USER MOD reduce.3.24.130724 H: found=0, std=0, add=2001, rem=0, adj=67 USER MOD reduce.3.24.130724 removed 2000 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: B 54 TYR OH : rot 1:sc= 1.42 USER MOD Set 1.2: B 119 HIS : no HD1:sc= -1.41 X(o=1.8,f=1.9) USER MOD Set 1.3: B 122 CYS SG : rot -95:sc= 1.79 USER MOD Set 2.1: A 10 THR OG1 : rot 85:sc= 0.616 USER MOD Set 2.2: B 80 THR OG1 : rot 180:sc= 0.566 USER MOD Set 3.1: A 54 TYR OH : rot -143:sc= -0.222 USER MOD Set 3.2: A 119 HIS : no HE2:sc= -0.107 K(o=-0.31,f=-9.3!) USER MOD Set 3.3: A 125 SER OG : rot 41:sc= 0.0224 USER MOD Set 4.1: A 80 THR OG1 : rot 180:sc= 0 USER MOD Set 4.2: B 10 THR OG1 : rot 180:sc= -0.767 USER MOD Set 5.1: A 55 SER OG : rot -80:sc= 0.972 USER MOD Set 5.2: B 11 SER OG : rot -126:sc= 0.321 USER MOD Set 6.1: A 48 GLN : amide:sc= -2.2! C(o=-1.4!,f=-6.1!) USER MOD Set 6.2: B 7 THR OG1 : rot -140:sc= 0.0634 USER MOD Set 6.3: B 21 SER OG : rot 150:sc= 0.0413 USER MOD Set 6.4: B 25 LYS NZ :NH3+ 157:sc= 0.678 (180deg=-1.7!) USER MOD Set 7.1: A 45 ASN : amide:sc= 0.737 K(o=1.6,f=-2.4) USER MOD Set 7.2: B 5 TYR OH : rot -66:sc= 0.866 USER MOD Set 8.1: A 11 SER OG : rot -3:sc= 0.889 USER MOD Set 8.2: B 55 SER OG : rot 112:sc= 0.0537 USER MOD Set 9.1: A 5 TYR OH : rot 180:sc= 0.183 USER MOD Set 9.2: A 7 THR OG1 : rot 54:sc= 0.985 USER MOD Set 9.3: A 21 SER OG : rot 80:sc= -0.923 USER MOD Set 9.4: A 25 LYS NZ :NH3+ 178:sc= 0.895 (180deg=-0.106) USER MOD Set 9.5: B 45 ASN : amide:sc= 0.368 K(o=-1.8,f=-4.7!) USER MOD Set 9.6: B 48 GLN : amide:sc= -3.32! C(o=-1.8!,f=-4.6!) USER MOD Single : A 1 MET CE :methyl 164:sc= -2.56 (180deg=-3.58) USER MOD Single : A 1 MET N :NH3+ -120:sc= 0.11 (180deg=0) USER MOD Single : A 2 ASN : amide:sc= -0.0267 X(o=-0.027,f=-0.34) USER MOD Single : A 6 LYS NZ :NH3+ -150:sc= 1.26 (180deg=0.0355) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 THR OG1 : rot -117:sc= 0.817 USER MOD Single : A 22 HIS : no HD1:sc= 0 X(o=0,f=-0.12) USER MOD Single : A 24 GLN : amide:sc= -0.27 X(o=-0.27,f=-0.21) USER MOD Single : A 29 LYS NZ :NH3+ -142:sc= 1.18 (180deg=0.205) USER MOD Single : A 31 SER OG : rot 101:sc= -0.102 USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 57 CYS SG : rot -167:sc= -0.038 USER MOD Single : A 60 SER OG : rot 93:sc= 0.314 USER MOD Single : A 62 MET CE :methyl -146:sc= -0.146 (180deg=-1.74) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 GLN :FLIP amide:sc= 0 F(o=-0.58,f=0) USER MOD Single : A 69 ASN : amide:sc= 0.564 K(o=0.56,f=0) USER MOD Single : A 70 LYS NZ :NH3+ -161:sc= 1.23 (180deg=1.06) USER MOD Single : A 71 GLN :FLIP amide:sc= -0.0315 F(o=-1,f=-0.032) USER MOD Single : A 72 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 THR OG1 : rot 51:sc= 0.894 USER MOD Single : A 78 THR OG1 : rot 180:sc= -0.223 USER MOD Single : A 88 ASN : amide:sc= -0.943 K(o=-0.94,f=-11!) USER MOD Single : A 112 LYS NZ :NH3+ 164:sc= 0.119 (180deg=0.0724) USER MOD Single : A 113 THR OG1 : rot 180:sc= 0 USER MOD Single : A 120 HIS : no HD1:sc= -0.506 X(o=-0.51,f=-0.33) USER MOD Single : A 122 CYS SG : rot -51:sc= -0.169 USER MOD Single : A 124 TYR OH : rot 150:sc= -0.789 USER MOD Single : A 126 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 128 THR OG1 : rot 180:sc= -0.406 USER MOD Single : A 130 ASN : amide:sc= -2.52 X(o=-2.5,f=-2.7!) USER MOD Single : A 131 ASN : amide:sc= -0.215 X(o=-0.21,f=0) USER MOD Single : B 1 MET CE :methyl -134:sc= -0.309 (180deg=-2.1) USER MOD Single : B 1 MET N :NH3+ 131:sc= 0.0923 (180deg=-0.167) USER MOD Single : B 2 ASN : amide:sc= 0 K(o=0,f=-0.59) USER MOD Single : B 6 LYS NZ :NH3+ 169:sc= 1.98 (180deg=1.77) USER MOD Single : B 12 THR OG1 : rot 180:sc= 0 USER MOD Single : B 20 THR OG1 : rot 180:sc= 0 USER MOD Single : B 22 HIS : no HD1:sc= -0.0529 X(o=-0.053,f=-0.35) USER MOD Single : B 24 GLN : amide:sc= 0.133 X(o=0.13,f=-0.12) USER MOD Single : B 29 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.0705) USER MOD Single : B 31 SER OG : rot 120:sc= 0.126 USER MOD Single : B 44 THR OG1 : rot 180:sc= 0 USER MOD Single : B 57 CYS SG : rot 176:sc= -0.743 USER MOD Single : B 60 SER OG : rot 123:sc= 0.413 USER MOD Single : B 62 MET CE :methyl -141:sc= -0.966 (180deg=-4.02!) USER MOD Single : B 63 LYS NZ :NH3+ 169:sc= -0.0172 (180deg=-0.132) USER MOD Single : B 68 GLN : amide:sc= 0.101 X(o=0.1,f=0) USER MOD Single : B 69 ASN :FLIP amide:sc= -0.171 F(o=-3.2!,f=-0.17) USER MOD Single : B 70 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0291) USER MOD Single : B 71 GLN :FLIP amide:sc= -0.0129 F(o=-1.1,f=-0.013) USER MOD Single : B 72 THR OG1 : rot 180:sc= 0 USER MOD Single : B 77 THR OG1 : rot 42:sc= 1.08 USER MOD Single : B 78 THR OG1 : rot 180:sc= -0.125 USER MOD Single : B 88 ASN : amide:sc= -0.46 K(o=-0.46,f=-11!) USER MOD Single : B 112 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00474) USER MOD Single : B 113 THR OG1 : rot 180:sc= 0 USER MOD Single : B 120 HIS : no HD1:sc= -0.0218 X(o=-0.022,f=-0.022) USER MOD Single : B 124 TYR OH : rot 180:sc= 0 USER MOD Single : B 128 THR OG1 : rot 180:sc= 0 USER MOD Single : B 130 ASN :FLIP amide:sc= 0 F(o=-0.72,f=0) USER MOD Single : B 131 ASN :FLIP amide:sc= 0 F(o=-0.82,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.782 0.597 2.381 1.00 60.05 N ATOM 2 CA MET A 1 2.146 1.098 1.034 1.00 3.23 C ATOM 3 C MET A 1 2.950 0.046 0.278 1.00 42.13 C ATOM 4 O MET A 1 3.141 -1.069 0.764 1.00 30.31 O ATOM 5 CB MET A 1 2.969 2.384 1.121 1.00 13.52 C ATOM 6 CG MET A 1 4.350 2.148 1.681 1.00 60.32 C ATOM 7 SD MET A 1 5.436 3.578 1.528 1.00 71.43 S ATOM 8 CE MET A 1 7.022 2.800 1.818 1.00 20.11 C ATOM 0 H1 MET A 1 0.747 0.578 2.476 1.00 60.05 H new ATOM 0 H2 MET A 1 2.159 -0.364 2.508 1.00 60.05 H new ATOM 0 H3 MET A 1 2.185 1.225 3.106 1.00 60.05 H new ATOM 0 HA MET A 1 1.218 1.310 0.503 1.00 3.23 H new ATOM 0 HB2 MET A 1 3.053 2.826 0.128 1.00 13.52 H new ATOM 0 HB3 MET A 1 2.445 3.106 1.747 1.00 13.52 H new ATOM 0 HG2 MET A 1 4.266 1.875 2.733 1.00 60.32 H new ATOM 0 HG3 MET A 1 4.803 1.300 1.167 1.00 60.32 H new ATOM 0 HE1 MET A 1 7.819 3.465 1.486 1.00 20.11 H new ATOM 0 HE2 MET A 1 7.139 2.597 2.883 1.00 20.11 H new ATOM 0 HE3 MET A 1 7.075 1.864 1.262 1.00 20.11 H new ATOM 20 N ASN A 2 3.432 0.417 -0.907 1.00 22.52 N ATOM 21 CA ASN A 2 4.280 -0.458 -1.712 1.00 14.33 C ATOM 22 C ASN A 2 5.658 -0.631 -1.063 1.00 22.14 C ATOM 23 O ASN A 2 6.631 0.008 -1.460 1.00 72.55 O ATOM 24 CB ASN A 2 4.432 0.105 -3.134 1.00 31.34 C ATOM 25 CG ASN A 2 5.315 -0.761 -4.021 1.00 75.52 C ATOM 26 OD1 ASN A 2 5.336 -1.988 -3.892 1.00 52.13 O ATOM 27 ND2 ASN A 2 6.057 -0.132 -4.918 1.00 35.23 N ATOM 0 H ASN A 2 3.247 1.325 -1.333 1.00 22.52 H new ATOM 0 HA ASN A 2 3.802 -1.436 -1.769 1.00 14.33 H new ATOM 0 HB2 ASN A 2 3.446 0.198 -3.590 1.00 31.34 H new ATOM 0 HB3 ASN A 2 4.853 1.109 -3.079 1.00 31.34 H new ATOM 0 HD21 ASN A 2 6.674 -0.663 -5.533 1.00 35.23 H new ATOM 0 HD22 ASN A 2 6.012 0.884 -4.995 1.00 35.23 H new ATOM 34 N ILE A 3 5.712 -1.449 -0.023 1.00 0.23 N ATOM 35 CA ILE A 3 6.963 -1.801 0.633 1.00 51.02 C ATOM 36 C ILE A 3 7.781 -2.771 -0.219 1.00 3.13 C ATOM 37 O ILE A 3 7.254 -3.745 -0.762 1.00 22.24 O ATOM 38 CB ILE A 3 6.685 -2.438 2.016 1.00 43.32 C ATOM 39 CG1 ILE A 3 5.915 -1.451 2.905 1.00 25.54 C ATOM 40 CG2 ILE A 3 7.984 -2.879 2.691 1.00 24.42 C ATOM 41 CD1 ILE A 3 6.728 -0.248 3.318 1.00 23.10 C ATOM 0 H ILE A 3 4.889 -1.888 0.391 1.00 0.23 H new ATOM 0 HA ILE A 3 7.537 -0.884 0.764 1.00 51.02 H new ATOM 0 HB ILE A 3 6.072 -3.327 1.869 1.00 43.32 H new ATOM 0 HG12 ILE A 3 5.026 -1.113 2.373 1.00 25.54 H new ATOM 0 HG13 ILE A 3 5.572 -1.972 3.799 1.00 25.54 H new ATOM 0 HG21 ILE A 3 7.758 -3.323 3.661 1.00 24.42 H new ATOM 0 HG22 ILE A 3 8.488 -3.614 2.064 1.00 24.42 H new ATOM 0 HG23 ILE A 3 8.633 -2.015 2.830 1.00 24.42 H new ATOM 0 HD11 ILE A 3 6.120 0.405 3.944 1.00 23.10 H new ATOM 0 HD12 ILE A 3 7.603 -0.576 3.879 1.00 23.10 H new ATOM 0 HD13 ILE A 3 7.049 0.297 2.430 1.00 23.10 H new ATOM 53 N LEU A 4 9.068 -2.480 -0.341 1.00 41.13 N ATOM 54 CA LEU A 4 10.015 -3.364 -1.016 1.00 42.04 C ATOM 55 C LEU A 4 10.614 -4.340 -0.015 1.00 41.22 C ATOM 56 O LEU A 4 10.620 -5.552 -0.238 1.00 74.21 O ATOM 57 CB LEU A 4 11.142 -2.555 -1.673 1.00 22.30 C ATOM 58 CG LEU A 4 10.691 -1.527 -2.715 1.00 5.11 C ATOM 59 CD1 LEU A 4 11.890 -0.749 -3.255 1.00 73.22 C ATOM 60 CD2 LEU A 4 9.927 -2.204 -3.852 1.00 52.13 C ATOM 0 H LEU A 4 9.488 -1.625 0.024 1.00 41.13 H new ATOM 0 HA LEU A 4 9.478 -3.913 -1.790 1.00 42.04 H new ATOM 0 HB2 LEU A 4 11.697 -2.036 -0.892 1.00 22.30 H new ATOM 0 HB3 LEU A 4 11.835 -3.249 -2.148 1.00 22.30 H new ATOM 0 HG LEU A 4 10.016 -0.822 -2.229 1.00 5.11 H new ATOM 0 HD11 LEU A 4 11.550 -0.023 -3.994 1.00 73.22 H new ATOM 0 HD12 LEU A 4 12.385 -0.228 -2.435 1.00 73.22 H new ATOM 0 HD13 LEU A 4 12.592 -1.440 -3.721 1.00 73.22 H new ATOM 0 HD21 LEU A 4 9.617 -1.454 -4.579 1.00 52.13 H new ATOM 0 HD22 LEU A 4 10.572 -2.936 -4.338 1.00 52.13 H new ATOM 0 HD23 LEU A 4 9.046 -2.706 -3.451 1.00 52.13 H new ATOM 72 N TYR A 5 11.090 -3.804 1.106 1.00 24.01 N ATOM 73 CA TYR A 5 11.749 -4.616 2.125 1.00 4.44 C ATOM 74 C TYR A 5 11.179 -4.282 3.491 1.00 12.52 C ATOM 75 O TYR A 5 11.050 -3.114 3.845 1.00 21.34 O ATOM 76 CB TYR A 5 13.267 -4.365 2.111 1.00 54.43 C ATOM 77 CG TYR A 5 14.065 -5.261 3.050 1.00 2.54 C ATOM 78 CD1 TYR A 5 14.201 -4.957 4.405 1.00 4.50 C ATOM 79 CD2 TYR A 5 14.680 -6.413 2.577 1.00 14.20 C ATOM 80 CE1 TYR A 5 14.926 -5.777 5.253 1.00 2.54 C ATOM 81 CE2 TYR A 5 15.404 -7.236 3.418 1.00 4.33 C ATOM 82 CZ TYR A 5 15.525 -6.916 4.753 1.00 33.20 C ATOM 83 OH TYR A 5 16.251 -7.741 5.592 1.00 31.30 O ATOM 0 H TYR A 5 11.032 -2.811 1.332 1.00 24.01 H new ATOM 0 HA TYR A 5 11.570 -5.669 1.908 1.00 4.44 H new ATOM 0 HB2 TYR A 5 13.636 -4.505 1.095 1.00 54.43 H new ATOM 0 HB3 TYR A 5 13.453 -3.324 2.377 1.00 54.43 H new ATOM 0 HD1 TYR A 5 13.733 -4.067 4.799 1.00 4.50 H new ATOM 0 HD2 TYR A 5 14.591 -6.670 1.532 1.00 14.20 H new ATOM 0 HE1 TYR A 5 15.022 -5.527 6.299 1.00 2.54 H new ATOM 0 HE2 TYR A 5 15.874 -8.128 3.030 1.00 4.33 H new ATOM 0 HH TYR A 5 16.605 -8.498 5.080 1.00 31.30 H new ATOM 93 N LYS A 6 10.823 -5.305 4.246 1.00 51.40 N ATOM 94 CA LYS A 6 10.330 -5.123 5.605 1.00 43.32 C ATOM 95 C LYS A 6 10.963 -6.139 6.547 1.00 62.42 C ATOM 96 O LYS A 6 11.196 -7.292 6.169 1.00 13.53 O ATOM 97 CB LYS A 6 8.798 -5.237 5.664 1.00 1.54 C ATOM 98 CG LYS A 6 8.250 -5.177 7.089 1.00 51.03 C ATOM 99 CD LYS A 6 6.731 -5.270 7.150 1.00 30.33 C ATOM 100 CE LYS A 6 6.054 -4.006 6.642 1.00 61.32 C ATOM 101 NZ LYS A 6 4.603 -3.994 6.972 1.00 4.41 N1+ ATOM 0 H LYS A 6 10.865 -6.278 3.941 1.00 51.40 H new ATOM 0 HA LYS A 6 10.611 -4.120 5.925 1.00 43.32 H new ATOM 0 HB2 LYS A 6 8.356 -4.432 5.076 1.00 1.54 H new ATOM 0 HB3 LYS A 6 8.491 -6.175 5.202 1.00 1.54 H new ATOM 0 HG2 LYS A 6 8.681 -5.991 7.672 1.00 51.03 H new ATOM 0 HG3 LYS A 6 8.570 -4.245 7.556 1.00 51.03 H new ATOM 0 HD2 LYS A 6 6.397 -6.122 6.557 1.00 30.33 H new ATOM 0 HD3 LYS A 6 6.422 -5.457 8.178 1.00 30.33 H new ATOM 0 HE2 LYS A 6 6.535 -3.132 7.082 1.00 61.32 H new ATOM 0 HE3 LYS A 6 6.183 -3.932 5.562 1.00 61.32 H new ATOM 0 HZ1 LYS A 6 4.086 -3.459 6.245 1.00 4.41 H new ATOM 0 HZ2 LYS A 6 4.246 -4.970 7.003 1.00 4.41 H new ATOM 0 HZ3 LYS A 6 4.461 -3.544 7.899 1.00 4.41 H new ATOM 115 N THR A 7 11.232 -5.703 7.770 1.00 30.21 N ATOM 116 CA THR A 7 11.769 -6.573 8.803 1.00 33.22 C ATOM 117 C THR A 7 11.250 -6.123 10.168 1.00 54.23 C ATOM 118 O THR A 7 11.024 -4.927 10.397 1.00 73.02 O ATOM 119 CB THR A 7 13.323 -6.592 8.787 1.00 43.13 C ATOM 120 OG1 THR A 7 13.818 -7.664 9.606 1.00 11.53 O ATOM 121 CG2 THR A 7 13.915 -5.270 9.272 1.00 62.33 C ATOM 0 H THR A 7 11.084 -4.740 8.072 1.00 30.21 H new ATOM 0 HA THR A 7 11.433 -7.591 8.604 1.00 33.22 H new ATOM 0 HB THR A 7 13.632 -6.744 7.753 1.00 43.13 H new ATOM 0 HG1 THR A 7 13.408 -8.508 9.323 1.00 11.53 H new ATOM 0 HG21 THR A 7 15.003 -5.327 9.245 1.00 62.33 H new ATOM 0 HG22 THR A 7 13.578 -4.461 8.624 1.00 62.33 H new ATOM 0 HG23 THR A 7 13.587 -5.078 10.294 1.00 62.33 H new ATOM 129 N ALA A 8 11.030 -7.081 11.060 1.00 51.42 N ATOM 130 CA ALA A 8 10.501 -6.788 12.390 1.00 62.45 C ATOM 131 C ALA A 8 11.549 -7.056 13.465 1.00 64.34 C ATOM 132 O ALA A 8 12.222 -8.092 13.457 1.00 4.53 O ATOM 133 CB ALA A 8 9.247 -7.619 12.654 1.00 11.23 C ATOM 0 H ALA A 8 11.210 -8.070 10.888 1.00 51.42 H new ATOM 0 HA ALA A 8 10.239 -5.731 12.427 1.00 62.45 H new ATOM 0 HB1 ALA A 8 8.862 -7.392 13.648 1.00 11.23 H new ATOM 0 HB2 ALA A 8 8.489 -7.380 11.908 1.00 11.23 H new ATOM 0 HB3 ALA A 8 9.494 -8.679 12.594 1.00 11.23 H new ATOM 139 N ALA A 9 11.675 -6.122 14.395 1.00 62.04 N ATOM 140 CA ALA A 9 12.587 -6.265 15.517 1.00 13.24 C ATOM 141 C ALA A 9 11.845 -5.984 16.812 1.00 53.42 C ATOM 142 O ALA A 9 11.270 -4.911 16.983 1.00 45.34 O ATOM 143 CB ALA A 9 13.784 -5.334 15.355 1.00 65.14 C ATOM 0 H ALA A 9 11.150 -5.247 14.393 1.00 62.04 H new ATOM 0 HA ALA A 9 12.966 -7.287 15.546 1.00 13.24 H new ATOM 0 HB1 ALA A 9 14.456 -5.455 16.204 1.00 65.14 H new ATOM 0 HB2 ALA A 9 14.314 -5.580 14.435 1.00 65.14 H new ATOM 0 HB3 ALA A 9 13.438 -4.301 15.310 1.00 65.14 H new ATOM 149 N THR A 10 11.839 -6.956 17.709 1.00 61.23 N ATOM 150 CA THR A 10 11.128 -6.832 18.965 1.00 51.35 C ATOM 151 C THR A 10 12.104 -6.455 20.073 1.00 43.21 C ATOM 152 O THR A 10 13.268 -6.853 20.050 1.00 73.43 O ATOM 153 CB THR A 10 10.373 -8.138 19.324 1.00 34.35 C ATOM 154 OG1 THR A 10 9.510 -7.916 20.446 1.00 3.15 O ATOM 155 CG2 THR A 10 11.338 -9.281 19.638 1.00 70.40 C ATOM 0 H THR A 10 12.323 -7.845 17.586 1.00 61.23 H new ATOM 0 HA THR A 10 10.382 -6.044 18.859 1.00 51.35 H new ATOM 0 HB THR A 10 9.781 -8.424 18.455 1.00 34.35 H new ATOM 0 HG1 THR A 10 8.656 -7.550 20.134 1.00 3.15 H new ATOM 0 HG21 THR A 10 10.771 -10.179 19.885 1.00 70.40 H new ATOM 0 HG22 THR A 10 11.966 -9.476 18.769 1.00 70.40 H new ATOM 0 HG23 THR A 10 11.966 -9.005 20.485 1.00 70.40 H new ATOM 163 N SER A 11 11.634 -5.669 21.022 1.00 71.32 N ATOM 164 CA SER A 11 12.468 -5.201 22.115 1.00 2.43 C ATOM 165 C SER A 11 11.773 -5.438 23.453 1.00 11.12 C ATOM 166 O SER A 11 10.719 -4.856 23.736 1.00 53.54 O ATOM 167 CB SER A 11 12.808 -3.716 21.915 1.00 22.21 C ATOM 168 OG SER A 11 11.646 -2.941 21.685 1.00 52.01 O ATOM 0 H SER A 11 10.670 -5.338 21.059 1.00 71.32 H new ATOM 0 HA SER A 11 13.401 -5.765 22.122 1.00 2.43 H new ATOM 0 HB2 SER A 11 13.328 -3.340 22.796 1.00 22.21 H new ATOM 0 HB3 SER A 11 13.490 -3.609 21.072 1.00 22.21 H new ATOM 0 HG SER A 11 10.863 -3.529 21.646 1.00 52.01 H new ATOM 174 N THR A 12 12.349 -6.325 24.254 1.00 54.12 N ATOM 175 CA THR A 12 11.788 -6.681 25.547 1.00 52.53 C ATOM 176 C THR A 12 12.391 -5.812 26.647 1.00 72.12 C ATOM 177 O THR A 12 13.505 -5.297 26.509 1.00 13.04 O ATOM 178 CB THR A 12 12.065 -8.164 25.870 1.00 35.03 C ATOM 179 OG1 THR A 12 11.935 -8.950 24.677 1.00 61.53 O ATOM 180 CG2 THR A 12 11.095 -8.688 26.926 1.00 33.34 C ATOM 0 H THR A 12 13.214 -6.815 24.026 1.00 54.12 H new ATOM 0 HA THR A 12 10.711 -6.516 25.501 1.00 52.53 H new ATOM 0 HB THR A 12 13.079 -8.242 26.261 1.00 35.03 H new ATOM 0 HG1 THR A 12 12.113 -9.891 24.884 1.00 61.53 H new ATOM 0 HG21 THR A 12 11.314 -9.735 27.133 1.00 33.34 H new ATOM 0 HG22 THR A 12 11.204 -8.106 27.841 1.00 33.34 H new ATOM 0 HG23 THR A 12 10.073 -8.597 26.558 1.00 33.34 H new ATOM 188 N GLY A 13 11.655 -5.649 27.735 1.00 62.44 N ATOM 189 CA GLY A 13 12.162 -4.903 28.866 1.00 34.44 C ATOM 190 C GLY A 13 13.078 -5.745 29.734 1.00 13.14 C ATOM 191 O GLY A 13 12.645 -6.269 30.759 1.00 50.55 O ATOM 0 H GLY A 13 10.713 -6.021 27.855 1.00 62.44 H new ATOM 0 HA2 GLY A 13 12.704 -4.027 28.510 1.00 34.44 H new ATOM 0 HA3 GLY A 13 11.327 -4.540 29.465 1.00 34.44 H new ATOM 195 N GLY A 14 14.325 -5.935 29.285 1.00 62.02 N ATOM 196 CA GLY A 14 15.335 -6.581 30.118 1.00 43.32 C ATOM 197 C GLY A 14 15.623 -5.798 31.397 1.00 33.13 C ATOM 198 O GLY A 14 14.704 -5.438 32.131 1.00 44.52 O ATOM 0 H GLY A 14 14.652 -5.653 28.361 1.00 62.02 H new ATOM 0 HA2 GLY A 14 15.000 -7.585 30.378 1.00 43.32 H new ATOM 0 HA3 GLY A 14 16.257 -6.691 29.547 1.00 43.32 H new ATOM 202 N ARG A 15 16.899 -5.534 31.674 1.00 24.13 N ATOM 203 CA ARG A 15 17.272 -4.736 32.844 1.00 34.21 C ATOM 204 C ARG A 15 16.868 -3.275 32.634 1.00 4.22 C ATOM 205 O ARG A 15 16.210 -2.675 33.486 1.00 73.04 O ATOM 206 CB ARG A 15 18.781 -4.840 33.125 1.00 34.44 C ATOM 207 CG ARG A 15 19.267 -3.933 34.259 1.00 1.44 C ATOM 208 CD ARG A 15 18.543 -4.206 35.576 1.00 44.04 C ATOM 209 NE ARG A 15 18.912 -3.235 36.613 1.00 64.51 N ATOM 210 CZ ARG A 15 18.099 -2.841 37.601 1.00 22.54 C ATOM 211 NH1 ARG A 15 16.900 -3.389 37.743 1.00 12.40 N1+ ATOM 212 NH2 ARG A 15 18.498 -1.908 38.456 1.00 44.23 N ATOM 0 H ARG A 15 17.686 -5.857 31.111 1.00 24.13 H new ATOM 0 HA ARG A 15 16.741 -5.130 33.710 1.00 34.21 H new ATOM 0 HB2 ARG A 15 19.024 -5.874 33.371 1.00 34.44 H new ATOM 0 HB3 ARG A 15 19.328 -4.592 32.215 1.00 34.44 H new ATOM 0 HG2 ARG A 15 20.338 -4.076 34.400 1.00 1.44 H new ATOM 0 HG3 ARG A 15 19.119 -2.891 33.976 1.00 1.44 H new ATOM 0 HD2 ARG A 15 17.466 -4.171 35.412 1.00 44.04 H new ATOM 0 HD3 ARG A 15 18.781 -5.213 35.920 1.00 44.04 H new ATOM 0 HE ARG A 15 19.849 -2.834 36.579 1.00 64.51 H new ATOM 0 HH11 ARG A 15 16.592 -4.116 37.097 1.00 12.40 H new ATOM 0 HH12 ARG A 15 16.286 -3.084 38.498 1.00 12.40 H new ATOM 0 HH21 ARG A 15 19.424 -1.491 38.360 1.00 44.23 H new ATOM 0 HH22 ARG A 15 17.879 -1.608 39.209 1.00 44.23 H new ATOM 226 N ASP A 16 17.280 -2.711 31.502 1.00 4.14 N ATOM 227 CA ASP A 16 16.891 -1.352 31.124 1.00 22.02 C ATOM 228 C ASP A 16 16.263 -1.386 29.735 1.00 52.02 C ATOM 229 O ASP A 16 15.238 -0.745 29.492 1.00 74.22 O ATOM 230 CB ASP A 16 18.110 -0.424 31.157 1.00 50.13 C ATOM 231 CG ASP A 16 17.769 1.060 31.035 1.00 53.42 C ATOM 232 OD1 ASP A 16 17.778 1.591 29.903 1.00 45.04 O ATOM 233 OD2 ASP A 16 17.538 1.713 32.078 1.00 61.02 O1- ATOM 0 H ASP A 16 17.886 -3.175 30.826 1.00 4.14 H new ATOM 0 HA ASP A 16 16.161 -0.963 31.834 1.00 22.02 H new ATOM 0 HB2 ASP A 16 18.651 -0.586 32.089 1.00 50.13 H new ATOM 0 HB3 ASP A 16 18.784 -0.699 30.346 1.00 50.13 H new ATOM 238 N GLY A 17 16.865 -2.160 28.820 1.00 73.12 N ATOM 239 CA GLY A 17 16.191 -2.464 27.573 1.00 31.14 C ATOM 240 C GLY A 17 16.832 -3.627 26.849 1.00 63.12 C ATOM 241 O GLY A 17 18.018 -3.898 27.024 1.00 34.35 O ATOM 0 H GLY A 17 17.792 -2.572 28.925 1.00 73.12 H new ATOM 0 HA2 GLY A 17 15.145 -2.695 27.774 1.00 31.14 H new ATOM 0 HA3 GLY A 17 16.206 -1.584 26.930 1.00 31.14 H new ATOM 245 N ARG A 18 16.046 -4.336 26.055 1.00 71.41 N ATOM 246 CA ARG A 18 16.570 -5.384 25.191 1.00 64.41 C ATOM 247 C ARG A 18 16.111 -5.115 23.766 1.00 2.04 C ATOM 248 O ARG A 18 15.055 -4.526 23.564 1.00 73.24 O ATOM 249 CB ARG A 18 16.104 -6.774 25.656 1.00 30.54 C ATOM 250 CG ARG A 18 16.741 -7.916 24.870 1.00 21.30 C ATOM 251 CD ARG A 18 16.223 -9.281 25.300 1.00 2.42 C ATOM 252 NE ARG A 18 16.896 -10.372 24.583 1.00 61.43 N ATOM 253 CZ ARG A 18 16.884 -11.652 24.971 1.00 42.21 C ATOM 254 NH1 ARG A 18 16.198 -12.025 26.044 1.00 65.11 N1+ ATOM 255 NH2 ARG A 18 17.548 -12.564 24.275 1.00 11.32 N ATOM 0 H ARG A 18 15.037 -4.204 25.990 1.00 71.41 H new ATOM 0 HA ARG A 18 17.659 -5.376 25.237 1.00 64.41 H new ATOM 0 HB2 ARG A 18 16.339 -6.894 26.714 1.00 30.54 H new ATOM 0 HB3 ARG A 18 15.020 -6.837 25.562 1.00 30.54 H new ATOM 0 HG2 ARG A 18 16.544 -7.775 23.807 1.00 21.30 H new ATOM 0 HG3 ARG A 18 17.823 -7.884 25.001 1.00 21.30 H new ATOM 0 HD2 ARG A 18 16.372 -9.405 26.373 1.00 2.42 H new ATOM 0 HD3 ARG A 18 15.149 -9.336 25.119 1.00 2.42 H new ATOM 0 HE ARG A 18 17.407 -10.138 23.732 1.00 61.43 H new ATOM 0 HH11 ARG A 18 15.674 -11.333 26.580 1.00 65.11 H new ATOM 0 HH12 ARG A 18 16.195 -13.003 26.332 1.00 65.11 H new ATOM 0 HH21 ARG A 18 18.069 -12.290 23.442 1.00 11.32 H new ATOM 0 HH22 ARG A 18 17.538 -13.540 24.572 1.00 11.32 H new ATOM 269 N ALA A 19 16.904 -5.533 22.791 1.00 71.12 N ATOM 270 CA ALA A 19 16.587 -5.320 21.382 1.00 34.25 C ATOM 271 C ALA A 19 16.958 -6.559 20.581 1.00 41.03 C ATOM 272 O ALA A 19 18.109 -6.999 20.597 1.00 12.34 O ATOM 273 CB ALA A 19 17.319 -4.094 20.847 1.00 5.35 C ATOM 0 H ALA A 19 17.782 -6.027 22.950 1.00 71.12 H new ATOM 0 HA ALA A 19 15.516 -5.142 21.282 1.00 34.25 H new ATOM 0 HB1 ALA A 19 17.070 -3.952 19.795 1.00 5.35 H new ATOM 0 HB2 ALA A 19 17.017 -3.214 21.414 1.00 5.35 H new ATOM 0 HB3 ALA A 19 18.394 -4.239 20.949 1.00 5.35 H new ATOM 279 N THR A 20 15.984 -7.104 19.870 1.00 63.53 N ATOM 280 CA THR A 20 16.154 -8.360 19.167 1.00 0.02 C ATOM 281 C THR A 20 15.427 -8.338 17.826 1.00 61.21 C ATOM 282 O THR A 20 14.200 -8.260 17.774 1.00 50.32 O ATOM 283 CB THR A 20 15.619 -9.531 20.030 1.00 22.13 C ATOM 284 OG1 THR A 20 16.280 -9.537 21.306 1.00 4.20 O ATOM 285 CG2 THR A 20 15.825 -10.878 19.343 1.00 30.30 C ATOM 0 H THR A 20 15.058 -6.688 19.766 1.00 63.53 H new ATOM 0 HA THR A 20 17.219 -8.502 18.982 1.00 0.02 H new ATOM 0 HB THR A 20 14.548 -9.381 20.166 1.00 22.13 H new ATOM 0 HG1 THR A 20 16.787 -10.369 21.408 1.00 4.20 H new ATOM 0 HG21 THR A 20 15.437 -11.674 19.979 1.00 30.30 H new ATOM 0 HG22 THR A 20 15.296 -10.885 18.390 1.00 30.30 H new ATOM 0 HG23 THR A 20 16.889 -11.039 19.169 1.00 30.30 H new ATOM 293 N SER A 21 16.186 -8.409 16.740 1.00 52.22 N ATOM 294 CA SER A 21 15.591 -8.528 15.425 1.00 61.23 C ATOM 295 C SER A 21 15.010 -9.917 15.317 1.00 4.01 C ATOM 296 O SER A 21 15.768 -10.903 15.265 1.00 53.51 O ATOM 297 CB SER A 21 16.606 -8.285 14.308 1.00 62.30 C ATOM 298 OG SER A 21 16.053 -8.600 13.041 1.00 0.33 O ATOM 0 H SER A 21 17.206 -8.386 16.748 1.00 52.22 H new ATOM 0 HA SER A 21 14.819 -7.768 15.307 1.00 61.23 H new ATOM 0 HB2 SER A 21 16.924 -7.242 14.321 1.00 62.30 H new ATOM 0 HB3 SER A 21 17.495 -8.891 14.482 1.00 62.30 H new ATOM 0 HG SER A 21 15.489 -7.858 12.737 1.00 0.33 H new ATOM 304 N HIS A 22 13.669 -9.956 15.275 1.00 22.03 N ATOM 305 CA HIS A 22 12.867 -11.170 15.455 1.00 2.11 C ATOM 306 C HIS A 22 13.269 -12.264 14.481 1.00 71.44 C ATOM 307 O HIS A 22 13.077 -13.451 14.750 1.00 63.31 O ATOM 308 CB HIS A 22 11.379 -10.832 15.272 1.00 42.33 C ATOM 309 CG HIS A 22 10.441 -11.918 15.716 1.00 64.41 C ATOM 310 ND1 HIS A 22 10.077 -12.984 14.919 1.00 70.44 N ATOM 311 CD2 HIS A 22 9.785 -12.091 16.886 1.00 33.23 C ATOM 312 CE1 HIS A 22 9.242 -13.759 15.583 1.00 21.33 C ATOM 313 NE2 HIS A 22 9.048 -13.239 16.778 1.00 41.54 N ATOM 0 H HIS A 22 13.102 -9.124 15.111 1.00 22.03 H new ATOM 0 HA HIS A 22 13.046 -11.544 16.463 1.00 2.11 H new ATOM 0 HB2 HIS A 22 11.154 -9.923 15.829 1.00 42.33 H new ATOM 0 HB3 HIS A 22 11.194 -10.615 14.220 1.00 42.33 H new ATOM 0 HD2 HIS A 22 9.834 -11.442 17.748 1.00 33.23 H new ATOM 0 HE1 HIS A 22 8.793 -14.667 15.210 1.00 21.33 H new ATOM 0 HE2 HIS A 22 8.447 -13.629 17.504 1.00 41.54 H new ATOM 322 N ASP A 23 13.848 -11.863 13.359 1.00 65.30 N ATOM 323 CA ASP A 23 14.264 -12.812 12.330 1.00 52.23 C ATOM 324 C ASP A 23 15.610 -13.444 12.704 1.00 2.53 C ATOM 325 O ASP A 23 16.276 -14.057 11.873 1.00 21.54 O ATOM 326 CB ASP A 23 14.350 -12.100 10.971 1.00 41.44 C ATOM 327 CG ASP A 23 14.542 -13.060 9.804 1.00 73.43 C ATOM 328 OD1 ASP A 23 15.616 -13.031 9.165 1.00 71.33 O ATOM 329 OD2 ASP A 23 13.615 -13.852 9.522 1.00 13.13 O1- ATOM 0 H ASP A 23 14.042 -10.887 13.135 1.00 65.30 H new ATOM 0 HA ASP A 23 13.525 -13.610 12.257 1.00 52.23 H new ATOM 0 HB2 ASP A 23 13.440 -11.522 10.812 1.00 41.44 H new ATOM 0 HB3 ASP A 23 15.178 -11.391 10.991 1.00 41.44 H new ATOM 334 N GLN A 24 15.992 -13.289 13.980 1.00 30.45 N ATOM 335 CA GLN A 24 17.255 -13.805 14.508 1.00 23.53 C ATOM 336 C GLN A 24 18.428 -13.040 13.914 1.00 71.34 C ATOM 337 O GLN A 24 19.576 -13.486 13.977 1.00 22.01 O ATOM 338 CB GLN A 24 17.404 -15.313 14.248 1.00 42.54 C ATOM 339 CG GLN A 24 16.347 -16.166 14.938 1.00 72.53 C ATOM 340 CD GLN A 24 16.298 -15.940 16.440 1.00 14.50 C ATOM 341 OE1 GLN A 24 17.020 -16.582 17.200 1.00 45.33 O ATOM 342 NE2 GLN A 24 15.433 -15.039 16.878 1.00 4.22 N ATOM 0 H GLN A 24 15.428 -12.799 14.675 1.00 30.45 H new ATOM 0 HA GLN A 24 17.249 -13.658 15.588 1.00 23.53 H new ATOM 0 HB2 GLN A 24 17.358 -15.493 13.174 1.00 42.54 H new ATOM 0 HB3 GLN A 24 18.391 -15.634 14.582 1.00 42.54 H new ATOM 0 HG2 GLN A 24 15.370 -15.943 14.509 1.00 72.53 H new ATOM 0 HG3 GLN A 24 16.549 -17.219 14.740 1.00 72.53 H new ATOM 0 HE21 GLN A 24 14.851 -14.526 16.215 1.00 4.22 H new ATOM 0 HE22 GLN A 24 15.348 -14.857 17.878 1.00 4.22 H new ATOM 351 N LYS A 25 18.129 -11.876 13.347 1.00 22.35 N ATOM 352 CA LYS A 25 19.153 -11.031 12.757 1.00 24.04 C ATOM 353 C LYS A 25 19.786 -10.129 13.811 1.00 45.31 C ATOM 354 O LYS A 25 20.822 -9.514 13.555 1.00 73.44 O ATOM 355 CB LYS A 25 18.580 -10.204 11.591 1.00 30.31 C ATOM 356 CG LYS A 25 18.273 -11.038 10.346 1.00 12.14 C ATOM 357 CD LYS A 25 17.807 -10.181 9.167 1.00 61.23 C ATOM 358 CE LYS A 25 16.431 -9.567 9.411 1.00 52.51 C ATOM 359 NZ LYS A 25 15.994 -8.699 8.284 1.00 22.01 N1+ ATOM 0 H LYS A 25 17.183 -11.499 13.285 1.00 22.35 H new ATOM 0 HA LYS A 25 19.934 -11.677 12.355 1.00 24.04 H new ATOM 0 HB2 LYS A 25 17.667 -9.709 11.921 1.00 30.31 H new ATOM 0 HB3 LYS A 25 19.290 -9.420 11.328 1.00 30.31 H new ATOM 0 HG2 LYS A 25 19.164 -11.595 10.057 1.00 12.14 H new ATOM 0 HG3 LYS A 25 17.503 -11.771 10.585 1.00 12.14 H new ATOM 0 HD2 LYS A 25 18.531 -9.386 8.989 1.00 61.23 H new ATOM 0 HD3 LYS A 25 17.776 -10.792 8.265 1.00 61.23 H new ATOM 0 HE2 LYS A 25 15.701 -10.363 9.558 1.00 52.51 H new ATOM 0 HE3 LYS A 25 16.454 -8.982 10.330 1.00 52.51 H new ATOM 0 HZ1 LYS A 25 15.041 -8.331 8.478 1.00 22.01 H new ATOM 0 HZ2 LYS A 25 16.657 -7.905 8.180 1.00 22.01 H new ATOM 0 HZ3 LYS A 25 15.978 -9.254 7.404 1.00 22.01 H new ATOM 373 N LEU A 26 19.165 -10.030 14.997 1.00 32.33 N ATOM 374 CA LEU A 26 19.796 -9.306 16.103 1.00 24.31 C ATOM 375 C LEU A 26 19.247 -9.772 17.444 1.00 21.31 C ATOM 376 O LEU A 26 18.079 -10.120 17.536 1.00 11.34 O ATOM 377 CB LEU A 26 19.561 -7.801 15.933 1.00 35.55 C ATOM 378 CG LEU A 26 19.973 -6.914 17.115 1.00 2.25 C ATOM 379 CD1 LEU A 26 21.487 -6.917 17.314 1.00 31.22 C ATOM 380 CD2 LEU A 26 19.441 -5.504 16.905 1.00 74.42 C ATOM 0 H LEU A 26 18.251 -10.431 15.209 1.00 32.33 H new ATOM 0 HA LEU A 26 20.866 -9.512 16.086 1.00 24.31 H new ATOM 0 HB2 LEU A 26 20.104 -7.467 15.049 1.00 35.55 H new ATOM 0 HB3 LEU A 26 18.501 -7.640 15.737 1.00 35.55 H new ATOM 0 HG LEU A 26 19.536 -7.320 18.027 1.00 2.25 H new ATOM 0 HD11 LEU A 26 21.744 -6.279 18.159 1.00 31.22 H new ATOM 0 HD12 LEU A 26 21.826 -7.934 17.511 1.00 31.22 H new ATOM 0 HD13 LEU A 26 21.973 -6.540 16.414 1.00 31.22 H new ATOM 0 HD21 LEU A 26 19.735 -4.875 17.746 1.00 74.42 H new ATOM 0 HD22 LEU A 26 19.853 -5.093 15.983 1.00 74.42 H new ATOM 0 HD23 LEU A 26 18.354 -5.532 16.835 1.00 74.42 H new ATOM 392 N ASP A 27 20.099 -9.777 18.471 1.00 3.11 N ATOM 393 CA ASP A 27 19.678 -10.092 19.839 1.00 12.11 C ATOM 394 C ASP A 27 20.707 -9.584 20.851 1.00 11.44 C ATOM 395 O ASP A 27 21.748 -10.213 21.058 1.00 42.31 O ATOM 396 CB ASP A 27 19.478 -11.605 20.019 1.00 5.04 C ATOM 397 CG ASP A 27 19.018 -11.967 21.426 1.00 74.13 C ATOM 398 OD1 ASP A 27 19.868 -12.264 22.292 1.00 54.23 O ATOM 399 OD2 ASP A 27 17.799 -11.958 21.676 1.00 11.42 O1- ATOM 0 H ASP A 27 21.093 -9.565 18.380 1.00 3.11 H new ATOM 0 HA ASP A 27 18.727 -9.590 20.017 1.00 12.11 H new ATOM 0 HB2 ASP A 27 18.743 -11.960 19.297 1.00 5.04 H new ATOM 0 HB3 ASP A 27 20.413 -12.121 19.802 1.00 5.04 H new ATOM 404 N VAL A 28 20.423 -8.430 21.457 1.00 5.03 N ATOM 405 CA VAL A 28 21.279 -7.849 22.503 1.00 42.02 C ATOM 406 C VAL A 28 20.458 -7.052 23.510 1.00 62.12 C ATOM 407 O VAL A 28 19.244 -6.923 23.373 1.00 32.30 O ATOM 408 CB VAL A 28 22.387 -6.920 21.929 1.00 24.24 C ATOM 409 CG1 VAL A 28 23.551 -7.734 21.377 1.00 34.22 C ATOM 410 CG2 VAL A 28 21.813 -5.983 20.866 1.00 1.00 C ATOM 0 H VAL A 28 19.598 -7.871 21.241 1.00 5.03 H new ATOM 0 HA VAL A 28 21.757 -8.697 22.993 1.00 42.02 H new ATOM 0 HB VAL A 28 22.770 -6.306 22.744 1.00 24.24 H new ATOM 0 HG11 VAL A 28 24.311 -7.060 20.982 1.00 34.22 H new ATOM 0 HG12 VAL A 28 23.982 -8.340 22.174 1.00 34.22 H new ATOM 0 HG13 VAL A 28 23.194 -8.385 20.579 1.00 34.22 H new ATOM 0 HG21 VAL A 28 22.606 -5.343 20.479 1.00 1.00 H new ATOM 0 HG22 VAL A 28 21.392 -6.572 20.051 1.00 1.00 H new ATOM 0 HG23 VAL A 28 21.032 -5.365 21.309 1.00 1.00 H new ATOM 420 N LYS A 29 21.138 -6.524 24.522 1.00 24.10 N ATOM 421 CA LYS A 29 20.512 -5.694 25.546 1.00 44.35 C ATOM 422 C LYS A 29 21.219 -4.352 25.637 1.00 43.02 C ATOM 423 O LYS A 29 22.442 -4.272 25.506 1.00 12.55 O ATOM 424 CB LYS A 29 20.526 -6.426 26.909 1.00 13.02 C ATOM 425 CG LYS A 29 20.561 -5.524 28.156 1.00 22.53 C ATOM 426 CD LYS A 29 21.986 -5.213 28.637 1.00 24.23 C ATOM 427 CE LYS A 29 22.728 -6.469 29.088 1.00 1.41 C ATOM 428 NZ LYS A 29 24.032 -6.153 29.734 1.00 62.42 N1+ ATOM 0 H LYS A 29 22.140 -6.659 24.656 1.00 24.10 H new ATOM 0 HA LYS A 29 19.473 -5.511 25.271 1.00 44.35 H new ATOM 0 HB2 LYS A 29 19.642 -7.060 26.968 1.00 13.02 H new ATOM 0 HB3 LYS A 29 21.394 -7.085 26.937 1.00 13.02 H new ATOM 0 HG2 LYS A 29 20.047 -4.589 27.935 1.00 22.53 H new ATOM 0 HG3 LYS A 29 20.010 -6.008 28.962 1.00 22.53 H new ATOM 0 HD2 LYS A 29 22.543 -4.733 27.832 1.00 24.23 H new ATOM 0 HD3 LYS A 29 21.942 -4.502 29.462 1.00 24.23 H new ATOM 0 HE2 LYS A 29 22.104 -7.026 29.787 1.00 1.41 H new ATOM 0 HE3 LYS A 29 22.898 -7.116 28.228 1.00 1.41 H new ATOM 0 HZ1 LYS A 29 24.738 -6.864 29.457 1.00 62.42 H new ATOM 0 HZ2 LYS A 29 24.351 -5.211 29.429 1.00 62.42 H new ATOM 0 HZ3 LYS A 29 23.919 -6.162 30.768 1.00 62.42 H new ATOM 442 N LEU A 30 20.445 -3.301 25.858 1.00 2.53 N ATOM 443 CA LEU A 30 20.981 -1.977 26.067 1.00 41.03 C ATOM 444 C LEU A 30 20.470 -1.421 27.392 1.00 64.12 C ATOM 445 O LEU A 30 19.522 -1.967 27.996 1.00 54.30 O ATOM 446 CB LEU A 30 20.673 -1.035 24.875 1.00 11.12 C ATOM 447 CG LEU A 30 19.233 -1.009 24.305 1.00 54.41 C ATOM 448 CD1 LEU A 30 18.865 -2.317 23.609 1.00 21.32 C ATOM 449 CD2 LEU A 30 18.211 -0.646 25.378 1.00 54.12 C ATOM 0 H LEU A 30 19.427 -3.348 25.896 1.00 2.53 H new ATOM 0 HA LEU A 30 22.068 -2.043 26.121 1.00 41.03 H new ATOM 0 HB2 LEU A 30 20.927 -0.020 25.181 1.00 11.12 H new ATOM 0 HB3 LEU A 30 21.347 -1.300 24.060 1.00 11.12 H new ATOM 0 HG LEU A 30 19.210 -0.226 23.547 1.00 54.41 H new ATOM 0 HD11 LEU A 30 17.847 -2.251 23.226 1.00 21.32 H new ATOM 0 HD12 LEU A 30 19.553 -2.495 22.783 1.00 21.32 H new ATOM 0 HD13 LEU A 30 18.932 -3.140 24.321 1.00 21.32 H new ATOM 0 HD21 LEU A 30 17.212 -0.638 24.941 1.00 54.12 H new ATOM 0 HD22 LEU A 30 18.250 -1.382 26.181 1.00 54.12 H new ATOM 0 HD23 LEU A 30 18.440 0.341 25.779 1.00 54.12 H new ATOM 461 N SER A 31 21.093 -0.347 27.848 1.00 75.34 N ATOM 462 CA SER A 31 20.804 0.178 29.163 1.00 34.22 C ATOM 463 C SER A 31 21.521 1.491 29.407 1.00 62.41 C ATOM 464 O SER A 31 22.712 1.626 29.108 1.00 64.13 O ATOM 465 CB SER A 31 21.218 -0.843 30.232 1.00 52.23 C ATOM 466 OG SER A 31 22.580 -1.204 30.100 1.00 11.31 O ATOM 0 H SER A 31 21.798 0.173 27.326 1.00 75.34 H new ATOM 0 HA SER A 31 19.731 0.363 29.223 1.00 34.22 H new ATOM 0 HB2 SER A 31 21.045 -0.424 31.224 1.00 52.23 H new ATOM 0 HB3 SER A 31 20.594 -1.733 30.149 1.00 52.23 H new ATOM 0 HG SER A 31 23.113 -0.719 30.764 1.00 11.31 H new ATOM 472 N ALA A 32 20.791 2.455 29.941 1.00 52.21 N ATOM 473 CA ALA A 32 21.397 3.670 30.441 1.00 43.51 C ATOM 474 C ALA A 32 22.102 3.359 31.763 1.00 25.12 C ATOM 475 O ALA A 32 21.572 2.604 32.586 1.00 4.30 O ATOM 476 CB ALA A 32 20.342 4.757 30.628 1.00 22.44 C ATOM 0 H ALA A 32 19.776 2.417 30.038 1.00 52.21 H new ATOM 0 HA ALA A 32 22.126 4.042 29.721 1.00 43.51 H new ATOM 0 HB1 ALA A 32 20.816 5.663 31.005 1.00 22.44 H new ATOM 0 HB2 ALA A 32 19.864 4.968 29.672 1.00 22.44 H new ATOM 0 HB3 ALA A 32 19.592 4.417 31.342 1.00 22.44 H new ATOM 482 N PRO A 33 23.307 3.917 31.992 1.00 32.33 N ATOM 483 CA PRO A 33 24.056 3.709 33.243 1.00 35.40 C ATOM 484 C PRO A 33 23.433 4.478 34.416 1.00 50.42 C ATOM 485 O PRO A 33 24.140 5.014 35.269 1.00 70.53 O ATOM 486 CB PRO A 33 25.453 4.247 32.908 1.00 73.33 C ATOM 487 CG PRO A 33 25.220 5.271 31.849 1.00 10.15 C ATOM 488 CD PRO A 33 24.044 4.779 31.044 1.00 32.53 C ATOM 0 HA PRO A 33 24.060 2.667 33.562 1.00 35.40 H new ATOM 0 HB2 PRO A 33 25.929 4.685 33.785 1.00 73.33 H new ATOM 0 HB3 PRO A 33 26.109 3.452 32.553 1.00 73.33 H new ATOM 0 HG2 PRO A 33 25.011 6.246 32.289 1.00 10.15 H new ATOM 0 HG3 PRO A 33 26.102 5.388 31.219 1.00 10.15 H new ATOM 0 HD2 PRO A 33 23.427 5.605 30.691 1.00 32.53 H new ATOM 0 HD3 PRO A 33 24.366 4.223 30.164 1.00 32.53 H new ATOM 496 N ARG A 34 22.101 4.469 34.466 1.00 10.53 N ATOM 497 CA ARG A 34 21.329 5.203 35.448 1.00 33.33 C ATOM 498 C ARG A 34 21.652 6.682 35.391 1.00 40.12 C ATOM 499 O ARG A 34 21.002 7.406 34.644 1.00 0.24 O ATOM 500 CB ARG A 34 21.549 4.608 36.839 1.00 35.21 C ATOM 501 CG ARG A 34 20.317 4.631 37.726 1.00 34.41 C ATOM 502 CD ARG A 34 20.438 3.594 38.825 1.00 50.12 C ATOM 503 NE ARG A 34 19.323 3.642 39.771 1.00 3.50 N ATOM 504 CZ ARG A 34 18.806 2.568 40.374 1.00 2.33 C ATOM 505 NH1 ARG A 34 19.247 1.349 40.071 1.00 23.02 N1+ ATOM 506 NH2 ARG A 34 17.825 2.712 41.255 1.00 21.42 N ATOM 0 H ARG A 34 21.526 3.940 33.811 1.00 10.53 H new ATOM 0 HA ARG A 34 20.268 5.107 35.216 1.00 33.33 H new ATOM 0 HB2 ARG A 34 21.887 3.577 36.732 1.00 35.21 H new ATOM 0 HB3 ARG A 34 22.350 5.156 37.334 1.00 35.21 H new ATOM 0 HG2 ARG A 34 20.195 5.622 38.164 1.00 34.41 H new ATOM 0 HG3 ARG A 34 19.427 4.435 37.128 1.00 34.41 H new ATOM 0 HD2 ARG A 34 20.488 2.601 38.378 1.00 50.12 H new ATOM 0 HD3 ARG A 34 21.373 3.748 39.363 1.00 50.12 H new ATOM 0 HE ARG A 34 18.915 4.552 39.983 1.00 3.50 H new ATOM 0 HH11 ARG A 34 19.983 1.231 39.375 1.00 23.02 H new ATOM 0 HH12 ARG A 34 18.848 0.533 40.535 1.00 23.02 H new ATOM 0 HH21 ARG A 34 17.466 3.642 41.471 1.00 21.42 H new ATOM 0 HH22 ARG A 34 17.429 1.893 41.716 1.00 21.42 H new ATOM 520 N GLU A 35 22.661 7.102 36.147 1.00 72.31 N ATOM 521 CA GLU A 35 23.118 8.491 36.179 1.00 75.14 C ATOM 522 C GLU A 35 21.981 9.480 36.423 1.00 65.21 C ATOM 523 O GLU A 35 21.817 9.999 37.528 1.00 33.12 O ATOM 524 CB GLU A 35 23.864 8.847 34.882 1.00 20.34 C ATOM 525 CG GLU A 35 25.168 8.083 34.691 1.00 71.30 C ATOM 526 CD GLU A 35 26.188 8.400 35.770 1.00 31.03 C ATOM 527 OE1 GLU A 35 26.220 7.693 36.800 1.00 31.45 O ATOM 528 OE2 GLU A 35 26.966 9.362 35.596 1.00 43.03 O1- ATOM 0 H GLU A 35 23.191 6.484 36.761 1.00 72.31 H new ATOM 0 HA GLU A 35 23.803 8.575 37.023 1.00 75.14 H new ATOM 0 HB2 GLU A 35 23.210 8.649 34.032 1.00 20.34 H new ATOM 0 HB3 GLU A 35 24.077 9.916 34.878 1.00 20.34 H new ATOM 0 HG2 GLU A 35 24.962 7.013 34.693 1.00 71.30 H new ATOM 0 HG3 GLU A 35 25.588 8.325 33.715 1.00 71.30 H new ATOM 535 N LEU A 36 21.192 9.713 35.389 1.00 33.22 N ATOM 536 CA LEU A 36 20.174 10.753 35.400 1.00 32.24 C ATOM 537 C LEU A 36 18.887 10.213 36.015 1.00 55.25 C ATOM 538 O LEU A 36 18.093 10.959 36.592 1.00 40.24 O ATOM 539 CB LEU A 36 19.945 11.252 33.965 1.00 11.21 C ATOM 540 CG LEU A 36 21.234 11.634 33.206 1.00 24.22 C ATOM 541 CD1 LEU A 36 20.940 12.005 31.754 1.00 52.21 C ATOM 542 CD2 LEU A 36 21.963 12.772 33.916 1.00 63.44 C ATOM 0 H LEU A 36 21.238 9.187 34.516 1.00 33.22 H new ATOM 0 HA LEU A 36 20.506 11.594 36.009 1.00 32.24 H new ATOM 0 HB2 LEU A 36 19.424 10.477 33.403 1.00 11.21 H new ATOM 0 HB3 LEU A 36 19.286 12.120 33.997 1.00 11.21 H new ATOM 0 HG LEU A 36 21.884 10.759 33.199 1.00 24.22 H new ATOM 0 HD11 LEU A 36 21.870 12.268 31.250 1.00 52.21 H new ATOM 0 HD12 LEU A 36 20.481 11.156 31.247 1.00 52.21 H new ATOM 0 HD13 LEU A 36 20.259 12.856 31.727 1.00 52.21 H new ATOM 0 HD21 LEU A 36 22.868 13.025 33.364 1.00 63.44 H new ATOM 0 HD22 LEU A 36 21.313 13.645 33.966 1.00 63.44 H new ATOM 0 HD23 LEU A 36 22.229 12.460 34.926 1.00 63.44 H new ATOM 554 N GLY A 37 18.695 8.902 35.895 1.00 72.22 N ATOM 555 CA GLY A 37 17.544 8.256 36.500 1.00 12.23 C ATOM 556 C GLY A 37 17.080 7.045 35.721 1.00 31.23 C ATOM 557 O GLY A 37 15.892 6.901 35.440 1.00 41.24 O ATOM 0 H GLY A 37 19.319 8.274 35.388 1.00 72.22 H new ATOM 0 HA2 GLY A 37 17.794 7.955 37.517 1.00 12.23 H new ATOM 0 HA3 GLY A 37 16.726 8.973 36.572 1.00 12.23 H new ATOM 561 N GLY A 38 18.015 6.164 35.367 1.00 73.44 N ATOM 562 CA GLY A 38 17.651 4.964 34.644 1.00 31.42 C ATOM 563 C GLY A 38 17.637 3.758 35.557 1.00 22.15 C ATOM 564 O GLY A 38 17.148 3.830 36.685 1.00 21.21 O ATOM 0 H GLY A 38 19.010 6.262 35.568 1.00 73.44 H new ATOM 0 HA2 GLY A 38 16.667 5.093 34.192 1.00 31.42 H new ATOM 0 HA3 GLY A 38 18.357 4.799 33.830 1.00 31.42 H new ATOM 568 N ALA A 39 18.202 2.665 35.075 1.00 14.21 N ATOM 569 CA ALA A 39 18.297 1.426 35.849 1.00 43.43 C ATOM 570 C ALA A 39 19.740 1.167 36.274 1.00 63.22 C ATOM 571 O ALA A 39 20.002 0.695 37.383 1.00 3.43 O ATOM 572 CB ALA A 39 17.763 0.250 35.037 1.00 5.43 C ATOM 0 H ALA A 39 18.608 2.604 34.141 1.00 14.21 H new ATOM 0 HA ALA A 39 17.688 1.534 36.747 1.00 43.43 H new ATOM 0 HB1 ALA A 39 17.840 -0.664 35.626 1.00 5.43 H new ATOM 0 HB2 ALA A 39 16.719 0.429 34.781 1.00 5.43 H new ATOM 0 HB3 ALA A 39 18.348 0.143 34.123 1.00 5.43 H new ATOM 578 N GLY A 40 20.677 1.505 35.389 1.00 15.31 N ATOM 579 CA GLY A 40 22.084 1.279 35.660 1.00 42.15 C ATOM 580 C GLY A 40 22.509 -0.136 35.332 1.00 45.53 C ATOM 581 O GLY A 40 22.320 -1.046 36.140 1.00 15.12 O ATOM 0 H GLY A 40 20.482 1.934 34.484 1.00 15.31 H new ATOM 0 HA2 GLY A 40 22.682 1.980 35.078 1.00 42.15 H new ATOM 0 HA3 GLY A 40 22.287 1.483 36.711 1.00 42.15 H new ATOM 585 N ALA A 41 23.062 -0.326 34.138 1.00 5.32 N ATOM 586 CA ALA A 41 23.538 -1.639 33.710 1.00 5.21 C ATOM 587 C ALA A 41 24.567 -1.513 32.589 1.00 44.21 C ATOM 588 O ALA A 41 24.626 -0.491 31.894 1.00 13.22 O ATOM 589 CB ALA A 41 22.366 -2.504 33.261 1.00 40.21 C ATOM 0 H ALA A 41 23.192 0.414 33.448 1.00 5.32 H new ATOM 0 HA ALA A 41 24.024 -2.117 34.560 1.00 5.21 H new ATOM 0 HB1 ALA A 41 22.734 -3.480 32.945 1.00 40.21 H new ATOM 0 HB2 ALA A 41 21.669 -2.630 34.089 1.00 40.21 H new ATOM 0 HB3 ALA A 41 21.856 -2.021 32.428 1.00 40.21 H new ATOM 595 N GLU A 42 25.378 -2.557 32.423 1.00 32.32 N ATOM 596 CA GLU A 42 26.396 -2.603 31.373 1.00 71.23 C ATOM 597 C GLU A 42 25.752 -2.885 30.013 1.00 1.12 C ATOM 598 O GLU A 42 25.656 -4.032 29.557 1.00 55.43 O ATOM 599 CB GLU A 42 27.456 -3.660 31.707 1.00 42.31 C ATOM 600 CG GLU A 42 26.864 -5.031 31.977 1.00 52.14 C ATOM 601 CD GLU A 42 27.892 -6.033 32.473 1.00 31.41 C ATOM 602 OE1 GLU A 42 28.203 -6.029 33.684 1.00 24.22 O ATOM 603 OE2 GLU A 42 28.393 -6.834 31.656 1.00 54.53 O1- ATOM 0 H GLU A 42 25.349 -3.391 33.009 1.00 32.32 H new ATOM 0 HA GLU A 42 26.887 -1.631 31.319 1.00 71.23 H new ATOM 0 HB2 GLU A 42 28.162 -3.732 30.880 1.00 42.31 H new ATOM 0 HB3 GLU A 42 28.021 -3.336 32.581 1.00 42.31 H new ATOM 0 HG2 GLU A 42 26.069 -4.938 32.717 1.00 52.14 H new ATOM 0 HG3 GLU A 42 26.407 -5.410 31.063 1.00 52.14 H new ATOM 610 N GLY A 43 25.270 -1.829 29.399 1.00 3.30 N ATOM 611 CA GLY A 43 24.670 -1.919 28.082 1.00 20.41 C ATOM 612 C GLY A 43 24.944 -0.681 27.262 1.00 55.55 C ATOM 613 O GLY A 43 25.838 0.102 27.591 1.00 25.21 O ATOM 0 H GLY A 43 25.281 -0.888 29.793 1.00 3.30 H new ATOM 0 HA2 GLY A 43 25.060 -2.794 27.563 1.00 20.41 H new ATOM 0 HA3 GLY A 43 23.594 -2.060 28.180 1.00 20.41 H new ATOM 617 N THR A 44 24.180 -0.497 26.197 1.00 1.14 N ATOM 618 CA THR A 44 24.359 0.644 25.317 1.00 0.00 C ATOM 619 C THR A 44 23.318 1.727 25.613 1.00 54.32 C ATOM 620 O THR A 44 22.141 1.426 25.817 1.00 53.24 O ATOM 621 CB THR A 44 24.246 0.208 23.837 1.00 74.01 C ATOM 622 OG1 THR A 44 25.134 -0.894 23.592 1.00 60.01 O ATOM 623 CG2 THR A 44 24.582 1.354 22.885 1.00 54.14 C ATOM 0 H THR A 44 23.427 -1.127 25.921 1.00 1.14 H new ATOM 0 HA THR A 44 25.353 1.053 25.496 1.00 0.00 H new ATOM 0 HB THR A 44 23.214 -0.092 23.653 1.00 74.01 H new ATOM 0 HG1 THR A 44 25.061 -1.171 22.655 1.00 60.01 H new ATOM 0 HG21 THR A 44 24.492 1.010 21.855 1.00 54.14 H new ATOM 0 HG22 THR A 44 23.892 2.181 23.053 1.00 54.14 H new ATOM 0 HG23 THR A 44 25.603 1.691 23.067 1.00 54.14 H new ATOM 631 N ASN A 45 23.773 2.977 25.685 1.00 72.33 N ATOM 632 CA ASN A 45 22.873 4.129 25.746 1.00 33.43 C ATOM 633 C ASN A 45 22.063 4.217 24.451 1.00 24.30 C ATOM 634 O ASN A 45 22.641 4.173 23.365 1.00 63.01 O ATOM 635 CB ASN A 45 23.677 5.428 25.948 1.00 4.20 C ATOM 636 CG ASN A 45 23.905 5.770 27.409 1.00 5.33 C ATOM 637 OD1 ASN A 45 24.839 5.271 28.040 1.00 50.31 O ATOM 638 ND2 ASN A 45 23.072 6.649 27.947 1.00 41.45 N ATOM 0 H ASN A 45 24.764 3.219 25.703 1.00 72.33 H new ATOM 0 HA ASN A 45 22.195 4.003 26.590 1.00 33.43 H new ATOM 0 HB2 ASN A 45 24.642 5.332 25.449 1.00 4.20 H new ATOM 0 HB3 ASN A 45 23.150 6.252 25.467 1.00 4.20 H new ATOM 0 HD21 ASN A 45 23.191 6.936 28.918 1.00 41.45 H new ATOM 0 HD22 ASN A 45 22.311 7.038 27.390 1.00 41.45 H new ATOM 645 N PRO A 46 20.723 4.315 24.544 1.00 63.04 N ATOM 646 CA PRO A 46 19.853 4.460 23.368 1.00 61.02 C ATOM 647 C PRO A 46 20.304 5.598 22.441 1.00 4.44 C ATOM 648 O PRO A 46 20.379 5.420 21.220 1.00 23.02 O ATOM 649 CB PRO A 46 18.459 4.746 23.965 1.00 23.35 C ATOM 650 CG PRO A 46 18.683 4.997 25.423 1.00 42.23 C ATOM 651 CD PRO A 46 19.943 4.265 25.790 1.00 1.14 C ATOM 0 HA PRO A 46 19.872 3.569 22.740 1.00 61.02 H new ATOM 0 HB2 PRO A 46 17.998 5.610 23.486 1.00 23.35 H new ATOM 0 HB3 PRO A 46 17.788 3.901 23.812 1.00 23.35 H new ATOM 0 HG2 PRO A 46 18.781 6.064 25.623 1.00 42.23 H new ATOM 0 HG3 PRO A 46 17.840 4.639 26.013 1.00 42.23 H new ATOM 0 HD2 PRO A 46 20.466 4.749 26.615 1.00 1.14 H new ATOM 0 HD3 PRO A 46 19.740 3.240 26.099 1.00 1.14 H new ATOM 659 N GLU A 47 20.630 6.753 23.025 1.00 25.31 N ATOM 660 CA GLU A 47 21.078 7.912 22.242 1.00 53.11 C ATOM 661 C GLU A 47 22.345 7.537 21.479 1.00 42.42 C ATOM 662 O GLU A 47 22.498 7.834 20.292 1.00 0.52 O ATOM 663 CB GLU A 47 21.368 9.147 23.132 1.00 52.55 C ATOM 664 CG GLU A 47 20.627 9.186 24.469 1.00 35.10 C ATOM 665 CD GLU A 47 21.340 8.391 25.559 1.00 32.04 C ATOM 666 OE1 GLU A 47 22.306 8.914 26.145 1.00 53.13 O ATOM 667 OE2 GLU A 47 20.946 7.238 25.822 1.00 62.13 O1- ATOM 0 H GLU A 47 20.593 6.913 24.032 1.00 25.31 H new ATOM 0 HA GLU A 47 20.274 8.180 21.557 1.00 53.11 H new ATOM 0 HB2 GLU A 47 22.439 9.187 23.329 1.00 52.55 H new ATOM 0 HB3 GLU A 47 21.114 10.046 22.570 1.00 52.55 H new ATOM 0 HG2 GLU A 47 20.520 10.222 24.791 1.00 35.10 H new ATOM 0 HG3 GLU A 47 19.621 8.789 24.334 1.00 35.10 H new ATOM 674 N GLN A 48 23.238 6.868 22.193 1.00 41.14 N ATOM 675 CA GLN A 48 24.497 6.384 21.646 1.00 71.11 C ATOM 676 C GLN A 48 24.249 5.386 20.518 1.00 34.04 C ATOM 677 O GLN A 48 24.962 5.374 19.516 1.00 32.22 O ATOM 678 CB GLN A 48 25.291 5.720 22.772 1.00 12.45 C ATOM 679 CG GLN A 48 26.619 5.105 22.355 1.00 72.35 C ATOM 680 CD GLN A 48 27.252 4.307 23.483 1.00 3.55 C ATOM 681 OE1 GLN A 48 28.468 4.224 23.594 1.00 43.42 O ATOM 682 NE2 GLN A 48 26.425 3.698 24.322 1.00 72.04 N ATOM 0 H GLN A 48 23.108 6.643 23.179 1.00 41.14 H new ATOM 0 HA GLN A 48 25.060 7.221 21.233 1.00 71.11 H new ATOM 0 HB2 GLN A 48 25.480 6.462 23.547 1.00 12.45 H new ATOM 0 HB3 GLN A 48 24.673 4.942 23.220 1.00 12.45 H new ATOM 0 HG2 GLN A 48 26.464 4.456 21.493 1.00 72.35 H new ATOM 0 HG3 GLN A 48 27.302 5.894 22.041 1.00 72.35 H new ATOM 0 HE21 GLN A 48 25.416 3.789 24.200 1.00 72.04 H new ATOM 0 HE22 GLN A 48 26.798 3.139 25.089 1.00 72.04 H new ATOM 691 N LEU A 49 23.228 4.556 20.700 1.00 51.33 N ATOM 692 CA LEU A 49 22.883 3.520 19.730 1.00 61.13 C ATOM 693 C LEU A 49 22.453 4.165 18.411 1.00 21.55 C ATOM 694 O LEU A 49 22.948 3.802 17.339 1.00 71.11 O ATOM 695 CB LEU A 49 21.773 2.615 20.316 1.00 4.20 C ATOM 696 CG LEU A 49 21.466 1.299 19.562 1.00 31.10 C ATOM 697 CD1 LEU A 49 20.665 1.549 18.288 1.00 0.52 C ATOM 698 CD2 LEU A 49 22.754 0.539 19.248 1.00 52.41 C ATOM 0 H LEU A 49 22.619 4.580 21.518 1.00 51.33 H new ATOM 0 HA LEU A 49 23.753 2.897 19.524 1.00 61.13 H new ATOM 0 HB2 LEU A 49 22.048 2.362 21.340 1.00 4.20 H new ATOM 0 HB3 LEU A 49 20.853 3.198 20.368 1.00 4.20 H new ATOM 0 HG LEU A 49 20.852 0.684 20.220 1.00 31.10 H new ATOM 0 HD11 LEU A 49 20.470 0.600 17.788 1.00 0.52 H new ATOM 0 HD12 LEU A 49 19.718 2.027 18.541 1.00 0.52 H new ATOM 0 HD13 LEU A 49 21.233 2.199 17.623 1.00 0.52 H new ATOM 0 HD21 LEU A 49 22.513 -0.382 18.718 1.00 52.41 H new ATOM 0 HD22 LEU A 49 23.399 1.158 18.624 1.00 52.41 H new ATOM 0 HD23 LEU A 49 23.270 0.298 20.177 1.00 52.41 H new ATOM 710 N PHE A 50 21.544 5.133 18.498 1.00 3.42 N ATOM 711 CA PHE A 50 21.068 5.852 17.317 1.00 25.51 C ATOM 712 C PHE A 50 22.208 6.643 16.664 1.00 64.45 C ATOM 713 O PHE A 50 22.396 6.568 15.457 1.00 15.22 O ATOM 714 CB PHE A 50 19.901 6.779 17.687 1.00 52.14 C ATOM 715 CG PHE A 50 19.485 7.735 16.590 1.00 40.34 C ATOM 716 CD1 PHE A 50 18.934 7.275 15.398 1.00 40.14 C ATOM 717 CD2 PHE A 50 19.634 9.100 16.764 1.00 31.01 C ATOM 718 CE1 PHE A 50 18.546 8.161 14.407 1.00 11.20 C ATOM 719 CE2 PHE A 50 19.253 9.988 15.780 1.00 34.34 C ATOM 720 CZ PHE A 50 18.711 9.520 14.597 1.00 61.21 C ATOM 0 H PHE A 50 21.121 5.439 19.375 1.00 3.42 H new ATOM 0 HA PHE A 50 20.708 5.121 16.592 1.00 25.51 H new ATOM 0 HB2 PHE A 50 19.042 6.168 17.964 1.00 52.14 H new ATOM 0 HB3 PHE A 50 20.178 7.357 18.569 1.00 52.14 H new ATOM 0 HD1 PHE A 50 18.807 6.214 15.244 1.00 40.14 H new ATOM 0 HD2 PHE A 50 20.055 9.476 17.685 1.00 31.01 H new ATOM 0 HE1 PHE A 50 18.116 7.791 13.488 1.00 11.20 H new ATOM 0 HE2 PHE A 50 19.378 11.050 15.933 1.00 34.34 H new ATOM 0 HZ PHE A 50 18.417 10.214 13.824 1.00 61.21 H new ATOM 730 N ALA A 51 22.958 7.393 17.469 1.00 33.43 N ATOM 731 CA ALA A 51 24.110 8.161 16.978 1.00 33.33 C ATOM 732 C ALA A 51 25.088 7.271 16.205 1.00 4.13 C ATOM 733 O ALA A 51 25.503 7.608 15.091 1.00 52.03 O ATOM 734 CB ALA A 51 24.820 8.840 18.144 1.00 51.41 C ATOM 0 H ALA A 51 22.790 7.488 18.471 1.00 33.43 H new ATOM 0 HA ALA A 51 23.740 8.922 16.291 1.00 33.33 H new ATOM 0 HB1 ALA A 51 25.673 9.407 17.770 1.00 51.41 H new ATOM 0 HB2 ALA A 51 24.128 9.515 18.648 1.00 51.41 H new ATOM 0 HB3 ALA A 51 25.167 8.084 18.848 1.00 51.41 H new ATOM 740 N ALA A 52 25.444 6.132 16.794 1.00 32.43 N ATOM 741 CA ALA A 52 26.376 5.195 16.170 1.00 41.10 C ATOM 742 C ALA A 52 25.813 4.676 14.848 1.00 30.53 C ATOM 743 O ALA A 52 26.469 4.755 13.803 1.00 13.40 O ATOM 744 CB ALA A 52 26.675 4.037 17.116 1.00 51.43 C ATOM 0 H ALA A 52 25.100 5.834 17.707 1.00 32.43 H new ATOM 0 HA ALA A 52 27.307 5.721 15.961 1.00 41.10 H new ATOM 0 HB1 ALA A 52 27.370 3.347 16.638 1.00 51.43 H new ATOM 0 HB2 ALA A 52 27.119 4.422 18.034 1.00 51.43 H new ATOM 0 HB3 ALA A 52 25.749 3.513 17.353 1.00 51.43 H new ATOM 750 N GLY A 53 24.588 4.163 14.904 1.00 32.23 N ATOM 751 CA GLY A 53 23.947 3.618 13.721 1.00 45.35 C ATOM 752 C GLY A 53 23.727 4.664 12.644 1.00 24.44 C ATOM 753 O GLY A 53 23.830 4.366 11.459 1.00 23.31 O ATOM 0 H GLY A 53 24.025 4.115 15.753 1.00 32.23 H new ATOM 0 HA2 GLY A 53 24.560 2.811 13.319 1.00 45.35 H new ATOM 0 HA3 GLY A 53 22.988 3.181 14.000 1.00 45.35 H new ATOM 757 N TYR A 54 23.440 5.892 13.065 1.00 20.42 N ATOM 758 CA TYR A 54 23.159 6.994 12.147 1.00 1.52 C ATOM 759 C TYR A 54 24.430 7.426 11.421 1.00 10.14 C ATOM 760 O TYR A 54 24.414 7.645 10.209 1.00 3.35 O ATOM 761 CB TYR A 54 22.544 8.174 12.922 1.00 4.31 C ATOM 762 CG TYR A 54 22.193 9.398 12.086 1.00 71.40 C ATOM 763 CD1 TYR A 54 21.891 9.300 10.730 1.00 61.33 C ATOM 764 CD2 TYR A 54 22.150 10.659 12.674 1.00 12.15 C ATOM 765 CE1 TYR A 54 21.561 10.423 9.988 1.00 65.13 C ATOM 766 CE2 TYR A 54 21.824 11.782 11.939 1.00 14.31 C ATOM 767 CZ TYR A 54 21.529 11.660 10.599 1.00 61.32 C ATOM 768 OH TYR A 54 21.195 12.779 9.867 1.00 14.13 O ATOM 0 H TYR A 54 23.395 6.152 14.050 1.00 20.42 H new ATOM 0 HA TYR A 54 22.444 6.656 11.397 1.00 1.52 H new ATOM 0 HB2 TYR A 54 21.640 7.826 13.421 1.00 4.31 H new ATOM 0 HB3 TYR A 54 23.243 8.477 13.702 1.00 4.31 H new ATOM 0 HD1 TYR A 54 21.914 8.333 10.249 1.00 61.33 H new ATOM 0 HD2 TYR A 54 22.376 10.761 13.725 1.00 12.15 H new ATOM 0 HE1 TYR A 54 21.330 10.331 8.937 1.00 65.13 H new ATOM 0 HE2 TYR A 54 21.800 12.752 12.413 1.00 14.31 H new ATOM 0 HH TYR A 54 21.733 13.540 10.169 1.00 14.13 H new ATOM 778 N SER A 55 25.529 7.538 12.160 1.00 11.10 N ATOM 779 CA SER A 55 26.810 7.906 11.563 1.00 22.53 C ATOM 780 C SER A 55 27.263 6.825 10.582 1.00 50.31 C ATOM 781 O SER A 55 27.628 7.120 9.442 1.00 23.31 O ATOM 782 CB SER A 55 27.867 8.136 12.652 1.00 0.44 C ATOM 783 OG SER A 55 27.948 7.031 13.537 1.00 35.10 O ATOM 0 H SER A 55 25.560 7.381 13.167 1.00 11.10 H new ATOM 0 HA SER A 55 26.686 8.839 11.014 1.00 22.53 H new ATOM 0 HB2 SER A 55 28.839 8.304 12.188 1.00 0.44 H new ATOM 0 HB3 SER A 55 27.622 9.037 13.214 1.00 0.44 H new ATOM 0 HG SER A 55 27.217 7.079 14.187 1.00 35.10 H new ATOM 789 N ALA A 56 27.205 5.571 11.028 1.00 25.24 N ATOM 790 CA ALA A 56 27.539 4.438 10.173 1.00 63.14 C ATOM 791 C ALA A 56 26.595 4.373 8.973 1.00 34.41 C ATOM 792 O ALA A 56 27.014 4.083 7.851 1.00 72.41 O ATOM 793 CB ALA A 56 27.486 3.143 10.974 1.00 2.41 C ATOM 0 H ALA A 56 26.930 5.316 11.977 1.00 25.24 H new ATOM 0 HA ALA A 56 28.553 4.571 9.797 1.00 63.14 H new ATOM 0 HB1 ALA A 56 27.737 2.304 10.326 1.00 2.41 H new ATOM 0 HB2 ALA A 56 28.201 3.194 11.795 1.00 2.41 H new ATOM 0 HB3 ALA A 56 26.482 3.004 11.375 1.00 2.41 H new ATOM 799 N CYS A 57 25.319 4.664 9.216 1.00 43.11 N ATOM 800 CA CYS A 57 24.315 4.683 8.158 1.00 65.50 C ATOM 801 C CYS A 57 24.619 5.800 7.170 1.00 1.30 C ATOM 802 O CYS A 57 24.388 5.656 5.972 1.00 31.43 O ATOM 803 CB CYS A 57 22.906 4.866 8.738 1.00 74.40 C ATOM 804 SG CYS A 57 21.586 4.878 7.501 1.00 3.24 S ATOM 0 H CYS A 57 24.956 4.891 10.142 1.00 43.11 H new ATOM 0 HA CYS A 57 24.349 3.725 7.640 1.00 65.50 H new ATOM 0 HB2 CYS A 57 22.712 4.064 9.451 1.00 74.40 H new ATOM 0 HB3 CYS A 57 22.874 5.802 9.295 1.00 74.40 H new ATOM 0 HG CYS A 57 20.485 5.306 8.045 1.00 3.24 H new ATOM 810 N PHE A 58 25.121 6.920 7.686 1.00 12.51 N ATOM 811 CA PHE A 58 25.428 8.080 6.860 1.00 55.51 C ATOM 812 C PHE A 58 26.526 7.728 5.857 1.00 60.31 C ATOM 813 O PHE A 58 26.580 8.280 4.759 1.00 54.45 O ATOM 814 CB PHE A 58 25.853 9.268 7.741 1.00 64.12 C ATOM 815 CG PHE A 58 25.649 10.609 7.082 1.00 32.51 C ATOM 816 CD1 PHE A 58 26.704 11.282 6.480 1.00 53.31 C ATOM 817 CD2 PHE A 58 24.389 11.193 7.059 1.00 40.52 C ATOM 818 CE1 PHE A 58 26.504 12.508 5.871 1.00 60.42 C ATOM 819 CE2 PHE A 58 24.184 12.417 6.455 1.00 51.42 C ATOM 820 CZ PHE A 58 25.243 13.076 5.859 1.00 5.31 C ATOM 0 H PHE A 58 25.324 7.046 8.678 1.00 12.51 H new ATOM 0 HA PHE A 58 24.534 8.370 6.309 1.00 55.51 H new ATOM 0 HB2 PHE A 58 25.287 9.240 8.672 1.00 64.12 H new ATOM 0 HB3 PHE A 58 26.905 9.157 8.003 1.00 64.12 H new ATOM 0 HD1 PHE A 58 27.691 10.844 6.487 1.00 53.31 H new ATOM 0 HD2 PHE A 58 23.557 10.682 7.521 1.00 40.52 H new ATOM 0 HE1 PHE A 58 27.332 13.021 5.405 1.00 60.42 H new ATOM 0 HE2 PHE A 58 23.199 12.859 6.448 1.00 51.42 H new ATOM 0 HZ PHE A 58 25.086 14.033 5.385 1.00 5.31 H new ATOM 830 N LEU A 59 27.396 6.797 6.245 1.00 64.51 N ATOM 831 CA LEU A 59 28.425 6.279 5.345 1.00 63.33 C ATOM 832 C LEU A 59 27.769 5.542 4.177 1.00 14.15 C ATOM 833 O LEU A 59 28.021 5.855 3.011 1.00 3.51 O ATOM 834 CB LEU A 59 29.377 5.338 6.100 1.00 74.12 C ATOM 835 CG LEU A 59 30.204 5.992 7.223 1.00 31.41 C ATOM 836 CD1 LEU A 59 30.993 4.939 7.998 1.00 61.22 C ATOM 837 CD2 LEU A 59 31.140 7.056 6.653 1.00 2.33 C ATOM 0 H LEU A 59 27.409 6.385 7.178 1.00 64.51 H new ATOM 0 HA LEU A 59 29.006 7.116 4.957 1.00 63.33 H new ATOM 0 HB2 LEU A 59 28.791 4.526 6.530 1.00 74.12 H new ATOM 0 HB3 LEU A 59 30.063 4.890 5.381 1.00 74.12 H new ATOM 0 HG LEU A 59 29.515 6.477 7.914 1.00 31.41 H new ATOM 0 HD11 LEU A 59 31.570 5.423 8.786 1.00 61.22 H new ATOM 0 HD12 LEU A 59 30.303 4.221 8.442 1.00 61.22 H new ATOM 0 HD13 LEU A 59 31.670 4.420 7.320 1.00 61.22 H new ATOM 0 HD21 LEU A 59 31.715 7.506 7.462 1.00 2.33 H new ATOM 0 HD22 LEU A 59 31.820 6.596 5.936 1.00 2.33 H new ATOM 0 HD23 LEU A 59 30.553 7.827 6.153 1.00 2.33 H new ATOM 849 N SER A 60 26.916 4.575 4.509 1.00 34.05 N ATOM 850 CA SER A 60 26.166 3.813 3.511 1.00 74.40 C ATOM 851 C SER A 60 25.330 4.756 2.640 1.00 42.34 C ATOM 852 O SER A 60 25.238 4.588 1.419 1.00 41.15 O ATOM 853 CB SER A 60 25.267 2.783 4.213 1.00 52.34 C ATOM 854 OG SER A 60 24.598 1.953 3.280 1.00 74.20 O ATOM 0 H SER A 60 26.725 4.298 5.472 1.00 34.05 H new ATOM 0 HA SER A 60 26.866 3.284 2.864 1.00 74.40 H new ATOM 0 HB2 SER A 60 25.870 2.168 4.881 1.00 52.34 H new ATOM 0 HB3 SER A 60 24.534 3.301 4.832 1.00 52.34 H new ATOM 0 HG SER A 60 25.124 1.140 3.129 1.00 74.20 H new ATOM 860 N ALA A 61 24.753 5.773 3.275 1.00 5.22 N ATOM 861 CA ALA A 61 23.951 6.769 2.577 1.00 61.10 C ATOM 862 C ALA A 61 24.808 7.512 1.560 1.00 23.52 C ATOM 863 O ALA A 61 24.426 7.647 0.402 1.00 64.15 O ATOM 864 CB ALA A 61 23.323 7.742 3.569 1.00 23.00 C ATOM 0 H ALA A 61 24.828 5.928 4.280 1.00 5.22 H new ATOM 0 HA ALA A 61 23.146 6.261 2.046 1.00 61.10 H new ATOM 0 HB1 ALA A 61 22.728 8.478 3.029 1.00 23.00 H new ATOM 0 HB2 ALA A 61 22.683 7.194 4.260 1.00 23.00 H new ATOM 0 HB3 ALA A 61 24.109 8.250 4.128 1.00 23.00 H new ATOM 870 N MET A 62 25.981 7.967 1.997 1.00 1.42 N ATOM 871 CA MET A 62 26.919 8.662 1.117 1.00 22.23 C ATOM 872 C MET A 62 27.442 7.723 0.035 1.00 52.25 C ATOM 873 O MET A 62 27.840 8.167 -1.041 1.00 52.11 O ATOM 874 CB MET A 62 28.092 9.252 1.914 1.00 12.31 C ATOM 875 CG MET A 62 27.735 10.512 2.692 1.00 13.45 C ATOM 876 SD MET A 62 27.146 11.844 1.623 1.00 13.34 S ATOM 877 CE MET A 62 28.539 12.054 0.511 1.00 61.32 C ATOM 0 H MET A 62 26.305 7.866 2.959 1.00 1.42 H new ATOM 0 HA MET A 62 26.380 9.481 0.640 1.00 22.23 H new ATOM 0 HB2 MET A 62 28.461 8.499 2.610 1.00 12.31 H new ATOM 0 HB3 MET A 62 28.908 9.479 1.228 1.00 12.31 H new ATOM 0 HG2 MET A 62 26.967 10.275 3.428 1.00 13.45 H new ATOM 0 HG3 MET A 62 28.610 10.854 3.244 1.00 13.45 H new ATOM 0 HE1 MET A 62 28.630 13.105 0.237 1.00 61.32 H new ATOM 0 HE2 MET A 62 29.453 11.728 1.007 1.00 61.32 H new ATOM 0 HE3 MET A 62 28.381 11.457 -0.387 1.00 61.32 H new ATOM 887 N LYS A 63 27.442 6.424 0.328 1.00 50.31 N ATOM 888 CA LYS A 63 27.835 5.414 -0.651 1.00 32.21 C ATOM 889 C LYS A 63 26.806 5.406 -1.784 1.00 55.33 C ATOM 890 O LYS A 63 27.156 5.434 -2.966 1.00 31.21 O ATOM 891 CB LYS A 63 27.925 4.028 0.025 1.00 32.54 C ATOM 892 CG LYS A 63 28.981 3.072 -0.552 1.00 62.32 C ATOM 893 CD LYS A 63 28.719 2.662 -2.008 1.00 52.53 C ATOM 894 CE LYS A 63 29.530 3.496 -2.999 1.00 52.13 C ATOM 895 NZ LYS A 63 29.345 3.038 -4.403 1.00 51.23 N1+ ATOM 0 H LYS A 63 27.174 6.046 1.237 1.00 50.31 H new ATOM 0 HA LYS A 63 28.818 5.649 -1.060 1.00 32.21 H new ATOM 0 HB2 LYS A 63 28.134 4.174 1.085 1.00 32.54 H new ATOM 0 HB3 LYS A 63 26.949 3.547 -0.044 1.00 32.54 H new ATOM 0 HG2 LYS A 63 29.960 3.547 -0.489 1.00 62.32 H new ATOM 0 HG3 LYS A 63 29.022 2.175 0.066 1.00 62.32 H new ATOM 0 HD2 LYS A 63 28.965 1.608 -2.136 1.00 52.53 H new ATOM 0 HD3 LYS A 63 27.657 2.771 -2.228 1.00 52.53 H new ATOM 0 HE2 LYS A 63 29.235 4.542 -2.918 1.00 52.13 H new ATOM 0 HE3 LYS A 63 30.587 3.442 -2.737 1.00 52.13 H new ATOM 0 HZ1 LYS A 63 29.913 3.632 -5.040 1.00 51.23 H new ATOM 0 HZ2 LYS A 63 29.651 2.048 -4.488 1.00 51.23 H new ATOM 0 HZ3 LYS A 63 28.341 3.114 -4.663 1.00 51.23 H new ATOM 909 N PHE A 64 25.530 5.389 -1.401 1.00 54.13 N ATOM 910 CA PHE A 64 24.430 5.437 -2.362 1.00 15.41 C ATOM 911 C PHE A 64 24.418 6.781 -3.097 1.00 43.31 C ATOM 912 O PHE A 64 24.268 6.833 -4.320 1.00 31.42 O ATOM 913 CB PHE A 64 23.086 5.203 -1.653 1.00 54.23 C ATOM 914 CG PHE A 64 21.892 5.271 -2.577 1.00 22.52 C ATOM 915 CD1 PHE A 64 21.686 4.292 -3.539 1.00 70.34 C ATOM 916 CD2 PHE A 64 20.986 6.319 -2.489 1.00 44.41 C ATOM 917 CE1 PHE A 64 20.600 4.354 -4.390 1.00 70.35 C ATOM 918 CE2 PHE A 64 19.898 6.384 -3.338 1.00 31.33 C ATOM 919 CZ PHE A 64 19.708 5.403 -4.292 1.00 62.32 C ATOM 0 H PHE A 64 25.232 5.342 -0.427 1.00 54.13 H new ATOM 0 HA PHE A 64 24.578 4.643 -3.094 1.00 15.41 H new ATOM 0 HB2 PHE A 64 23.105 4.226 -1.170 1.00 54.23 H new ATOM 0 HB3 PHE A 64 22.967 5.946 -0.865 1.00 54.23 H new ATOM 0 HD1 PHE A 64 22.383 3.472 -3.623 1.00 70.34 H new ATOM 0 HD2 PHE A 64 21.133 7.092 -1.749 1.00 44.41 H new ATOM 0 HE1 PHE A 64 20.449 3.583 -5.131 1.00 70.35 H new ATOM 0 HE2 PHE A 64 19.197 7.201 -3.256 1.00 31.33 H new ATOM 0 HZ PHE A 64 18.862 5.457 -4.961 1.00 62.32 H new ATOM 929 N VAL A 65 24.590 7.863 -2.342 1.00 22.12 N ATOM 930 CA VAL A 65 24.646 9.208 -2.909 1.00 1.13 C ATOM 931 C VAL A 65 25.757 9.299 -3.951 1.00 2.04 C ATOM 932 O VAL A 65 25.538 9.765 -5.070 1.00 1.42 O ATOM 933 CB VAL A 65 24.866 10.290 -1.819 1.00 51.41 C ATOM 934 CG1 VAL A 65 25.157 11.650 -2.453 1.00 35.23 C ATOM 935 CG2 VAL A 65 23.653 10.378 -0.889 1.00 41.32 C ATOM 0 H VAL A 65 24.694 7.834 -1.328 1.00 22.12 H new ATOM 0 HA VAL A 65 23.682 9.398 -3.382 1.00 1.13 H new ATOM 0 HB VAL A 65 25.732 9.999 -1.225 1.00 51.41 H new ATOM 0 HG11 VAL A 65 25.308 12.392 -1.669 1.00 35.23 H new ATOM 0 HG12 VAL A 65 26.056 11.581 -3.065 1.00 35.23 H new ATOM 0 HG13 VAL A 65 24.315 11.948 -3.078 1.00 35.23 H new ATOM 0 HG21 VAL A 65 23.829 11.143 -0.133 1.00 41.32 H new ATOM 0 HG22 VAL A 65 22.768 10.639 -1.469 1.00 41.32 H new ATOM 0 HG23 VAL A 65 23.497 9.415 -0.402 1.00 41.32 H new ATOM 945 N ALA A 66 26.941 8.829 -3.586 1.00 10.53 N ATOM 946 CA ALA A 66 28.070 8.801 -4.505 1.00 34.24 C ATOM 947 C ALA A 66 27.729 7.959 -5.731 1.00 52.01 C ATOM 948 O ALA A 66 28.184 8.238 -6.840 1.00 55.45 O ATOM 949 CB ALA A 66 29.315 8.263 -3.804 1.00 2.15 C ATOM 0 H ALA A 66 27.145 8.461 -2.657 1.00 10.53 H new ATOM 0 HA ALA A 66 28.281 9.818 -4.835 1.00 34.24 H new ATOM 0 HB1 ALA A 66 30.150 8.249 -4.505 1.00 2.15 H new ATOM 0 HB2 ALA A 66 29.562 8.905 -2.958 1.00 2.15 H new ATOM 0 HB3 ALA A 66 29.123 7.251 -3.448 1.00 2.15 H new ATOM 955 N GLY A 67 26.878 6.962 -5.520 1.00 41.30 N ATOM 956 CA GLY A 67 26.493 6.053 -6.588 1.00 41.44 C ATOM 957 C GLY A 67 25.576 6.712 -7.598 1.00 65.01 C ATOM 958 O GLY A 67 25.604 6.386 -8.786 1.00 24.21 O ATOM 0 H GLY A 67 26.443 6.764 -4.619 1.00 41.30 H new ATOM 0 HA2 GLY A 67 27.388 5.691 -7.094 1.00 41.44 H new ATOM 0 HA3 GLY A 67 25.994 5.183 -6.160 1.00 41.44 H new ATOM 962 N GLN A 68 24.773 7.665 -7.129 1.00 2.22 N ATOM 963 CA GLN A 68 23.829 8.373 -7.992 1.00 3.22 C ATOM 964 C GLN A 68 24.473 9.656 -8.496 1.00 13.50 C ATOM 965 O GLN A 68 24.025 10.254 -9.472 1.00 73.33 O ATOM 966 CB GLN A 68 22.522 8.680 -7.242 1.00 70.02 C ATOM 967 CG GLN A 68 22.726 9.424 -5.927 1.00 23.14 C ATOM 968 CD GLN A 68 21.426 9.846 -5.257 1.00 11.52 C ATOM 969 OE1 GLN A 68 20.375 9.058 -5.428 1.00 54.51 O flip ATOM 970 NE2 GLN A 68 21.372 10.868 -4.574 1.00 55.13 N flip ATOM 0 H GLN A 68 24.757 7.965 -6.154 1.00 2.22 H new ATOM 0 HA GLN A 68 23.580 7.737 -8.842 1.00 3.22 H new ATOM 0 HB2 GLN A 68 21.875 9.274 -7.888 1.00 70.02 H new ATOM 0 HB3 GLN A 68 22.001 7.744 -7.042 1.00 70.02 H new ATOM 0 HG2 GLN A 68 23.288 8.788 -5.243 1.00 23.14 H new ATOM 0 HG3 GLN A 68 23.334 10.310 -6.111 1.00 23.14 H new ATOM 0 HE21 GLN A 68 22.201 11.452 -4.464 1.00 55.13 H new ATOM 0 HE22 GLN A 68 20.498 11.131 -4.118 1.00 55.13 H new ATOM 979 N ASN A 69 25.545 10.053 -7.823 1.00 45.10 N ATOM 980 CA ASN A 69 26.326 11.227 -8.201 1.00 61.12 C ATOM 981 C ASN A 69 27.537 10.807 -9.026 1.00 41.24 C ATOM 982 O ASN A 69 28.395 11.623 -9.364 1.00 42.44 O ATOM 983 CB ASN A 69 26.745 12.010 -6.950 1.00 43.31 C ATOM 984 CG ASN A 69 25.656 12.957 -6.464 1.00 21.20 C ATOM 985 OD1 ASN A 69 25.629 14.134 -6.828 1.00 73.01 O ATOM 986 ND2 ASN A 69 24.740 12.448 -5.653 1.00 73.35 N ATOM 0 H ASN A 69 25.900 9.570 -6.998 1.00 45.10 H new ATOM 0 HA ASN A 69 25.711 11.884 -8.816 1.00 61.12 H new ATOM 0 HB2 ASN A 69 26.995 11.309 -6.153 1.00 43.31 H new ATOM 0 HB3 ASN A 69 27.648 12.581 -7.168 1.00 43.31 H new ATOM 0 HD21 ASN A 69 23.980 13.035 -5.309 1.00 73.35 H new ATOM 0 HD22 ASN A 69 24.794 11.469 -5.373 1.00 73.35 H new ATOM 993 N LYS A 70 27.589 9.512 -9.328 1.00 63.25 N ATOM 994 CA LYS A 70 28.565 8.931 -10.255 1.00 32.31 C ATOM 995 C LYS A 70 29.998 9.158 -9.770 1.00 12.34 C ATOM 996 O LYS A 70 30.951 9.097 -10.549 1.00 70.50 O ATOM 997 CB LYS A 70 28.389 9.503 -11.680 1.00 4.35 C ATOM 998 CG LYS A 70 26.935 9.710 -12.129 1.00 13.20 C ATOM 999 CD LYS A 70 26.004 8.583 -11.683 1.00 32.43 C ATOM 1000 CE LYS A 70 24.644 8.665 -12.378 1.00 4.32 C ATOM 1001 NZ LYS A 70 23.987 9.991 -12.190 1.00 52.12 N1+ ATOM 0 H LYS A 70 26.947 8.825 -8.932 1.00 63.25 H new ATOM 0 HA LYS A 70 28.381 7.857 -10.287 1.00 32.31 H new ATOM 0 HB2 LYS A 70 28.909 10.459 -11.737 1.00 4.35 H new ATOM 0 HB3 LYS A 70 28.878 8.832 -12.386 1.00 4.35 H new ATOM 0 HG2 LYS A 70 26.569 10.656 -11.729 1.00 13.20 H new ATOM 0 HG3 LYS A 70 26.904 9.790 -13.216 1.00 13.20 H new ATOM 0 HD2 LYS A 70 26.467 7.621 -11.901 1.00 32.43 H new ATOM 0 HD3 LYS A 70 25.864 8.632 -10.603 1.00 32.43 H new ATOM 0 HE2 LYS A 70 24.772 8.474 -13.443 1.00 4.32 H new ATOM 0 HE3 LYS A 70 23.993 7.882 -11.989 1.00 4.32 H new ATOM 0 HZ1 LYS A 70 22.969 9.905 -12.385 1.00 52.12 H new ATOM 0 HZ2 LYS A 70 24.126 10.311 -11.210 1.00 52.12 H new ATOM 0 HZ3 LYS A 70 24.408 10.683 -12.843 1.00 52.12 H new ATOM 1015 N GLN A 71 30.139 9.386 -8.475 1.00 41.25 N ATOM 1016 CA GLN A 71 31.436 9.673 -7.867 1.00 41.44 C ATOM 1017 C GLN A 71 31.854 8.552 -6.923 1.00 11.15 C ATOM 1018 O GLN A 71 31.056 7.668 -6.596 1.00 3.32 O ATOM 1019 CB GLN A 71 31.390 11.006 -7.108 1.00 65.11 C ATOM 1020 CG GLN A 71 30.193 11.128 -6.179 1.00 11.32 C ATOM 1021 CD GLN A 71 30.423 12.082 -5.026 1.00 14.24 C ATOM 1022 OE1 GLN A 71 30.822 11.530 -3.899 1.00 4.02 O flip ATOM 1023 NE2 GLN A 71 30.214 13.286 -5.139 1.00 60.02 N flip ATOM 0 H GLN A 71 29.363 9.378 -7.814 1.00 41.25 H new ATOM 0 HA GLN A 71 32.173 9.746 -8.667 1.00 41.44 H new ATOM 0 HB2 GLN A 71 32.305 11.117 -6.526 1.00 65.11 H new ATOM 0 HB3 GLN A 71 31.368 11.825 -7.827 1.00 65.11 H new ATOM 0 HG2 GLN A 71 29.330 11.465 -6.753 1.00 11.32 H new ATOM 0 HG3 GLN A 71 29.948 10.143 -5.783 1.00 11.32 H new ATOM 0 HE21 GLN A 71 29.906 13.668 -6.033 1.00 60.02 H new ATOM 0 HE22 GLN A 71 30.349 13.904 -4.339 1.00 60.02 H new ATOM 1032 N THR A 72 33.108 8.595 -6.491 1.00 0.13 N ATOM 1033 CA THR A 72 33.645 7.613 -5.555 1.00 33.54 C ATOM 1034 C THR A 72 34.210 8.304 -4.316 1.00 64.51 C ATOM 1035 O THR A 72 34.868 9.343 -4.418 1.00 2.32 O ATOM 1036 CB THR A 72 34.752 6.758 -6.211 1.00 55.21 C ATOM 1037 OG1 THR A 72 35.739 7.607 -6.821 1.00 1.42 O ATOM 1038 CG2 THR A 72 34.170 5.811 -7.256 1.00 71.13 C ATOM 0 H THR A 72 33.779 9.308 -6.777 1.00 0.13 H new ATOM 0 HA THR A 72 32.823 6.959 -5.264 1.00 33.54 H new ATOM 0 HB THR A 72 35.222 6.161 -5.430 1.00 55.21 H new ATOM 0 HG1 THR A 72 36.436 7.055 -7.232 1.00 1.42 H new ATOM 0 HG21 THR A 72 34.972 5.222 -7.701 1.00 71.13 H new ATOM 0 HG22 THR A 72 33.450 5.144 -6.782 1.00 71.13 H new ATOM 0 HG23 THR A 72 33.671 6.389 -8.033 1.00 71.13 H new ATOM 1046 N LEU A 73 33.936 7.730 -3.154 1.00 24.22 N ATOM 1047 CA LEU A 73 34.437 8.256 -1.887 1.00 2.33 C ATOM 1048 C LEU A 73 35.507 7.325 -1.313 1.00 44.11 C ATOM 1049 O LEU A 73 35.355 6.102 -1.365 1.00 52.40 O ATOM 1050 CB LEU A 73 33.275 8.423 -0.900 1.00 54.54 C ATOM 1051 CG LEU A 73 32.207 9.444 -1.325 1.00 53.14 C ATOM 1052 CD1 LEU A 73 31.012 9.402 -0.380 1.00 63.13 C ATOM 1053 CD2 LEU A 73 32.800 10.851 -1.390 1.00 44.41 C ATOM 0 H LEU A 73 33.364 6.891 -3.060 1.00 24.22 H new ATOM 0 HA LEU A 73 34.892 9.231 -2.058 1.00 2.33 H new ATOM 0 HB2 LEU A 73 32.795 7.455 -0.759 1.00 54.54 H new ATOM 0 HB3 LEU A 73 33.679 8.723 0.067 1.00 54.54 H new ATOM 0 HG LEU A 73 31.858 9.177 -2.322 1.00 53.14 H new ATOM 0 HD11 LEU A 73 30.269 10.133 -0.700 1.00 63.13 H new ATOM 0 HD12 LEU A 73 30.571 8.405 -0.395 1.00 63.13 H new ATOM 0 HD13 LEU A 73 31.340 9.638 0.632 1.00 63.13 H new ATOM 0 HD21 LEU A 73 32.027 11.558 -1.693 1.00 44.41 H new ATOM 0 HD22 LEU A 73 33.183 11.130 -0.408 1.00 44.41 H new ATOM 0 HD23 LEU A 73 33.613 10.870 -2.115 1.00 44.41 H new ATOM 1065 N PRO A 74 36.607 7.889 -0.772 1.00 14.33 N ATOM 1066 CA PRO A 74 37.717 7.097 -0.217 1.00 71.54 C ATOM 1067 C PRO A 74 37.262 6.160 0.904 1.00 22.35 C ATOM 1068 O PRO A 74 36.577 6.585 1.834 1.00 71.04 O ATOM 1069 CB PRO A 74 38.677 8.156 0.339 1.00 0.31 C ATOM 1070 CG PRO A 74 38.338 9.409 -0.395 1.00 75.32 C ATOM 1071 CD PRO A 74 36.858 9.338 -0.659 1.00 21.31 C ATOM 0 HA PRO A 74 38.164 6.450 -0.972 1.00 71.54 H new ATOM 0 HB2 PRO A 74 38.547 8.281 1.414 1.00 0.31 H new ATOM 0 HB3 PRO A 74 39.716 7.871 0.175 1.00 0.31 H new ATOM 0 HG2 PRO A 74 38.588 10.289 0.197 1.00 75.32 H new ATOM 0 HG3 PRO A 74 38.899 9.481 -1.327 1.00 75.32 H new ATOM 0 HD2 PRO A 74 36.282 9.785 0.152 1.00 21.31 H new ATOM 0 HD3 PRO A 74 36.586 9.867 -1.573 1.00 21.31 H new ATOM 1079 N ALA A 75 37.665 4.894 0.822 1.00 74.43 N ATOM 1080 CA ALA A 75 37.251 3.885 1.798 1.00 72.21 C ATOM 1081 C ALA A 75 38.026 4.008 3.107 1.00 34.41 C ATOM 1082 O ALA A 75 37.788 3.263 4.057 1.00 42.34 O ATOM 1083 CB ALA A 75 37.397 2.484 1.212 1.00 2.05 C ATOM 0 H ALA A 75 38.279 4.541 0.088 1.00 74.43 H new ATOM 0 HA ALA A 75 36.200 4.061 2.027 1.00 72.21 H new ATOM 0 HB1 ALA A 75 37.085 1.746 1.951 1.00 2.05 H new ATOM 0 HB2 ALA A 75 36.772 2.394 0.323 1.00 2.05 H new ATOM 0 HB3 ALA A 75 38.439 2.309 0.942 1.00 2.05 H new ATOM 1089 N ASP A 76 38.947 4.957 3.148 1.00 35.21 N ATOM 1090 CA ASP A 76 39.772 5.194 4.329 1.00 24.42 C ATOM 1091 C ASP A 76 39.076 6.155 5.296 1.00 33.35 C ATOM 1092 O ASP A 76 39.630 6.540 6.326 1.00 61.01 O ATOM 1093 CB ASP A 76 41.120 5.759 3.870 1.00 72.44 C ATOM 1094 CG ASP A 76 42.144 5.875 4.990 1.00 23.12 C ATOM 1095 OD1 ASP A 76 42.562 4.832 5.536 1.00 55.31 O ATOM 1096 OD2 ASP A 76 42.559 7.011 5.310 1.00 42.23 O1- ATOM 0 H ASP A 76 39.146 5.584 2.369 1.00 35.21 H new ATOM 0 HA ASP A 76 39.929 4.258 4.864 1.00 24.42 H new ATOM 0 HB2 ASP A 76 41.524 5.120 3.084 1.00 72.44 H new ATOM 0 HB3 ASP A 76 40.961 6.744 3.430 1.00 72.44 H new ATOM 1101 N THR A 77 37.842 6.514 4.964 1.00 11.55 N ATOM 1102 CA THR A 77 37.082 7.505 5.719 1.00 12.43 C ATOM 1103 C THR A 77 36.541 6.942 7.039 1.00 50.31 C ATOM 1104 O THR A 77 36.518 5.724 7.257 1.00 30.02 O ATOM 1105 CB THR A 77 35.914 8.052 4.867 1.00 41.10 C ATOM 1106 OG1 THR A 77 35.176 9.040 5.597 1.00 73.42 O ATOM 1107 CG2 THR A 77 34.971 6.932 4.432 1.00 73.22 C ATOM 0 H THR A 77 37.340 6.127 4.165 1.00 11.55 H new ATOM 0 HA THR A 77 37.770 8.315 5.962 1.00 12.43 H new ATOM 0 HB THR A 77 36.346 8.508 3.977 1.00 41.10 H new ATOM 0 HG1 THR A 77 35.793 9.712 5.953 1.00 73.42 H new ATOM 0 HG21 THR A 77 34.161 7.350 3.835 1.00 73.22 H new ATOM 0 HG22 THR A 77 35.522 6.203 3.837 1.00 73.22 H new ATOM 0 HG23 THR A 77 34.557 6.442 5.313 1.00 73.22 H new ATOM 1115 N THR A 78 36.108 7.849 7.916 1.00 13.54 N ATOM 1116 CA THR A 78 35.561 7.499 9.221 1.00 2.03 C ATOM 1117 C THR A 78 34.686 8.649 9.733 1.00 41.21 C ATOM 1118 O THR A 78 34.944 9.813 9.426 1.00 33.42 O ATOM 1119 CB THR A 78 36.695 7.239 10.245 1.00 65.01 C ATOM 1120 OG1 THR A 78 37.649 6.314 9.702 1.00 41.13 O ATOM 1121 CG2 THR A 78 36.147 6.690 11.556 1.00 52.04 C ATOM 0 H THR A 78 36.129 8.853 7.736 1.00 13.54 H new ATOM 0 HA THR A 78 34.969 6.591 9.111 1.00 2.03 H new ATOM 0 HB THR A 78 37.181 8.193 10.448 1.00 65.01 H new ATOM 0 HG1 THR A 78 38.362 6.158 10.356 1.00 41.13 H new ATOM 0 HG21 THR A 78 36.969 6.519 12.251 1.00 52.04 H new ATOM 0 HG22 THR A 78 35.450 7.408 11.988 1.00 52.04 H new ATOM 0 HG23 THR A 78 35.629 5.749 11.368 1.00 52.04 H new ATOM 1129 N VAL A 79 33.664 8.326 10.512 1.00 13.33 N ATOM 1130 CA VAL A 79 32.785 9.338 11.103 1.00 51.35 C ATOM 1131 C VAL A 79 32.619 9.081 12.595 1.00 40.33 C ATOM 1132 O VAL A 79 32.266 7.984 13.004 1.00 15.54 O ATOM 1133 CB VAL A 79 31.386 9.358 10.432 1.00 73.54 C ATOM 1134 CG1 VAL A 79 30.437 10.309 11.166 1.00 32.33 C ATOM 1135 CG2 VAL A 79 31.498 9.754 8.965 1.00 4.51 C ATOM 0 H VAL A 79 33.418 7.366 10.754 1.00 13.33 H new ATOM 0 HA VAL A 79 33.255 10.308 10.938 1.00 51.35 H new ATOM 0 HB VAL A 79 30.974 8.351 10.491 1.00 73.54 H new ATOM 0 HG11 VAL A 79 29.464 10.303 10.674 1.00 32.33 H new ATOM 0 HG12 VAL A 79 30.323 9.983 12.200 1.00 32.33 H new ATOM 0 HG13 VAL A 79 30.847 11.319 11.147 1.00 32.33 H new ATOM 0 HG21 VAL A 79 30.506 9.762 8.513 1.00 4.51 H new ATOM 0 HG22 VAL A 79 31.939 10.748 8.889 1.00 4.51 H new ATOM 0 HG23 VAL A 79 32.129 9.036 8.441 1.00 4.51 H new ATOM 1145 N THR A 80 32.886 10.089 13.408 1.00 3.21 N ATOM 1146 CA THR A 80 32.741 9.956 14.852 1.00 52.54 C ATOM 1147 C THR A 80 31.520 10.729 15.345 1.00 43.34 C ATOM 1148 O THR A 80 31.499 11.962 15.321 1.00 4.30 O ATOM 1149 CB THR A 80 34.006 10.443 15.592 1.00 61.00 C ATOM 1150 OG1 THR A 80 35.160 9.785 15.050 1.00 41.24 O ATOM 1151 CG2 THR A 80 33.912 10.157 17.088 1.00 20.33 C ATOM 0 H THR A 80 33.204 11.007 13.096 1.00 3.21 H new ATOM 0 HA THR A 80 32.603 8.897 15.071 1.00 52.54 H new ATOM 0 HB THR A 80 34.092 11.521 15.454 1.00 61.00 H new ATOM 0 HG1 THR A 80 35.963 10.095 15.518 1.00 41.24 H new ATOM 0 HG21 THR A 80 34.816 10.510 17.584 1.00 20.33 H new ATOM 0 HG22 THR A 80 33.046 10.672 17.503 1.00 20.33 H new ATOM 0 HG23 THR A 80 33.807 9.084 17.247 1.00 20.33 H new ATOM 1159 N ALA A 81 30.500 9.995 15.776 1.00 63.21 N ATOM 1160 CA ALA A 81 29.288 10.590 16.317 1.00 75.00 C ATOM 1161 C ALA A 81 29.397 10.696 17.831 1.00 14.40 C ATOM 1162 O ALA A 81 29.305 9.695 18.544 1.00 73.21 O ATOM 1163 CB ALA A 81 28.071 9.756 15.930 1.00 42.42 C ATOM 0 H ALA A 81 30.492 8.975 15.760 1.00 63.21 H new ATOM 0 HA ALA A 81 29.167 11.590 15.900 1.00 75.00 H new ATOM 0 HB1 ALA A 81 27.171 10.213 16.342 1.00 42.42 H new ATOM 0 HB2 ALA A 81 27.991 9.711 14.844 1.00 42.42 H new ATOM 0 HB3 ALA A 81 28.180 8.747 16.328 1.00 42.42 H new ATOM 1169 N GLU A 82 29.628 11.907 18.316 1.00 71.31 N ATOM 1170 CA GLU A 82 29.726 12.146 19.750 1.00 72.51 C ATOM 1171 C GLU A 82 28.410 12.738 20.249 1.00 53.13 C ATOM 1172 O GLU A 82 28.088 13.892 19.966 1.00 25.01 O ATOM 1173 CB GLU A 82 30.909 13.082 20.048 1.00 74.00 C ATOM 1174 CG GLU A 82 31.226 13.225 21.532 1.00 3.23 C ATOM 1175 CD GLU A 82 32.517 13.989 21.785 1.00 23.22 C ATOM 1176 OE1 GLU A 82 33.602 13.374 21.701 1.00 3.55 O ATOM 1177 OE2 GLU A 82 32.461 15.203 22.059 1.00 51.44 O1- ATOM 0 H GLU A 82 29.751 12.739 17.739 1.00 71.31 H new ATOM 0 HA GLU A 82 29.906 11.207 20.273 1.00 72.51 H new ATOM 0 HB2 GLU A 82 31.794 12.709 19.532 1.00 74.00 H new ATOM 0 HB3 GLU A 82 30.692 14.068 19.636 1.00 74.00 H new ATOM 0 HG2 GLU A 82 30.402 13.738 22.028 1.00 3.23 H new ATOM 0 HG3 GLU A 82 31.301 12.234 21.981 1.00 3.23 H new ATOM 1184 N VAL A 83 27.650 11.931 20.982 1.00 31.40 N ATOM 1185 CA VAL A 83 26.306 12.311 21.408 1.00 74.25 C ATOM 1186 C VAL A 83 26.287 12.649 22.897 1.00 12.15 C ATOM 1187 O VAL A 83 26.950 11.997 23.700 1.00 3.30 O ATOM 1188 CB VAL A 83 25.283 11.182 21.115 1.00 22.15 C ATOM 1189 CG1 VAL A 83 25.670 9.886 21.830 1.00 60.03 C ATOM 1190 CG2 VAL A 83 23.866 11.614 21.497 1.00 42.03 C ATOM 0 H VAL A 83 27.943 11.005 21.295 1.00 31.40 H new ATOM 0 HA VAL A 83 26.019 13.195 20.838 1.00 74.25 H new ATOM 0 HB VAL A 83 25.299 10.989 20.042 1.00 22.15 H new ATOM 0 HG11 VAL A 83 24.935 9.113 21.606 1.00 60.03 H new ATOM 0 HG12 VAL A 83 26.653 9.562 21.488 1.00 60.03 H new ATOM 0 HG13 VAL A 83 25.698 10.059 22.906 1.00 60.03 H new ATOM 0 HG21 VAL A 83 23.168 10.805 21.282 1.00 42.03 H new ATOM 0 HG22 VAL A 83 23.832 11.849 22.561 1.00 42.03 H new ATOM 0 HG23 VAL A 83 23.587 12.496 20.921 1.00 42.03 H new ATOM 1200 N GLY A 84 25.531 13.677 23.250 1.00 33.12 N ATOM 1201 CA GLY A 84 25.413 14.091 24.627 1.00 23.12 C ATOM 1202 C GLY A 84 24.031 14.611 24.945 1.00 64.22 C ATOM 1203 O GLY A 84 23.211 14.815 24.047 1.00 21.33 O ATOM 0 H GLY A 84 24.990 14.239 22.593 1.00 33.12 H new ATOM 0 HA2 GLY A 84 25.643 13.249 25.280 1.00 23.12 H new ATOM 0 HA3 GLY A 84 26.149 14.867 24.837 1.00 23.12 H new ATOM 1207 N ILE A 85 23.786 14.835 26.222 1.00 23.52 N ATOM 1208 CA ILE A 85 22.497 15.296 26.707 1.00 1.40 C ATOM 1209 C ILE A 85 22.696 16.210 27.908 1.00 61.15 C ATOM 1210 O ILE A 85 23.554 15.954 28.766 1.00 10.52 O ATOM 1211 CB ILE A 85 21.577 14.091 27.075 1.00 52.02 C ATOM 1212 CG1 ILE A 85 20.205 14.552 27.628 1.00 53.33 C ATOM 1213 CG2 ILE A 85 22.280 13.166 28.071 1.00 35.55 C ATOM 1214 CD1 ILE A 85 20.173 14.772 29.129 1.00 71.32 C ATOM 0 H ILE A 85 24.480 14.702 26.958 1.00 23.52 H new ATOM 0 HA ILE A 85 22.005 15.858 25.913 1.00 1.40 H new ATOM 0 HB ILE A 85 21.382 13.537 26.157 1.00 52.02 H new ATOM 0 HG12 ILE A 85 19.921 15.480 27.131 1.00 53.33 H new ATOM 0 HG13 ILE A 85 19.453 13.807 27.367 1.00 53.33 H new ATOM 0 HG21 ILE A 85 21.624 12.331 28.317 1.00 35.55 H new ATOM 0 HG22 ILE A 85 23.201 12.786 27.628 1.00 35.55 H new ATOM 0 HG23 ILE A 85 22.516 13.721 28.979 1.00 35.55 H new ATOM 0 HD11 ILE A 85 19.175 15.093 29.429 1.00 71.32 H new ATOM 0 HD12 ILE A 85 20.423 13.841 29.639 1.00 71.32 H new ATOM 0 HD13 ILE A 85 20.898 15.540 29.400 1.00 71.32 H new ATOM 1226 N GLY A 86 21.902 17.276 27.948 1.00 43.44 N ATOM 1227 CA GLY A 86 21.971 18.261 29.016 1.00 64.20 C ATOM 1228 C GLY A 86 20.612 18.890 29.261 1.00 43.21 C ATOM 1229 O GLY A 86 19.691 18.669 28.476 1.00 31.32 O ATOM 0 H GLY A 86 21.195 17.479 27.241 1.00 43.44 H new ATOM 0 HA2 GLY A 86 22.327 17.787 29.931 1.00 64.20 H new ATOM 0 HA3 GLY A 86 22.693 19.035 28.756 1.00 64.20 H new ATOM 1233 N PRO A 87 20.444 19.668 30.343 1.00 20.43 N ATOM 1234 CA PRO A 87 19.149 20.252 30.695 1.00 73.43 C ATOM 1235 C PRO A 87 18.767 21.405 29.765 1.00 33.24 C ATOM 1236 O PRO A 87 19.618 22.195 29.347 1.00 11.41 O ATOM 1237 CB PRO A 87 19.365 20.749 32.129 1.00 75.13 C ATOM 1238 CG PRO A 87 20.822 21.057 32.203 1.00 24.22 C ATOM 1239 CD PRO A 87 21.507 20.077 31.281 1.00 44.21 C ATOM 0 HA PRO A 87 18.332 19.537 30.603 1.00 73.43 H new ATOM 0 HB2 PRO A 87 18.762 21.632 32.338 1.00 75.13 H new ATOM 0 HB3 PRO A 87 19.082 19.990 32.859 1.00 75.13 H new ATOM 0 HG2 PRO A 87 21.019 22.084 31.895 1.00 24.22 H new ATOM 0 HG3 PRO A 87 21.190 20.954 33.224 1.00 24.22 H new ATOM 0 HD2 PRO A 87 22.345 20.539 30.758 1.00 44.21 H new ATOM 0 HD3 PRO A 87 21.905 19.224 31.830 1.00 44.21 H new ATOM 1247 N ASN A 88 17.483 21.485 29.440 1.00 50.13 N ATOM 1248 CA ASN A 88 16.954 22.547 28.586 1.00 62.23 C ATOM 1249 C ASN A 88 16.323 23.628 29.461 1.00 31.22 C ATOM 1250 O ASN A 88 15.750 23.319 30.507 1.00 11.01 O ATOM 1251 CB ASN A 88 15.915 21.959 27.610 1.00 63.43 C ATOM 1252 CG ASN A 88 15.421 22.949 26.558 1.00 21.32 C ATOM 1253 OD1 ASN A 88 15.351 24.154 26.792 1.00 63.22 O ATOM 1254 ND2 ASN A 88 15.067 22.439 25.385 1.00 22.41 N ATOM 0 H ASN A 88 16.779 20.819 29.758 1.00 50.13 H new ATOM 0 HA ASN A 88 17.760 22.992 28.003 1.00 62.23 H new ATOM 0 HB2 ASN A 88 16.352 21.097 27.106 1.00 63.43 H new ATOM 0 HB3 ASN A 88 15.061 21.595 28.181 1.00 63.43 H new ATOM 0 HD21 ASN A 88 14.725 23.052 24.645 1.00 22.41 H new ATOM 0 HD22 ASN A 88 15.137 21.434 25.224 1.00 22.41 H new ATOM 1261 N GLU A 89 16.422 24.886 29.030 1.00 43.32 N ATOM 1262 CA GLU A 89 15.885 26.014 29.798 1.00 2.23 C ATOM 1263 C GLU A 89 14.361 25.925 29.925 1.00 10.40 C ATOM 1264 O GLU A 89 13.754 26.603 30.758 1.00 74.31 O ATOM 1265 CB GLU A 89 16.288 27.349 29.156 1.00 13.04 C ATOM 1266 CG GLU A 89 15.874 27.487 27.694 1.00 64.14 C ATOM 1267 CD GLU A 89 16.187 28.862 27.123 1.00 35.31 C ATOM 1268 OE1 GLU A 89 15.260 29.695 27.022 1.00 70.11 O ATOM 1269 OE2 GLU A 89 17.358 29.119 26.777 1.00 74.23 O1- ATOM 0 H GLU A 89 16.869 25.151 28.153 1.00 43.32 H new ATOM 0 HA GLU A 89 16.312 25.965 30.800 1.00 2.23 H new ATOM 0 HB2 GLU A 89 15.843 28.164 29.727 1.00 13.04 H new ATOM 0 HB3 GLU A 89 17.370 27.463 29.229 1.00 13.04 H new ATOM 0 HG2 GLU A 89 16.385 26.727 27.103 1.00 64.14 H new ATOM 0 HG3 GLU A 89 14.805 27.295 27.604 1.00 64.14 H new ATOM 1276 N GLU A 90 13.752 25.086 29.091 1.00 62.24 N ATOM 1277 CA GLU A 90 12.321 24.805 29.174 1.00 33.11 C ATOM 1278 C GLU A 90 12.009 24.045 30.467 1.00 41.22 C ATOM 1279 O GLU A 90 10.901 24.122 31.003 1.00 23.51 O ATOM 1280 CB GLU A 90 11.880 23.973 27.959 1.00 62.35 C ATOM 1281 CG GLU A 90 10.438 23.490 28.040 1.00 2.12 C ATOM 1282 CD GLU A 90 10.060 22.561 26.901 1.00 32.41 C ATOM 1283 OE1 GLU A 90 10.216 21.331 27.051 1.00 34.55 O ATOM 1284 OE2 GLU A 90 9.594 23.057 25.852 1.00 15.02 O1- ATOM 0 H GLU A 90 14.232 24.585 28.344 1.00 62.24 H new ATOM 0 HA GLU A 90 11.775 25.748 29.178 1.00 33.11 H new ATOM 0 HB2 GLU A 90 12.004 24.571 27.056 1.00 62.35 H new ATOM 0 HB3 GLU A 90 12.538 23.110 27.862 1.00 62.35 H new ATOM 0 HG2 GLU A 90 10.286 22.974 28.988 1.00 2.12 H new ATOM 0 HG3 GLU A 90 9.771 24.352 28.035 1.00 2.12 H new ATOM 1291 N GLY A 91 13.016 23.345 30.976 1.00 4.53 N ATOM 1292 CA GLY A 91 12.846 22.508 32.149 1.00 50.31 C ATOM 1293 C GLY A 91 12.785 21.040 31.784 1.00 52.42 C ATOM 1294 O GLY A 91 12.183 20.234 32.496 1.00 50.31 O ATOM 0 H GLY A 91 13.960 23.343 30.590 1.00 4.53 H new ATOM 0 HA2 GLY A 91 13.672 22.677 32.840 1.00 50.31 H new ATOM 0 HA3 GLY A 91 11.931 22.792 32.670 1.00 50.31 H new ATOM 1298 N GLY A 92 13.411 20.696 30.663 1.00 31.10 N ATOM 1299 CA GLY A 92 13.469 19.316 30.222 1.00 44.24 C ATOM 1300 C GLY A 92 14.875 18.929 29.820 1.00 74.12 C ATOM 1301 O GLY A 92 15.842 19.351 30.458 1.00 42.22 O ATOM 0 H GLY A 92 13.884 21.357 30.047 1.00 31.10 H new ATOM 0 HA2 GLY A 92 13.123 18.661 31.022 1.00 44.24 H new ATOM 0 HA3 GLY A 92 12.794 19.172 29.378 1.00 44.24 H new ATOM 1305 N PHE A 93 14.999 18.150 28.755 1.00 65.13 N ATOM 1306 CA PHE A 93 16.304 17.709 28.274 1.00 72.25 C ATOM 1307 C PHE A 93 16.547 18.206 26.856 1.00 30.35 C ATOM 1308 O PHE A 93 15.606 18.450 26.098 1.00 35.35 O ATOM 1309 CB PHE A 93 16.418 16.180 28.330 1.00 70.53 C ATOM 1310 CG PHE A 93 16.372 15.627 29.734 1.00 33.33 C ATOM 1311 CD1 PHE A 93 15.413 14.694 30.103 1.00 41.34 C ATOM 1312 CD2 PHE A 93 17.295 16.044 30.686 1.00 64.21 C ATOM 1313 CE1 PHE A 93 15.376 14.189 31.387 1.00 2.11 C ATOM 1314 CE2 PHE A 93 17.259 15.542 31.974 1.00 3.04 C ATOM 1315 CZ PHE A 93 16.300 14.613 32.324 1.00 12.34 C ATOM 0 H PHE A 93 14.211 17.809 28.205 1.00 65.13 H new ATOM 0 HA PHE A 93 17.067 18.134 28.927 1.00 72.25 H new ATOM 0 HB2 PHE A 93 15.608 15.741 27.748 1.00 70.53 H new ATOM 0 HB3 PHE A 93 17.352 15.875 27.858 1.00 70.53 H new ATOM 0 HD1 PHE A 93 14.687 14.359 29.377 1.00 41.34 H new ATOM 0 HD2 PHE A 93 18.049 16.769 30.417 1.00 64.21 H new ATOM 0 HE1 PHE A 93 14.625 13.462 31.660 1.00 2.11 H new ATOM 0 HE2 PHE A 93 17.980 15.876 32.705 1.00 3.04 H new ATOM 0 HZ PHE A 93 16.271 14.218 33.329 1.00 12.34 H new ATOM 1325 N ALA A 94 17.814 18.354 26.515 1.00 73.43 N ATOM 1326 CA ALA A 94 18.226 18.828 25.208 1.00 60.33 C ATOM 1327 C ALA A 94 19.402 17.993 24.721 1.00 65.32 C ATOM 1328 O ALA A 94 20.356 17.758 25.469 1.00 32.10 O ATOM 1329 CB ALA A 94 18.587 20.308 25.278 1.00 64.21 C ATOM 0 H ALA A 94 18.591 18.147 27.142 1.00 73.43 H new ATOM 0 HA ALA A 94 17.406 18.720 24.498 1.00 60.33 H new ATOM 0 HB1 ALA A 94 18.895 20.654 24.292 1.00 64.21 H new ATOM 0 HB2 ALA A 94 17.719 20.879 25.608 1.00 64.21 H new ATOM 0 HB3 ALA A 94 19.405 20.450 25.984 1.00 64.21 H new ATOM 1335 N LEU A 95 19.312 17.517 23.485 1.00 31.23 N ATOM 1336 CA LEU A 95 20.314 16.614 22.928 1.00 75.45 C ATOM 1337 C LEU A 95 21.357 17.375 22.116 1.00 41.42 C ATOM 1338 O LEU A 95 21.023 18.217 21.278 1.00 2.34 O ATOM 1339 CB LEU A 95 19.644 15.530 22.064 1.00 51.22 C ATOM 1340 CG LEU A 95 19.068 14.327 22.838 1.00 42.15 C ATOM 1341 CD1 LEU A 95 20.190 13.494 23.456 1.00 64.34 C ATOM 1342 CD2 LEU A 95 18.088 14.787 23.918 1.00 71.23 C ATOM 0 H LEU A 95 18.550 17.743 22.845 1.00 31.23 H new ATOM 0 HA LEU A 95 20.826 16.131 23.760 1.00 75.45 H new ATOM 0 HB2 LEU A 95 18.839 15.992 21.493 1.00 51.22 H new ATOM 0 HB3 LEU A 95 20.374 15.161 21.344 1.00 51.22 H new ATOM 0 HG LEU A 95 18.524 13.703 22.129 1.00 42.15 H new ATOM 0 HD11 LEU A 95 19.761 12.651 23.997 1.00 64.34 H new ATOM 0 HD12 LEU A 95 20.845 13.124 22.667 1.00 64.34 H new ATOM 0 HD13 LEU A 95 20.765 14.113 24.145 1.00 64.34 H new ATOM 0 HD21 LEU A 95 17.697 13.919 24.448 1.00 71.23 H new ATOM 0 HD22 LEU A 95 18.603 15.441 24.622 1.00 71.23 H new ATOM 0 HD23 LEU A 95 17.264 15.330 23.455 1.00 71.23 H new ATOM 1354 N ASP A 96 22.615 17.061 22.384 1.00 51.32 N ATOM 1355 CA ASP A 96 23.754 17.661 21.695 1.00 15.24 C ATOM 1356 C ASP A 96 24.490 16.576 20.931 1.00 33.43 C ATOM 1357 O ASP A 96 25.113 15.707 21.534 1.00 1.11 O ATOM 1358 CB ASP A 96 24.702 18.278 22.724 1.00 62.10 C ATOM 1359 CG ASP A 96 25.874 19.038 22.117 1.00 42.14 C ATOM 1360 OD1 ASP A 96 26.880 18.395 21.741 1.00 0.44 O ATOM 1361 OD2 ASP A 96 25.816 20.282 22.043 1.00 11.32 O1- ATOM 0 H ASP A 96 22.880 16.376 23.092 1.00 51.32 H new ATOM 0 HA ASP A 96 23.406 18.434 21.009 1.00 15.24 H new ATOM 0 HB2 ASP A 96 24.136 18.956 23.362 1.00 62.10 H new ATOM 0 HB3 ASP A 96 25.090 17.486 23.365 1.00 62.10 H new ATOM 1366 N VAL A 97 24.418 16.612 19.615 1.00 3.45 N ATOM 1367 CA VAL A 97 25.059 15.580 18.801 1.00 33.41 C ATOM 1368 C VAL A 97 26.089 16.198 17.870 1.00 35.23 C ATOM 1369 O VAL A 97 25.742 16.900 16.931 1.00 5.33 O ATOM 1370 CB VAL A 97 24.025 14.782 17.966 1.00 12.11 C ATOM 1371 CG1 VAL A 97 24.706 13.656 17.187 1.00 31.40 C ATOM 1372 CG2 VAL A 97 22.914 14.228 18.861 1.00 41.42 C ATOM 0 H VAL A 97 23.929 17.333 19.085 1.00 3.45 H new ATOM 0 HA VAL A 97 25.552 14.891 19.487 1.00 33.41 H new ATOM 0 HB VAL A 97 23.573 15.465 17.247 1.00 12.11 H new ATOM 0 HG11 VAL A 97 23.960 13.111 16.609 1.00 31.40 H new ATOM 0 HG12 VAL A 97 25.450 14.079 16.512 1.00 31.40 H new ATOM 0 HG13 VAL A 97 25.194 12.975 17.884 1.00 31.40 H new ATOM 0 HG21 VAL A 97 22.200 13.672 18.253 1.00 41.42 H new ATOM 0 HG22 VAL A 97 23.347 13.565 19.610 1.00 41.42 H new ATOM 0 HG23 VAL A 97 22.402 15.052 19.358 1.00 41.42 H new ATOM 1382 N GLU A 98 27.357 15.930 18.132 1.00 23.12 N ATOM 1383 CA GLU A 98 28.442 16.432 17.300 1.00 44.32 C ATOM 1384 C GLU A 98 28.883 15.349 16.321 1.00 21.31 C ATOM 1385 O GLU A 98 29.498 14.356 16.717 1.00 34.12 O ATOM 1386 CB GLU A 98 29.616 16.882 18.178 1.00 13.10 C ATOM 1387 CG GLU A 98 29.246 17.985 19.166 1.00 35.31 C ATOM 1388 CD GLU A 98 30.416 18.425 20.026 1.00 11.53 C ATOM 1389 OE1 GLU A 98 31.298 19.144 19.511 1.00 51.52 O ATOM 1390 OE2 GLU A 98 30.454 18.069 21.225 1.00 21.24 O1- ATOM 0 H GLU A 98 27.664 15.362 18.922 1.00 23.12 H new ATOM 0 HA GLU A 98 28.091 17.294 16.732 1.00 44.32 H new ATOM 0 HB2 GLU A 98 29.997 16.023 18.730 1.00 13.10 H new ATOM 0 HB3 GLU A 98 30.425 17.234 17.538 1.00 13.10 H new ATOM 0 HG2 GLU A 98 28.862 18.844 18.616 1.00 35.31 H new ATOM 0 HG3 GLU A 98 28.440 17.633 19.810 1.00 35.31 H new ATOM 1397 N LEU A 99 28.545 15.530 15.046 1.00 4.53 N ATOM 1398 CA LEU A 99 28.850 14.534 14.027 1.00 32.31 C ATOM 1399 C LEU A 99 30.130 14.927 13.293 1.00 52.01 C ATOM 1400 O LEU A 99 30.146 15.896 12.527 1.00 21.43 O ATOM 1401 CB LEU A 99 27.674 14.397 13.041 1.00 42.25 C ATOM 1402 CG LEU A 99 27.649 13.086 12.236 1.00 64.41 C ATOM 1403 CD1 LEU A 99 27.470 11.889 13.170 1.00 73.33 C ATOM 1404 CD2 LEU A 99 26.544 13.118 11.183 1.00 23.33 C ATOM 0 H LEU A 99 28.061 16.357 14.696 1.00 4.53 H new ATOM 0 HA LEU A 99 29.003 13.567 14.505 1.00 32.31 H new ATOM 0 HB2 LEU A 99 26.741 14.481 13.598 1.00 42.25 H new ATOM 0 HB3 LEU A 99 27.705 15.234 12.343 1.00 42.25 H new ATOM 0 HG LEU A 99 28.604 12.982 11.721 1.00 64.41 H new ATOM 0 HD11 LEU A 99 27.454 10.970 12.584 1.00 73.33 H new ATOM 0 HD12 LEU A 99 28.297 11.854 13.879 1.00 73.33 H new ATOM 0 HD13 LEU A 99 26.530 11.989 13.714 1.00 73.33 H new ATOM 0 HD21 LEU A 99 26.545 12.181 10.626 1.00 23.33 H new ATOM 0 HD22 LEU A 99 25.579 13.248 11.672 1.00 23.33 H new ATOM 0 HD23 LEU A 99 26.718 13.948 10.498 1.00 23.33 H new ATOM 1416 N ARG A 100 31.203 14.180 13.548 1.00 15.15 N ATOM 1417 CA ARG A 100 32.523 14.486 13.001 1.00 11.05 C ATOM 1418 C ARG A 100 32.811 13.618 11.781 1.00 44.33 C ATOM 1419 O ARG A 100 32.984 12.405 11.900 1.00 60.34 O ATOM 1420 CB ARG A 100 33.595 14.270 14.081 1.00 62.13 C ATOM 1421 CG ARG A 100 33.383 15.148 15.308 1.00 11.51 C ATOM 1422 CD ARG A 100 34.379 14.855 16.418 1.00 61.51 C ATOM 1423 NE ARG A 100 34.159 15.740 17.568 1.00 42.53 N ATOM 1424 CZ ARG A 100 34.104 15.334 18.838 1.00 32.53 C ATOM 1425 NH1 ARG A 100 34.460 14.099 19.169 1.00 73.43 N1+ ATOM 1426 NH2 ARG A 100 33.745 16.189 19.788 1.00 1.52 N ATOM 0 H ARG A 100 31.182 13.348 14.138 1.00 15.15 H new ATOM 0 HA ARG A 100 32.542 15.530 12.687 1.00 11.05 H new ATOM 0 HB2 ARG A 100 33.593 13.223 14.384 1.00 62.13 H new ATOM 0 HB3 ARG A 100 34.578 14.477 13.657 1.00 62.13 H new ATOM 0 HG2 ARG A 100 33.465 16.196 15.019 1.00 11.51 H new ATOM 0 HG3 ARG A 100 32.371 15.000 15.685 1.00 11.51 H new ATOM 0 HD2 ARG A 100 34.285 13.815 16.731 1.00 61.51 H new ATOM 0 HD3 ARG A 100 35.395 14.984 16.044 1.00 61.51 H new ATOM 0 HE ARG A 100 34.040 16.736 17.383 1.00 42.53 H new ATOM 0 HH11 ARG A 100 34.779 13.450 18.450 1.00 73.43 H new ATOM 0 HH12 ARG A 100 34.414 13.799 20.143 1.00 73.43 H new ATOM 0 HH21 ARG A 100 33.512 17.152 19.546 1.00 1.52 H new ATOM 0 HH22 ARG A 100 33.702 15.883 20.760 1.00 1.52 H new ATOM 1440 N VAL A 101 32.867 14.247 10.613 1.00 42.14 N ATOM 1441 CA VAL A 101 33.017 13.530 9.350 1.00 72.23 C ATOM 1442 C VAL A 101 34.454 13.605 8.854 1.00 42.25 C ATOM 1443 O VAL A 101 34.864 14.618 8.291 1.00 41.22 O ATOM 1444 CB VAL A 101 32.087 14.122 8.265 1.00 14.41 C ATOM 1445 CG1 VAL A 101 32.158 13.306 6.973 1.00 25.41 C ATOM 1446 CG2 VAL A 101 30.649 14.217 8.776 1.00 42.30 C ATOM 0 H VAL A 101 32.810 15.261 10.513 1.00 42.14 H new ATOM 0 HA VAL A 101 32.746 12.490 9.533 1.00 72.23 H new ATOM 0 HB VAL A 101 32.433 15.131 8.039 1.00 14.41 H new ATOM 0 HG11 VAL A 101 31.494 13.745 6.228 1.00 25.41 H new ATOM 0 HG12 VAL A 101 33.181 13.311 6.595 1.00 25.41 H new ATOM 0 HG13 VAL A 101 31.850 12.280 7.173 1.00 25.41 H new ATOM 0 HG21 VAL A 101 30.013 14.636 7.996 1.00 42.30 H new ATOM 0 HG22 VAL A 101 30.291 13.222 9.041 1.00 42.30 H new ATOM 0 HG23 VAL A 101 30.617 14.861 9.655 1.00 42.30 H new ATOM 1456 N ALA A 102 35.223 12.546 9.067 1.00 43.12 N ATOM 1457 CA ALA A 102 36.602 12.507 8.604 1.00 40.03 C ATOM 1458 C ALA A 102 36.677 11.873 7.221 1.00 12.52 C ATOM 1459 O ALA A 102 36.623 10.649 7.087 1.00 73.10 O ATOM 1460 CB ALA A 102 37.476 11.743 9.593 1.00 44.05 C ATOM 0 H ALA A 102 34.916 11.705 9.556 1.00 43.12 H new ATOM 0 HA ALA A 102 36.975 13.529 8.537 1.00 40.03 H new ATOM 0 HB1 ALA A 102 38.504 11.724 9.231 1.00 44.05 H new ATOM 0 HB2 ALA A 102 37.443 12.236 10.564 1.00 44.05 H new ATOM 0 HB3 ALA A 102 37.107 10.722 9.692 1.00 44.05 H new ATOM 1466 N LEU A 103 36.804 12.706 6.195 1.00 73.31 N ATOM 1467 CA LEU A 103 36.919 12.224 4.823 1.00 63.24 C ATOM 1468 C LEU A 103 38.299 12.596 4.279 1.00 11.33 C ATOM 1469 O LEU A 103 38.627 13.775 4.151 1.00 24.41 O ATOM 1470 CB LEU A 103 35.795 12.805 3.941 1.00 41.13 C ATOM 1471 CG LEU A 103 35.630 12.144 2.551 1.00 32.24 C ATOM 1472 CD1 LEU A 103 35.314 10.658 2.685 1.00 55.32 C ATOM 1473 CD2 LEU A 103 34.537 12.839 1.737 1.00 41.41 C ATOM 0 H LEU A 103 36.830 13.721 6.287 1.00 73.31 H new ATOM 0 HA LEU A 103 36.811 11.139 4.808 1.00 63.24 H new ATOM 0 HB2 LEU A 103 34.852 12.717 4.480 1.00 41.13 H new ATOM 0 HB3 LEU A 103 35.982 13.869 3.798 1.00 41.13 H new ATOM 0 HG LEU A 103 36.578 12.252 2.023 1.00 32.24 H new ATOM 0 HD11 LEU A 103 35.203 10.219 1.694 1.00 55.32 H new ATOM 0 HD12 LEU A 103 36.126 10.160 3.214 1.00 55.32 H new ATOM 0 HD13 LEU A 103 34.386 10.532 3.243 1.00 55.32 H new ATOM 0 HD21 LEU A 103 34.443 12.354 0.765 1.00 41.41 H new ATOM 0 HD22 LEU A 103 33.588 12.772 2.270 1.00 41.41 H new ATOM 0 HD23 LEU A 103 34.800 13.887 1.595 1.00 41.41 H new ATOM 1485 N PRO A 104 39.132 11.587 3.980 1.00 73.52 N ATOM 1486 CA PRO A 104 40.529 11.795 3.598 1.00 62.42 C ATOM 1487 C PRO A 104 40.685 12.393 2.200 1.00 45.15 C ATOM 1488 O PRO A 104 39.867 12.151 1.308 1.00 0.45 O ATOM 1489 CB PRO A 104 41.124 10.386 3.666 1.00 24.31 C ATOM 1490 CG PRO A 104 39.977 9.473 3.410 1.00 63.40 C ATOM 1491 CD PRO A 104 38.765 10.161 3.977 1.00 45.41 C ATOM 0 HA PRO A 104 41.026 12.513 4.250 1.00 62.42 H new ATOM 0 HB2 PRO A 104 41.909 10.252 2.922 1.00 24.31 H new ATOM 0 HB3 PRO A 104 41.573 10.193 4.641 1.00 24.31 H new ATOM 0 HG2 PRO A 104 39.857 9.287 2.343 1.00 63.40 H new ATOM 0 HG3 PRO A 104 40.135 8.505 3.886 1.00 63.40 H new ATOM 0 HD2 PRO A 104 37.881 9.978 3.367 1.00 45.41 H new ATOM 0 HD3 PRO A 104 38.538 9.805 4.982 1.00 45.41 H new ATOM 1499 N GLY A 105 41.751 13.169 2.027 1.00 54.45 N ATOM 1500 CA GLY A 105 42.021 13.821 0.753 1.00 13.33 C ATOM 1501 C GLY A 105 41.039 14.938 0.445 1.00 43.42 C ATOM 1502 O GLY A 105 40.959 15.408 -0.691 1.00 1.41 O ATOM 0 H GLY A 105 42.441 13.361 2.754 1.00 54.45 H new ATOM 0 HA2 GLY A 105 43.033 14.226 0.764 1.00 13.33 H new ATOM 0 HA3 GLY A 105 41.983 13.079 -0.045 1.00 13.33 H new ATOM 1506 N LEU A 106 40.303 15.371 1.463 1.00 4.51 N ATOM 1507 CA LEU A 106 39.260 16.382 1.310 1.00 40.14 C ATOM 1508 C LEU A 106 39.580 17.619 2.155 1.00 43.11 C ATOM 1509 O LEU A 106 40.114 17.501 3.259 1.00 42.33 O ATOM 1510 CB LEU A 106 37.906 15.770 1.715 1.00 65.03 C ATOM 1511 CG LEU A 106 36.743 16.758 1.889 1.00 43.51 C ATOM 1512 CD1 LEU A 106 36.438 17.489 0.588 1.00 44.14 C ATOM 1513 CD2 LEU A 106 35.504 16.033 2.398 1.00 41.21 C ATOM 0 H LEU A 106 40.412 15.031 2.419 1.00 4.51 H new ATOM 0 HA LEU A 106 39.210 16.701 0.269 1.00 40.14 H new ATOM 0 HB2 LEU A 106 37.622 15.035 0.961 1.00 65.03 H new ATOM 0 HB3 LEU A 106 38.040 15.230 2.652 1.00 65.03 H new ATOM 0 HG LEU A 106 37.042 17.503 2.627 1.00 43.51 H new ATOM 0 HD11 LEU A 106 35.610 18.181 0.745 1.00 44.14 H new ATOM 0 HD12 LEU A 106 37.319 18.045 0.268 1.00 44.14 H new ATOM 0 HD13 LEU A 106 36.166 16.766 -0.181 1.00 44.14 H new ATOM 0 HD21 LEU A 106 34.688 16.746 2.516 1.00 41.21 H new ATOM 0 HD22 LEU A 106 35.213 15.264 1.683 1.00 41.21 H new ATOM 0 HD23 LEU A 106 35.723 15.569 3.360 1.00 41.21 H new ATOM 1525 N ASP A 107 39.275 18.803 1.616 1.00 72.42 N ATOM 1526 CA ASP A 107 39.523 20.067 2.321 1.00 14.02 C ATOM 1527 C ASP A 107 38.501 20.286 3.417 1.00 1.12 C ATOM 1528 O ASP A 107 37.432 19.689 3.407 1.00 10.24 O ATOM 1529 CB ASP A 107 39.426 21.270 1.379 1.00 13.35 C ATOM 1530 CG ASP A 107 40.333 22.420 1.799 1.00 12.43 C ATOM 1531 OD1 ASP A 107 39.852 23.339 2.494 1.00 14.01 O ATOM 1532 OD2 ASP A 107 41.528 22.409 1.440 1.00 2.52 O1- ATOM 0 H ASP A 107 38.856 18.914 0.693 1.00 72.42 H new ATOM 0 HA ASP A 107 40.529 19.990 2.733 1.00 14.02 H new ATOM 0 HB2 ASP A 107 39.688 20.957 0.368 1.00 13.35 H new ATOM 0 HB3 ASP A 107 38.394 21.619 1.347 1.00 13.35 H new ATOM 1537 N ALA A 108 38.825 21.191 4.320 1.00 41.30 N ATOM 1538 CA ALA A 108 37.885 21.667 5.316 1.00 54.32 C ATOM 1539 C ALA A 108 36.737 22.410 4.644 1.00 74.35 C ATOM 1540 O ALA A 108 35.566 22.181 4.946 1.00 33.14 O ATOM 1541 CB ALA A 108 38.610 22.588 6.277 1.00 73.33 C ATOM 0 H ALA A 108 39.749 21.618 4.384 1.00 41.30 H new ATOM 0 HA ALA A 108 37.472 20.819 5.862 1.00 54.32 H new ATOM 0 HB1 ALA A 108 37.911 22.951 7.030 1.00 73.33 H new ATOM 0 HB2 ALA A 108 39.418 22.042 6.765 1.00 73.33 H new ATOM 0 HB3 ALA A 108 39.024 23.434 5.728 1.00 73.33 H new ATOM 1547 N ALA A 109 37.092 23.287 3.707 1.00 23.13 N ATOM 1548 CA ALA A 109 36.120 24.131 3.026 1.00 64.13 C ATOM 1549 C ALA A 109 35.155 23.286 2.208 1.00 31.24 C ATOM 1550 O ALA A 109 33.934 23.433 2.313 1.00 41.21 O ATOM 1551 CB ALA A 109 36.830 25.141 2.134 1.00 33.23 C ATOM 0 H ALA A 109 38.055 23.430 3.402 1.00 23.13 H new ATOM 0 HA ALA A 109 35.547 24.673 3.779 1.00 64.13 H new ATOM 0 HB1 ALA A 109 36.091 25.765 1.631 1.00 33.23 H new ATOM 0 HB2 ALA A 109 37.482 25.769 2.742 1.00 33.23 H new ATOM 0 HB3 ALA A 109 37.426 24.613 1.389 1.00 33.23 H new ATOM 1557 N ALA A 110 35.714 22.387 1.408 1.00 73.25 N ATOM 1558 CA ALA A 110 34.915 21.527 0.554 1.00 12.34 C ATOM 1559 C ALA A 110 34.092 20.575 1.408 1.00 44.05 C ATOM 1560 O ALA A 110 32.905 20.372 1.162 1.00 34.04 O ATOM 1561 CB ALA A 110 35.804 20.764 -0.420 1.00 53.00 C ATOM 0 H ALA A 110 36.720 22.237 1.335 1.00 73.25 H new ATOM 0 HA ALA A 110 34.233 22.142 -0.033 1.00 12.34 H new ATOM 0 HB1 ALA A 110 35.187 20.125 -1.052 1.00 53.00 H new ATOM 0 HB2 ALA A 110 36.351 21.471 -1.044 1.00 53.00 H new ATOM 0 HB3 ALA A 110 36.511 20.149 0.137 1.00 53.00 H new ATOM 1567 N ALA A 111 34.728 20.014 2.431 1.00 5.14 N ATOM 1568 CA ALA A 111 34.043 19.121 3.363 1.00 43.54 C ATOM 1569 C ALA A 111 32.810 19.787 3.966 1.00 4.44 C ATOM 1570 O ALA A 111 31.733 19.188 4.013 1.00 54.13 O ATOM 1571 CB ALA A 111 34.993 18.675 4.463 1.00 13.31 C ATOM 0 H ALA A 111 35.716 20.161 2.637 1.00 5.14 H new ATOM 0 HA ALA A 111 33.712 18.245 2.805 1.00 43.54 H new ATOM 0 HB1 ALA A 111 34.468 18.010 5.149 1.00 13.31 H new ATOM 0 HB2 ALA A 111 35.838 18.147 4.022 1.00 13.31 H new ATOM 0 HB3 ALA A 111 35.354 19.547 5.008 1.00 13.31 H new ATOM 1577 N LYS A 112 32.967 21.034 4.411 1.00 1.14 N ATOM 1578 CA LYS A 112 31.860 21.784 5.003 1.00 13.13 C ATOM 1579 C LYS A 112 30.653 21.832 4.064 1.00 74.23 C ATOM 1580 O LYS A 112 29.511 21.770 4.520 1.00 4.50 O ATOM 1581 CB LYS A 112 32.300 23.214 5.375 1.00 13.05 C ATOM 1582 CG LYS A 112 33.061 23.314 6.697 1.00 32.13 C ATOM 1583 CD LYS A 112 32.165 22.996 7.898 1.00 10.41 C ATOM 1584 CE LYS A 112 32.913 23.138 9.222 1.00 22.11 C ATOM 1585 NZ LYS A 112 32.036 22.863 10.398 1.00 2.23 N1+ ATOM 0 H LYS A 112 33.849 21.545 4.373 1.00 1.14 H new ATOM 0 HA LYS A 112 31.563 21.262 5.913 1.00 13.13 H new ATOM 0 HB2 LYS A 112 32.929 23.607 4.576 1.00 13.05 H new ATOM 0 HB3 LYS A 112 31.417 23.851 5.428 1.00 13.05 H new ATOM 0 HG2 LYS A 112 33.906 22.626 6.682 1.00 32.13 H new ATOM 0 HG3 LYS A 112 33.470 24.319 6.805 1.00 32.13 H new ATOM 0 HD2 LYS A 112 31.303 23.664 7.895 1.00 10.41 H new ATOM 0 HD3 LYS A 112 31.781 21.980 7.805 1.00 10.41 H new ATOM 0 HE2 LYS A 112 33.760 22.452 9.234 1.00 22.11 H new ATOM 0 HE3 LYS A 112 33.319 24.147 9.302 1.00 22.11 H new ATOM 0 HZ1 LYS A 112 32.625 22.703 11.240 1.00 2.23 H new ATOM 0 HZ2 LYS A 112 31.410 23.677 10.562 1.00 2.23 H new ATOM 0 HZ3 LYS A 112 31.461 22.017 10.212 1.00 2.23 H new ATOM 1599 N THR A 113 30.905 21.932 2.758 1.00 31.43 N ATOM 1600 CA THR A 113 29.821 22.031 1.782 1.00 60.21 C ATOM 1601 C THR A 113 29.257 20.644 1.445 1.00 74.22 C ATOM 1602 O THR A 113 28.044 20.481 1.276 1.00 73.22 O ATOM 1603 CB THR A 113 30.271 22.769 0.484 1.00 31.33 C ATOM 1604 OG1 THR A 113 29.162 23.481 -0.081 1.00 10.35 O ATOM 1605 CG2 THR A 113 30.827 21.812 -0.568 1.00 32.43 C ATOM 0 H THR A 113 31.842 21.946 2.355 1.00 31.43 H new ATOM 0 HA THR A 113 29.031 22.625 2.240 1.00 60.21 H new ATOM 0 HB THR A 113 31.067 23.457 0.770 1.00 31.33 H new ATOM 0 HG1 THR A 113 29.451 23.944 -0.895 1.00 10.35 H new ATOM 0 HG21 THR A 113 31.126 22.376 -1.452 1.00 32.43 H new ATOM 0 HG22 THR A 113 31.692 21.288 -0.162 1.00 32.43 H new ATOM 0 HG23 THR A 113 30.060 21.087 -0.842 1.00 32.43 H new ATOM 1613 N LEU A 114 30.137 19.643 1.373 1.00 23.12 N ATOM 1614 CA LEU A 114 29.727 18.289 1.014 1.00 20.51 C ATOM 1615 C LEU A 114 28.813 17.710 2.086 1.00 41.04 C ATOM 1616 O LEU A 114 27.731 17.204 1.788 1.00 13.34 O ATOM 1617 CB LEU A 114 30.946 17.376 0.809 1.00 61.01 C ATOM 1618 CG LEU A 114 31.922 17.813 -0.299 1.00 11.45 C ATOM 1619 CD1 LEU A 114 33.005 16.760 -0.515 1.00 1.51 C ATOM 1620 CD2 LEU A 114 31.175 18.107 -1.600 1.00 50.51 C ATOM 0 H LEU A 114 31.135 19.747 1.558 1.00 23.12 H new ATOM 0 HA LEU A 114 29.180 18.343 0.073 1.00 20.51 H new ATOM 0 HB2 LEU A 114 31.494 17.315 1.749 1.00 61.01 H new ATOM 0 HB3 LEU A 114 30.591 16.371 0.581 1.00 61.01 H new ATOM 0 HG LEU A 114 32.408 18.734 0.023 1.00 11.45 H new ATOM 0 HD11 LEU A 114 33.682 17.091 -1.302 1.00 1.51 H new ATOM 0 HD12 LEU A 114 33.565 16.619 0.410 1.00 1.51 H new ATOM 0 HD13 LEU A 114 32.543 15.817 -0.807 1.00 1.51 H new ATOM 0 HD21 LEU A 114 31.886 18.414 -2.367 1.00 50.51 H new ATOM 0 HD22 LEU A 114 30.651 17.210 -1.929 1.00 50.51 H new ATOM 0 HD23 LEU A 114 30.454 18.908 -1.433 1.00 50.51 H new ATOM 1632 N VAL A 115 29.249 17.814 3.338 1.00 72.22 N ATOM 1633 CA VAL A 115 28.467 17.322 4.467 1.00 32.34 C ATOM 1634 C VAL A 115 27.171 18.118 4.594 1.00 1.13 C ATOM 1635 O VAL A 115 26.135 17.580 4.988 1.00 25.22 O ATOM 1636 CB VAL A 115 29.266 17.411 5.793 1.00 63.01 C ATOM 1637 CG1 VAL A 115 28.437 16.895 6.971 1.00 14.41 C ATOM 1638 CG2 VAL A 115 30.583 16.642 5.681 1.00 35.24 C ATOM 0 H VAL A 115 30.141 18.235 3.596 1.00 72.22 H new ATOM 0 HA VAL A 115 28.236 16.274 4.279 1.00 32.34 H new ATOM 0 HB VAL A 115 29.495 18.460 5.978 1.00 63.01 H new ATOM 0 HG11 VAL A 115 29.022 16.969 7.888 1.00 14.41 H new ATOM 0 HG12 VAL A 115 27.532 17.494 7.069 1.00 14.41 H new ATOM 0 HG13 VAL A 115 28.166 15.854 6.797 1.00 14.41 H new ATOM 0 HG21 VAL A 115 31.129 16.717 6.621 1.00 35.24 H new ATOM 0 HG22 VAL A 115 30.375 15.594 5.464 1.00 35.24 H new ATOM 0 HG23 VAL A 115 31.185 17.066 4.877 1.00 35.24 H new ATOM 1648 N ASP A 116 27.242 19.396 4.235 1.00 34.11 N ATOM 1649 CA ASP A 116 26.085 20.290 4.295 1.00 22.44 C ATOM 1650 C ASP A 116 24.974 19.783 3.380 1.00 4.20 C ATOM 1651 O ASP A 116 23.879 19.448 3.841 1.00 63.50 O ATOM 1652 CB ASP A 116 26.490 21.714 3.883 1.00 1.42 C ATOM 1653 CG ASP A 116 25.405 22.753 4.151 1.00 43.12 C ATOM 1654 OD1 ASP A 116 24.354 22.729 3.473 1.00 62.34 O ATOM 1655 OD2 ASP A 116 25.614 23.619 5.031 1.00 50.12 O1- ATOM 0 H ASP A 116 28.095 19.841 3.896 1.00 34.11 H new ATOM 0 HA ASP A 116 25.717 20.309 5.321 1.00 22.44 H new ATOM 0 HB2 ASP A 116 27.395 21.997 4.421 1.00 1.42 H new ATOM 0 HB3 ASP A 116 26.736 21.721 2.821 1.00 1.42 H new ATOM 1660 N ARG A 117 25.270 19.699 2.081 1.00 43.12 N ATOM 1661 CA ARG A 117 24.266 19.321 1.095 1.00 25.23 C ATOM 1662 C ARG A 117 23.860 17.861 1.259 1.00 51.42 C ATOM 1663 O ARG A 117 22.691 17.511 1.101 1.00 42.42 O ATOM 1664 CB ARG A 117 24.802 19.579 -0.311 1.00 4.30 C ATOM 1665 CG ARG A 117 26.103 18.851 -0.606 1.00 3.24 C ATOM 1666 CD ARG A 117 26.736 19.344 -1.893 1.00 12.41 C ATOM 1667 NE ARG A 117 25.889 19.066 -3.061 1.00 15.40 N ATOM 1668 CZ ARG A 117 25.694 19.917 -4.074 1.00 54.12 C ATOM 1669 NH1 ARG A 117 26.331 21.079 -4.110 1.00 44.31 N1+ ATOM 1670 NH2 ARG A 117 24.870 19.594 -5.062 1.00 65.24 N ATOM 0 H ARG A 117 26.194 19.888 1.693 1.00 43.12 H new ATOM 0 HA ARG A 117 23.376 19.930 1.252 1.00 25.23 H new ATOM 0 HB2 ARG A 117 24.051 19.274 -1.039 1.00 4.30 H new ATOM 0 HB3 ARG A 117 24.956 20.650 -0.442 1.00 4.30 H new ATOM 0 HG2 ARG A 117 26.798 18.996 0.221 1.00 3.24 H new ATOM 0 HG3 ARG A 117 25.913 17.780 -0.679 1.00 3.24 H new ATOM 0 HD2 ARG A 117 26.916 20.417 -1.822 1.00 12.41 H new ATOM 0 HD3 ARG A 117 27.707 18.867 -2.026 1.00 12.41 H new ATOM 0 HE ARG A 117 25.418 18.162 -3.102 1.00 15.40 H new ATOM 0 HH11 ARG A 117 26.976 21.330 -3.361 1.00 44.31 H new ATOM 0 HH12 ARG A 117 26.176 21.722 -4.887 1.00 44.31 H new ATOM 0 HH21 ARG A 117 24.385 18.697 -5.049 1.00 65.24 H new ATOM 0 HH22 ARG A 117 24.721 20.243 -5.835 1.00 65.24 H new ATOM 1684 N ALA A 118 24.829 17.014 1.589 1.00 40.10 N ATOM 1685 CA ALA A 118 24.564 15.596 1.821 1.00 45.33 C ATOM 1686 C ALA A 118 23.562 15.421 2.959 1.00 63.41 C ATOM 1687 O ALA A 118 22.582 14.683 2.839 1.00 0.11 O ATOM 1688 CB ALA A 118 25.858 14.851 2.130 1.00 44.02 C ATOM 0 H ALA A 118 25.806 17.284 1.702 1.00 40.10 H new ATOM 0 HA ALA A 118 24.134 15.173 0.913 1.00 45.33 H new ATOM 0 HB1 ALA A 118 25.639 13.797 2.300 1.00 44.02 H new ATOM 0 HB2 ALA A 118 26.544 14.948 1.288 1.00 44.02 H new ATOM 0 HB3 ALA A 118 26.317 15.275 3.023 1.00 44.02 H new ATOM 1694 N HIS A 119 23.797 16.144 4.052 1.00 52.13 N ATOM 1695 CA HIS A 119 22.941 16.066 5.233 1.00 15.33 C ATOM 1696 C HIS A 119 21.641 16.843 5.003 1.00 0.40 C ATOM 1697 O HIS A 119 20.769 16.891 5.874 1.00 63.33 O ATOM 1698 CB HIS A 119 23.689 16.617 6.460 1.00 54.45 C ATOM 1699 CG HIS A 119 23.347 15.920 7.743 1.00 21.21 C ATOM 1700 ND1 HIS A 119 24.244 15.125 8.422 1.00 2.34 N ATOM 1701 CD2 HIS A 119 22.204 15.892 8.465 1.00 20.34 C ATOM 1702 CE1 HIS A 119 23.667 14.634 9.500 1.00 52.23 C ATOM 1703 NE2 HIS A 119 22.426 15.081 9.555 1.00 74.13 N ATOM 0 H HIS A 119 24.578 16.794 4.144 1.00 52.13 H new ATOM 0 HA HIS A 119 22.687 15.022 5.416 1.00 15.33 H new ATOM 0 HB2 HIS A 119 24.762 16.533 6.287 1.00 54.45 H new ATOM 0 HB3 HIS A 119 23.465 17.679 6.564 1.00 54.45 H new ATOM 0 HD1 HIS A 119 25.206 14.944 8.135 1.00 2.34 H new ATOM 0 HD2 HIS A 119 21.286 16.410 8.230 1.00 20.34 H new ATOM 0 HE1 HIS A 119 24.132 13.976 10.219 1.00 52.23 H new ATOM 1712 N HIS A 120 21.535 17.462 3.829 1.00 43.52 N ATOM 1713 CA HIS A 120 20.335 18.193 3.424 1.00 31.45 C ATOM 1714 C HIS A 120 19.467 17.325 2.514 1.00 61.14 C ATOM 1715 O HIS A 120 18.243 17.291 2.659 1.00 43.11 O ATOM 1716 CB HIS A 120 20.738 19.489 2.692 1.00 2.24 C ATOM 1717 CG HIS A 120 19.589 20.314 2.171 1.00 45.12 C ATOM 1718 ND1 HIS A 120 19.269 21.556 2.675 1.00 44.32 N ATOM 1719 CD2 HIS A 120 18.703 20.082 1.169 1.00 50.50 C ATOM 1720 CE1 HIS A 120 18.240 22.048 2.010 1.00 65.24 C ATOM 1721 NE2 HIS A 120 17.877 21.176 1.092 1.00 75.14 N ATOM 0 H HIS A 120 22.279 17.471 3.131 1.00 43.52 H new ATOM 0 HA HIS A 120 19.759 18.448 4.313 1.00 31.45 H new ATOM 0 HB2 HIS A 120 21.327 20.104 3.373 1.00 2.24 H new ATOM 0 HB3 HIS A 120 21.386 19.229 1.855 1.00 2.24 H new ATOM 0 HD2 HIS A 120 18.656 19.200 0.547 1.00 50.50 H new ATOM 0 HE1 HIS A 120 17.774 23.006 2.189 1.00 65.24 H new ATOM 0 HE2 HIS A 120 17.108 21.294 0.432 1.00 75.14 H new ATOM 1730 N VAL A 121 20.112 16.622 1.585 1.00 33.11 N ATOM 1731 CA VAL A 121 19.405 15.888 0.536 1.00 23.21 C ATOM 1732 C VAL A 121 18.984 14.486 0.982 1.00 3.02 C ATOM 1733 O VAL A 121 17.857 14.067 0.717 1.00 30.52 O ATOM 1734 CB VAL A 121 20.251 15.784 -0.765 1.00 61.42 C ATOM 1735 CG1 VAL A 121 20.557 17.174 -1.323 1.00 74.54 C ATOM 1736 CG2 VAL A 121 21.543 14.998 -0.528 1.00 44.31 C ATOM 0 H VAL A 121 21.128 16.545 1.537 1.00 33.11 H new ATOM 0 HA VAL A 121 18.503 16.465 0.330 1.00 23.21 H new ATOM 0 HB VAL A 121 19.662 15.239 -1.503 1.00 61.42 H new ATOM 0 HG11 VAL A 121 21.150 17.078 -2.233 1.00 74.54 H new ATOM 0 HG12 VAL A 121 19.623 17.688 -1.550 1.00 74.54 H new ATOM 0 HG13 VAL A 121 21.117 17.748 -0.584 1.00 74.54 H new ATOM 0 HG21 VAL A 121 22.111 14.944 -1.457 1.00 44.31 H new ATOM 0 HG22 VAL A 121 22.140 15.500 0.234 1.00 44.31 H new ATOM 0 HG23 VAL A 121 21.299 13.990 -0.192 1.00 44.31 H new ATOM 1746 N CYS A 122 19.873 13.759 1.664 1.00 31.44 N ATOM 1747 CA CYS A 122 19.587 12.370 2.022 1.00 53.14 C ATOM 1748 C CYS A 122 20.235 11.963 3.350 1.00 23.34 C ATOM 1749 O CYS A 122 21.154 11.139 3.379 1.00 24.32 O ATOM 1750 CB CYS A 122 20.036 11.430 0.891 1.00 50.43 C ATOM 1751 SG CYS A 122 19.742 9.675 1.217 1.00 72.12 S ATOM 0 H CYS A 122 20.782 14.103 1.974 1.00 31.44 H new ATOM 0 HA CYS A 122 18.509 12.284 2.157 1.00 53.14 H new ATOM 0 HB2 CYS A 122 19.515 11.709 -0.025 1.00 50.43 H new ATOM 0 HB3 CYS A 122 21.100 11.580 0.711 1.00 50.43 H new ATOM 0 HG CYS A 122 20.223 9.364 2.384 1.00 72.12 H new ATOM 1757 N PRO A 123 19.788 12.556 4.473 1.00 50.40 N ATOM 1758 CA PRO A 123 20.134 12.082 5.805 1.00 60.03 C ATOM 1759 C PRO A 123 19.081 11.097 6.314 1.00 74.45 C ATOM 1760 O PRO A 123 17.905 11.219 5.970 1.00 30.15 O ATOM 1761 CB PRO A 123 20.114 13.376 6.620 1.00 24.23 C ATOM 1762 CG PRO A 123 19.027 14.195 5.993 1.00 34.14 C ATOM 1763 CD PRO A 123 18.927 13.756 4.542 1.00 45.03 C ATOM 0 HA PRO A 123 21.083 11.549 5.855 1.00 60.03 H new ATOM 0 HB2 PRO A 123 19.907 13.180 7.672 1.00 24.23 H new ATOM 0 HB3 PRO A 123 21.075 13.889 6.574 1.00 24.23 H new ATOM 0 HG2 PRO A 123 18.080 14.040 6.510 1.00 34.14 H new ATOM 0 HG3 PRO A 123 19.257 15.258 6.060 1.00 34.14 H new ATOM 0 HD2 PRO A 123 17.898 13.526 4.264 1.00 45.03 H new ATOM 0 HD3 PRO A 123 19.274 14.536 3.864 1.00 45.03 H new ATOM 1771 N TYR A 124 19.489 10.124 7.129 1.00 53.44 N ATOM 1772 CA TYR A 124 18.537 9.154 7.677 1.00 1.24 C ATOM 1773 C TYR A 124 17.469 9.866 8.509 1.00 42.34 C ATOM 1774 O TYR A 124 16.364 9.360 8.698 1.00 23.13 O ATOM 1775 CB TYR A 124 19.246 8.093 8.532 1.00 65.44 C ATOM 1776 CG TYR A 124 18.324 6.954 8.932 1.00 10.42 C ATOM 1777 CD1 TYR A 124 17.824 6.829 10.231 1.00 42.12 C ATOM 1778 CD2 TYR A 124 17.930 6.010 7.988 1.00 13.25 C ATOM 1779 CE1 TYR A 124 16.965 5.803 10.560 1.00 14.31 C ATOM 1780 CE2 TYR A 124 17.075 4.980 8.319 1.00 12.12 C ATOM 1781 CZ TYR A 124 16.595 4.881 9.603 1.00 5.42 C ATOM 1782 OH TYR A 124 15.733 3.861 9.932 1.00 60.35 O ATOM 0 H TYR A 124 20.456 9.986 7.422 1.00 53.44 H new ATOM 0 HA TYR A 124 18.060 8.649 6.837 1.00 1.24 H new ATOM 0 HB2 TYR A 124 20.094 7.691 7.977 1.00 65.44 H new ATOM 0 HB3 TYR A 124 19.647 8.564 9.430 1.00 65.44 H new ATOM 0 HD1 TYR A 124 18.114 7.545 10.986 1.00 42.12 H new ATOM 0 HD2 TYR A 124 18.301 6.086 6.977 1.00 13.25 H new ATOM 0 HE1 TYR A 124 16.582 5.721 11.566 1.00 14.31 H new ATOM 0 HE2 TYR A 124 16.784 4.255 7.573 1.00 12.12 H new ATOM 0 HH TYR A 124 15.208 3.609 9.144 1.00 60.35 H new ATOM 1792 N SER A 125 17.818 11.046 9.000 1.00 23.21 N ATOM 1793 CA SER A 125 16.910 11.859 9.786 1.00 62.44 C ATOM 1794 C SER A 125 17.094 13.339 9.443 1.00 2.13 C ATOM 1795 O SER A 125 18.105 13.950 9.796 1.00 5.11 O ATOM 1796 CB SER A 125 17.157 11.608 11.280 1.00 61.32 C ATOM 1797 OG SER A 125 18.539 11.711 11.591 1.00 44.54 O ATOM 0 H SER A 125 18.738 11.464 8.863 1.00 23.21 H new ATOM 0 HA SER A 125 15.882 11.584 9.551 1.00 62.44 H new ATOM 0 HB2 SER A 125 16.593 12.329 11.872 1.00 61.32 H new ATOM 0 HB3 SER A 125 16.792 10.617 11.551 1.00 61.32 H new ATOM 0 HG SER A 125 18.927 12.471 11.110 1.00 44.54 H new ATOM 1803 N ASN A 126 16.135 13.901 8.713 1.00 23.44 N ATOM 1804 CA ASN A 126 16.122 15.337 8.425 1.00 73.42 C ATOM 1805 C ASN A 126 15.885 16.112 9.717 1.00 24.25 C ATOM 1806 O ASN A 126 16.406 17.211 9.912 1.00 64.13 O ATOM 1807 CB ASN A 126 15.029 15.684 7.402 1.00 54.23 C ATOM 1808 CG ASN A 126 15.261 15.043 6.042 1.00 23.41 C ATOM 1809 OD1 ASN A 126 14.845 13.913 5.800 1.00 4.50 O ATOM 1810 ND2 ASN A 126 15.908 15.765 5.138 1.00 5.31 N ATOM 0 H ASN A 126 15.354 13.385 8.308 1.00 23.44 H new ATOM 0 HA ASN A 126 17.087 15.614 8.000 1.00 73.42 H new ATOM 0 HB2 ASN A 126 14.062 15.362 7.789 1.00 54.23 H new ATOM 0 HB3 ASN A 126 14.981 16.766 7.284 1.00 54.23 H new ATOM 0 HD21 ASN A 126 16.074 15.385 4.206 1.00 5.31 H new ATOM 0 HD22 ASN A 126 16.239 16.700 5.374 1.00 5.31 H new ATOM 1817 N ALA A 127 15.126 15.493 10.614 1.00 54.04 N ATOM 1818 CA ALA A 127 14.725 16.097 11.881 1.00 54.10 C ATOM 1819 C ALA A 127 15.908 16.365 12.804 1.00 52.15 C ATOM 1820 O ALA A 127 15.754 16.996 13.842 1.00 1.24 O ATOM 1821 CB ALA A 127 13.736 15.178 12.588 1.00 41.33 C ATOM 0 H ALA A 127 14.767 14.547 10.481 1.00 54.04 H new ATOM 0 HA ALA A 127 14.266 17.058 11.651 1.00 54.10 H new ATOM 0 HB1 ALA A 127 13.435 15.627 13.535 1.00 41.33 H new ATOM 0 HB2 ALA A 127 12.858 15.035 11.958 1.00 41.33 H new ATOM 0 HB3 ALA A 127 14.207 14.213 12.777 1.00 41.33 H new ATOM 1827 N THR A 128 17.093 15.937 12.411 1.00 1.20 N ATOM 1828 CA THR A 128 18.218 15.896 13.327 1.00 2.03 C ATOM 1829 C THR A 128 18.990 17.199 13.236 1.00 41.31 C ATOM 1830 O THR A 128 19.919 17.451 13.998 1.00 64.41 O ATOM 1831 CB THR A 128 19.147 14.697 13.010 1.00 53.22 C ATOM 1832 OG1 THR A 128 19.927 14.352 14.159 1.00 44.43 O ATOM 1833 CG2 THR A 128 20.079 15.012 11.845 1.00 73.21 C ATOM 0 H THR A 128 17.302 15.614 11.466 1.00 1.20 H new ATOM 0 HA THR A 128 17.841 15.768 14.342 1.00 2.03 H new ATOM 0 HB THR A 128 18.513 13.855 12.733 1.00 53.22 H new ATOM 0 HG1 THR A 128 20.508 13.592 13.944 1.00 44.43 H new ATOM 0 HG21 THR A 128 20.718 14.151 11.647 1.00 73.21 H new ATOM 0 HG22 THR A 128 19.488 15.237 10.957 1.00 73.21 H new ATOM 0 HG23 THR A 128 20.698 15.873 12.097 1.00 73.21 H new ATOM 1841 N ARG A 129 18.576 18.032 12.292 1.00 15.30 N ATOM 1842 CA ARG A 129 19.258 19.284 12.021 1.00 1.24 C ATOM 1843 C ARG A 129 18.313 20.474 12.202 1.00 21.22 C ATOM 1844 O ARG A 129 18.694 21.496 12.770 1.00 60.25 O ATOM 1845 CB ARG A 129 19.843 19.246 10.606 1.00 61.34 C ATOM 1846 CG ARG A 129 18.819 19.025 9.501 1.00 45.30 C ATOM 1847 CD ARG A 129 19.468 19.028 8.124 1.00 1.10 C ATOM 1848 NE ARG A 129 20.213 20.268 7.872 1.00 10.14 N ATOM 1849 CZ ARG A 129 20.001 21.075 6.831 1.00 72.04 C ATOM 1850 NH1 ARG A 129 19.032 20.810 5.963 1.00 12.15 N1+ ATOM 1851 NH2 ARG A 129 20.745 22.161 6.672 1.00 55.55 N ATOM 0 H ARG A 129 17.765 17.859 11.698 1.00 15.30 H new ATOM 0 HA ARG A 129 20.072 19.411 12.735 1.00 1.24 H new ATOM 0 HB2 ARG A 129 20.364 20.185 10.417 1.00 61.34 H new ATOM 0 HB3 ARG A 129 20.588 18.452 10.557 1.00 61.34 H new ATOM 0 HG2 ARG A 129 18.310 18.075 9.661 1.00 45.30 H new ATOM 0 HG3 ARG A 129 18.059 19.805 9.547 1.00 45.30 H new ATOM 0 HD2 ARG A 129 20.142 18.176 8.039 1.00 1.10 H new ATOM 0 HD3 ARG A 129 18.700 18.904 7.360 1.00 1.10 H new ATOM 0 HE ARG A 129 20.941 20.530 8.537 1.00 10.14 H new ATOM 0 HH11 ARG A 129 18.445 19.986 6.090 1.00 12.15 H new ATOM 0 HH12 ARG A 129 18.875 21.431 5.169 1.00 12.15 H new ATOM 0 HH21 ARG A 129 21.479 22.379 7.346 1.00 55.55 H new ATOM 0 HH22 ARG A 129 20.583 22.778 5.876 1.00 55.55 H new ATOM 1865 N ASN A 130 17.090 20.348 11.692 1.00 53.23 N ATOM 1866 CA ASN A 130 16.063 21.378 11.892 1.00 71.44 C ATOM 1867 C ASN A 130 15.445 21.274 13.281 1.00 71.52 C ATOM 1868 O ASN A 130 15.328 22.264 14.007 1.00 41.25 O ATOM 1869 CB ASN A 130 14.961 21.302 10.825 1.00 51.21 C ATOM 1870 CG ASN A 130 14.854 19.932 10.220 1.00 65.44 C ATOM 1871 OD1 ASN A 130 14.101 19.077 10.683 1.00 64.05 O ATOM 1872 ND2 ASN A 130 15.635 19.713 9.185 1.00 32.23 N ATOM 0 H ASN A 130 16.783 19.548 11.139 1.00 53.23 H new ATOM 0 HA ASN A 130 16.562 22.343 11.797 1.00 71.44 H new ATOM 0 HB2 ASN A 130 14.005 21.576 11.271 1.00 51.21 H new ATOM 0 HB3 ASN A 130 15.166 22.030 10.040 1.00 51.21 H new ATOM 0 HD21 ASN A 130 15.634 18.801 8.729 1.00 32.23 H new ATOM 0 HD22 ASN A 130 16.242 20.456 8.838 1.00 32.23 H new ATOM 1879 N ASN A 131 15.038 20.060 13.629 1.00 23.53 N ATOM 1880 CA ASN A 131 14.332 19.803 14.887 1.00 43.51 C ATOM 1881 C ASN A 131 15.319 19.592 16.042 1.00 71.03 C ATOM 1882 O ASN A 131 15.090 20.060 17.159 1.00 72.12 O ATOM 1883 CB ASN A 131 13.436 18.559 14.732 1.00 43.33 C ATOM 1884 CG ASN A 131 12.243 18.524 15.689 1.00 4.41 C ATOM 1885 OD1 ASN A 131 11.211 17.922 15.380 1.00 52.34 O ATOM 1886 ND2 ASN A 131 12.365 19.143 16.858 1.00 53.22 N ATOM 0 H ASN A 131 15.184 19.229 13.056 1.00 23.53 H new ATOM 0 HA ASN A 131 13.717 20.673 15.120 1.00 43.51 H new ATOM 0 HB2 ASN A 131 13.067 18.516 13.707 1.00 43.33 H new ATOM 0 HB3 ASN A 131 14.041 17.667 14.891 1.00 43.33 H new ATOM 0 HD21 ASN A 131 11.594 19.128 17.526 1.00 53.22 H new ATOM 0 HD22 ASN A 131 13.229 19.633 17.088 1.00 53.22 H new ATOM 1893 N VAL A 132 16.407 18.878 15.761 1.00 22.24 N ATOM 1894 CA VAL A 132 17.390 18.503 16.784 1.00 51.15 C ATOM 1895 C VAL A 132 18.720 19.237 16.550 1.00 30.12 C ATOM 1896 O VAL A 132 18.954 19.772 15.463 1.00 33.10 O ATOM 1897 CB VAL A 132 17.625 16.965 16.775 1.00 54.43 C ATOM 1898 CG1 VAL A 132 18.467 16.515 17.970 1.00 31.31 C ATOM 1899 CG2 VAL A 132 16.291 16.213 16.737 1.00 70.22 C ATOM 0 H VAL A 132 16.634 18.543 14.825 1.00 22.24 H new ATOM 0 HA VAL A 132 16.996 18.794 17.758 1.00 51.15 H new ATOM 0 HB VAL A 132 18.184 16.724 15.871 1.00 54.43 H new ATOM 0 HG11 VAL A 132 18.609 15.435 17.929 1.00 31.31 H new ATOM 0 HG12 VAL A 132 19.437 17.010 17.939 1.00 31.31 H new ATOM 0 HG13 VAL A 132 17.955 16.778 18.896 1.00 31.31 H new ATOM 0 HG21 VAL A 132 16.479 15.139 16.731 1.00 70.22 H new ATOM 0 HG22 VAL A 132 15.701 16.474 17.616 1.00 70.22 H new ATOM 0 HG23 VAL A 132 15.743 16.490 15.837 1.00 70.22 H new ATOM 1909 N ALA A 133 19.586 19.262 17.569 1.00 44.32 N ATOM 1910 CA ALA A 133 20.856 19.984 17.492 1.00 45.42 C ATOM 1911 C ALA A 133 22.027 19.051 17.194 1.00 30.31 C ATOM 1912 O ALA A 133 22.637 18.463 18.103 1.00 14.22 O ATOM 1913 CB ALA A 133 21.105 20.767 18.778 1.00 22.23 C ATOM 0 H ALA A 133 19.428 18.788 18.458 1.00 44.32 H new ATOM 0 HA ALA A 133 20.782 20.686 16.661 1.00 45.42 H new ATOM 0 HB1 ALA A 133 22.054 21.298 18.703 1.00 22.23 H new ATOM 0 HB2 ALA A 133 20.299 21.485 18.929 1.00 22.23 H new ATOM 0 HB3 ALA A 133 21.140 20.078 19.622 1.00 22.23 H new ATOM 1919 N VAL A 134 22.326 18.909 15.911 1.00 55.21 N ATOM 1920 CA VAL A 134 23.513 18.196 15.469 1.00 14.23 C ATOM 1921 C VAL A 134 24.538 19.175 14.897 1.00 75.02 C ATOM 1922 O VAL A 134 24.250 19.919 13.955 1.00 44.45 O ATOM 1923 CB VAL A 134 23.189 17.113 14.414 1.00 13.33 C ATOM 1924 CG1 VAL A 134 24.474 16.520 13.843 1.00 2.32 C ATOM 1925 CG2 VAL A 134 22.320 16.018 15.022 1.00 40.12 C ATOM 0 H VAL A 134 21.756 19.283 15.152 1.00 55.21 H new ATOM 0 HA VAL A 134 23.927 17.695 16.344 1.00 14.23 H new ATOM 0 HB VAL A 134 22.635 17.581 13.600 1.00 13.33 H new ATOM 0 HG11 VAL A 134 24.226 15.760 13.102 1.00 2.32 H new ATOM 0 HG12 VAL A 134 25.060 17.309 13.371 1.00 2.32 H new ATOM 0 HG13 VAL A 134 25.055 16.068 14.647 1.00 2.32 H new ATOM 0 HG21 VAL A 134 22.102 15.264 14.265 1.00 40.12 H new ATOM 0 HG22 VAL A 134 22.849 15.554 15.854 1.00 40.12 H new ATOM 0 HG23 VAL A 134 21.387 16.452 15.382 1.00 40.12 H new ATOM 1935 N ARG A 135 25.724 19.175 15.490 1.00 5.32 N ATOM 1936 CA ARG A 135 26.831 20.008 15.047 1.00 35.41 C ATOM 1937 C ARG A 135 27.590 19.275 13.953 1.00 62.34 C ATOM 1938 O ARG A 135 28.262 18.276 14.223 1.00 24.24 O ATOM 1939 CB ARG A 135 27.793 20.325 16.214 1.00 72.41 C ATOM 1940 CG ARG A 135 27.171 21.085 17.390 1.00 24.53 C ATOM 1941 CD ARG A 135 26.059 20.293 18.069 1.00 72.30 C ATOM 1942 NE ARG A 135 25.666 20.868 19.350 1.00 54.11 N ATOM 1943 CZ ARG A 135 24.873 21.925 19.498 1.00 2.05 C ATOM 1944 NH1 ARG A 135 24.405 22.574 18.436 1.00 12.22 N1+ ATOM 1945 NH2 ARG A 135 24.546 22.327 20.718 1.00 32.21 N ATOM 0 H ARG A 135 25.945 18.593 16.298 1.00 5.32 H new ATOM 0 HA ARG A 135 26.431 20.949 14.670 1.00 35.41 H new ATOM 0 HB2 ARG A 135 28.206 19.388 16.587 1.00 72.41 H new ATOM 0 HB3 ARG A 135 28.627 20.909 15.826 1.00 72.41 H new ATOM 0 HG2 ARG A 135 27.946 21.317 18.120 1.00 24.53 H new ATOM 0 HG3 ARG A 135 26.772 22.035 17.035 1.00 24.53 H new ATOM 0 HD2 ARG A 135 25.191 20.254 17.411 1.00 72.30 H new ATOM 0 HD3 ARG A 135 26.390 19.266 18.222 1.00 72.30 H new ATOM 0 HE ARG A 135 26.026 20.426 20.196 1.00 54.11 H new ATOM 0 HH11 ARG A 135 24.654 22.262 17.497 1.00 12.22 H new ATOM 0 HH12 ARG A 135 23.797 23.384 18.560 1.00 12.22 H new ATOM 0 HH21 ARG A 135 24.902 21.827 21.532 1.00 32.21 H new ATOM 0 HH22 ARG A 135 23.938 23.137 20.842 1.00 32.21 H new ATOM 1959 N LEU A 136 27.458 19.736 12.719 1.00 14.32 N ATOM 1960 CA LEU A 136 28.171 19.131 11.608 1.00 2.32 C ATOM 1961 C LEU A 136 29.610 19.623 11.575 1.00 50.04 C ATOM 1962 O LEU A 136 29.903 20.735 11.120 1.00 1.31 O ATOM 1963 CB LEU A 136 27.444 19.407 10.288 1.00 33.50 C ATOM 1964 CG LEU A 136 26.146 18.607 10.107 1.00 40.54 C ATOM 1965 CD1 LEU A 136 25.454 18.965 8.792 1.00 3.54 C ATOM 1966 CD2 LEU A 136 26.435 17.108 10.183 1.00 32.41 C ATOM 0 H LEU A 136 26.865 20.525 12.463 1.00 14.32 H new ATOM 0 HA LEU A 136 28.194 18.050 11.747 1.00 2.32 H new ATOM 0 HB2 LEU A 136 27.214 20.471 10.228 1.00 33.50 H new ATOM 0 HB3 LEU A 136 28.117 19.179 9.461 1.00 33.50 H new ATOM 0 HG LEU A 136 25.466 18.871 10.917 1.00 40.54 H new ATOM 0 HD11 LEU A 136 24.538 18.382 8.692 1.00 3.54 H new ATOM 0 HD12 LEU A 136 25.211 20.027 8.786 1.00 3.54 H new ATOM 0 HD13 LEU A 136 26.119 18.741 7.958 1.00 3.54 H new ATOM 0 HD21 LEU A 136 25.507 16.551 10.053 1.00 32.41 H new ATOM 0 HD22 LEU A 136 27.136 16.832 9.396 1.00 32.41 H new ATOM 0 HD23 LEU A 136 26.868 16.870 11.154 1.00 32.41 H new ATOM 1978 N VAL A 137 30.497 18.786 12.087 1.00 24.14 N ATOM 1979 CA VAL A 137 31.912 19.102 12.192 1.00 11.21 C ATOM 1980 C VAL A 137 32.702 18.212 11.241 1.00 22.22 C ATOM 1981 O VAL A 137 32.631 16.987 11.311 1.00 60.11 O ATOM 1982 CB VAL A 137 32.415 18.950 13.660 1.00 74.42 C ATOM 1983 CG1 VAL A 137 31.581 17.914 14.411 1.00 2.12 C ATOM 1984 CG2 VAL A 137 33.905 18.584 13.717 1.00 51.44 C ATOM 0 H VAL A 137 30.254 17.862 12.444 1.00 24.14 H new ATOM 0 HA VAL A 137 32.065 20.143 11.908 1.00 11.21 H new ATOM 0 HB VAL A 137 32.295 19.918 14.147 1.00 74.42 H new ATOM 0 HG11 VAL A 137 31.948 17.823 15.433 1.00 2.12 H new ATOM 0 HG12 VAL A 137 30.538 18.229 14.427 1.00 2.12 H new ATOM 0 HG13 VAL A 137 31.661 16.950 13.910 1.00 2.12 H new ATOM 0 HG21 VAL A 137 34.216 18.487 14.757 1.00 51.44 H new ATOM 0 HG22 VAL A 137 34.067 17.638 13.200 1.00 51.44 H new ATOM 0 HG23 VAL A 137 34.491 19.366 13.234 1.00 51.44 H new ATOM 1994 N VAL A 138 33.434 18.839 10.335 1.00 43.23 N ATOM 1995 CA VAL A 138 34.157 18.119 9.304 1.00 53.11 C ATOM 1996 C VAL A 138 35.611 17.940 9.708 1.00 13.33 C ATOM 1997 O VAL A 138 36.235 18.839 10.281 1.00 44.02 O ATOM 1998 CB VAL A 138 34.078 18.816 7.930 1.00 15.42 C ATOM 1999 CG1 VAL A 138 32.634 19.166 7.590 1.00 20.25 C ATOM 2000 CG2 VAL A 138 34.978 20.038 7.898 1.00 13.44 C ATOM 0 H VAL A 138 33.542 19.852 10.294 1.00 43.23 H new ATOM 0 HA VAL A 138 33.679 17.145 9.203 1.00 53.11 H new ATOM 0 HB VAL A 138 34.437 18.127 7.165 1.00 15.42 H new ATOM 0 HG11 VAL A 138 32.598 19.657 6.617 1.00 20.25 H new ATOM 0 HG12 VAL A 138 32.036 18.255 7.559 1.00 20.25 H new ATOM 0 HG13 VAL A 138 32.234 19.837 8.350 1.00 20.25 H new ATOM 0 HG21 VAL A 138 34.908 20.516 6.921 1.00 13.44 H new ATOM 0 HG22 VAL A 138 34.664 20.742 8.669 1.00 13.44 H new ATOM 0 HG23 VAL A 138 36.009 19.735 8.081 1.00 13.44 H new ATOM 2010 N ALA A 139 36.123 16.767 9.437 1.00 53.03 N ATOM 2011 CA ALA A 139 37.475 16.394 9.846 1.00 12.31 C ATOM 2012 C ALA A 139 38.320 16.000 8.636 1.00 73.13 C ATOM 2013 O ALA A 139 37.808 15.424 7.672 1.00 43.50 O ATOM 2014 CB ALA A 139 37.425 15.255 10.859 1.00 22.50 C ATOM 0 H ALA A 139 35.625 16.037 8.928 1.00 53.03 H new ATOM 0 HA ALA A 139 37.942 17.259 10.317 1.00 12.31 H new ATOM 0 HB1 ALA A 139 38.439 14.987 11.155 1.00 22.50 H new ATOM 0 HB2 ALA A 139 36.863 15.573 11.737 1.00 22.50 H new ATOM 0 HB3 ALA A 139 36.938 14.390 10.410 1.00 22.50 H new ATOM 2021 N MET B 1 26.663 23.977 25.354 1.00 72.34 N ATOM 2022 CA MET B 1 25.663 23.819 26.401 1.00 63.32 C ATOM 2023 C MET B 1 26.248 23.087 27.604 1.00 71.35 C ATOM 2024 O MET B 1 27.414 22.681 27.597 1.00 2.40 O ATOM 2025 CB MET B 1 24.452 23.046 25.863 1.00 41.04 C ATOM 2026 CG MET B 1 24.789 21.622 25.451 1.00 5.33 C ATOM 2027 SD MET B 1 23.369 20.714 24.801 1.00 24.33 S ATOM 2028 CE MET B 1 22.472 20.347 26.307 1.00 72.42 C ATOM 0 H1 MET B 1 26.264 23.671 24.444 1.00 72.34 H new ATOM 0 H2 MET B 1 26.944 24.976 25.291 1.00 72.34 H new ATOM 0 H3 MET B 1 27.496 23.396 25.579 1.00 72.34 H new ATOM 0 HA MET B 1 25.345 24.812 26.719 1.00 63.32 H new ATOM 0 HB2 MET B 1 23.675 23.023 26.627 1.00 41.04 H new ATOM 0 HB3 MET B 1 24.040 23.578 25.006 1.00 41.04 H new ATOM 0 HG2 MET B 1 25.574 21.646 24.695 1.00 5.33 H new ATOM 0 HG3 MET B 1 25.191 21.087 26.311 1.00 5.33 H new ATOM 0 HE1 MET B 1 22.163 19.302 26.301 1.00 72.42 H new ATOM 0 HE2 MET B 1 23.116 20.530 27.168 1.00 72.42 H new ATOM 0 HE3 MET B 1 21.591 20.986 26.371 1.00 72.42 H new ATOM 2038 N ASN B 2 25.422 22.908 28.625 1.00 33.33 N ATOM 2039 CA ASN B 2 25.835 22.235 29.852 1.00 51.30 C ATOM 2040 C ASN B 2 25.411 20.774 29.804 1.00 60.31 C ATOM 2041 O ASN B 2 24.320 20.412 30.246 1.00 61.35 O ATOM 2042 CB ASN B 2 25.245 22.929 31.090 1.00 21.53 C ATOM 2043 CG ASN B 2 25.641 22.241 32.389 1.00 32.42 C ATOM 2044 OD1 ASN B 2 26.688 21.602 32.475 1.00 51.33 O ATOM 2045 ND2 ASN B 2 24.816 22.385 33.414 1.00 42.33 N ATOM 0 H ASN B 2 24.452 23.223 28.629 1.00 33.33 H new ATOM 0 HA ASN B 2 26.921 22.289 29.929 1.00 51.30 H new ATOM 0 HB2 ASN B 2 25.580 23.966 31.115 1.00 21.53 H new ATOM 0 HB3 ASN B 2 24.158 22.947 31.009 1.00 21.53 H new ATOM 0 HD21 ASN B 2 25.040 21.958 34.313 1.00 42.33 H new ATOM 0 HD22 ASN B 2 23.956 22.923 33.305 1.00 42.33 H new ATOM 2052 N ILE B 3 26.260 19.956 29.206 1.00 21.23 N ATOM 2053 CA ILE B 3 26.010 18.530 29.079 1.00 72.42 C ATOM 2054 C ILE B 3 26.103 17.820 30.427 1.00 64.03 C ATOM 2055 O ILE B 3 27.047 18.024 31.188 1.00 40.30 O ATOM 2056 CB ILE B 3 27.020 17.897 28.094 1.00 60.30 C ATOM 2057 CG1 ILE B 3 26.879 18.544 26.710 1.00 50.54 C ATOM 2058 CG2 ILE B 3 26.827 16.388 28.006 1.00 62.10 C ATOM 2059 CD1 ILE B 3 25.563 18.232 26.031 1.00 13.01 C ATOM 0 H ILE B 3 27.142 20.261 28.795 1.00 21.23 H new ATOM 0 HA ILE B 3 24.996 18.408 28.697 1.00 72.42 H new ATOM 0 HB ILE B 3 28.028 18.081 28.467 1.00 60.30 H new ATOM 0 HG12 ILE B 3 26.980 19.625 26.810 1.00 50.54 H new ATOM 0 HG13 ILE B 3 27.697 18.205 26.074 1.00 50.54 H new ATOM 0 HG21 ILE B 3 27.550 15.969 27.306 1.00 62.10 H new ATOM 0 HG22 ILE B 3 26.975 15.944 28.990 1.00 62.10 H new ATOM 0 HG23 ILE B 3 25.817 16.170 27.658 1.00 62.10 H new ATOM 0 HD11 ILE B 3 25.531 18.721 25.057 1.00 13.01 H new ATOM 0 HD12 ILE B 3 25.468 17.154 25.899 1.00 13.01 H new ATOM 0 HD13 ILE B 3 24.741 18.596 26.647 1.00 13.01 H new ATOM 2071 N LEU B 4 25.105 16.991 30.708 1.00 23.11 N ATOM 2072 CA LEU B 4 25.099 16.144 31.894 1.00 23.43 C ATOM 2073 C LEU B 4 25.735 14.796 31.576 1.00 41.14 C ATOM 2074 O LEU B 4 26.430 14.212 32.410 1.00 62.34 O ATOM 2075 CB LEU B 4 23.668 15.931 32.401 1.00 50.44 C ATOM 2076 CG LEU B 4 22.908 17.210 32.773 1.00 31.23 C ATOM 2077 CD1 LEU B 4 21.478 16.880 33.198 1.00 75.25 C ATOM 2078 CD2 LEU B 4 23.641 17.981 33.873 1.00 11.04 C ATOM 0 H LEU B 4 24.278 16.887 30.120 1.00 23.11 H new ATOM 0 HA LEU B 4 25.676 16.642 32.673 1.00 23.43 H new ATOM 0 HB2 LEU B 4 23.103 15.402 31.633 1.00 50.44 H new ATOM 0 HB3 LEU B 4 23.703 15.281 33.275 1.00 50.44 H new ATOM 0 HG LEU B 4 22.863 17.849 31.891 1.00 31.23 H new ATOM 0 HD11 LEU B 4 20.954 17.800 33.458 1.00 75.25 H new ATOM 0 HD12 LEU B 4 20.959 16.387 32.376 1.00 75.25 H new ATOM 0 HD13 LEU B 4 21.499 16.217 34.063 1.00 75.25 H new ATOM 0 HD21 LEU B 4 23.082 18.884 34.119 1.00 11.04 H new ATOM 0 HD22 LEU B 4 23.727 17.354 34.761 1.00 11.04 H new ATOM 0 HD23 LEU B 4 24.637 18.255 33.524 1.00 11.04 H new ATOM 2090 N TYR B 5 25.485 14.300 30.363 1.00 23.42 N ATOM 2091 CA TYR B 5 26.031 13.006 29.939 1.00 44.15 C ATOM 2092 C TYR B 5 26.419 13.047 28.461 1.00 24.15 C ATOM 2093 O TYR B 5 25.627 13.476 27.634 1.00 75.34 O ATOM 2094 CB TYR B 5 24.985 11.902 30.174 1.00 21.21 C ATOM 2095 CG TYR B 5 25.500 10.491 29.945 1.00 10.12 C ATOM 2096 CD1 TYR B 5 25.756 10.016 28.660 1.00 52.12 C ATOM 2097 CD2 TYR B 5 25.733 9.639 31.016 1.00 71.12 C ATOM 2098 CE1 TYR B 5 26.232 8.739 28.452 1.00 75.45 C ATOM 2099 CE2 TYR B 5 26.208 8.356 30.814 1.00 10.31 C ATOM 2100 CZ TYR B 5 26.458 7.914 29.529 1.00 52.51 C ATOM 2101 OH TYR B 5 26.929 6.637 29.319 1.00 25.44 O ATOM 0 H TYR B 5 24.913 14.769 29.661 1.00 23.42 H new ATOM 0 HA TYR B 5 26.924 12.792 30.526 1.00 44.15 H new ATOM 0 HB2 TYR B 5 24.616 11.980 31.197 1.00 21.21 H new ATOM 0 HB3 TYR B 5 24.135 12.077 29.514 1.00 21.21 H new ATOM 0 HD1 TYR B 5 25.578 10.660 27.812 1.00 52.12 H new ATOM 0 HD2 TYR B 5 25.541 9.983 32.021 1.00 71.12 H new ATOM 0 HE1 TYR B 5 26.426 8.388 27.449 1.00 75.45 H new ATOM 0 HE2 TYR B 5 26.383 7.703 31.656 1.00 10.31 H new ATOM 0 HH TYR B 5 26.251 6.113 28.843 1.00 25.44 H new ATOM 2111 N LYS B 6 27.635 12.613 28.129 1.00 30.03 N ATOM 2112 CA LYS B 6 28.049 12.501 26.732 1.00 63.12 C ATOM 2113 C LYS B 6 28.922 11.267 26.506 1.00 12.41 C ATOM 2114 O LYS B 6 29.763 10.918 27.337 1.00 54.02 O ATOM 2115 CB LYS B 6 28.777 13.775 26.272 1.00 22.40 C ATOM 2116 CG LYS B 6 29.399 13.670 24.879 1.00 43.31 C ATOM 2117 CD LYS B 6 29.770 15.038 24.312 1.00 65.01 C ATOM 2118 CE LYS B 6 28.537 15.816 23.852 1.00 23.11 C ATOM 2119 NZ LYS B 6 28.893 17.115 23.223 1.00 52.41 N1+ ATOM 0 H LYS B 6 28.347 12.335 28.805 1.00 30.03 H new ATOM 0 HA LYS B 6 27.148 12.385 26.130 1.00 63.12 H new ATOM 0 HB2 LYS B 6 28.073 14.607 26.282 1.00 22.40 H new ATOM 0 HB3 LYS B 6 29.561 14.012 26.991 1.00 22.40 H new ATOM 0 HG2 LYS B 6 30.290 13.044 24.926 1.00 43.31 H new ATOM 0 HG3 LYS B 6 28.698 13.177 24.206 1.00 43.31 H new ATOM 0 HD2 LYS B 6 30.301 15.614 25.070 1.00 65.01 H new ATOM 0 HD3 LYS B 6 30.453 14.910 23.472 1.00 65.01 H new ATOM 0 HE2 LYS B 6 27.974 15.212 23.140 1.00 23.11 H new ATOM 0 HE3 LYS B 6 27.883 15.995 24.706 1.00 23.11 H new ATOM 0 HZ1 LYS B 6 28.053 17.520 22.763 1.00 52.41 H new ATOM 0 HZ2 LYS B 6 29.238 17.771 23.953 1.00 52.41 H new ATOM 0 HZ3 LYS B 6 29.638 16.964 22.513 1.00 52.41 H new ATOM 2133 N THR B 7 28.687 10.603 25.382 1.00 10.14 N ATOM 2134 CA THR B 7 29.462 9.434 24.977 1.00 42.05 C ATOM 2135 C THR B 7 29.775 9.514 23.476 1.00 63.52 C ATOM 2136 O THR B 7 28.985 10.061 22.697 1.00 72.52 O ATOM 2137 CB THR B 7 28.700 8.122 25.307 1.00 0.35 C ATOM 2138 OG1 THR B 7 29.482 6.974 24.942 1.00 0.11 O ATOM 2139 CG2 THR B 7 27.345 8.069 24.603 1.00 24.11 C ATOM 0 H THR B 7 27.952 10.859 24.723 1.00 10.14 H new ATOM 0 HA THR B 7 30.398 9.425 25.535 1.00 42.05 H new ATOM 0 HB THR B 7 28.528 8.109 26.383 1.00 0.35 H new ATOM 0 HG1 THR B 7 28.897 6.290 24.554 1.00 0.11 H new ATOM 0 HG21 THR B 7 26.839 7.137 24.857 1.00 24.11 H new ATOM 0 HG22 THR B 7 26.734 8.913 24.925 1.00 24.11 H new ATOM 0 HG23 THR B 7 27.493 8.119 23.524 1.00 24.11 H new ATOM 2147 N ALA B 8 30.934 8.989 23.073 1.00 4.15 N ATOM 2148 CA ALA B 8 31.380 9.084 21.681 1.00 51.31 C ATOM 2149 C ALA B 8 31.376 7.719 20.991 1.00 33.43 C ATOM 2150 O ALA B 8 31.737 6.702 21.589 1.00 64.22 O ATOM 2151 CB ALA B 8 32.771 9.704 21.618 1.00 24.44 C ATOM 0 H ALA B 8 31.580 8.495 23.689 1.00 4.15 H new ATOM 0 HA ALA B 8 30.676 9.724 21.149 1.00 51.31 H new ATOM 0 HB1 ALA B 8 33.093 9.770 20.579 1.00 24.44 H new ATOM 0 HB2 ALA B 8 32.744 10.703 22.054 1.00 24.44 H new ATOM 0 HB3 ALA B 8 33.472 9.083 22.176 1.00 24.44 H new ATOM 2157 N ALA B 9 30.973 7.711 19.722 1.00 21.22 N ATOM 2158 CA ALA B 9 30.952 6.499 18.913 1.00 20.22 C ATOM 2159 C ALA B 9 31.614 6.751 17.560 1.00 31.45 C ATOM 2160 O ALA B 9 31.154 7.582 16.782 1.00 1.21 O ATOM 2161 CB ALA B 9 29.520 6.006 18.732 1.00 3.15 C ATOM 0 H ALA B 9 30.653 8.544 19.228 1.00 21.22 H new ATOM 0 HA ALA B 9 31.517 5.724 19.430 1.00 20.22 H new ATOM 0 HB1 ALA B 9 29.521 5.100 18.126 1.00 3.15 H new ATOM 0 HB2 ALA B 9 29.084 5.789 19.707 1.00 3.15 H new ATOM 0 HB3 ALA B 9 28.931 6.776 18.234 1.00 3.15 H new ATOM 2167 N THR B 10 32.696 6.036 17.295 1.00 33.23 N ATOM 2168 CA THR B 10 33.446 6.174 16.057 1.00 64.31 C ATOM 2169 C THR B 10 33.067 5.058 15.086 1.00 63.33 C ATOM 2170 O THR B 10 33.279 3.878 15.368 1.00 30.04 O ATOM 2171 CB THR B 10 34.965 6.125 16.333 1.00 62.43 C ATOM 2172 OG1 THR B 10 35.320 7.145 17.279 1.00 21.44 O ATOM 2173 CG2 THR B 10 35.772 6.316 15.054 1.00 23.24 C ATOM 0 H THR B 10 33.080 5.341 17.935 1.00 33.23 H new ATOM 0 HA THR B 10 33.199 7.139 15.613 1.00 64.31 H new ATOM 0 HB THR B 10 35.199 5.141 16.740 1.00 62.43 H new ATOM 0 HG1 THR B 10 36.284 7.109 17.452 1.00 21.44 H new ATOM 0 HG21 THR B 10 36.836 6.276 15.286 1.00 23.24 H new ATOM 0 HG22 THR B 10 35.525 5.525 14.346 1.00 23.24 H new ATOM 0 HG23 THR B 10 35.533 7.284 14.614 1.00 23.24 H new ATOM 2181 N SER B 11 32.477 5.431 13.963 1.00 64.42 N ATOM 2182 CA SER B 11 32.092 4.475 12.936 1.00 20.54 C ATOM 2183 C SER B 11 33.031 4.562 11.728 1.00 44.42 C ATOM 2184 O SER B 11 33.078 5.577 11.028 1.00 74.01 O ATOM 2185 CB SER B 11 30.634 4.712 12.531 1.00 74.14 C ATOM 2186 OG SER B 11 30.396 6.073 12.215 1.00 11.25 O ATOM 0 H SER B 11 32.252 6.400 13.737 1.00 64.42 H new ATOM 0 HA SER B 11 32.179 3.466 13.339 1.00 20.54 H new ATOM 0 HB2 SER B 11 30.389 4.090 11.670 1.00 74.14 H new ATOM 0 HB3 SER B 11 29.975 4.406 13.344 1.00 74.14 H new ATOM 0 HG SER B 11 29.644 6.406 12.748 1.00 11.25 H new ATOM 2192 N THR B 12 33.796 3.499 11.508 1.00 44.31 N ATOM 2193 CA THR B 12 34.737 3.428 10.400 1.00 14.13 C ATOM 2194 C THR B 12 34.024 3.041 9.105 1.00 53.42 C ATOM 2195 O THR B 12 32.962 2.391 9.128 1.00 32.44 O ATOM 2196 CB THR B 12 35.835 2.379 10.682 1.00 2.30 C ATOM 2197 OG1 THR B 12 36.207 2.427 12.069 1.00 14.42 O ATOM 2198 CG2 THR B 12 37.069 2.622 9.813 1.00 31.31 C ATOM 0 H THR B 12 33.780 2.664 12.093 1.00 44.31 H new ATOM 0 HA THR B 12 35.186 4.415 10.292 1.00 14.13 H new ATOM 0 HB THR B 12 35.434 1.395 10.440 1.00 2.30 H new ATOM 0 HG1 THR B 12 36.902 1.759 12.244 1.00 14.42 H new ATOM 0 HG21 THR B 12 37.824 1.868 10.034 1.00 31.31 H new ATOM 0 HG22 THR B 12 36.791 2.559 8.761 1.00 31.31 H new ATOM 0 HG23 THR B 12 37.473 3.612 10.023 1.00 31.31 H new ATOM 2206 N GLY B 13 34.622 3.435 7.982 1.00 25.11 N ATOM 2207 CA GLY B 13 34.125 3.038 6.684 1.00 71.12 C ATOM 2208 C GLY B 13 34.421 1.583 6.396 1.00 70.11 C ATOM 2209 O GLY B 13 35.350 1.262 5.649 1.00 42.34 O ATOM 0 H GLY B 13 35.451 4.029 7.954 1.00 25.11 H new ATOM 0 HA2 GLY B 13 33.049 3.207 6.638 1.00 71.12 H new ATOM 0 HA3 GLY B 13 34.579 3.662 5.914 1.00 71.12 H new ATOM 2213 N GLY B 14 33.663 0.697 7.039 1.00 21.54 N ATOM 2214 CA GLY B 14 33.759 -0.724 6.756 1.00 31.21 C ATOM 2215 C GLY B 14 33.292 -1.055 5.353 1.00 73.40 C ATOM 2216 O GLY B 14 33.396 -0.227 4.446 1.00 13.01 O ATOM 0 H GLY B 14 32.980 0.942 7.756 1.00 21.54 H new ATOM 0 HA2 GLY B 14 34.792 -1.050 6.881 1.00 31.21 H new ATOM 0 HA3 GLY B 14 33.160 -1.279 7.478 1.00 31.21 H new ATOM 2220 N ARG B 15 32.781 -2.263 5.155 1.00 12.42 N ATOM 2221 CA ARG B 15 32.256 -2.641 3.848 1.00 62.32 C ATOM 2222 C ARG B 15 30.954 -1.898 3.561 1.00 53.41 C ATOM 2223 O ARG B 15 30.725 -1.462 2.434 1.00 34.04 O ATOM 2224 CB ARG B 15 32.098 -4.166 3.733 1.00 22.32 C ATOM 2225 CG ARG B 15 33.439 -4.869 3.531 1.00 23.03 C ATOM 2226 CD ARG B 15 33.303 -6.365 3.266 1.00 52.22 C ATOM 2227 NE ARG B 15 34.559 -6.919 2.749 1.00 65.14 N ATOM 2228 CZ ARG B 15 35.141 -8.040 3.179 1.00 55.23 C ATOM 2229 NH1 ARG B 15 34.566 -8.789 4.114 1.00 21.14 N1+ ATOM 2230 NH2 ARG B 15 36.302 -8.416 2.659 1.00 51.30 N ATOM 0 H ARG B 15 32.719 -2.988 5.869 1.00 12.42 H new ATOM 0 HA ARG B 15 32.975 -2.344 3.084 1.00 62.32 H new ATOM 0 HB2 ARG B 15 31.620 -4.550 4.635 1.00 22.32 H new ATOM 0 HB3 ARG B 15 31.437 -4.400 2.898 1.00 22.32 H new ATOM 0 HG2 ARG B 15 33.962 -4.405 2.695 1.00 23.03 H new ATOM 0 HG3 ARG B 15 34.057 -4.719 4.416 1.00 23.03 H new ATOM 0 HD2 ARG B 15 33.026 -6.878 4.187 1.00 52.22 H new ATOM 0 HD3 ARG B 15 32.501 -6.540 2.549 1.00 52.22 H new ATOM 0 HE ARG B 15 35.025 -6.406 2.001 1.00 65.14 H new ATOM 0 HH11 ARG B 15 33.669 -8.509 4.512 1.00 21.14 H new ATOM 0 HH12 ARG B 15 35.021 -9.644 4.434 1.00 21.14 H new ATOM 0 HH21 ARG B 15 36.744 -7.849 1.935 1.00 51.30 H new ATOM 0 HH22 ARG B 15 36.753 -9.272 2.983 1.00 51.30 H new ATOM 2244 N ASP B 16 30.100 -1.760 4.576 1.00 43.23 N ATOM 2245 CA ASP B 16 28.947 -0.860 4.479 1.00 64.45 C ATOM 2246 C ASP B 16 28.949 0.113 5.659 1.00 45.23 C ATOM 2247 O ASP B 16 28.738 1.315 5.485 1.00 44.01 O ATOM 2248 CB ASP B 16 27.660 -1.677 4.458 1.00 65.33 C ATOM 2249 CG ASP B 16 26.408 -0.839 4.215 1.00 54.31 C ATOM 2250 OD1 ASP B 16 25.955 -0.761 3.053 1.00 24.34 O ATOM 2251 OD2 ASP B 16 25.842 -0.303 5.188 1.00 12.23 O1- ATOM 0 H ASP B 16 30.182 -2.253 5.465 1.00 43.23 H new ATOM 0 HA ASP B 16 29.010 -0.284 3.556 1.00 64.45 H new ATOM 0 HB2 ASP B 16 27.735 -2.437 3.680 1.00 65.33 H new ATOM 0 HB3 ASP B 16 27.557 -2.202 5.408 1.00 65.33 H new ATOM 2256 N GLY B 17 29.230 -0.405 6.863 1.00 22.41 N ATOM 2257 CA GLY B 17 29.585 0.470 7.973 1.00 74.22 C ATOM 2258 C GLY B 17 30.149 -0.299 9.153 1.00 32.04 C ATOM 2259 O GLY B 17 29.745 -1.433 9.400 1.00 11.23 O ATOM 0 H GLY B 17 29.218 -1.401 7.084 1.00 22.41 H new ATOM 0 HA2 GLY B 17 30.318 1.203 7.635 1.00 74.22 H new ATOM 0 HA3 GLY B 17 28.703 1.025 8.292 1.00 74.22 H new ATOM 2263 N ARG B 18 31.089 0.303 9.881 1.00 41.41 N ATOM 2264 CA ARG B 18 31.675 -0.333 11.062 1.00 45.30 C ATOM 2265 C ARG B 18 31.545 0.616 12.254 1.00 1.35 C ATOM 2266 O ARG B 18 32.285 1.583 12.353 1.00 0.54 O ATOM 2267 CB ARG B 18 33.154 -0.680 10.784 1.00 74.40 C ATOM 2268 CG ARG B 18 33.769 -1.743 11.707 1.00 53.04 C ATOM 2269 CD ARG B 18 33.980 -1.251 13.138 1.00 43.11 C ATOM 2270 NE ARG B 18 34.851 -2.155 13.896 1.00 64.22 N ATOM 2271 CZ ARG B 18 34.423 -3.170 14.651 1.00 63.34 C ATOM 2272 NH1 ARG B 18 33.127 -3.404 14.798 1.00 23.22 N1+ ATOM 2273 NH2 ARG B 18 35.303 -3.948 15.266 1.00 54.01 N ATOM 0 H ARG B 18 31.461 1.230 9.674 1.00 41.41 H new ATOM 0 HA ARG B 18 31.148 -1.259 11.293 1.00 45.30 H new ATOM 0 HB2 ARG B 18 33.241 -1.025 9.754 1.00 74.40 H new ATOM 0 HB3 ARG B 18 33.745 0.232 10.866 1.00 74.40 H new ATOM 0 HG2 ARG B 18 33.121 -2.619 11.723 1.00 53.04 H new ATOM 0 HG3 ARG B 18 34.726 -2.062 11.295 1.00 53.04 H new ATOM 0 HD2 ARG B 18 34.418 -0.253 13.120 1.00 43.11 H new ATOM 0 HD3 ARG B 18 33.016 -1.167 13.640 1.00 43.11 H new ATOM 0 HE ARG B 18 35.857 -1.997 13.843 1.00 64.22 H new ATOM 0 HH11 ARG B 18 32.445 -2.806 14.332 1.00 23.22 H new ATOM 0 HH12 ARG B 18 32.812 -4.182 15.377 1.00 23.22 H new ATOM 0 HH21 ARG B 18 36.302 -3.770 15.161 1.00 54.01 H new ATOM 0 HH22 ARG B 18 34.981 -4.724 15.844 1.00 54.01 H new ATOM 2287 N ALA B 19 30.606 0.337 13.152 1.00 25.44 N ATOM 2288 CA ALA B 19 30.304 1.254 14.252 1.00 25.14 C ATOM 2289 C ALA B 19 30.926 0.765 15.556 1.00 64.21 C ATOM 2290 O ALA B 19 30.651 -0.344 16.006 1.00 14.23 O ATOM 2291 CB ALA B 19 28.792 1.413 14.406 1.00 63.23 C ATOM 0 H ALA B 19 30.041 -0.512 13.143 1.00 25.44 H new ATOM 0 HA ALA B 19 30.737 2.226 14.017 1.00 25.14 H new ATOM 0 HB1 ALA B 19 28.580 2.097 15.227 1.00 63.23 H new ATOM 0 HB2 ALA B 19 28.372 1.813 13.483 1.00 63.23 H new ATOM 0 HB3 ALA B 19 28.344 0.442 14.618 1.00 63.23 H new ATOM 2297 N THR B 20 31.740 1.610 16.171 1.00 63.15 N ATOM 2298 CA THR B 20 32.441 1.269 17.403 1.00 31.24 C ATOM 2299 C THR B 20 32.327 2.408 18.405 1.00 2.34 C ATOM 2300 O THR B 20 32.838 3.498 18.172 1.00 75.11 O ATOM 2301 CB THR B 20 33.934 0.981 17.107 1.00 15.15 C ATOM 2302 OG1 THR B 20 34.039 -0.104 16.173 1.00 53.32 O ATOM 2303 CG2 THR B 20 34.713 0.637 18.375 1.00 14.05 C ATOM 0 H THR B 20 31.934 2.552 15.831 1.00 63.15 H new ATOM 0 HA THR B 20 31.983 0.375 17.827 1.00 31.24 H new ATOM 0 HB THR B 20 34.368 1.887 16.685 1.00 15.15 H new ATOM 0 HG1 THR B 20 34.984 -0.284 15.985 1.00 53.32 H new ATOM 0 HG21 THR B 20 35.755 0.443 18.120 1.00 14.05 H new ATOM 0 HG22 THR B 20 34.660 1.473 19.073 1.00 14.05 H new ATOM 0 HG23 THR B 20 34.281 -0.250 18.838 1.00 14.05 H new ATOM 2311 N SER B 21 31.653 2.159 19.522 1.00 21.31 N ATOM 2312 CA SER B 21 31.569 3.157 20.571 1.00 32.44 C ATOM 2313 C SER B 21 32.962 3.380 21.116 1.00 11.23 C ATOM 2314 O SER B 21 33.501 2.494 21.813 1.00 42.34 O ATOM 2315 CB SER B 21 30.620 2.743 21.697 1.00 31.41 C ATOM 2316 OG SER B 21 30.819 3.548 22.847 1.00 74.21 O ATOM 0 H SER B 21 31.164 1.286 19.719 1.00 21.31 H new ATOM 0 HA SER B 21 31.163 4.076 20.148 1.00 32.44 H new ATOM 0 HB2 SER B 21 29.587 2.833 21.359 1.00 31.41 H new ATOM 0 HB3 SER B 21 30.783 1.695 21.949 1.00 31.41 H new ATOM 0 HG SER B 21 29.974 3.636 23.335 1.00 74.21 H new ATOM 2322 N HIS B 22 33.498 4.568 20.776 1.00 5.04 N ATOM 2323 CA HIS B 22 34.892 4.972 20.999 1.00 32.51 C ATOM 2324 C HIS B 22 35.293 4.857 22.458 1.00 35.24 C ATOM 2325 O HIS B 22 36.479 4.774 22.788 1.00 73.12 O ATOM 2326 CB HIS B 22 35.069 6.424 20.525 1.00 3.43 C ATOM 2327 CG HIS B 22 36.389 7.047 20.890 1.00 12.52 C ATOM 2328 ND1 HIS B 22 36.593 7.740 22.067 1.00 31.42 N ATOM 2329 CD2 HIS B 22 37.569 7.085 20.226 1.00 34.34 C ATOM 2330 CE1 HIS B 22 37.839 8.176 22.106 1.00 23.12 C ATOM 2331 NE2 HIS B 22 38.453 7.794 21.003 1.00 12.42 N ATOM 0 H HIS B 22 32.948 5.297 20.322 1.00 5.04 H new ATOM 0 HA HIS B 22 35.537 4.301 20.432 1.00 32.51 H new ATOM 0 HB2 HIS B 22 34.955 6.455 19.441 1.00 3.43 H new ATOM 0 HB3 HIS B 22 34.267 7.030 20.947 1.00 3.43 H new ATOM 0 HD2 HIS B 22 37.777 6.640 19.264 1.00 34.34 H new ATOM 0 HE1 HIS B 22 38.281 8.750 22.907 1.00 23.12 H new ATOM 0 HE2 HIS B 22 39.425 7.992 20.766 1.00 12.42 H new ATOM 2340 N ASP B 23 34.305 4.834 23.327 1.00 44.12 N ATOM 2341 CA ASP B 23 34.544 4.706 24.757 1.00 0.24 C ATOM 2342 C ASP B 23 34.797 3.239 25.102 1.00 62.21 C ATOM 2343 O ASP B 23 34.751 2.839 26.268 1.00 40.03 O ATOM 2344 CB ASP B 23 33.342 5.254 25.537 1.00 12.04 C ATOM 2345 CG ASP B 23 33.017 6.712 25.214 1.00 5.31 C ATOM 2346 OD1 ASP B 23 33.679 7.313 24.341 1.00 63.54 O ATOM 2347 OD2 ASP B 23 32.071 7.256 25.823 1.00 33.23 O1- ATOM 0 H ASP B 23 33.320 4.903 23.070 1.00 44.12 H new ATOM 0 HA ASP B 23 35.424 5.285 25.036 1.00 0.24 H new ATOM 0 HB2 ASP B 23 32.468 4.639 25.321 1.00 12.04 H new ATOM 0 HB3 ASP B 23 33.540 5.162 26.605 1.00 12.04 H new ATOM 2352 N GLN B 24 35.051 2.447 24.052 1.00 3.35 N ATOM 2353 CA GLN B 24 35.353 1.025 24.169 1.00 64.10 C ATOM 2354 C GLN B 24 34.130 0.292 24.686 1.00 11.02 C ATOM 2355 O GLN B 24 34.224 -0.795 25.257 1.00 0.33 O ATOM 2356 CB GLN B 24 36.580 0.785 25.066 1.00 41.34 C ATOM 2357 CG GLN B 24 37.848 1.475 24.564 1.00 71.43 C ATOM 2358 CD GLN B 24 38.163 1.152 23.109 1.00 54.02 C ATOM 2359 OE1 GLN B 24 38.851 0.176 22.808 1.00 54.01 O ATOM 2360 NE2 GLN B 24 37.674 1.980 22.195 1.00 4.32 N ATOM 0 H GLN B 24 35.051 2.785 23.090 1.00 3.35 H new ATOM 0 HA GLN B 24 35.605 0.633 23.184 1.00 64.10 H new ATOM 0 HB2 GLN B 24 36.358 1.138 26.073 1.00 41.34 H new ATOM 0 HB3 GLN B 24 36.764 -0.287 25.137 1.00 41.34 H new ATOM 0 HG2 GLN B 24 37.737 2.554 24.676 1.00 71.43 H new ATOM 0 HG3 GLN B 24 38.690 1.175 25.188 1.00 71.43 H new ATOM 0 HE21 GLN B 24 37.108 2.779 22.481 1.00 4.32 H new ATOM 0 HE22 GLN B 24 37.864 1.818 21.206 1.00 4.32 H new ATOM 2369 N LYS B 25 32.972 0.902 24.453 1.00 34.11 N ATOM 2370 CA LYS B 25 31.710 0.343 24.892 1.00 33.22 C ATOM 2371 C LYS B 25 31.060 -0.492 23.796 1.00 40.01 C ATOM 2372 O LYS B 25 30.246 -1.365 24.104 1.00 34.42 O ATOM 2373 CB LYS B 25 30.744 1.446 25.356 1.00 20.21 C ATOM 2374 CG LYS B 25 31.076 2.036 26.727 1.00 22.43 C ATOM 2375 CD LYS B 25 29.941 2.924 27.245 1.00 41.25 C ATOM 2376 CE LYS B 25 29.844 4.248 26.488 1.00 25.52 C ATOM 2377 NZ LYS B 25 30.705 5.296 27.097 1.00 5.33 N1+ ATOM 0 H LYS B 25 32.888 1.790 23.958 1.00 34.11 H new ATOM 0 HA LYS B 25 31.926 -0.309 25.739 1.00 33.22 H new ATOM 0 HB2 LYS B 25 30.745 2.248 24.618 1.00 20.21 H new ATOM 0 HB3 LYS B 25 29.733 1.040 25.383 1.00 20.21 H new ATOM 0 HG2 LYS B 25 31.261 1.229 27.436 1.00 22.43 H new ATOM 0 HG3 LYS B 25 31.994 2.619 26.661 1.00 22.43 H new ATOM 0 HD2 LYS B 25 28.996 2.389 27.157 1.00 41.25 H new ATOM 0 HD3 LYS B 25 30.096 3.125 28.305 1.00 41.25 H new ATOM 0 HE2 LYS B 25 30.137 4.095 25.449 1.00 25.52 H new ATOM 0 HE3 LYS B 25 28.808 4.587 26.480 1.00 25.52 H new ATOM 0 HZ1 LYS B 25 30.926 6.021 26.385 1.00 5.33 H new ATOM 0 HZ2 LYS B 25 30.204 5.736 27.895 1.00 5.33 H new ATOM 0 HZ3 LYS B 25 31.588 4.865 27.438 1.00 5.33 H new ATOM 2391 N LEU B 26 31.385 -0.243 22.516 1.00 71.52 N ATOM 2392 CA LEU B 26 30.732 -1.016 21.452 1.00 40.15 C ATOM 2393 C LEU B 26 31.631 -1.210 20.267 1.00 62.33 C ATOM 2394 O LEU B 26 32.448 -0.357 19.954 1.00 50.50 O ATOM 2395 CB LEU B 26 29.422 -0.331 21.036 1.00 64.14 C ATOM 2396 CG LEU B 26 28.729 -0.892 19.785 1.00 70.42 C ATOM 2397 CD1 LEU B 26 28.229 -2.315 20.016 1.00 23.12 C ATOM 2398 CD2 LEU B 26 27.591 0.031 19.366 1.00 31.22 C ATOM 0 H LEU B 26 32.063 0.453 22.204 1.00 71.52 H new ATOM 0 HA LEU B 26 30.508 -2.007 21.847 1.00 40.15 H new ATOM 0 HB2 LEU B 26 28.724 -0.392 21.871 1.00 64.14 H new ATOM 0 HB3 LEU B 26 29.627 0.726 20.869 1.00 64.14 H new ATOM 0 HG LEU B 26 29.459 -0.937 18.976 1.00 70.42 H new ATOM 0 HD11 LEU B 26 27.744 -2.682 19.111 1.00 23.12 H new ATOM 0 HD12 LEU B 26 29.071 -2.961 20.263 1.00 23.12 H new ATOM 0 HD13 LEU B 26 27.514 -2.320 20.839 1.00 23.12 H new ATOM 0 HD21 LEU B 26 27.104 -0.372 18.478 1.00 31.22 H new ATOM 0 HD22 LEU B 26 26.866 0.105 20.176 1.00 31.22 H new ATOM 0 HD23 LEU B 26 27.989 1.021 19.143 1.00 31.22 H new ATOM 2410 N ASP B 27 31.471 -2.356 19.627 1.00 22.45 N ATOM 2411 CA ASP B 27 32.226 -2.701 18.447 1.00 53.33 C ATOM 2412 C ASP B 27 31.393 -3.632 17.555 1.00 42.15 C ATOM 2413 O ASP B 27 31.276 -4.830 17.810 1.00 22.10 O ATOM 2414 CB ASP B 27 33.565 -3.340 18.855 1.00 24.13 C ATOM 2415 CG ASP B 27 33.429 -4.729 19.466 1.00 15.20 C ATOM 2416 OD1 ASP B 27 32.947 -4.836 20.615 1.00 3.40 O ATOM 2417 OD2 ASP B 27 33.800 -5.720 18.797 1.00 21.30 O1- ATOM 0 H ASP B 27 30.808 -3.074 19.918 1.00 22.45 H new ATOM 0 HA ASP B 27 32.451 -1.803 17.871 1.00 53.33 H new ATOM 0 HB2 ASP B 27 34.208 -3.402 17.977 1.00 24.13 H new ATOM 0 HB3 ASP B 27 34.064 -2.687 19.571 1.00 24.13 H new ATOM 2422 N VAL B 28 30.758 -3.051 16.543 1.00 42.42 N ATOM 2423 CA VAL B 28 29.950 -3.803 15.577 1.00 61.03 C ATOM 2424 C VAL B 28 30.072 -3.221 14.176 1.00 62.05 C ATOM 2425 O VAL B 28 30.770 -2.232 13.951 1.00 71.42 O ATOM 2426 CB VAL B 28 28.448 -3.854 15.961 1.00 35.33 C ATOM 2427 CG1 VAL B 28 28.210 -4.885 17.056 1.00 44.41 C ATOM 2428 CG2 VAL B 28 27.944 -2.470 16.375 1.00 74.12 C ATOM 0 H VAL B 28 30.786 -2.047 16.365 1.00 42.42 H new ATOM 0 HA VAL B 28 30.347 -4.818 15.594 1.00 61.03 H new ATOM 0 HB VAL B 28 27.878 -4.162 15.084 1.00 35.33 H new ATOM 0 HG11 VAL B 28 27.151 -4.906 17.312 1.00 44.41 H new ATOM 0 HG12 VAL B 28 28.518 -5.869 16.702 1.00 44.41 H new ATOM 0 HG13 VAL B 28 28.791 -4.619 17.939 1.00 44.41 H new ATOM 0 HG21 VAL B 28 26.888 -2.531 16.640 1.00 74.12 H new ATOM 0 HG22 VAL B 28 28.514 -2.117 17.235 1.00 74.12 H new ATOM 0 HG23 VAL B 28 28.070 -1.774 15.546 1.00 74.12 H new ATOM 2438 N LYS B 29 29.402 -3.865 13.237 1.00 64.31 N ATOM 2439 CA LYS B 29 29.423 -3.463 11.843 1.00 24.45 C ATOM 2440 C LYS B 29 28.074 -3.763 11.204 1.00 31.35 C ATOM 2441 O LYS B 29 27.453 -4.789 11.498 1.00 25.23 O ATOM 2442 CB LYS B 29 30.580 -4.183 11.127 1.00 11.40 C ATOM 2443 CG LYS B 29 30.364 -4.494 9.638 1.00 53.23 C ATOM 2444 CD LYS B 29 29.745 -5.875 9.407 1.00 3.25 C ATOM 2445 CE LYS B 29 30.524 -6.981 10.116 1.00 32.51 C ATOM 2446 NZ LYS B 29 31.970 -6.977 9.756 1.00 50.55 N1+ ATOM 0 H LYS B 29 28.825 -4.686 13.422 1.00 64.31 H new ATOM 0 HA LYS B 29 29.593 -2.390 11.756 1.00 24.45 H new ATOM 0 HB2 LYS B 29 31.477 -3.571 11.223 1.00 11.40 H new ATOM 0 HB3 LYS B 29 30.776 -5.120 11.648 1.00 11.40 H new ATOM 0 HG2 LYS B 29 29.717 -3.733 9.202 1.00 53.23 H new ATOM 0 HG3 LYS B 29 31.320 -4.437 9.117 1.00 53.23 H new ATOM 0 HD2 LYS B 29 28.714 -5.874 9.762 1.00 3.25 H new ATOM 0 HD3 LYS B 29 29.713 -6.083 8.338 1.00 3.25 H new ATOM 0 HE2 LYS B 29 30.420 -6.861 11.194 1.00 32.51 H new ATOM 0 HE3 LYS B 29 30.091 -7.948 9.860 1.00 32.51 H new ATOM 0 HZ1 LYS B 29 32.422 -7.839 10.123 1.00 50.55 H new ATOM 0 HZ2 LYS B 29 32.070 -6.948 8.721 1.00 50.55 H new ATOM 0 HZ3 LYS B 29 32.429 -6.142 10.172 1.00 50.55 H new ATOM 2460 N LEU B 30 27.619 -2.866 10.343 1.00 60.42 N ATOM 2461 CA LEU B 30 26.323 -2.997 9.716 1.00 43.12 C ATOM 2462 C LEU B 30 26.433 -2.909 8.194 1.00 50.11 C ATOM 2463 O LEU B 30 27.475 -2.483 7.642 1.00 72.32 O ATOM 2464 CB LEU B 30 25.317 -1.965 10.283 1.00 4.40 C ATOM 2465 CG LEU B 30 25.797 -0.507 10.480 1.00 61.23 C ATOM 2466 CD1 LEU B 30 26.793 -0.383 11.633 1.00 42.23 C ATOM 2467 CD2 LEU B 30 26.375 0.064 9.191 1.00 52.40 C ATOM 0 H LEU B 30 28.138 -2.033 10.064 1.00 60.42 H new ATOM 0 HA LEU B 30 25.935 -3.987 9.954 1.00 43.12 H new ATOM 0 HB2 LEU B 30 24.452 -1.944 9.620 1.00 4.40 H new ATOM 0 HB3 LEU B 30 24.970 -2.334 11.248 1.00 4.40 H new ATOM 0 HG LEU B 30 24.921 0.084 10.746 1.00 61.23 H new ATOM 0 HD11 LEU B 30 27.103 0.657 11.735 1.00 42.23 H new ATOM 0 HD12 LEU B 30 26.321 -0.714 12.558 1.00 42.23 H new ATOM 0 HD13 LEU B 30 27.665 -1.004 11.428 1.00 42.23 H new ATOM 0 HD21 LEU B 30 26.703 1.089 9.362 1.00 52.40 H new ATOM 0 HD22 LEU B 30 27.225 -0.541 8.874 1.00 52.40 H new ATOM 0 HD23 LEU B 30 25.611 0.053 8.413 1.00 52.40 H new ATOM 2479 N SER B 31 25.352 -3.331 7.533 1.00 24.22 N ATOM 2480 CA SER B 31 25.284 -3.371 6.086 1.00 21.40 C ATOM 2481 C SER B 31 23.838 -3.322 5.598 1.00 43.34 C ATOM 2482 O SER B 31 22.989 -4.074 6.081 1.00 1.33 O ATOM 2483 CB SER B 31 25.987 -4.628 5.561 1.00 62.35 C ATOM 2484 OG SER B 31 25.479 -5.800 6.178 1.00 3.34 O ATOM 0 H SER B 31 24.502 -3.653 7.995 1.00 24.22 H new ATOM 0 HA SER B 31 25.795 -2.491 5.696 1.00 21.40 H new ATOM 0 HB2 SER B 31 25.855 -4.697 4.481 1.00 62.35 H new ATOM 0 HB3 SER B 31 27.058 -4.552 5.747 1.00 62.35 H new ATOM 0 HG SER B 31 25.103 -6.393 5.494 1.00 3.34 H new ATOM 2490 N ALA B 32 23.573 -2.432 4.642 1.00 40.52 N ATOM 2491 CA ALA B 32 22.245 -2.288 4.057 1.00 75.13 C ATOM 2492 C ALA B 32 21.834 -3.553 3.298 1.00 31.44 C ATOM 2493 O ALA B 32 22.669 -4.183 2.631 1.00 42.31 O ATOM 2494 CB ALA B 32 22.210 -1.075 3.131 1.00 44.15 C ATOM 0 H ALA B 32 24.270 -1.795 4.255 1.00 40.52 H new ATOM 0 HA ALA B 32 21.530 -2.138 4.866 1.00 75.13 H new ATOM 0 HB1 ALA B 32 21.214 -0.976 2.699 1.00 44.15 H new ATOM 0 HB2 ALA B 32 22.450 -0.176 3.699 1.00 44.15 H new ATOM 0 HB3 ALA B 32 22.941 -1.206 2.333 1.00 44.15 H new ATOM 2500 N PRO B 33 20.543 -3.942 3.384 1.00 64.54 N ATOM 2501 CA PRO B 33 20.021 -5.128 2.694 1.00 71.30 C ATOM 2502 C PRO B 33 20.302 -5.074 1.189 1.00 44.54 C ATOM 2503 O PRO B 33 19.947 -4.104 0.510 1.00 60.20 O ATOM 2504 CB PRO B 33 18.505 -5.093 2.980 1.00 5.21 C ATOM 2505 CG PRO B 33 18.226 -3.711 3.476 1.00 53.32 C ATOM 2506 CD PRO B 33 19.487 -3.255 4.157 1.00 34.02 C ATOM 0 HA PRO B 33 20.492 -6.048 3.041 1.00 71.30 H new ATOM 0 HB2 PRO B 33 17.930 -5.311 2.080 1.00 5.21 H new ATOM 0 HB3 PRO B 33 18.228 -5.841 3.723 1.00 5.21 H new ATOM 0 HG2 PRO B 33 17.964 -3.046 2.653 1.00 53.32 H new ATOM 0 HG3 PRO B 33 17.385 -3.707 4.169 1.00 53.32 H new ATOM 0 HD2 PRO B 33 19.598 -2.171 4.119 1.00 34.02 H new ATOM 0 HD3 PRO B 33 19.505 -3.541 5.209 1.00 34.02 H new ATOM 2514 N ARG B 34 20.934 -6.123 0.669 1.00 0.10 N ATOM 2515 CA ARG B 34 21.355 -6.154 -0.730 1.00 23.43 C ATOM 2516 C ARG B 34 20.140 -6.150 -1.656 1.00 64.55 C ATOM 2517 O ARG B 34 20.240 -5.780 -2.825 1.00 62.12 O ATOM 2518 CB ARG B 34 22.216 -7.392 -1.000 1.00 33.02 C ATOM 2519 CG ARG B 34 22.931 -7.364 -2.342 1.00 11.34 C ATOM 2520 CD ARG B 34 24.050 -6.334 -2.374 1.00 70.25 C ATOM 2521 NE ARG B 34 24.563 -6.107 -3.726 1.00 41.11 N ATOM 2522 CZ ARG B 34 25.852 -6.178 -4.069 1.00 71.43 C ATOM 2523 NH1 ARG B 34 26.755 -6.641 -3.210 1.00 70.13 N1+ ATOM 2524 NH2 ARG B 34 26.226 -5.821 -5.291 1.00 21.32 N ATOM 0 H ARG B 34 21.166 -6.965 1.196 1.00 0.10 H new ATOM 0 HA ARG B 34 21.948 -5.262 -0.929 1.00 23.43 H new ATOM 0 HB2 ARG B 34 22.957 -7.487 -0.206 1.00 33.02 H new ATOM 0 HB3 ARG B 34 21.584 -8.279 -0.954 1.00 33.02 H new ATOM 0 HG2 ARG B 34 23.342 -8.351 -2.554 1.00 11.34 H new ATOM 0 HG3 ARG B 34 22.212 -7.142 -3.131 1.00 11.34 H new ATOM 0 HD2 ARG B 34 23.685 -5.392 -1.964 1.00 70.25 H new ATOM 0 HD3 ARG B 34 24.865 -6.667 -1.731 1.00 70.25 H new ATOM 0 HE ARG B 34 23.889 -5.879 -4.457 1.00 41.11 H new ATOM 0 HH11 ARG B 34 26.466 -6.946 -2.281 1.00 70.13 H new ATOM 0 HH12 ARG B 34 27.737 -6.692 -3.480 1.00 70.13 H new ATOM 0 HH21 ARG B 34 25.531 -5.495 -5.962 1.00 21.32 H new ATOM 0 HH22 ARG B 34 27.209 -5.873 -5.559 1.00 21.32 H new ATOM 2538 N GLU B 35 18.995 -6.547 -1.103 1.00 42.24 N ATOM 2539 CA GLU B 35 17.728 -6.582 -1.835 1.00 63.02 C ATOM 2540 C GLU B 35 17.439 -5.233 -2.486 1.00 12.03 C ATOM 2541 O GLU B 35 16.821 -5.161 -3.548 1.00 54.43 O ATOM 2542 CB GLU B 35 16.576 -6.944 -0.880 1.00 72.41 C ATOM 2543 CG GLU B 35 16.588 -8.392 -0.388 1.00 31.33 C ATOM 2544 CD GLU B 35 17.877 -8.774 0.324 1.00 34.33 C ATOM 2545 OE1 GLU B 35 18.272 -8.066 1.275 1.00 72.42 O ATOM 2546 OE2 GLU B 35 18.503 -9.785 -0.063 1.00 24.25 O1- ATOM 0 H GLU B 35 18.919 -6.854 -0.133 1.00 42.24 H new ATOM 0 HA GLU B 35 17.809 -7.339 -2.615 1.00 63.02 H new ATOM 0 HB2 GLU B 35 16.615 -6.280 -0.016 1.00 72.41 H new ATOM 0 HB3 GLU B 35 15.629 -6.754 -1.385 1.00 72.41 H new ATOM 0 HG2 GLU B 35 15.748 -8.546 0.289 1.00 31.33 H new ATOM 0 HG3 GLU B 35 16.439 -9.059 -1.237 1.00 31.33 H new ATOM 2553 N LEU B 36 17.898 -4.171 -1.838 1.00 53.04 N ATOM 2554 CA LEU B 36 17.605 -2.807 -2.269 1.00 1.52 C ATOM 2555 C LEU B 36 18.807 -2.184 -2.975 1.00 52.10 C ATOM 2556 O LEU B 36 18.827 -0.984 -3.250 1.00 30.14 O ATOM 2557 CB LEU B 36 17.210 -1.981 -1.042 1.00 63.52 C ATOM 2558 CG LEU B 36 16.080 -2.600 -0.203 1.00 20.23 C ATOM 2559 CD1 LEU B 36 15.899 -1.857 1.112 1.00 52.43 C ATOM 2560 CD2 LEU B 36 14.774 -2.627 -0.994 1.00 15.21 C ATOM 0 H LEU B 36 18.481 -4.228 -1.003 1.00 53.04 H new ATOM 0 HA LEU B 36 16.782 -2.822 -2.984 1.00 1.52 H new ATOM 0 HB2 LEU B 36 18.087 -1.849 -0.409 1.00 63.52 H new ATOM 0 HB3 LEU B 36 16.902 -0.988 -1.370 1.00 63.52 H new ATOM 0 HG LEU B 36 16.361 -3.627 0.031 1.00 20.23 H new ATOM 0 HD11 LEU B 36 15.093 -2.318 1.683 1.00 52.43 H new ATOM 0 HD12 LEU B 36 16.824 -1.904 1.687 1.00 52.43 H new ATOM 0 HD13 LEU B 36 15.650 -0.815 0.910 1.00 52.43 H new ATOM 0 HD21 LEU B 36 13.987 -3.069 -0.382 1.00 15.21 H new ATOM 0 HD22 LEU B 36 14.493 -1.610 -1.267 1.00 15.21 H new ATOM 0 HD23 LEU B 36 14.908 -3.222 -1.898 1.00 15.21 H new ATOM 2572 N GLY B 37 19.794 -3.019 -3.286 1.00 22.45 N ATOM 2573 CA GLY B 37 21.013 -2.547 -3.919 1.00 25.41 C ATOM 2574 C GLY B 37 22.075 -2.159 -2.910 1.00 51.22 C ATOM 2575 O GLY B 37 22.987 -1.397 -3.226 1.00 30.40 O ATOM 0 H GLY B 37 19.770 -4.023 -3.109 1.00 22.45 H new ATOM 0 HA2 GLY B 37 21.405 -3.326 -4.573 1.00 25.41 H new ATOM 0 HA3 GLY B 37 20.783 -1.688 -4.549 1.00 25.41 H new ATOM 2579 N GLY B 38 21.963 -2.700 -1.694 1.00 53.33 N ATOM 2580 CA GLY B 38 22.905 -2.375 -0.636 1.00 54.12 C ATOM 2581 C GLY B 38 24.155 -3.232 -0.695 1.00 61.21 C ATOM 2582 O GLY B 38 24.758 -3.386 -1.756 1.00 64.12 O ATOM 0 H GLY B 38 21.233 -3.360 -1.425 1.00 53.33 H new ATOM 0 HA2 GLY B 38 23.184 -1.324 -0.711 1.00 54.12 H new ATOM 0 HA3 GLY B 38 22.421 -2.508 0.332 1.00 54.12 H new ATOM 2586 N ALA B 39 24.531 -3.817 0.440 1.00 3.10 N ATOM 2587 CA ALA B 39 25.754 -4.618 0.528 1.00 71.25 C ATOM 2588 C ALA B 39 25.450 -6.090 0.810 1.00 4.43 C ATOM 2589 O ALA B 39 26.222 -6.969 0.419 1.00 31.41 O ATOM 2590 CB ALA B 39 26.673 -4.053 1.609 1.00 12.41 C ATOM 0 H ALA B 39 24.007 -3.753 1.313 1.00 3.10 H new ATOM 0 HA ALA B 39 26.256 -4.565 -0.438 1.00 71.25 H new ATOM 0 HB1 ALA B 39 27.580 -4.655 1.667 1.00 12.41 H new ATOM 0 HB2 ALA B 39 26.936 -3.024 1.362 1.00 12.41 H new ATOM 0 HB3 ALA B 39 26.160 -4.076 2.571 1.00 12.41 H new ATOM 2596 N GLY B 40 24.310 -6.347 1.458 1.00 23.34 N ATOM 2597 CA GLY B 40 23.954 -7.698 1.886 1.00 31.44 C ATOM 2598 C GLY B 40 25.089 -8.433 2.572 1.00 1.42 C ATOM 2599 O GLY B 40 25.289 -9.629 2.349 1.00 53.13 O ATOM 0 H GLY B 40 23.619 -5.635 1.697 1.00 23.34 H new ATOM 0 HA2 GLY B 40 23.104 -7.643 2.566 1.00 31.44 H new ATOM 0 HA3 GLY B 40 23.632 -8.273 1.018 1.00 31.44 H new ATOM 2603 N ALA B 41 25.831 -7.717 3.407 1.00 13.10 N ATOM 2604 CA ALA B 41 26.987 -8.284 4.096 1.00 45.11 C ATOM 2605 C ALA B 41 26.585 -8.874 5.446 1.00 24.05 C ATOM 2606 O ALA B 41 25.401 -8.955 5.775 1.00 14.44 O ATOM 2607 CB ALA B 41 28.070 -7.222 4.268 1.00 11.53 C ATOM 0 H ALA B 41 25.653 -6.737 3.625 1.00 13.10 H new ATOM 0 HA ALA B 41 27.388 -9.094 3.487 1.00 45.11 H new ATOM 0 HB1 ALA B 41 28.927 -7.656 4.783 1.00 11.53 H new ATOM 0 HB2 ALA B 41 28.381 -6.858 3.289 1.00 11.53 H new ATOM 0 HB3 ALA B 41 27.676 -6.392 4.855 1.00 11.53 H new ATOM 2613 N GLU B 42 27.585 -9.266 6.228 1.00 15.20 N ATOM 2614 CA GLU B 42 27.380 -9.896 7.534 1.00 53.20 C ATOM 2615 C GLU B 42 27.079 -8.853 8.621 1.00 74.14 C ATOM 2616 O GLU B 42 27.426 -9.040 9.792 1.00 53.42 O ATOM 2617 CB GLU B 42 28.642 -10.689 7.895 1.00 21.14 C ATOM 2618 CG GLU B 42 29.901 -9.827 7.931 1.00 73.23 C ATOM 2619 CD GLU B 42 31.166 -10.629 8.167 1.00 72.34 C ATOM 2620 OE1 GLU B 42 31.486 -10.916 9.340 1.00 61.42 O ATOM 2621 OE2 GLU B 42 31.854 -10.964 7.181 1.00 61.14 O1- ATOM 0 H GLU B 42 28.567 -9.157 5.975 1.00 15.20 H new ATOM 0 HA GLU B 42 26.518 -10.561 7.477 1.00 53.20 H new ATOM 0 HB2 GLU B 42 28.503 -11.159 8.869 1.00 21.14 H new ATOM 0 HB3 GLU B 42 28.779 -11.492 7.171 1.00 21.14 H new ATOM 0 HG2 GLU B 42 29.991 -9.287 6.988 1.00 73.23 H new ATOM 0 HG3 GLU B 42 29.800 -9.080 8.718 1.00 73.23 H new ATOM 2628 N GLY B 43 26.417 -7.766 8.237 1.00 33.24 N ATOM 2629 CA GLY B 43 26.127 -6.696 9.171 1.00 35.43 C ATOM 2630 C GLY B 43 24.648 -6.576 9.471 1.00 2.13 C ATOM 2631 O GLY B 43 23.854 -7.423 9.065 1.00 72.12 O ATOM 0 H GLY B 43 26.075 -7.608 7.289 1.00 33.24 H new ATOM 0 HA2 GLY B 43 26.670 -6.871 10.100 1.00 35.43 H new ATOM 0 HA3 GLY B 43 26.490 -5.753 8.763 1.00 35.43 H new ATOM 2635 N THR B 44 24.280 -5.520 10.186 1.00 33.20 N ATOM 2636 CA THR B 44 22.892 -5.276 10.553 1.00 33.40 C ATOM 2637 C THR B 44 22.267 -4.252 9.611 1.00 35.03 C ATOM 2638 O THR B 44 22.940 -3.323 9.166 1.00 4.14 O ATOM 2639 CB THR B 44 22.804 -4.761 12.009 1.00 13.15 C ATOM 2640 OG1 THR B 44 23.490 -5.668 12.880 1.00 1.03 O ATOM 2641 CG2 THR B 44 21.354 -4.610 12.469 1.00 34.45 C ATOM 0 H THR B 44 24.932 -4.813 10.526 1.00 33.20 H new ATOM 0 HA THR B 44 22.346 -6.216 10.473 1.00 33.40 H new ATOM 0 HB THR B 44 23.272 -3.777 12.046 1.00 13.15 H new ATOM 0 HG1 THR B 44 23.435 -5.340 13.802 1.00 1.03 H new ATOM 0 HG21 THR B 44 21.334 -4.246 13.496 1.00 34.45 H new ATOM 0 HG22 THR B 44 20.839 -3.899 11.822 1.00 34.45 H new ATOM 0 HG23 THR B 44 20.853 -5.577 12.417 1.00 34.45 H new ATOM 2649 N ASN B 45 20.995 -4.438 9.289 1.00 4.01 N ATOM 2650 CA ASN B 45 20.261 -3.473 8.478 1.00 51.43 C ATOM 2651 C ASN B 45 20.160 -2.134 9.213 1.00 21.43 C ATOM 2652 O ASN B 45 19.866 -2.108 10.410 1.00 31.35 O ATOM 2653 CB ASN B 45 18.851 -3.982 8.169 1.00 71.14 C ATOM 2654 CG ASN B 45 18.815 -5.266 7.363 1.00 11.33 C ATOM 2655 OD1 ASN B 45 19.687 -6.127 7.484 1.00 33.20 O ATOM 2656 ND2 ASN B 45 17.790 -5.405 6.538 1.00 55.34 N ATOM 0 H ASN B 45 20.448 -5.249 9.577 1.00 4.01 H new ATOM 0 HA ASN B 45 20.804 -3.339 7.542 1.00 51.43 H new ATOM 0 HB2 ASN B 45 18.321 -4.141 9.108 1.00 71.14 H new ATOM 0 HB3 ASN B 45 18.309 -3.209 7.624 1.00 71.14 H new ATOM 0 HD21 ASN B 45 17.701 -6.249 5.973 1.00 55.34 H new ATOM 0 HD22 ASN B 45 17.089 -4.668 6.467 1.00 55.34 H new ATOM 2663 N PRO B 46 20.402 -1.008 8.516 1.00 54.41 N ATOM 2664 CA PRO B 46 20.331 0.331 9.118 1.00 2.04 C ATOM 2665 C PRO B 46 18.946 0.627 9.697 1.00 14.41 C ATOM 2666 O PRO B 46 18.818 1.030 10.860 1.00 12.32 O ATOM 2667 CB PRO B 46 20.648 1.278 7.946 1.00 21.50 C ATOM 2668 CG PRO B 46 21.365 0.429 6.951 1.00 13.22 C ATOM 2669 CD PRO B 46 20.772 -0.945 7.089 1.00 31.44 C ATOM 0 HA PRO B 46 21.020 0.439 9.956 1.00 2.04 H new ATOM 0 HB2 PRO B 46 19.737 1.700 7.522 1.00 21.50 H new ATOM 0 HB3 PRO B 46 21.267 2.115 8.270 1.00 21.50 H new ATOM 0 HG2 PRO B 46 21.232 0.813 5.940 1.00 13.22 H new ATOM 0 HG3 PRO B 46 22.437 0.415 7.148 1.00 13.22 H new ATOM 0 HD2 PRO B 46 19.905 -1.077 6.442 1.00 31.44 H new ATOM 0 HD3 PRO B 46 21.489 -1.722 6.824 1.00 31.44 H new ATOM 2677 N GLU B 47 17.911 0.401 8.891 1.00 51.12 N ATOM 2678 CA GLU B 47 16.542 0.687 9.302 1.00 42.23 C ATOM 2679 C GLU B 47 16.130 -0.229 10.452 1.00 51.31 C ATOM 2680 O GLU B 47 15.380 0.172 11.344 1.00 51.34 O ATOM 2681 CB GLU B 47 15.562 0.568 8.113 1.00 43.35 C ATOM 2682 CG GLU B 47 15.192 -0.859 7.686 1.00 13.13 C ATOM 2683 CD GLU B 47 16.339 -1.663 7.079 1.00 41.12 C ATOM 2684 OE1 GLU B 47 16.232 -2.909 7.047 1.00 53.12 O ATOM 2685 OE2 GLU B 47 17.342 -1.062 6.635 1.00 73.03 O1- ATOM 0 H GLU B 47 17.996 0.020 7.949 1.00 51.12 H new ATOM 0 HA GLU B 47 16.500 1.718 9.654 1.00 42.23 H new ATOM 0 HB2 GLU B 47 14.645 1.099 8.369 1.00 43.35 H new ATOM 0 HB3 GLU B 47 15.998 1.081 7.256 1.00 43.35 H new ATOM 0 HG2 GLU B 47 14.810 -1.396 8.555 1.00 13.13 H new ATOM 0 HG3 GLU B 47 14.380 -0.807 6.961 1.00 13.13 H new ATOM 2692 N GLN B 48 16.658 -1.446 10.436 1.00 65.22 N ATOM 2693 CA GLN B 48 16.403 -2.424 11.488 1.00 23.21 C ATOM 2694 C GLN B 48 17.097 -2.009 12.785 1.00 44.13 C ATOM 2695 O GLN B 48 16.549 -2.165 13.878 1.00 15.51 O ATOM 2696 CB GLN B 48 16.915 -3.794 11.042 1.00 21.32 C ATOM 2697 CG GLN B 48 16.669 -4.913 12.042 1.00 64.34 C ATOM 2698 CD GLN B 48 17.357 -6.203 11.639 1.00 23.41 C ATOM 2699 OE1 GLN B 48 16.788 -7.022 10.925 1.00 3.40 O ATOM 2700 NE2 GLN B 48 18.583 -6.399 12.103 1.00 12.54 N ATOM 0 H GLN B 48 17.274 -1.783 9.696 1.00 65.22 H new ATOM 0 HA GLN B 48 15.330 -2.475 11.671 1.00 23.21 H new ATOM 0 HB2 GLN B 48 16.439 -4.056 10.097 1.00 21.32 H new ATOM 0 HB3 GLN B 48 17.986 -3.723 10.850 1.00 21.32 H new ATOM 0 HG2 GLN B 48 17.026 -4.605 13.025 1.00 64.34 H new ATOM 0 HG3 GLN B 48 15.597 -5.088 12.133 1.00 64.34 H new ATOM 0 HE21 GLN B 48 19.023 -5.694 12.694 1.00 12.54 H new ATOM 0 HE22 GLN B 48 19.086 -7.255 11.869 1.00 12.54 H new ATOM 2709 N LEU B 49 18.313 -1.490 12.644 1.00 25.52 N ATOM 2710 CA LEU B 49 19.116 -1.056 13.783 1.00 12.42 C ATOM 2711 C LEU B 49 18.412 0.095 14.504 1.00 73.15 C ATOM 2712 O LEU B 49 18.222 0.057 15.722 1.00 22.33 O ATOM 2713 CB LEU B 49 20.521 -0.645 13.287 1.00 25.41 C ATOM 2714 CG LEU B 49 21.581 -0.311 14.363 1.00 55.21 C ATOM 2715 CD1 LEU B 49 21.387 1.095 14.928 1.00 20.42 C ATOM 2716 CD2 LEU B 49 21.569 -1.350 15.484 1.00 31.54 C ATOM 0 H LEU B 49 18.768 -1.359 11.741 1.00 25.52 H new ATOM 0 HA LEU B 49 19.231 -1.872 14.496 1.00 12.42 H new ATOM 0 HB2 LEU B 49 20.911 -1.453 12.668 1.00 25.41 H new ATOM 0 HB3 LEU B 49 20.410 0.226 12.641 1.00 25.41 H new ATOM 0 HG LEU B 49 22.557 -0.340 13.878 1.00 55.21 H new ATOM 0 HD11 LEU B 49 22.150 1.293 15.681 1.00 20.42 H new ATOM 0 HD12 LEU B 49 21.473 1.825 14.123 1.00 20.42 H new ATOM 0 HD13 LEU B 49 20.400 1.171 15.384 1.00 20.42 H new ATOM 0 HD21 LEU B 49 22.323 -1.092 16.227 1.00 31.54 H new ATOM 0 HD22 LEU B 49 20.586 -1.366 15.955 1.00 31.54 H new ATOM 0 HD23 LEU B 49 21.789 -2.334 15.070 1.00 31.54 H new ATOM 2728 N PHE B 50 18.017 1.103 13.736 1.00 74.53 N ATOM 2729 CA PHE B 50 17.303 2.258 14.278 1.00 13.24 C ATOM 2730 C PHE B 50 15.965 1.837 14.877 1.00 54.12 C ATOM 2731 O PHE B 50 15.607 2.276 15.967 1.00 20.22 O ATOM 2732 CB PHE B 50 17.095 3.303 13.181 1.00 14.34 C ATOM 2733 CG PHE B 50 16.127 4.411 13.531 1.00 61.31 C ATOM 2734 CD1 PHE B 50 16.404 5.329 14.539 1.00 53.13 C ATOM 2735 CD2 PHE B 50 14.948 4.555 12.818 1.00 53.22 C ATOM 2736 CE1 PHE B 50 15.529 6.355 14.819 1.00 14.14 C ATOM 2737 CE2 PHE B 50 14.070 5.577 13.101 1.00 22.12 C ATOM 2738 CZ PHE B 50 14.363 6.480 14.102 1.00 62.30 C ATOM 0 H PHE B 50 18.179 1.146 12.730 1.00 74.53 H new ATOM 0 HA PHE B 50 17.904 2.696 15.074 1.00 13.24 H new ATOM 0 HB2 PHE B 50 18.060 3.747 12.935 1.00 14.34 H new ATOM 0 HB3 PHE B 50 16.738 2.799 12.283 1.00 14.34 H new ATOM 0 HD1 PHE B 50 17.317 5.236 15.109 1.00 53.13 H new ATOM 0 HD2 PHE B 50 14.714 3.856 12.029 1.00 53.22 H new ATOM 0 HE1 PHE B 50 15.759 7.062 15.602 1.00 14.14 H new ATOM 0 HE2 PHE B 50 13.152 5.672 12.540 1.00 22.12 H new ATOM 0 HZ PHE B 50 13.677 7.284 14.322 1.00 62.30 H new ATOM 2748 N ALA B 51 15.228 1.000 14.152 1.00 24.13 N ATOM 2749 CA ALA B 51 13.954 0.473 14.635 1.00 31.22 C ATOM 2750 C ALA B 51 14.101 -0.137 16.027 1.00 63.22 C ATOM 2751 O ALA B 51 13.385 0.237 16.957 1.00 61.14 O ATOM 2752 CB ALA B 51 13.421 -0.570 13.664 1.00 4.33 C ATOM 0 H ALA B 51 15.492 0.671 13.224 1.00 24.13 H new ATOM 0 HA ALA B 51 13.248 1.301 14.700 1.00 31.22 H new ATOM 0 HB1 ALA B 51 12.471 -0.958 14.032 1.00 4.33 H new ATOM 0 HB2 ALA B 51 13.272 -0.114 12.685 1.00 4.33 H new ATOM 0 HB3 ALA B 51 14.137 -1.387 13.578 1.00 4.33 H new ATOM 2758 N ALA B 52 15.059 -1.053 16.159 1.00 2.41 N ATOM 2759 CA ALA B 52 15.302 -1.738 17.425 1.00 55.02 C ATOM 2760 C ALA B 52 15.747 -0.750 18.500 1.00 53.11 C ATOM 2761 O ALA B 52 15.342 -0.854 19.660 1.00 74.31 O ATOM 2762 CB ALA B 52 16.345 -2.837 17.238 1.00 43.35 C ATOM 0 H ALA B 52 15.680 -1.338 15.402 1.00 2.41 H new ATOM 0 HA ALA B 52 14.369 -2.196 17.754 1.00 55.02 H new ATOM 0 HB1 ALA B 52 16.518 -3.340 18.189 1.00 43.35 H new ATOM 0 HB2 ALA B 52 15.985 -3.559 16.505 1.00 43.35 H new ATOM 0 HB3 ALA B 52 17.278 -2.397 16.886 1.00 43.35 H new ATOM 2768 N GLY B 53 16.578 0.211 18.104 1.00 41.34 N ATOM 2769 CA GLY B 53 17.050 1.223 19.030 1.00 4.13 C ATOM 2770 C GLY B 53 15.939 2.150 19.484 1.00 15.42 C ATOM 2771 O GLY B 53 15.932 2.609 20.624 1.00 73.22 O ATOM 0 H GLY B 53 16.934 0.306 17.153 1.00 41.34 H new ATOM 0 HA2 GLY B 53 17.494 0.738 19.900 1.00 4.13 H new ATOM 0 HA3 GLY B 53 17.837 1.808 18.555 1.00 4.13 H new ATOM 2775 N TYR B 54 14.993 2.413 18.588 1.00 15.35 N ATOM 2776 CA TYR B 54 13.869 3.299 18.875 1.00 21.24 C ATOM 2777 C TYR B 54 12.893 2.609 19.827 1.00 2.44 C ATOM 2778 O TYR B 54 12.495 3.184 20.839 1.00 55.40 O ATOM 2779 CB TYR B 54 13.167 3.706 17.563 1.00 22.10 C ATOM 2780 CG TYR B 54 12.043 4.735 17.707 1.00 24.43 C ATOM 2781 CD1 TYR B 54 11.790 5.393 18.912 1.00 33.43 C ATOM 2782 CD2 TYR B 54 11.234 5.048 16.617 1.00 20.22 C ATOM 2783 CE1 TYR B 54 10.772 6.323 19.021 1.00 54.12 C ATOM 2784 CE2 TYR B 54 10.216 5.977 16.722 1.00 11.21 C ATOM 2785 CZ TYR B 54 9.988 6.610 17.926 1.00 15.31 C ATOM 2786 OH TYR B 54 8.974 7.536 18.038 1.00 73.14 O ATOM 0 H TYR B 54 14.983 2.020 17.647 1.00 15.35 H new ATOM 0 HA TYR B 54 14.238 4.204 19.358 1.00 21.24 H new ATOM 0 HB2 TYR B 54 13.916 4.106 16.880 1.00 22.10 H new ATOM 0 HB3 TYR B 54 12.757 2.809 17.098 1.00 22.10 H new ATOM 0 HD1 TYR B 54 12.400 5.172 19.775 1.00 33.43 H new ATOM 0 HD2 TYR B 54 11.406 4.555 15.671 1.00 20.22 H new ATOM 0 HE1 TYR B 54 10.593 6.822 19.962 1.00 54.12 H new ATOM 0 HE2 TYR B 54 9.601 6.206 15.864 1.00 11.21 H new ATOM 0 HH TYR B 54 8.961 7.899 18.948 1.00 73.14 H new ATOM 2796 N SER B 55 12.524 1.374 19.504 1.00 62.44 N ATOM 2797 CA SER B 55 11.595 0.617 20.333 1.00 11.44 C ATOM 2798 C SER B 55 12.193 0.367 21.721 1.00 45.34 C ATOM 2799 O SER B 55 11.532 0.573 22.743 1.00 23.33 O ATOM 2800 CB SER B 55 11.239 -0.703 19.645 1.00 71.55 C ATOM 2801 OG SER B 55 12.404 -1.434 19.310 1.00 22.42 O ATOM 0 H SER B 55 12.853 0.878 18.676 1.00 62.44 H new ATOM 0 HA SER B 55 10.682 1.198 20.462 1.00 11.44 H new ATOM 0 HB2 SER B 55 10.608 -1.301 20.303 1.00 71.55 H new ATOM 0 HB3 SER B 55 10.660 -0.502 18.743 1.00 71.55 H new ATOM 0 HG SER B 55 12.453 -2.243 19.861 1.00 22.42 H new ATOM 2807 N ALA B 56 13.457 -0.053 21.746 1.00 72.32 N ATOM 2808 CA ALA B 56 14.166 -0.292 23.001 1.00 72.14 C ATOM 2809 C ALA B 56 14.292 1.002 23.805 1.00 34.31 C ATOM 2810 O ALA B 56 14.098 1.012 25.022 1.00 51.54 O ATOM 2811 CB ALA B 56 15.538 -0.894 22.726 1.00 11.32 C ATOM 0 H ALA B 56 14.012 -0.235 20.909 1.00 72.32 H new ATOM 0 HA ALA B 56 13.591 -1.003 23.594 1.00 72.14 H new ATOM 0 HB1 ALA B 56 16.055 -1.067 23.670 1.00 11.32 H new ATOM 0 HB2 ALA B 56 15.421 -1.840 22.198 1.00 11.32 H new ATOM 0 HB3 ALA B 56 16.121 -0.206 22.113 1.00 11.32 H new ATOM 2817 N CYS B 57 14.607 2.096 23.115 1.00 24.02 N ATOM 2818 CA CYS B 57 14.687 3.407 23.752 1.00 54.22 C ATOM 2819 C CYS B 57 13.323 3.803 24.300 1.00 22.14 C ATOM 2820 O CYS B 57 13.224 4.415 25.360 1.00 1.03 O ATOM 2821 CB CYS B 57 15.173 4.471 22.764 1.00 72.40 C ATOM 2822 SG CYS B 57 15.301 6.131 23.468 1.00 42.35 S ATOM 0 H CYS B 57 14.811 2.100 22.116 1.00 24.02 H new ATOM 0 HA CYS B 57 15.405 3.342 24.570 1.00 54.22 H new ATOM 0 HB2 CYS B 57 16.149 4.175 22.380 1.00 72.40 H new ATOM 0 HB3 CYS B 57 14.491 4.500 21.914 1.00 72.40 H new ATOM 0 HG CYS B 57 15.801 6.941 22.582 1.00 42.35 H new ATOM 2828 N PHE B 58 12.276 3.439 23.566 1.00 34.03 N ATOM 2829 CA PHE B 58 10.909 3.782 23.938 1.00 42.11 C ATOM 2830 C PHE B 58 10.540 3.111 25.263 1.00 1.15 C ATOM 2831 O PHE B 58 9.759 3.650 26.045 1.00 52.32 O ATOM 2832 CB PHE B 58 9.934 3.361 22.826 1.00 13.13 C ATOM 2833 CG PHE B 58 8.599 4.062 22.885 1.00 50.11 C ATOM 2834 CD1 PHE B 58 7.498 3.457 23.476 1.00 2.44 C ATOM 2835 CD2 PHE B 58 8.450 5.333 22.345 1.00 25.34 C ATOM 2836 CE1 PHE B 58 6.279 4.105 23.529 1.00 5.05 C ATOM 2837 CE2 PHE B 58 7.234 5.985 22.395 1.00 25.32 C ATOM 2838 CZ PHE B 58 6.146 5.371 22.988 1.00 52.03 C ATOM 0 H PHE B 58 12.351 2.902 22.702 1.00 34.03 H new ATOM 0 HA PHE B 58 10.838 4.862 24.066 1.00 42.11 H new ATOM 0 HB2 PHE B 58 10.395 3.559 21.858 1.00 13.13 H new ATOM 0 HB3 PHE B 58 9.771 2.285 22.887 1.00 13.13 H new ATOM 0 HD1 PHE B 58 7.596 2.468 23.899 1.00 2.44 H new ATOM 0 HD2 PHE B 58 9.296 5.817 21.880 1.00 25.34 H new ATOM 0 HE1 PHE B 58 5.431 3.623 23.992 1.00 5.05 H new ATOM 0 HE2 PHE B 58 7.133 6.973 21.972 1.00 25.32 H new ATOM 0 HZ PHE B 58 5.194 5.879 23.029 1.00 52.03 H new ATOM 2848 N LEU B 59 11.123 1.938 25.507 1.00 60.43 N ATOM 2849 CA LEU B 59 10.928 1.219 26.764 1.00 11.12 C ATOM 2850 C LEU B 59 11.513 2.018 27.929 1.00 60.54 C ATOM 2851 O LEU B 59 10.812 2.347 28.889 1.00 64.41 O ATOM 2852 CB LEU B 59 11.592 -0.165 26.696 1.00 33.41 C ATOM 2853 CG LEU B 59 11.010 -1.132 25.653 1.00 23.42 C ATOM 2854 CD1 LEU B 59 11.851 -2.405 25.578 1.00 12.45 C ATOM 2855 CD2 LEU B 59 9.556 -1.465 25.982 1.00 24.24 C ATOM 0 H LEU B 59 11.738 1.464 24.846 1.00 60.43 H new ATOM 0 HA LEU B 59 9.858 1.090 26.925 1.00 11.12 H new ATOM 0 HB2 LEU B 59 12.653 -0.029 26.486 1.00 33.41 H new ATOM 0 HB3 LEU B 59 11.519 -0.632 27.678 1.00 33.41 H new ATOM 0 HG LEU B 59 11.036 -0.645 24.678 1.00 23.42 H new ATOM 0 HD11 LEU B 59 11.425 -3.079 24.835 1.00 12.45 H new ATOM 0 HD12 LEU B 59 12.872 -2.150 25.294 1.00 12.45 H new ATOM 0 HD13 LEU B 59 11.857 -2.895 26.552 1.00 12.45 H new ATOM 0 HD21 LEU B 59 9.161 -2.151 25.232 1.00 24.24 H new ATOM 0 HD22 LEU B 59 9.503 -1.933 26.965 1.00 24.24 H new ATOM 0 HD23 LEU B 59 8.964 -0.549 25.984 1.00 24.24 H new ATOM 2867 N SER B 60 12.800 2.335 27.825 1.00 44.21 N ATOM 2868 CA SER B 60 13.501 3.093 28.859 1.00 2.40 C ATOM 2869 C SER B 60 12.858 4.478 29.029 1.00 73.23 C ATOM 2870 O SER B 60 12.723 4.990 30.145 1.00 65.55 O ATOM 2871 CB SER B 60 14.988 3.215 28.487 1.00 63.24 C ATOM 2872 OG SER B 60 15.752 3.781 29.540 1.00 24.13 O ATOM 0 H SER B 60 13.383 2.077 27.029 1.00 44.21 H new ATOM 0 HA SER B 60 13.423 2.569 29.811 1.00 2.40 H new ATOM 0 HB2 SER B 60 15.383 2.229 28.241 1.00 63.24 H new ATOM 0 HB3 SER B 60 15.089 3.831 27.593 1.00 63.24 H new ATOM 0 HG SER B 60 16.477 3.168 29.784 1.00 24.13 H new ATOM 2878 N ALA B 61 12.432 5.064 27.910 1.00 21.42 N ATOM 2879 CA ALA B 61 11.751 6.354 27.920 1.00 31.00 C ATOM 2880 C ALA B 61 10.418 6.235 28.650 1.00 42.41 C ATOM 2881 O ALA B 61 10.064 7.091 29.457 1.00 44.10 O ATOM 2882 CB ALA B 61 11.538 6.858 26.495 1.00 4.34 C ATOM 0 H ALA B 61 12.549 4.661 26.980 1.00 21.42 H new ATOM 0 HA ALA B 61 12.375 7.076 28.447 1.00 31.00 H new ATOM 0 HB1 ALA B 61 11.029 7.821 26.522 1.00 4.34 H new ATOM 0 HB2 ALA B 61 12.503 6.972 26.001 1.00 4.34 H new ATOM 0 HB3 ALA B 61 10.930 6.142 25.943 1.00 4.34 H new ATOM 2888 N MET B 62 9.698 5.150 28.369 1.00 64.12 N ATOM 2889 CA MET B 62 8.421 4.867 29.018 1.00 62.41 C ATOM 2890 C MET B 62 8.631 4.717 30.528 1.00 51.11 C ATOM 2891 O MET B 62 7.796 5.142 31.331 1.00 53.32 O ATOM 2892 CB MET B 62 7.809 3.585 28.424 1.00 4.11 C ATOM 2893 CG MET B 62 6.394 3.249 28.899 1.00 71.00 C ATOM 2894 SD MET B 62 5.095 4.234 28.111 1.00 51.43 S ATOM 2895 CE MET B 62 5.180 5.770 29.027 1.00 33.40 C ATOM 0 H MET B 62 9.983 4.446 27.688 1.00 64.12 H new ATOM 0 HA MET B 62 7.732 5.693 28.844 1.00 62.41 H new ATOM 0 HB2 MET B 62 7.796 3.679 27.338 1.00 4.11 H new ATOM 0 HB3 MET B 62 8.463 2.746 28.664 1.00 4.11 H new ATOM 0 HG2 MET B 62 6.200 2.193 28.709 1.00 71.00 H new ATOM 0 HG3 MET B 62 6.341 3.394 29.978 1.00 71.00 H new ATOM 0 HE1 MET B 62 4.172 6.150 29.194 1.00 33.40 H new ATOM 0 HE2 MET B 62 5.666 5.595 29.987 1.00 33.40 H new ATOM 0 HE3 MET B 62 5.754 6.502 28.458 1.00 33.40 H new ATOM 2905 N LYS B 63 9.765 4.116 30.897 1.00 72.03 N ATOM 2906 CA LYS B 63 10.173 3.986 32.298 1.00 43.00 C ATOM 2907 C LYS B 63 10.325 5.368 32.935 1.00 70.35 C ATOM 2908 O LYS B 63 9.745 5.641 33.990 1.00 23.43 O ATOM 2909 CB LYS B 63 11.496 3.194 32.384 1.00 31.31 C ATOM 2910 CG LYS B 63 12.294 3.391 33.677 1.00 20.13 C ATOM 2911 CD LYS B 63 11.556 2.875 34.909 1.00 10.22 C ATOM 2912 CE LYS B 63 12.401 3.033 36.171 1.00 1.23 C ATOM 2913 NZ LYS B 63 12.748 4.457 36.448 1.00 55.13 N1+ ATOM 0 H LYS B 63 10.424 3.707 30.235 1.00 72.03 H new ATOM 0 HA LYS B 63 9.404 3.442 32.847 1.00 43.00 H new ATOM 0 HB2 LYS B 63 11.273 2.133 32.272 1.00 31.31 H new ATOM 0 HB3 LYS B 63 12.126 3.478 31.541 1.00 31.31 H new ATOM 0 HG2 LYS B 63 13.251 2.877 33.590 1.00 20.13 H new ATOM 0 HG3 LYS B 63 12.512 4.451 33.807 1.00 20.13 H new ATOM 0 HD2 LYS B 63 10.618 3.418 35.027 1.00 10.22 H new ATOM 0 HD3 LYS B 63 11.301 1.824 34.769 1.00 10.22 H new ATOM 0 HE2 LYS B 63 11.858 2.622 37.022 1.00 1.23 H new ATOM 0 HE3 LYS B 63 13.317 2.452 36.067 1.00 1.23 H new ATOM 0 HZ1 LYS B 63 13.157 4.536 37.401 1.00 55.13 H new ATOM 0 HZ2 LYS B 63 13.440 4.789 35.746 1.00 55.13 H new ATOM 0 HZ3 LYS B 63 11.889 5.041 36.390 1.00 55.13 H new ATOM 2927 N PHE B 64 11.095 6.234 32.281 1.00 21.33 N ATOM 2928 CA PHE B 64 11.315 7.591 32.778 1.00 32.24 C ATOM 2929 C PHE B 64 9.991 8.348 32.874 1.00 14.21 C ATOM 2930 O PHE B 64 9.741 9.068 33.844 1.00 73.11 O ATOM 2931 CB PHE B 64 12.297 8.349 31.872 1.00 30.41 C ATOM 2932 CG PHE B 64 12.573 9.761 32.332 1.00 63.34 C ATOM 2933 CD1 PHE B 64 13.332 9.997 33.471 1.00 43.42 C ATOM 2934 CD2 PHE B 64 12.070 10.849 31.632 1.00 31.33 C ATOM 2935 CE1 PHE B 64 13.582 11.288 33.899 1.00 55.11 C ATOM 2936 CE2 PHE B 64 12.319 12.140 32.056 1.00 33.41 C ATOM 2937 CZ PHE B 64 13.075 12.359 33.191 1.00 14.04 C ATOM 0 H PHE B 64 11.577 6.022 31.407 1.00 21.33 H new ATOM 0 HA PHE B 64 11.749 7.521 33.775 1.00 32.24 H new ATOM 0 HB2 PHE B 64 13.237 7.799 31.828 1.00 30.41 H new ATOM 0 HB3 PHE B 64 11.897 8.377 30.859 1.00 30.41 H new ATOM 0 HD1 PHE B 64 13.731 9.163 34.029 1.00 43.42 H new ATOM 0 HD2 PHE B 64 11.477 10.684 30.745 1.00 31.33 H new ATOM 0 HE1 PHE B 64 14.173 11.458 34.786 1.00 55.11 H new ATOM 0 HE2 PHE B 64 11.923 12.977 31.501 1.00 33.41 H new ATOM 0 HZ PHE B 64 13.269 13.368 33.524 1.00 14.04 H new ATOM 2947 N VAL B 65 9.144 8.174 31.862 1.00 75.05 N ATOM 2948 CA VAL B 65 7.829 8.804 31.838 1.00 40.30 C ATOM 2949 C VAL B 65 7.007 8.369 33.045 1.00 43.44 C ATOM 2950 O VAL B 65 6.406 9.197 33.731 1.00 35.52 O ATOM 2951 CB VAL B 65 7.051 8.472 30.542 1.00 54.45 C ATOM 2952 CG1 VAL B 65 5.595 8.927 30.650 1.00 70.43 C ATOM 2953 CG2 VAL B 65 7.727 9.110 29.331 1.00 51.21 C ATOM 0 H VAL B 65 9.348 7.599 31.045 1.00 75.05 H new ATOM 0 HA VAL B 65 7.991 9.881 31.871 1.00 40.30 H new ATOM 0 HB VAL B 65 7.059 7.390 30.408 1.00 54.45 H new ATOM 0 HG11 VAL B 65 5.068 8.683 29.727 1.00 70.43 H new ATOM 0 HG12 VAL B 65 5.116 8.418 31.487 1.00 70.43 H new ATOM 0 HG13 VAL B 65 5.562 10.004 30.813 1.00 70.43 H new ATOM 0 HG21 VAL B 65 7.165 8.865 28.430 1.00 51.21 H new ATOM 0 HG22 VAL B 65 7.755 10.192 29.458 1.00 51.21 H new ATOM 0 HG23 VAL B 65 8.744 8.729 29.239 1.00 51.21 H new ATOM 2963 N ALA B 66 6.997 7.068 33.308 1.00 30.22 N ATOM 2964 CA ALA B 66 6.258 6.523 34.439 1.00 74.13 C ATOM 2965 C ALA B 66 6.722 7.167 35.743 1.00 44.35 C ATOM 2966 O ALA B 66 5.933 7.355 36.673 1.00 34.23 O ATOM 2967 CB ALA B 66 6.418 5.008 34.499 1.00 23.44 C ATOM 0 H ALA B 66 7.493 6.371 32.753 1.00 30.22 H new ATOM 0 HA ALA B 66 5.201 6.751 34.304 1.00 74.13 H new ATOM 0 HB1 ALA B 66 5.860 4.617 35.350 1.00 23.44 H new ATOM 0 HB2 ALA B 66 6.036 4.565 33.579 1.00 23.44 H new ATOM 0 HB3 ALA B 66 7.473 4.758 34.611 1.00 23.44 H new ATOM 2973 N GLY B 67 7.996 7.543 35.774 1.00 23.35 N ATOM 2974 CA GLY B 67 8.583 8.138 36.959 1.00 73.24 C ATOM 2975 C GLY B 67 8.090 9.552 37.203 1.00 45.13 C ATOM 2976 O GLY B 67 8.027 10.009 38.346 1.00 75.04 O ATOM 0 H GLY B 67 8.639 7.444 34.988 1.00 23.35 H new ATOM 0 HA2 GLY B 67 8.349 7.520 37.826 1.00 73.24 H new ATOM 0 HA3 GLY B 67 9.668 8.147 36.858 1.00 73.24 H new ATOM 2980 N GLN B 68 7.725 10.245 36.127 1.00 2.12 N ATOM 2981 CA GLN B 68 7.223 11.614 36.226 1.00 44.13 C ATOM 2982 C GLN B 68 5.700 11.604 36.167 1.00 40.32 C ATOM 2983 O GLN B 68 5.041 12.600 36.464 1.00 64.50 O ATOM 2984 CB GLN B 68 7.806 12.497 35.112 1.00 33.05 C ATOM 2985 CG GLN B 68 7.598 11.946 33.709 1.00 52.44 C ATOM 2986 CD GLN B 68 7.990 12.930 32.625 1.00 54.32 C ATOM 2987 OE1 GLN B 68 7.168 13.722 32.164 1.00 53.51 O ATOM 2988 NE2 GLN B 68 9.248 12.895 32.221 1.00 53.21 N ATOM 0 H GLN B 68 7.767 9.881 35.175 1.00 2.12 H new ATOM 0 HA GLN B 68 7.540 12.037 37.179 1.00 44.13 H new ATOM 0 HB2 GLN B 68 7.353 13.486 35.173 1.00 33.05 H new ATOM 0 HB3 GLN B 68 8.874 12.624 35.286 1.00 33.05 H new ATOM 0 HG2 GLN B 68 8.182 11.033 33.592 1.00 52.44 H new ATOM 0 HG3 GLN B 68 6.550 11.673 33.583 1.00 52.44 H new ATOM 0 HE21 GLN B 68 9.896 12.222 32.630 1.00 53.21 H new ATOM 0 HE22 GLN B 68 9.570 13.541 31.500 1.00 53.21 H new ATOM 2997 N ASN B 69 5.152 10.460 35.770 1.00 21.43 N ATOM 2998 CA ASN B 69 3.706 10.266 35.713 1.00 41.54 C ATOM 2999 C ASN B 69 3.206 9.571 36.974 1.00 23.00 C ATOM 3000 O ASN B 69 1.999 9.407 37.159 1.00 34.41 O ATOM 3001 CB ASN B 69 3.323 9.450 34.468 1.00 65.13 C ATOM 3002 CG ASN B 69 3.319 10.267 33.179 1.00 21.52 C ATOM 3003 OD1 ASN B 69 4.208 11.240 33.081 1.00 65.21 O flip ATOM 3004 ND2 ASN B 69 2.519 10.022 32.276 1.00 45.52 N flip ATOM 0 H ASN B 69 5.693 9.645 35.480 1.00 21.43 H new ATOM 0 HA ASN B 69 3.232 11.245 35.648 1.00 41.54 H new ATOM 0 HB2 ASN B 69 4.021 8.619 34.360 1.00 65.13 H new ATOM 0 HB3 ASN B 69 2.334 9.018 34.617 1.00 65.13 H new ATOM 0 HD21 ASN B 69 1.845 9.264 32.383 1.00 45.52 H new ATOM 0 HD22 ASN B 69 2.530 10.577 31.420 1.00 45.52 H new ATOM 3011 N LYS B 70 4.144 9.168 37.838 1.00 4.22 N ATOM 3012 CA LYS B 70 3.814 8.549 39.126 1.00 71.04 C ATOM 3013 C LYS B 70 2.933 7.315 38.927 1.00 55.13 C ATOM 3014 O LYS B 70 2.011 7.050 39.702 1.00 71.33 O ATOM 3015 CB LYS B 70 3.143 9.584 40.052 1.00 43.15 C ATOM 3016 CG LYS B 70 4.130 10.516 40.766 1.00 61.50 C ATOM 3017 CD LYS B 70 5.295 10.936 39.867 1.00 21.25 C ATOM 3018 CE LYS B 70 6.232 11.927 40.551 1.00 20.34 C ATOM 3019 NZ LYS B 70 5.604 13.261 40.736 1.00 73.12 N1+ ATOM 0 H LYS B 70 5.145 9.261 37.666 1.00 4.22 H new ATOM 0 HA LYS B 70 4.735 8.214 39.604 1.00 71.04 H new ATOM 0 HB2 LYS B 70 2.450 10.187 39.464 1.00 43.15 H new ATOM 0 HB3 LYS B 70 2.551 9.057 40.800 1.00 43.15 H new ATOM 0 HG2 LYS B 70 3.601 11.405 41.109 1.00 61.50 H new ATOM 0 HG3 LYS B 70 4.521 10.016 41.652 1.00 61.50 H new ATOM 0 HD2 LYS B 70 5.859 10.051 39.572 1.00 21.25 H new ATOM 0 HD3 LYS B 70 4.902 11.383 38.954 1.00 21.25 H new ATOM 0 HE2 LYS B 70 6.531 11.531 41.521 1.00 20.34 H new ATOM 0 HE3 LYS B 70 7.140 12.034 39.957 1.00 20.34 H new ATOM 0 HZ1 LYS B 70 6.304 13.923 41.126 1.00 73.12 H new ATOM 0 HZ2 LYS B 70 5.266 13.616 39.819 1.00 73.12 H new ATOM 0 HZ3 LYS B 70 4.802 13.179 41.393 1.00 73.12 H new ATOM 3033 N GLN B 71 3.259 6.558 37.886 1.00 41.03 N ATOM 3034 CA GLN B 71 2.550 5.323 37.545 1.00 14.44 C ATOM 3035 C GLN B 71 3.522 4.142 37.531 1.00 73.31 C ATOM 3036 O GLN B 71 4.738 4.329 37.596 1.00 34.15 O ATOM 3037 CB GLN B 71 1.862 5.449 36.177 1.00 1.40 C ATOM 3038 CG GLN B 71 2.770 6.017 35.092 1.00 33.32 C ATOM 3039 CD GLN B 71 2.454 5.496 33.704 1.00 34.04 C ATOM 3040 OE1 GLN B 71 3.179 4.473 33.300 1.00 74.24 O flip ATOM 3041 NE2 GLN B 71 1.603 6.032 32.996 1.00 0.43 N flip ATOM 0 H GLN B 71 4.025 6.781 37.250 1.00 41.03 H new ATOM 0 HA GLN B 71 1.786 5.149 38.303 1.00 14.44 H new ATOM 0 HB2 GLN B 71 1.507 4.467 35.866 1.00 1.40 H new ATOM 0 HB3 GLN B 71 0.985 6.088 36.277 1.00 1.40 H new ATOM 0 HG2 GLN B 71 2.686 7.104 35.091 1.00 33.32 H new ATOM 0 HG3 GLN B 71 3.805 5.778 35.334 1.00 33.32 H new ATOM 0 HE21 GLN B 71 1.066 6.822 33.353 1.00 0.43 H new ATOM 0 HE22 GLN B 71 1.434 5.686 32.051 1.00 0.43 H new ATOM 3050 N THR B 72 2.979 2.931 37.447 1.00 1.35 N ATOM 3051 CA THR B 72 3.783 1.710 37.447 1.00 51.41 C ATOM 3052 C THR B 72 3.579 0.924 36.152 1.00 74.12 C ATOM 3053 O THR B 72 2.454 0.805 35.659 1.00 25.05 O ATOM 3054 CB THR B 72 3.428 0.811 38.655 1.00 13.02 C ATOM 3055 OG1 THR B 72 2.003 0.695 38.773 1.00 4.22 O ATOM 3056 CG2 THR B 72 4.004 1.372 39.952 1.00 71.50 C ATOM 0 H THR B 72 1.975 2.767 37.377 1.00 1.35 H new ATOM 0 HA THR B 72 4.829 2.008 37.523 1.00 51.41 H new ATOM 0 HB THR B 72 3.866 -0.172 38.483 1.00 13.02 H new ATOM 0 HG1 THR B 72 1.784 0.123 39.538 1.00 4.22 H new ATOM 0 HG21 THR B 72 3.737 0.718 40.782 1.00 71.50 H new ATOM 0 HG22 THR B 72 5.089 1.432 39.872 1.00 71.50 H new ATOM 0 HG23 THR B 72 3.598 2.368 40.130 1.00 71.50 H new ATOM 3064 N LEU B 73 4.672 0.412 35.594 1.00 74.12 N ATOM 3065 CA LEU B 73 4.628 -0.379 34.365 1.00 52.35 C ATOM 3066 C LEU B 73 4.934 -1.851 34.655 1.00 64.24 C ATOM 3067 O LEU B 73 5.825 -2.153 35.451 1.00 14.14 O ATOM 3068 CB LEU B 73 5.639 0.180 33.361 1.00 75.15 C ATOM 3069 CG LEU B 73 5.354 1.606 32.875 1.00 62.34 C ATOM 3070 CD1 LEU B 73 6.548 2.150 32.102 1.00 33.12 C ATOM 3071 CD2 LEU B 73 4.087 1.642 32.020 1.00 51.14 C ATOM 0 H LEU B 73 5.610 0.532 35.977 1.00 74.12 H new ATOM 0 HA LEU B 73 3.625 -0.317 33.944 1.00 52.35 H new ATOM 0 HB2 LEU B 73 6.629 0.159 33.816 1.00 75.15 H new ATOM 0 HB3 LEU B 73 5.672 -0.482 32.496 1.00 75.15 H new ATOM 0 HG LEU B 73 5.190 2.243 33.744 1.00 62.34 H new ATOM 0 HD11 LEU B 73 6.331 3.163 31.763 1.00 33.12 H new ATOM 0 HD12 LEU B 73 7.425 2.164 32.749 1.00 33.12 H new ATOM 0 HD13 LEU B 73 6.744 1.513 31.239 1.00 33.12 H new ATOM 0 HD21 LEU B 73 3.903 2.663 31.685 1.00 51.14 H new ATOM 0 HD22 LEU B 73 4.214 0.993 31.153 1.00 51.14 H new ATOM 0 HD23 LEU B 73 3.239 1.295 32.611 1.00 51.14 H new ATOM 3083 N PRO B 74 4.186 -2.781 34.028 1.00 22.31 N ATOM 3084 CA PRO B 74 4.446 -4.226 34.141 1.00 33.15 C ATOM 3085 C PRO B 74 5.769 -4.620 33.478 1.00 51.21 C ATOM 3086 O PRO B 74 6.121 -4.095 32.422 1.00 62.01 O ATOM 3087 CB PRO B 74 3.264 -4.873 33.399 1.00 23.12 C ATOM 3088 CG PRO B 74 2.239 -3.792 33.269 1.00 12.13 C ATOM 3089 CD PRO B 74 3.012 -2.508 33.184 1.00 51.43 C ATOM 0 HA PRO B 74 4.531 -4.544 35.180 1.00 33.15 H new ATOM 0 HB2 PRO B 74 3.570 -5.245 32.421 1.00 23.12 H new ATOM 0 HB3 PRO B 74 2.870 -5.724 33.954 1.00 23.12 H new ATOM 0 HG2 PRO B 74 1.625 -3.939 32.380 1.00 12.13 H new ATOM 0 HG3 PRO B 74 1.564 -3.787 34.125 1.00 12.13 H new ATOM 0 HD2 PRO B 74 3.296 -2.274 32.158 1.00 51.43 H new ATOM 0 HD3 PRO B 74 2.434 -1.662 33.556 1.00 51.43 H new ATOM 3097 N ALA B 75 6.482 -5.560 34.090 1.00 24.41 N ATOM 3098 CA ALA B 75 7.803 -5.971 33.613 1.00 71.53 C ATOM 3099 C ALA B 75 7.721 -6.892 32.392 1.00 71.01 C ATOM 3100 O ALA B 75 8.694 -7.040 31.651 1.00 12.42 O ATOM 3101 CB ALA B 75 8.577 -6.649 34.739 1.00 50.55 C ATOM 0 H ALA B 75 6.166 -6.056 34.923 1.00 24.41 H new ATOM 0 HA ALA B 75 8.331 -5.071 33.299 1.00 71.53 H new ATOM 0 HB1 ALA B 75 9.559 -6.952 34.375 1.00 50.55 H new ATOM 0 HB2 ALA B 75 8.697 -5.953 35.569 1.00 50.55 H new ATOM 0 HB3 ALA B 75 8.029 -7.528 35.079 1.00 50.55 H new ATOM 3107 N ASP B 76 6.558 -7.506 32.184 1.00 24.20 N ATOM 3108 CA ASP B 76 6.374 -8.488 31.101 1.00 60.22 C ATOM 3109 C ASP B 76 6.118 -7.800 29.751 1.00 14.12 C ATOM 3110 O ASP B 76 5.788 -8.449 28.758 1.00 34.13 O ATOM 3111 CB ASP B 76 5.207 -9.434 31.444 1.00 21.51 C ATOM 3112 CG ASP B 76 5.059 -10.582 30.450 1.00 33.51 C ATOM 3113 OD1 ASP B 76 4.100 -10.571 29.644 1.00 23.44 O ATOM 3114 OD2 ASP B 76 5.912 -11.495 30.464 1.00 41.11 O1- ATOM 0 H ASP B 76 5.724 -7.345 32.749 1.00 24.20 H new ATOM 0 HA ASP B 76 7.295 -9.064 31.010 1.00 60.22 H new ATOM 0 HB2 ASP B 76 5.359 -9.843 32.443 1.00 21.51 H new ATOM 0 HB3 ASP B 76 4.279 -8.863 31.472 1.00 21.51 H new ATOM 3119 N THR B 77 6.297 -6.486 29.710 1.00 44.41 N ATOM 3120 CA THR B 77 5.981 -5.701 28.521 1.00 1.21 C ATOM 3121 C THR B 77 7.051 -5.841 27.427 1.00 31.44 C ATOM 3122 O THR B 77 8.192 -6.237 27.695 1.00 72.52 O ATOM 3123 CB THR B 77 5.794 -4.214 28.889 1.00 44.03 C ATOM 3124 OG1 THR B 77 5.466 -3.445 27.725 1.00 73.25 O ATOM 3125 CG2 THR B 77 7.050 -3.639 29.540 1.00 30.02 C ATOM 0 H THR B 77 6.661 -5.938 30.490 1.00 44.41 H new ATOM 0 HA THR B 77 5.048 -6.095 28.119 1.00 1.21 H new ATOM 0 HB THR B 77 4.974 -4.156 29.605 1.00 44.03 H new ATOM 0 HG1 THR B 77 4.826 -3.942 27.174 1.00 73.25 H new ATOM 0 HG21 THR B 77 6.884 -2.590 29.787 1.00 30.02 H new ATOM 0 HG22 THR B 77 7.275 -4.195 30.450 1.00 30.02 H new ATOM 0 HG23 THR B 77 7.888 -3.721 28.848 1.00 30.02 H new ATOM 3133 N THR B 78 6.660 -5.521 26.193 1.00 70.31 N ATOM 3134 CA THR B 78 7.539 -5.596 25.028 1.00 64.53 C ATOM 3135 C THR B 78 7.035 -4.641 23.938 1.00 71.23 C ATOM 3136 O THR B 78 5.845 -4.338 23.878 1.00 64.44 O ATOM 3137 CB THR B 78 7.580 -7.035 24.452 1.00 53.44 C ATOM 3138 OG1 THR B 78 7.923 -7.979 25.481 1.00 34.22 O ATOM 3139 CG2 THR B 78 8.585 -7.157 23.311 1.00 23.30 C ATOM 0 H THR B 78 5.717 -5.200 25.973 1.00 70.31 H new ATOM 0 HA THR B 78 8.543 -5.313 25.344 1.00 64.53 H new ATOM 0 HB THR B 78 6.585 -7.254 24.065 1.00 53.44 H new ATOM 0 HG1 THR B 78 7.943 -8.883 25.102 1.00 34.22 H new ATOM 0 HG21 THR B 78 8.585 -8.180 22.934 1.00 23.30 H new ATOM 0 HG22 THR B 78 8.308 -6.474 22.508 1.00 23.30 H new ATOM 0 HG23 THR B 78 9.581 -6.905 23.675 1.00 23.30 H new ATOM 3147 N VAL B 79 7.933 -4.164 23.088 1.00 22.45 N ATOM 3148 CA VAL B 79 7.555 -3.342 21.938 1.00 23.02 C ATOM 3149 C VAL B 79 8.239 -3.877 20.690 1.00 31.21 C ATOM 3150 O VAL B 79 9.449 -4.085 20.686 1.00 14.34 O ATOM 3151 CB VAL B 79 7.926 -1.846 22.134 1.00 21.11 C ATOM 3152 CG1 VAL B 79 7.638 -1.039 20.867 1.00 1.41 C ATOM 3153 CG2 VAL B 79 7.171 -1.257 23.323 1.00 54.24 C ATOM 0 H VAL B 79 8.936 -4.331 23.171 1.00 22.45 H new ATOM 0 HA VAL B 79 6.471 -3.398 21.834 1.00 23.02 H new ATOM 0 HB VAL B 79 8.995 -1.789 22.338 1.00 21.11 H new ATOM 0 HG11 VAL B 79 7.907 0.005 21.031 1.00 1.41 H new ATOM 0 HG12 VAL B 79 8.225 -1.439 20.040 1.00 1.41 H new ATOM 0 HG13 VAL B 79 6.577 -1.107 20.626 1.00 1.41 H new ATOM 0 HG21 VAL B 79 7.444 -0.209 23.444 1.00 54.24 H new ATOM 0 HG22 VAL B 79 6.098 -1.335 23.147 1.00 54.24 H new ATOM 0 HG23 VAL B 79 7.431 -1.807 24.228 1.00 54.24 H new ATOM 3163 N THR B 80 7.464 -4.120 19.644 1.00 72.42 N ATOM 3164 CA THR B 80 7.998 -4.654 18.400 1.00 23.21 C ATOM 3165 C THR B 80 7.947 -3.603 17.293 1.00 63.22 C ATOM 3166 O THR B 80 6.871 -3.153 16.902 1.00 42.43 O ATOM 3167 CB THR B 80 7.221 -5.919 17.962 1.00 22.40 C ATOM 3168 OG1 THR B 80 7.171 -6.863 19.047 1.00 71.34 O ATOM 3169 CG2 THR B 80 7.877 -6.574 16.749 1.00 64.25 C ATOM 0 H THR B 80 6.458 -3.955 19.632 1.00 72.42 H new ATOM 0 HA THR B 80 9.038 -4.928 18.576 1.00 23.21 H new ATOM 0 HB THR B 80 6.210 -5.617 17.689 1.00 22.40 H new ATOM 0 HG1 THR B 80 6.677 -7.661 18.764 1.00 71.34 H new ATOM 0 HG21 THR B 80 7.310 -7.460 16.463 1.00 64.25 H new ATOM 0 HG22 THR B 80 7.891 -5.869 15.918 1.00 64.25 H new ATOM 0 HG23 THR B 80 8.898 -6.861 16.999 1.00 64.25 H new ATOM 3177 N ALA B 81 9.118 -3.204 16.809 1.00 41.34 N ATOM 3178 CA ALA B 81 9.221 -2.228 15.734 1.00 73.43 C ATOM 3179 C ALA B 81 9.305 -2.936 14.385 1.00 13.31 C ATOM 3180 O ALA B 81 10.331 -3.530 14.046 1.00 32.14 O ATOM 3181 CB ALA B 81 10.435 -1.327 15.948 1.00 31.52 C ATOM 0 H ALA B 81 10.017 -3.546 17.149 1.00 41.34 H new ATOM 0 HA ALA B 81 8.327 -1.604 15.740 1.00 73.43 H new ATOM 0 HB1 ALA B 81 10.498 -0.603 15.136 1.00 31.52 H new ATOM 0 HB2 ALA B 81 10.334 -0.800 16.897 1.00 31.52 H new ATOM 0 HB3 ALA B 81 11.340 -1.934 15.964 1.00 31.52 H new ATOM 3187 N GLU B 82 8.208 -2.902 13.638 1.00 50.12 N ATOM 3188 CA GLU B 82 8.150 -3.515 12.317 1.00 53.10 C ATOM 3189 C GLU B 82 8.335 -2.434 11.257 1.00 51.21 C ATOM 3190 O GLU B 82 7.451 -1.605 11.045 1.00 13.21 O ATOM 3191 CB GLU B 82 6.809 -4.239 12.124 1.00 51.24 C ATOM 3192 CG GLU B 82 6.737 -5.087 10.857 1.00 31.41 C ATOM 3193 CD GLU B 82 5.385 -5.765 10.672 1.00 63.34 C ATOM 3194 OE1 GLU B 82 4.684 -5.455 9.681 1.00 35.34 O ATOM 3195 OE2 GLU B 82 5.018 -6.619 11.512 1.00 71.23 O1- ATOM 0 H GLU B 82 7.340 -2.452 13.928 1.00 50.12 H new ATOM 0 HA GLU B 82 8.947 -4.252 12.221 1.00 53.10 H new ATOM 0 HB2 GLU B 82 6.626 -4.878 12.988 1.00 51.24 H new ATOM 0 HB3 GLU B 82 6.009 -3.499 12.100 1.00 51.24 H new ATOM 0 HG2 GLU B 82 6.943 -4.457 9.992 1.00 31.41 H new ATOM 0 HG3 GLU B 82 7.517 -5.847 10.890 1.00 31.41 H new ATOM 3202 N VAL B 83 9.492 -2.429 10.610 1.00 40.31 N ATOM 3203 CA VAL B 83 9.832 -1.369 9.663 1.00 71.44 C ATOM 3204 C VAL B 83 9.832 -1.881 8.230 1.00 35.11 C ATOM 3205 O VAL B 83 10.283 -2.995 7.956 1.00 1.44 O ATOM 3206 CB VAL B 83 11.212 -0.737 9.976 1.00 65.23 C ATOM 3207 CG1 VAL B 83 11.154 0.037 11.288 1.00 71.22 C ATOM 3208 CG2 VAL B 83 12.309 -1.802 10.018 1.00 51.35 C ATOM 0 H VAL B 83 10.211 -3.144 10.721 1.00 40.31 H new ATOM 0 HA VAL B 83 9.063 -0.604 9.770 1.00 71.44 H new ATOM 0 HB VAL B 83 11.459 -0.041 9.175 1.00 65.23 H new ATOM 0 HG11 VAL B 83 12.130 0.475 11.495 1.00 71.22 H new ATOM 0 HG12 VAL B 83 10.409 0.829 11.210 1.00 71.22 H new ATOM 0 HG13 VAL B 83 10.881 -0.640 12.098 1.00 71.22 H new ATOM 0 HG21 VAL B 83 13.266 -1.330 10.240 1.00 51.35 H new ATOM 0 HG22 VAL B 83 12.077 -2.533 10.793 1.00 51.35 H new ATOM 0 HG23 VAL B 83 12.367 -2.303 9.052 1.00 51.35 H new ATOM 3218 N GLY B 84 9.310 -1.064 7.325 1.00 51.11 N ATOM 3219 CA GLY B 84 9.327 -1.382 5.919 1.00 52.45 C ATOM 3220 C GLY B 84 9.804 -0.201 5.103 1.00 30.33 C ATOM 3221 O GLY B 84 9.637 0.947 5.510 1.00 4.21 O ATOM 0 H GLY B 84 8.869 -0.172 7.550 1.00 51.11 H new ATOM 0 HA2 GLY B 84 9.980 -2.237 5.744 1.00 52.45 H new ATOM 0 HA3 GLY B 84 8.327 -1.672 5.596 1.00 52.45 H new ATOM 3225 N ILE B 85 10.396 -0.480 3.961 1.00 72.33 N ATOM 3226 CA ILE B 85 10.913 0.550 3.080 1.00 70.35 C ATOM 3227 C ILE B 85 10.450 0.274 1.660 1.00 24.30 C ATOM 3228 O ILE B 85 10.595 -0.850 1.156 1.00 65.43 O ATOM 3229 CB ILE B 85 12.466 0.629 3.149 1.00 43.15 C ATOM 3230 CG1 ILE B 85 13.030 1.729 2.220 1.00 73.10 C ATOM 3231 CG2 ILE B 85 13.085 -0.729 2.827 1.00 2.22 C ATOM 3232 CD1 ILE B 85 13.294 1.281 0.792 1.00 22.31 C ATOM 0 H ILE B 85 10.533 -1.430 3.615 1.00 72.33 H new ATOM 0 HA ILE B 85 10.527 1.516 3.405 1.00 70.35 H new ATOM 0 HB ILE B 85 12.737 0.902 4.169 1.00 43.15 H new ATOM 0 HG12 ILE B 85 12.329 2.564 2.201 1.00 73.10 H new ATOM 0 HG13 ILE B 85 13.960 2.104 2.647 1.00 73.10 H new ATOM 0 HG21 ILE B 85 14.171 -0.655 2.880 1.00 2.22 H new ATOM 0 HG22 ILE B 85 12.736 -1.468 3.548 1.00 2.22 H new ATOM 0 HG23 ILE B 85 12.790 -1.034 1.823 1.00 2.22 H new ATOM 0 HD11 ILE B 85 13.688 2.118 0.215 1.00 22.31 H new ATOM 0 HD12 ILE B 85 14.020 0.468 0.794 1.00 22.31 H new ATOM 0 HD13 ILE B 85 12.364 0.935 0.341 1.00 22.31 H new ATOM 3244 N GLY B 86 9.882 1.301 1.038 1.00 43.24 N ATOM 3245 CA GLY B 86 9.352 1.200 -0.309 1.00 50.02 C ATOM 3246 C GLY B 86 9.617 2.466 -1.097 1.00 52.30 C ATOM 3247 O GLY B 86 10.054 3.463 -0.521 1.00 42.02 O ATOM 0 H GLY B 86 9.778 2.225 1.457 1.00 43.24 H new ATOM 0 HA2 GLY B 86 9.805 0.350 -0.818 1.00 50.02 H new ATOM 0 HA3 GLY B 86 8.279 1.012 -0.268 1.00 50.02 H new ATOM 3251 N PRO B 87 9.378 2.464 -2.418 1.00 42.21 N ATOM 3252 CA PRO B 87 9.679 3.598 -3.271 1.00 30.25 C ATOM 3253 C PRO B 87 8.523 4.588 -3.359 1.00 61.30 C ATOM 3254 O PRO B 87 7.375 4.214 -3.620 1.00 52.32 O ATOM 3255 CB PRO B 87 9.948 2.952 -4.639 1.00 44.10 C ATOM 3256 CG PRO B 87 9.384 1.557 -4.567 1.00 14.42 C ATOM 3257 CD PRO B 87 8.775 1.378 -3.194 1.00 45.13 C ATOM 0 HA PRO B 87 10.516 4.183 -2.890 1.00 30.25 H new ATOM 0 HB2 PRO B 87 9.474 3.522 -5.438 1.00 44.10 H new ATOM 0 HB3 PRO B 87 11.016 2.929 -4.855 1.00 44.10 H new ATOM 0 HG2 PRO B 87 8.632 1.408 -5.342 1.00 14.42 H new ATOM 0 HG3 PRO B 87 10.167 0.818 -4.737 1.00 14.42 H new ATOM 0 HD2 PRO B 87 7.688 1.458 -3.222 1.00 45.13 H new ATOM 0 HD3 PRO B 87 9.012 0.401 -2.772 1.00 45.13 H new ATOM 3265 N ASN B 88 8.848 5.850 -3.131 1.00 53.24 N ATOM 3266 CA ASN B 88 7.904 6.946 -3.312 1.00 21.43 C ATOM 3267 C ASN B 88 7.649 7.120 -4.803 1.00 21.10 C ATOM 3268 O ASN B 88 8.581 7.022 -5.605 1.00 51.23 O ATOM 3269 CB ASN B 88 8.485 8.243 -2.720 1.00 72.30 C ATOM 3270 CG ASN B 88 7.524 9.428 -2.760 1.00 63.22 C ATOM 3271 OD1 ASN B 88 6.628 9.502 -3.598 1.00 5.32 O ATOM 3272 ND2 ASN B 88 7.725 10.381 -1.860 1.00 3.11 N ATOM 0 H ASN B 88 9.772 6.146 -2.816 1.00 53.24 H new ATOM 0 HA ASN B 88 6.969 6.723 -2.799 1.00 21.43 H new ATOM 0 HB2 ASN B 88 8.777 8.060 -1.686 1.00 72.30 H new ATOM 0 HB3 ASN B 88 9.392 8.505 -3.265 1.00 72.30 H new ATOM 0 HD21 ASN B 88 7.127 11.207 -1.849 1.00 3.11 H new ATOM 0 HD22 ASN B 88 8.478 10.288 -1.178 1.00 3.11 H new ATOM 3279 N GLU B 89 6.402 7.387 -5.175 1.00 65.22 N ATOM 3280 CA GLU B 89 6.036 7.521 -6.583 1.00 51.32 C ATOM 3281 C GLU B 89 6.795 8.677 -7.240 1.00 22.42 C ATOM 3282 O GLU B 89 6.913 8.741 -8.463 1.00 11.02 O ATOM 3283 CB GLU B 89 4.523 7.726 -6.726 1.00 62.31 C ATOM 3284 CG GLU B 89 4.012 9.009 -6.080 1.00 11.15 C ATOM 3285 CD GLU B 89 2.520 9.210 -6.280 1.00 24.23 C ATOM 3286 OE1 GLU B 89 2.095 9.437 -7.432 1.00 4.32 O ATOM 3287 OE2 GLU B 89 1.765 9.150 -5.290 1.00 35.35 O1- ATOM 0 H GLU B 89 5.628 7.515 -4.524 1.00 65.22 H new ATOM 0 HA GLU B 89 6.314 6.599 -7.094 1.00 51.32 H new ATOM 0 HB2 GLU B 89 4.266 7.736 -7.785 1.00 62.31 H new ATOM 0 HB3 GLU B 89 4.007 6.875 -6.281 1.00 62.31 H new ATOM 0 HG2 GLU B 89 4.232 8.986 -5.013 1.00 11.15 H new ATOM 0 HG3 GLU B 89 4.549 9.861 -6.498 1.00 11.15 H new ATOM 3294 N GLU B 90 7.312 9.579 -6.411 1.00 52.12 N ATOM 3295 CA GLU B 90 8.084 10.724 -6.885 1.00 15.12 C ATOM 3296 C GLU B 90 9.456 10.286 -7.417 1.00 74.05 C ATOM 3297 O GLU B 90 10.095 10.997 -8.199 1.00 53.12 O ATOM 3298 CB GLU B 90 8.243 11.737 -5.745 1.00 14.23 C ATOM 3299 CG GLU B 90 9.214 12.858 -6.057 1.00 30.33 C ATOM 3300 CD GLU B 90 9.256 13.917 -4.969 1.00 5.15 C ATOM 3301 OE1 GLU B 90 8.446 14.866 -5.025 1.00 54.43 O ATOM 3302 OE2 GLU B 90 10.094 13.805 -4.051 1.00 12.50 O1- ATOM 0 H GLU B 90 7.209 9.538 -5.397 1.00 52.12 H new ATOM 0 HA GLU B 90 7.548 11.192 -7.711 1.00 15.12 H new ATOM 0 HB2 GLU B 90 7.268 12.166 -5.514 1.00 14.23 H new ATOM 0 HB3 GLU B 90 8.581 11.214 -4.850 1.00 14.23 H new ATOM 0 HG2 GLU B 90 10.212 12.441 -6.192 1.00 30.33 H new ATOM 0 HG3 GLU B 90 8.933 13.324 -7.001 1.00 30.33 H new ATOM 3309 N GLY B 91 9.876 9.092 -7.027 1.00 72.20 N ATOM 3310 CA GLY B 91 11.164 8.566 -7.450 1.00 12.11 C ATOM 3311 C GLY B 91 12.205 8.618 -6.349 1.00 71.02 C ATOM 3312 O GLY B 91 13.387 8.868 -6.604 1.00 5.53 O ATOM 0 H GLY B 91 9.344 8.470 -6.419 1.00 72.20 H new ATOM 0 HA2 GLY B 91 11.040 7.534 -7.780 1.00 12.11 H new ATOM 0 HA3 GLY B 91 11.520 9.135 -8.309 1.00 12.11 H new ATOM 3316 N GLY B 92 11.759 8.399 -5.118 1.00 60.34 N ATOM 3317 CA GLY B 92 12.661 8.324 -3.983 1.00 61.32 C ATOM 3318 C GLY B 92 12.314 7.151 -3.088 1.00 12.52 C ATOM 3319 O GLY B 92 11.491 6.314 -3.457 1.00 70.13 O ATOM 0 H GLY B 92 10.775 8.270 -4.883 1.00 60.34 H new ATOM 0 HA2 GLY B 92 13.687 8.225 -4.336 1.00 61.32 H new ATOM 0 HA3 GLY B 92 12.609 9.250 -3.411 1.00 61.32 H new ATOM 3323 N PHE B 93 12.936 7.078 -1.917 1.00 71.13 N ATOM 3324 CA PHE B 93 12.635 6.024 -0.950 1.00 4.00 C ATOM 3325 C PHE B 93 11.769 6.570 0.177 1.00 73.12 C ATOM 3326 O PHE B 93 11.834 7.758 0.508 1.00 63.14 O ATOM 3327 CB PHE B 93 13.924 5.416 -0.381 1.00 42.41 C ATOM 3328 CG PHE B 93 14.697 4.601 -1.386 1.00 52.32 C ATOM 3329 CD1 PHE B 93 15.954 5.001 -1.817 1.00 72.40 C ATOM 3330 CD2 PHE B 93 14.159 3.428 -1.898 1.00 72.15 C ATOM 3331 CE1 PHE B 93 16.658 4.250 -2.738 1.00 54.33 C ATOM 3332 CE2 PHE B 93 14.859 2.673 -2.820 1.00 20.53 C ATOM 3333 CZ PHE B 93 16.111 3.083 -3.241 1.00 20.53 C ATOM 0 H PHE B 93 13.653 7.736 -1.612 1.00 71.13 H new ATOM 0 HA PHE B 93 12.086 5.237 -1.467 1.00 4.00 H new ATOM 0 HB2 PHE B 93 14.561 6.218 -0.008 1.00 42.41 H new ATOM 0 HB3 PHE B 93 13.673 4.785 0.472 1.00 42.41 H new ATOM 0 HD1 PHE B 93 16.387 5.911 -1.428 1.00 72.40 H new ATOM 0 HD2 PHE B 93 13.182 3.102 -1.572 1.00 72.15 H new ATOM 0 HE1 PHE B 93 17.635 4.574 -3.065 1.00 54.33 H new ATOM 0 HE2 PHE B 93 14.429 1.763 -3.212 1.00 20.53 H new ATOM 0 HZ PHE B 93 16.660 2.494 -3.960 1.00 20.53 H new ATOM 3343 N ALA B 94 10.963 5.696 0.764 1.00 22.42 N ATOM 3344 CA ALA B 94 10.041 6.078 1.821 1.00 62.21 C ATOM 3345 C ALA B 94 10.036 5.017 2.918 1.00 42.21 C ATOM 3346 O ALA B 94 9.945 3.819 2.633 1.00 61.15 O ATOM 3347 CB ALA B 94 8.644 6.282 1.242 1.00 43.22 C ATOM 0 H ALA B 94 10.931 4.706 0.521 1.00 22.42 H new ATOM 0 HA ALA B 94 10.366 7.019 2.264 1.00 62.21 H new ATOM 0 HB1 ALA B 94 7.958 6.568 2.039 1.00 43.22 H new ATOM 0 HB2 ALA B 94 8.674 7.069 0.489 1.00 43.22 H new ATOM 0 HB3 ALA B 94 8.301 5.354 0.784 1.00 43.22 H new ATOM 3353 N LEU B 95 10.164 5.464 4.165 1.00 51.40 N ATOM 3354 CA LEU B 95 10.207 4.563 5.317 1.00 52.52 C ATOM 3355 C LEU B 95 8.865 4.533 6.037 1.00 31.45 C ATOM 3356 O LEU B 95 8.329 5.574 6.423 1.00 74.21 O ATOM 3357 CB LEU B 95 11.322 4.981 6.295 1.00 5.44 C ATOM 3358 CG LEU B 95 12.731 4.448 5.973 1.00 70.54 C ATOM 3359 CD1 LEU B 95 12.787 2.929 6.135 1.00 3.52 C ATOM 3360 CD2 LEU B 95 13.159 4.852 4.566 1.00 13.14 C ATOM 0 H LEU B 95 10.240 6.452 4.406 1.00 51.40 H new ATOM 0 HA LEU B 95 10.423 3.561 4.947 1.00 52.52 H new ATOM 0 HB2 LEU B 95 11.364 6.070 6.325 1.00 5.44 H new ATOM 0 HB3 LEU B 95 11.047 4.645 7.295 1.00 5.44 H new ATOM 0 HG LEU B 95 13.428 4.895 6.682 1.00 70.54 H new ATOM 0 HD11 LEU B 95 13.791 2.575 5.902 1.00 3.52 H new ATOM 0 HD12 LEU B 95 12.537 2.663 7.162 1.00 3.52 H new ATOM 0 HD13 LEU B 95 12.072 2.464 5.456 1.00 3.52 H new ATOM 0 HD21 LEU B 95 14.157 4.463 4.364 1.00 13.14 H new ATOM 0 HD22 LEU B 95 12.456 4.443 3.840 1.00 13.14 H new ATOM 0 HD23 LEU B 95 13.170 5.939 4.487 1.00 13.14 H new ATOM 3372 N ASP B 96 8.337 3.329 6.201 1.00 51.23 N ATOM 3373 CA ASP B 96 7.105 3.097 6.950 1.00 11.24 C ATOM 3374 C ASP B 96 7.417 2.273 8.188 1.00 14.30 C ATOM 3375 O ASP B 96 7.762 1.096 8.084 1.00 55.22 O ATOM 3376 CB ASP B 96 6.082 2.348 6.093 1.00 22.11 C ATOM 3377 CG ASP B 96 4.726 2.211 6.776 1.00 4.43 C ATOM 3378 OD1 ASP B 96 4.263 3.187 7.399 1.00 73.12 O ATOM 3379 OD2 ASP B 96 4.098 1.136 6.660 1.00 73.53 O1- ATOM 0 H ASP B 96 8.751 2.479 5.817 1.00 51.23 H new ATOM 0 HA ASP B 96 6.685 4.061 7.235 1.00 11.24 H new ATOM 0 HB2 ASP B 96 5.955 2.872 5.146 1.00 22.11 H new ATOM 0 HB3 ASP B 96 6.468 1.356 5.859 1.00 22.11 H new ATOM 3384 N VAL B 97 7.314 2.885 9.352 1.00 43.21 N ATOM 3385 CA VAL B 97 7.654 2.207 10.598 1.00 65.34 C ATOM 3386 C VAL B 97 6.423 2.025 11.482 1.00 4.12 C ATOM 3387 O VAL B 97 5.792 2.989 11.920 1.00 1.23 O ATOM 3388 CB VAL B 97 8.788 2.940 11.365 1.00 44.15 C ATOM 3389 CG1 VAL B 97 8.568 4.446 11.366 1.00 31.14 C ATOM 3390 CG2 VAL B 97 8.922 2.409 12.797 1.00 13.32 C ATOM 0 H VAL B 97 6.999 3.848 9.466 1.00 43.21 H new ATOM 0 HA VAL B 97 8.028 1.218 10.333 1.00 65.34 H new ATOM 0 HB VAL B 97 9.722 2.737 10.842 1.00 44.15 H new ATOM 0 HG11 VAL B 97 9.378 4.932 11.910 1.00 31.14 H new ATOM 0 HG12 VAL B 97 8.550 4.812 10.339 1.00 31.14 H new ATOM 0 HG13 VAL B 97 7.618 4.675 11.849 1.00 31.14 H new ATOM 0 HG21 VAL B 97 9.724 2.941 13.309 1.00 13.32 H new ATOM 0 HG22 VAL B 97 7.985 2.564 13.332 1.00 13.32 H new ATOM 0 HG23 VAL B 97 9.153 1.344 12.770 1.00 13.32 H new ATOM 3400 N GLU B 98 6.096 0.767 11.723 1.00 55.41 N ATOM 3401 CA GLU B 98 4.953 0.380 12.532 1.00 61.25 C ATOM 3402 C GLU B 98 5.429 0.001 13.930 1.00 55.42 C ATOM 3403 O GLU B 98 6.108 -1.010 14.112 1.00 74.01 O ATOM 3404 CB GLU B 98 4.218 -0.805 11.879 1.00 43.20 C ATOM 3405 CG GLU B 98 3.742 -0.525 10.455 1.00 33.43 C ATOM 3406 CD GLU B 98 3.085 -1.733 9.798 1.00 35.25 C ATOM 3407 OE1 GLU B 98 1.918 -2.037 10.127 1.00 70.42 O ATOM 3408 OE2 GLU B 98 3.725 -2.377 8.937 1.00 74.42 O1- ATOM 0 H GLU B 98 6.624 -0.025 11.357 1.00 55.41 H new ATOM 0 HA GLU B 98 4.260 1.218 12.603 1.00 61.25 H new ATOM 0 HB2 GLU B 98 4.881 -1.670 11.867 1.00 43.20 H new ATOM 0 HB3 GLU B 98 3.358 -1.071 12.494 1.00 43.20 H new ATOM 0 HG2 GLU B 98 3.033 0.303 10.471 1.00 33.43 H new ATOM 0 HG3 GLU B 98 4.591 -0.206 9.850 1.00 33.43 H new ATOM 3415 N LEU B 99 5.095 0.828 14.910 1.00 61.12 N ATOM 3416 CA LEU B 99 5.507 0.583 16.288 1.00 54.24 C ATOM 3417 C LEU B 99 4.409 -0.169 17.030 1.00 51.12 C ATOM 3418 O LEU B 99 3.339 0.385 17.310 1.00 12.44 O ATOM 3419 CB LEU B 99 5.843 1.902 16.996 1.00 60.12 C ATOM 3420 CG LEU B 99 7.062 2.651 16.427 1.00 42.10 C ATOM 3421 CD1 LEU B 99 7.288 3.959 17.176 1.00 24.34 C ATOM 3422 CD2 LEU B 99 8.311 1.769 16.481 1.00 1.13 C ATOM 0 H LEU B 99 4.541 1.674 14.779 1.00 61.12 H new ATOM 0 HA LEU B 99 6.408 -0.031 16.283 1.00 54.24 H new ATOM 0 HB2 LEU B 99 4.974 2.558 16.942 1.00 60.12 H new ATOM 0 HB3 LEU B 99 6.022 1.696 18.051 1.00 60.12 H new ATOM 0 HG LEU B 99 6.861 2.890 15.383 1.00 42.10 H new ATOM 0 HD11 LEU B 99 8.154 4.473 16.758 1.00 24.34 H new ATOM 0 HD12 LEU B 99 6.407 4.593 17.075 1.00 24.34 H new ATOM 0 HD13 LEU B 99 7.465 3.748 18.231 1.00 24.34 H new ATOM 0 HD21 LEU B 99 9.161 2.317 16.074 1.00 1.13 H new ATOM 0 HD22 LEU B 99 8.518 1.494 17.515 1.00 1.13 H new ATOM 0 HD23 LEU B 99 8.145 0.867 15.892 1.00 1.13 H new ATOM 3434 N ARG B 100 4.687 -1.436 17.333 1.00 53.41 N ATOM 3435 CA ARG B 100 3.708 -2.336 17.930 1.00 2.45 C ATOM 3436 C ARG B 100 3.939 -2.424 19.436 1.00 14.01 C ATOM 3437 O ARG B 100 4.934 -2.986 19.893 1.00 24.14 O ATOM 3438 CB ARG B 100 3.821 -3.722 17.279 1.00 53.52 C ATOM 3439 CG ARG B 100 2.599 -4.614 17.471 1.00 13.43 C ATOM 3440 CD ARG B 100 2.767 -5.931 16.726 1.00 64.11 C ATOM 3441 NE ARG B 100 1.510 -6.671 16.616 1.00 3.43 N ATOM 3442 CZ ARG B 100 1.295 -7.646 15.731 1.00 52.33 C ATOM 3443 NH1 ARG B 100 2.250 -8.000 14.876 1.00 41.53 N1+ ATOM 3444 NH2 ARG B 100 0.121 -8.256 15.701 1.00 11.32 N ATOM 0 H ARG B 100 5.598 -1.865 17.171 1.00 53.41 H new ATOM 0 HA ARG B 100 2.703 -1.951 17.758 1.00 2.45 H new ATOM 0 HB2 ARG B 100 3.997 -3.594 16.211 1.00 53.52 H new ATOM 0 HB3 ARG B 100 4.694 -4.231 17.687 1.00 53.52 H new ATOM 0 HG2 ARG B 100 2.449 -4.809 18.533 1.00 13.43 H new ATOM 0 HG3 ARG B 100 1.708 -4.099 17.112 1.00 13.43 H new ATOM 0 HD2 ARG B 100 3.158 -5.734 15.728 1.00 64.11 H new ATOM 0 HD3 ARG B 100 3.504 -6.546 17.242 1.00 64.11 H new ATOM 0 HE ARG B 100 0.753 -6.427 17.254 1.00 3.43 H new ATOM 0 HH11 ARG B 100 3.153 -7.525 14.895 1.00 41.53 H new ATOM 0 HH12 ARG B 100 2.080 -8.746 14.202 1.00 41.53 H new ATOM 0 HH21 ARG B 100 -0.614 -7.980 16.352 1.00 11.32 H new ATOM 0 HH22 ARG B 100 -0.049 -9.002 15.027 1.00 11.32 H new ATOM 3458 N VAL B 101 3.020 -1.846 20.193 1.00 41.00 N ATOM 3459 CA VAL B 101 3.164 -1.712 21.639 1.00 50.20 C ATOM 3460 C VAL B 101 2.454 -2.837 22.375 1.00 3.30 C ATOM 3461 O VAL B 101 1.226 -2.909 22.369 1.00 1.54 O ATOM 3462 CB VAL B 101 2.587 -0.362 22.116 1.00 60.12 C ATOM 3463 CG1 VAL B 101 2.550 -0.288 23.643 1.00 22.35 C ATOM 3464 CG2 VAL B 101 3.390 0.799 21.526 1.00 51.31 C ATOM 0 H VAL B 101 2.152 -1.456 19.825 1.00 41.00 H new ATOM 0 HA VAL B 101 4.230 -1.760 21.863 1.00 50.20 H new ATOM 0 HB VAL B 101 1.560 -0.283 21.759 1.00 60.12 H new ATOM 0 HG11 VAL B 101 2.139 0.674 23.951 1.00 22.35 H new ATOM 0 HG12 VAL B 101 1.924 -1.091 24.031 1.00 22.35 H new ATOM 0 HG13 VAL B 101 3.561 -0.394 24.037 1.00 22.35 H new ATOM 0 HG21 VAL B 101 2.971 1.744 21.872 1.00 51.31 H new ATOM 0 HG22 VAL B 101 4.429 0.724 21.848 1.00 51.31 H new ATOM 0 HG23 VAL B 101 3.343 0.758 20.438 1.00 51.31 H new ATOM 3474 N ALA B 102 3.227 -3.704 23.019 1.00 24.03 N ATOM 3475 CA ALA B 102 2.665 -4.803 23.789 1.00 53.32 C ATOM 3476 C ALA B 102 2.827 -4.545 25.282 1.00 44.40 C ATOM 3477 O ALA B 102 3.910 -4.727 25.843 1.00 4.42 O ATOM 3478 CB ALA B 102 3.329 -6.118 23.390 1.00 42.24 C ATOM 0 H ALA B 102 4.246 -3.665 23.022 1.00 24.03 H new ATOM 0 HA ALA B 102 1.599 -4.876 23.572 1.00 53.32 H new ATOM 0 HB1 ALA B 102 2.901 -6.933 23.973 1.00 42.24 H new ATOM 0 HB2 ALA B 102 3.161 -6.303 22.329 1.00 42.24 H new ATOM 0 HB3 ALA B 102 4.400 -6.058 23.583 1.00 42.24 H new ATOM 3484 N LEU B 103 1.750 -4.111 25.922 1.00 61.44 N ATOM 3485 CA LEU B 103 1.750 -3.883 27.361 1.00 72.24 C ATOM 3486 C LEU B 103 0.720 -4.808 28.004 1.00 41.41 C ATOM 3487 O LEU B 103 -0.465 -4.745 27.679 1.00 40.11 O ATOM 3488 CB LEU B 103 1.440 -2.411 27.687 1.00 55.34 C ATOM 3489 CG LEU B 103 1.645 -2.003 29.163 1.00 34.43 C ATOM 3490 CD1 LEU B 103 3.116 -2.102 29.550 1.00 40.33 C ATOM 3491 CD2 LEU B 103 1.121 -0.591 29.422 1.00 1.40 C ATOM 0 H LEU B 103 0.861 -3.909 25.465 1.00 61.44 H new ATOM 0 HA LEU B 103 2.740 -4.102 27.762 1.00 72.24 H new ATOM 0 HB2 LEU B 103 2.069 -1.778 27.062 1.00 55.34 H new ATOM 0 HB3 LEU B 103 0.406 -2.205 27.411 1.00 55.34 H new ATOM 0 HG LEU B 103 1.075 -2.696 29.782 1.00 34.43 H new ATOM 0 HD11 LEU B 103 3.238 -1.810 30.593 1.00 40.33 H new ATOM 0 HD12 LEU B 103 3.459 -3.128 29.418 1.00 40.33 H new ATOM 0 HD13 LEU B 103 3.704 -1.438 28.916 1.00 40.33 H new ATOM 0 HD21 LEU B 103 1.278 -0.331 30.469 1.00 1.40 H new ATOM 0 HD22 LEU B 103 1.654 0.117 28.788 1.00 1.40 H new ATOM 0 HD23 LEU B 103 0.056 -0.551 29.194 1.00 1.40 H new ATOM 3503 N PRO B 104 1.166 -5.697 28.902 1.00 3.11 N ATOM 3504 CA PRO B 104 0.294 -6.690 29.527 1.00 24.44 C ATOM 3505 C PRO B 104 -0.738 -6.059 30.457 1.00 5.10 C ATOM 3506 O PRO B 104 -0.461 -5.069 31.141 1.00 15.44 O ATOM 3507 CB PRO B 104 1.264 -7.586 30.300 1.00 10.11 C ATOM 3508 CG PRO B 104 2.466 -6.742 30.543 1.00 31.23 C ATOM 3509 CD PRO B 104 2.552 -5.797 29.378 1.00 74.24 C ATOM 0 HA PRO B 104 -0.299 -7.233 28.791 1.00 24.44 H new ATOM 0 HB2 PRO B 104 0.825 -7.925 31.238 1.00 10.11 H new ATOM 0 HB3 PRO B 104 1.518 -8.478 29.727 1.00 10.11 H new ATOM 0 HG2 PRO B 104 2.376 -6.196 31.482 1.00 31.23 H new ATOM 0 HG3 PRO B 104 3.365 -7.355 30.615 1.00 31.23 H new ATOM 0 HD2 PRO B 104 2.942 -4.825 29.680 1.00 74.24 H new ATOM 0 HD3 PRO B 104 3.215 -6.179 28.601 1.00 74.24 H new ATOM 3517 N GLY B 105 -1.922 -6.654 30.475 1.00 72.34 N ATOM 3518 CA GLY B 105 -3.021 -6.146 31.282 1.00 21.00 C ATOM 3519 C GLY B 105 -3.588 -4.838 30.752 1.00 53.31 C ATOM 3520 O GLY B 105 -4.356 -4.159 31.443 1.00 21.33 O ATOM 0 H GLY B 105 -2.146 -7.492 29.938 1.00 72.34 H new ATOM 0 HA2 GLY B 105 -3.815 -6.892 31.318 1.00 21.00 H new ATOM 0 HA3 GLY B 105 -2.676 -5.999 32.305 1.00 21.00 H new ATOM 3524 N LEU B 106 -3.227 -4.493 29.521 1.00 45.40 N ATOM 3525 CA LEU B 106 -3.651 -3.241 28.898 1.00 45.21 C ATOM 3526 C LEU B 106 -4.594 -3.510 27.722 1.00 60.53 C ATOM 3527 O LEU B 106 -4.390 -4.451 26.949 1.00 55.33 O ATOM 3528 CB LEU B 106 -2.418 -2.444 28.436 1.00 22.13 C ATOM 3529 CG LEU B 106 -2.704 -1.228 27.537 1.00 5.55 C ATOM 3530 CD1 LEU B 106 -3.560 -0.199 28.267 1.00 53.52 C ATOM 3531 CD2 LEU B 106 -1.406 -0.592 27.047 1.00 55.01 C ATOM 0 H LEU B 106 -2.633 -5.071 28.926 1.00 45.40 H new ATOM 0 HA LEU B 106 -4.196 -2.651 29.634 1.00 45.21 H new ATOM 0 HB2 LEU B 106 -1.879 -2.100 29.319 1.00 22.13 H new ATOM 0 HB3 LEU B 106 -1.752 -3.120 27.899 1.00 22.13 H new ATOM 0 HG LEU B 106 -3.260 -1.581 26.668 1.00 5.55 H new ATOM 0 HD11 LEU B 106 -3.748 0.650 27.610 1.00 53.52 H new ATOM 0 HD12 LEU B 106 -4.509 -0.653 28.554 1.00 53.52 H new ATOM 0 HD13 LEU B 106 -3.036 0.142 29.160 1.00 53.52 H new ATOM 0 HD21 LEU B 106 -1.637 0.265 26.414 1.00 55.01 H new ATOM 0 HD22 LEU B 106 -0.817 -0.263 27.903 1.00 55.01 H new ATOM 0 HD23 LEU B 106 -0.836 -1.323 26.474 1.00 55.01 H new ATOM 3543 N ASP B 107 -5.632 -2.685 27.608 1.00 0.12 N ATOM 3544 CA ASP B 107 -6.626 -2.814 26.538 1.00 50.41 C ATOM 3545 C ASP B 107 -6.080 -2.265 25.234 1.00 24.13 C ATOM 3546 O ASP B 107 -5.094 -1.541 25.225 1.00 45.41 O ATOM 3547 CB ASP B 107 -7.897 -2.025 26.855 1.00 1.44 C ATOM 3548 CG ASP B 107 -9.146 -2.643 26.245 1.00 20.21 C ATOM 3549 OD1 ASP B 107 -9.464 -2.319 25.078 1.00 63.12 O ATOM 3550 OD2 ASP B 107 -9.821 -3.441 26.925 1.00 14.11 O1- ATOM 0 H ASP B 107 -5.810 -1.912 28.249 1.00 0.12 H new ATOM 0 HA ASP B 107 -6.854 -3.877 26.453 1.00 50.41 H new ATOM 0 HB2 ASP B 107 -8.020 -1.963 27.936 1.00 1.44 H new ATOM 0 HB3 ASP B 107 -7.786 -1.005 26.488 1.00 1.44 H new ATOM 3555 N ALA B 108 -6.773 -2.575 24.155 1.00 12.24 N ATOM 3556 CA ALA B 108 -6.506 -1.974 22.859 1.00 21.33 C ATOM 3557 C ALA B 108 -6.897 -0.501 22.873 1.00 4.44 C ATOM 3558 O ALA B 108 -6.148 0.359 22.400 1.00 12.01 O ATOM 3559 CB ALA B 108 -7.302 -2.710 21.798 1.00 34.32 C ATOM 0 H ALA B 108 -7.537 -3.250 24.150 1.00 12.24 H new ATOM 0 HA ALA B 108 -5.442 -2.049 22.637 1.00 21.33 H new ATOM 0 HB1 ALA B 108 -7.107 -2.265 20.822 1.00 34.32 H new ATOM 0 HB2 ALA B 108 -7.006 -3.759 21.784 1.00 34.32 H new ATOM 0 HB3 ALA B 108 -8.366 -2.636 22.024 1.00 34.32 H new ATOM 3565 N ALA B 109 -8.068 -0.221 23.439 1.00 61.34 N ATOM 3566 CA ALA B 109 -8.606 1.131 23.478 1.00 64.51 C ATOM 3567 C ALA B 109 -7.721 2.035 24.322 1.00 34.40 C ATOM 3568 O ALA B 109 -7.375 3.146 23.914 1.00 22.24 O ATOM 3569 CB ALA B 109 -10.030 1.118 24.018 1.00 34.53 C ATOM 0 H ALA B 109 -8.665 -0.921 23.880 1.00 61.34 H new ATOM 0 HA ALA B 109 -8.625 1.526 22.462 1.00 64.51 H new ATOM 0 HB1 ALA B 109 -10.420 2.136 24.042 1.00 34.53 H new ATOM 0 HB2 ALA B 109 -10.658 0.504 23.373 1.00 34.53 H new ATOM 0 HB3 ALA B 109 -10.033 0.705 25.027 1.00 34.53 H new ATOM 3575 N ALA B 110 -7.344 1.540 25.494 1.00 13.42 N ATOM 3576 CA ALA B 110 -6.484 2.288 26.397 1.00 72.03 C ATOM 3577 C ALA B 110 -5.088 2.403 25.800 1.00 4.25 C ATOM 3578 O ALA B 110 -4.484 3.475 25.811 1.00 22.41 O ATOM 3579 CB ALA B 110 -6.443 1.628 27.770 1.00 4.12 C ATOM 0 H ALA B 110 -7.622 0.622 25.840 1.00 13.42 H new ATOM 0 HA ALA B 110 -6.889 3.292 26.526 1.00 72.03 H new ATOM 0 HB1 ALA B 110 -5.794 2.203 28.431 1.00 4.12 H new ATOM 0 HB2 ALA B 110 -7.449 1.595 28.188 1.00 4.12 H new ATOM 0 HB3 ALA B 110 -6.056 0.613 27.675 1.00 4.12 H new ATOM 3585 N ALA B 111 -4.591 1.295 25.253 1.00 64.14 N ATOM 3586 CA ALA B 111 -3.276 1.278 24.614 1.00 51.51 C ATOM 3587 C ALA B 111 -3.176 2.351 23.538 1.00 2.23 C ATOM 3588 O ALA B 111 -2.172 3.057 23.451 1.00 42.41 O ATOM 3589 CB ALA B 111 -2.988 -0.092 24.015 1.00 4.22 C ATOM 0 H ALA B 111 -5.078 0.399 25.239 1.00 64.14 H new ATOM 0 HA ALA B 111 -2.531 1.490 25.381 1.00 51.51 H new ATOM 0 HB1 ALA B 111 -2.005 -0.084 23.544 1.00 4.22 H new ATOM 0 HB2 ALA B 111 -3.007 -0.845 24.803 1.00 4.22 H new ATOM 0 HB3 ALA B 111 -3.746 -0.329 23.268 1.00 4.22 H new ATOM 3595 N LYS B 112 -4.233 2.480 22.736 1.00 32.30 N ATOM 3596 CA LYS B 112 -4.268 3.462 21.657 1.00 34.20 C ATOM 3597 C LYS B 112 -3.891 4.852 22.171 1.00 24.41 C ATOM 3598 O LYS B 112 -3.027 5.523 21.600 1.00 32.01 O ATOM 3599 CB LYS B 112 -5.663 3.509 21.004 1.00 45.31 C ATOM 3600 CG LYS B 112 -5.890 2.481 19.894 1.00 74.45 C ATOM 3601 CD LYS B 112 -4.982 2.740 18.689 1.00 63.04 C ATOM 3602 CE LYS B 112 -5.463 2.018 17.433 1.00 72.33 C ATOM 3603 NZ LYS B 112 -5.496 0.538 17.594 1.00 62.21 N1+ ATOM 0 H LYS B 112 -5.078 1.914 22.815 1.00 32.30 H new ATOM 0 HA LYS B 112 -3.538 3.155 20.908 1.00 34.20 H new ATOM 0 HB2 LYS B 112 -6.416 3.358 21.778 1.00 45.31 H new ATOM 0 HB3 LYS B 112 -5.823 4.506 20.594 1.00 45.31 H new ATOM 0 HG2 LYS B 112 -5.704 1.479 20.282 1.00 74.45 H new ATOM 0 HG3 LYS B 112 -6.933 2.511 19.577 1.00 74.45 H new ATOM 0 HD2 LYS B 112 -4.938 3.812 18.494 1.00 63.04 H new ATOM 0 HD3 LYS B 112 -3.968 2.417 18.925 1.00 63.04 H new ATOM 0 HE2 LYS B 112 -6.461 2.373 17.175 1.00 72.33 H new ATOM 0 HE3 LYS B 112 -4.809 2.274 16.600 1.00 72.33 H new ATOM 0 HZ1 LYS B 112 -5.797 0.098 16.701 1.00 62.21 H new ATOM 0 HZ2 LYS B 112 -4.547 0.195 17.846 1.00 62.21 H new ATOM 0 HZ3 LYS B 112 -6.167 0.286 18.348 1.00 62.21 H new ATOM 3617 N THR B 113 -4.524 5.267 23.268 1.00 71.03 N ATOM 3618 CA THR B 113 -4.314 6.608 23.800 1.00 12.30 C ATOM 3619 C THR B 113 -2.960 6.709 24.498 1.00 72.03 C ATOM 3620 O THR B 113 -2.281 7.737 24.411 1.00 34.03 O ATOM 3621 CB THR B 113 -5.442 7.031 24.776 1.00 51.23 C ATOM 3622 OG1 THR B 113 -5.487 8.462 24.890 1.00 15.33 O ATOM 3623 CG2 THR B 113 -5.243 6.437 26.164 1.00 55.23 C ATOM 0 H THR B 113 -5.181 4.697 23.800 1.00 71.03 H new ATOM 0 HA THR B 113 -4.332 7.291 22.951 1.00 12.30 H new ATOM 0 HB THR B 113 -6.379 6.653 24.367 1.00 51.23 H new ATOM 0 HG1 THR B 113 -6.204 8.719 25.507 1.00 15.33 H new ATOM 0 HG21 THR B 113 -6.055 6.758 26.817 1.00 55.23 H new ATOM 0 HG22 THR B 113 -5.240 5.349 26.097 1.00 55.23 H new ATOM 0 HG23 THR B 113 -4.292 6.778 26.573 1.00 55.23 H new ATOM 3631 N LEU B 114 -2.573 5.638 25.187 1.00 42.02 N ATOM 3632 CA LEU B 114 -1.315 5.624 25.931 1.00 34.43 C ATOM 3633 C LEU B 114 -0.124 5.819 24.995 1.00 70.23 C ATOM 3634 O LEU B 114 0.775 6.604 25.286 1.00 14.10 O ATOM 3635 CB LEU B 114 -1.158 4.327 26.740 1.00 61.41 C ATOM 3636 CG LEU B 114 -2.232 4.088 27.819 1.00 44.12 C ATOM 3637 CD1 LEU B 114 -1.835 2.928 28.729 1.00 65.44 C ATOM 3638 CD2 LEU B 114 -2.484 5.358 28.632 1.00 20.12 C ATOM 0 H LEU B 114 -3.109 4.772 25.246 1.00 42.02 H new ATOM 0 HA LEU B 114 -1.340 6.457 26.633 1.00 34.43 H new ATOM 0 HB2 LEU B 114 -1.167 3.484 26.049 1.00 61.41 H new ATOM 0 HB3 LEU B 114 -0.180 4.334 27.220 1.00 61.41 H new ATOM 0 HG LEU B 114 -3.162 3.823 27.317 1.00 44.12 H new ATOM 0 HD11 LEU B 114 -2.607 2.777 29.483 1.00 65.44 H new ATOM 0 HD12 LEU B 114 -1.725 2.021 28.135 1.00 65.44 H new ATOM 0 HD13 LEU B 114 -0.889 3.157 29.219 1.00 65.44 H new ATOM 0 HD21 LEU B 114 -3.246 5.162 29.386 1.00 20.12 H new ATOM 0 HD22 LEU B 114 -1.560 5.666 29.121 1.00 20.12 H new ATOM 0 HD23 LEU B 114 -2.826 6.153 27.969 1.00 20.12 H new ATOM 3650 N VAL B 115 -0.137 5.119 23.865 1.00 61.11 N ATOM 3651 CA VAL B 115 0.927 5.246 22.870 1.00 23.35 C ATOM 3652 C VAL B 115 0.955 6.669 22.306 1.00 63.55 C ATOM 3653 O VAL B 115 2.027 7.271 22.125 1.00 10.54 O ATOM 3654 CB VAL B 115 0.735 4.235 21.708 1.00 32.23 C ATOM 3655 CG1 VAL B 115 1.884 4.327 20.705 1.00 53.51 C ATOM 3656 CG2 VAL B 115 0.600 2.810 22.245 1.00 32.34 C ATOM 0 H VAL B 115 -0.872 4.458 23.614 1.00 61.11 H new ATOM 0 HA VAL B 115 1.873 5.029 23.366 1.00 23.35 H new ATOM 0 HB VAL B 115 -0.188 4.493 21.188 1.00 32.23 H new ATOM 0 HG11 VAL B 115 1.724 3.608 19.902 1.00 53.51 H new ATOM 0 HG12 VAL B 115 1.924 5.334 20.289 1.00 53.51 H new ATOM 0 HG13 VAL B 115 2.825 4.105 21.208 1.00 53.51 H new ATOM 0 HG21 VAL B 115 0.466 2.119 21.413 1.00 32.34 H new ATOM 0 HG22 VAL B 115 1.501 2.543 22.798 1.00 32.34 H new ATOM 0 HG23 VAL B 115 -0.263 2.751 22.908 1.00 32.34 H new ATOM 3666 N ASP B 116 -0.240 7.199 22.055 1.00 33.05 N ATOM 3667 CA ASP B 116 -0.408 8.546 21.509 1.00 4.03 C ATOM 3668 C ASP B 116 0.313 9.564 22.386 1.00 43.14 C ATOM 3669 O ASP B 116 1.246 10.240 21.943 1.00 21.31 O ATOM 3670 CB ASP B 116 -1.902 8.895 21.427 1.00 75.43 C ATOM 3671 CG ASP B 116 -2.170 10.233 20.751 1.00 20.42 C ATOM 3672 OD1 ASP B 116 -2.301 10.263 19.507 1.00 45.35 O ATOM 3673 OD2 ASP B 116 -2.274 11.255 21.463 1.00 32.45 O1- ATOM 0 H ASP B 116 -1.118 6.709 22.224 1.00 33.05 H new ATOM 0 HA ASP B 116 0.022 8.575 20.508 1.00 4.03 H new ATOM 0 HB2 ASP B 116 -2.423 8.109 20.880 1.00 75.43 H new ATOM 0 HB3 ASP B 116 -2.320 8.914 22.434 1.00 75.43 H new ATOM 3678 N ARG B 117 -0.103 9.630 23.649 1.00 65.05 N ATOM 3679 CA ARG B 117 0.447 10.591 24.596 1.00 30.34 C ATOM 3680 C ARG B 117 1.916 10.295 24.886 1.00 41.22 C ATOM 3681 O ARG B 117 2.716 11.203 25.109 1.00 22.44 O ATOM 3682 CB ARG B 117 -0.366 10.557 25.890 1.00 5.33 C ATOM 3683 CG ARG B 117 -0.446 9.175 26.526 1.00 52.02 C ATOM 3684 CD ARG B 117 -1.408 9.138 27.707 1.00 70.20 C ATOM 3685 NE ARG B 117 -0.886 9.873 28.863 1.00 35.41 N ATOM 3686 CZ ARG B 117 -1.377 9.782 30.102 1.00 33.14 C ATOM 3687 NH1 ARG B 117 -2.463 9.057 30.347 1.00 12.31 N1+ ATOM 3688 NH2 ARG B 117 -0.792 10.443 31.093 1.00 12.43 N ATOM 0 H ARG B 117 -0.824 9.024 24.040 1.00 65.05 H new ATOM 0 HA ARG B 117 0.387 11.587 24.157 1.00 30.34 H new ATOM 0 HB2 ARG B 117 0.076 11.251 26.605 1.00 5.33 H new ATOM 0 HB3 ARG B 117 -1.376 10.912 25.684 1.00 5.33 H new ATOM 0 HG2 ARG B 117 -0.765 8.450 25.777 1.00 52.02 H new ATOM 0 HG3 ARG B 117 0.547 8.872 26.859 1.00 52.02 H new ATOM 0 HD2 ARG B 117 -2.366 9.565 27.408 1.00 70.20 H new ATOM 0 HD3 ARG B 117 -1.595 8.102 27.990 1.00 70.20 H new ATOM 0 HE ARG B 117 -0.093 10.497 28.711 1.00 35.41 H new ATOM 0 HH11 ARG B 117 -2.929 8.564 29.586 1.00 12.31 H new ATOM 0 HH12 ARG B 117 -2.830 8.994 31.296 1.00 12.31 H new ATOM 0 HH21 ARG B 117 0.030 11.018 30.907 1.00 12.43 H new ATOM 0 HH22 ARG B 117 -1.164 10.376 32.040 1.00 12.43 H new ATOM 3702 N ALA B 118 2.258 9.015 24.885 1.00 61.11 N ATOM 3703 CA ALA B 118 3.641 8.586 25.088 1.00 4.01 C ATOM 3704 C ALA B 118 4.555 9.192 24.024 1.00 4.12 C ATOM 3705 O ALA B 118 5.672 9.620 24.316 1.00 22.32 O ATOM 3706 CB ALA B 118 3.743 7.065 25.079 1.00 4.44 C ATOM 0 H ALA B 118 1.597 8.251 24.746 1.00 61.11 H new ATOM 0 HA ALA B 118 3.967 8.943 26.065 1.00 4.01 H new ATOM 0 HB1 ALA B 118 4.781 6.769 25.232 1.00 4.44 H new ATOM 0 HB2 ALA B 118 3.127 6.654 25.879 1.00 4.44 H new ATOM 0 HB3 ALA B 118 3.394 6.683 24.120 1.00 4.44 H new ATOM 3712 N HIS B 119 4.072 9.239 22.781 1.00 53.54 N ATOM 3713 CA HIS B 119 4.852 9.827 21.688 1.00 31.05 C ATOM 3714 C HIS B 119 4.908 11.352 21.771 1.00 22.51 C ATOM 3715 O HIS B 119 5.626 11.984 20.998 1.00 73.21 O ATOM 3716 CB HIS B 119 4.312 9.381 20.323 1.00 24.30 C ATOM 3717 CG HIS B 119 4.829 8.039 19.907 1.00 50.32 C ATOM 3718 ND1 HIS B 119 5.946 7.879 19.112 1.00 33.22 N ATOM 3719 CD2 HIS B 119 4.399 6.790 20.200 1.00 55.12 C ATOM 3720 CE1 HIS B 119 6.179 6.595 18.936 1.00 74.31 C ATOM 3721 NE2 HIS B 119 5.256 5.909 19.585 1.00 22.51 N ATOM 0 H HIS B 119 3.157 8.882 22.507 1.00 53.54 H new ATOM 0 HA HIS B 119 5.872 9.459 21.796 1.00 31.05 H new ATOM 0 HB2 HIS B 119 3.223 9.351 20.360 1.00 24.30 H new ATOM 0 HB3 HIS B 119 4.585 10.120 19.570 1.00 24.30 H new ATOM 0 HD2 HIS B 119 3.542 6.533 20.805 1.00 55.12 H new ATOM 0 HE1 HIS B 119 6.989 6.174 18.358 1.00 74.31 H new ATOM 0 HE2 HIS B 119 5.190 4.892 19.624 1.00 22.51 H new ATOM 3730 N HIS B 120 4.164 11.938 22.705 1.00 35.12 N ATOM 3731 CA HIS B 120 4.212 13.385 22.927 1.00 61.52 C ATOM 3732 C HIS B 120 5.529 13.781 23.598 1.00 22.12 C ATOM 3733 O HIS B 120 5.997 14.909 23.450 1.00 21.30 O ATOM 3734 CB HIS B 120 3.020 13.842 23.782 1.00 61.10 C ATOM 3735 CG HIS B 120 3.107 15.269 24.241 1.00 45.20 C ATOM 3736 ND1 HIS B 120 3.163 15.633 25.571 1.00 23.40 N ATOM 3737 CD2 HIS B 120 3.152 16.425 23.537 1.00 61.34 C ATOM 3738 CE1 HIS B 120 3.244 16.946 25.662 1.00 14.23 C ATOM 3739 NE2 HIS B 120 3.239 17.453 24.444 1.00 33.30 N ATOM 0 H HIS B 120 3.522 11.438 23.320 1.00 35.12 H new ATOM 0 HA HIS B 120 4.152 13.881 21.958 1.00 61.52 H new ATOM 0 HB2 HIS B 120 2.103 13.712 23.207 1.00 61.10 H new ATOM 0 HB3 HIS B 120 2.944 13.194 24.655 1.00 61.10 H new ATOM 0 HD2 HIS B 120 3.125 16.521 22.462 1.00 61.34 H new ATOM 0 HE1 HIS B 120 3.304 17.512 26.580 1.00 14.23 H new ATOM 0 HE2 HIS B 120 3.291 18.445 24.214 1.00 33.30 H new ATOM 3748 N VAL B 121 6.118 12.841 24.332 1.00 53.34 N ATOM 3749 CA VAL B 121 7.380 13.074 25.039 1.00 2.11 C ATOM 3750 C VAL B 121 8.498 12.217 24.446 1.00 31.12 C ATOM 3751 O VAL B 121 9.529 11.985 25.084 1.00 43.14 O ATOM 3752 CB VAL B 121 7.236 12.772 26.554 1.00 52.03 C ATOM 3753 CG1 VAL B 121 6.281 13.764 27.217 1.00 41.33 C ATOM 3754 CG2 VAL B 121 6.764 11.336 26.777 1.00 63.42 C ATOM 0 H VAL B 121 5.740 11.902 24.455 1.00 53.34 H new ATOM 0 HA VAL B 121 7.636 14.126 24.917 1.00 2.11 H new ATOM 0 HB VAL B 121 8.217 12.884 27.017 1.00 52.03 H new ATOM 0 HG11 VAL B 121 6.196 13.533 28.279 1.00 41.33 H new ATOM 0 HG12 VAL B 121 6.666 14.776 27.096 1.00 41.33 H new ATOM 0 HG13 VAL B 121 5.299 13.691 26.750 1.00 41.33 H new ATOM 0 HG21 VAL B 121 6.670 11.146 27.846 1.00 63.42 H new ATOM 0 HG22 VAL B 121 5.796 11.192 26.296 1.00 63.42 H new ATOM 0 HG23 VAL B 121 7.489 10.644 26.348 1.00 63.42 H new ATOM 3764 N CYS B 122 8.296 11.783 23.204 1.00 64.23 N ATOM 3765 CA CYS B 122 9.239 10.905 22.519 1.00 24.42 C ATOM 3766 C CYS B 122 10.579 11.611 22.277 1.00 23.34 C ATOM 3767 O CYS B 122 10.609 12.727 21.756 1.00 74.53 O ATOM 3768 CB CYS B 122 8.635 10.445 21.184 1.00 15.34 C ATOM 3769 SG CYS B 122 9.744 9.451 20.158 1.00 14.44 S ATOM 0 H CYS B 122 7.478 12.029 22.647 1.00 64.23 H new ATOM 0 HA CYS B 122 9.428 10.038 23.153 1.00 24.42 H new ATOM 0 HB2 CYS B 122 7.734 9.866 21.388 1.00 15.34 H new ATOM 0 HB3 CYS B 122 8.328 11.324 20.617 1.00 15.34 H new ATOM 0 HG CYS B 122 10.353 10.221 19.305 1.00 14.44 H new ATOM 3775 N PRO B 123 11.708 10.967 22.665 1.00 45.45 N ATOM 3776 CA PRO B 123 13.055 11.529 22.465 1.00 1.30 C ATOM 3777 C PRO B 123 13.325 11.858 20.995 1.00 21.43 C ATOM 3778 O PRO B 123 13.763 12.962 20.660 1.00 1.12 O ATOM 3779 CB PRO B 123 13.991 10.408 22.954 1.00 65.25 C ATOM 3780 CG PRO B 123 13.156 9.594 23.886 1.00 12.41 C ATOM 3781 CD PRO B 123 11.755 9.651 23.336 1.00 30.51 C ATOM 0 HA PRO B 123 13.192 12.470 22.998 1.00 1.30 H new ATOM 0 HB2 PRO B 123 14.356 9.806 22.122 1.00 65.25 H new ATOM 0 HB3 PRO B 123 14.866 10.816 23.460 1.00 65.25 H new ATOM 0 HG2 PRO B 123 13.515 8.566 23.936 1.00 12.41 H new ATOM 0 HG3 PRO B 123 13.195 9.995 24.899 1.00 12.41 H new ATOM 0 HD2 PRO B 123 11.563 8.836 22.638 1.00 30.51 H new ATOM 0 HD3 PRO B 123 11.009 9.576 24.127 1.00 30.51 H new ATOM 3789 N TYR B 124 13.061 10.887 20.122 1.00 44.15 N ATOM 3790 CA TYR B 124 13.182 11.099 18.686 1.00 41.53 C ATOM 3791 C TYR B 124 12.097 12.094 18.262 1.00 41.03 C ATOM 3792 O TYR B 124 10.902 11.802 18.348 1.00 24.42 O ATOM 3793 CB TYR B 124 13.086 9.758 17.935 1.00 11.44 C ATOM 3794 CG TYR B 124 14.142 8.747 18.383 1.00 34.02 C ATOM 3795 CD1 TYR B 124 15.309 8.521 17.643 1.00 62.34 C ATOM 3796 CD2 TYR B 124 13.983 8.039 19.573 1.00 4.11 C ATOM 3797 CE1 TYR B 124 16.266 7.621 18.076 1.00 22.14 C ATOM 3798 CE2 TYR B 124 14.936 7.137 20.003 1.00 2.53 C ATOM 3799 CZ TYR B 124 16.075 6.931 19.254 1.00 65.35 C ATOM 3800 OH TYR B 124 17.025 6.034 19.684 1.00 21.31 O ATOM 0 H TYR B 124 12.763 9.948 20.386 1.00 44.15 H new ATOM 0 HA TYR B 124 14.156 11.518 18.433 1.00 41.53 H new ATOM 0 HB2 TYR B 124 12.095 9.332 18.088 1.00 11.44 H new ATOM 0 HB3 TYR B 124 13.194 9.938 16.865 1.00 11.44 H new ATOM 0 HD1 TYR B 124 15.464 9.058 16.719 1.00 62.34 H new ATOM 0 HD2 TYR B 124 13.097 8.199 20.170 1.00 4.11 H new ATOM 0 HE1 TYR B 124 17.160 7.459 17.493 1.00 22.14 H new ATOM 0 HE2 TYR B 124 14.789 6.594 20.925 1.00 2.53 H new ATOM 0 HH TYR B 124 16.738 5.634 20.531 1.00 21.31 H new ATOM 3845 N THR B 128 10.409 13.432 12.985 1.00 13.32 N ATOM 3846 CA THR B 128 10.825 12.056 12.722 1.00 55.14 C ATOM 3847 C THR B 128 9.645 11.094 12.914 1.00 13.14 C ATOM 3848 O THR B 128 9.704 9.936 12.506 1.00 21.45 O ATOM 3849 CB THR B 128 12.016 11.650 13.639 1.00 41.45 C ATOM 3850 OG1 THR B 128 12.924 10.800 12.924 1.00 41.22 O ATOM 3851 CG2 THR B 128 11.547 10.924 14.898 1.00 11.25 C ATOM 0 HA THR B 128 11.159 11.994 11.686 1.00 55.14 H new ATOM 0 HB THR B 128 12.517 12.571 13.939 1.00 41.45 H new ATOM 0 HG1 THR B 128 13.670 10.552 13.509 1.00 41.22 H new ATOM 0 HG21 THR B 128 12.410 10.659 15.508 1.00 11.25 H new ATOM 0 HG22 THR B 128 10.885 11.576 15.469 1.00 11.25 H new ATOM 0 HG23 THR B 128 11.010 10.018 14.617 1.00 11.25 H new ATOM 3859 N ARG B 129 8.573 11.594 13.528 1.00 41.51 N ATOM 3860 CA ARG B 129 7.386 10.788 13.818 1.00 75.21 C ATOM 3861 C ARG B 129 6.164 11.340 13.089 1.00 73.32 C ATOM 3862 O ARG B 129 5.343 10.589 12.565 1.00 44.41 O ATOM 3863 CB ARG B 129 7.130 10.773 15.331 1.00 21.01 C ATOM 3864 CG ARG B 129 7.042 12.168 15.951 1.00 45.10 C ATOM 3865 CD ARG B 129 6.728 12.114 17.437 1.00 21.21 C ATOM 3866 NE ARG B 129 6.758 13.442 18.057 1.00 2.44 N ATOM 3867 CZ ARG B 129 5.709 14.034 18.639 1.00 0.21 C ATOM 3868 NH1 ARG B 129 4.520 13.441 18.658 1.00 5.12 N1+ ATOM 3869 NH2 ARG B 129 5.849 15.225 19.199 1.00 44.44 N ATOM 0 H ARG B 129 8.502 12.563 13.837 1.00 41.51 H new ATOM 0 HA ARG B 129 7.562 9.771 13.468 1.00 75.21 H new ATOM 0 HB2 ARG B 129 6.201 10.238 15.529 1.00 21.01 H new ATOM 0 HB3 ARG B 129 7.929 10.217 15.821 1.00 21.01 H new ATOM 0 HG2 ARG B 129 7.986 12.692 15.799 1.00 45.10 H new ATOM 0 HG3 ARG B 129 6.271 12.744 15.439 1.00 45.10 H new ATOM 0 HD2 ARG B 129 5.744 11.669 17.583 1.00 21.21 H new ATOM 0 HD3 ARG B 129 7.448 11.466 17.936 1.00 21.21 H new ATOM 0 HE ARG B 129 7.642 13.951 18.044 1.00 2.44 H new ATOM 0 HH11 ARG B 129 4.400 12.525 18.226 1.00 5.12 H new ATOM 0 HH12 ARG B 129 3.727 13.902 19.105 1.00 5.12 H new ATOM 0 HH21 ARG B 129 6.756 15.691 19.187 1.00 44.44 H new ATOM 0 HH22 ARG B 129 5.050 15.677 19.643 1.00 44.44 H new ATOM 3883 N ASN B 130 6.041 12.661 13.091 1.00 21.53 N ATOM 3884 CA ASN B 130 4.944 13.342 12.409 1.00 53.34 C ATOM 3885 C ASN B 130 5.200 13.397 10.905 1.00 22.35 C ATOM 3886 O ASN B 130 4.336 13.040 10.104 1.00 70.41 O ATOM 3887 CB ASN B 130 4.768 14.766 12.964 1.00 70.21 C ATOM 3888 CG ASN B 130 4.421 14.799 14.448 1.00 33.52 C ATOM 3889 OD1 ASN B 130 3.657 13.822 14.916 1.00 60.32 O flip ATOM 3890 ND2 ASN B 130 4.831 15.706 15.170 1.00 74.14 N flip ATOM 0 H ASN B 130 6.693 13.289 13.561 1.00 21.53 H new ATOM 0 HA ASN B 130 4.028 12.778 12.588 1.00 53.34 H new ATOM 0 HB2 ASN B 130 5.688 15.328 12.801 1.00 70.21 H new ATOM 0 HB3 ASN B 130 3.982 15.272 12.403 1.00 70.21 H new ATOM 0 HD21 ASN B 130 5.417 16.443 14.779 1.00 74.14 H new ATOM 0 HD22 ASN B 130 4.585 15.721 16.160 1.00 74.14 H new ATOM 3897 N ASN B 131 6.396 13.839 10.529 1.00 34.23 N ATOM 3898 CA ASN B 131 6.749 13.993 9.118 1.00 31.43 C ATOM 3899 C ASN B 131 6.964 12.634 8.456 1.00 54.44 C ATOM 3900 O ASN B 131 6.490 12.389 7.344 1.00 13.44 O ATOM 3901 CB ASN B 131 8.010 14.854 8.972 1.00 3.33 C ATOM 3902 CG ASN B 131 8.407 15.086 7.518 1.00 61.21 C ATOM 3903 OD1 ASN B 131 7.427 15.155 6.621 1.00 75.43 O flip ATOM 3904 ND2 ASN B 131 9.590 15.217 7.202 1.00 34.33 N flip ATOM 0 H ASN B 131 7.138 14.097 11.180 1.00 34.23 H new ATOM 0 HA ASN B 131 5.920 14.492 8.617 1.00 31.43 H new ATOM 0 HB2 ASN B 131 7.844 15.817 9.456 1.00 3.33 H new ATOM 0 HB3 ASN B 131 8.835 14.372 9.496 1.00 3.33 H new ATOM 0 HD21 ASN B 131 10.318 15.159 7.914 1.00 34.33 H new ATOM 0 HD22 ASN B 131 9.842 15.384 6.228 1.00 34.33 H new ATOM 3911 N VAL B 132 7.673 11.753 9.153 1.00 52.13 N ATOM 3912 CA VAL B 132 7.917 10.397 8.668 1.00 11.30 C ATOM 3913 C VAL B 132 6.712 9.518 8.981 1.00 11.32 C ATOM 3914 O VAL B 132 6.023 9.733 9.980 1.00 35.23 O ATOM 3915 CB VAL B 132 9.193 9.786 9.307 1.00 15.30 C ATOM 3916 CG1 VAL B 132 9.470 8.385 8.758 1.00 32.53 C ATOM 3917 CG2 VAL B 132 10.394 10.707 9.086 1.00 3.12 C ATOM 0 H VAL B 132 8.092 11.954 10.061 1.00 52.13 H new ATOM 0 HA VAL B 132 8.071 10.445 7.590 1.00 11.30 H new ATOM 0 HB VAL B 132 9.024 9.692 10.380 1.00 15.30 H new ATOM 0 HG11 VAL B 132 10.370 7.983 9.224 1.00 32.53 H new ATOM 0 HG12 VAL B 132 8.624 7.734 8.979 1.00 32.53 H new ATOM 0 HG13 VAL B 132 9.614 8.439 7.679 1.00 32.53 H new ATOM 0 HG21 VAL B 132 11.280 10.264 9.540 1.00 3.12 H new ATOM 0 HG22 VAL B 132 10.561 10.837 8.017 1.00 3.12 H new ATOM 0 HG23 VAL B 132 10.198 11.677 9.544 1.00 3.12 H new ATOM 3927 N ALA B 133 6.451 8.544 8.124 1.00 53.04 N ATOM 3928 CA ALA B 133 5.290 7.681 8.278 1.00 53.01 C ATOM 3929 C ALA B 133 5.517 6.639 9.356 1.00 72.23 C ATOM 3930 O ALA B 133 6.001 5.536 9.092 1.00 0.23 O ATOM 3931 CB ALA B 133 4.931 7.033 6.946 1.00 11.23 C ATOM 0 H ALA B 133 7.030 8.330 7.312 1.00 53.04 H new ATOM 0 HA ALA B 133 4.447 8.295 8.596 1.00 53.01 H new ATOM 0 HB1 ALA B 133 4.061 6.390 7.077 1.00 11.23 H new ATOM 0 HB2 ALA B 133 4.703 7.808 6.214 1.00 11.23 H new ATOM 0 HB3 ALA B 133 5.772 6.437 6.593 1.00 11.23 H new ATOM 3937 N VAL B 134 5.206 7.016 10.588 1.00 34.41 N ATOM 3938 CA VAL B 134 5.220 6.080 11.690 1.00 31.34 C ATOM 3939 C VAL B 134 3.800 5.686 12.064 1.00 33.12 C ATOM 3940 O VAL B 134 3.019 6.513 12.542 1.00 12.15 O ATOM 3941 CB VAL B 134 5.922 6.651 12.937 1.00 33.43 C ATOM 3942 CG1 VAL B 134 6.163 5.528 13.936 1.00 61.10 C ATOM 3943 CG2 VAL B 134 7.223 7.356 12.562 1.00 5.41 C ATOM 0 H VAL B 134 4.941 7.967 10.844 1.00 34.41 H new ATOM 0 HA VAL B 134 5.781 5.208 11.353 1.00 31.34 H new ATOM 0 HB VAL B 134 5.279 7.400 13.399 1.00 33.43 H new ATOM 0 HG11 VAL B 134 6.660 5.928 14.820 1.00 61.10 H new ATOM 0 HG12 VAL B 134 5.209 5.086 14.224 1.00 61.10 H new ATOM 0 HG13 VAL B 134 6.793 4.764 13.480 1.00 61.10 H new ATOM 0 HG21 VAL B 134 7.696 7.749 13.462 1.00 5.41 H new ATOM 0 HG22 VAL B 134 7.895 6.647 12.079 1.00 5.41 H new ATOM 0 HG23 VAL B 134 7.008 8.177 11.877 1.00 5.41 H new ATOM 3953 N ARG B 135 3.466 4.428 11.829 1.00 11.21 N ATOM 3954 CA ARG B 135 2.159 3.896 12.190 1.00 24.23 C ATOM 3955 C ARG B 135 2.184 3.358 13.614 1.00 24.22 C ATOM 3956 O ARG B 135 2.995 2.494 13.948 1.00 54.44 O ATOM 3957 CB ARG B 135 1.723 2.793 11.211 1.00 74.32 C ATOM 3958 CG ARG B 135 0.903 3.308 10.031 1.00 34.13 C ATOM 3959 CD ARG B 135 1.680 4.288 9.157 1.00 2.43 C ATOM 3960 NE ARG B 135 0.812 4.926 8.163 1.00 1.50 N ATOM 3961 CZ ARG B 135 1.162 5.175 6.901 1.00 23.13 C ATOM 3962 NH1 ARG B 135 2.347 4.800 6.443 1.00 1.54 N1+ ATOM 3963 NH2 ARG B 135 0.309 5.790 6.092 1.00 14.33 N ATOM 0 H ARG B 135 4.086 3.750 11.386 1.00 11.21 H new ATOM 0 HA ARG B 135 1.434 4.708 12.131 1.00 24.23 H new ATOM 0 HB2 ARG B 135 2.610 2.285 10.832 1.00 74.32 H new ATOM 0 HB3 ARG B 135 1.137 2.050 11.752 1.00 74.32 H new ATOM 0 HG2 ARG B 135 0.579 2.463 9.423 1.00 34.13 H new ATOM 0 HG3 ARG B 135 0.003 3.796 10.405 1.00 34.13 H new ATOM 0 HD2 ARG B 135 2.139 5.052 9.785 1.00 2.43 H new ATOM 0 HD3 ARG B 135 2.490 3.763 8.651 1.00 2.43 H new ATOM 0 HE ARG B 135 -0.126 5.199 8.458 1.00 1.50 H new ATOM 0 HH11 ARG B 135 3.001 4.316 7.058 1.00 1.54 H new ATOM 0 HH12 ARG B 135 2.605 4.995 5.476 1.00 1.54 H new ATOM 0 HH21 ARG B 135 -0.609 6.070 6.437 1.00 14.33 H new ATOM 0 HH22 ARG B 135 0.572 5.983 5.125 1.00 14.33 H new ATOM 3977 N LEU B 136 1.307 3.889 14.452 1.00 62.51 N ATOM 3978 CA LEU B 136 1.176 3.425 15.816 1.00 72.41 C ATOM 3979 C LEU B 136 0.176 2.288 15.882 1.00 41.21 C ATOM 3980 O LEU B 136 -1.004 2.460 15.565 1.00 33.52 O ATOM 3981 CB LEU B 136 0.759 4.580 16.720 1.00 60.04 C ATOM 3982 CG LEU B 136 1.817 5.680 16.852 1.00 34.22 C ATOM 3983 CD1 LEU B 136 1.327 6.808 17.755 1.00 41.31 C ATOM 3984 CD2 LEU B 136 3.130 5.094 17.367 1.00 0.00 C ATOM 0 H LEU B 136 0.672 4.648 14.204 1.00 62.51 H new ATOM 0 HA LEU B 136 2.138 3.051 16.166 1.00 72.41 H new ATOM 0 HB2 LEU B 136 -0.160 5.019 16.331 1.00 60.04 H new ATOM 0 HB3 LEU B 136 0.531 4.188 17.711 1.00 60.04 H new ATOM 0 HG LEU B 136 1.995 6.105 15.864 1.00 34.22 H new ATOM 0 HD11 LEU B 136 2.098 7.575 17.831 1.00 41.31 H new ATOM 0 HD12 LEU B 136 0.422 7.244 17.333 1.00 41.31 H new ATOM 0 HD13 LEU B 136 1.111 6.412 18.747 1.00 41.31 H new ATOM 0 HD21 LEU B 136 3.872 5.887 17.456 1.00 0.00 H new ATOM 0 HD22 LEU B 136 2.967 4.639 18.344 1.00 0.00 H new ATOM 0 HD23 LEU B 136 3.489 4.337 16.669 1.00 0.00 H new ATOM 3996 N VAL B 137 0.665 1.128 16.279 1.00 22.01 N ATOM 3997 CA VAL B 137 -0.139 -0.076 16.348 1.00 61.13 C ATOM 3998 C VAL B 137 -0.029 -0.691 17.738 1.00 31.22 C ATOM 3999 O VAL B 137 1.065 -0.952 18.234 1.00 63.04 O ATOM 4000 CB VAL B 137 0.287 -1.096 15.253 1.00 72.22 C ATOM 4001 CG1 VAL B 137 1.802 -1.079 15.051 1.00 20.11 C ATOM 4002 CG2 VAL B 137 -0.194 -2.507 15.598 1.00 5.14 C ATOM 0 H VAL B 137 1.635 0.995 16.564 1.00 22.01 H new ATOM 0 HA VAL B 137 -1.180 0.188 16.162 1.00 61.13 H new ATOM 0 HB VAL B 137 -0.186 -0.796 14.318 1.00 72.22 H new ATOM 0 HG11 VAL B 137 2.074 -1.800 14.281 1.00 20.11 H new ATOM 0 HG12 VAL B 137 2.117 -0.082 14.742 1.00 20.11 H new ATOM 0 HG13 VAL B 137 2.297 -1.342 15.986 1.00 20.11 H new ATOM 0 HG21 VAL B 137 0.118 -3.199 14.816 1.00 5.14 H new ATOM 0 HG22 VAL B 137 0.238 -2.816 16.550 1.00 5.14 H new ATOM 0 HG23 VAL B 137 -1.281 -2.512 15.675 1.00 5.14 H new ATOM 4012 N VAL B 138 -1.168 -0.888 18.377 1.00 51.04 N ATOM 4013 CA VAL B 138 -1.201 -1.461 19.711 1.00 24.22 C ATOM 4014 C VAL B 138 -1.326 -2.975 19.596 1.00 70.52 C ATOM 4015 O VAL B 138 -2.062 -3.488 18.748 1.00 62.24 O ATOM 4016 CB VAL B 138 -2.348 -0.862 20.564 1.00 51.45 C ATOM 4017 CG1 VAL B 138 -2.445 0.642 20.338 1.00 13.13 C ATOM 4018 CG2 VAL B 138 -3.679 -1.557 20.284 1.00 0.20 C ATOM 0 H VAL B 138 -2.085 -0.659 17.993 1.00 51.04 H new ATOM 0 HA VAL B 138 -0.273 -1.214 20.226 1.00 24.22 H new ATOM 0 HB VAL B 138 -2.116 -1.035 21.615 1.00 51.45 H new ATOM 0 HG11 VAL B 138 -3.255 1.049 20.943 1.00 13.13 H new ATOM 0 HG12 VAL B 138 -1.505 1.114 20.624 1.00 13.13 H new ATOM 0 HG13 VAL B 138 -2.645 0.840 19.285 1.00 13.13 H new ATOM 0 HG21 VAL B 138 -4.459 -1.110 20.900 1.00 0.20 H new ATOM 0 HG22 VAL B 138 -3.936 -1.440 19.231 1.00 0.20 H new ATOM 0 HG23 VAL B 138 -3.593 -2.618 20.521 1.00 0.20 H new ATOM 4028 N ALA B 139 -0.574 -3.681 20.419 1.00 41.23 N ATOM 4029 CA ALA B 139 -0.451 -5.133 20.293 1.00 52.34 C ATOM 4030 C ALA B 139 -1.722 -5.843 20.757 1.00 22.31 C ATOM 4031 O ALA B 139 -2.040 -5.775 21.963 1.00 10.42 O ATOM 4032 CB ALA B 139 0.759 -5.642 21.057 1.00 71.35 C ATOM 4033 OXT ALA B 139 -2.389 -6.483 19.917 1.00 0.00 O1- ATOM 0 H ALA B 139 -0.035 -3.278 21.186 1.00 41.23 H new ATOM 0 HA ALA B 139 -0.310 -5.361 19.237 1.00 52.34 H new ATOM 0 HB1 ALA B 139 0.829 -6.724 20.948 1.00 71.35 H new ATOM 0 HB2 ALA B 139 1.662 -5.178 20.660 1.00 71.35 H new ATOM 0 HB3 ALA B 139 0.656 -5.389 22.112 1.00 71.35 H new