USER MOD reduce.3.24.130724 H: found=0, std=0, add=2018, rem=0, adj=64 USER MOD reduce.3.24.130724 removed 2016 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 126 ASN : amide:sc= 1.51 K(o=1.8,f=-3.9) USER MOD Set 1.2: A 130 ASN : amide:sc= 0.955 K(o=1.8,f=-0.35) USER MOD Set 1.3: B 131 ASN : amide:sc= -0.648! C(o=1.8!,f=-6.3!) USER MOD Set 2.1: B 126 ASN : amide:sc= 0.0791 K(o=0.066,f=-1.8) USER MOD Set 2.2: B 130 ASN : amide:sc= -0.0128 K(o=0.066,f=-0.45) USER MOD Set 3.1: A 10 THR OG1 : rot 180:sc= -0.211 USER MOD Set 3.2: B 80 THR OG1 : rot 180:sc= 0 USER MOD Set 4.1: A 80 THR OG1 : rot 180:sc= 0 USER MOD Set 4.2: B 10 THR OG1 : rot -134:sc= 0.602 USER MOD Set 4.3: B 22 HIS : no HE2:sc= 0.629 K(o=1.2,f=-4!) USER MOD Set 5.1: A 60 SER OG : rot -138:sc= -0.219 USER MOD Set 5.2: A 63 LYS NZ :NH3+ 142:sc= -0.821 (180deg=-3.11!) USER MOD Set 6.1: A 54 TYR OH : rot -130:sc= 0.0935 USER MOD Set 6.2: A 125 SER OG : rot -36:sc= -1.39 USER MOD Set 7.1: A 45 ASN : amide:sc= -1.47 X(o=-1,f=-0.97!) USER MOD Set 7.2: B 5 TYR OH : rot 180:sc= 0.576 USER MOD Set 7.3: B 25 LYS NZ :NH3+ -121:sc= -0.149 (180deg=0) USER MOD Set 8.1: A 29 LYS NZ :NH3+ -164:sc= -2.6! (180deg=-4.19!) USER MOD Set 8.2: A 31 SER OG : rot -3:sc= 0.496 USER MOD Set 9.1: A 11 SER OG : rot -64:sc= 0.559 USER MOD Set 9.2: B 55 SER OG : rot -80:sc= 0.659 USER MOD Set10.1: A 5 TYR OH : rot -131:sc= 0.371 USER MOD Set10.2: A 7 THR OG1 : rot 121:sc= -0.417 USER MOD Set10.3: A 21 SER OG : rot -81:sc= -1.13! USER MOD Set10.4: A 25 LYS NZ :NH3+ 176:sc= 1.46 (180deg=0) USER MOD Set10.5: B 45 ASN : amide:sc= -1.89 K(o=-4.3,f=-11!) USER MOD Set10.6: B 48 GLN : amide:sc= -2.72! C(o=-4.3!,f=-18!) USER MOD Single : A 1 MET CE :methyl -164:sc= -2.94! (180deg=-3.82!) USER MOD Single : A 1 MET N :NH3+ -116:sc= 0.109 (180deg=-0.0731) USER MOD Single : A 2 ASN : amide:sc= 0 X(o=0,f=-0.44) USER MOD Single : A 6 LYS NZ :NH3+ -176:sc= 2.46 (180deg=2.43) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 THR OG1 : rot -110:sc= 0.824 USER MOD Single : A 22 HIS : no HD1:sc= -0.031 X(o=-0.031,f=-0.031) USER MOD Single : A 24 GLN : amide:sc= 0.223 X(o=0.22,f=-0.18) USER MOD Single : A 44 THR OG1 : rot 180:sc= -2.49! USER MOD Single : A 48 GLN : amide:sc= -1.2 K(o=-1.2,f=-2.5!) USER MOD Single : A 55 SER OG : rot 180:sc= -0.343 USER MOD Single : A 57 CYS SG : rot 73:sc= -1.21! USER MOD Single : A 62 MET CE :methyl -161:sc= -0.171 (180deg=-0.684) USER MOD Single : A 68 GLN : amide:sc= 0 X(o=0,f=0.093) USER MOD Single : A 69 ASN : amide:sc= 0.327 X(o=0.33,f=-0.093) USER MOD Single : A 70 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.016) USER MOD Single : A 71 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 72 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 THR OG1 : rot 43:sc= 0.728 USER MOD Single : A 78 THR OG1 : rot 180:sc= -0.0194 USER MOD Single : A 88 ASN : amide:sc= -1.84 K(o=-1.8,f=-10!) USER MOD Single : A 112 LYS NZ :NH3+ -132:sc= -1.8 (180deg=-4.39!) USER MOD Single : A 113 THR OG1 : rot 180:sc= 0 USER MOD Single : A 119 HIS : no HE2:sc= -1.56 K(o=-1.6,f=-4!) USER MOD Single : A 120 HIS : no HD1:sc= -0.107 K(o=-0.11,f=-1.3) USER MOD Single : A 122 CYS SG : rot 85:sc= 0.721 USER MOD Single : A 124 TYR OH : rot 180:sc= 0 USER MOD Single : A 128 THR OG1 : rot 180:sc= -1.87! USER MOD Single : A 131 ASN : amide:sc= -1.24 K(o=-1.2,f=-4.8!) USER MOD Single : B 1 MET CE :methyl -146:sc= -0.889 (180deg=-3.84!) USER MOD Single : B 1 MET N :NH3+ 133:sc= 0.0864 (180deg=-0.152) USER MOD Single : B 2 ASN : amide:sc= 0 K(o=0,f=-0.74) USER MOD Single : B 6 LYS NZ :NH3+ -160:sc= 1.28 (180deg=0.768) USER MOD Single : B 7 THR OG1 : rot 98:sc= 0.744 USER MOD Single : B 11 SER OG : rot 36:sc= 1.23 USER MOD Single : B 12 THR OG1 : rot -130:sc= 0.637 USER MOD Single : B 20 THR OG1 : rot -140:sc= 0 USER MOD Single : B 21 SER OG : rot -73:sc= 0.647 USER MOD Single : B 24 GLN : amide:sc= 0.437 K(o=0.44,f=-0.11) USER MOD Single : B 29 LYS NZ :NH3+ -152:sc= -2.17! (180deg=-3.77!) USER MOD Single : B 31 SER OG : rot 90:sc= 0.47 USER MOD Single : B 44 THR OG1 : rot 180:sc= 0 USER MOD Single : B 54 TYR OH : rot -92:sc= -1.88 USER MOD Single : B 57 CYS SG : rot 180:sc= -1.6 USER MOD Single : B 60 SER OG : rot 92:sc= 0.644 USER MOD Single : B 62 MET CE :methyl -113:sc= -0.502 (180deg=-3.34!) USER MOD Single : B 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 68 GLN : amide:sc= -0.441 X(o=-0.44,f=0) USER MOD Single : B 69 ASN : amide:sc= 0.966 K(o=0.97,f=-5!) USER MOD Single : B 70 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00413) USER MOD Single : B 71 GLN :FLIP amide:sc= -0.0253 F(o=-1.2,f=-0.025) USER MOD Single : B 72 THR OG1 : rot 180:sc= 0 USER MOD Single : B 77 THR OG1 : rot 57:sc= 1.09 USER MOD Single : B 78 THR OG1 : rot 180:sc= -0.0673 USER MOD Single : B 88 ASN : amide:sc= -0.247 K(o=-0.25,f=-11!) USER MOD Single : B 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 113 THR OG1 : rot 180:sc= 0 USER MOD Single : B 119 HIS : no HE2:sc= -1.72 K(o=-1.7,f=-6.8!) USER MOD Single : B 120 HIS : no HD1:sc= -0.183 X(o=-0.18,f=0) USER MOD Single : B 122 CYS SG : rot 96:sc= 0.293 USER MOD Single : B 124 TYR OH : rot 12:sc= 0.775 USER MOD Single : B 125 SER OG : rot 8:sc= -2.19! USER MOD Single : B 128 THR OG1 : rot 155:sc= -0.758 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 2.139 0.183 -0.034 1.00 60.05 N ATOM 2 CA MET A 1 3.284 0.368 -0.960 1.00 3.23 C ATOM 3 C MET A 1 3.858 -0.977 -1.382 1.00 42.13 C ATOM 4 O MET A 1 3.444 -2.026 -0.886 1.00 30.31 O ATOM 5 CB MET A 1 4.385 1.208 -0.304 1.00 13.52 C ATOM 6 CG MET A 1 5.049 0.511 0.870 1.00 60.32 C ATOM 7 SD MET A 1 6.305 1.524 1.669 1.00 71.43 S ATOM 8 CE MET A 1 7.557 1.565 0.395 1.00 20.11 C ATOM 0 H1 MET A 1 1.271 0.546 -0.478 1.00 60.05 H new ATOM 0 H2 MET A 1 2.023 -0.829 0.177 1.00 60.05 H new ATOM 0 H3 MET A 1 2.319 0.702 0.849 1.00 60.05 H new ATOM 0 HA MET A 1 2.915 0.892 -1.842 1.00 3.23 H new ATOM 0 HB2 MET A 1 5.142 1.450 -1.050 1.00 13.52 H new ATOM 0 HB3 MET A 1 3.959 2.152 0.036 1.00 13.52 H new ATOM 0 HG2 MET A 1 4.288 0.240 1.602 1.00 60.32 H new ATOM 0 HG3 MET A 1 5.504 -0.417 0.525 1.00 60.32 H new ATOM 0 HE1 MET A 1 8.501 1.901 0.823 1.00 20.11 H new ATOM 0 HE2 MET A 1 7.684 0.566 -0.023 1.00 20.11 H new ATOM 0 HE3 MET A 1 7.251 2.252 -0.394 1.00 20.11 H new ATOM 20 N ASN A 2 4.831 -0.933 -2.285 1.00 22.52 N ATOM 21 CA ASN A 2 5.470 -2.139 -2.804 1.00 14.33 C ATOM 22 C ASN A 2 6.812 -2.352 -2.111 1.00 22.14 C ATOM 23 O ASN A 2 7.854 -1.920 -2.599 1.00 72.55 O ATOM 24 CB ASN A 2 5.667 -2.037 -4.327 1.00 31.34 C ATOM 25 CG ASN A 2 6.286 -3.292 -4.929 1.00 75.52 C ATOM 26 OD1 ASN A 2 6.064 -4.405 -4.447 1.00 52.13 O ATOM 27 ND2 ASN A 2 7.068 -3.119 -5.985 1.00 35.23 N ATOM 0 H ASN A 2 5.198 -0.066 -2.677 1.00 22.52 H new ATOM 0 HA ASN A 2 4.823 -2.992 -2.600 1.00 14.33 H new ATOM 0 HB2 ASN A 2 4.704 -1.849 -4.801 1.00 31.34 H new ATOM 0 HB3 ASN A 2 6.304 -1.181 -4.550 1.00 31.34 H new ATOM 0 HD21 ASN A 2 7.511 -3.923 -6.429 1.00 35.23 H new ATOM 0 HD22 ASN A 2 7.227 -2.181 -6.354 1.00 35.23 H new ATOM 34 N ILE A 3 6.767 -2.973 -0.941 1.00 0.23 N ATOM 35 CA ILE A 3 7.966 -3.219 -0.146 1.00 51.02 C ATOM 36 C ILE A 3 8.914 -4.203 -0.831 1.00 3.13 C ATOM 37 O ILE A 3 8.506 -5.286 -1.258 1.00 22.24 O ATOM 38 CB ILE A 3 7.591 -3.763 1.252 1.00 43.32 C ATOM 39 CG1 ILE A 3 6.749 -2.733 2.015 1.00 25.54 C ATOM 40 CG2 ILE A 3 8.837 -4.134 2.049 1.00 24.42 C ATOM 41 CD1 ILE A 3 7.528 -1.499 2.422 1.00 23.10 C ATOM 0 H ILE A 3 5.906 -3.319 -0.517 1.00 0.23 H new ATOM 0 HA ILE A 3 8.479 -2.263 -0.043 1.00 51.02 H new ATOM 0 HB ILE A 3 6.999 -4.668 1.117 1.00 43.32 H new ATOM 0 HG12 ILE A 3 5.906 -2.432 1.393 1.00 25.54 H new ATOM 0 HG13 ILE A 3 6.335 -3.203 2.907 1.00 25.54 H new ATOM 0 HG21 ILE A 3 8.543 -4.514 3.028 1.00 24.42 H new ATOM 0 HG22 ILE A 3 9.395 -4.902 1.514 1.00 24.42 H new ATOM 0 HG23 ILE A 3 9.464 -3.252 2.175 1.00 24.42 H new ATOM 0 HD11 ILE A 3 6.871 -0.814 2.957 1.00 23.10 H new ATOM 0 HD12 ILE A 3 8.355 -1.788 3.070 1.00 23.10 H new ATOM 0 HD13 ILE A 3 7.919 -1.006 1.532 1.00 23.10 H new ATOM 53 N LEU A 4 10.178 -3.805 -0.934 1.00 41.13 N ATOM 54 CA LEU A 4 11.235 -4.669 -1.447 1.00 42.04 C ATOM 55 C LEU A 4 11.802 -5.513 -0.317 1.00 41.22 C ATOM 56 O LEU A 4 12.036 -6.712 -0.476 1.00 74.21 O ATOM 57 CB LEU A 4 12.358 -3.830 -2.071 1.00 22.30 C ATOM 58 CG LEU A 4 11.929 -2.915 -3.223 1.00 5.11 C ATOM 59 CD1 LEU A 4 13.112 -2.083 -3.718 1.00 73.22 C ATOM 60 CD2 LEU A 4 11.314 -3.723 -4.364 1.00 52.13 C ATOM 0 H LEU A 4 10.498 -2.875 -0.664 1.00 41.13 H new ATOM 0 HA LEU A 4 10.812 -5.319 -2.213 1.00 42.04 H new ATOM 0 HB2 LEU A 4 12.808 -3.217 -1.290 1.00 22.30 H new ATOM 0 HB3 LEU A 4 13.134 -4.504 -2.434 1.00 22.30 H new ATOM 0 HG LEU A 4 11.166 -2.233 -2.849 1.00 5.11 H new ATOM 0 HD11 LEU A 4 12.788 -1.440 -4.536 1.00 73.22 H new ATOM 0 HD12 LEU A 4 13.492 -1.468 -2.902 1.00 73.22 H new ATOM 0 HD13 LEU A 4 13.902 -2.747 -4.070 1.00 73.22 H new ATOM 0 HD21 LEU A 4 11.018 -3.050 -5.168 1.00 52.13 H new ATOM 0 HD22 LEU A 4 12.046 -4.438 -4.740 1.00 52.13 H new ATOM 0 HD23 LEU A 4 10.438 -4.259 -3.999 1.00 52.13 H new ATOM 72 N TYR A 5 12.023 -4.879 0.832 1.00 24.01 N ATOM 73 CA TYR A 5 12.566 -5.578 1.996 1.00 4.44 C ATOM 74 C TYR A 5 11.892 -5.081 3.262 1.00 12.52 C ATOM 75 O TYR A 5 11.695 -3.885 3.433 1.00 21.34 O ATOM 76 CB TYR A 5 14.085 -5.374 2.089 1.00 54.43 C ATOM 77 CG TYR A 5 14.762 -6.173 3.193 1.00 2.54 C ATOM 78 CD1 TYR A 5 14.918 -5.646 4.474 1.00 4.50 C ATOM 79 CD2 TYR A 5 15.259 -7.451 2.950 1.00 14.20 C ATOM 80 CE1 TYR A 5 15.549 -6.368 5.472 1.00 2.54 C ATOM 81 CE2 TYR A 5 15.883 -8.172 3.943 1.00 4.33 C ATOM 82 CZ TYR A 5 16.028 -7.632 5.199 1.00 33.20 C ATOM 83 OH TYR A 5 16.668 -8.359 6.179 1.00 31.30 O ATOM 0 H TYR A 5 11.836 -3.888 0.983 1.00 24.01 H new ATOM 0 HA TYR A 5 12.368 -6.644 1.884 1.00 4.44 H new ATOM 0 HB2 TYR A 5 14.535 -5.645 1.134 1.00 54.43 H new ATOM 0 HB3 TYR A 5 14.288 -4.315 2.248 1.00 54.43 H new ATOM 0 HD1 TYR A 5 14.540 -4.658 4.691 1.00 4.50 H new ATOM 0 HD2 TYR A 5 15.153 -7.884 1.966 1.00 14.20 H new ATOM 0 HE1 TYR A 5 15.666 -5.944 6.458 1.00 2.54 H new ATOM 0 HE2 TYR A 5 16.259 -9.163 3.735 1.00 4.33 H new ATOM 0 HH TYR A 5 17.508 -8.719 5.824 1.00 31.30 H new ATOM 93 N LYS A 6 11.519 -6.004 4.131 1.00 51.40 N ATOM 94 CA LYS A 6 10.916 -5.664 5.416 1.00 43.32 C ATOM 95 C LYS A 6 11.342 -6.659 6.486 1.00 62.42 C ATOM 96 O LYS A 6 11.424 -7.863 6.235 1.00 13.53 O ATOM 97 CB LYS A 6 9.380 -5.611 5.315 1.00 1.54 C ATOM 98 CG LYS A 6 8.679 -5.520 6.670 1.00 51.03 C ATOM 99 CD LYS A 6 7.184 -5.237 6.543 1.00 30.33 C ATOM 100 CE LYS A 6 6.905 -3.786 6.159 1.00 61.32 C ATOM 101 NZ LYS A 6 5.476 -3.428 6.353 1.00 4.41 N1+ ATOM 0 H LYS A 6 11.623 -7.006 3.971 1.00 51.40 H new ATOM 0 HA LYS A 6 11.270 -4.673 5.699 1.00 43.32 H new ATOM 0 HB2 LYS A 6 9.094 -4.751 4.709 1.00 1.54 H new ATOM 0 HB3 LYS A 6 9.028 -6.500 4.793 1.00 1.54 H new ATOM 0 HG2 LYS A 6 8.823 -6.455 7.212 1.00 51.03 H new ATOM 0 HG3 LYS A 6 9.144 -4.733 7.263 1.00 51.03 H new ATOM 0 HD2 LYS A 6 6.752 -5.900 5.793 1.00 30.33 H new ATOM 0 HD3 LYS A 6 6.691 -5.463 7.489 1.00 30.33 H new ATOM 0 HE2 LYS A 6 7.530 -3.125 6.759 1.00 61.32 H new ATOM 0 HE3 LYS A 6 7.181 -3.626 5.117 1.00 61.32 H new ATOM 0 HZ1 LYS A 6 5.313 -2.457 6.018 1.00 4.41 H new ATOM 0 HZ2 LYS A 6 4.877 -4.086 5.814 1.00 4.41 H new ATOM 0 HZ3 LYS A 6 5.237 -3.490 7.363 1.00 4.41 H new ATOM 115 N THR A 7 11.615 -6.138 7.670 1.00 30.21 N ATOM 116 CA THR A 7 11.992 -6.941 8.818 1.00 33.22 C ATOM 117 C THR A 7 11.298 -6.390 10.063 1.00 54.23 C ATOM 118 O THR A 7 10.552 -5.408 9.981 1.00 73.02 O ATOM 119 CB THR A 7 13.530 -6.952 9.009 1.00 43.13 C ATOM 120 OG1 THR A 7 13.889 -7.722 10.169 1.00 11.53 O ATOM 121 CG2 THR A 7 14.080 -5.531 9.134 1.00 62.33 C ATOM 0 H THR A 7 11.581 -5.137 7.862 1.00 30.21 H new ATOM 0 HA THR A 7 11.676 -7.971 8.651 1.00 33.22 H new ATOM 0 HB THR A 7 13.972 -7.415 8.126 1.00 43.13 H new ATOM 0 HG1 THR A 7 14.486 -8.453 9.905 1.00 11.53 H new ATOM 0 HG21 THR A 7 15.161 -5.570 9.267 1.00 62.33 H new ATOM 0 HG22 THR A 7 13.846 -4.969 8.230 1.00 62.33 H new ATOM 0 HG23 THR A 7 13.626 -5.039 9.994 1.00 62.33 H new ATOM 129 N ALA A 8 11.540 -7.017 11.204 1.00 51.42 N ATOM 130 CA ALA A 8 10.907 -6.617 12.453 1.00 62.45 C ATOM 131 C ALA A 8 11.803 -6.960 13.634 1.00 64.34 C ATOM 132 O ALA A 8 12.549 -7.943 13.599 1.00 4.53 O ATOM 133 CB ALA A 8 9.545 -7.289 12.601 1.00 11.23 C ATOM 0 H ALA A 8 12.175 -7.811 11.291 1.00 51.42 H new ATOM 0 HA ALA A 8 10.757 -5.538 12.435 1.00 62.45 H new ATOM 0 HB1 ALA A 8 9.086 -6.979 13.540 1.00 11.23 H new ATOM 0 HB2 ALA A 8 8.903 -6.997 11.770 1.00 11.23 H new ATOM 0 HB3 ALA A 8 9.671 -8.372 12.599 1.00 11.23 H new ATOM 139 N ALA A 9 11.725 -6.150 14.680 1.00 62.04 N ATOM 140 CA ALA A 9 12.526 -6.352 15.875 1.00 13.24 C ATOM 141 C ALA A 9 11.679 -6.113 17.115 1.00 53.42 C ATOM 142 O ALA A 9 10.964 -5.116 17.204 1.00 45.34 O ATOM 143 CB ALA A 9 13.740 -5.430 15.859 1.00 65.14 C ATOM 0 H ALA A 9 11.108 -5.339 14.723 1.00 62.04 H new ATOM 0 HA ALA A 9 12.883 -7.382 15.895 1.00 13.24 H new ATOM 0 HB1 ALA A 9 14.332 -5.592 16.760 1.00 65.14 H new ATOM 0 HB2 ALA A 9 14.349 -5.646 14.981 1.00 65.14 H new ATOM 0 HB3 ALA A 9 13.408 -4.392 15.824 1.00 65.14 H new ATOM 149 N THR A 10 11.750 -7.034 18.060 1.00 61.23 N ATOM 150 CA THR A 10 10.976 -6.947 19.283 1.00 51.35 C ATOM 151 C THR A 10 11.870 -6.470 20.430 1.00 43.21 C ATOM 152 O THR A 10 12.904 -7.071 20.723 1.00 73.43 O ATOM 153 CB THR A 10 10.317 -8.312 19.619 1.00 34.35 C ATOM 154 OG1 THR A 10 9.498 -8.202 20.790 1.00 3.15 O ATOM 155 CG2 THR A 10 11.359 -9.411 19.818 1.00 70.40 C ATOM 0 H THR A 10 12.345 -7.861 18.000 1.00 61.23 H new ATOM 0 HA THR A 10 10.175 -6.222 19.142 1.00 51.35 H new ATOM 0 HB THR A 10 9.694 -8.587 18.768 1.00 34.35 H new ATOM 0 HG1 THR A 10 9.089 -9.071 20.986 1.00 3.15 H new ATOM 0 HG21 THR A 10 10.857 -10.350 20.051 1.00 70.40 H new ATOM 0 HG22 THR A 10 11.943 -9.529 18.905 1.00 70.40 H new ATOM 0 HG23 THR A 10 12.022 -9.140 20.640 1.00 70.40 H new ATOM 163 N SER A 11 11.490 -5.359 21.042 1.00 71.32 N ATOM 164 CA SER A 11 12.260 -4.781 22.137 1.00 2.43 C ATOM 165 C SER A 11 11.535 -4.994 23.465 1.00 11.12 C ATOM 166 O SER A 11 10.449 -4.454 23.689 1.00 53.54 O ATOM 167 CB SER A 11 12.504 -3.288 21.879 1.00 22.21 C ATOM 168 OG SER A 11 11.287 -2.579 21.732 1.00 52.01 O ATOM 0 H SER A 11 10.649 -4.836 20.799 1.00 71.32 H new ATOM 0 HA SER A 11 13.226 -5.282 22.194 1.00 2.43 H new ATOM 0 HB2 SER A 11 13.075 -2.864 22.705 1.00 22.21 H new ATOM 0 HB3 SER A 11 13.107 -3.167 20.979 1.00 22.21 H new ATOM 0 HG SER A 11 10.818 -2.897 20.933 1.00 52.01 H new ATOM 174 N THR A 12 12.129 -5.798 24.334 1.00 54.12 N ATOM 175 CA THR A 12 11.523 -6.114 25.617 1.00 52.53 C ATOM 176 C THR A 12 11.874 -5.049 26.655 1.00 72.12 C ATOM 177 O THR A 12 12.933 -4.406 26.577 1.00 13.04 O ATOM 178 CB THR A 12 12.005 -7.492 26.130 1.00 35.03 C ATOM 179 OG1 THR A 12 12.204 -8.384 25.022 1.00 61.53 O ATOM 180 CG2 THR A 12 11.002 -8.105 27.105 1.00 33.34 C ATOM 0 H THR A 12 13.032 -6.244 24.173 1.00 54.12 H new ATOM 0 HA THR A 12 10.443 -6.141 25.472 1.00 52.53 H new ATOM 0 HB THR A 12 12.947 -7.342 26.657 1.00 35.03 H new ATOM 0 HG1 THR A 12 12.511 -9.254 25.353 1.00 61.53 H new ATOM 0 HG21 THR A 12 11.371 -9.072 27.446 1.00 33.34 H new ATOM 0 HG22 THR A 12 10.875 -7.442 27.961 1.00 33.34 H new ATOM 0 HG23 THR A 12 10.043 -8.239 26.604 1.00 33.34 H new ATOM 188 N GLY A 13 10.989 -4.876 27.627 1.00 62.44 N ATOM 189 CA GLY A 13 11.232 -3.944 28.703 1.00 34.44 C ATOM 190 C GLY A 13 12.173 -4.517 29.742 1.00 13.14 C ATOM 191 O GLY A 13 11.760 -4.818 30.863 1.00 50.55 O ATOM 0 H GLY A 13 10.099 -5.371 27.687 1.00 62.44 H new ATOM 0 HA2 GLY A 13 11.654 -3.024 28.299 1.00 34.44 H new ATOM 0 HA3 GLY A 13 10.286 -3.680 29.176 1.00 34.44 H new ATOM 195 N GLY A 14 13.437 -4.708 29.353 1.00 62.02 N ATOM 196 CA GLY A 14 14.448 -5.173 30.291 1.00 43.32 C ATOM 197 C GLY A 14 14.723 -4.172 31.405 1.00 33.13 C ATOM 198 O GLY A 14 13.900 -3.299 31.672 1.00 44.52 O ATOM 0 H GLY A 14 13.777 -4.548 28.405 1.00 62.02 H new ATOM 0 HA2 GLY A 14 14.124 -6.117 30.729 1.00 43.32 H new ATOM 0 HA3 GLY A 14 15.374 -5.373 29.751 1.00 43.32 H new ATOM 202 N ARG A 15 15.889 -4.298 32.051 1.00 24.13 N ATOM 203 CA ARG A 15 16.265 -3.400 33.156 1.00 34.21 C ATOM 204 C ARG A 15 16.030 -1.938 32.786 1.00 4.22 C ATOM 205 O ARG A 15 15.430 -1.187 33.555 1.00 73.04 O ATOM 206 CB ARG A 15 17.731 -3.613 33.574 1.00 34.44 C ATOM 207 CG ARG A 15 17.958 -4.823 34.484 1.00 1.44 C ATOM 208 CD ARG A 15 17.399 -4.599 35.893 1.00 44.04 C ATOM 209 NE ARG A 15 15.933 -4.515 35.916 1.00 64.51 N ATOM 210 CZ ARG A 15 15.236 -3.602 36.606 1.00 22.54 C ATOM 211 NH1 ARG A 15 15.863 -2.665 37.310 1.00 12.40 N1+ ATOM 212 NH2 ARG A 15 13.909 -3.634 36.593 1.00 44.23 N ATOM 0 H ARG A 15 16.587 -5.009 31.831 1.00 24.13 H new ATOM 0 HA ARG A 15 15.626 -3.647 34.004 1.00 34.21 H new ATOM 0 HB2 ARG A 15 18.339 -3.729 32.677 1.00 34.44 H new ATOM 0 HB3 ARG A 15 18.084 -2.718 34.085 1.00 34.44 H new ATOM 0 HG2 ARG A 15 17.486 -5.701 34.043 1.00 1.44 H new ATOM 0 HG3 ARG A 15 19.026 -5.033 34.547 1.00 1.44 H new ATOM 0 HD2 ARG A 15 17.722 -5.414 36.541 1.00 44.04 H new ATOM 0 HD3 ARG A 15 17.818 -3.680 36.303 1.00 44.04 H new ATOM 0 HE ARG A 15 15.409 -5.199 35.369 1.00 64.51 H new ATOM 0 HH11 ARG A 15 16.882 -2.637 37.328 1.00 12.40 H new ATOM 0 HH12 ARG A 15 15.325 -1.974 37.832 1.00 12.40 H new ATOM 0 HH21 ARG A 15 13.421 -4.353 36.058 1.00 44.23 H new ATOM 0 HH22 ARG A 15 13.377 -2.940 37.118 1.00 44.23 H new ATOM 226 N ASP A 16 16.523 -1.541 31.616 1.00 4.14 N ATOM 227 CA ASP A 16 16.216 -0.221 31.068 1.00 22.02 C ATOM 228 C ASP A 16 15.652 -0.383 29.668 1.00 52.02 C ATOM 229 O ASP A 16 14.660 0.246 29.303 1.00 74.22 O ATOM 230 CB ASP A 16 17.484 0.622 31.030 1.00 50.13 C ATOM 231 CG ASP A 16 17.280 2.014 30.447 1.00 53.42 C ATOM 232 OD1 ASP A 16 16.549 2.818 31.058 1.00 45.04 O ATOM 233 OD2 ASP A 16 17.882 2.311 29.394 1.00 61.02 O1- ATOM 0 H ASP A 16 17.134 -2.111 31.031 1.00 4.14 H new ATOM 0 HA ASP A 16 15.479 0.280 31.696 1.00 22.02 H new ATOM 0 HB2 ASP A 16 17.877 0.716 32.042 1.00 50.13 H new ATOM 0 HB3 ASP A 16 18.239 0.099 30.443 1.00 50.13 H new ATOM 238 N GLY A 17 16.277 -1.275 28.896 1.00 73.12 N ATOM 239 CA GLY A 17 15.676 -1.714 27.656 1.00 31.14 C ATOM 240 C GLY A 17 16.311 -2.982 27.131 1.00 63.12 C ATOM 241 O GLY A 17 17.436 -3.333 27.516 1.00 34.35 O ATOM 0 H GLY A 17 17.182 -1.695 29.110 1.00 73.12 H new ATOM 0 HA2 GLY A 17 14.610 -1.880 27.810 1.00 31.14 H new ATOM 0 HA3 GLY A 17 15.771 -0.926 26.909 1.00 31.14 H new ATOM 245 N ARG A 18 15.577 -3.689 26.285 1.00 71.41 N ATOM 246 CA ARG A 18 16.095 -4.847 25.575 1.00 64.41 C ATOM 247 C ARG A 18 15.689 -4.748 24.107 1.00 2.04 C ATOM 248 O ARG A 18 14.682 -4.123 23.794 1.00 73.24 O ATOM 249 CB ARG A 18 15.561 -6.137 26.209 1.00 30.54 C ATOM 250 CG ARG A 18 15.992 -7.397 25.479 1.00 21.30 C ATOM 251 CD ARG A 18 15.548 -8.658 26.202 1.00 2.42 C ATOM 252 NE ARG A 18 16.053 -9.859 25.539 1.00 61.43 N ATOM 253 CZ ARG A 18 16.880 -10.737 26.106 1.00 42.21 C ATOM 254 NH1 ARG A 18 17.221 -10.606 27.383 1.00 65.11 N1+ ATOM 255 NH2 ARG A 18 17.343 -11.758 25.401 1.00 11.32 N ATOM 0 H ARG A 18 14.603 -3.475 26.071 1.00 71.41 H new ATOM 0 HA ARG A 18 17.183 -4.870 25.642 1.00 64.41 H new ATOM 0 HB2 ARG A 18 15.902 -6.192 27.243 1.00 30.54 H new ATOM 0 HB3 ARG A 18 14.472 -6.096 26.234 1.00 30.54 H new ATOM 0 HG2 ARG A 18 15.576 -7.392 24.472 1.00 21.30 H new ATOM 0 HG3 ARG A 18 17.077 -7.402 25.376 1.00 21.30 H new ATOM 0 HD2 ARG A 18 15.903 -8.633 27.232 1.00 2.42 H new ATOM 0 HD3 ARG A 18 14.459 -8.693 26.241 1.00 2.42 H new ATOM 0 HE ARG A 18 15.753 -10.037 24.580 1.00 61.43 H new ATOM 0 HH11 ARG A 18 16.850 -9.831 27.933 1.00 65.11 H new ATOM 0 HH12 ARG A 18 17.854 -11.280 27.814 1.00 65.11 H new ATOM 0 HH21 ARG A 18 17.067 -11.871 24.426 1.00 11.32 H new ATOM 0 HH22 ARG A 18 17.976 -12.431 25.833 1.00 11.32 H new ATOM 269 N ALA A 19 16.470 -5.349 23.217 1.00 71.12 N ATOM 270 CA ALA A 19 16.220 -5.265 21.780 1.00 34.25 C ATOM 271 C ALA A 19 16.626 -6.562 21.087 1.00 41.03 C ATOM 272 O ALA A 19 17.771 -7.006 21.200 1.00 12.34 O ATOM 273 CB ALA A 19 16.968 -4.080 21.178 1.00 5.35 C ATOM 0 H ALA A 19 17.288 -5.904 23.466 1.00 71.12 H new ATOM 0 HA ALA A 19 15.152 -5.114 21.625 1.00 34.25 H new ATOM 0 HB1 ALA A 19 16.771 -4.032 20.107 1.00 5.35 H new ATOM 0 HB2 ALA A 19 16.630 -3.158 21.651 1.00 5.35 H new ATOM 0 HB3 ALA A 19 18.038 -4.202 21.345 1.00 5.35 H new ATOM 279 N THR A 20 15.684 -7.156 20.370 1.00 63.53 N ATOM 280 CA THR A 20 15.894 -8.429 19.695 1.00 0.02 C ATOM 281 C THR A 20 15.369 -8.361 18.265 1.00 61.21 C ATOM 282 O THR A 20 14.168 -8.224 18.044 1.00 50.32 O ATOM 283 CB THR A 20 15.165 -9.564 20.457 1.00 22.13 C ATOM 284 OG1 THR A 20 15.524 -9.529 21.848 1.00 4.20 O ATOM 285 CG2 THR A 20 15.507 -10.931 19.876 1.00 30.30 C ATOM 0 H THR A 20 14.750 -6.768 20.239 1.00 63.53 H new ATOM 0 HA THR A 20 16.964 -8.637 19.675 1.00 0.02 H new ATOM 0 HB THR A 20 14.092 -9.405 20.349 1.00 22.13 H new ATOM 0 HG1 THR A 20 16.089 -10.301 22.060 1.00 4.20 H new ATOM 0 HG21 THR A 20 14.979 -11.705 20.433 1.00 30.30 H new ATOM 0 HG22 THR A 20 15.205 -10.967 18.829 1.00 30.30 H new ATOM 0 HG23 THR A 20 16.581 -11.099 19.950 1.00 30.30 H new ATOM 293 N SER A 21 16.271 -8.455 17.296 1.00 52.22 N ATOM 294 CA SER A 21 15.871 -8.489 15.901 1.00 61.23 C ATOM 295 C SER A 21 15.296 -9.864 15.629 1.00 4.01 C ATOM 296 O SER A 21 16.039 -10.865 15.707 1.00 53.51 O ATOM 297 CB SER A 21 17.041 -8.187 14.964 1.00 62.30 C ATOM 298 OG SER A 21 16.597 -8.018 13.635 1.00 0.33 O ATOM 0 H SER A 21 17.278 -8.509 17.452 1.00 52.22 H new ATOM 0 HA SER A 21 15.127 -7.716 15.711 1.00 61.23 H new ATOM 0 HB2 SER A 21 17.554 -7.285 15.297 1.00 62.30 H new ATOM 0 HB3 SER A 21 17.766 -9.000 15.008 1.00 62.30 H new ATOM 0 HG SER A 21 16.471 -8.896 13.218 1.00 0.33 H new ATOM 304 N HIS A 22 13.984 -9.863 15.307 1.00 22.03 N ATOM 305 CA HIS A 22 13.104 -11.042 15.334 1.00 2.11 C ATOM 306 C HIS A 22 13.527 -12.123 14.350 1.00 71.44 C ATOM 307 O HIS A 22 13.158 -13.290 14.508 1.00 63.31 O ATOM 308 CB HIS A 22 11.654 -10.602 15.055 1.00 42.33 C ATOM 309 CG HIS A 22 10.663 -11.727 14.955 1.00 64.41 C ATOM 310 ND1 HIS A 22 10.076 -12.316 16.053 1.00 70.44 N ATOM 311 CD2 HIS A 22 10.146 -12.359 13.873 1.00 33.23 C ATOM 312 CE1 HIS A 22 9.244 -13.258 15.652 1.00 21.33 C ATOM 313 NE2 HIS A 22 9.266 -13.305 14.334 1.00 41.54 N ATOM 0 H HIS A 22 13.498 -9.015 15.013 1.00 22.03 H new ATOM 0 HA HIS A 22 13.180 -11.484 16.327 1.00 2.11 H new ATOM 0 HB2 HIS A 22 11.336 -9.925 15.848 1.00 42.33 H new ATOM 0 HB3 HIS A 22 11.634 -10.035 14.124 1.00 42.33 H new ATOM 0 HD2 HIS A 22 10.383 -12.155 12.839 1.00 33.23 H new ATOM 0 HE1 HIS A 22 8.645 -13.886 16.295 1.00 21.33 H new ATOM 0 HE2 HIS A 22 8.719 -13.940 13.753 1.00 41.54 H new ATOM 322 N ASP A 23 14.317 -11.752 13.359 1.00 65.30 N ATOM 323 CA ASP A 23 14.882 -12.732 12.432 1.00 52.23 C ATOM 324 C ASP A 23 16.099 -13.395 13.079 1.00 2.53 C ATOM 325 O ASP A 23 16.893 -14.073 12.421 1.00 21.54 O ATOM 326 CB ASP A 23 15.247 -12.076 11.089 1.00 41.44 C ATOM 327 CG ASP A 23 16.007 -10.765 11.234 1.00 73.43 C ATOM 328 OD1 ASP A 23 15.972 -9.951 10.287 1.00 71.33 O ATOM 329 OD2 ASP A 23 16.625 -10.531 12.295 1.00 13.13 O1- ATOM 0 H ASP A 23 14.585 -10.786 13.171 1.00 65.30 H new ATOM 0 HA ASP A 23 14.136 -13.497 12.220 1.00 52.23 H new ATOM 0 HB2 ASP A 23 15.850 -12.773 10.507 1.00 41.44 H new ATOM 0 HB3 ASP A 23 14.333 -11.895 10.523 1.00 41.44 H new ATOM 334 N GLN A 24 16.216 -13.168 14.390 1.00 30.45 N ATOM 335 CA GLN A 24 17.192 -13.819 15.251 1.00 23.53 C ATOM 336 C GLN A 24 18.599 -13.342 14.952 1.00 71.34 C ATOM 337 O GLN A 24 19.576 -13.999 15.320 1.00 22.01 O ATOM 338 CB GLN A 24 17.089 -15.349 15.147 1.00 42.54 C ATOM 339 CG GLN A 24 15.724 -15.897 15.552 1.00 72.53 C ATOM 340 CD GLN A 24 15.277 -15.407 16.919 1.00 14.50 C ATOM 341 OE1 GLN A 24 15.594 -16.005 17.946 1.00 45.33 O ATOM 342 NE2 GLN A 24 14.517 -14.324 16.940 1.00 4.22 N ATOM 0 H GLN A 24 15.618 -12.510 14.889 1.00 30.45 H new ATOM 0 HA GLN A 24 16.963 -13.539 16.279 1.00 23.53 H new ATOM 0 HB2 GLN A 24 17.303 -15.651 14.122 1.00 42.54 H new ATOM 0 HB3 GLN A 24 17.855 -15.800 15.778 1.00 42.54 H new ATOM 0 HG2 GLN A 24 14.984 -15.605 14.806 1.00 72.53 H new ATOM 0 HG3 GLN A 24 15.761 -16.986 15.555 1.00 72.53 H new ATOM 0 HE21 GLN A 24 14.274 -13.854 16.068 1.00 4.22 H new ATOM 0 HE22 GLN A 24 14.174 -13.959 17.828 1.00 4.22 H new ATOM 351 N LYS A 25 18.716 -12.180 14.314 1.00 22.35 N ATOM 352 CA LYS A 25 20.027 -11.618 14.050 1.00 24.04 C ATOM 353 C LYS A 25 20.444 -10.687 15.182 1.00 45.31 C ATOM 354 O LYS A 25 21.614 -10.310 15.261 1.00 73.44 O ATOM 355 CB LYS A 25 20.093 -10.890 12.693 1.00 30.31 C ATOM 356 CG LYS A 25 19.545 -9.466 12.704 1.00 12.14 C ATOM 357 CD LYS A 25 19.760 -8.758 11.364 1.00 61.23 C ATOM 358 CE LYS A 25 19.096 -9.500 10.206 1.00 52.51 C ATOM 359 NZ LYS A 25 18.978 -8.648 8.987 1.00 22.01 N1+ ATOM 0 H LYS A 25 17.931 -11.622 13.978 1.00 22.35 H new ATOM 0 HA LYS A 25 20.729 -12.450 13.997 1.00 24.04 H new ATOM 0 HB2 LYS A 25 21.131 -10.862 12.361 1.00 30.31 H new ATOM 0 HB3 LYS A 25 19.539 -11.472 11.957 1.00 30.31 H new ATOM 0 HG2 LYS A 25 18.480 -9.489 12.935 1.00 12.14 H new ATOM 0 HG3 LYS A 25 20.031 -8.897 13.497 1.00 12.14 H new ATOM 0 HD2 LYS A 25 19.360 -7.746 11.422 1.00 61.23 H new ATOM 0 HD3 LYS A 25 20.829 -8.668 11.170 1.00 61.23 H new ATOM 0 HE2 LYS A 25 19.675 -10.393 9.969 1.00 52.51 H new ATOM 0 HE3 LYS A 25 18.105 -9.834 10.511 1.00 52.51 H new ATOM 0 HZ1 LYS A 25 18.584 -9.211 8.206 1.00 22.01 H new ATOM 0 HZ2 LYS A 25 18.349 -7.844 9.185 1.00 22.01 H new ATOM 0 HZ3 LYS A 25 19.918 -8.294 8.718 1.00 22.01 H new ATOM 373 N LEU A 26 19.507 -10.301 16.073 1.00 32.33 N ATOM 374 CA LEU A 26 19.909 -9.492 17.220 1.00 24.31 C ATOM 375 C LEU A 26 19.138 -9.904 18.462 1.00 21.31 C ATOM 376 O LEU A 26 17.964 -10.236 18.373 1.00 11.34 O ATOM 377 CB LEU A 26 19.687 -8.006 16.922 1.00 35.55 C ATOM 378 CG LEU A 26 20.016 -7.048 18.069 1.00 2.25 C ATOM 379 CD1 LEU A 26 21.501 -7.106 18.424 1.00 31.22 C ATOM 380 CD2 LEU A 26 19.583 -5.628 17.716 1.00 74.42 C ATOM 0 H LEU A 26 18.514 -10.528 16.019 1.00 32.33 H new ATOM 0 HA LEU A 26 20.970 -9.658 17.406 1.00 24.31 H new ATOM 0 HB2 LEU A 26 20.293 -7.732 16.058 1.00 35.55 H new ATOM 0 HB3 LEU A 26 18.644 -7.862 16.639 1.00 35.55 H new ATOM 0 HG LEU A 26 19.458 -7.362 18.951 1.00 2.25 H new ATOM 0 HD11 LEU A 26 21.707 -6.415 19.242 1.00 31.22 H new ATOM 0 HD12 LEU A 26 21.763 -8.119 18.730 1.00 31.22 H new ATOM 0 HD13 LEU A 26 22.094 -6.825 17.554 1.00 31.22 H new ATOM 0 HD21 LEU A 26 19.824 -4.958 18.542 1.00 74.42 H new ATOM 0 HD22 LEU A 26 20.107 -5.300 16.818 1.00 74.42 H new ATOM 0 HD23 LEU A 26 18.508 -5.610 17.535 1.00 74.42 H new ATOM 392 N ASP A 27 19.815 -9.890 19.607 1.00 3.11 N ATOM 393 CA ASP A 27 19.192 -10.198 20.891 1.00 12.11 C ATOM 394 C ASP A 27 20.102 -9.727 22.024 1.00 11.44 C ATOM 395 O ASP A 27 20.984 -10.460 22.476 1.00 42.31 O ATOM 396 CB ASP A 27 18.916 -11.708 21.001 1.00 5.04 C ATOM 397 CG ASP A 27 18.342 -12.116 22.351 1.00 74.13 C ATOM 398 OD1 ASP A 27 19.033 -12.832 23.106 1.00 54.23 O ATOM 399 OD2 ASP A 27 17.195 -11.728 22.658 1.00 11.42 O1- ATOM 0 H ASP A 27 20.808 -9.666 19.671 1.00 3.11 H new ATOM 0 HA ASP A 27 18.238 -9.675 20.966 1.00 12.11 H new ATOM 0 HB2 ASP A 27 18.221 -12.002 20.214 1.00 5.04 H new ATOM 0 HB3 ASP A 27 19.843 -12.254 20.828 1.00 5.04 H new ATOM 404 N VAL A 28 19.897 -8.482 22.455 1.00 5.03 N ATOM 405 CA VAL A 28 20.739 -7.851 23.478 1.00 42.02 C ATOM 406 C VAL A 28 19.941 -6.879 24.341 1.00 62.12 C ATOM 407 O VAL A 28 18.746 -6.671 24.133 1.00 32.30 O ATOM 408 CB VAL A 28 21.938 -7.076 22.869 1.00 24.24 C ATOM 409 CG1 VAL A 28 22.990 -8.033 22.322 1.00 34.22 C ATOM 410 CG2 VAL A 28 21.462 -6.103 21.792 1.00 1.00 C ATOM 0 H VAL A 28 19.147 -7.883 22.109 1.00 5.03 H new ATOM 0 HA VAL A 28 21.116 -8.673 24.087 1.00 42.02 H new ATOM 0 HB VAL A 28 22.404 -6.495 23.665 1.00 24.24 H new ATOM 0 HG11 VAL A 28 23.818 -7.462 21.902 1.00 34.22 H new ATOM 0 HG12 VAL A 28 23.359 -8.667 23.128 1.00 34.22 H new ATOM 0 HG13 VAL A 28 22.547 -8.655 21.544 1.00 34.22 H new ATOM 0 HG21 VAL A 28 22.318 -5.570 21.379 1.00 1.00 H new ATOM 0 HG22 VAL A 28 20.961 -6.656 20.998 1.00 1.00 H new ATOM 0 HG23 VAL A 28 20.767 -5.387 22.230 1.00 1.00 H new ATOM 420 N LYS A 29 20.626 -6.298 25.316 1.00 24.10 N ATOM 421 CA LYS A 29 20.044 -5.312 26.216 1.00 44.35 C ATOM 422 C LYS A 29 20.770 -3.976 26.086 1.00 43.02 C ATOM 423 O LYS A 29 21.957 -3.931 25.754 1.00 12.55 O ATOM 424 CB LYS A 29 20.142 -5.816 27.669 1.00 13.02 C ATOM 425 CG LYS A 29 20.643 -4.761 28.666 1.00 22.53 C ATOM 426 CD LYS A 29 20.594 -5.248 30.103 1.00 24.23 C ATOM 427 CE LYS A 29 19.166 -5.265 30.609 1.00 1.41 C ATOM 428 NZ LYS A 29 18.489 -3.964 30.351 1.00 62.42 N1+ ATOM 0 H LYS A 29 21.608 -6.499 25.506 1.00 24.10 H new ATOM 0 HA LYS A 29 18.997 -5.169 25.949 1.00 44.35 H new ATOM 0 HB2 LYS A 29 19.160 -6.165 27.988 1.00 13.02 H new ATOM 0 HB3 LYS A 29 20.811 -6.676 27.700 1.00 13.02 H new ATOM 0 HG2 LYS A 29 21.667 -4.485 28.414 1.00 22.53 H new ATOM 0 HG3 LYS A 29 20.038 -3.860 28.571 1.00 22.53 H new ATOM 0 HD2 LYS A 29 21.021 -6.249 30.169 1.00 24.23 H new ATOM 0 HD3 LYS A 29 21.202 -4.600 30.734 1.00 24.23 H new ATOM 0 HE2 LYS A 29 18.614 -6.068 30.121 1.00 1.41 H new ATOM 0 HE3 LYS A 29 19.159 -5.476 31.678 1.00 1.41 H new ATOM 0 HZ1 LYS A 29 17.629 -3.899 30.932 1.00 62.42 H new ATOM 0 HZ2 LYS A 29 19.132 -3.184 30.596 1.00 62.42 H new ATOM 0 HZ3 LYS A 29 18.233 -3.899 29.345 1.00 62.42 H new ATOM 442 N LEU A 30 20.050 -2.890 26.352 1.00 2.53 N ATOM 443 CA LEU A 30 20.661 -1.592 26.524 1.00 41.03 C ATOM 444 C LEU A 30 20.146 -0.952 27.818 1.00 64.12 C ATOM 445 O LEU A 30 19.051 -1.310 28.322 1.00 54.30 O ATOM 446 CB LEU A 30 20.443 -0.690 25.285 1.00 11.12 C ATOM 447 CG LEU A 30 19.035 -0.640 24.661 1.00 54.41 C ATOM 448 CD1 LEU A 30 18.651 -1.954 23.980 1.00 21.32 C ATOM 449 CD2 LEU A 30 18.004 -0.226 25.696 1.00 54.12 C ATOM 0 H LEU A 30 19.035 -2.892 26.452 1.00 2.53 H new ATOM 0 HA LEU A 30 21.740 -1.714 26.614 1.00 41.03 H new ATOM 0 HB2 LEU A 30 20.722 0.327 25.560 1.00 11.12 H new ATOM 0 HB3 LEU A 30 21.139 -1.013 24.511 1.00 11.12 H new ATOM 0 HG LEU A 30 19.055 0.117 23.877 1.00 54.41 H new ATOM 0 HD11 LEU A 30 17.650 -1.866 23.557 1.00 21.32 H new ATOM 0 HD12 LEU A 30 19.363 -2.173 23.185 1.00 21.32 H new ATOM 0 HD13 LEU A 30 18.665 -2.761 24.712 1.00 21.32 H new ATOM 0 HD21 LEU A 30 17.017 -0.197 25.235 1.00 54.12 H new ATOM 0 HD22 LEU A 30 18.001 -0.946 26.515 1.00 54.12 H new ATOM 0 HD23 LEU A 30 18.253 0.762 26.083 1.00 54.12 H new ATOM 461 N SER A 31 20.946 -0.045 28.370 1.00 75.34 N ATOM 462 CA SER A 31 20.641 0.578 29.649 1.00 34.22 C ATOM 463 C SER A 31 21.480 1.830 29.876 1.00 62.41 C ATOM 464 O SER A 31 22.701 1.818 29.699 1.00 64.13 O ATOM 465 CB SER A 31 20.844 -0.424 30.803 1.00 52.23 C ATOM 466 OG SER A 31 19.896 -1.485 30.725 1.00 11.31 O ATOM 0 H SER A 31 21.817 0.275 27.946 1.00 75.34 H new ATOM 0 HA SER A 31 19.594 0.879 29.627 1.00 34.22 H new ATOM 0 HB2 SER A 31 21.855 -0.830 30.764 1.00 52.23 H new ATOM 0 HB3 SER A 31 20.743 0.090 31.759 1.00 52.23 H new ATOM 0 HG SER A 31 19.285 -1.324 29.976 1.00 11.31 H new ATOM 472 N ALA A 32 20.801 2.906 30.264 1.00 52.21 N ATOM 473 CA ALA A 32 21.453 4.169 30.580 1.00 43.51 C ATOM 474 C ALA A 32 22.195 4.074 31.914 1.00 25.12 C ATOM 475 O ALA A 32 21.651 3.564 32.906 1.00 4.30 O ATOM 476 CB ALA A 32 20.427 5.298 30.614 1.00 22.44 C ATOM 0 H ALA A 32 19.786 2.925 30.367 1.00 52.21 H new ATOM 0 HA ALA A 32 22.183 4.387 29.801 1.00 43.51 H new ATOM 0 HB1 ALA A 32 20.927 6.237 30.851 1.00 22.44 H new ATOM 0 HB2 ALA A 32 19.944 5.380 29.640 1.00 22.44 H new ATOM 0 HB3 ALA A 32 19.676 5.084 31.375 1.00 22.44 H new ATOM 482 N PRO A 33 23.452 4.557 31.958 1.00 32.33 N ATOM 483 CA PRO A 33 24.281 4.511 33.166 1.00 35.40 C ATOM 484 C PRO A 33 23.650 5.279 34.329 1.00 50.42 C ATOM 485 O PRO A 33 22.956 6.284 34.128 1.00 70.53 O ATOM 486 CB PRO A 33 25.603 5.171 32.733 1.00 73.33 C ATOM 487 CG PRO A 33 25.609 5.079 31.244 1.00 10.15 C ATOM 488 CD PRO A 33 24.167 5.184 30.829 1.00 32.53 C ATOM 0 HA PRO A 33 24.407 3.492 33.532 1.00 35.40 H new ATOM 0 HB2 PRO A 33 25.654 6.208 33.065 1.00 73.33 H new ATOM 0 HB3 PRO A 33 26.461 4.656 33.164 1.00 73.33 H new ATOM 0 HG2 PRO A 33 26.203 5.880 30.804 1.00 10.15 H new ATOM 0 HG3 PRO A 33 26.046 4.138 30.911 1.00 10.15 H new ATOM 0 HD2 PRO A 33 23.863 6.221 30.684 1.00 32.53 H new ATOM 0 HD3 PRO A 33 23.978 4.662 29.891 1.00 32.53 H new ATOM 496 N ARG A 34 23.905 4.813 35.548 1.00 10.53 N ATOM 497 CA ARG A 34 23.365 5.453 36.747 1.00 33.33 C ATOM 498 C ARG A 34 24.015 6.812 36.997 1.00 40.12 C ATOM 499 O ARG A 34 23.629 7.525 37.917 1.00 0.24 O ATOM 500 CB ARG A 34 23.524 4.536 37.974 1.00 35.21 C ATOM 501 CG ARG A 34 22.258 3.759 38.326 1.00 34.41 C ATOM 502 CD ARG A 34 21.132 4.675 38.804 1.00 50.12 C ATOM 503 NE ARG A 34 19.846 3.975 38.866 1.00 3.50 N ATOM 504 CZ ARG A 34 19.407 3.286 39.923 1.00 2.33 C ATOM 505 NH1 ARG A 34 20.141 3.204 41.028 1.00 23.02 N1+ ATOM 506 NH2 ARG A 34 18.227 2.679 39.869 1.00 21.42 N ATOM 0 H ARG A 34 24.483 3.993 35.733 1.00 10.53 H new ATOM 0 HA ARG A 34 22.301 5.623 36.580 1.00 33.33 H new ATOM 0 HB2 ARG A 34 24.333 3.830 37.787 1.00 35.21 H new ATOM 0 HB3 ARG A 34 23.820 5.140 38.832 1.00 35.21 H new ATOM 0 HG2 ARG A 34 21.923 3.199 37.453 1.00 34.41 H new ATOM 0 HG3 ARG A 34 22.486 3.030 39.104 1.00 34.41 H new ATOM 0 HD2 ARG A 34 21.379 5.069 39.790 1.00 50.12 H new ATOM 0 HD3 ARG A 34 21.048 5.529 38.131 1.00 50.12 H new ATOM 0 HE ARG A 34 19.244 4.017 38.044 1.00 3.50 H new ATOM 0 HH11 ARG A 34 21.047 3.669 41.074 1.00 23.02 H new ATOM 0 HH12 ARG A 34 19.798 2.676 41.830 1.00 23.02 H new ATOM 0 HH21 ARG A 34 17.660 2.740 39.023 1.00 21.42 H new ATOM 0 HH22 ARG A 34 17.887 2.152 40.673 1.00 21.42 H new ATOM 520 N GLU A 35 24.990 7.171 36.161 1.00 72.31 N ATOM 521 CA GLU A 35 25.624 8.486 36.231 1.00 75.14 C ATOM 522 C GLU A 35 24.576 9.594 36.072 1.00 65.21 C ATOM 523 O GLU A 35 24.710 10.682 36.637 1.00 33.12 O ATOM 524 CB GLU A 35 26.702 8.616 35.145 1.00 20.34 C ATOM 525 CG GLU A 35 27.625 9.818 35.329 1.00 71.30 C ATOM 526 CD GLU A 35 28.431 9.740 36.620 1.00 31.03 C ATOM 527 OE1 GLU A 35 28.074 10.425 37.604 1.00 31.45 O ATOM 528 OE2 GLU A 35 29.417 8.975 36.665 1.00 43.03 O1- ATOM 0 H GLU A 35 25.358 6.567 35.426 1.00 72.31 H new ATOM 0 HA GLU A 35 26.096 8.591 37.208 1.00 75.14 H new ATOM 0 HB2 GLU A 35 27.304 7.707 35.134 1.00 20.34 H new ATOM 0 HB3 GLU A 35 26.216 8.689 34.172 1.00 20.34 H new ATOM 0 HG2 GLU A 35 28.307 9.882 34.481 1.00 71.30 H new ATOM 0 HG3 GLU A 35 27.031 10.732 35.329 1.00 71.30 H new ATOM 535 N LEU A 36 23.531 9.297 35.297 1.00 33.22 N ATOM 536 CA LEU A 36 22.434 10.242 35.064 1.00 32.24 C ATOM 537 C LEU A 36 21.236 9.891 35.943 1.00 55.25 C ATOM 538 O LEU A 36 20.171 10.500 35.832 1.00 40.24 O ATOM 539 CB LEU A 36 21.996 10.220 33.587 1.00 11.21 C ATOM 540 CG LEU A 36 23.076 10.570 32.547 1.00 24.22 C ATOM 541 CD1 LEU A 36 23.783 11.871 32.917 1.00 52.21 C ATOM 542 CD2 LEU A 36 24.072 9.421 32.382 1.00 63.44 C ATOM 0 H LEU A 36 23.420 8.404 34.817 1.00 33.22 H new ATOM 0 HA LEU A 36 22.794 11.240 35.316 1.00 32.24 H new ATOM 0 HB2 LEU A 36 21.612 9.226 33.359 1.00 11.21 H new ATOM 0 HB3 LEU A 36 21.167 10.917 33.466 1.00 11.21 H new ATOM 0 HG LEU A 36 22.586 10.720 31.585 1.00 24.22 H new ATOM 0 HD11 LEU A 36 24.542 12.098 32.168 1.00 52.21 H new ATOM 0 HD12 LEU A 36 23.056 12.682 32.955 1.00 52.21 H new ATOM 0 HD13 LEU A 36 24.257 11.763 33.893 1.00 52.21 H new ATOM 0 HD21 LEU A 36 24.824 9.695 31.642 1.00 63.44 H new ATOM 0 HD22 LEU A 36 24.559 9.221 33.337 1.00 63.44 H new ATOM 0 HD23 LEU A 36 23.544 8.527 32.050 1.00 63.44 H new ATOM 554 N GLY A 37 21.428 8.917 36.825 1.00 72.22 N ATOM 555 CA GLY A 37 20.326 8.368 37.592 1.00 12.23 C ATOM 556 C GLY A 37 19.464 7.452 36.744 1.00 31.23 C ATOM 557 O GLY A 37 18.239 7.442 36.874 1.00 41.24 O ATOM 0 H GLY A 37 22.335 8.495 37.023 1.00 72.22 H new ATOM 0 HA2 GLY A 37 20.715 7.815 38.447 1.00 12.23 H new ATOM 0 HA3 GLY A 37 19.716 9.180 37.988 1.00 12.23 H new ATOM 561 N GLY A 38 20.117 6.691 35.860 1.00 73.44 N ATOM 562 CA GLY A 38 19.407 5.797 34.957 1.00 31.42 C ATOM 563 C GLY A 38 18.913 4.527 35.635 1.00 22.15 C ATOM 564 O GLY A 38 18.198 4.586 36.636 1.00 21.21 O ATOM 0 H GLY A 38 21.132 6.680 35.755 1.00 73.44 H new ATOM 0 HA2 GLY A 38 18.556 6.326 34.527 1.00 31.42 H new ATOM 0 HA3 GLY A 38 20.065 5.528 34.131 1.00 31.42 H new ATOM 568 N ALA A 39 19.321 3.372 35.112 1.00 14.21 N ATOM 569 CA ALA A 39 18.803 2.087 35.587 1.00 43.43 C ATOM 570 C ALA A 39 19.819 1.373 36.466 1.00 63.22 C ATOM 571 O ALA A 39 19.462 0.753 37.470 1.00 3.43 O ATOM 572 CB ALA A 39 18.416 1.204 34.406 1.00 5.43 C ATOM 0 H ALA A 39 20.007 3.298 34.361 1.00 14.21 H new ATOM 0 HA ALA A 39 17.916 2.285 36.189 1.00 43.43 H new ATOM 0 HB1 ALA A 39 18.033 0.252 34.774 1.00 5.43 H new ATOM 0 HB2 ALA A 39 17.646 1.702 33.816 1.00 5.43 H new ATOM 0 HB3 ALA A 39 19.292 1.026 33.782 1.00 5.43 H new ATOM 578 N GLY A 40 21.085 1.467 36.084 1.00 15.31 N ATOM 579 CA GLY A 40 22.140 0.798 36.819 1.00 42.15 C ATOM 580 C GLY A 40 22.554 -0.495 36.157 1.00 45.53 C ATOM 581 O GLY A 40 22.337 -1.579 36.700 1.00 15.12 O ATOM 0 H GLY A 40 21.402 1.998 35.273 1.00 15.31 H new ATOM 0 HA2 GLY A 40 23.003 1.459 36.897 1.00 42.15 H new ATOM 0 HA3 GLY A 40 21.802 0.594 37.835 1.00 42.15 H new ATOM 585 N ALA A 41 23.145 -0.373 34.975 1.00 5.32 N ATOM 586 CA ALA A 41 23.582 -1.526 34.198 1.00 5.21 C ATOM 587 C ALA A 41 24.477 -1.072 33.054 1.00 44.21 C ATOM 588 O ALA A 41 24.179 -0.085 32.381 1.00 13.22 O ATOM 589 CB ALA A 41 22.386 -2.299 33.652 1.00 40.21 C ATOM 0 H ALA A 41 23.334 0.525 34.529 1.00 5.32 H new ATOM 0 HA ALA A 41 24.146 -2.189 34.854 1.00 5.21 H new ATOM 0 HB1 ALA A 41 22.738 -3.155 33.076 1.00 40.21 H new ATOM 0 HB2 ALA A 41 21.770 -2.648 34.480 1.00 40.21 H new ATOM 0 HB3 ALA A 41 21.794 -1.647 33.009 1.00 40.21 H new ATOM 595 N GLU A 42 25.560 -1.803 32.833 1.00 32.32 N ATOM 596 CA GLU A 42 26.524 -1.462 31.789 1.00 71.23 C ATOM 597 C GLU A 42 26.107 -2.057 30.438 1.00 1.12 C ATOM 598 O GLU A 42 26.845 -2.832 29.821 1.00 55.43 O ATOM 599 CB GLU A 42 27.928 -1.935 32.194 1.00 42.31 C ATOM 600 CG GLU A 42 28.004 -3.408 32.576 1.00 52.14 C ATOM 601 CD GLU A 42 29.426 -3.852 32.874 1.00 31.41 C ATOM 602 OE1 GLU A 42 29.811 -3.887 34.061 1.00 24.22 O ATOM 603 OE2 GLU A 42 30.171 -4.156 31.917 1.00 54.53 O1- ATOM 0 H GLU A 42 25.797 -2.641 33.364 1.00 32.32 H new ATOM 0 HA GLU A 42 26.544 -0.378 31.675 1.00 71.23 H new ATOM 0 HB2 GLU A 42 28.614 -1.749 31.368 1.00 42.31 H new ATOM 0 HB3 GLU A 42 28.273 -1.334 33.036 1.00 42.31 H new ATOM 0 HG2 GLU A 42 27.379 -3.587 33.451 1.00 52.14 H new ATOM 0 HG3 GLU A 42 27.599 -4.013 31.765 1.00 52.14 H new ATOM 610 N GLY A 43 24.905 -1.695 29.996 1.00 3.30 N ATOM 611 CA GLY A 43 24.433 -2.096 28.680 1.00 20.41 C ATOM 612 C GLY A 43 24.921 -1.134 27.617 1.00 55.55 C ATOM 613 O GLY A 43 26.054 -0.654 27.689 1.00 25.21 O ATOM 0 H GLY A 43 24.246 -1.128 30.529 1.00 3.30 H new ATOM 0 HA2 GLY A 43 24.784 -3.103 28.454 1.00 20.41 H new ATOM 0 HA3 GLY A 43 23.344 -2.129 28.674 1.00 20.41 H new ATOM 617 N THR A 44 24.081 -0.824 26.639 1.00 1.14 N ATOM 618 CA THR A 44 24.432 0.170 25.636 1.00 0.00 C ATOM 619 C THR A 44 23.552 1.399 25.825 1.00 54.32 C ATOM 620 O THR A 44 22.443 1.291 26.350 1.00 53.24 O ATOM 621 CB THR A 44 24.294 -0.399 24.201 1.00 74.01 C ATOM 622 OG1 THR A 44 23.109 -1.197 24.099 1.00 60.01 O ATOM 623 CG2 THR A 44 25.510 -1.242 23.826 1.00 54.14 C ATOM 0 H THR A 44 23.159 -1.243 26.519 1.00 1.14 H new ATOM 0 HA THR A 44 25.477 0.450 25.766 1.00 0.00 H new ATOM 0 HB THR A 44 24.228 0.442 23.511 1.00 74.01 H new ATOM 0 HG1 THR A 44 23.030 -1.551 23.188 1.00 60.01 H new ATOM 0 HG21 THR A 44 25.387 -1.629 22.814 1.00 54.14 H new ATOM 0 HG22 THR A 44 26.408 -0.626 23.872 1.00 54.14 H new ATOM 0 HG23 THR A 44 25.605 -2.074 24.523 1.00 54.14 H new ATOM 631 N ASN A 45 24.052 2.564 25.442 1.00 72.33 N ATOM 632 CA ASN A 45 23.299 3.796 25.624 1.00 33.43 C ATOM 633 C ASN A 45 22.368 4.005 24.424 1.00 24.30 C ATOM 634 O ASN A 45 22.795 3.852 23.278 1.00 63.01 O ATOM 635 CB ASN A 45 24.243 4.999 25.802 1.00 4.20 C ATOM 636 CG ASN A 45 25.193 4.868 26.981 1.00 5.33 C ATOM 637 OD1 ASN A 45 24.953 4.111 27.921 1.00 50.31 O ATOM 638 ND2 ASN A 45 26.278 5.634 26.952 1.00 41.45 N ATOM 0 H ASN A 45 24.967 2.683 25.007 1.00 72.33 H new ATOM 0 HA ASN A 45 22.700 3.714 26.531 1.00 33.43 H new ATOM 0 HB2 ASN A 45 24.827 5.128 24.891 1.00 4.20 H new ATOM 0 HB3 ASN A 45 23.645 5.902 25.928 1.00 4.20 H new ATOM 0 HD21 ASN A 45 26.943 5.606 27.725 1.00 41.45 H new ATOM 0 HD22 ASN A 45 26.446 6.250 26.157 1.00 41.45 H new ATOM 645 N PRO A 46 21.083 4.338 24.669 1.00 63.04 N ATOM 646 CA PRO A 46 20.064 4.453 23.608 1.00 61.02 C ATOM 647 C PRO A 46 20.444 5.456 22.509 1.00 4.44 C ATOM 648 O PRO A 46 20.445 5.121 21.318 1.00 23.02 O ATOM 649 CB PRO A 46 18.798 4.911 24.362 1.00 23.35 C ATOM 650 CG PRO A 46 19.287 5.426 25.678 1.00 42.23 C ATOM 651 CD PRO A 46 20.519 4.627 26.001 1.00 1.14 C ATOM 0 HA PRO A 46 19.937 3.510 23.076 1.00 61.02 H new ATOM 0 HB2 PRO A 46 18.269 5.687 23.808 1.00 23.35 H new ATOM 0 HB3 PRO A 46 18.100 4.085 24.498 1.00 23.35 H new ATOM 0 HG2 PRO A 46 19.516 6.490 25.620 1.00 42.23 H new ATOM 0 HG3 PRO A 46 18.529 5.304 26.451 1.00 42.23 H new ATOM 0 HD2 PRO A 46 21.216 5.191 26.621 1.00 1.14 H new ATOM 0 HD3 PRO A 46 20.277 3.713 26.544 1.00 1.14 H new ATOM 659 N GLU A 47 20.774 6.679 22.910 1.00 25.31 N ATOM 660 CA GLU A 47 21.139 7.729 21.957 1.00 53.11 C ATOM 661 C GLU A 47 22.487 7.414 21.308 1.00 42.42 C ATOM 662 O GLU A 47 22.718 7.753 20.149 1.00 0.52 O ATOM 663 CB GLU A 47 21.149 9.130 22.620 1.00 52.55 C ATOM 664 CG GLU A 47 21.289 9.136 24.146 1.00 35.10 C ATOM 665 CD GLU A 47 22.569 8.483 24.644 1.00 32.04 C ATOM 666 OE1 GLU A 47 22.570 7.248 24.814 1.00 53.13 O ATOM 667 OE2 GLU A 47 23.566 9.196 24.866 1.00 62.13 O1- ATOM 0 H GLU A 47 20.797 6.971 23.887 1.00 25.31 H new ATOM 0 HA GLU A 47 20.378 7.752 21.177 1.00 53.11 H new ATOM 0 HB2 GLU A 47 21.969 9.708 22.195 1.00 52.55 H new ATOM 0 HB3 GLU A 47 20.225 9.645 22.355 1.00 52.55 H new ATOM 0 HG2 GLU A 47 21.255 10.166 24.501 1.00 35.10 H new ATOM 0 HG3 GLU A 47 20.434 8.620 24.583 1.00 35.10 H new ATOM 674 N GLN A 48 23.361 6.752 22.061 1.00 41.14 N ATOM 675 CA GLN A 48 24.637 6.267 21.542 1.00 71.11 C ATOM 676 C GLN A 48 24.404 5.217 20.455 1.00 34.04 C ATOM 677 O GLN A 48 25.132 5.158 19.457 1.00 32.22 O ATOM 678 CB GLN A 48 25.461 5.692 22.708 1.00 12.45 C ATOM 679 CG GLN A 48 26.743 4.950 22.330 1.00 72.35 C ATOM 680 CD GLN A 48 26.541 3.447 22.183 1.00 3.55 C ATOM 681 OE1 GLN A 48 26.617 2.698 23.161 1.00 43.42 O ATOM 682 NE2 GLN A 48 26.302 2.990 20.961 1.00 72.04 N ATOM 0 H GLN A 48 23.206 6.537 23.046 1.00 41.14 H new ATOM 0 HA GLN A 48 25.191 7.089 21.088 1.00 71.11 H new ATOM 0 HB2 GLN A 48 25.724 6.511 23.377 1.00 12.45 H new ATOM 0 HB3 GLN A 48 24.825 5.010 23.273 1.00 12.45 H new ATOM 0 HG2 GLN A 48 27.126 5.353 21.392 1.00 72.35 H new ATOM 0 HG3 GLN A 48 27.501 5.136 23.090 1.00 72.35 H new ATOM 0 HE21 GLN A 48 26.246 3.639 20.176 1.00 72.04 H new ATOM 0 HE22 GLN A 48 26.174 1.990 20.806 1.00 72.04 H new ATOM 691 N LEU A 49 23.385 4.391 20.660 1.00 51.33 N ATOM 692 CA LEU A 49 23.029 3.347 19.706 1.00 61.13 C ATOM 693 C LEU A 49 22.526 3.991 18.418 1.00 21.55 C ATOM 694 O LEU A 49 23.027 3.697 17.327 1.00 71.11 O ATOM 695 CB LEU A 49 21.971 2.409 20.324 1.00 4.20 C ATOM 696 CG LEU A 49 21.734 1.060 19.606 1.00 31.10 C ATOM 697 CD1 LEU A 49 20.961 1.241 18.301 1.00 0.52 C ATOM 698 CD2 LEU A 49 23.063 0.347 19.351 1.00 52.41 C ATOM 0 H LEU A 49 22.786 4.425 21.485 1.00 51.33 H new ATOM 0 HA LEU A 49 23.905 2.745 19.467 1.00 61.13 H new ATOM 0 HB2 LEU A 49 22.262 2.200 21.354 1.00 4.20 H new ATOM 0 HB3 LEU A 49 21.023 2.945 20.363 1.00 4.20 H new ATOM 0 HG LEU A 49 21.124 0.440 20.264 1.00 31.10 H new ATOM 0 HD11 LEU A 49 20.815 0.270 17.827 1.00 0.52 H new ATOM 0 HD12 LEU A 49 19.991 1.691 18.512 1.00 0.52 H new ATOM 0 HD13 LEU A 49 21.525 1.891 17.631 1.00 0.52 H new ATOM 0 HD21 LEU A 49 22.876 -0.600 18.845 1.00 52.41 H new ATOM 0 HD22 LEU A 49 23.698 0.974 18.725 1.00 52.41 H new ATOM 0 HD23 LEU A 49 23.563 0.159 20.301 1.00 52.41 H new ATOM 710 N PHE A 50 21.548 4.887 18.554 1.00 3.42 N ATOM 711 CA PHE A 50 21.018 5.621 17.405 1.00 25.51 C ATOM 712 C PHE A 50 22.126 6.423 16.724 1.00 64.45 C ATOM 713 O PHE A 50 22.176 6.503 15.502 1.00 15.22 O ATOM 714 CB PHE A 50 19.875 6.557 17.827 1.00 52.14 C ATOM 715 CG PHE A 50 19.490 7.565 16.766 1.00 40.34 C ATOM 716 CD1 PHE A 50 18.727 7.196 15.666 1.00 40.14 C ATOM 717 CD2 PHE A 50 19.895 8.888 16.874 1.00 31.01 C ATOM 718 CE1 PHE A 50 18.381 8.123 14.699 1.00 11.20 C ATOM 719 CE2 PHE A 50 19.551 9.816 15.911 1.00 34.34 C ATOM 720 CZ PHE A 50 18.794 9.435 14.821 1.00 61.21 C ATOM 0 H PHE A 50 21.109 5.121 19.444 1.00 3.42 H new ATOM 0 HA PHE A 50 20.622 4.893 16.697 1.00 25.51 H new ATOM 0 HB2 PHE A 50 19.001 5.957 18.080 1.00 52.14 H new ATOM 0 HB3 PHE A 50 20.169 7.089 18.732 1.00 52.14 H new ATOM 0 HD1 PHE A 50 18.399 6.172 15.564 1.00 40.14 H new ATOM 0 HD2 PHE A 50 20.487 9.196 17.723 1.00 31.01 H new ATOM 0 HE1 PHE A 50 17.788 7.820 13.849 1.00 11.20 H new ATOM 0 HE2 PHE A 50 19.875 10.842 16.011 1.00 34.34 H new ATOM 0 HZ PHE A 50 18.526 10.160 14.067 1.00 61.21 H new ATOM 730 N ALA A 51 22.998 7.019 17.530 1.00 33.43 N ATOM 731 CA ALA A 51 24.127 7.794 17.018 1.00 33.33 C ATOM 732 C ALA A 51 24.987 6.949 16.088 1.00 4.13 C ATOM 733 O ALA A 51 25.256 7.341 14.955 1.00 52.03 O ATOM 734 CB ALA A 51 24.972 8.324 18.169 1.00 51.41 C ATOM 0 H ALA A 51 22.945 6.981 18.548 1.00 33.43 H new ATOM 0 HA ALA A 51 23.730 8.637 16.452 1.00 33.33 H new ATOM 0 HB1 ALA A 51 25.809 8.899 17.772 1.00 51.41 H new ATOM 0 HB2 ALA A 51 24.361 8.965 18.804 1.00 51.41 H new ATOM 0 HB3 ALA A 51 25.352 7.488 18.756 1.00 51.41 H new ATOM 740 N ALA A 52 25.406 5.783 16.576 1.00 32.43 N ATOM 741 CA ALA A 52 26.245 4.875 15.798 1.00 41.10 C ATOM 742 C ALA A 52 25.537 4.456 14.512 1.00 30.53 C ATOM 743 O ALA A 52 26.119 4.499 13.422 1.00 13.40 O ATOM 744 CB ALA A 52 26.616 3.654 16.632 1.00 51.43 C ATOM 0 H ALA A 52 25.177 5.444 17.510 1.00 32.43 H new ATOM 0 HA ALA A 52 27.161 5.398 15.524 1.00 41.10 H new ATOM 0 HB1 ALA A 52 27.241 2.986 16.040 1.00 51.43 H new ATOM 0 HB2 ALA A 52 27.163 3.972 17.519 1.00 51.43 H new ATOM 0 HB3 ALA A 52 25.709 3.130 16.934 1.00 51.43 H new ATOM 750 N GLY A 53 24.272 4.064 14.651 1.00 32.23 N ATOM 751 CA GLY A 53 23.479 3.660 13.506 1.00 45.35 C ATOM 752 C GLY A 53 23.363 4.762 12.468 1.00 24.44 C ATOM 753 O GLY A 53 23.680 4.558 11.299 1.00 23.31 O ATOM 0 H GLY A 53 23.781 4.020 15.544 1.00 32.23 H new ATOM 0 HA2 GLY A 53 23.928 2.779 13.048 1.00 45.35 H new ATOM 0 HA3 GLY A 53 22.482 3.372 13.840 1.00 45.35 H new ATOM 757 N TYR A 54 22.930 5.937 12.913 1.00 20.42 N ATOM 758 CA TYR A 54 22.747 7.097 12.037 1.00 1.52 C ATOM 759 C TYR A 54 24.080 7.513 11.417 1.00 10.14 C ATOM 760 O TYR A 54 24.136 7.899 10.252 1.00 3.35 O ATOM 761 CB TYR A 54 22.121 8.262 12.833 1.00 4.31 C ATOM 762 CG TYR A 54 21.914 9.559 12.054 1.00 71.40 C ATOM 763 CD1 TYR A 54 21.681 9.558 10.679 1.00 61.33 C ATOM 764 CD2 TYR A 54 21.941 10.792 12.708 1.00 12.15 C ATOM 765 CE1 TYR A 54 21.486 10.743 9.984 1.00 65.13 C ATOM 766 CE2 TYR A 54 21.745 11.973 12.020 1.00 14.31 C ATOM 767 CZ TYR A 54 21.519 11.946 10.660 1.00 61.32 C ATOM 768 OH TYR A 54 21.328 13.128 9.973 1.00 14.13 O ATOM 0 H TYR A 54 22.695 6.116 13.889 1.00 20.42 H new ATOM 0 HA TYR A 54 22.069 6.828 11.227 1.00 1.52 H new ATOM 0 HB2 TYR A 54 21.157 7.935 13.222 1.00 4.31 H new ATOM 0 HB3 TYR A 54 22.757 8.473 13.693 1.00 4.31 H new ATOM 0 HD1 TYR A 54 21.652 8.619 10.146 1.00 61.33 H new ATOM 0 HD2 TYR A 54 22.119 10.823 13.773 1.00 12.15 H new ATOM 0 HE1 TYR A 54 21.309 10.724 8.919 1.00 65.13 H new ATOM 0 HE2 TYR A 54 21.769 12.916 12.546 1.00 14.31 H new ATOM 0 HH TYR A 54 22.043 13.758 10.202 1.00 14.13 H new ATOM 778 N SER A 55 25.148 7.409 12.199 1.00 11.10 N ATOM 779 CA SER A 55 26.487 7.747 11.732 1.00 22.53 C ATOM 780 C SER A 55 26.864 6.872 10.534 1.00 50.31 C ATOM 781 O SER A 55 27.232 7.374 9.469 1.00 23.31 O ATOM 782 CB SER A 55 27.497 7.563 12.874 1.00 0.44 C ATOM 783 OG SER A 55 28.801 7.970 12.496 1.00 35.10 O ATOM 0 H SER A 55 25.111 7.091 13.167 1.00 11.10 H new ATOM 0 HA SER A 55 26.503 8.790 11.414 1.00 22.53 H new ATOM 0 HB2 SER A 55 27.174 8.139 13.741 1.00 0.44 H new ATOM 0 HB3 SER A 55 27.517 6.516 13.176 1.00 0.44 H new ATOM 0 HG SER A 55 29.415 7.840 13.248 1.00 35.10 H new ATOM 789 N ALA A 56 26.742 5.561 10.712 1.00 25.24 N ATOM 790 CA ALA A 56 27.090 4.606 9.666 1.00 63.14 C ATOM 791 C ALA A 56 26.092 4.671 8.509 1.00 34.41 C ATOM 792 O ALA A 56 26.464 4.524 7.342 1.00 72.41 O ATOM 793 CB ALA A 56 27.166 3.200 10.245 1.00 2.41 C ATOM 0 H ALA A 56 26.403 5.134 11.574 1.00 25.24 H new ATOM 0 HA ALA A 56 28.070 4.870 9.269 1.00 63.14 H new ATOM 0 HB1 ALA A 56 27.426 2.495 9.456 1.00 2.41 H new ATOM 0 HB2 ALA A 56 27.927 3.168 11.025 1.00 2.41 H new ATOM 0 HB3 ALA A 56 26.199 2.929 10.669 1.00 2.41 H new ATOM 799 N CYS A 57 24.826 4.914 8.840 1.00 43.11 N ATOM 800 CA CYS A 57 23.778 5.050 7.835 1.00 65.50 C ATOM 801 C CYS A 57 24.034 6.284 6.978 1.00 1.30 C ATOM 802 O CYS A 57 23.772 6.278 5.779 1.00 31.43 O ATOM 803 CB CYS A 57 22.393 5.127 8.490 1.00 74.40 C ATOM 804 SG CYS A 57 21.905 3.621 9.365 1.00 3.24 S ATOM 0 H CYS A 57 24.501 5.021 9.801 1.00 43.11 H new ATOM 0 HA CYS A 57 23.797 4.167 7.197 1.00 65.50 H new ATOM 0 HB2 CYS A 57 22.380 5.962 9.191 1.00 74.40 H new ATOM 0 HB3 CYS A 57 21.651 5.344 7.722 1.00 74.40 H new ATOM 0 HG CYS A 57 22.583 3.522 10.469 1.00 3.24 H new ATOM 810 N PHE A 58 24.548 7.337 7.611 1.00 12.51 N ATOM 811 CA PHE A 58 24.859 8.584 6.923 1.00 55.51 C ATOM 812 C PHE A 58 25.926 8.319 5.861 1.00 60.31 C ATOM 813 O PHE A 58 25.880 8.863 4.755 1.00 54.45 O ATOM 814 CB PHE A 58 25.353 9.623 7.943 1.00 64.12 C ATOM 815 CG PHE A 58 25.353 11.048 7.444 1.00 32.51 C ATOM 816 CD1 PHE A 58 26.497 11.614 6.896 1.00 53.31 C ATOM 817 CD2 PHE A 58 24.206 11.824 7.537 1.00 40.52 C ATOM 818 CE1 PHE A 58 26.494 12.923 6.452 1.00 60.42 C ATOM 819 CE2 PHE A 58 24.197 13.130 7.094 1.00 51.42 C ATOM 820 CZ PHE A 58 25.341 13.682 6.552 1.00 5.31 C ATOM 0 H PHE A 58 24.759 7.348 8.609 1.00 12.51 H new ATOM 0 HA PHE A 58 23.966 8.975 6.435 1.00 55.51 H new ATOM 0 HB2 PHE A 58 24.727 9.564 8.833 1.00 64.12 H new ATOM 0 HB3 PHE A 58 26.366 9.359 8.248 1.00 64.12 H new ATOM 0 HD1 PHE A 58 27.399 11.025 6.816 1.00 53.31 H new ATOM 0 HD2 PHE A 58 23.309 11.399 7.962 1.00 40.52 H new ATOM 0 HE1 PHE A 58 27.390 13.353 6.028 1.00 60.42 H new ATOM 0 HE2 PHE A 58 23.296 13.721 7.171 1.00 51.42 H new ATOM 0 HZ PHE A 58 25.336 14.705 6.206 1.00 5.31 H new ATOM 830 N LEU A 59 26.869 7.447 6.211 1.00 64.51 N ATOM 831 CA LEU A 59 27.945 7.059 5.307 1.00 63.33 C ATOM 832 C LEU A 59 27.389 6.286 4.106 1.00 14.15 C ATOM 833 O LEU A 59 27.670 6.626 2.957 1.00 3.51 O ATOM 834 CB LEU A 59 28.988 6.215 6.057 1.00 74.12 C ATOM 835 CG LEU A 59 30.229 5.820 5.239 1.00 31.41 C ATOM 836 CD1 LEU A 59 30.972 7.064 4.749 1.00 61.22 C ATOM 837 CD2 LEU A 59 31.154 4.924 6.063 1.00 2.33 C ATOM 0 H LEU A 59 26.908 6.993 7.124 1.00 64.51 H new ATOM 0 HA LEU A 59 28.429 7.962 4.935 1.00 63.33 H new ATOM 0 HB2 LEU A 59 29.315 6.770 6.936 1.00 74.12 H new ATOM 0 HB3 LEU A 59 28.505 5.306 6.415 1.00 74.12 H new ATOM 0 HG LEU A 59 29.899 5.257 4.366 1.00 31.41 H new ATOM 0 HD11 LEU A 59 31.846 6.762 4.173 1.00 61.22 H new ATOM 0 HD12 LEU A 59 30.310 7.659 4.119 1.00 61.22 H new ATOM 0 HD13 LEU A 59 31.290 7.659 5.605 1.00 61.22 H new ATOM 0 HD21 LEU A 59 32.026 4.655 5.467 1.00 2.33 H new ATOM 0 HD22 LEU A 59 31.476 5.458 6.957 1.00 2.33 H new ATOM 0 HD23 LEU A 59 30.620 4.019 6.353 1.00 2.33 H new ATOM 849 N SER A 60 26.587 5.253 4.375 1.00 34.05 N ATOM 850 CA SER A 60 25.979 4.453 3.311 1.00 74.40 C ATOM 851 C SER A 60 25.020 5.295 2.467 1.00 42.34 C ATOM 852 O SER A 60 24.924 5.111 1.247 1.00 41.15 O ATOM 853 CB SER A 60 25.273 3.227 3.903 1.00 52.34 C ATOM 854 OG SER A 60 26.225 2.352 4.489 1.00 74.20 O ATOM 0 H SER A 60 26.344 4.952 5.319 1.00 34.05 H new ATOM 0 HA SER A 60 26.771 4.102 2.649 1.00 74.40 H new ATOM 0 HB2 SER A 60 24.547 3.542 4.653 1.00 52.34 H new ATOM 0 HB3 SER A 60 24.719 2.705 3.123 1.00 52.34 H new ATOM 0 HG SER A 60 26.000 1.425 4.263 1.00 74.20 H new ATOM 860 N ALA A 61 24.337 6.232 3.115 1.00 5.22 N ATOM 861 CA ALA A 61 23.478 7.177 2.414 1.00 61.10 C ATOM 862 C ALA A 61 24.311 7.969 1.418 1.00 23.52 C ATOM 863 O ALA A 61 23.941 8.110 0.255 1.00 64.15 O ATOM 864 CB ALA A 61 22.781 8.109 3.402 1.00 23.00 C ATOM 0 H ALA A 61 24.362 6.357 4.127 1.00 5.22 H new ATOM 0 HA ALA A 61 22.705 6.629 1.876 1.00 61.10 H new ATOM 0 HB1 ALA A 61 22.145 8.806 2.857 1.00 23.00 H new ATOM 0 HB2 ALA A 61 22.171 7.521 4.088 1.00 23.00 H new ATOM 0 HB3 ALA A 61 23.529 8.666 3.967 1.00 23.00 H new ATOM 870 N MET A 62 25.461 8.450 1.883 1.00 1.42 N ATOM 871 CA MET A 62 26.403 9.163 1.025 1.00 22.23 C ATOM 872 C MET A 62 26.961 8.244 -0.062 1.00 52.25 C ATOM 873 O MET A 62 27.245 8.695 -1.171 1.00 52.11 O ATOM 874 CB MET A 62 27.548 9.769 1.849 1.00 12.31 C ATOM 875 CG MET A 62 27.148 11.016 2.629 1.00 13.45 C ATOM 876 SD MET A 62 26.575 12.349 1.551 1.00 13.34 S ATOM 877 CE MET A 62 28.000 12.585 0.489 1.00 61.32 C ATOM 0 H MET A 62 25.764 8.358 2.853 1.00 1.42 H new ATOM 0 HA MET A 62 25.859 9.975 0.542 1.00 22.23 H new ATOM 0 HB2 MET A 62 27.919 9.018 2.547 1.00 12.31 H new ATOM 0 HB3 MET A 62 28.372 10.018 1.181 1.00 12.31 H new ATOM 0 HG2 MET A 62 26.360 10.761 3.337 1.00 13.45 H new ATOM 0 HG3 MET A 62 28.000 11.365 3.212 1.00 13.45 H new ATOM 0 HE1 MET A 62 27.941 13.564 0.013 1.00 61.32 H new ATOM 0 HE2 MET A 62 28.911 12.525 1.084 1.00 61.32 H new ATOM 0 HE3 MET A 62 28.015 11.810 -0.277 1.00 61.32 H new ATOM 887 N LYS A 63 27.117 6.954 0.253 1.00 50.31 N ATOM 888 CA LYS A 63 27.588 5.983 -0.738 1.00 32.21 C ATOM 889 C LYS A 63 26.587 5.890 -1.888 1.00 55.33 C ATOM 890 O LYS A 63 26.971 5.819 -3.058 1.00 31.21 O ATOM 891 CB LYS A 63 27.808 4.584 -0.126 1.00 32.54 C ATOM 892 CG LYS A 63 28.853 4.531 0.995 1.00 62.32 C ATOM 893 CD LYS A 63 29.552 3.167 1.072 1.00 52.53 C ATOM 894 CE LYS A 63 28.577 1.999 1.248 1.00 52.13 C ATOM 895 NZ LYS A 63 28.074 1.863 2.645 1.00 51.23 N1+ ATOM 0 H LYS A 63 26.926 6.562 1.175 1.00 50.31 H new ATOM 0 HA LYS A 63 28.551 6.335 -1.108 1.00 32.21 H new ATOM 0 HB2 LYS A 63 26.858 4.220 0.264 1.00 32.54 H new ATOM 0 HB3 LYS A 63 28.110 3.899 -0.918 1.00 32.54 H new ATOM 0 HG2 LYS A 63 29.598 5.310 0.832 1.00 62.32 H new ATOM 0 HG3 LYS A 63 28.371 4.745 1.949 1.00 62.32 H new ATOM 0 HD2 LYS A 63 30.134 3.012 0.163 1.00 52.53 H new ATOM 0 HD3 LYS A 63 30.256 3.173 1.904 1.00 52.53 H new ATOM 0 HE2 LYS A 63 27.731 2.135 0.575 1.00 52.13 H new ATOM 0 HE3 LYS A 63 29.072 1.073 0.954 1.00 52.13 H new ATOM 0 HZ1 LYS A 63 27.071 1.587 2.628 1.00 51.23 H new ATOM 0 HZ2 LYS A 63 28.625 1.135 3.143 1.00 51.23 H new ATOM 0 HZ3 LYS A 63 28.174 2.772 3.140 1.00 51.23 H new ATOM 909 N PHE A 64 25.301 5.893 -1.549 1.00 54.13 N ATOM 910 CA PHE A 64 24.249 5.868 -2.562 1.00 15.41 C ATOM 911 C PHE A 64 24.180 7.211 -3.292 1.00 43.31 C ATOM 912 O PHE A 64 24.150 7.256 -4.524 1.00 31.42 O ATOM 913 CB PHE A 64 22.889 5.528 -1.936 1.00 54.23 C ATOM 914 CG PHE A 64 21.759 5.508 -2.939 1.00 22.52 C ATOM 915 CD1 PHE A 64 21.798 4.652 -4.033 1.00 70.34 C ATOM 916 CD2 PHE A 64 20.667 6.353 -2.795 1.00 44.41 C ATOM 917 CE1 PHE A 64 20.772 4.642 -4.958 1.00 70.35 C ATOM 918 CE2 PHE A 64 19.640 6.344 -3.718 1.00 31.33 C ATOM 919 CZ PHE A 64 19.692 5.488 -4.801 1.00 62.32 C ATOM 0 H PHE A 64 24.963 5.912 -0.587 1.00 54.13 H new ATOM 0 HA PHE A 64 24.493 5.089 -3.284 1.00 15.41 H new ATOM 0 HB2 PHE A 64 22.953 4.554 -1.451 1.00 54.23 H new ATOM 0 HB3 PHE A 64 22.662 6.257 -1.158 1.00 54.23 H new ATOM 0 HD1 PHE A 64 22.640 3.987 -4.161 1.00 70.34 H new ATOM 0 HD2 PHE A 64 20.620 7.025 -1.951 1.00 44.41 H new ATOM 0 HE1 PHE A 64 20.815 3.972 -5.804 1.00 70.35 H new ATOM 0 HE2 PHE A 64 18.796 7.006 -3.593 1.00 31.33 H new ATOM 0 HZ PHE A 64 18.889 5.480 -5.524 1.00 62.32 H new ATOM 929 N VAL A 65 24.173 8.299 -2.524 1.00 22.12 N ATOM 930 CA VAL A 65 24.126 9.653 -3.078 1.00 1.13 C ATOM 931 C VAL A 65 25.231 9.863 -4.114 1.00 2.04 C ATOM 932 O VAL A 65 24.988 10.377 -5.213 1.00 1.42 O ATOM 933 CB VAL A 65 24.251 10.723 -1.961 1.00 51.41 C ATOM 934 CG1 VAL A 65 24.529 12.105 -2.546 1.00 35.23 C ATOM 935 CG2 VAL A 65 22.988 10.749 -1.099 1.00 41.32 C ATOM 0 H VAL A 65 24.200 8.269 -1.505 1.00 22.12 H new ATOM 0 HA VAL A 65 23.158 9.767 -3.566 1.00 1.13 H new ATOM 0 HB VAL A 65 25.097 10.451 -1.331 1.00 51.41 H new ATOM 0 HG11 VAL A 65 24.611 12.832 -1.738 1.00 35.23 H new ATOM 0 HG12 VAL A 65 25.462 12.081 -3.109 1.00 35.23 H new ATOM 0 HG13 VAL A 65 23.712 12.390 -3.209 1.00 35.23 H new ATOM 0 HG21 VAL A 65 23.094 11.505 -0.321 1.00 41.32 H new ATOM 0 HG22 VAL A 65 22.127 10.988 -1.723 1.00 41.32 H new ATOM 0 HG23 VAL A 65 22.842 9.772 -0.638 1.00 41.32 H new ATOM 945 N ALA A 66 26.441 9.448 -3.766 1.00 10.53 N ATOM 946 CA ALA A 66 27.585 9.572 -4.660 1.00 34.24 C ATOM 947 C ALA A 66 27.308 8.867 -5.987 1.00 52.01 C ATOM 948 O ALA A 66 27.734 9.323 -7.049 1.00 55.45 O ATOM 949 CB ALA A 66 28.836 9.009 -3.993 1.00 2.15 C ATOM 0 H ALA A 66 26.657 9.020 -2.866 1.00 10.53 H new ATOM 0 HA ALA A 66 27.754 10.628 -4.870 1.00 34.24 H new ATOM 0 HB1 ALA A 66 29.685 9.107 -4.670 1.00 2.15 H new ATOM 0 HB2 ALA A 66 29.039 9.561 -3.075 1.00 2.15 H new ATOM 0 HB3 ALA A 66 28.680 7.956 -3.757 1.00 2.15 H new ATOM 955 N GLY A 67 26.540 7.785 -5.914 1.00 41.30 N ATOM 956 CA GLY A 67 26.250 6.979 -7.088 1.00 41.44 C ATOM 957 C GLY A 67 25.310 7.672 -8.057 1.00 65.01 C ATOM 958 O GLY A 67 25.360 7.430 -9.262 1.00 24.21 O ATOM 0 H GLY A 67 26.109 7.448 -5.053 1.00 41.30 H new ATOM 0 HA2 GLY A 67 27.183 6.742 -7.600 1.00 41.44 H new ATOM 0 HA3 GLY A 67 25.809 6.033 -6.774 1.00 41.44 H new ATOM 962 N GLN A 68 24.456 8.547 -7.533 1.00 2.22 N ATOM 963 CA GLN A 68 23.498 9.275 -8.364 1.00 3.22 C ATOM 964 C GLN A 68 24.054 10.655 -8.692 1.00 13.50 C ATOM 965 O GLN A 68 23.560 11.350 -9.583 1.00 73.33 O ATOM 966 CB GLN A 68 22.137 9.384 -7.660 1.00 70.02 C ATOM 967 CG GLN A 68 22.214 9.945 -6.248 1.00 23.14 C ATOM 968 CD GLN A 68 20.849 10.190 -5.635 1.00 11.52 C ATOM 969 OE1 GLN A 68 20.280 9.318 -4.983 1.00 54.51 O ATOM 970 NE2 GLN A 68 20.313 11.379 -5.852 1.00 55.13 N ATOM 0 H GLN A 68 24.407 8.770 -6.539 1.00 2.22 H new ATOM 0 HA GLN A 68 23.344 8.726 -9.293 1.00 3.22 H new ATOM 0 HB2 GLN A 68 21.481 10.018 -8.256 1.00 70.02 H new ATOM 0 HB3 GLN A 68 21.678 8.396 -7.623 1.00 70.02 H new ATOM 0 HG2 GLN A 68 22.771 9.252 -5.617 1.00 23.14 H new ATOM 0 HG3 GLN A 68 22.773 10.881 -6.264 1.00 23.14 H new ATOM 0 HE21 GLN A 68 20.820 12.075 -6.399 1.00 55.13 H new ATOM 0 HE22 GLN A 68 19.393 11.601 -5.472 1.00 55.13 H new ATOM 979 N ASN A 69 25.084 11.041 -7.948 1.00 45.10 N ATOM 980 CA ASN A 69 25.826 12.272 -8.212 1.00 61.12 C ATOM 981 C ASN A 69 27.037 11.982 -9.100 1.00 41.24 C ATOM 982 O ASN A 69 27.767 12.896 -9.495 1.00 42.44 O ATOM 983 CB ASN A 69 26.261 12.919 -6.887 1.00 43.31 C ATOM 984 CG ASN A 69 25.159 13.754 -6.251 1.00 21.20 C ATOM 985 OD1 ASN A 69 25.091 14.966 -6.447 1.00 73.01 O ATOM 986 ND2 ASN A 69 24.277 13.113 -5.498 1.00 73.35 N ATOM 0 H ASN A 69 25.429 10.513 -7.147 1.00 45.10 H new ATOM 0 HA ASN A 69 25.178 12.971 -8.740 1.00 61.12 H new ATOM 0 HB2 ASN A 69 26.568 12.139 -6.190 1.00 43.31 H new ATOM 0 HB3 ASN A 69 27.132 13.549 -7.064 1.00 43.31 H new ATOM 0 HD21 ASN A 69 23.512 13.626 -5.060 1.00 73.35 H new ATOM 0 HD22 ASN A 69 24.363 12.107 -5.356 1.00 73.35 H new ATOM 993 N LYS A 70 27.241 10.692 -9.395 1.00 63.25 N ATOM 994 CA LYS A 70 28.313 10.225 -10.280 1.00 32.31 C ATOM 995 C LYS A 70 29.686 10.628 -9.755 1.00 12.34 C ATOM 996 O LYS A 70 30.667 10.694 -10.500 1.00 70.50 O ATOM 997 CB LYS A 70 28.087 10.711 -11.721 1.00 4.35 C ATOM 998 CG LYS A 70 27.137 9.812 -12.512 1.00 13.20 C ATOM 999 CD LYS A 70 25.902 9.441 -11.697 1.00 32.43 C ATOM 1000 CE LYS A 70 24.905 8.610 -12.495 1.00 4.32 C ATOM 1001 NZ LYS A 70 25.443 7.264 -12.816 1.00 52.12 N1+ ATOM 0 H LYS A 70 26.662 9.939 -9.023 1.00 63.25 H new ATOM 0 HA LYS A 70 28.285 9.135 -10.293 1.00 32.31 H new ATOM 0 HB2 LYS A 70 27.685 11.724 -11.698 1.00 4.35 H new ATOM 0 HB3 LYS A 70 29.046 10.760 -12.237 1.00 4.35 H new ATOM 0 HG2 LYS A 70 26.831 10.321 -13.426 1.00 13.20 H new ATOM 0 HG3 LYS A 70 27.661 8.905 -12.813 1.00 13.20 H new ATOM 0 HD2 LYS A 70 26.209 8.884 -10.812 1.00 32.43 H new ATOM 0 HD3 LYS A 70 25.414 10.351 -11.348 1.00 32.43 H new ATOM 0 HE2 LYS A 70 23.981 8.506 -11.927 1.00 4.32 H new ATOM 0 HE3 LYS A 70 24.654 9.131 -13.419 1.00 4.32 H new ATOM 0 HZ1 LYS A 70 24.712 6.704 -13.300 1.00 52.12 H new ATOM 0 HZ2 LYS A 70 26.272 7.360 -13.436 1.00 52.12 H new ATOM 0 HZ3 LYS A 70 25.722 6.783 -11.937 1.00 52.12 H new ATOM 1015 N GLN A 71 29.744 10.861 -8.455 1.00 41.25 N ATOM 1016 CA GLN A 71 30.987 11.180 -7.773 1.00 41.44 C ATOM 1017 C GLN A 71 31.409 9.996 -6.911 1.00 11.15 C ATOM 1018 O GLN A 71 30.599 9.122 -6.602 1.00 3.32 O ATOM 1019 CB GLN A 71 30.828 12.437 -6.907 1.00 65.11 C ATOM 1020 CG GLN A 71 29.646 12.372 -5.947 1.00 11.32 C ATOM 1021 CD GLN A 71 29.871 13.156 -4.670 1.00 14.24 C ATOM 1022 OE1 GLN A 71 29.618 14.360 -4.597 1.00 4.02 O ATOM 1023 NE2 GLN A 71 30.313 12.456 -3.645 1.00 60.02 N ATOM 0 H GLN A 71 28.930 10.834 -7.842 1.00 41.25 H new ATOM 0 HA GLN A 71 31.757 11.380 -8.518 1.00 41.44 H new ATOM 0 HB2 GLN A 71 31.742 12.591 -6.334 1.00 65.11 H new ATOM 0 HB3 GLN A 71 30.710 13.303 -7.558 1.00 65.11 H new ATOM 0 HG2 GLN A 71 28.757 12.754 -6.449 1.00 11.32 H new ATOM 0 HG3 GLN A 71 29.447 11.330 -5.696 1.00 11.32 H new ATOM 0 HE21 GLN A 71 30.509 11.461 -3.753 1.00 60.02 H new ATOM 0 HE22 GLN A 71 30.459 12.909 -2.743 1.00 60.02 H new ATOM 1032 N THR A 72 32.669 9.972 -6.520 1.00 0.13 N ATOM 1033 CA THR A 72 33.213 8.874 -5.732 1.00 33.54 C ATOM 1034 C THR A 72 33.844 9.396 -4.449 1.00 64.51 C ATOM 1035 O THR A 72 34.609 10.363 -4.471 1.00 2.32 O ATOM 1036 CB THR A 72 34.261 8.080 -6.545 1.00 55.21 C ATOM 1037 OG1 THR A 72 35.172 8.988 -7.185 1.00 1.42 O ATOM 1038 CG2 THR A 72 33.592 7.196 -7.591 1.00 71.13 C ATOM 0 H THR A 72 33.343 10.706 -6.736 1.00 0.13 H new ATOM 0 HA THR A 72 32.390 8.207 -5.476 1.00 33.54 H new ATOM 0 HB THR A 72 34.810 7.437 -5.857 1.00 55.21 H new ATOM 0 HG1 THR A 72 35.835 8.479 -7.697 1.00 1.42 H new ATOM 0 HG21 THR A 72 34.354 6.650 -8.147 1.00 71.13 H new ATOM 0 HG22 THR A 72 32.926 6.488 -7.097 1.00 71.13 H new ATOM 0 HG23 THR A 72 33.017 7.817 -8.278 1.00 71.13 H new ATOM 1046 N LEU A 73 33.495 8.773 -3.330 1.00 24.22 N ATOM 1047 CA LEU A 73 34.070 9.136 -2.040 1.00 2.33 C ATOM 1048 C LEU A 73 35.011 8.031 -1.547 1.00 44.11 C ATOM 1049 O LEU A 73 34.710 6.844 -1.695 1.00 52.40 O ATOM 1050 CB LEU A 73 32.970 9.446 -1.004 1.00 54.54 C ATOM 1051 CG LEU A 73 31.582 8.894 -1.335 1.00 53.14 C ATOM 1052 CD1 LEU A 73 31.540 7.372 -1.217 1.00 63.13 C ATOM 1053 CD2 LEU A 73 30.517 9.539 -0.452 1.00 44.41 C ATOM 0 H LEU A 73 32.816 8.013 -3.290 1.00 24.22 H new ATOM 0 HA LEU A 73 34.655 10.047 -2.169 1.00 2.33 H new ATOM 0 HB2 LEU A 73 33.281 9.046 -0.039 1.00 54.54 H new ATOM 0 HB3 LEU A 73 32.895 10.528 -0.892 1.00 54.54 H new ATOM 0 HG LEU A 73 31.365 9.148 -2.373 1.00 53.14 H new ATOM 0 HD11 LEU A 73 30.539 7.016 -1.459 1.00 63.13 H new ATOM 0 HD12 LEU A 73 32.259 6.933 -1.909 1.00 63.13 H new ATOM 0 HD13 LEU A 73 31.793 7.079 -0.198 1.00 63.13 H new ATOM 0 HD21 LEU A 73 29.538 9.131 -0.705 1.00 44.41 H new ATOM 0 HD22 LEU A 73 30.737 9.330 0.595 1.00 44.41 H new ATOM 0 HD23 LEU A 73 30.514 10.617 -0.614 1.00 44.41 H new ATOM 1065 N PRO A 74 36.177 8.416 -0.991 1.00 14.33 N ATOM 1066 CA PRO A 74 37.172 7.468 -0.463 1.00 71.54 C ATOM 1067 C PRO A 74 36.597 6.532 0.604 1.00 22.35 C ATOM 1068 O PRO A 74 35.934 6.981 1.538 1.00 71.04 O ATOM 1069 CB PRO A 74 38.253 8.375 0.161 1.00 0.31 C ATOM 1070 CG PRO A 74 37.642 9.736 0.241 1.00 75.32 C ATOM 1071 CD PRO A 74 36.630 9.810 -0.861 1.00 21.31 C ATOM 0 HA PRO A 74 37.543 6.811 -1.249 1.00 71.54 H new ATOM 0 HB2 PRO A 74 38.542 8.017 1.149 1.00 0.31 H new ATOM 0 HB3 PRO A 74 39.155 8.386 -0.450 1.00 0.31 H new ATOM 0 HG2 PRO A 74 37.172 9.894 1.212 1.00 75.32 H new ATOM 0 HG3 PRO A 74 38.401 10.510 0.124 1.00 75.32 H new ATOM 0 HD2 PRO A 74 35.808 10.479 -0.609 1.00 21.31 H new ATOM 0 HD3 PRO A 74 37.069 10.179 -1.788 1.00 21.31 H new ATOM 1079 N ALA A 75 36.881 5.237 0.473 1.00 74.43 N ATOM 1080 CA ALA A 75 36.448 4.233 1.450 1.00 72.21 C ATOM 1081 C ALA A 75 37.319 4.270 2.707 1.00 34.41 C ATOM 1082 O ALA A 75 37.135 3.481 3.634 1.00 42.34 O ATOM 1083 CB ALA A 75 36.467 2.844 0.820 1.00 2.05 C ATOM 0 H ALA A 75 37.414 4.854 -0.307 1.00 74.43 H new ATOM 0 HA ALA A 75 35.427 4.468 1.750 1.00 72.21 H new ATOM 0 HB1 ALA A 75 36.144 2.107 1.555 1.00 2.05 H new ATOM 0 HB2 ALA A 75 35.792 2.823 -0.036 1.00 2.05 H new ATOM 0 HB3 ALA A 75 37.479 2.608 0.490 1.00 2.05 H new ATOM 1089 N ASP A 76 38.269 5.199 2.726 1.00 35.21 N ATOM 1090 CA ASP A 76 39.189 5.362 3.854 1.00 24.42 C ATOM 1091 C ASP A 76 38.662 6.431 4.817 1.00 33.35 C ATOM 1092 O ASP A 76 39.393 6.966 5.652 1.00 61.01 O ATOM 1093 CB ASP A 76 40.575 5.745 3.311 1.00 72.44 C ATOM 1094 CG ASP A 76 41.667 5.736 4.373 1.00 23.12 C ATOM 1095 OD1 ASP A 76 41.947 4.658 4.938 1.00 55.31 O ATOM 1096 OD2 ASP A 76 42.282 6.799 4.620 1.00 42.23 O1- ATOM 0 H ASP A 76 38.425 5.860 1.965 1.00 35.21 H new ATOM 0 HA ASP A 76 39.268 4.427 4.408 1.00 24.42 H new ATOM 0 HB2 ASP A 76 40.848 5.053 2.514 1.00 72.44 H new ATOM 0 HB3 ASP A 76 40.520 6.738 2.866 1.00 72.44 H new ATOM 1101 N THR A 77 37.374 6.724 4.694 1.00 11.55 N ATOM 1102 CA THR A 77 36.726 7.771 5.477 1.00 12.43 C ATOM 1103 C THR A 77 36.151 7.240 6.795 1.00 50.31 C ATOM 1104 O THR A 77 36.031 6.025 6.998 1.00 30.02 O ATOM 1105 CB THR A 77 35.604 8.433 4.644 1.00 41.10 C ATOM 1106 OG1 THR A 77 34.944 9.457 5.395 1.00 73.42 O ATOM 1107 CG2 THR A 77 34.574 7.406 4.185 1.00 73.22 C ATOM 0 H THR A 77 36.748 6.243 4.049 1.00 11.55 H new ATOM 0 HA THR A 77 37.488 8.509 5.727 1.00 12.43 H new ATOM 0 HB THR A 77 36.076 8.877 3.768 1.00 41.10 H new ATOM 0 HG1 THR A 77 35.610 9.988 5.880 1.00 73.42 H new ATOM 0 HG21 THR A 77 33.799 7.904 3.602 1.00 73.22 H new ATOM 0 HG22 THR A 77 35.063 6.651 3.569 1.00 73.22 H new ATOM 0 HG23 THR A 77 34.123 6.929 5.055 1.00 73.22 H new ATOM 1115 N THR A 78 35.797 8.170 7.684 1.00 13.54 N ATOM 1116 CA THR A 78 35.238 7.850 8.993 1.00 2.03 C ATOM 1117 C THR A 78 34.270 8.943 9.449 1.00 41.21 C ATOM 1118 O THR A 78 34.428 10.116 9.103 1.00 33.42 O ATOM 1119 CB THR A 78 36.351 7.694 10.061 1.00 65.01 C ATOM 1120 OG1 THR A 78 37.421 8.606 9.788 1.00 41.13 O ATOM 1121 CG2 THR A 78 36.882 6.271 10.108 1.00 52.04 C ATOM 0 H THR A 78 35.892 9.171 7.512 1.00 13.54 H new ATOM 0 HA THR A 78 34.706 6.904 8.891 1.00 2.03 H new ATOM 0 HB THR A 78 35.917 7.922 11.034 1.00 65.01 H new ATOM 0 HG1 THR A 78 38.120 8.503 10.467 1.00 41.13 H new ATOM 0 HG21 THR A 78 37.661 6.198 10.867 1.00 52.04 H new ATOM 0 HG22 THR A 78 36.070 5.587 10.354 1.00 52.04 H new ATOM 0 HG23 THR A 78 37.297 6.005 9.136 1.00 52.04 H new ATOM 1129 N VAL A 79 33.271 8.546 10.224 1.00 13.33 N ATOM 1130 CA VAL A 79 32.343 9.479 10.858 1.00 51.35 C ATOM 1131 C VAL A 79 32.205 9.124 12.329 1.00 40.33 C ATOM 1132 O VAL A 79 31.905 7.985 12.669 1.00 15.54 O ATOM 1133 CB VAL A 79 30.939 9.468 10.198 1.00 73.54 C ATOM 1134 CG1 VAL A 79 29.970 10.376 10.960 1.00 32.33 C ATOM 1135 CG2 VAL A 79 31.028 9.900 8.743 1.00 4.51 C ATOM 0 H VAL A 79 33.078 7.566 10.433 1.00 13.33 H new ATOM 0 HA VAL A 79 32.754 10.481 10.734 1.00 51.35 H new ATOM 0 HB VAL A 79 30.558 8.448 10.237 1.00 73.54 H new ATOM 0 HG11 VAL A 79 28.993 10.351 10.478 1.00 32.33 H new ATOM 0 HG12 VAL A 79 29.876 10.027 11.988 1.00 32.33 H new ATOM 0 HG13 VAL A 79 30.350 11.398 10.957 1.00 32.33 H new ATOM 0 HG21 VAL A 79 30.033 9.886 8.298 1.00 4.51 H new ATOM 0 HG22 VAL A 79 31.436 10.909 8.687 1.00 4.51 H new ATOM 0 HG23 VAL A 79 31.679 9.215 8.199 1.00 4.51 H new ATOM 1145 N THR A 80 32.447 10.090 13.196 1.00 3.21 N ATOM 1146 CA THR A 80 32.357 9.865 14.633 1.00 52.54 C ATOM 1147 C THR A 80 31.174 10.627 15.222 1.00 43.34 C ATOM 1148 O THR A 80 31.156 11.858 15.220 1.00 4.30 O ATOM 1149 CB THR A 80 33.662 10.284 15.348 1.00 61.00 C ATOM 1150 OG1 THR A 80 34.773 9.602 14.750 1.00 41.24 O ATOM 1151 CG2 THR A 80 33.609 9.962 16.841 1.00 20.33 C ATOM 0 H THR A 80 32.708 11.040 12.933 1.00 3.21 H new ATOM 0 HA THR A 80 32.206 8.797 14.792 1.00 52.54 H new ATOM 0 HB THR A 80 33.779 11.362 15.238 1.00 61.00 H new ATOM 0 HG1 THR A 80 35.601 9.868 15.201 1.00 41.24 H new ATOM 0 HG21 THR A 80 34.542 10.269 17.313 1.00 20.33 H new ATOM 0 HG22 THR A 80 32.777 10.497 17.299 1.00 20.33 H new ATOM 0 HG23 THR A 80 33.470 8.890 16.977 1.00 20.33 H new ATOM 1159 N ALA A 81 30.179 9.886 15.696 1.00 63.21 N ATOM 1160 CA ALA A 81 29.009 10.476 16.332 1.00 75.00 C ATOM 1161 C ALA A 81 29.215 10.541 17.840 1.00 14.40 C ATOM 1162 O ALA A 81 29.193 9.515 18.525 1.00 73.21 O ATOM 1163 CB ALA A 81 27.756 9.678 15.991 1.00 42.42 C ATOM 0 H ALA A 81 30.161 8.867 15.651 1.00 63.21 H new ATOM 0 HA ALA A 81 28.876 11.490 15.955 1.00 75.00 H new ATOM 0 HB1 ALA A 81 26.892 10.133 16.475 1.00 42.42 H new ATOM 0 HB2 ALA A 81 27.608 9.676 14.911 1.00 42.42 H new ATOM 0 HB3 ALA A 81 27.871 8.653 16.343 1.00 42.42 H new ATOM 1169 N GLU A 82 29.450 11.741 18.347 1.00 71.31 N ATOM 1170 CA GLU A 82 29.669 11.950 19.772 1.00 72.51 C ATOM 1171 C GLU A 82 28.456 12.640 20.387 1.00 53.13 C ATOM 1172 O GLU A 82 28.212 13.820 20.141 1.00 25.01 O ATOM 1173 CB GLU A 82 30.946 12.777 19.985 1.00 74.00 C ATOM 1174 CG GLU A 82 31.370 12.902 21.443 1.00 3.23 C ATOM 1175 CD GLU A 82 32.745 13.533 21.604 1.00 23.22 C ATOM 1176 OE1 GLU A 82 33.756 12.822 21.425 1.00 3.55 O ATOM 1177 OE2 GLU A 82 32.825 14.735 21.925 1.00 51.44 O1- ATOM 0 H GLU A 82 29.494 12.593 17.788 1.00 71.31 H new ATOM 0 HA GLU A 82 29.799 10.988 20.267 1.00 72.51 H new ATOM 0 HB2 GLU A 82 31.759 12.322 19.419 1.00 74.00 H new ATOM 0 HB3 GLU A 82 30.792 13.775 19.576 1.00 74.00 H new ATOM 0 HG2 GLU A 82 30.635 13.501 21.981 1.00 3.23 H new ATOM 0 HG3 GLU A 82 31.373 11.913 21.902 1.00 3.23 H new ATOM 1184 N VAL A 83 27.687 11.893 21.170 1.00 31.40 N ATOM 1185 CA VAL A 83 26.460 12.412 21.771 1.00 74.25 C ATOM 1186 C VAL A 83 26.700 12.823 23.219 1.00 12.15 C ATOM 1187 O VAL A 83 27.433 12.155 23.952 1.00 3.30 O ATOM 1188 CB VAL A 83 25.313 11.366 21.723 1.00 22.15 C ATOM 1189 CG1 VAL A 83 24.978 10.990 20.285 1.00 60.03 C ATOM 1190 CG2 VAL A 83 25.670 10.119 22.527 1.00 42.03 C ATOM 0 H VAL A 83 27.891 10.922 21.406 1.00 31.40 H new ATOM 0 HA VAL A 83 26.163 13.284 21.188 1.00 74.25 H new ATOM 0 HB VAL A 83 24.432 11.823 22.175 1.00 22.15 H new ATOM 0 HG11 VAL A 83 24.172 10.256 20.279 1.00 60.03 H new ATOM 0 HG12 VAL A 83 24.663 11.880 19.740 1.00 60.03 H new ATOM 0 HG13 VAL A 83 25.859 10.564 19.805 1.00 60.03 H new ATOM 0 HG21 VAL A 83 24.848 9.405 22.475 1.00 42.03 H new ATOM 0 HG22 VAL A 83 26.571 9.666 22.114 1.00 42.03 H new ATOM 0 HG23 VAL A 83 25.846 10.395 23.567 1.00 42.03 H new ATOM 1200 N GLY A 84 26.103 13.939 23.620 1.00 33.12 N ATOM 1201 CA GLY A 84 26.170 14.369 24.997 1.00 23.12 C ATOM 1202 C GLY A 84 24.800 14.695 25.539 1.00 64.22 C ATOM 1203 O GLY A 84 23.915 15.099 24.789 1.00 21.33 O ATOM 0 H GLY A 84 25.570 14.556 23.007 1.00 33.12 H new ATOM 0 HA2 GLY A 84 26.626 13.586 25.603 1.00 23.12 H new ATOM 0 HA3 GLY A 84 26.812 15.246 25.075 1.00 23.12 H new ATOM 1207 N ILE A 85 24.628 14.523 26.837 1.00 23.52 N ATOM 1208 CA ILE A 85 23.367 14.806 27.495 1.00 1.40 C ATOM 1209 C ILE A 85 23.619 15.644 28.737 1.00 61.15 C ATOM 1210 O ILE A 85 24.481 15.310 29.569 1.00 10.52 O ATOM 1211 CB ILE A 85 22.599 13.504 27.860 1.00 52.02 C ATOM 1212 CG1 ILE A 85 21.255 13.817 28.563 1.00 53.33 C ATOM 1213 CG2 ILE A 85 23.469 12.588 28.719 1.00 35.55 C ATOM 1214 CD1 ILE A 85 21.332 13.924 30.078 1.00 71.32 C ATOM 0 H ILE A 85 25.358 14.184 27.463 1.00 23.52 H new ATOM 0 HA ILE A 85 22.739 15.364 26.801 1.00 1.40 H new ATOM 0 HB ILE A 85 22.367 12.982 26.932 1.00 52.02 H new ATOM 0 HG12 ILE A 85 20.865 14.755 28.167 1.00 53.33 H new ATOM 0 HG13 ILE A 85 20.537 13.038 28.305 1.00 53.33 H new ATOM 0 HG21 ILE A 85 22.913 11.683 28.964 1.00 35.55 H new ATOM 0 HG22 ILE A 85 24.372 12.322 28.169 1.00 35.55 H new ATOM 0 HG23 ILE A 85 23.744 13.105 29.639 1.00 35.55 H new ATOM 0 HD11 ILE A 85 20.342 14.145 30.478 1.00 71.32 H new ATOM 0 HD12 ILE A 85 21.688 12.981 30.492 1.00 71.32 H new ATOM 0 HD13 ILE A 85 22.021 14.723 30.352 1.00 71.32 H new ATOM 1226 N GLY A 86 22.892 16.751 28.825 1.00 43.44 N ATOM 1227 CA GLY A 86 22.995 17.648 29.965 1.00 64.20 C ATOM 1228 C GLY A 86 21.730 18.463 30.147 1.00 43.21 C ATOM 1229 O GLY A 86 20.857 18.438 29.278 1.00 31.32 O ATOM 0 H GLY A 86 22.222 17.048 28.116 1.00 43.44 H new ATOM 0 HA2 GLY A 86 23.189 17.069 30.868 1.00 64.20 H new ATOM 0 HA3 GLY A 86 23.844 18.318 29.827 1.00 64.20 H new ATOM 1233 N PRO A 87 21.586 19.185 31.272 1.00 20.43 N ATOM 1234 CA PRO A 87 20.449 20.074 31.498 1.00 73.43 C ATOM 1235 C PRO A 87 20.573 21.341 30.652 1.00 33.24 C ATOM 1236 O PRO A 87 21.610 22.007 30.669 1.00 11.41 O ATOM 1237 CB PRO A 87 20.522 20.407 33.004 1.00 75.13 C ATOM 1238 CG PRO A 87 21.617 19.548 33.560 1.00 24.22 C ATOM 1239 CD PRO A 87 22.519 19.216 32.404 1.00 44.21 C ATOM 0 HA PRO A 87 19.500 19.617 31.218 1.00 73.43 H new ATOM 0 HB2 PRO A 87 20.737 21.464 33.161 1.00 75.13 H new ATOM 0 HB3 PRO A 87 19.573 20.198 33.497 1.00 75.13 H new ATOM 0 HG2 PRO A 87 22.165 20.074 34.342 1.00 24.22 H new ATOM 0 HG3 PRO A 87 21.211 18.642 34.009 1.00 24.22 H new ATOM 0 HD2 PRO A 87 23.297 19.967 32.268 1.00 44.21 H new ATOM 0 HD3 PRO A 87 23.021 18.258 32.543 1.00 44.21 H new ATOM 1247 N ASN A 88 19.525 21.659 29.902 1.00 50.13 N ATOM 1248 CA ASN A 88 19.530 22.837 29.035 1.00 62.23 C ATOM 1249 C ASN A 88 18.966 24.053 29.760 1.00 31.22 C ATOM 1250 O ASN A 88 18.392 23.938 30.845 1.00 11.01 O ATOM 1251 CB ASN A 88 18.731 22.581 27.746 1.00 63.43 C ATOM 1252 CG ASN A 88 17.278 22.192 27.993 1.00 21.32 C ATOM 1253 OD1 ASN A 88 16.691 22.536 29.018 1.00 63.22 O ATOM 1254 ND2 ASN A 88 16.681 21.496 27.041 1.00 22.41 N ATOM 0 H ASN A 88 18.660 21.120 29.875 1.00 50.13 H new ATOM 0 HA ASN A 88 20.567 23.039 28.767 1.00 62.23 H new ATOM 0 HB2 ASN A 88 18.758 23.479 27.128 1.00 63.43 H new ATOM 0 HB3 ASN A 88 19.219 21.789 27.178 1.00 63.43 H new ATOM 0 HD21 ASN A 88 15.702 21.227 27.143 1.00 22.41 H new ATOM 0 HD22 ASN A 88 17.199 21.228 26.204 1.00 22.41 H new ATOM 1261 N GLU A 89 19.109 25.216 29.133 1.00 43.32 N ATOM 1262 CA GLU A 89 18.628 26.476 29.693 1.00 2.23 C ATOM 1263 C GLU A 89 17.098 26.513 29.749 1.00 10.40 C ATOM 1264 O GLU A 89 16.513 27.364 30.421 1.00 74.31 O ATOM 1265 CB GLU A 89 19.177 27.648 28.869 1.00 13.04 C ATOM 1266 CG GLU A 89 18.864 27.559 27.379 1.00 64.14 C ATOM 1267 CD GLU A 89 19.630 28.590 26.565 1.00 35.31 C ATOM 1268 OE1 GLU A 89 20.637 28.223 25.922 1.00 70.11 O ATOM 1269 OE2 GLU A 89 19.243 29.773 26.580 1.00 74.23 O1- ATOM 0 H GLU A 89 19.561 25.313 28.224 1.00 43.32 H new ATOM 0 HA GLU A 89 18.989 26.563 30.718 1.00 2.23 H new ATOM 0 HB2 GLU A 89 18.766 28.578 29.261 1.00 13.04 H new ATOM 0 HB3 GLU A 89 20.258 27.696 29.000 1.00 13.04 H new ATOM 0 HG2 GLU A 89 19.108 26.560 27.018 1.00 64.14 H new ATOM 0 HG3 GLU A 89 17.794 27.701 27.226 1.00 64.14 H new ATOM 1276 N GLU A 90 16.458 25.581 29.045 1.00 62.24 N ATOM 1277 CA GLU A 90 14.999 25.456 29.071 1.00 33.11 C ATOM 1278 C GLU A 90 14.537 24.924 30.432 1.00 41.22 C ATOM 1279 O GLU A 90 13.421 25.207 30.878 1.00 23.51 O ATOM 1280 CB GLU A 90 14.523 24.529 27.938 1.00 62.35 C ATOM 1281 CG GLU A 90 13.027 24.227 27.966 1.00 2.12 C ATOM 1282 CD GLU A 90 12.580 23.332 26.819 1.00 32.41 C ATOM 1283 OE1 GLU A 90 11.804 23.803 25.954 1.00 34.55 O ATOM 1284 OE2 GLU A 90 13.001 22.161 26.773 1.00 15.02 O1- ATOM 0 H GLU A 90 16.927 24.899 28.448 1.00 62.24 H new ATOM 0 HA GLU A 90 14.559 26.442 28.918 1.00 33.11 H new ATOM 0 HB2 GLU A 90 14.773 24.986 26.980 1.00 62.35 H new ATOM 0 HB3 GLU A 90 15.073 23.590 27.996 1.00 62.35 H new ATOM 0 HG2 GLU A 90 12.776 23.748 28.912 1.00 2.12 H new ATOM 0 HG3 GLU A 90 12.472 25.164 27.926 1.00 2.12 H new ATOM 1291 N GLY A 91 15.418 24.180 31.096 1.00 4.53 N ATOM 1292 CA GLY A 91 15.108 23.615 32.403 1.00 50.31 C ATOM 1293 C GLY A 91 14.805 22.131 32.335 1.00 52.42 C ATOM 1294 O GLY A 91 14.186 21.573 33.243 1.00 50.31 O ATOM 0 H GLY A 91 16.351 23.956 30.750 1.00 4.53 H new ATOM 0 HA2 GLY A 91 15.949 23.781 33.076 1.00 50.31 H new ATOM 0 HA3 GLY A 91 14.252 24.139 32.828 1.00 50.31 H new ATOM 1298 N GLY A 92 15.244 21.494 31.255 1.00 31.10 N ATOM 1299 CA GLY A 92 15.067 20.059 31.090 1.00 44.24 C ATOM 1300 C GLY A 92 16.350 19.398 30.632 1.00 74.12 C ATOM 1301 O GLY A 92 17.439 19.907 30.901 1.00 42.22 O ATOM 0 H GLY A 92 15.726 21.951 30.481 1.00 31.10 H new ATOM 0 HA2 GLY A 92 14.745 19.619 32.034 1.00 44.24 H new ATOM 0 HA3 GLY A 92 14.277 19.869 30.363 1.00 44.24 H new ATOM 1305 N PHE A 93 16.231 18.279 29.925 1.00 65.13 N ATOM 1306 CA PHE A 93 17.400 17.573 29.409 1.00 72.25 C ATOM 1307 C PHE A 93 17.627 17.946 27.951 1.00 30.35 C ATOM 1308 O PHE A 93 16.695 18.358 27.257 1.00 35.35 O ATOM 1309 CB PHE A 93 17.223 16.053 29.518 1.00 70.53 C ATOM 1310 CG PHE A 93 16.985 15.555 30.920 1.00 33.33 C ATOM 1311 CD1 PHE A 93 15.881 14.766 31.208 1.00 41.34 C ATOM 1312 CD2 PHE A 93 17.873 15.861 31.943 1.00 64.21 C ATOM 1313 CE1 PHE A 93 15.664 14.291 32.485 1.00 2.11 C ATOM 1314 CE2 PHE A 93 17.658 15.390 33.226 1.00 3.04 C ATOM 1315 CZ PHE A 93 16.553 14.603 33.496 1.00 12.34 C ATOM 0 H PHE A 93 15.339 17.841 29.696 1.00 65.13 H new ATOM 0 HA PHE A 93 18.262 17.867 30.008 1.00 72.25 H new ATOM 0 HB2 PHE A 93 16.385 15.751 28.890 1.00 70.53 H new ATOM 0 HB3 PHE A 93 18.112 15.566 29.118 1.00 70.53 H new ATOM 0 HD1 PHE A 93 15.182 14.520 30.422 1.00 41.34 H new ATOM 0 HD2 PHE A 93 18.739 16.472 31.735 1.00 64.21 H new ATOM 0 HE1 PHE A 93 14.801 13.676 32.694 1.00 2.11 H new ATOM 0 HE2 PHE A 93 18.352 15.637 34.016 1.00 3.04 H new ATOM 0 HZ PHE A 93 16.385 14.233 34.496 1.00 12.34 H new ATOM 1325 N ALA A 94 18.861 17.796 27.489 1.00 73.43 N ATOM 1326 CA ALA A 94 19.195 18.099 26.108 1.00 60.33 C ATOM 1327 C ALA A 94 20.299 17.184 25.609 1.00 65.32 C ATOM 1328 O ALA A 94 21.270 16.908 26.331 1.00 32.10 O ATOM 1329 CB ALA A 94 19.611 19.557 25.964 1.00 64.21 C ATOM 0 H ALA A 94 19.645 17.466 28.052 1.00 73.43 H new ATOM 0 HA ALA A 94 18.306 17.931 25.500 1.00 60.33 H new ATOM 0 HB1 ALA A 94 19.857 19.764 24.923 1.00 64.21 H new ATOM 0 HB2 ALA A 94 18.791 20.202 26.278 1.00 64.21 H new ATOM 0 HB3 ALA A 94 20.484 19.750 26.588 1.00 64.21 H new ATOM 1335 N LEU A 95 20.118 16.696 24.383 1.00 31.23 N ATOM 1336 CA LEU A 95 21.112 15.878 23.704 1.00 75.45 C ATOM 1337 C LEU A 95 21.838 16.715 22.663 1.00 41.42 C ATOM 1338 O LEU A 95 21.232 17.188 21.699 1.00 2.34 O ATOM 1339 CB LEU A 95 20.457 14.651 23.042 1.00 51.22 C ATOM 1340 CG LEU A 95 20.242 13.430 23.957 1.00 42.15 C ATOM 1341 CD1 LEU A 95 21.581 12.815 24.363 1.00 64.34 C ATOM 1342 CD2 LEU A 95 19.432 13.812 25.193 1.00 71.23 C ATOM 0 H LEU A 95 19.274 16.859 23.834 1.00 31.23 H new ATOM 0 HA LEU A 95 21.830 15.518 24.441 1.00 75.45 H new ATOM 0 HB2 LEU A 95 19.491 14.953 22.637 1.00 51.22 H new ATOM 0 HB3 LEU A 95 21.075 14.344 22.198 1.00 51.22 H new ATOM 0 HG LEU A 95 19.678 12.685 23.396 1.00 42.15 H new ATOM 0 HD11 LEU A 95 21.405 11.955 25.009 1.00 64.34 H new ATOM 0 HD12 LEU A 95 22.120 12.495 23.471 1.00 64.34 H new ATOM 0 HD13 LEU A 95 22.174 13.556 24.899 1.00 64.34 H new ATOM 0 HD21 LEU A 95 19.294 12.933 25.823 1.00 71.23 H new ATOM 0 HD22 LEU A 95 19.964 14.580 25.754 1.00 71.23 H new ATOM 0 HD23 LEU A 95 18.459 14.195 24.886 1.00 71.23 H new ATOM 1354 N ASP A 96 23.127 16.901 22.883 1.00 51.32 N ATOM 1355 CA ASP A 96 23.985 17.666 21.983 1.00 15.24 C ATOM 1356 C ASP A 96 24.939 16.704 21.281 1.00 33.43 C ATOM 1357 O ASP A 96 25.817 16.115 21.918 1.00 1.11 O ATOM 1358 CB ASP A 96 24.766 18.717 22.787 1.00 62.10 C ATOM 1359 CG ASP A 96 25.345 19.847 21.936 1.00 42.14 C ATOM 1360 OD1 ASP A 96 26.261 20.553 22.424 1.00 0.44 O ATOM 1361 OD2 ASP A 96 24.883 20.061 20.794 1.00 11.32 O1- ATOM 0 H ASP A 96 23.616 16.525 23.695 1.00 51.32 H new ATOM 0 HA ASP A 96 23.384 18.184 21.235 1.00 15.24 H new ATOM 0 HB2 ASP A 96 24.107 19.146 23.542 1.00 62.10 H new ATOM 0 HB3 ASP A 96 25.579 18.223 23.318 1.00 62.10 H new ATOM 1366 N VAL A 97 24.739 16.514 19.981 1.00 3.45 N ATOM 1367 CA VAL A 97 25.441 15.472 19.235 1.00 33.41 C ATOM 1368 C VAL A 97 26.423 16.058 18.227 1.00 35.23 C ATOM 1369 O VAL A 97 26.015 16.632 17.225 1.00 5.33 O ATOM 1370 CB VAL A 97 24.434 14.573 18.471 1.00 12.11 C ATOM 1371 CG1 VAL A 97 25.155 13.448 17.724 1.00 31.40 C ATOM 1372 CG2 VAL A 97 23.372 14.019 19.422 1.00 41.42 C ATOM 0 H VAL A 97 24.094 17.070 19.419 1.00 3.45 H new ATOM 0 HA VAL A 97 25.993 14.883 19.967 1.00 33.41 H new ATOM 0 HB VAL A 97 23.928 15.188 17.727 1.00 12.11 H new ATOM 0 HG11 VAL A 97 24.424 12.834 17.198 1.00 31.40 H new ATOM 0 HG12 VAL A 97 25.853 13.877 17.005 1.00 31.40 H new ATOM 0 HG13 VAL A 97 25.702 12.830 18.436 1.00 31.40 H new ATOM 0 HG21 VAL A 97 22.676 13.391 18.865 1.00 41.42 H new ATOM 0 HG22 VAL A 97 23.854 13.426 20.199 1.00 41.42 H new ATOM 0 HG23 VAL A 97 22.828 14.845 19.881 1.00 41.42 H new ATOM 1382 N GLU A 98 27.711 15.889 18.482 1.00 23.12 N ATOM 1383 CA GLU A 98 28.741 16.275 17.527 1.00 44.32 C ATOM 1384 C GLU A 98 28.892 15.200 16.449 1.00 21.31 C ATOM 1385 O GLU A 98 29.346 14.091 16.730 1.00 34.12 O ATOM 1386 CB GLU A 98 30.098 16.499 18.225 1.00 13.10 C ATOM 1387 CG GLU A 98 30.221 17.820 18.985 1.00 35.31 C ATOM 1388 CD GLU A 98 29.351 17.890 20.230 1.00 11.53 C ATOM 1389 OE1 GLU A 98 29.728 17.285 21.258 1.00 51.52 O ATOM 1390 OE2 GLU A 98 28.315 18.580 20.203 1.00 21.24 O1- ATOM 0 H GLU A 98 28.071 15.485 19.347 1.00 23.12 H new ATOM 0 HA GLU A 98 28.431 17.213 17.067 1.00 44.32 H new ATOM 0 HB2 GLU A 98 30.272 15.679 18.921 1.00 13.10 H new ATOM 0 HB3 GLU A 98 30.888 16.453 17.475 1.00 13.10 H new ATOM 0 HG2 GLU A 98 31.262 17.969 19.271 1.00 35.31 H new ATOM 0 HG3 GLU A 98 29.953 18.639 18.318 1.00 35.31 H new ATOM 1397 N LEU A 99 28.495 15.523 15.221 1.00 4.53 N ATOM 1398 CA LEU A 99 28.720 14.629 14.087 1.00 32.31 C ATOM 1399 C LEU A 99 30.021 15.015 13.398 1.00 52.01 C ATOM 1400 O LEU A 99 30.101 16.046 12.725 1.00 21.43 O ATOM 1401 CB LEU A 99 27.549 14.678 13.092 1.00 42.25 C ATOM 1402 CG LEU A 99 26.239 14.027 13.571 1.00 64.41 C ATOM 1403 CD1 LEU A 99 25.160 14.127 12.492 1.00 73.33 C ATOM 1404 CD2 LEU A 99 26.471 12.568 13.967 1.00 23.33 C ATOM 0 H LEU A 99 28.018 16.393 14.985 1.00 4.53 H new ATOM 0 HA LEU A 99 28.789 13.606 14.456 1.00 32.31 H new ATOM 0 HB2 LEU A 99 27.347 15.721 12.848 1.00 42.25 H new ATOM 0 HB3 LEU A 99 27.860 14.189 12.169 1.00 42.25 H new ATOM 0 HG LEU A 99 25.894 14.568 14.452 1.00 64.41 H new ATOM 0 HD11 LEU A 99 24.242 13.661 12.851 1.00 73.33 H new ATOM 0 HD12 LEU A 99 24.969 15.176 12.264 1.00 73.33 H new ATOM 0 HD13 LEU A 99 25.498 13.616 11.591 1.00 73.33 H new ATOM 0 HD21 LEU A 99 25.532 12.128 14.302 1.00 23.33 H new ATOM 0 HD22 LEU A 99 26.845 12.013 13.107 1.00 23.33 H new ATOM 0 HD23 LEU A 99 27.202 12.522 14.774 1.00 23.33 H new ATOM 1416 N ARG A 100 31.035 14.182 13.591 1.00 15.15 N ATOM 1417 CA ARG A 100 32.386 14.451 13.108 1.00 11.05 C ATOM 1418 C ARG A 100 32.651 13.690 11.813 1.00 44.33 C ATOM 1419 O ARG A 100 32.809 12.469 11.824 1.00 60.34 O ATOM 1420 CB ARG A 100 33.382 14.049 14.203 1.00 62.13 C ATOM 1421 CG ARG A 100 34.856 14.236 13.857 1.00 11.51 C ATOM 1422 CD ARG A 100 35.720 13.890 15.062 1.00 61.51 C ATOM 1423 NE ARG A 100 37.152 13.846 14.761 1.00 42.53 N ATOM 1424 CZ ARG A 100 38.049 13.207 15.519 1.00 32.53 C ATOM 1425 NH1 ARG A 100 37.669 12.568 16.623 1.00 73.43 N1+ ATOM 1426 NH2 ARG A 100 39.329 13.214 15.174 1.00 1.52 N ATOM 0 H ARG A 100 30.945 13.296 14.089 1.00 15.15 H new ATOM 0 HA ARG A 100 32.501 15.512 12.888 1.00 11.05 H new ATOM 0 HB2 ARG A 100 33.162 14.629 15.099 1.00 62.13 H new ATOM 0 HB3 ARG A 100 33.216 13.001 14.452 1.00 62.13 H new ATOM 0 HG2 ARG A 100 35.124 13.601 13.013 1.00 11.51 H new ATOM 0 HG3 ARG A 100 35.039 15.266 13.551 1.00 11.51 H new ATOM 0 HD2 ARG A 100 35.544 14.625 15.848 1.00 61.51 H new ATOM 0 HD3 ARG A 100 35.410 12.922 15.456 1.00 61.51 H new ATOM 0 HE ARG A 100 37.484 14.330 13.927 1.00 42.53 H new ATOM 0 HH11 ARG A 100 36.686 12.563 16.897 1.00 73.43 H new ATOM 0 HH12 ARG A 100 38.360 12.083 17.195 1.00 73.43 H new ATOM 0 HH21 ARG A 100 39.628 13.706 14.332 1.00 1.52 H new ATOM 0 HH22 ARG A 100 40.015 12.727 15.751 1.00 1.52 H new ATOM 1440 N VAL A 101 32.696 14.414 10.699 1.00 42.14 N ATOM 1441 CA VAL A 101 32.810 13.787 9.384 1.00 72.23 C ATOM 1442 C VAL A 101 34.234 13.906 8.852 1.00 42.25 C ATOM 1443 O VAL A 101 34.636 14.969 8.380 1.00 41.22 O ATOM 1444 CB VAL A 101 31.833 14.434 8.372 1.00 14.41 C ATOM 1445 CG1 VAL A 101 31.905 13.731 7.015 1.00 25.41 C ATOM 1446 CG2 VAL A 101 30.404 14.424 8.921 1.00 42.30 C ATOM 0 H VAL A 101 32.655 15.433 10.679 1.00 42.14 H new ATOM 0 HA VAL A 101 32.554 12.734 9.501 1.00 72.23 H new ATOM 0 HB VAL A 101 32.133 15.472 8.225 1.00 14.41 H new ATOM 0 HG11 VAL A 101 31.209 14.205 6.322 1.00 25.41 H new ATOM 0 HG12 VAL A 101 32.918 13.806 6.620 1.00 25.41 H new ATOM 0 HG13 VAL A 101 31.639 12.681 7.135 1.00 25.41 H new ATOM 0 HG21 VAL A 101 29.732 14.883 8.196 1.00 42.30 H new ATOM 0 HG22 VAL A 101 30.092 13.396 9.105 1.00 42.30 H new ATOM 0 HG23 VAL A 101 30.369 14.986 9.854 1.00 42.30 H new ATOM 1456 N ALA A 102 35.000 12.826 8.941 1.00 43.12 N ATOM 1457 CA ALA A 102 36.366 12.823 8.439 1.00 40.03 C ATOM 1458 C ALA A 102 36.424 12.162 7.069 1.00 12.52 C ATOM 1459 O ALA A 102 36.416 10.935 6.960 1.00 73.10 O ATOM 1460 CB ALA A 102 37.292 12.110 9.421 1.00 44.05 C ATOM 0 H ALA A 102 34.699 11.944 9.355 1.00 43.12 H new ATOM 0 HA ALA A 102 36.703 13.855 8.338 1.00 40.03 H new ATOM 0 HB1 ALA A 102 38.310 12.116 9.031 1.00 44.05 H new ATOM 0 HB2 ALA A 102 37.268 12.624 10.382 1.00 44.05 H new ATOM 0 HB3 ALA A 102 36.960 11.080 9.552 1.00 44.05 H new ATOM 1466 N LEU A 103 36.493 12.980 6.026 1.00 73.31 N ATOM 1467 CA LEU A 103 36.567 12.487 4.654 1.00 63.24 C ATOM 1468 C LEU A 103 37.924 12.869 4.063 1.00 11.33 C ATOM 1469 O LEU A 103 38.241 14.054 3.955 1.00 24.41 O ATOM 1470 CB LEU A 103 35.414 13.066 3.808 1.00 41.13 C ATOM 1471 CG LEU A 103 35.264 12.479 2.386 1.00 32.24 C ATOM 1472 CD1 LEU A 103 34.962 10.985 2.438 1.00 55.32 C ATOM 1473 CD2 LEU A 103 34.171 13.208 1.604 1.00 41.41 C ATOM 0 H LEU A 103 36.499 13.997 6.105 1.00 73.31 H new ATOM 0 HA LEU A 103 36.466 11.402 4.648 1.00 63.24 H new ATOM 0 HB2 LEU A 103 34.479 12.909 4.346 1.00 41.13 H new ATOM 0 HB3 LEU A 103 35.556 14.143 3.723 1.00 41.13 H new ATOM 0 HG LEU A 103 36.214 12.622 1.871 1.00 32.24 H new ATOM 0 HD11 LEU A 103 34.862 10.599 1.424 1.00 55.32 H new ATOM 0 HD12 LEU A 103 35.776 10.467 2.945 1.00 55.32 H new ATOM 0 HD13 LEU A 103 34.032 10.820 2.983 1.00 55.32 H new ATOM 0 HD21 LEU A 103 34.086 12.775 0.607 1.00 41.41 H new ATOM 0 HD22 LEU A 103 33.220 13.105 2.126 1.00 41.41 H new ATOM 0 HD23 LEU A 103 34.426 14.264 1.520 1.00 41.41 H new ATOM 1485 N PRO A 104 38.753 11.875 3.695 1.00 73.52 N ATOM 1486 CA PRO A 104 40.105 12.129 3.202 1.00 62.42 C ATOM 1487 C PRO A 104 40.107 12.695 1.788 1.00 45.15 C ATOM 1488 O PRO A 104 39.228 12.388 0.980 1.00 0.45 O ATOM 1489 CB PRO A 104 40.766 10.751 3.244 1.00 24.31 C ATOM 1490 CG PRO A 104 39.650 9.775 3.115 1.00 63.40 C ATOM 1491 CD PRO A 104 38.431 10.437 3.708 1.00 45.41 C ATOM 0 HA PRO A 104 40.627 12.876 3.800 1.00 62.42 H new ATOM 0 HB2 PRO A 104 41.485 10.635 2.433 1.00 24.31 H new ATOM 0 HB3 PRO A 104 41.311 10.604 4.177 1.00 24.31 H new ATOM 0 HG2 PRO A 104 39.481 9.515 2.070 1.00 63.40 H new ATOM 0 HG3 PRO A 104 39.882 8.848 3.640 1.00 63.40 H new ATOM 0 HD2 PRO A 104 37.538 10.224 3.121 1.00 45.41 H new ATOM 0 HD3 PRO A 104 38.239 10.082 4.720 1.00 45.41 H new ATOM 1499 N GLY A 105 41.103 13.522 1.502 1.00 54.45 N ATOM 1500 CA GLY A 105 41.193 14.163 0.204 1.00 13.33 C ATOM 1501 C GLY A 105 40.178 15.281 0.047 1.00 43.42 C ATOM 1502 O GLY A 105 39.919 15.747 -1.068 1.00 1.41 O ATOM 0 H GLY A 105 41.854 13.762 2.149 1.00 54.45 H new ATOM 0 HA2 GLY A 105 42.197 14.564 0.067 1.00 13.33 H new ATOM 0 HA3 GLY A 105 41.037 13.420 -0.578 1.00 13.33 H new ATOM 1506 N LEU A 106 39.603 15.707 1.170 1.00 4.51 N ATOM 1507 CA LEU A 106 38.561 16.729 1.187 1.00 40.14 C ATOM 1508 C LEU A 106 38.951 17.884 2.113 1.00 43.11 C ATOM 1509 O LEU A 106 39.515 17.667 3.191 1.00 42.33 O ATOM 1510 CB LEU A 106 37.226 16.107 1.637 1.00 65.03 C ATOM 1511 CG LEU A 106 36.112 17.109 1.989 1.00 43.51 C ATOM 1512 CD1 LEU A 106 35.708 17.933 0.774 1.00 44.14 C ATOM 1513 CD2 LEU A 106 34.900 16.396 2.577 1.00 41.21 C ATOM 0 H LEU A 106 39.848 15.352 2.094 1.00 4.51 H new ATOM 0 HA LEU A 106 38.445 17.127 0.179 1.00 40.14 H new ATOM 0 HB2 LEU A 106 36.865 15.453 0.844 1.00 65.03 H new ATOM 0 HB3 LEU A 106 37.413 15.479 2.508 1.00 65.03 H new ATOM 0 HG LEU A 106 36.508 17.789 2.743 1.00 43.51 H new ATOM 0 HD11 LEU A 106 34.920 18.632 1.054 1.00 44.14 H new ATOM 0 HD12 LEU A 106 36.571 18.488 0.407 1.00 44.14 H new ATOM 0 HD13 LEU A 106 35.343 17.270 -0.010 1.00 44.14 H new ATOM 0 HD21 LEU A 106 34.128 17.128 2.817 1.00 41.21 H new ATOM 0 HD22 LEU A 106 34.510 15.682 1.851 1.00 41.21 H new ATOM 0 HD23 LEU A 106 35.193 15.868 3.484 1.00 41.21 H new ATOM 1525 N ASP A 107 38.651 19.109 1.678 1.00 72.42 N ATOM 1526 CA ASP A 107 38.930 20.309 2.470 1.00 14.02 C ATOM 1527 C ASP A 107 37.929 20.449 3.595 1.00 1.12 C ATOM 1528 O ASP A 107 36.851 19.865 3.555 1.00 10.24 O ATOM 1529 CB ASP A 107 38.824 21.581 1.626 1.00 13.35 C ATOM 1530 CG ASP A 107 39.791 22.667 2.072 1.00 12.43 C ATOM 1531 OD1 ASP A 107 40.760 22.950 1.341 1.00 14.01 O ATOM 1532 OD2 ASP A 107 39.574 23.249 3.157 1.00 2.52 O1- ATOM 0 H ASP A 107 38.212 19.297 0.777 1.00 72.42 H new ATOM 0 HA ASP A 107 39.944 20.194 2.853 1.00 14.02 H new ATOM 0 HB2 ASP A 107 39.017 21.336 0.582 1.00 13.35 H new ATOM 0 HB3 ASP A 107 37.805 21.964 1.680 1.00 13.35 H new ATOM 1537 N ALA A 108 38.275 21.277 4.558 1.00 41.30 N ATOM 1538 CA ALA A 108 37.351 21.695 5.594 1.00 54.32 C ATOM 1539 C ALA A 108 36.272 22.590 4.996 1.00 74.35 C ATOM 1540 O ALA A 108 35.083 22.423 5.270 1.00 33.14 O ATOM 1541 CB ALA A 108 38.117 22.447 6.662 1.00 73.33 C ATOM 0 H ALA A 108 39.207 21.681 4.646 1.00 41.30 H new ATOM 0 HA ALA A 108 36.873 20.821 6.035 1.00 54.32 H new ATOM 0 HB1 ALA A 108 37.430 22.766 7.446 1.00 73.33 H new ATOM 0 HB2 ALA A 108 38.879 21.796 7.090 1.00 73.33 H new ATOM 0 HB3 ALA A 108 38.594 23.322 6.220 1.00 73.33 H new ATOM 1547 N ALA A 109 36.709 23.531 4.159 1.00 23.13 N ATOM 1548 CA ALA A 109 35.815 24.511 3.551 1.00 64.13 C ATOM 1549 C ALA A 109 34.765 23.821 2.683 1.00 31.24 C ATOM 1550 O ALA A 109 33.580 24.156 2.734 1.00 41.21 O ATOM 1551 CB ALA A 109 36.615 25.519 2.732 1.00 33.23 C ATOM 0 H ALA A 109 37.686 23.634 3.886 1.00 23.13 H new ATOM 0 HA ALA A 109 35.296 25.045 4.347 1.00 64.13 H new ATOM 0 HB1 ALA A 109 35.936 26.244 2.284 1.00 33.23 H new ATOM 0 HB2 ALA A 109 37.322 26.036 3.381 1.00 33.23 H new ATOM 0 HB3 ALA A 109 37.160 24.998 1.945 1.00 33.23 H new ATOM 1557 N ALA A 110 35.212 22.858 1.885 1.00 73.25 N ATOM 1558 CA ALA A 110 34.319 22.092 1.025 1.00 12.34 C ATOM 1559 C ALA A 110 33.483 21.124 1.858 1.00 44.05 C ATOM 1560 O ALA A 110 32.273 20.981 1.643 1.00 34.04 O ATOM 1561 CB ALA A 110 35.118 21.343 -0.038 1.00 53.00 C ATOM 0 H ALA A 110 36.193 22.588 1.816 1.00 73.25 H new ATOM 0 HA ALA A 110 33.642 22.781 0.520 1.00 12.34 H new ATOM 0 HB1 ALA A 110 34.437 20.776 -0.672 1.00 53.00 H new ATOM 0 HB2 ALA A 110 35.672 22.057 -0.648 1.00 53.00 H new ATOM 0 HB3 ALA A 110 35.817 20.660 0.446 1.00 53.00 H new ATOM 1567 N ALA A 111 34.131 20.478 2.827 1.00 5.14 N ATOM 1568 CA ALA A 111 33.441 19.548 3.724 1.00 43.54 C ATOM 1569 C ALA A 111 32.252 20.223 4.395 1.00 4.44 C ATOM 1570 O ALA A 111 31.199 19.611 4.561 1.00 54.13 O ATOM 1571 CB ALA A 111 34.394 19.004 4.779 1.00 13.31 C ATOM 0 H ALA A 111 35.129 20.580 3.012 1.00 5.14 H new ATOM 0 HA ALA A 111 33.076 18.716 3.122 1.00 43.54 H new ATOM 0 HB1 ALA A 111 33.858 18.316 5.433 1.00 13.31 H new ATOM 0 HB2 ALA A 111 35.214 18.477 4.291 1.00 13.31 H new ATOM 0 HB3 ALA A 111 34.793 19.829 5.369 1.00 13.31 H new ATOM 1577 N LYS A 112 32.426 21.489 4.767 1.00 1.14 N ATOM 1578 CA LYS A 112 31.354 22.270 5.380 1.00 13.13 C ATOM 1579 C LYS A 112 30.080 22.217 4.539 1.00 74.23 C ATOM 1580 O LYS A 112 28.988 22.015 5.069 1.00 4.50 O ATOM 1581 CB LYS A 112 31.786 23.728 5.574 1.00 13.05 C ATOM 1582 CG LYS A 112 32.774 23.930 6.717 1.00 32.13 C ATOM 1583 CD LYS A 112 33.250 25.378 6.830 1.00 10.41 C ATOM 1584 CE LYS A 112 32.120 26.358 7.164 1.00 22.11 C ATOM 1585 NZ LYS A 112 31.226 26.629 6.003 1.00 2.23 N1+ ATOM 0 H LYS A 112 33.303 21.998 4.654 1.00 1.14 H new ATOM 0 HA LYS A 112 31.144 21.829 6.354 1.00 13.13 H new ATOM 0 HB2 LYS A 112 32.235 24.090 4.649 1.00 13.05 H new ATOM 0 HB3 LYS A 112 30.902 24.338 5.759 1.00 13.05 H new ATOM 0 HG2 LYS A 112 32.306 23.631 7.655 1.00 32.13 H new ATOM 0 HG3 LYS A 112 33.635 23.278 6.568 1.00 32.13 H new ATOM 0 HD2 LYS A 112 34.018 25.443 7.600 1.00 10.41 H new ATOM 0 HD3 LYS A 112 33.715 25.676 5.890 1.00 10.41 H new ATOM 0 HE2 LYS A 112 31.528 25.956 7.986 1.00 22.11 H new ATOM 0 HE3 LYS A 112 32.551 27.297 7.511 1.00 22.11 H new ATOM 0 HZ1 LYS A 112 31.084 27.655 5.906 1.00 2.23 H new ATOM 0 HZ2 LYS A 112 31.661 26.256 5.135 1.00 2.23 H new ATOM 0 HZ3 LYS A 112 30.308 26.166 6.156 1.00 2.23 H new ATOM 1599 N THR A 113 30.223 22.386 3.226 1.00 31.43 N ATOM 1600 CA THR A 113 29.065 22.426 2.346 1.00 60.21 C ATOM 1601 C THR A 113 28.548 21.011 2.075 1.00 74.22 C ATOM 1602 O THR A 113 27.339 20.788 2.002 1.00 73.22 O ATOM 1603 CB THR A 113 29.368 23.151 1.004 1.00 31.33 C ATOM 1604 OG1 THR A 113 28.167 23.743 0.487 1.00 10.35 O ATOM 1605 CG2 THR A 113 29.939 22.201 -0.044 1.00 32.43 C ATOM 0 H THR A 113 31.121 22.496 2.755 1.00 31.43 H new ATOM 0 HA THR A 113 28.294 23.000 2.860 1.00 60.21 H new ATOM 0 HB THR A 113 30.113 23.918 1.213 1.00 31.33 H new ATOM 0 HG1 THR A 113 28.365 24.200 -0.357 1.00 10.35 H new ATOM 0 HG21 THR A 113 30.135 22.750 -0.965 1.00 32.43 H new ATOM 0 HG22 THR A 113 30.869 21.768 0.325 1.00 32.43 H new ATOM 0 HG23 THR A 113 29.222 21.405 -0.243 1.00 32.43 H new ATOM 1613 N LEU A 114 29.471 20.055 1.946 1.00 23.12 N ATOM 1614 CA LEU A 114 29.097 18.673 1.661 1.00 20.51 C ATOM 1615 C LEU A 114 28.284 18.089 2.813 1.00 41.04 C ATOM 1616 O LEU A 114 27.223 17.498 2.599 1.00 13.34 O ATOM 1617 CB LEU A 114 30.340 17.816 1.385 1.00 61.01 C ATOM 1618 CG LEU A 114 31.201 18.274 0.194 1.00 11.45 C ATOM 1619 CD1 LEU A 114 32.309 17.265 -0.096 1.00 1.51 C ATOM 1620 CD2 LEU A 114 30.338 18.510 -1.047 1.00 50.51 C ATOM 0 H LEU A 114 30.475 20.213 2.034 1.00 23.12 H new ATOM 0 HA LEU A 114 28.476 18.666 0.765 1.00 20.51 H new ATOM 0 HB2 LEU A 114 30.962 17.808 2.280 1.00 61.01 H new ATOM 0 HB3 LEU A 114 30.021 16.789 1.209 1.00 61.01 H new ATOM 0 HG LEU A 114 31.669 19.221 0.462 1.00 11.45 H new ATOM 0 HD11 LEU A 114 32.904 17.611 -0.942 1.00 1.51 H new ATOM 0 HD12 LEU A 114 32.949 17.165 0.781 1.00 1.51 H new ATOM 0 HD13 LEU A 114 31.867 16.298 -0.335 1.00 1.51 H new ATOM 0 HD21 LEU A 114 30.970 18.833 -1.874 1.00 50.51 H new ATOM 0 HD22 LEU A 114 29.830 17.585 -1.318 1.00 50.51 H new ATOM 0 HD23 LEU A 114 29.598 19.281 -0.834 1.00 50.51 H new ATOM 1632 N VAL A 115 28.773 18.278 4.034 1.00 72.22 N ATOM 1633 CA VAL A 115 28.070 17.812 5.225 1.00 32.34 C ATOM 1634 C VAL A 115 26.740 18.548 5.371 1.00 1.13 C ATOM 1635 O VAL A 115 25.739 17.959 5.775 1.00 25.22 O ATOM 1636 CB VAL A 115 28.919 18.007 6.508 1.00 63.01 C ATOM 1637 CG1 VAL A 115 28.151 17.558 7.751 1.00 14.41 C ATOM 1638 CG2 VAL A 115 30.244 17.255 6.392 1.00 35.24 C ATOM 0 H VAL A 115 29.656 18.752 4.226 1.00 72.22 H new ATOM 0 HA VAL A 115 27.888 16.744 5.102 1.00 32.34 H new ATOM 0 HB VAL A 115 29.132 19.071 6.613 1.00 63.01 H new ATOM 0 HG11 VAL A 115 28.771 17.706 8.635 1.00 14.41 H new ATOM 0 HG12 VAL A 115 27.237 18.145 7.846 1.00 14.41 H new ATOM 0 HG13 VAL A 115 27.896 16.502 7.660 1.00 14.41 H new ATOM 0 HG21 VAL A 115 30.827 17.403 7.301 1.00 35.24 H new ATOM 0 HG22 VAL A 115 30.048 16.191 6.256 1.00 35.24 H new ATOM 0 HG23 VAL A 115 30.803 17.633 5.537 1.00 35.24 H new ATOM 1648 N ASP A 116 26.735 19.832 5.018 1.00 34.11 N ATOM 1649 CA ASP A 116 25.528 20.656 5.100 1.00 22.44 C ATOM 1650 C ASP A 116 24.405 20.054 4.262 1.00 4.20 C ATOM 1651 O ASP A 116 23.333 19.726 4.777 1.00 63.50 O ATOM 1652 CB ASP A 116 25.812 22.087 4.620 1.00 1.42 C ATOM 1653 CG ASP A 116 24.597 22.996 4.740 1.00 43.12 C ATOM 1654 OD1 ASP A 116 23.820 23.105 3.767 1.00 62.34 O ATOM 1655 OD2 ASP A 116 24.406 23.606 5.813 1.00 50.12 O1- ATOM 0 H ASP A 116 27.556 20.327 4.671 1.00 34.11 H new ATOM 0 HA ASP A 116 25.217 20.686 6.144 1.00 22.44 H new ATOM 0 HB2 ASP A 116 26.633 22.505 5.202 1.00 1.42 H new ATOM 0 HB3 ASP A 116 26.140 22.060 3.581 1.00 1.42 H new ATOM 1660 N ARG A 117 24.670 19.892 2.966 1.00 43.12 N ATOM 1661 CA ARG A 117 23.672 19.384 2.033 1.00 25.23 C ATOM 1662 C ARG A 117 23.299 17.939 2.370 1.00 51.42 C ATOM 1663 O ARG A 117 22.123 17.561 2.333 1.00 42.42 O ATOM 1664 CB ARG A 117 24.197 19.496 0.598 1.00 4.30 C ATOM 1665 CG ARG A 117 25.561 18.850 0.395 1.00 3.24 C ATOM 1666 CD ARG A 117 26.132 19.137 -0.984 1.00 12.41 C ATOM 1667 NE ARG A 117 25.336 18.509 -2.043 1.00 15.40 N ATOM 1668 CZ ARG A 117 25.819 18.117 -3.226 1.00 54.12 C ATOM 1669 NH1 ARG A 117 27.101 18.296 -3.520 1.00 44.31 N1+ ATOM 1670 NH2 ARG A 117 25.012 17.557 -4.119 1.00 65.24 N ATOM 0 H ARG A 117 25.571 20.107 2.540 1.00 43.12 H new ATOM 0 HA ARG A 117 22.768 19.987 2.121 1.00 25.23 H new ATOM 0 HB2 ARG A 117 23.480 19.032 -0.079 1.00 4.30 H new ATOM 0 HB3 ARG A 117 24.259 20.549 0.324 1.00 4.30 H new ATOM 0 HG2 ARG A 117 26.251 19.215 1.155 1.00 3.24 H new ATOM 0 HG3 ARG A 117 25.475 17.772 0.534 1.00 3.24 H new ATOM 0 HD2 ARG A 117 26.167 20.214 -1.146 1.00 12.41 H new ATOM 0 HD3 ARG A 117 27.158 18.773 -1.036 1.00 12.41 H new ATOM 0 HE ARG A 117 24.343 18.361 -1.864 1.00 15.40 H new ATOM 0 HH11 ARG A 117 27.723 18.735 -2.841 1.00 44.31 H new ATOM 0 HH12 ARG A 117 27.464 17.995 -4.424 1.00 44.31 H new ATOM 0 HH21 ARG A 117 24.024 17.426 -3.902 1.00 65.24 H new ATOM 0 HH22 ARG A 117 25.380 17.258 -5.022 1.00 65.24 H new ATOM 1684 N ALA A 118 24.305 17.143 2.723 1.00 40.10 N ATOM 1685 CA ALA A 118 24.089 15.755 3.124 1.00 45.33 C ATOM 1686 C ALA A 118 23.201 15.694 4.368 1.00 63.41 C ATOM 1687 O ALA A 118 22.355 14.807 4.506 1.00 0.11 O ATOM 1688 CB ALA A 118 25.423 15.061 3.378 1.00 44.02 C ATOM 0 H ALA A 118 25.282 17.437 2.740 1.00 40.10 H new ATOM 0 HA ALA A 118 23.581 15.232 2.314 1.00 45.33 H new ATOM 0 HB1 ALA A 118 25.245 14.028 3.676 1.00 44.02 H new ATOM 0 HB2 ALA A 118 26.021 15.078 2.467 1.00 44.02 H new ATOM 0 HB3 ALA A 118 25.958 15.581 4.173 1.00 44.02 H new ATOM 1694 N HIS A 119 23.382 16.670 5.255 1.00 52.13 N ATOM 1695 CA HIS A 119 22.599 16.768 6.485 1.00 15.33 C ATOM 1696 C HIS A 119 21.231 17.398 6.203 1.00 0.40 C ATOM 1697 O HIS A 119 20.490 17.751 7.122 1.00 63.33 O ATOM 1698 CB HIS A 119 23.367 17.594 7.529 1.00 54.45 C ATOM 1699 CG HIS A 119 22.783 17.543 8.909 1.00 21.21 C ATOM 1700 ND1 HIS A 119 22.066 18.579 9.465 1.00 2.34 N ATOM 1701 CD2 HIS A 119 22.836 16.577 9.856 1.00 20.34 C ATOM 1702 CE1 HIS A 119 21.705 18.254 10.691 1.00 52.23 C ATOM 1703 NE2 HIS A 119 22.158 17.044 10.952 1.00 74.13 N ATOM 0 H HIS A 119 24.072 17.412 5.142 1.00 52.13 H new ATOM 0 HA HIS A 119 22.437 15.765 6.879 1.00 15.33 H new ATOM 0 HB2 HIS A 119 24.397 17.239 7.570 1.00 54.45 H new ATOM 0 HB3 HIS A 119 23.401 18.633 7.200 1.00 54.45 H new ATOM 0 HD1 HIS A 119 21.848 19.461 9.001 1.00 2.34 H new ATOM 0 HD2 HIS A 119 23.322 15.617 9.765 1.00 20.34 H new ATOM 0 HE1 HIS A 119 21.135 18.874 11.367 1.00 52.23 H new ATOM 1712 N HIS A 120 20.924 17.584 4.921 1.00 43.52 N ATOM 1713 CA HIS A 120 19.590 18.001 4.492 1.00 31.45 C ATOM 1714 C HIS A 120 18.870 16.848 3.796 1.00 61.14 C ATOM 1715 O HIS A 120 17.714 16.557 4.095 1.00 43.11 O ATOM 1716 CB HIS A 120 19.660 19.210 3.547 1.00 2.24 C ATOM 1717 CG HIS A 120 20.236 20.448 4.170 1.00 45.12 C ATOM 1718 ND1 HIS A 120 20.039 20.795 5.490 1.00 44.32 N ATOM 1719 CD2 HIS A 120 21.011 21.423 3.641 1.00 50.50 C ATOM 1720 CE1 HIS A 120 20.669 21.929 5.743 1.00 65.24 C ATOM 1721 NE2 HIS A 120 21.266 22.329 4.638 1.00 75.14 N ATOM 0 H HIS A 120 21.586 17.452 4.156 1.00 43.52 H new ATOM 0 HA HIS A 120 19.033 18.291 5.383 1.00 31.45 H new ATOM 0 HB2 HIS A 120 20.260 18.942 2.677 1.00 2.24 H new ATOM 0 HB3 HIS A 120 18.656 19.433 3.186 1.00 2.24 H new ATOM 0 HD2 HIS A 120 21.364 21.477 2.622 1.00 50.50 H new ATOM 0 HE1 HIS A 120 20.691 22.441 6.694 1.00 65.24 H new ATOM 0 HE2 HIS A 120 21.827 23.175 4.540 1.00 75.14 H new ATOM 1730 N VAL A 121 19.574 16.194 2.868 1.00 33.11 N ATOM 1731 CA VAL A 121 18.973 15.159 2.019 1.00 23.21 C ATOM 1732 C VAL A 121 18.581 13.903 2.808 1.00 3.02 C ATOM 1733 O VAL A 121 17.584 13.249 2.486 1.00 30.52 O ATOM 1734 CB VAL A 121 19.916 14.762 0.853 1.00 61.42 C ATOM 1735 CG1 VAL A 121 20.210 15.970 -0.035 1.00 74.54 C ATOM 1736 CG2 VAL A 121 21.215 14.143 1.374 1.00 44.31 C ATOM 0 H VAL A 121 20.563 16.363 2.685 1.00 33.11 H new ATOM 0 HA VAL A 121 18.063 15.600 1.612 1.00 23.21 H new ATOM 0 HB VAL A 121 19.407 14.008 0.253 1.00 61.42 H new ATOM 0 HG11 VAL A 121 20.873 15.672 -0.847 1.00 74.54 H new ATOM 0 HG12 VAL A 121 19.277 16.352 -0.450 1.00 74.54 H new ATOM 0 HG13 VAL A 121 20.690 16.749 0.558 1.00 74.54 H new ATOM 0 HG21 VAL A 121 21.854 13.876 0.532 1.00 44.31 H new ATOM 0 HG22 VAL A 121 21.732 14.863 2.008 1.00 44.31 H new ATOM 0 HG23 VAL A 121 20.985 13.249 1.953 1.00 44.31 H new ATOM 1746 N CYS A 122 19.367 13.557 3.825 1.00 31.44 N ATOM 1747 CA CYS A 122 19.079 12.380 4.646 1.00 53.14 C ATOM 1748 C CYS A 122 17.805 12.604 5.473 1.00 23.34 C ATOM 1749 O CYS A 122 17.686 13.616 6.160 1.00 24.32 O ATOM 1750 CB CYS A 122 20.271 12.069 5.558 1.00 50.43 C ATOM 1751 SG CYS A 122 21.810 11.748 4.666 1.00 72.12 S ATOM 0 H CYS A 122 20.204 14.071 4.100 1.00 31.44 H new ATOM 0 HA CYS A 122 18.913 11.525 3.991 1.00 53.14 H new ATOM 0 HB2 CYS A 122 20.424 12.907 6.238 1.00 50.43 H new ATOM 0 HB3 CYS A 122 20.030 11.201 6.171 1.00 50.43 H new ATOM 0 HG CYS A 122 22.404 12.875 4.405 1.00 72.12 H new ATOM 1757 N PRO A 123 16.842 11.656 5.428 1.00 50.40 N ATOM 1758 CA PRO A 123 15.535 11.814 6.091 1.00 60.03 C ATOM 1759 C PRO A 123 15.655 12.037 7.603 1.00 74.45 C ATOM 1760 O PRO A 123 14.925 12.843 8.183 1.00 30.15 O ATOM 1761 CB PRO A 123 14.806 10.491 5.784 1.00 24.23 C ATOM 1762 CG PRO A 123 15.884 9.534 5.392 1.00 34.14 C ATOM 1763 CD PRO A 123 16.943 10.364 4.723 1.00 45.03 C ATOM 0 HA PRO A 123 15.006 12.695 5.728 1.00 60.03 H new ATOM 0 HB2 PRO A 123 14.258 10.132 6.655 1.00 24.23 H new ATOM 0 HB3 PRO A 123 14.080 10.618 4.981 1.00 24.23 H new ATOM 0 HG2 PRO A 123 16.285 9.017 6.264 1.00 34.14 H new ATOM 0 HG3 PRO A 123 15.501 8.769 4.716 1.00 34.14 H new ATOM 0 HD2 PRO A 123 17.933 9.921 4.832 1.00 45.03 H new ATOM 0 HD3 PRO A 123 16.757 10.471 3.654 1.00 45.03 H new ATOM 1771 N TYR A 124 16.598 11.337 8.232 1.00 53.44 N ATOM 1772 CA TYR A 124 16.791 11.426 9.684 1.00 1.24 C ATOM 1773 C TYR A 124 17.229 12.836 10.094 1.00 42.34 C ATOM 1774 O TYR A 124 17.112 13.218 11.258 1.00 23.13 O ATOM 1775 CB TYR A 124 17.849 10.415 10.159 1.00 65.44 C ATOM 1776 CG TYR A 124 17.512 8.954 9.880 1.00 10.42 C ATOM 1777 CD1 TYR A 124 17.129 8.090 10.909 1.00 42.12 C ATOM 1778 CD2 TYR A 124 17.586 8.436 8.590 1.00 13.25 C ATOM 1779 CE1 TYR A 124 16.834 6.766 10.655 1.00 14.31 C ATOM 1780 CE2 TYR A 124 17.289 7.111 8.333 1.00 12.12 C ATOM 1781 CZ TYR A 124 16.914 6.280 9.367 1.00 5.42 C ATOM 1782 OH TYR A 124 16.621 4.960 9.113 1.00 60.35 O ATOM 0 H TYR A 124 17.242 10.701 7.761 1.00 53.44 H new ATOM 0 HA TYR A 124 15.834 11.196 10.153 1.00 1.24 H new ATOM 0 HB2 TYR A 124 18.798 10.652 9.679 1.00 65.44 H new ATOM 0 HB3 TYR A 124 17.995 10.541 11.232 1.00 65.44 H new ATOM 0 HD1 TYR A 124 17.063 8.464 11.920 1.00 42.12 H new ATOM 0 HD2 TYR A 124 17.881 9.081 7.776 1.00 13.25 H new ATOM 0 HE1 TYR A 124 16.541 6.112 11.463 1.00 14.31 H new ATOM 0 HE2 TYR A 124 17.351 6.728 7.325 1.00 12.12 H new ATOM 0 HH TYR A 124 16.725 4.780 8.155 1.00 60.35 H new ATOM 1792 N SER A 125 17.723 13.601 9.124 1.00 23.21 N ATOM 1793 CA SER A 125 18.319 14.903 9.391 1.00 62.44 C ATOM 1794 C SER A 125 17.311 15.894 9.975 1.00 2.13 C ATOM 1795 O SER A 125 17.658 16.693 10.847 1.00 5.11 O ATOM 1796 CB SER A 125 18.923 15.471 8.110 1.00 61.32 C ATOM 1797 OG SER A 125 19.822 14.547 7.522 1.00 44.54 O ATOM 0 H SER A 125 17.721 13.337 8.139 1.00 23.21 H new ATOM 0 HA SER A 125 19.101 14.756 10.136 1.00 62.44 H new ATOM 0 HB2 SER A 125 18.128 15.711 7.404 1.00 61.32 H new ATOM 0 HB3 SER A 125 19.445 16.402 8.331 1.00 61.32 H new ATOM 0 HG SER A 125 20.305 14.067 8.227 1.00 44.54 H new ATOM 1803 N ASN A 126 16.067 15.841 9.505 1.00 23.44 N ATOM 1804 CA ASN A 126 15.050 16.802 9.942 1.00 73.42 C ATOM 1805 C ASN A 126 14.854 16.716 11.454 1.00 24.25 C ATOM 1806 O ASN A 126 14.854 17.733 12.162 1.00 64.13 O ATOM 1807 CB ASN A 126 13.716 16.566 9.222 1.00 54.23 C ATOM 1808 CG ASN A 126 12.678 17.621 9.575 1.00 23.41 C ATOM 1809 OD1 ASN A 126 13.017 18.775 9.842 1.00 4.50 O ATOM 1810 ND2 ASN A 126 11.414 17.234 9.592 1.00 5.31 N ATOM 0 H ASN A 126 15.738 15.152 8.829 1.00 23.44 H new ATOM 0 HA ASN A 126 15.401 17.801 9.685 1.00 73.42 H new ATOM 0 HB2 ASN A 126 13.881 16.568 8.145 1.00 54.23 H new ATOM 0 HB3 ASN A 126 13.333 15.580 9.484 1.00 54.23 H new ATOM 0 HD21 ASN A 126 10.680 17.900 9.832 1.00 5.31 H new ATOM 0 HD22 ASN A 126 11.173 16.269 9.365 1.00 5.31 H new ATOM 1817 N ALA A 127 14.734 15.489 11.942 1.00 54.04 N ATOM 1818 CA ALA A 127 14.545 15.223 13.363 1.00 54.10 C ATOM 1819 C ALA A 127 15.792 15.570 14.168 1.00 52.15 C ATOM 1820 O ALA A 127 15.728 15.752 15.378 1.00 1.24 O ATOM 1821 CB ALA A 127 14.190 13.756 13.570 1.00 41.33 C ATOM 0 H ALA A 127 14.765 14.649 11.364 1.00 54.04 H new ATOM 0 HA ALA A 127 13.730 15.854 13.717 1.00 54.10 H new ATOM 0 HB1 ALA A 127 14.050 13.562 14.633 1.00 41.33 H new ATOM 0 HB2 ALA A 127 13.269 13.525 13.035 1.00 41.33 H new ATOM 0 HB3 ALA A 127 14.997 13.129 13.190 1.00 41.33 H new ATOM 1827 N THR A 128 16.920 15.694 13.488 1.00 1.20 N ATOM 1828 CA THR A 128 18.203 15.820 14.159 1.00 2.03 C ATOM 1829 C THR A 128 18.729 17.247 14.013 1.00 41.31 C ATOM 1830 O THR A 128 19.871 17.547 14.360 1.00 64.41 O ATOM 1831 CB THR A 128 19.215 14.779 13.598 1.00 53.22 C ATOM 1832 OG1 THR A 128 20.150 14.396 14.609 1.00 44.43 O ATOM 1833 CG2 THR A 128 19.977 15.317 12.390 1.00 73.21 C ATOM 0 H THR A 128 16.973 15.710 12.470 1.00 1.20 H new ATOM 0 HA THR A 128 18.074 15.613 15.221 1.00 2.03 H new ATOM 0 HB THR A 128 18.636 13.912 13.280 1.00 53.22 H new ATOM 0 HG1 THR A 128 20.779 13.740 14.242 1.00 44.43 H new ATOM 0 HG21 THR A 128 20.672 14.558 12.031 1.00 73.21 H new ATOM 0 HG22 THR A 128 19.272 15.568 11.597 1.00 73.21 H new ATOM 0 HG23 THR A 128 20.532 16.210 12.678 1.00 73.21 H new ATOM 1841 N ARG A 129 17.873 18.132 13.504 1.00 15.30 N ATOM 1842 CA ARG A 129 18.227 19.537 13.334 1.00 1.24 C ATOM 1843 C ARG A 129 17.205 20.438 14.026 1.00 21.22 C ATOM 1844 O ARG A 129 17.559 21.269 14.864 1.00 60.25 O ATOM 1845 CB ARG A 129 18.342 19.881 11.833 1.00 61.34 C ATOM 1846 CG ARG A 129 17.071 19.637 11.027 1.00 45.30 C ATOM 1847 CD ARG A 129 17.292 19.800 9.527 1.00 1.10 C ATOM 1848 NE ARG A 129 17.600 21.185 9.156 1.00 10.14 N ATOM 1849 CZ ARG A 129 17.014 21.847 8.155 1.00 72.04 C ATOM 1850 NH1 ARG A 129 16.052 21.274 7.436 1.00 12.15 N1+ ATOM 1851 NH2 ARG A 129 17.391 23.088 7.881 1.00 55.55 N ATOM 0 H ARG A 129 16.927 17.898 13.202 1.00 15.30 H new ATOM 0 HA ARG A 129 19.197 19.712 13.800 1.00 1.24 H new ATOM 0 HB2 ARG A 129 18.623 20.929 11.734 1.00 61.34 H new ATOM 0 HB3 ARG A 129 19.150 19.292 11.400 1.00 61.34 H new ATOM 0 HG2 ARG A 129 16.703 18.631 11.230 1.00 45.30 H new ATOM 0 HG3 ARG A 129 16.297 20.331 11.355 1.00 45.30 H new ATOM 0 HD2 ARG A 129 18.109 19.151 9.210 1.00 1.10 H new ATOM 0 HD3 ARG A 129 16.400 19.473 8.993 1.00 1.10 H new ATOM 0 HE ARG A 129 18.310 21.676 9.699 1.00 10.14 H new ATOM 0 HH11 ARG A 129 15.756 20.321 7.647 1.00 12.15 H new ATOM 0 HH12 ARG A 129 15.610 21.788 6.673 1.00 12.15 H new ATOM 0 HH21 ARG A 129 18.125 23.532 8.433 1.00 55.55 H new ATOM 0 HH22 ARG A 129 16.947 23.599 7.118 1.00 55.55 H new ATOM 1865 N ASN A 130 15.941 20.276 13.660 1.00 53.23 N ATOM 1866 CA ASN A 130 14.857 21.064 14.234 1.00 71.44 C ATOM 1867 C ASN A 130 14.476 20.528 15.605 1.00 71.52 C ATOM 1868 O ASN A 130 14.256 21.287 16.550 1.00 41.25 O ATOM 1869 CB ASN A 130 13.651 21.047 13.286 1.00 51.21 C ATOM 1870 CG ASN A 130 13.934 21.783 11.986 1.00 65.44 C ATOM 1871 OD1 ASN A 130 14.482 22.885 11.991 1.00 64.05 O ATOM 1872 ND2 ASN A 130 13.609 21.166 10.865 1.00 32.23 N ATOM 0 H ASN A 130 15.638 19.598 12.960 1.00 53.23 H new ATOM 0 HA ASN A 130 15.191 22.094 14.359 1.00 71.44 H new ATOM 0 HB2 ASN A 130 13.378 20.015 13.066 1.00 51.21 H new ATOM 0 HB3 ASN A 130 12.795 21.504 13.782 1.00 51.21 H new ATOM 0 HD21 ASN A 130 13.811 21.602 9.966 1.00 32.23 H new ATOM 0 HD22 ASN A 130 13.156 20.253 10.898 1.00 32.23 H new ATOM 1879 N ASN A 131 14.420 19.206 15.707 1.00 23.53 N ATOM 1880 CA ASN A 131 13.988 18.545 16.932 1.00 43.51 C ATOM 1881 C ASN A 131 15.161 18.358 17.899 1.00 71.03 C ATOM 1882 O ASN A 131 15.034 18.618 19.098 1.00 72.12 O ATOM 1883 CB ASN A 131 13.361 17.185 16.597 1.00 43.33 C ATOM 1884 CG ASN A 131 12.560 16.590 17.749 1.00 4.41 C ATOM 1885 OD1 ASN A 131 12.509 15.374 17.908 1.00 52.34 O ATOM 1886 ND2 ASN A 131 11.913 17.434 18.546 1.00 53.22 N ATOM 0 H ASN A 131 14.670 18.568 14.952 1.00 23.53 H new ATOM 0 HA ASN A 131 13.244 19.176 17.418 1.00 43.51 H new ATOM 0 HB2 ASN A 131 12.710 17.297 15.730 1.00 43.33 H new ATOM 0 HB3 ASN A 131 14.150 16.488 16.315 1.00 43.33 H new ATOM 0 HD21 ASN A 131 11.352 17.077 19.319 1.00 53.22 H new ATOM 0 HD22 ASN A 131 11.978 18.439 18.385 1.00 53.22 H new ATOM 1893 N VAL A 132 16.312 17.942 17.367 1.00 22.24 N ATOM 1894 CA VAL A 132 17.471 17.594 18.191 1.00 51.15 C ATOM 1895 C VAL A 132 18.645 18.520 17.890 1.00 30.12 C ATOM 1896 O VAL A 132 18.792 18.999 16.764 1.00 33.10 O ATOM 1897 CB VAL A 132 17.896 16.116 17.967 1.00 54.43 C ATOM 1898 CG1 VAL A 132 19.084 15.740 18.856 1.00 31.31 C ATOM 1899 CG2 VAL A 132 16.717 15.167 18.208 1.00 70.22 C ATOM 0 H VAL A 132 16.466 17.838 16.364 1.00 22.24 H new ATOM 0 HA VAL A 132 17.181 17.717 19.234 1.00 51.15 H new ATOM 0 HB VAL A 132 18.210 16.015 16.928 1.00 54.43 H new ATOM 0 HG11 VAL A 132 19.358 14.700 18.677 1.00 31.31 H new ATOM 0 HG12 VAL A 132 19.932 16.384 18.622 1.00 31.31 H new ATOM 0 HG13 VAL A 132 18.810 15.867 19.903 1.00 31.31 H new ATOM 0 HG21 VAL A 132 17.039 14.138 18.045 1.00 70.22 H new ATOM 0 HG22 VAL A 132 16.364 15.279 19.233 1.00 70.22 H new ATOM 0 HG23 VAL A 132 15.909 15.408 17.517 1.00 70.22 H new ATOM 1909 N ALA A 133 19.466 18.779 18.906 1.00 44.32 N ATOM 1910 CA ALA A 133 20.625 19.653 18.767 1.00 45.42 C ATOM 1911 C ALA A 133 21.850 18.854 18.347 1.00 30.31 C ATOM 1912 O ALA A 133 22.445 18.131 19.147 1.00 14.22 O ATOM 1913 CB ALA A 133 20.888 20.398 20.073 1.00 22.23 C ATOM 0 H ALA A 133 19.346 18.391 19.842 1.00 44.32 H new ATOM 0 HA ALA A 133 20.415 20.387 17.989 1.00 45.42 H new ATOM 0 HB1 ALA A 133 21.756 21.046 19.954 1.00 22.23 H new ATOM 0 HB2 ALA A 133 20.017 21.001 20.330 1.00 22.23 H new ATOM 0 HB3 ALA A 133 21.079 19.679 20.870 1.00 22.23 H new ATOM 1919 N VAL A 134 22.197 18.958 17.077 1.00 55.21 N ATOM 1920 CA VAL A 134 23.376 18.291 16.541 1.00 14.23 C ATOM 1921 C VAL A 134 24.400 19.308 16.037 1.00 75.02 C ATOM 1922 O VAL A 134 24.093 20.163 15.201 1.00 44.45 O ATOM 1923 CB VAL A 134 23.000 17.310 15.404 1.00 13.33 C ATOM 1924 CG1 VAL A 134 24.245 16.731 14.744 1.00 2.32 C ATOM 1925 CG2 VAL A 134 22.109 16.192 15.945 1.00 40.12 C ATOM 0 H VAL A 134 21.676 19.502 16.390 1.00 55.21 H new ATOM 0 HA VAL A 134 23.823 17.719 17.354 1.00 14.23 H new ATOM 0 HB VAL A 134 22.447 17.864 14.645 1.00 13.33 H new ATOM 0 HG11 VAL A 134 23.950 16.046 13.949 1.00 2.32 H new ATOM 0 HG12 VAL A 134 24.843 17.539 14.323 1.00 2.32 H new ATOM 0 HG13 VAL A 134 24.834 16.193 15.487 1.00 2.32 H new ATOM 0 HG21 VAL A 134 21.851 15.509 15.136 1.00 40.12 H new ATOM 0 HG22 VAL A 134 22.642 15.647 16.724 1.00 40.12 H new ATOM 0 HG23 VAL A 134 21.198 16.622 16.361 1.00 40.12 H new ATOM 1935 N ARG A 135 25.611 19.207 16.568 1.00 5.32 N ATOM 1936 CA ARG A 135 26.723 20.062 16.182 1.00 35.41 C ATOM 1937 C ARG A 135 27.486 19.412 15.026 1.00 62.34 C ATOM 1938 O ARG A 135 28.029 18.316 15.174 1.00 24.24 O ATOM 1939 CB ARG A 135 27.660 20.262 17.387 1.00 72.41 C ATOM 1940 CG ARG A 135 28.262 21.657 17.493 1.00 24.53 C ATOM 1941 CD ARG A 135 27.196 22.703 17.806 1.00 72.30 C ATOM 1942 NE ARG A 135 26.432 22.363 19.013 1.00 54.11 N ATOM 1943 CZ ARG A 135 25.744 23.241 19.743 1.00 2.05 C ATOM 1944 NH1 ARG A 135 25.778 24.535 19.441 1.00 12.22 N1+ ATOM 1945 NH2 ARG A 135 25.042 22.825 20.786 1.00 32.21 N ATOM 0 H ARG A 135 25.850 18.523 17.285 1.00 5.32 H new ATOM 0 HA ARG A 135 26.346 21.033 15.860 1.00 35.41 H new ATOM 0 HB2 ARG A 135 27.106 20.048 18.301 1.00 72.41 H new ATOM 0 HB3 ARG A 135 28.469 19.534 17.327 1.00 72.41 H new ATOM 0 HG2 ARG A 135 29.024 21.668 18.273 1.00 24.53 H new ATOM 0 HG3 ARG A 135 28.760 21.912 16.557 1.00 24.53 H new ATOM 0 HD2 ARG A 135 27.670 23.676 17.938 1.00 72.30 H new ATOM 0 HD3 ARG A 135 26.516 22.793 16.959 1.00 72.30 H new ATOM 0 HE ARG A 135 26.427 21.388 19.313 1.00 54.11 H new ATOM 0 HH11 ARG A 135 26.332 24.859 18.648 1.00 12.22 H new ATOM 0 HH12 ARG A 135 25.250 25.204 20.002 1.00 12.22 H new ATOM 0 HH21 ARG A 135 25.028 21.835 21.029 1.00 32.21 H new ATOM 0 HH22 ARG A 135 24.515 23.495 21.346 1.00 32.21 H new ATOM 1959 N LEU A 136 27.513 20.070 13.875 1.00 14.32 N ATOM 1960 CA LEU A 136 28.188 19.530 12.704 1.00 2.32 C ATOM 1961 C LEU A 136 29.665 19.918 12.691 1.00 50.04 C ATOM 1962 O LEU A 136 30.020 21.083 12.487 1.00 1.31 O ATOM 1963 CB LEU A 136 27.480 19.990 11.424 1.00 33.50 C ATOM 1964 CG LEU A 136 26.128 19.304 11.159 1.00 40.54 C ATOM 1965 CD1 LEU A 136 25.491 19.822 9.872 1.00 3.54 C ATOM 1966 CD2 LEU A 136 26.305 17.785 11.106 1.00 32.41 C ATOM 0 H LEU A 136 27.075 20.979 13.728 1.00 14.32 H new ATOM 0 HA LEU A 136 28.139 18.442 12.750 1.00 2.32 H new ATOM 0 HB2 LEU A 136 27.322 21.067 11.479 1.00 33.50 H new ATOM 0 HB3 LEU A 136 28.138 19.807 10.575 1.00 33.50 H new ATOM 0 HG LEU A 136 25.455 19.546 11.982 1.00 40.54 H new ATOM 0 HD11 LEU A 136 24.537 19.320 9.710 1.00 3.54 H new ATOM 0 HD12 LEU A 136 25.326 20.896 9.954 1.00 3.54 H new ATOM 0 HD13 LEU A 136 26.154 19.620 9.031 1.00 3.54 H new ATOM 0 HD21 LEU A 136 25.341 17.313 10.918 1.00 32.41 H new ATOM 0 HD22 LEU A 136 26.998 17.527 10.305 1.00 32.41 H new ATOM 0 HD23 LEU A 136 26.703 17.432 12.057 1.00 32.41 H new ATOM 1978 N VAL A 137 30.515 18.921 12.921 1.00 24.14 N ATOM 1979 CA VAL A 137 31.960 19.105 12.943 1.00 11.21 C ATOM 1980 C VAL A 137 32.606 18.328 11.794 1.00 22.22 C ATOM 1981 O VAL A 137 32.562 17.097 11.746 1.00 60.11 O ATOM 1982 CB VAL A 137 32.568 18.681 14.317 1.00 74.42 C ATOM 1983 CG1 VAL A 137 31.785 17.522 14.929 1.00 2.12 C ATOM 1984 CG2 VAL A 137 34.050 18.312 14.183 1.00 51.44 C ATOM 0 H VAL A 137 30.219 17.961 13.098 1.00 24.14 H new ATOM 0 HA VAL A 137 32.171 20.166 12.809 1.00 11.21 H new ATOM 0 HB VAL A 137 32.492 19.539 14.985 1.00 74.42 H new ATOM 0 HG11 VAL A 137 32.230 17.247 15.885 1.00 2.12 H new ATOM 0 HG12 VAL A 137 30.749 17.824 15.084 1.00 2.12 H new ATOM 0 HG13 VAL A 137 31.816 16.666 14.255 1.00 2.12 H new ATOM 0 HG21 VAL A 137 34.442 18.022 15.158 1.00 51.44 H new ATOM 0 HG22 VAL A 137 34.156 17.480 13.487 1.00 51.44 H new ATOM 0 HG23 VAL A 137 34.607 19.171 13.809 1.00 51.44 H new ATOM 1994 N VAL A 138 33.185 19.061 10.857 1.00 43.23 N ATOM 1995 CA VAL A 138 33.823 18.467 9.692 1.00 53.11 C ATOM 1996 C VAL A 138 35.315 18.279 9.956 1.00 13.33 C ATOM 1997 O VAL A 138 35.964 19.128 10.574 1.00 44.02 O ATOM 1998 CB VAL A 138 33.616 19.305 8.408 1.00 15.42 C ATOM 1999 CG1 VAL A 138 32.158 19.730 8.263 1.00 20.25 C ATOM 2000 CG2 VAL A 138 34.550 20.501 8.388 1.00 13.44 C ATOM 0 H VAL A 138 33.226 20.080 10.881 1.00 43.23 H new ATOM 0 HA VAL A 138 33.349 17.500 9.524 1.00 53.11 H new ATOM 0 HB VAL A 138 33.862 18.680 7.549 1.00 15.42 H new ATOM 0 HG11 VAL A 138 32.039 20.318 7.353 1.00 20.25 H new ATOM 0 HG12 VAL A 138 31.525 18.845 8.209 1.00 20.25 H new ATOM 0 HG13 VAL A 138 31.867 20.332 9.124 1.00 20.25 H new ATOM 0 HG21 VAL A 138 34.386 21.075 7.476 1.00 13.44 H new ATOM 0 HG22 VAL A 138 34.352 21.132 9.255 1.00 13.44 H new ATOM 0 HG23 VAL A 138 35.584 20.156 8.419 1.00 13.44 H new ATOM 2010 N ALA A 139 35.835 17.151 9.526 1.00 53.03 N ATOM 2011 CA ALA A 139 37.224 16.779 9.793 1.00 12.31 C ATOM 2012 C ALA A 139 37.985 16.526 8.495 1.00 73.13 C ATOM 2013 O ALA A 139 37.384 16.375 7.426 1.00 43.50 O ATOM 2014 CB ALA A 139 37.270 15.548 10.690 1.00 22.50 C ATOM 0 H ALA A 139 35.316 16.461 8.982 1.00 53.03 H new ATOM 0 HA ALA A 139 37.710 17.609 10.306 1.00 12.31 H new ATOM 0 HB1 ALA A 139 38.308 15.278 10.884 1.00 22.50 H new ATOM 0 HB2 ALA A 139 36.770 15.766 11.633 1.00 22.50 H new ATOM 0 HB3 ALA A 139 36.765 14.718 10.195 1.00 22.50 H new TER 2020 ALA A 139 ATOM 2021 N MET B 1 26.746 23.934 26.252 1.00 72.34 N ATOM 2022 CA MET B 1 25.885 23.591 27.382 1.00 63.32 C ATOM 2023 C MET B 1 26.669 22.833 28.449 1.00 71.35 C ATOM 2024 O MET B 1 27.871 22.598 28.300 1.00 2.40 O ATOM 2025 CB MET B 1 24.694 22.745 26.916 1.00 41.04 C ATOM 2026 CG MET B 1 25.100 21.410 26.308 1.00 5.33 C ATOM 2027 SD MET B 1 23.693 20.434 25.740 1.00 24.33 S ATOM 2028 CE MET B 1 23.051 19.817 27.292 1.00 72.42 C ATOM 0 H1 MET B 1 26.265 23.691 25.363 1.00 72.34 H new ATOM 0 H2 MET B 1 26.950 24.954 26.268 1.00 72.34 H new ATOM 0 H3 MET B 1 27.637 23.402 26.320 1.00 72.34 H new ATOM 0 HA MET B 1 25.512 24.520 27.813 1.00 63.32 H new ATOM 0 HB2 MET B 1 24.033 22.563 27.764 1.00 41.04 H new ATOM 0 HB3 MET B 1 24.121 23.311 26.181 1.00 41.04 H new ATOM 0 HG2 MET B 1 25.773 21.589 25.469 1.00 5.33 H new ATOM 0 HG3 MET B 1 25.658 20.836 27.047 1.00 5.33 H new ATOM 0 HE1 MET B 1 22.642 18.817 27.145 1.00 72.42 H new ATOM 0 HE2 MET B 1 23.854 19.776 28.027 1.00 72.42 H new ATOM 0 HE3 MET B 1 22.265 20.482 27.650 1.00 72.42 H new ATOM 2038 N ASN B 2 25.979 22.446 29.514 1.00 33.33 N ATOM 2039 CA ASN B 2 26.599 21.696 30.602 1.00 51.30 C ATOM 2040 C ASN B 2 26.288 20.214 30.449 1.00 60.31 C ATOM 2041 O ASN B 2 25.307 19.711 31.000 1.00 61.35 O ATOM 2042 CB ASN B 2 26.122 22.197 31.976 1.00 21.53 C ATOM 2043 CG ASN B 2 26.848 21.506 33.122 1.00 32.42 C ATOM 2044 OD1 ASN B 2 28.008 21.119 32.993 1.00 51.33 O ATOM 2045 ND2 ASN B 2 26.175 21.347 34.254 1.00 42.33 N ATOM 0 H ASN B 2 24.987 22.639 29.649 1.00 33.33 H new ATOM 0 HA ASN B 2 27.677 21.850 30.548 1.00 51.30 H new ATOM 0 HB2 ASN B 2 26.280 23.273 32.044 1.00 21.53 H new ATOM 0 HB3 ASN B 2 25.050 22.026 32.071 1.00 21.53 H new ATOM 0 HD21 ASN B 2 26.619 20.892 35.052 1.00 42.33 H new ATOM 0 HD22 ASN B 2 25.214 21.680 34.327 1.00 42.33 H new ATOM 2052 N ILE B 3 27.094 19.532 29.646 1.00 21.23 N ATOM 2053 CA ILE B 3 26.921 18.107 29.414 1.00 72.42 C ATOM 2054 C ILE B 3 27.284 17.296 30.652 1.00 64.03 C ATOM 2055 O ILE B 3 28.399 17.386 31.165 1.00 40.30 O ATOM 2056 CB ILE B 3 27.777 17.642 28.216 1.00 60.30 C ATOM 2057 CG1 ILE B 3 27.329 18.370 26.945 1.00 50.54 C ATOM 2058 CG2 ILE B 3 27.686 16.129 28.034 1.00 62.10 C ATOM 2059 CD1 ILE B 3 25.961 17.944 26.458 1.00 13.01 C ATOM 0 H ILE B 3 27.878 19.947 29.142 1.00 21.23 H new ATOM 0 HA ILE B 3 25.868 17.938 29.188 1.00 72.42 H new ATOM 0 HB ILE B 3 28.820 17.889 28.415 1.00 60.30 H new ATOM 0 HG12 ILE B 3 27.321 19.443 27.134 1.00 50.54 H new ATOM 0 HG13 ILE B 3 28.059 18.191 26.156 1.00 50.54 H new ATOM 0 HG21 ILE B 3 28.298 15.827 27.184 1.00 62.10 H new ATOM 0 HG22 ILE B 3 28.046 15.632 28.935 1.00 62.10 H new ATOM 0 HG23 ILE B 3 26.649 15.846 27.853 1.00 62.10 H new ATOM 0 HD11 ILE B 3 25.707 18.499 25.555 1.00 13.01 H new ATOM 0 HD12 ILE B 3 25.969 16.877 26.237 1.00 13.01 H new ATOM 0 HD13 ILE B 3 25.220 18.149 27.230 1.00 13.01 H new ATOM 2071 N LEU B 4 26.329 16.507 31.120 1.00 23.11 N ATOM 2072 CA LEU B 4 26.542 15.621 32.258 1.00 23.43 C ATOM 2073 C LEU B 4 27.278 14.369 31.804 1.00 41.14 C ATOM 2074 O LEU B 4 28.249 13.937 32.433 1.00 62.34 O ATOM 2075 CB LEU B 4 25.202 15.229 32.892 1.00 50.44 C ATOM 2076 CG LEU B 4 24.352 16.397 33.404 1.00 31.23 C ATOM 2077 CD1 LEU B 4 23.010 15.894 33.934 1.00 75.25 C ATOM 2078 CD2 LEU B 4 25.101 17.181 34.481 1.00 11.04 C ATOM 0 H LEU B 4 25.389 16.461 30.726 1.00 23.11 H new ATOM 0 HA LEU B 4 27.141 16.147 33.001 1.00 23.43 H new ATOM 0 HB2 LEU B 4 24.620 14.673 32.157 1.00 50.44 H new ATOM 0 HB3 LEU B 4 25.397 14.551 33.723 1.00 50.44 H new ATOM 0 HG LEU B 4 24.158 17.070 32.569 1.00 31.23 H new ATOM 0 HD11 LEU B 4 22.421 16.738 34.293 1.00 75.25 H new ATOM 0 HD12 LEU B 4 22.469 15.388 33.134 1.00 75.25 H new ATOM 0 HD13 LEU B 4 23.181 15.196 34.754 1.00 75.25 H new ATOM 0 HD21 LEU B 4 24.479 18.005 34.830 1.00 11.04 H new ATOM 0 HD22 LEU B 4 25.332 16.521 35.317 1.00 11.04 H new ATOM 0 HD23 LEU B 4 26.028 17.577 34.065 1.00 11.04 H new ATOM 2090 N TYR B 5 26.821 13.799 30.693 1.00 23.42 N ATOM 2091 CA TYR B 5 27.401 12.559 30.175 1.00 44.15 C ATOM 2092 C TYR B 5 27.554 12.654 28.669 1.00 24.15 C ATOM 2093 O TYR B 5 26.634 13.070 27.976 1.00 75.34 O ATOM 2094 CB TYR B 5 26.513 11.358 30.549 1.00 21.21 C ATOM 2095 CG TYR B 5 27.034 10.001 30.084 1.00 10.12 C ATOM 2096 CD1 TYR B 5 26.904 9.597 28.756 1.00 52.12 C ATOM 2097 CD2 TYR B 5 27.644 9.118 30.974 1.00 71.12 C ATOM 2098 CE1 TYR B 5 27.367 8.368 28.331 1.00 75.45 C ATOM 2099 CE2 TYR B 5 28.110 7.884 30.552 1.00 10.31 C ATOM 2100 CZ TYR B 5 27.970 7.516 29.228 1.00 52.51 C ATOM 2101 OH TYR B 5 28.435 6.289 28.796 1.00 25.44 O ATOM 0 H TYR B 5 26.054 14.172 30.134 1.00 23.42 H new ATOM 0 HA TYR B 5 28.384 12.413 30.622 1.00 44.15 H new ATOM 0 HB2 TYR B 5 26.398 11.334 31.633 1.00 21.21 H new ATOM 0 HB3 TYR B 5 25.520 11.514 30.126 1.00 21.21 H new ATOM 0 HD1 TYR B 5 26.431 10.259 28.045 1.00 52.12 H new ATOM 0 HD2 TYR B 5 27.755 9.401 32.010 1.00 71.12 H new ATOM 0 HE1 TYR B 5 27.256 8.076 27.297 1.00 75.45 H new ATOM 0 HE2 TYR B 5 28.581 7.213 31.255 1.00 10.31 H new ATOM 0 HH TYR B 5 28.835 5.807 29.550 1.00 25.44 H new ATOM 2111 N LYS B 6 28.719 12.282 28.168 1.00 30.03 N ATOM 2112 CA LYS B 6 28.970 12.279 26.733 1.00 63.12 C ATOM 2113 C LYS B 6 29.702 11.009 26.318 1.00 12.41 C ATOM 2114 O LYS B 6 30.647 10.577 26.982 1.00 54.02 O ATOM 2115 CB LYS B 6 29.775 13.522 26.324 1.00 22.40 C ATOM 2116 CG LYS B 6 30.165 13.545 24.849 1.00 43.31 C ATOM 2117 CD LYS B 6 30.775 14.882 24.430 1.00 65.01 C ATOM 2118 CE LYS B 6 29.759 16.016 24.479 1.00 23.11 C ATOM 2119 NZ LYS B 6 30.318 17.278 23.926 1.00 52.41 N1+ ATOM 0 H LYS B 6 29.510 11.977 28.734 1.00 30.03 H new ATOM 0 HA LYS B 6 28.010 12.305 26.218 1.00 63.12 H new ATOM 0 HB2 LYS B 6 29.189 14.413 26.549 1.00 22.40 H new ATOM 0 HB3 LYS B 6 30.679 13.573 26.930 1.00 22.40 H new ATOM 0 HG2 LYS B 6 30.879 12.745 24.652 1.00 43.31 H new ATOM 0 HG3 LYS B 6 29.284 13.343 24.240 1.00 43.31 H new ATOM 0 HD2 LYS B 6 31.613 15.119 25.085 1.00 65.01 H new ATOM 0 HD3 LYS B 6 31.174 14.797 23.419 1.00 65.01 H new ATOM 0 HE2 LYS B 6 28.870 15.733 23.915 1.00 23.11 H new ATOM 0 HE3 LYS B 6 29.444 16.178 25.510 1.00 23.11 H new ATOM 0 HZ1 LYS B 6 29.760 18.085 24.270 1.00 52.41 H new ATOM 0 HZ2 LYS B 6 31.306 17.384 24.233 1.00 52.41 H new ATOM 0 HZ3 LYS B 6 30.280 17.249 22.887 1.00 52.41 H new ATOM 2133 N THR B 7 29.257 10.416 25.222 1.00 10.14 N ATOM 2134 CA THR B 7 29.864 9.207 24.688 1.00 42.05 C ATOM 2135 C THR B 7 30.067 9.350 23.182 1.00 63.52 C ATOM 2136 O THR B 7 29.216 9.904 22.478 1.00 72.52 O ATOM 2137 CB THR B 7 29.010 7.953 25.004 1.00 0.35 C ATOM 2138 OG1 THR B 7 29.582 6.791 24.391 1.00 0.11 O ATOM 2139 CG2 THR B 7 27.569 8.124 24.541 1.00 24.11 C ATOM 0 H THR B 7 28.465 10.759 24.678 1.00 10.14 H new ATOM 0 HA THR B 7 30.832 9.073 25.170 1.00 42.05 H new ATOM 0 HB THR B 7 29.005 7.825 26.086 1.00 0.35 H new ATOM 0 HG1 THR B 7 30.115 6.301 25.052 1.00 0.11 H new ATOM 0 HG21 THR B 7 27.001 7.225 24.780 1.00 24.11 H new ATOM 0 HG22 THR B 7 27.123 8.980 25.048 1.00 24.11 H new ATOM 0 HG23 THR B 7 27.550 8.290 23.464 1.00 24.11 H new ATOM 2147 N ALA B 8 31.207 8.872 22.699 1.00 4.15 N ATOM 2148 CA ALA B 8 31.562 8.983 21.290 1.00 51.31 C ATOM 2149 C ALA B 8 31.521 7.617 20.628 1.00 33.43 C ATOM 2150 O ALA B 8 31.875 6.613 21.245 1.00 64.22 O ATOM 2151 CB ALA B 8 32.950 9.600 21.145 1.00 24.44 C ATOM 0 H ALA B 8 31.908 8.399 23.269 1.00 4.15 H new ATOM 0 HA ALA B 8 30.838 9.631 20.796 1.00 51.31 H new ATOM 0 HB1 ALA B 8 33.205 9.678 20.088 1.00 24.44 H new ATOM 0 HB2 ALA B 8 32.955 10.593 21.594 1.00 24.44 H new ATOM 0 HB3 ALA B 8 33.683 8.970 21.649 1.00 24.44 H new ATOM 2157 N ALA B 9 31.091 7.579 19.374 1.00 21.22 N ATOM 2158 CA ALA B 9 31.060 6.342 18.609 1.00 20.22 C ATOM 2159 C ALA B 9 31.667 6.558 17.226 1.00 31.45 C ATOM 2160 O ALA B 9 31.190 7.384 16.447 1.00 1.21 O ATOM 2161 CB ALA B 9 29.634 5.813 18.515 1.00 3.15 C ATOM 0 H ALA B 9 30.757 8.396 18.863 1.00 21.22 H new ATOM 0 HA ALA B 9 31.661 5.592 19.123 1.00 20.22 H new ATOM 0 HB1 ALA B 9 29.627 4.887 17.940 1.00 3.15 H new ATOM 0 HB2 ALA B 9 29.250 5.621 19.517 1.00 3.15 H new ATOM 0 HB3 ALA B 9 29.004 6.552 18.021 1.00 3.15 H new ATOM 2167 N THR B 10 32.731 5.822 16.941 1.00 33.23 N ATOM 2168 CA THR B 10 33.453 5.937 15.686 1.00 64.31 C ATOM 2169 C THR B 10 32.897 4.955 14.650 1.00 63.33 C ATOM 2170 O THR B 10 32.820 3.749 14.894 1.00 30.04 O ATOM 2171 CB THR B 10 34.962 5.677 15.908 1.00 62.43 C ATOM 2172 OG1 THR B 10 35.477 6.607 16.878 1.00 21.44 O ATOM 2173 CG2 THR B 10 35.747 5.805 14.606 1.00 23.24 C ATOM 0 H THR B 10 33.118 5.126 17.578 1.00 33.23 H new ATOM 0 HA THR B 10 33.321 6.951 15.308 1.00 64.31 H new ATOM 0 HB THR B 10 35.079 4.657 16.275 1.00 62.43 H new ATOM 0 HG1 THR B 10 36.323 6.982 16.555 1.00 21.44 H new ATOM 0 HG21 THR B 10 36.803 5.616 14.798 1.00 23.24 H new ATOM 0 HG22 THR B 10 35.374 5.079 13.883 1.00 23.24 H new ATOM 0 HG23 THR B 10 35.625 6.811 14.205 1.00 23.24 H new ATOM 2181 N SER B 11 32.490 5.489 13.508 1.00 64.42 N ATOM 2182 CA SER B 11 31.969 4.697 12.406 1.00 20.54 C ATOM 2183 C SER B 11 32.949 4.739 11.234 1.00 44.42 C ATOM 2184 O SER B 11 33.189 5.795 10.652 1.00 74.01 O ATOM 2185 CB SER B 11 30.597 5.240 11.986 1.00 74.14 C ATOM 2186 OG SER B 11 30.065 4.528 10.882 1.00 11.25 O ATOM 0 H SER B 11 32.513 6.491 13.320 1.00 64.42 H new ATOM 0 HA SER B 11 31.851 3.661 12.722 1.00 20.54 H new ATOM 0 HB2 SER B 11 29.907 5.175 12.827 1.00 74.14 H new ATOM 0 HB3 SER B 11 30.687 6.295 11.729 1.00 74.14 H new ATOM 0 HG SER B 11 30.303 3.580 10.958 1.00 11.25 H new ATOM 2192 N THR B 12 33.546 3.599 10.917 1.00 44.31 N ATOM 2193 CA THR B 12 34.492 3.502 9.818 1.00 14.13 C ATOM 2194 C THR B 12 33.832 2.871 8.592 1.00 53.42 C ATOM 2195 O THR B 12 32.827 2.164 8.711 1.00 32.44 O ATOM 2196 CB THR B 12 35.699 2.636 10.230 1.00 2.30 C ATOM 2197 OG1 THR B 12 36.106 2.973 11.564 1.00 14.42 O ATOM 2198 CG2 THR B 12 36.871 2.825 9.280 1.00 31.31 C ATOM 0 H THR B 12 33.389 2.721 11.412 1.00 44.31 H new ATOM 0 HA THR B 12 34.825 4.510 9.572 1.00 14.13 H new ATOM 0 HB THR B 12 35.391 1.591 10.187 1.00 2.30 H new ATOM 0 HG1 THR B 12 37.073 3.134 11.580 1.00 14.42 H new ATOM 0 HG21 THR B 12 37.704 2.199 9.601 1.00 31.31 H new ATOM 0 HG22 THR B 12 36.571 2.541 8.271 1.00 31.31 H new ATOM 0 HG23 THR B 12 37.179 3.871 9.286 1.00 31.31 H new ATOM 2206 N GLY B 13 34.405 3.120 7.424 1.00 25.11 N ATOM 2207 CA GLY B 13 33.943 2.472 6.212 1.00 71.12 C ATOM 2208 C GLY B 13 34.515 1.074 6.084 1.00 70.11 C ATOM 2209 O GLY B 13 35.421 0.843 5.288 1.00 42.34 O ATOM 0 H GLY B 13 35.186 3.763 7.293 1.00 25.11 H new ATOM 0 HA2 GLY B 13 32.854 2.423 6.215 1.00 71.12 H new ATOM 0 HA3 GLY B 13 34.233 3.067 5.346 1.00 71.12 H new ATOM 2213 N GLY B 14 34.006 0.149 6.902 1.00 21.54 N ATOM 2214 CA GLY B 14 34.484 -1.228 6.876 1.00 31.21 C ATOM 2215 C GLY B 14 34.209 -1.918 5.548 1.00 73.40 C ATOM 2216 O GLY B 14 34.881 -1.650 4.553 1.00 13.01 O ATOM 0 H GLY B 14 33.269 0.330 7.584 1.00 21.54 H new ATOM 0 HA2 GLY B 14 35.556 -1.240 7.072 1.00 31.21 H new ATOM 0 HA3 GLY B 14 34.006 -1.790 7.679 1.00 31.21 H new ATOM 2220 N ARG B 15 33.246 -2.835 5.532 1.00 12.42 N ATOM 2221 CA ARG B 15 32.815 -3.463 4.284 1.00 62.32 C ATOM 2222 C ARG B 15 31.702 -2.628 3.657 1.00 53.41 C ATOM 2223 O ARG B 15 31.771 -2.253 2.488 1.00 34.04 O ATOM 2224 CB ARG B 15 32.368 -4.911 4.528 1.00 22.32 C ATOM 2225 CG ARG B 15 31.958 -5.682 3.268 1.00 23.03 C ATOM 2226 CD ARG B 15 33.012 -5.626 2.160 1.00 52.22 C ATOM 2227 NE ARG B 15 32.862 -4.432 1.320 1.00 65.14 N ATOM 2228 CZ ARG B 15 33.866 -3.803 0.709 1.00 55.23 C ATOM 2229 NH1 ARG B 15 35.113 -4.234 0.841 1.00 21.14 N1+ ATOM 2230 NH2 ARG B 15 33.616 -2.747 -0.050 1.00 51.30 N ATOM 0 H ARG B 15 32.751 -3.159 6.363 1.00 12.42 H new ATOM 0 HA ARG B 15 33.654 -3.501 3.589 1.00 62.32 H new ATOM 0 HB2 ARG B 15 33.180 -5.449 5.017 1.00 22.32 H new ATOM 0 HB3 ARG B 15 31.527 -4.904 5.222 1.00 22.32 H new ATOM 0 HG2 ARG B 15 31.771 -6.723 3.531 1.00 23.03 H new ATOM 0 HG3 ARG B 15 31.020 -5.276 2.890 1.00 23.03 H new ATOM 0 HD2 ARG B 15 34.007 -5.634 2.605 1.00 52.22 H new ATOM 0 HD3 ARG B 15 32.934 -6.518 1.539 1.00 52.22 H new ATOM 0 HE ARG B 15 31.922 -4.056 1.195 1.00 65.14 H new ATOM 0 HH11 ARG B 15 35.311 -5.054 1.414 1.00 21.14 H new ATOM 0 HH12 ARG B 15 35.874 -3.746 0.369 1.00 21.14 H new ATOM 0 HH21 ARG B 15 32.658 -2.417 -0.166 1.00 51.30 H new ATOM 0 HH22 ARG B 15 34.382 -2.263 -0.519 1.00 51.30 H new ATOM 2244 N ASP B 16 30.667 -2.343 4.445 1.00 43.23 N ATOM 2245 CA ASP B 16 29.659 -1.366 4.044 1.00 64.45 C ATOM 2246 C ASP B 16 29.510 -0.309 5.120 1.00 45.23 C ATOM 2247 O ASP B 16 29.433 0.887 4.818 1.00 44.01 O ATOM 2248 CB ASP B 16 28.308 -2.032 3.806 1.00 65.33 C ATOM 2249 CG ASP B 16 27.270 -1.045 3.281 1.00 54.31 C ATOM 2250 OD1 ASP B 16 26.461 -0.532 4.080 1.00 24.34 O ATOM 2251 OD2 ASP B 16 27.279 -0.757 2.071 1.00 12.23 O1- ATOM 0 H ASP B 16 30.506 -2.771 5.357 1.00 43.23 H new ATOM 0 HA ASP B 16 29.989 -0.907 3.112 1.00 64.45 H new ATOM 0 HB2 ASP B 16 28.426 -2.848 3.093 1.00 65.33 H new ATOM 0 HB3 ASP B 16 27.952 -2.472 4.737 1.00 65.33 H new ATOM 2256 N GLY B 17 29.490 -0.749 6.381 1.00 22.41 N ATOM 2257 CA GLY B 17 29.591 0.187 7.478 1.00 74.22 C ATOM 2258 C GLY B 17 30.118 -0.462 8.736 1.00 32.04 C ATOM 2259 O GLY B 17 29.817 -1.622 9.022 1.00 11.23 O ATOM 0 H GLY B 17 29.406 -1.728 6.653 1.00 22.41 H new ATOM 0 HA2 GLY B 17 30.248 1.009 7.193 1.00 74.22 H new ATOM 0 HA3 GLY B 17 28.610 0.618 7.677 1.00 74.22 H new ATOM 2263 N ARG B 18 30.922 0.279 9.477 1.00 41.41 N ATOM 2264 CA ARG B 18 31.428 -0.165 10.766 1.00 45.30 C ATOM 2265 C ARG B 18 30.909 0.774 11.841 1.00 1.35 C ATOM 2266 O ARG B 18 30.671 1.951 11.576 1.00 0.54 O ATOM 2267 CB ARG B 18 32.964 -0.173 10.771 1.00 74.40 C ATOM 2268 CG ARG B 18 33.580 -0.585 12.108 1.00 53.04 C ATOM 2269 CD ARG B 18 35.074 -0.302 12.151 1.00 43.11 C ATOM 2270 NE ARG B 18 35.665 -0.599 13.457 1.00 64.22 N ATOM 2271 CZ ARG B 18 36.627 0.127 14.035 1.00 63.34 C ATOM 2272 NH1 ARG B 18 37.100 1.224 13.446 1.00 23.22 N1+ ATOM 2273 NH2 ARG B 18 37.111 -0.246 15.210 1.00 54.01 N ATOM 0 H ARG B 18 31.244 1.207 9.203 1.00 41.41 H new ATOM 0 HA ARG B 18 31.085 -1.181 10.960 1.00 45.30 H new ATOM 0 HB2 ARG B 18 33.316 -0.853 9.996 1.00 74.40 H new ATOM 0 HB3 ARG B 18 33.323 0.822 10.509 1.00 74.40 H new ATOM 0 HG2 ARG B 18 33.085 -0.049 12.917 1.00 53.04 H new ATOM 0 HG3 ARG B 18 33.406 -1.648 12.277 1.00 53.04 H new ATOM 0 HD2 ARG B 18 35.575 -0.895 11.386 1.00 43.11 H new ATOM 0 HD3 ARG B 18 35.249 0.746 11.907 1.00 43.11 H new ATOM 0 HE ARG B 18 35.319 -1.416 13.960 1.00 64.22 H new ATOM 0 HH11 ARG B 18 36.728 1.519 12.543 1.00 23.22 H new ATOM 0 HH12 ARG B 18 37.834 1.769 13.898 1.00 23.22 H new ATOM 0 HH21 ARG B 18 36.750 -1.083 15.668 1.00 54.01 H new ATOM 0 HH22 ARG B 18 37.845 0.303 15.657 1.00 54.01 H new ATOM 2287 N ALA B 19 30.742 0.260 13.042 1.00 25.44 N ATOM 2288 CA ALA B 19 30.262 1.056 14.158 1.00 25.14 C ATOM 2289 C ALA B 19 30.946 0.598 15.431 1.00 64.21 C ATOM 2290 O ALA B 19 30.890 -0.577 15.785 1.00 14.23 O ATOM 2291 CB ALA B 19 28.746 0.942 14.288 1.00 63.23 C ATOM 0 H ALA B 19 30.933 -0.715 13.274 1.00 25.44 H new ATOM 0 HA ALA B 19 30.502 2.104 13.981 1.00 25.14 H new ATOM 0 HB1 ALA B 19 28.407 1.546 15.130 1.00 63.23 H new ATOM 0 HB2 ALA B 19 28.274 1.299 13.372 1.00 63.23 H new ATOM 0 HB3 ALA B 19 28.472 -0.100 14.455 1.00 63.23 H new ATOM 2297 N THR B 20 31.600 1.518 16.108 1.00 63.15 N ATOM 2298 CA THR B 20 32.336 1.197 17.315 1.00 31.24 C ATOM 2299 C THR B 20 32.170 2.306 18.341 1.00 2.34 C ATOM 2300 O THR B 20 32.664 3.416 18.148 1.00 75.11 O ATOM 2301 CB THR B 20 33.835 0.989 16.986 1.00 15.15 C ATOM 2302 OG1 THR B 20 33.961 0.038 15.917 1.00 53.32 O ATOM 2303 CG2 THR B 20 34.613 0.488 18.199 1.00 14.05 C ATOM 0 H THR B 20 31.637 2.502 15.841 1.00 63.15 H new ATOM 0 HA THR B 20 31.939 0.272 17.734 1.00 31.24 H new ATOM 0 HB THR B 20 34.251 1.952 16.690 1.00 15.15 H new ATOM 0 HG1 THR B 20 34.721 -0.555 16.095 1.00 53.32 H new ATOM 0 HG21 THR B 20 35.661 0.354 17.929 1.00 14.05 H new ATOM 0 HG22 THR B 20 34.536 1.216 19.006 1.00 14.05 H new ATOM 0 HG23 THR B 20 34.199 -0.465 18.529 1.00 14.05 H new ATOM 2311 N SER B 21 31.456 2.013 19.424 1.00 21.31 N ATOM 2312 CA SER B 21 31.303 2.979 20.493 1.00 32.44 C ATOM 2313 C SER B 21 32.678 3.176 21.097 1.00 11.23 C ATOM 2314 O SER B 21 33.200 2.265 21.777 1.00 42.34 O ATOM 2315 CB SER B 21 30.287 2.521 21.543 1.00 31.41 C ATOM 2316 OG SER B 21 29.926 3.578 22.417 1.00 74.21 O ATOM 0 H SER B 21 30.981 1.123 19.579 1.00 21.31 H new ATOM 0 HA SER B 21 30.910 3.918 20.103 1.00 32.44 H new ATOM 0 HB2 SER B 21 29.396 2.139 21.045 1.00 31.41 H new ATOM 0 HB3 SER B 21 30.706 1.698 22.121 1.00 31.41 H new ATOM 0 HG SER B 21 30.666 3.760 23.033 1.00 74.21 H new ATOM 2322 N HIS B 22 33.221 4.367 20.797 1.00 5.04 N ATOM 2323 CA HIS B 22 34.637 4.723 20.929 1.00 32.51 C ATOM 2324 C HIS B 22 35.150 4.570 22.349 1.00 35.24 C ATOM 2325 O HIS B 22 36.352 4.415 22.563 1.00 73.12 O ATOM 2326 CB HIS B 22 34.818 6.173 20.442 1.00 3.43 C ATOM 2327 CG HIS B 22 36.228 6.692 20.449 1.00 12.52 C ATOM 2328 ND1 HIS B 22 36.999 6.784 19.308 1.00 31.42 N ATOM 2329 CD2 HIS B 22 36.982 7.206 21.450 1.00 34.34 C ATOM 2330 CE1 HIS B 22 38.162 7.335 19.610 1.00 23.12 C ATOM 2331 NE2 HIS B 22 38.175 7.599 20.900 1.00 12.42 N ATOM 0 H HIS B 22 32.658 5.139 20.441 1.00 5.04 H new ATOM 0 HA HIS B 22 35.224 4.035 20.320 1.00 32.51 H new ATOM 0 HB2 HIS B 22 34.428 6.247 19.427 1.00 3.43 H new ATOM 0 HB3 HIS B 22 34.207 6.825 21.066 1.00 3.43 H new ATOM 0 HD1 HIS B 22 36.716 6.475 18.378 1.00 31.42 H new ATOM 0 HD2 HIS B 22 36.697 7.291 22.488 1.00 34.34 H new ATOM 0 HE1 HIS B 22 38.965 7.535 18.916 1.00 23.12 H new ATOM 2340 N ASP B 23 34.245 4.584 23.313 1.00 44.12 N ATOM 2341 CA ASP B 23 34.624 4.384 24.714 1.00 0.24 C ATOM 2342 C ASP B 23 34.805 2.892 25.000 1.00 62.21 C ATOM 2343 O ASP B 23 34.804 2.453 26.152 1.00 40.03 O ATOM 2344 CB ASP B 23 33.596 5.024 25.663 1.00 12.04 C ATOM 2345 CG ASP B 23 32.157 4.609 25.396 1.00 5.31 C ATOM 2346 OD1 ASP B 23 31.916 3.774 24.498 1.00 63.54 O ATOM 2347 OD2 ASP B 23 31.255 5.142 26.080 1.00 33.23 O1- ATOM 0 H ASP B 23 33.247 4.730 23.160 1.00 44.12 H new ATOM 0 HA ASP B 23 35.577 4.882 24.894 1.00 0.24 H new ATOM 0 HB2 ASP B 23 33.853 4.762 26.689 1.00 12.04 H new ATOM 0 HB3 ASP B 23 33.670 6.109 25.583 1.00 12.04 H new ATOM 2352 N GLN B 24 34.973 2.132 23.912 1.00 3.35 N ATOM 2353 CA GLN B 24 35.365 0.726 23.946 1.00 64.10 C ATOM 2354 C GLN B 24 34.239 -0.169 24.445 1.00 11.02 C ATOM 2355 O GLN B 24 34.489 -1.285 24.909 1.00 0.33 O ATOM 2356 CB GLN B 24 36.630 0.530 24.798 1.00 41.34 C ATOM 2357 CG GLN B 24 37.845 1.309 24.298 1.00 71.43 C ATOM 2358 CD GLN B 24 38.192 1.001 22.850 1.00 54.02 C ATOM 2359 OE1 GLN B 24 38.914 0.043 22.559 1.00 54.01 O ATOM 2360 NE2 GLN B 24 37.703 1.823 21.936 1.00 4.32 N ATOM 0 H GLN B 24 34.837 2.488 22.966 1.00 3.35 H new ATOM 0 HA GLN B 24 35.586 0.430 22.921 1.00 64.10 H new ATOM 0 HB2 GLN B 24 36.415 0.832 25.823 1.00 41.34 H new ATOM 0 HB3 GLN B 24 36.877 -0.531 24.823 1.00 41.34 H new ATOM 0 HG2 GLN B 24 37.653 2.377 24.401 1.00 71.43 H new ATOM 0 HG3 GLN B 24 38.703 1.078 24.929 1.00 71.43 H new ATOM 0 HE21 GLN B 24 37.110 2.604 22.217 1.00 4.32 H new ATOM 0 HE22 GLN B 24 37.919 1.676 20.950 1.00 4.32 H new ATOM 2369 N LYS B 25 32.998 0.296 24.326 1.00 34.11 N ATOM 2370 CA LYS B 25 31.861 -0.516 24.741 1.00 33.22 C ATOM 2371 C LYS B 25 31.209 -1.222 23.551 1.00 40.01 C ATOM 2372 O LYS B 25 30.597 -2.279 23.731 1.00 34.42 O ATOM 2373 CB LYS B 25 30.811 0.307 25.509 1.00 20.21 C ATOM 2374 CG LYS B 25 29.946 1.206 24.633 1.00 22.43 C ATOM 2375 CD LYS B 25 28.847 1.903 25.435 1.00 41.25 C ATOM 2376 CE LYS B 25 29.415 2.712 26.594 1.00 25.52 C ATOM 2377 NZ LYS B 25 28.375 3.537 27.264 1.00 5.33 N1+ ATOM 0 H LYS B 25 32.758 1.214 23.952 1.00 34.11 H new ATOM 0 HA LYS B 25 32.255 -1.273 25.419 1.00 33.22 H new ATOM 0 HB2 LYS B 25 30.163 -0.376 26.058 1.00 20.21 H new ATOM 0 HB3 LYS B 25 31.322 0.924 26.248 1.00 20.21 H new ATOM 0 HG2 LYS B 25 30.574 1.956 24.152 1.00 22.43 H new ATOM 0 HG3 LYS B 25 29.494 0.612 23.839 1.00 22.43 H new ATOM 0 HD2 LYS B 25 28.279 2.561 24.777 1.00 41.25 H new ATOM 0 HD3 LYS B 25 28.150 1.158 25.819 1.00 41.25 H new ATOM 0 HE2 LYS B 25 29.865 2.036 27.321 1.00 25.52 H new ATOM 0 HE3 LYS B 25 30.211 3.360 26.227 1.00 25.52 H new ATOM 0 HZ1 LYS B 25 28.645 4.540 27.218 1.00 5.33 H new ATOM 0 HZ2 LYS B 25 27.462 3.402 26.784 1.00 5.33 H new ATOM 0 HZ3 LYS B 25 28.290 3.247 28.259 1.00 5.33 H new ATOM 2391 N LEU B 26 31.323 -0.678 22.324 1.00 71.52 N ATOM 2392 CA LEU B 26 30.632 -1.321 21.194 1.00 40.15 C ATOM 2393 C LEU B 26 31.518 -1.452 19.980 1.00 62.33 C ATOM 2394 O LEU B 26 32.253 -0.539 19.643 1.00 50.50 O ATOM 2395 CB LEU B 26 29.343 -0.565 20.844 1.00 64.14 C ATOM 2396 CG LEU B 26 28.593 -1.055 19.594 1.00 70.42 C ATOM 2397 CD1 LEU B 26 28.132 -2.501 19.762 1.00 23.12 C ATOM 2398 CD2 LEU B 26 27.410 -0.139 19.288 1.00 31.22 C ATOM 0 H LEU B 26 31.858 0.161 22.097 1.00 71.52 H new ATOM 0 HA LEU B 26 30.372 -2.331 21.512 1.00 40.15 H new ATOM 0 HB2 LEU B 26 28.667 -0.626 21.697 1.00 64.14 H new ATOM 0 HB3 LEU B 26 29.589 0.488 20.707 1.00 64.14 H new ATOM 0 HG LEU B 26 29.281 -1.022 18.750 1.00 70.42 H new ATOM 0 HD11 LEU B 26 27.605 -2.821 18.864 1.00 23.12 H new ATOM 0 HD12 LEU B 26 28.998 -3.143 19.923 1.00 23.12 H new ATOM 0 HD13 LEU B 26 27.463 -2.572 20.620 1.00 23.12 H new ATOM 0 HD21 LEU B 26 26.890 -0.500 18.401 1.00 31.22 H new ATOM 0 HD22 LEU B 26 26.723 -0.136 20.135 1.00 31.22 H new ATOM 0 HD23 LEU B 26 27.771 0.874 19.110 1.00 31.22 H new ATOM 2410 N ASP B 27 31.412 -2.606 19.329 1.00 22.45 N ATOM 2411 CA ASP B 27 32.219 -2.931 18.169 1.00 53.33 C ATOM 2412 C ASP B 27 31.463 -3.887 17.236 1.00 42.15 C ATOM 2413 O ASP B 27 31.489 -5.107 17.413 1.00 22.10 O ATOM 2414 CB ASP B 27 33.561 -3.533 18.626 1.00 24.13 C ATOM 2415 CG ASP B 27 33.416 -4.734 19.561 1.00 15.20 C ATOM 2416 OD1 ASP B 27 32.980 -4.547 20.720 1.00 3.40 O ATOM 2417 OD2 ASP B 27 33.765 -5.867 19.156 1.00 21.30 O1- ATOM 0 H ASP B 27 30.759 -3.343 19.597 1.00 22.45 H new ATOM 0 HA ASP B 27 32.424 -2.021 17.605 1.00 53.33 H new ATOM 0 HB2 ASP B 27 34.130 -3.836 17.747 1.00 24.13 H new ATOM 0 HB3 ASP B 27 34.141 -2.760 19.130 1.00 24.13 H new ATOM 2422 N VAL B 28 30.755 -3.316 16.261 1.00 42.42 N ATOM 2423 CA VAL B 28 29.969 -4.095 15.295 1.00 61.03 C ATOM 2424 C VAL B 28 30.058 -3.514 13.887 1.00 62.05 C ATOM 2425 O VAL B 28 30.703 -2.488 13.655 1.00 71.42 O ATOM 2426 CB VAL B 28 28.474 -4.186 15.694 1.00 35.33 C ATOM 2427 CG1 VAL B 28 28.274 -5.207 16.806 1.00 44.41 C ATOM 2428 CG2 VAL B 28 27.934 -2.815 16.099 1.00 74.12 C ATOM 0 H VAL B 28 30.708 -2.307 16.116 1.00 42.42 H new ATOM 0 HA VAL B 28 30.404 -5.094 15.304 1.00 61.03 H new ATOM 0 HB VAL B 28 27.909 -4.522 14.825 1.00 35.33 H new ATOM 0 HG11 VAL B 28 27.218 -5.255 17.071 1.00 44.41 H new ATOM 0 HG12 VAL B 28 28.607 -6.187 16.464 1.00 44.41 H new ATOM 0 HG13 VAL B 28 28.854 -4.911 17.680 1.00 44.41 H new ATOM 0 HG21 VAL B 28 26.883 -2.905 16.375 1.00 74.12 H new ATOM 0 HG22 VAL B 28 28.501 -2.437 16.950 1.00 74.12 H new ATOM 0 HG23 VAL B 28 28.032 -2.124 15.262 1.00 74.12 H new ATOM 2438 N LYS B 29 29.400 -4.195 12.952 1.00 64.31 N ATOM 2439 CA LYS B 29 29.361 -3.793 11.550 1.00 24.45 C ATOM 2440 C LYS B 29 27.936 -3.878 11.013 1.00 31.35 C ATOM 2441 O LYS B 29 27.159 -4.747 11.417 1.00 25.23 O ATOM 2442 CB LYS B 29 30.289 -4.701 10.726 1.00 11.40 C ATOM 2443 CG LYS B 29 29.899 -4.846 9.252 1.00 53.23 C ATOM 2444 CD LYS B 29 30.710 -5.926 8.532 1.00 3.25 C ATOM 2445 CE LYS B 29 30.220 -7.342 8.851 1.00 32.51 C ATOM 2446 NZ LYS B 29 30.422 -7.718 10.277 1.00 50.55 N1+ ATOM 0 H LYS B 29 28.875 -5.047 13.148 1.00 64.31 H new ATOM 0 HA LYS B 29 29.702 -2.761 11.468 1.00 24.45 H new ATOM 0 HB2 LYS B 29 31.304 -4.307 10.782 1.00 11.40 H new ATOM 0 HB3 LYS B 29 30.305 -5.691 11.182 1.00 11.40 H new ATOM 0 HG2 LYS B 29 28.838 -5.087 9.183 1.00 53.23 H new ATOM 0 HG3 LYS B 29 30.043 -3.891 8.746 1.00 53.23 H new ATOM 0 HD2 LYS B 29 30.654 -5.760 7.456 1.00 3.25 H new ATOM 0 HD3 LYS B 29 31.759 -5.836 8.815 1.00 3.25 H new ATOM 0 HE2 LYS B 29 29.160 -7.418 8.607 1.00 32.51 H new ATOM 0 HE3 LYS B 29 30.745 -8.055 8.215 1.00 32.51 H new ATOM 0 HZ1 LYS B 29 30.535 -8.749 10.351 1.00 50.55 H new ATOM 0 HZ2 LYS B 29 31.275 -7.249 10.642 1.00 50.55 H new ATOM 0 HZ3 LYS B 29 29.597 -7.419 10.835 1.00 50.55 H new ATOM 2460 N LEU B 30 27.596 -2.973 10.103 1.00 60.42 N ATOM 2461 CA LEU B 30 26.337 -3.023 9.404 1.00 43.12 C ATOM 2462 C LEU B 30 26.580 -2.911 7.895 1.00 50.11 C ATOM 2463 O LEU B 30 27.709 -2.609 7.447 1.00 72.32 O ATOM 2464 CB LEU B 30 25.359 -1.949 9.934 1.00 4.40 C ATOM 2465 CG LEU B 30 25.881 -0.502 10.074 1.00 61.23 C ATOM 2466 CD1 LEU B 30 26.904 -0.353 11.206 1.00 42.23 C ATOM 2467 CD2 LEU B 30 26.439 -0.001 8.751 1.00 52.40 C ATOM 0 H LEU B 30 28.191 -2.189 9.836 1.00 60.42 H new ATOM 0 HA LEU B 30 25.858 -3.984 9.592 1.00 43.12 H new ATOM 0 HB2 LEU B 30 24.493 -1.930 9.272 1.00 4.40 H new ATOM 0 HB3 LEU B 30 25.005 -2.273 10.913 1.00 4.40 H new ATOM 0 HG LEU B 30 25.030 0.122 10.346 1.00 61.23 H new ATOM 0 HD11 LEU B 30 27.238 0.683 11.260 1.00 42.23 H new ATOM 0 HD12 LEU B 30 26.443 -0.636 12.152 1.00 42.23 H new ATOM 0 HD13 LEU B 30 27.759 -1.000 11.011 1.00 42.23 H new ATOM 0 HD21 LEU B 30 26.801 1.020 8.872 1.00 52.40 H new ATOM 0 HD22 LEU B 30 27.262 -0.643 8.437 1.00 52.40 H new ATOM 0 HD23 LEU B 30 25.654 -0.020 7.995 1.00 52.40 H new ATOM 2479 N SER B 31 25.531 -3.151 7.119 1.00 24.22 N ATOM 2480 CA SER B 31 25.665 -3.248 5.679 1.00 21.40 C ATOM 2481 C SER B 31 24.312 -3.242 4.978 1.00 43.34 C ATOM 2482 O SER B 31 23.312 -3.709 5.529 1.00 1.33 O ATOM 2483 CB SER B 31 26.427 -4.531 5.340 1.00 62.35 C ATOM 2484 OG SER B 31 25.878 -5.647 6.026 1.00 3.34 O ATOM 0 H SER B 31 24.581 -3.281 7.466 1.00 24.22 H new ATOM 0 HA SER B 31 26.213 -2.375 5.324 1.00 21.40 H new ATOM 0 HB2 SER B 31 26.390 -4.707 4.265 1.00 62.35 H new ATOM 0 HB3 SER B 31 27.477 -4.416 5.608 1.00 62.35 H new ATOM 0 HG SER B 31 25.177 -6.056 5.477 1.00 3.34 H new ATOM 2490 N ALA B 32 24.300 -2.700 3.762 1.00 40.52 N ATOM 2491 CA ALA B 32 23.132 -2.753 2.898 1.00 75.13 C ATOM 2492 C ALA B 32 22.737 -4.212 2.636 1.00 31.44 C ATOM 2493 O ALA B 32 23.590 -5.031 2.273 1.00 42.31 O ATOM 2494 CB ALA B 32 23.422 -2.025 1.589 1.00 44.15 C ATOM 0 H ALA B 32 25.098 -2.214 3.353 1.00 40.52 H new ATOM 0 HA ALA B 32 22.296 -2.256 3.391 1.00 75.13 H new ATOM 0 HB1 ALA B 32 22.543 -2.068 0.946 1.00 44.15 H new ATOM 0 HB2 ALA B 32 23.667 -0.984 1.798 1.00 44.15 H new ATOM 0 HB3 ALA B 32 24.263 -2.502 1.086 1.00 44.15 H new ATOM 2500 N PRO B 33 21.444 -4.554 2.823 1.00 64.54 N ATOM 2501 CA PRO B 33 20.950 -5.937 2.720 1.00 71.30 C ATOM 2502 C PRO B 33 21.385 -6.650 1.436 1.00 44.54 C ATOM 2503 O PRO B 33 20.878 -6.367 0.345 1.00 60.20 O ATOM 2504 CB PRO B 33 19.423 -5.774 2.758 1.00 5.21 C ATOM 2505 CG PRO B 33 19.202 -4.512 3.518 1.00 53.32 C ATOM 2506 CD PRO B 33 20.354 -3.609 3.156 1.00 34.02 C ATOM 0 HA PRO B 33 21.352 -6.560 3.519 1.00 71.30 H new ATOM 0 HB2 PRO B 33 19.005 -5.711 1.753 1.00 5.21 H new ATOM 0 HB3 PRO B 33 18.945 -6.622 3.249 1.00 5.21 H new ATOM 0 HG2 PRO B 33 18.249 -4.056 3.251 1.00 53.32 H new ATOM 0 HG3 PRO B 33 19.175 -4.701 4.591 1.00 53.32 H new ATOM 0 HD2 PRO B 33 20.109 -2.965 2.311 1.00 34.02 H new ATOM 0 HD3 PRO B 33 20.628 -2.956 3.985 1.00 34.02 H new ATOM 2514 N ARG B 34 22.341 -7.566 1.577 1.00 0.10 N ATOM 2515 CA ARG B 34 22.760 -8.448 0.483 1.00 23.43 C ATOM 2516 C ARG B 34 21.580 -9.283 -0.021 1.00 64.55 C ATOM 2517 O ARG B 34 21.645 -9.884 -1.092 1.00 62.12 O ATOM 2518 CB ARG B 34 23.901 -9.352 0.960 1.00 33.02 C ATOM 2519 CG ARG B 34 25.127 -8.571 1.417 1.00 11.34 C ATOM 2520 CD ARG B 34 26.001 -8.104 0.258 1.00 70.25 C ATOM 2521 NE ARG B 34 26.705 -9.210 -0.386 1.00 41.11 N ATOM 2522 CZ ARG B 34 28.018 -9.226 -0.642 1.00 71.43 C ATOM 2523 NH1 ARG B 34 28.791 -8.204 -0.284 1.00 70.13 N1+ ATOM 2524 NH2 ARG B 34 28.558 -10.276 -1.245 1.00 21.32 N ATOM 0 H ARG B 34 22.847 -7.720 2.449 1.00 0.10 H new ATOM 0 HA ARG B 34 23.116 -7.839 -0.348 1.00 23.43 H new ATOM 0 HB2 ARG B 34 23.546 -9.973 1.782 1.00 33.02 H new ATOM 0 HB3 ARG B 34 24.186 -10.025 0.152 1.00 33.02 H new ATOM 0 HG2 ARG B 34 24.805 -7.704 1.994 1.00 11.34 H new ATOM 0 HG3 ARG B 34 25.721 -9.195 2.084 1.00 11.34 H new ATOM 0 HD2 ARG B 34 25.381 -7.593 -0.479 1.00 70.25 H new ATOM 0 HD3 ARG B 34 26.727 -7.377 0.623 1.00 70.25 H new ATOM 0 HE ARG B 34 26.158 -10.026 -0.659 1.00 41.11 H new ATOM 0 HH11 ARG B 34 28.384 -7.398 0.190 1.00 70.13 H new ATOM 0 HH12 ARG B 34 29.791 -8.226 -0.484 1.00 70.13 H new ATOM 0 HH21 ARG B 34 27.973 -11.068 -1.512 1.00 21.32 H new ATOM 0 HH22 ARG B 34 29.559 -10.292 -1.442 1.00 21.32 H new ATOM 2538 N GLU B 35 20.505 -9.302 0.768 1.00 42.24 N ATOM 2539 CA GLU B 35 19.241 -9.921 0.370 1.00 63.02 C ATOM 2540 C GLU B 35 18.818 -9.444 -1.016 1.00 12.03 C ATOM 2541 O GLU B 35 18.431 -10.241 -1.875 1.00 54.43 O ATOM 2542 CB GLU B 35 18.130 -9.583 1.382 1.00 72.41 C ATOM 2543 CG GLU B 35 18.280 -10.259 2.748 1.00 31.33 C ATOM 2544 CD GLU B 35 19.390 -9.662 3.610 1.00 34.33 C ATOM 2545 OE1 GLU B 35 19.080 -8.836 4.497 1.00 72.42 O ATOM 2546 OE2 GLU B 35 20.572 -10.013 3.400 1.00 24.25 O1- ATOM 0 H GLU B 35 20.486 -8.889 1.700 1.00 42.24 H new ATOM 0 HA GLU B 35 19.393 -11.000 0.347 1.00 63.02 H new ATOM 0 HB2 GLU B 35 18.106 -8.503 1.527 1.00 72.41 H new ATOM 0 HB3 GLU B 35 17.169 -9.868 0.954 1.00 72.41 H new ATOM 0 HG2 GLU B 35 17.335 -10.185 3.286 1.00 31.33 H new ATOM 0 HG3 GLU B 35 18.479 -11.320 2.598 1.00 31.33 H new ATOM 2553 N LEU B 36 18.906 -8.135 -1.225 1.00 53.04 N ATOM 2554 CA LEU B 36 18.530 -7.523 -2.497 1.00 1.52 C ATOM 2555 C LEU B 36 19.777 -7.234 -3.324 1.00 52.10 C ATOM 2556 O LEU B 36 19.734 -6.476 -4.293 1.00 30.14 O ATOM 2557 CB LEU B 36 17.757 -6.221 -2.243 1.00 63.52 C ATOM 2558 CG LEU B 36 16.523 -6.351 -1.334 1.00 20.23 C ATOM 2559 CD1 LEU B 36 15.847 -4.997 -1.156 1.00 52.43 C ATOM 2560 CD2 LEU B 36 15.539 -7.384 -1.885 1.00 15.21 C ATOM 0 H LEU B 36 19.237 -7.472 -0.524 1.00 53.04 H new ATOM 0 HA LEU B 36 17.891 -8.214 -3.048 1.00 1.52 H new ATOM 0 HB2 LEU B 36 18.438 -5.495 -1.800 1.00 63.52 H new ATOM 0 HB3 LEU B 36 17.438 -5.815 -3.203 1.00 63.52 H new ATOM 0 HG LEU B 36 16.857 -6.700 -0.357 1.00 20.23 H new ATOM 0 HD11 LEU B 36 14.976 -5.107 -0.510 1.00 52.43 H new ATOM 0 HD12 LEU B 36 16.549 -4.297 -0.702 1.00 52.43 H new ATOM 0 HD13 LEU B 36 15.532 -4.617 -2.128 1.00 52.43 H new ATOM 0 HD21 LEU B 36 14.677 -7.455 -1.222 1.00 15.21 H new ATOM 0 HD22 LEU B 36 15.209 -7.079 -2.878 1.00 15.21 H new ATOM 0 HD23 LEU B 36 16.029 -8.356 -1.948 1.00 15.21 H new ATOM 2572 N GLY B 37 20.886 -7.859 -2.937 1.00 22.45 N ATOM 2573 CA GLY B 37 22.160 -7.590 -3.572 1.00 25.41 C ATOM 2574 C GLY B 37 22.698 -6.230 -3.184 1.00 51.22 C ATOM 2575 O GLY B 37 23.184 -5.482 -4.032 1.00 30.40 O ATOM 0 H GLY B 37 20.922 -8.552 -2.189 1.00 22.45 H new ATOM 0 HA2 GLY B 37 22.878 -8.360 -3.290 1.00 25.41 H new ATOM 0 HA3 GLY B 37 22.046 -7.642 -4.655 1.00 25.41 H new ATOM 2579 N GLY B 38 22.609 -5.910 -1.891 1.00 53.33 N ATOM 2580 CA GLY B 38 23.037 -4.609 -1.407 1.00 54.12 C ATOM 2581 C GLY B 38 24.503 -4.342 -1.683 1.00 61.21 C ATOM 2582 O GLY B 38 24.927 -3.189 -1.736 1.00 64.12 O ATOM 0 H GLY B 38 22.246 -6.534 -1.170 1.00 53.33 H new ATOM 0 HA2 GLY B 38 22.434 -3.833 -1.879 1.00 54.12 H new ATOM 0 HA3 GLY B 38 22.855 -4.546 -0.334 1.00 54.12 H new ATOM 2586 N ALA B 39 25.276 -5.431 -1.797 1.00 3.10 N ATOM 2587 CA ALA B 39 26.677 -5.396 -2.158 1.00 71.25 C ATOM 2588 C ALA B 39 27.478 -4.973 -0.959 1.00 4.43 C ATOM 2589 O ALA B 39 28.695 -4.771 -1.008 1.00 31.41 O ATOM 2590 CB ALA B 39 26.856 -4.478 -3.319 1.00 12.41 C ATOM 0 H ALA B 39 24.925 -6.375 -1.635 1.00 3.10 H new ATOM 0 HA ALA B 39 27.032 -6.381 -2.461 1.00 71.25 H new ATOM 0 HB1 ALA B 39 27.909 -4.445 -3.598 1.00 12.41 H new ATOM 0 HB2 ALA B 39 26.268 -4.839 -4.163 1.00 12.41 H new ATOM 0 HB3 ALA B 39 26.522 -3.477 -3.046 1.00 12.41 H new ATOM 2596 N GLY B 40 26.738 -4.871 0.120 1.00 23.34 N ATOM 2597 CA GLY B 40 27.262 -4.492 1.379 1.00 31.44 C ATOM 2598 C GLY B 40 28.045 -5.603 2.040 1.00 1.42 C ATOM 2599 O GLY B 40 29.214 -5.824 1.727 1.00 53.13 O ATOM 0 H GLY B 40 25.735 -5.057 0.131 1.00 23.34 H new ATOM 0 HA2 GLY B 40 27.907 -3.623 1.253 1.00 31.44 H new ATOM 0 HA3 GLY B 40 26.444 -4.190 2.033 1.00 31.44 H new ATOM 2603 N ALA B 41 27.376 -6.330 2.925 1.00 13.10 N ATOM 2604 CA ALA B 41 28.001 -7.393 3.702 1.00 45.11 C ATOM 2605 C ALA B 41 26.949 -8.160 4.484 1.00 24.05 C ATOM 2606 O ALA B 41 25.750 -7.942 4.305 1.00 14.44 O ATOM 2607 CB ALA B 41 29.035 -6.817 4.660 1.00 11.53 C ATOM 0 H ALA B 41 26.384 -6.200 3.125 1.00 13.10 H new ATOM 0 HA ALA B 41 28.501 -8.073 3.012 1.00 45.11 H new ATOM 0 HB1 ALA B 41 29.491 -7.625 5.232 1.00 11.53 H new ATOM 0 HB2 ALA B 41 29.805 -6.294 4.093 1.00 11.53 H new ATOM 0 HB3 ALA B 41 28.550 -6.119 5.342 1.00 11.53 H new ATOM 2613 N GLU B 42 27.406 -9.043 5.358 1.00 15.20 N ATOM 2614 CA GLU B 42 26.519 -9.828 6.203 1.00 53.20 C ATOM 2615 C GLU B 42 26.605 -9.321 7.633 1.00 74.14 C ATOM 2616 O GLU B 42 26.919 -10.065 8.565 1.00 53.42 O ATOM 2617 CB GLU B 42 26.898 -11.303 6.104 1.00 21.14 C ATOM 2618 CG GLU B 42 27.031 -11.761 4.661 1.00 73.23 C ATOM 2619 CD GLU B 42 27.313 -13.244 4.532 1.00 72.34 C ATOM 2620 OE1 GLU B 42 28.503 -13.627 4.496 1.00 61.42 O ATOM 2621 OE2 GLU B 42 26.349 -14.035 4.464 1.00 61.14 O1- ATOM 0 H GLU B 42 28.397 -9.235 5.502 1.00 15.20 H new ATOM 0 HA GLU B 42 25.487 -9.723 5.870 1.00 53.20 H new ATOM 0 HB2 GLU B 42 27.840 -11.471 6.626 1.00 21.14 H new ATOM 0 HB3 GLU B 42 26.142 -11.906 6.608 1.00 21.14 H new ATOM 0 HG2 GLU B 42 26.112 -11.524 4.125 1.00 73.23 H new ATOM 0 HG3 GLU B 42 27.834 -11.201 4.181 1.00 73.23 H new ATOM 2628 N GLY B 43 26.358 -8.027 7.774 1.00 33.24 N ATOM 2629 CA GLY B 43 26.385 -7.381 9.074 1.00 35.43 C ATOM 2630 C GLY B 43 24.989 -7.162 9.630 1.00 2.13 C ATOM 2631 O GLY B 43 24.264 -8.124 9.893 1.00 72.12 O ATOM 0 H GLY B 43 26.136 -7.403 6.999 1.00 33.24 H new ATOM 0 HA2 GLY B 43 26.961 -7.991 9.770 1.00 35.43 H new ATOM 0 HA3 GLY B 43 26.897 -6.422 8.992 1.00 35.43 H new ATOM 2635 N THR B 44 24.613 -5.900 9.814 1.00 33.20 N ATOM 2636 CA THR B 44 23.298 -5.544 10.320 1.00 33.40 C ATOM 2637 C THR B 44 22.622 -4.579 9.346 1.00 35.03 C ATOM 2638 O THR B 44 23.298 -3.791 8.687 1.00 4.14 O ATOM 2639 CB THR B 44 23.424 -4.895 11.716 1.00 13.15 C ATOM 2640 OG1 THR B 44 24.179 -5.756 12.582 1.00 1.03 O ATOM 2641 CG2 THR B 44 22.053 -4.631 12.322 1.00 34.45 C ATOM 0 H THR B 44 25.213 -5.099 9.616 1.00 33.20 H new ATOM 0 HA THR B 44 22.690 -6.444 10.411 1.00 33.40 H new ATOM 0 HB THR B 44 23.939 -3.941 11.606 1.00 13.15 H new ATOM 0 HG1 THR B 44 24.259 -5.342 13.466 1.00 1.03 H new ATOM 0 HG21 THR B 44 22.171 -4.174 13.304 1.00 34.45 H new ATOM 0 HG22 THR B 44 21.492 -3.958 11.674 1.00 34.45 H new ATOM 0 HG23 THR B 44 21.512 -5.572 12.422 1.00 34.45 H new ATOM 2649 N ASN B 45 21.301 -4.653 9.234 1.00 4.01 N ATOM 2650 CA ASN B 45 20.568 -3.797 8.309 1.00 51.43 C ATOM 2651 C ASN B 45 20.346 -2.416 8.939 1.00 21.43 C ATOM 2652 O ASN B 45 19.991 -2.319 10.115 1.00 31.35 O ATOM 2653 CB ASN B 45 19.230 -4.447 7.923 1.00 71.14 C ATOM 2654 CG ASN B 45 19.390 -5.834 7.320 1.00 11.33 C ATOM 2655 OD1 ASN B 45 20.249 -6.620 7.732 1.00 33.20 O ATOM 2656 ND2 ASN B 45 18.562 -6.146 6.338 1.00 55.34 N ATOM 0 H ASN B 45 20.717 -5.295 9.770 1.00 4.01 H new ATOM 0 HA ASN B 45 21.155 -3.671 7.399 1.00 51.43 H new ATOM 0 HB2 ASN B 45 18.597 -4.513 8.808 1.00 71.14 H new ATOM 0 HB3 ASN B 45 18.714 -3.805 7.209 1.00 71.14 H new ATOM 0 HD21 ASN B 45 18.620 -7.062 5.894 1.00 55.34 H new ATOM 0 HD22 ASN B 45 17.865 -5.470 6.024 1.00 55.34 H new ATOM 2663 N PRO B 46 20.572 -1.330 8.166 1.00 54.41 N ATOM 2664 CA PRO B 46 20.517 0.055 8.678 1.00 2.04 C ATOM 2665 C PRO B 46 19.167 0.425 9.309 1.00 14.41 C ATOM 2666 O PRO B 46 19.103 0.828 10.479 1.00 12.32 O ATOM 2667 CB PRO B 46 20.782 0.911 7.427 1.00 21.50 C ATOM 2668 CG PRO B 46 21.489 -0.002 6.482 1.00 13.22 C ATOM 2669 CD PRO B 46 20.905 -1.366 6.728 1.00 31.44 C ATOM 0 HA PRO B 46 21.237 0.206 9.482 1.00 2.04 H new ATOM 0 HB2 PRO B 46 19.851 1.282 6.997 1.00 21.50 H new ATOM 0 HB3 PRO B 46 21.392 1.782 7.666 1.00 21.50 H new ATOM 0 HG2 PRO B 46 21.337 0.309 5.448 1.00 13.22 H new ATOM 0 HG3 PRO B 46 22.564 0.003 6.662 1.00 13.22 H new ATOM 0 HD2 PRO B 46 20.022 -1.544 6.114 1.00 31.44 H new ATOM 0 HD3 PRO B 46 21.618 -2.158 6.498 1.00 31.44 H new ATOM 2677 N GLU B 47 18.089 0.271 8.541 1.00 51.12 N ATOM 2678 CA GLU B 47 16.757 0.660 9.005 1.00 42.23 C ATOM 2679 C GLU B 47 16.306 -0.268 10.127 1.00 51.31 C ATOM 2680 O GLU B 47 15.587 0.140 11.042 1.00 51.34 O ATOM 2681 CB GLU B 47 15.732 0.682 7.844 1.00 43.35 C ATOM 2682 CG GLU B 47 16.059 -0.227 6.653 1.00 13.13 C ATOM 2683 CD GLU B 47 16.253 -1.685 7.036 1.00 41.12 C ATOM 2684 OE1 GLU B 47 15.256 -2.426 7.115 1.00 53.12 O ATOM 2685 OE2 GLU B 47 17.414 -2.086 7.263 1.00 73.03 O1- ATOM 0 H GLU B 47 18.111 -0.119 7.599 1.00 51.12 H new ATOM 0 HA GLU B 47 16.813 1.676 9.395 1.00 42.23 H new ATOM 0 HB2 GLU B 47 14.757 0.397 8.239 1.00 43.35 H new ATOM 0 HB3 GLU B 47 15.642 1.706 7.482 1.00 43.35 H new ATOM 0 HG2 GLU B 47 15.255 -0.156 5.921 1.00 13.13 H new ATOM 0 HG3 GLU B 47 16.965 0.136 6.167 1.00 13.13 H new ATOM 2692 N GLN B 48 16.761 -1.509 10.051 1.00 65.22 N ATOM 2693 CA GLN B 48 16.508 -2.501 11.084 1.00 23.21 C ATOM 2694 C GLN B 48 17.186 -2.084 12.386 1.00 44.13 C ATOM 2695 O GLN B 48 16.619 -2.220 13.476 1.00 15.51 O ATOM 2696 CB GLN B 48 17.043 -3.858 10.621 1.00 21.32 C ATOM 2697 CG GLN B 48 16.677 -5.026 11.523 1.00 64.34 C ATOM 2698 CD GLN B 48 17.143 -6.350 10.950 1.00 23.41 C ATOM 2699 OE1 GLN B 48 18.162 -6.423 10.262 1.00 3.40 O ATOM 2700 NE2 GLN B 48 16.389 -7.402 11.206 1.00 12.54 N ATOM 0 H GLN B 48 17.317 -1.857 9.270 1.00 65.22 H new ATOM 0 HA GLN B 48 15.435 -2.577 11.261 1.00 23.21 H new ATOM 0 HB2 GLN B 48 16.666 -4.059 9.618 1.00 21.32 H new ATOM 0 HB3 GLN B 48 18.129 -3.799 10.548 1.00 21.32 H new ATOM 0 HG2 GLN B 48 17.123 -4.879 12.507 1.00 64.34 H new ATOM 0 HG3 GLN B 48 15.596 -5.051 11.664 1.00 64.34 H new ATOM 0 HE21 GLN B 48 15.552 -7.302 11.780 1.00 12.54 H new ATOM 0 HE22 GLN B 48 16.643 -8.315 10.830 1.00 12.54 H new ATOM 2709 N LEU B 49 18.402 -1.562 12.256 1.00 25.52 N ATOM 2710 CA LEU B 49 19.184 -1.110 13.399 1.00 12.42 C ATOM 2711 C LEU B 49 18.476 0.065 14.072 1.00 73.15 C ATOM 2712 O LEU B 49 18.292 0.071 15.291 1.00 22.33 O ATOM 2713 CB LEU B 49 20.609 -0.726 12.941 1.00 25.41 C ATOM 2714 CG LEU B 49 21.666 -0.503 14.050 1.00 55.21 C ATOM 2715 CD1 LEU B 49 21.467 0.832 14.768 1.00 20.42 C ATOM 2716 CD2 LEU B 49 21.649 -1.655 15.054 1.00 31.54 C ATOM 0 H LEU B 49 18.871 -1.441 11.358 1.00 25.52 H new ATOM 0 HA LEU B 49 19.273 -1.915 14.128 1.00 12.42 H new ATOM 0 HB2 LEU B 49 20.974 -1.509 12.277 1.00 25.41 H new ATOM 0 HB3 LEU B 49 20.541 0.187 12.349 1.00 25.41 H new ATOM 0 HG LEU B 49 22.641 -0.474 13.564 1.00 55.21 H new ATOM 0 HD11 LEU B 49 22.230 0.948 15.538 1.00 20.42 H new ATOM 0 HD12 LEU B 49 21.550 1.647 14.049 1.00 20.42 H new ATOM 0 HD13 LEU B 49 20.480 0.853 15.229 1.00 20.42 H new ATOM 0 HD21 LEU B 49 22.400 -1.477 15.824 1.00 31.54 H new ATOM 0 HD22 LEU B 49 20.664 -1.721 15.516 1.00 31.54 H new ATOM 0 HD23 LEU B 49 21.872 -2.590 14.539 1.00 31.54 H new ATOM 2728 N PHE B 50 18.070 1.052 13.269 1.00 74.53 N ATOM 2729 CA PHE B 50 17.333 2.205 13.792 1.00 13.24 C ATOM 2730 C PHE B 50 16.037 1.754 14.462 1.00 54.12 C ATOM 2731 O PHE B 50 15.719 2.200 15.559 1.00 20.22 O ATOM 2732 CB PHE B 50 17.032 3.230 12.681 1.00 14.34 C ATOM 2733 CG PHE B 50 16.010 4.283 13.076 1.00 61.31 C ATOM 2734 CD1 PHE B 50 16.294 5.242 14.047 1.00 53.13 C ATOM 2735 CD2 PHE B 50 14.760 4.307 12.474 1.00 53.22 C ATOM 2736 CE1 PHE B 50 15.351 6.188 14.403 1.00 14.14 C ATOM 2737 CE2 PHE B 50 13.818 5.254 12.827 1.00 22.12 C ATOM 2738 CZ PHE B 50 14.112 6.193 13.794 1.00 62.30 C ATOM 0 H PHE B 50 18.237 1.076 12.263 1.00 74.53 H new ATOM 0 HA PHE B 50 17.963 2.691 14.537 1.00 13.24 H new ATOM 0 HB2 PHE B 50 17.960 3.727 12.397 1.00 14.34 H new ATOM 0 HB3 PHE B 50 16.671 2.700 11.799 1.00 14.34 H new ATOM 0 HD1 PHE B 50 17.262 5.246 14.527 1.00 53.13 H new ATOM 0 HD2 PHE B 50 14.520 3.574 11.718 1.00 53.22 H new ATOM 0 HE1 PHE B 50 15.584 6.924 15.158 1.00 14.14 H new ATOM 0 HE2 PHE B 50 12.851 5.259 12.346 1.00 22.12 H new ATOM 0 HZ PHE B 50 13.374 6.931 14.074 1.00 62.30 H new ATOM 2748 N ALA B 51 15.300 0.865 13.800 1.00 24.13 N ATOM 2749 CA ALA B 51 14.024 0.372 14.323 1.00 31.22 C ATOM 2750 C ALA B 51 14.195 -0.255 15.709 1.00 63.22 C ATOM 2751 O ALA B 51 13.499 0.116 16.662 1.00 61.14 O ATOM 2752 CB ALA B 51 13.410 -0.636 13.355 1.00 4.33 C ATOM 0 H ALA B 51 15.564 0.469 12.898 1.00 24.13 H new ATOM 0 HA ALA B 51 13.350 1.223 14.423 1.00 31.22 H new ATOM 0 HB1 ALA B 51 12.462 -0.995 13.756 1.00 4.33 H new ATOM 0 HB2 ALA B 51 13.238 -0.157 12.391 1.00 4.33 H new ATOM 0 HB3 ALA B 51 14.091 -1.477 13.226 1.00 4.33 H new ATOM 2758 N ALA B 52 15.126 -1.197 15.813 1.00 2.41 N ATOM 2759 CA ALA B 52 15.408 -1.880 17.073 1.00 55.02 C ATOM 2760 C ALA B 52 15.842 -0.886 18.151 1.00 53.11 C ATOM 2761 O ALA B 52 15.276 -0.853 19.245 1.00 74.31 O ATOM 2762 CB ALA B 52 16.480 -2.947 16.868 1.00 43.35 C ATOM 0 H ALA B 52 15.704 -1.508 15.032 1.00 2.41 H new ATOM 0 HA ALA B 52 14.491 -2.364 17.410 1.00 55.02 H new ATOM 0 HB1 ALA B 52 16.680 -3.448 17.815 1.00 43.35 H new ATOM 0 HB2 ALA B 52 16.132 -3.677 16.138 1.00 43.35 H new ATOM 0 HB3 ALA B 52 17.395 -2.479 16.505 1.00 43.35 H new ATOM 2768 N GLY B 53 16.839 -0.067 17.825 1.00 41.34 N ATOM 2769 CA GLY B 53 17.353 0.906 18.775 1.00 4.13 C ATOM 2770 C GLY B 53 16.300 1.913 19.199 1.00 15.42 C ATOM 2771 O GLY B 53 16.240 2.307 20.362 1.00 73.22 O ATOM 0 H GLY B 53 17.302 -0.060 16.916 1.00 41.34 H new ATOM 0 HA2 GLY B 53 17.730 0.386 19.656 1.00 4.13 H new ATOM 0 HA3 GLY B 53 18.197 1.433 18.330 1.00 4.13 H new ATOM 2775 N TYR B 54 15.467 2.318 18.247 1.00 15.35 N ATOM 2776 CA TYR B 54 14.396 3.273 18.495 1.00 21.24 C ATOM 2777 C TYR B 54 13.359 2.684 19.448 1.00 2.44 C ATOM 2778 O TYR B 54 13.016 3.305 20.450 1.00 55.40 O ATOM 2779 CB TYR B 54 13.748 3.685 17.159 1.00 22.10 C ATOM 2780 CG TYR B 54 12.463 4.490 17.282 1.00 24.43 C ATOM 2781 CD1 TYR B 54 12.226 5.322 18.373 1.00 33.43 C ATOM 2782 CD2 TYR B 54 11.484 4.409 16.297 1.00 20.22 C ATOM 2783 CE1 TYR B 54 11.054 6.043 18.479 1.00 54.12 C ATOM 2784 CE2 TYR B 54 10.316 5.130 16.395 1.00 11.21 C ATOM 2785 CZ TYR B 54 10.103 5.942 17.488 1.00 15.31 C ATOM 2786 OH TYR B 54 8.932 6.649 17.595 1.00 73.14 O ATOM 0 H TYR B 54 15.516 1.993 17.282 1.00 15.35 H new ATOM 0 HA TYR B 54 14.814 4.161 18.969 1.00 21.24 H new ATOM 0 HB2 TYR B 54 14.470 4.269 16.588 1.00 22.10 H new ATOM 0 HB3 TYR B 54 13.539 2.784 16.582 1.00 22.10 H new ATOM 0 HD1 TYR B 54 12.972 5.405 19.150 1.00 33.43 H new ATOM 0 HD2 TYR B 54 11.643 3.770 15.441 1.00 20.22 H new ATOM 0 HE1 TYR B 54 10.884 6.682 19.333 1.00 54.12 H new ATOM 0 HE2 TYR B 54 9.569 5.060 15.618 1.00 11.21 H new ATOM 0 HH TYR B 54 8.256 6.096 18.040 1.00 73.14 H new ATOM 2796 N SER B 55 12.871 1.490 19.135 1.00 62.44 N ATOM 2797 CA SER B 55 11.862 0.840 19.966 1.00 11.44 C ATOM 2798 C SER B 55 12.384 0.651 21.393 1.00 45.34 C ATOM 2799 O SER B 55 11.711 1.004 22.366 1.00 23.33 O ATOM 2800 CB SER B 55 11.444 -0.499 19.345 1.00 71.55 C ATOM 2801 OG SER B 55 12.572 -1.292 19.011 1.00 22.42 O ATOM 0 H SER B 55 13.155 0.953 18.316 1.00 62.44 H new ATOM 0 HA SER B 55 10.981 1.479 20.015 1.00 11.44 H new ATOM 0 HB2 SER B 55 10.810 -1.043 20.044 1.00 71.55 H new ATOM 0 HB3 SER B 55 10.849 -0.316 18.450 1.00 71.55 H new ATOM 0 HG SER B 55 12.946 -0.987 18.158 1.00 22.42 H new ATOM 2807 N ALA B 56 13.605 0.130 21.502 1.00 72.32 N ATOM 2808 CA ALA B 56 14.247 -0.066 22.798 1.00 72.14 C ATOM 2809 C ALA B 56 14.438 1.269 23.520 1.00 34.31 C ATOM 2810 O ALA B 56 14.224 1.372 24.731 1.00 51.54 O ATOM 2811 CB ALA B 56 15.582 -0.774 22.616 1.00 11.32 C ATOM 0 H ALA B 56 14.170 -0.164 20.705 1.00 72.32 H new ATOM 0 HA ALA B 56 13.600 -0.690 23.415 1.00 72.14 H new ATOM 0 HB1 ALA B 56 16.054 -0.916 23.588 1.00 11.32 H new ATOM 0 HB2 ALA B 56 15.418 -1.744 22.147 1.00 11.32 H new ATOM 0 HB3 ALA B 56 16.231 -0.169 21.982 1.00 11.32 H new ATOM 2817 N CYS B 57 14.828 2.291 22.764 1.00 24.02 N ATOM 2818 CA CYS B 57 15.022 3.631 23.313 1.00 54.22 C ATOM 2819 C CYS B 57 13.691 4.195 23.794 1.00 22.14 C ATOM 2820 O CYS B 57 13.624 4.890 24.811 1.00 1.03 O ATOM 2821 CB CYS B 57 15.642 4.561 22.261 1.00 72.40 C ATOM 2822 SG CYS B 57 15.964 6.242 22.847 1.00 42.35 S ATOM 0 H CYS B 57 15.017 2.217 21.764 1.00 24.02 H new ATOM 0 HA CYS B 57 15.706 3.564 24.159 1.00 54.22 H new ATOM 0 HB2 CYS B 57 16.579 4.124 21.915 1.00 72.40 H new ATOM 0 HB3 CYS B 57 14.976 4.611 21.400 1.00 72.40 H new ATOM 0 HG CYS B 57 16.488 6.944 21.886 1.00 42.35 H new ATOM 2828 N PHE B 58 12.630 3.878 23.059 1.00 34.03 N ATOM 2829 CA PHE B 58 11.305 4.395 23.352 1.00 42.11 C ATOM 2830 C PHE B 58 10.786 3.786 24.650 1.00 1.15 C ATOM 2831 O PHE B 58 10.023 4.415 25.387 1.00 52.32 O ATOM 2832 CB PHE B 58 10.349 4.089 22.191 1.00 13.13 C ATOM 2833 CG PHE B 58 9.058 4.855 22.269 1.00 50.11 C ATOM 2834 CD1 PHE B 58 7.912 4.277 22.800 1.00 2.44 C ATOM 2835 CD2 PHE B 58 8.999 6.165 21.820 1.00 25.34 C ATOM 2836 CE1 PHE B 58 6.736 4.994 22.884 1.00 5.05 C ATOM 2837 CE2 PHE B 58 7.824 6.883 21.901 1.00 25.32 C ATOM 2838 CZ PHE B 58 6.692 6.298 22.433 1.00 52.03 C ATOM 0 H PHE B 58 12.667 3.259 22.249 1.00 34.03 H new ATOM 0 HA PHE B 58 11.363 5.477 23.473 1.00 42.11 H new ATOM 0 HB2 PHE B 58 10.846 4.322 21.249 1.00 13.13 H new ATOM 0 HB3 PHE B 58 10.130 3.021 22.181 1.00 13.13 H new ATOM 0 HD1 PHE B 58 7.942 3.256 23.151 1.00 2.44 H new ATOM 0 HD2 PHE B 58 9.881 6.628 21.403 1.00 25.34 H new ATOM 0 HE1 PHE B 58 5.852 4.536 23.302 1.00 5.05 H new ATOM 0 HE2 PHE B 58 7.789 7.903 21.548 1.00 25.32 H new ATOM 0 HZ PHE B 58 5.772 6.861 22.496 1.00 52.03 H new ATOM 2848 N LEU B 59 11.221 2.560 24.921 1.00 60.43 N ATOM 2849 CA LEU B 59 10.868 1.867 26.153 1.00 11.12 C ATOM 2850 C LEU B 59 11.408 2.665 27.349 1.00 60.54 C ATOM 2851 O LEU B 59 10.662 3.002 28.273 1.00 64.41 O ATOM 2852 CB LEU B 59 11.443 0.434 26.126 1.00 33.41 C ATOM 2853 CG LEU B 59 10.763 -0.601 27.048 1.00 23.42 C ATOM 2854 CD1 LEU B 59 10.976 -0.267 28.521 1.00 12.45 C ATOM 2855 CD2 LEU B 59 9.272 -0.716 26.727 1.00 24.24 C ATOM 0 H LEU B 59 11.824 2.023 24.298 1.00 60.43 H new ATOM 0 HA LEU B 59 9.785 1.792 26.248 1.00 11.12 H new ATOM 0 HB2 LEU B 59 11.390 0.065 25.102 1.00 33.41 H new ATOM 0 HB3 LEU B 59 12.499 0.485 26.392 1.00 33.41 H new ATOM 0 HG LEU B 59 11.231 -1.567 26.860 1.00 23.42 H new ATOM 0 HD11 LEU B 59 10.483 -1.017 29.139 1.00 12.45 H new ATOM 0 HD12 LEU B 59 12.043 -0.259 28.742 1.00 12.45 H new ATOM 0 HD13 LEU B 59 10.554 0.715 28.736 1.00 12.45 H new ATOM 0 HD21 LEU B 59 8.813 -1.451 27.389 1.00 24.24 H new ATOM 0 HD22 LEU B 59 8.793 0.252 26.872 1.00 24.24 H new ATOM 0 HD23 LEU B 59 9.146 -1.032 25.691 1.00 24.24 H new ATOM 2867 N SER B 60 12.702 2.981 27.304 1.00 44.21 N ATOM 2868 CA SER B 60 13.348 3.789 28.341 1.00 2.40 C ATOM 2869 C SER B 60 12.698 5.175 28.411 1.00 73.23 C ATOM 2870 O SER B 60 12.426 5.707 29.500 1.00 65.55 O ATOM 2871 CB SER B 60 14.852 3.912 28.050 1.00 63.24 C ATOM 2872 OG SER B 60 15.516 4.680 29.039 1.00 24.13 O ATOM 0 H SER B 60 13.329 2.688 26.555 1.00 44.21 H new ATOM 0 HA SER B 60 13.219 3.299 29.306 1.00 2.40 H new ATOM 0 HB2 SER B 60 15.296 2.918 28.002 1.00 63.24 H new ATOM 0 HB3 SER B 60 14.997 4.373 27.073 1.00 63.24 H new ATOM 0 HG SER B 60 15.858 4.086 29.739 1.00 24.13 H new ATOM 2878 N ALA B 61 12.423 5.746 27.239 1.00 21.42 N ATOM 2879 CA ALA B 61 11.748 7.034 27.155 1.00 31.00 C ATOM 2880 C ALA B 61 10.439 6.995 27.934 1.00 42.41 C ATOM 2881 O ALA B 61 10.153 7.896 28.718 1.00 44.10 O ATOM 2882 CB ALA B 61 11.496 7.416 25.701 1.00 4.34 C ATOM 0 H ALA B 61 12.659 5.334 26.336 1.00 21.42 H new ATOM 0 HA ALA B 61 12.393 7.793 27.598 1.00 31.00 H new ATOM 0 HB1 ALA B 61 10.991 8.381 25.661 1.00 4.34 H new ATOM 0 HB2 ALA B 61 12.447 7.482 25.172 1.00 4.34 H new ATOM 0 HB3 ALA B 61 10.870 6.659 25.229 1.00 4.34 H new ATOM 2888 N MET B 62 9.666 5.925 27.743 1.00 64.12 N ATOM 2889 CA MET B 62 8.394 5.767 28.444 1.00 62.41 C ATOM 2890 C MET B 62 8.609 5.459 29.920 1.00 51.11 C ATOM 2891 O MET B 62 7.736 5.734 30.739 1.00 53.32 O ATOM 2892 CB MET B 62 7.518 4.682 27.804 1.00 4.11 C ATOM 2893 CG MET B 62 6.883 5.100 26.484 1.00 71.00 C ATOM 2894 SD MET B 62 5.311 4.265 26.190 1.00 51.43 S ATOM 2895 CE MET B 62 4.358 4.845 27.597 1.00 33.40 C ATOM 0 H MET B 62 9.898 5.159 27.111 1.00 64.12 H new ATOM 0 HA MET B 62 7.870 6.719 28.358 1.00 62.41 H new ATOM 0 HB2 MET B 62 8.124 3.791 27.638 1.00 4.11 H new ATOM 0 HB3 MET B 62 6.729 4.406 28.504 1.00 4.11 H new ATOM 0 HG2 MET B 62 6.725 6.179 26.484 1.00 71.00 H new ATOM 0 HG3 MET B 62 7.569 4.878 25.666 1.00 71.00 H new ATOM 0 HE1 MET B 62 4.148 4.009 28.264 1.00 33.40 H new ATOM 0 HE2 MET B 62 4.928 5.603 28.135 1.00 33.40 H new ATOM 0 HE3 MET B 62 3.420 5.276 27.248 1.00 33.40 H new ATOM 2905 N LYS B 63 9.761 4.884 30.260 1.00 72.03 N ATOM 2906 CA LYS B 63 10.122 4.692 31.662 1.00 43.00 C ATOM 2907 C LYS B 63 10.197 6.053 32.347 1.00 70.35 C ATOM 2908 O LYS B 63 9.628 6.256 33.422 1.00 23.43 O ATOM 2909 CB LYS B 63 11.467 3.960 31.797 1.00 31.31 C ATOM 2910 CG LYS B 63 11.436 2.489 31.382 1.00 20.13 C ATOM 2911 CD LYS B 63 10.662 1.624 32.377 1.00 10.22 C ATOM 2912 CE LYS B 63 10.716 0.146 32.002 1.00 1.23 C ATOM 2913 NZ LYS B 63 10.070 -0.716 33.028 1.00 55.13 N1+ ATOM 0 H LYS B 63 10.453 4.546 29.592 1.00 72.03 H new ATOM 0 HA LYS B 63 9.360 4.076 32.138 1.00 43.00 H new ATOM 0 HB2 LYS B 63 12.210 4.479 31.192 1.00 31.31 H new ATOM 0 HB3 LYS B 63 11.798 4.025 32.833 1.00 31.31 H new ATOM 0 HG2 LYS B 63 10.980 2.401 30.396 1.00 20.13 H new ATOM 0 HG3 LYS B 63 12.457 2.116 31.296 1.00 20.13 H new ATOM 0 HD2 LYS B 63 11.075 1.761 33.376 1.00 10.22 H new ATOM 0 HD3 LYS B 63 9.623 1.952 32.413 1.00 10.22 H new ATOM 0 HE2 LYS B 63 10.222 -0.002 31.042 1.00 1.23 H new ATOM 0 HE3 LYS B 63 11.755 -0.158 31.876 1.00 1.23 H new ATOM 0 HZ1 LYS B 63 10.130 -1.711 32.733 1.00 55.13 H new ATOM 0 HZ2 LYS B 63 10.557 -0.595 33.939 1.00 55.13 H new ATOM 0 HZ3 LYS B 63 9.071 -0.445 33.131 1.00 55.13 H new ATOM 2927 N PHE B 64 10.891 6.990 31.701 1.00 21.33 N ATOM 2928 CA PHE B 64 10.989 8.357 32.212 1.00 32.24 C ATOM 2929 C PHE B 64 9.633 9.070 32.131 1.00 14.21 C ATOM 2930 O PHE B 64 9.210 9.732 33.084 1.00 73.11 O ATOM 2931 CB PHE B 64 12.055 9.155 31.442 1.00 30.41 C ATOM 2932 CG PHE B 64 12.192 10.585 31.916 1.00 63.34 C ATOM 2933 CD1 PHE B 64 12.383 10.866 33.264 1.00 43.42 C ATOM 2934 CD2 PHE B 64 12.124 11.645 31.021 1.00 31.33 C ATOM 2935 CE1 PHE B 64 12.497 12.172 33.706 1.00 55.11 C ATOM 2936 CE2 PHE B 64 12.240 12.952 31.460 1.00 33.41 C ATOM 2937 CZ PHE B 64 12.425 13.214 32.804 1.00 14.04 C ATOM 0 H PHE B 64 11.391 6.829 30.827 1.00 21.33 H new ATOM 0 HA PHE B 64 11.288 8.300 33.259 1.00 32.24 H new ATOM 0 HB2 PHE B 64 13.017 8.653 31.542 1.00 30.41 H new ATOM 0 HB3 PHE B 64 11.804 9.154 30.381 1.00 30.41 H new ATOM 0 HD1 PHE B 64 12.443 10.055 33.975 1.00 43.42 H new ATOM 0 HD2 PHE B 64 11.979 11.447 29.969 1.00 31.33 H new ATOM 0 HE1 PHE B 64 12.642 12.376 34.757 1.00 55.11 H new ATOM 0 HE2 PHE B 64 12.186 13.767 30.753 1.00 33.41 H new ATOM 0 HZ PHE B 64 12.513 14.234 33.148 1.00 14.04 H new ATOM 2947 N VAL B 65 8.953 8.923 30.995 1.00 75.05 N ATOM 2948 CA VAL B 65 7.651 9.555 30.780 1.00 40.30 C ATOM 2949 C VAL B 65 6.664 9.147 31.871 1.00 43.44 C ATOM 2950 O VAL B 65 6.037 9.997 32.506 1.00 35.52 O ATOM 2951 CB VAL B 65 7.067 9.198 29.386 1.00 54.45 C ATOM 2952 CG1 VAL B 65 5.600 9.609 29.283 1.00 70.43 C ATOM 2953 CG2 VAL B 65 7.888 9.855 28.276 1.00 51.21 C ATOM 0 H VAL B 65 9.284 8.369 30.205 1.00 75.05 H new ATOM 0 HA VAL B 65 7.805 10.633 30.822 1.00 40.30 H new ATOM 0 HB VAL B 65 7.123 8.116 29.265 1.00 54.45 H new ATOM 0 HG11 VAL B 65 5.217 9.347 28.297 1.00 70.43 H new ATOM 0 HG12 VAL B 65 5.022 9.089 30.047 1.00 70.43 H new ATOM 0 HG13 VAL B 65 5.512 10.685 29.432 1.00 70.43 H new ATOM 0 HG21 VAL B 65 7.464 9.594 27.306 1.00 51.21 H new ATOM 0 HG22 VAL B 65 7.868 10.938 28.401 1.00 51.21 H new ATOM 0 HG23 VAL B 65 8.918 9.503 28.328 1.00 51.21 H new ATOM 2963 N ALA B 66 6.551 7.851 32.103 1.00 30.22 N ATOM 2964 CA ALA B 66 5.650 7.331 33.121 1.00 74.13 C ATOM 2965 C ALA B 66 5.970 7.947 34.483 1.00 44.35 C ATOM 2966 O ALA B 66 5.073 8.208 35.288 1.00 34.23 O ATOM 2967 CB ALA B 66 5.739 5.809 33.171 1.00 23.44 C ATOM 0 H ALA B 66 7.074 7.135 31.599 1.00 30.22 H new ATOM 0 HA ALA B 66 4.627 7.605 32.862 1.00 74.13 H new ATOM 0 HB1 ALA B 66 5.061 5.430 33.936 1.00 23.44 H new ATOM 0 HB2 ALA B 66 5.460 5.396 32.202 1.00 23.44 H new ATOM 0 HB3 ALA B 66 6.760 5.512 33.411 1.00 23.44 H new ATOM 2973 N GLY B 67 7.251 8.231 34.700 1.00 23.35 N ATOM 2974 CA GLY B 67 7.699 8.789 35.963 1.00 73.24 C ATOM 2975 C GLY B 67 7.224 10.216 36.160 1.00 45.13 C ATOM 2976 O GLY B 67 6.866 10.614 37.272 1.00 75.04 O ATOM 0 H GLY B 67 7.993 8.083 34.016 1.00 23.35 H new ATOM 0 HA2 GLY B 67 7.333 8.170 36.782 1.00 73.24 H new ATOM 0 HA3 GLY B 67 8.788 8.761 36.005 1.00 73.24 H new ATOM 2980 N GLN B 68 7.174 10.976 35.069 1.00 2.12 N ATOM 2981 CA GLN B 68 6.800 12.389 35.130 1.00 44.13 C ATOM 2982 C GLN B 68 5.300 12.523 34.929 1.00 40.32 C ATOM 2983 O GLN B 68 4.712 13.577 35.173 1.00 64.50 O ATOM 2984 CB GLN B 68 7.558 13.198 34.066 1.00 33.05 C ATOM 2985 CG GLN B 68 7.407 12.642 32.656 1.00 52.44 C ATOM 2986 CD GLN B 68 7.975 13.553 31.582 1.00 54.32 C ATOM 2987 OE1 GLN B 68 7.481 13.579 30.453 1.00 53.51 O ATOM 2988 NE2 GLN B 68 9.021 14.298 31.914 1.00 53.21 N ATOM 0 H GLN B 68 7.388 10.638 34.131 1.00 2.12 H new ATOM 0 HA GLN B 68 7.069 12.786 36.109 1.00 44.13 H new ATOM 0 HB2 GLN B 68 7.201 14.228 34.082 1.00 33.05 H new ATOM 0 HB3 GLN B 68 8.616 13.223 34.326 1.00 33.05 H new ATOM 0 HG2 GLN B 68 7.905 11.674 32.600 1.00 52.44 H new ATOM 0 HG3 GLN B 68 6.350 12.469 32.453 1.00 52.44 H new ATOM 0 HE21 GLN B 68 9.402 14.250 32.859 1.00 53.21 H new ATOM 0 HE22 GLN B 68 9.444 14.919 31.225 1.00 53.21 H new ATOM 2997 N ASN B 69 4.695 11.437 34.469 1.00 21.43 N ATOM 2998 CA ASN B 69 3.253 11.354 34.291 1.00 41.54 C ATOM 2999 C ASN B 69 2.593 10.712 35.511 1.00 23.00 C ATOM 3000 O ASN B 69 1.377 10.516 35.534 1.00 34.41 O ATOM 3001 CB ASN B 69 2.936 10.570 33.012 1.00 65.13 C ATOM 3002 CG ASN B 69 2.991 11.446 31.767 1.00 21.52 C ATOM 3003 OD1 ASN B 69 1.976 11.978 31.317 1.00 65.21 O ATOM 3004 ND2 ASN B 69 4.178 11.619 31.213 1.00 45.52 N ATOM 0 H ASN B 69 5.193 10.586 34.208 1.00 21.43 H new ATOM 0 HA ASN B 69 2.847 12.361 34.192 1.00 41.54 H new ATOM 0 HB2 ASN B 69 3.645 9.749 32.907 1.00 65.13 H new ATOM 0 HB3 ASN B 69 1.944 10.126 33.097 1.00 65.13 H new ATOM 0 HD21 ASN B 69 4.274 12.209 30.386 1.00 45.52 H new ATOM 0 HD22 ASN B 69 4.998 11.163 31.612 1.00 45.52 H new ATOM 3011 N LYS B 70 3.416 10.392 36.518 1.00 4.22 N ATOM 3012 CA LYS B 70 2.942 9.867 37.804 1.00 71.04 C ATOM 3013 C LYS B 70 2.195 8.542 37.628 1.00 55.13 C ATOM 3014 O LYS B 70 1.362 8.161 38.457 1.00 71.33 O ATOM 3015 CB LYS B 70 2.061 10.910 38.526 1.00 43.15 C ATOM 3016 CG LYS B 70 2.852 12.008 39.248 1.00 61.50 C ATOM 3017 CD LYS B 70 3.964 12.588 38.376 1.00 21.25 C ATOM 3018 CE LYS B 70 4.535 13.885 38.946 1.00 20.34 C ATOM 3019 NZ LYS B 70 5.135 13.698 40.295 1.00 73.12 N1+ ATOM 0 H LYS B 70 4.430 10.490 36.463 1.00 4.22 H new ATOM 0 HA LYS B 70 3.815 9.668 38.426 1.00 71.04 H new ATOM 0 HB2 LYS B 70 1.397 11.375 37.797 1.00 43.15 H new ATOM 0 HB3 LYS B 70 1.429 10.396 39.251 1.00 43.15 H new ATOM 0 HG2 LYS B 70 2.172 12.807 39.546 1.00 61.50 H new ATOM 0 HG3 LYS B 70 3.285 11.600 40.162 1.00 61.50 H new ATOM 0 HD2 LYS B 70 4.764 11.855 38.277 1.00 21.25 H new ATOM 0 HD3 LYS B 70 3.577 12.774 37.374 1.00 21.25 H new ATOM 0 HE2 LYS B 70 5.292 14.275 38.266 1.00 20.34 H new ATOM 0 HE3 LYS B 70 3.744 14.632 39.004 1.00 20.34 H new ATOM 0 HZ1 LYS B 70 5.538 14.599 40.624 1.00 73.12 H new ATOM 0 HZ2 LYS B 70 4.401 13.384 40.961 1.00 73.12 H new ATOM 0 HZ3 LYS B 70 5.886 12.981 40.244 1.00 73.12 H new ATOM 3033 N GLN B 71 2.532 7.828 36.560 1.00 41.03 N ATOM 3034 CA GLN B 71 1.920 6.538 36.254 1.00 14.44 C ATOM 3035 C GLN B 71 2.978 5.438 36.272 1.00 73.31 C ATOM 3036 O GLN B 71 4.175 5.717 36.250 1.00 34.15 O ATOM 3037 CB GLN B 71 1.231 6.580 34.884 1.00 1.40 C ATOM 3038 CG GLN B 71 2.131 7.103 33.771 1.00 33.32 C ATOM 3039 CD GLN B 71 1.808 6.520 32.411 1.00 34.04 C ATOM 3040 OE1 GLN B 71 2.530 5.477 32.051 1.00 74.24 O flip ATOM 3041 NE2 GLN B 71 0.954 7.022 31.684 1.00 0.43 N flip ATOM 0 H GLN B 71 3.235 8.125 35.883 1.00 41.03 H new ATOM 0 HA GLN B 71 1.169 6.323 37.014 1.00 14.44 H new ATOM 0 HB2 GLN B 71 0.891 5.577 34.625 1.00 1.40 H new ATOM 0 HB3 GLN B 71 0.344 7.210 34.951 1.00 1.40 H new ATOM 0 HG2 GLN B 71 2.043 8.188 33.723 1.00 33.32 H new ATOM 0 HG3 GLN B 71 3.169 6.878 34.017 1.00 33.32 H new ATOM 0 HE21 GLN B 71 0.420 7.829 32.007 1.00 0.43 H new ATOM 0 HE22 GLN B 71 0.779 6.632 30.758 1.00 0.43 H new ATOM 3050 N THR B 72 2.531 4.191 36.306 1.00 1.35 N ATOM 3051 CA THR B 72 3.431 3.045 36.312 1.00 51.41 C ATOM 3052 C THR B 72 3.164 2.149 35.110 1.00 74.12 C ATOM 3053 O THR B 72 2.013 1.966 34.704 1.00 25.05 O ATOM 3054 CB THR B 72 3.275 2.217 37.608 1.00 13.02 C ATOM 3055 OG1 THR B 72 1.893 1.889 37.812 1.00 4.22 O ATOM 3056 CG2 THR B 72 3.807 2.981 38.817 1.00 71.50 C ATOM 0 H THR B 72 1.541 3.945 36.330 1.00 1.35 H new ATOM 0 HA THR B 72 4.450 3.430 36.261 1.00 51.41 H new ATOM 0 HB THR B 72 3.857 1.302 37.499 1.00 13.02 H new ATOM 0 HG1 THR B 72 1.799 1.363 38.633 1.00 4.22 H new ATOM 0 HG21 THR B 72 3.684 2.374 39.714 1.00 71.50 H new ATOM 0 HG22 THR B 72 4.864 3.203 38.671 1.00 71.50 H new ATOM 0 HG23 THR B 72 3.253 3.913 38.931 1.00 71.50 H new ATOM 3064 N LEU B 73 4.229 1.616 34.529 1.00 74.12 N ATOM 3065 CA LEU B 73 4.121 0.694 33.406 1.00 52.35 C ATOM 3066 C LEU B 73 4.505 -0.716 33.849 1.00 64.24 C ATOM 3067 O LEU B 73 5.477 -0.889 34.590 1.00 14.14 O ATOM 3068 CB LEU B 73 5.021 1.160 32.253 1.00 75.15 C ATOM 3069 CG LEU B 73 4.651 2.518 31.645 1.00 62.34 C ATOM 3070 CD1 LEU B 73 5.671 2.928 30.589 1.00 33.12 C ATOM 3071 CD2 LEU B 73 3.243 2.478 31.054 1.00 51.14 C ATOM 0 H LEU B 73 5.187 1.808 34.820 1.00 74.12 H new ATOM 0 HA LEU B 73 3.089 0.679 33.055 1.00 52.35 H new ATOM 0 HB2 LEU B 73 6.049 1.209 32.612 1.00 75.15 H new ATOM 0 HB3 LEU B 73 4.994 0.407 31.465 1.00 75.15 H new ATOM 0 HG LEU B 73 4.664 3.265 32.439 1.00 62.34 H new ATOM 0 HD11 LEU B 73 5.391 3.894 30.169 1.00 33.12 H new ATOM 0 HD12 LEU B 73 6.658 3.003 31.046 1.00 33.12 H new ATOM 0 HD13 LEU B 73 5.694 2.181 29.796 1.00 33.12 H new ATOM 0 HD21 LEU B 73 3.000 3.451 30.628 1.00 51.14 H new ATOM 0 HD22 LEU B 73 3.197 1.718 30.274 1.00 51.14 H new ATOM 0 HD23 LEU B 73 2.526 2.236 31.838 1.00 51.14 H new ATOM 3083 N PRO B 74 3.748 -1.738 33.410 1.00 22.31 N ATOM 3084 CA PRO B 74 4.043 -3.140 33.732 1.00 33.15 C ATOM 3085 C PRO B 74 5.395 -3.584 33.171 1.00 51.21 C ATOM 3086 O PRO B 74 5.858 -3.064 32.158 1.00 62.01 O ATOM 3087 CB PRO B 74 2.896 -3.920 33.063 1.00 23.12 C ATOM 3088 CG PRO B 74 1.821 -2.908 32.848 1.00 12.13 C ATOM 3089 CD PRO B 74 2.535 -1.612 32.585 1.00 51.43 C ATOM 0 HA PRO B 74 4.108 -3.306 34.807 1.00 33.15 H new ATOM 0 HB2 PRO B 74 3.216 -4.363 32.120 1.00 23.12 H new ATOM 0 HB3 PRO B 74 2.550 -4.736 33.697 1.00 23.12 H new ATOM 0 HG2 PRO B 74 1.186 -3.184 32.006 1.00 12.13 H new ATOM 0 HG3 PRO B 74 1.175 -2.830 33.723 1.00 12.13 H new ATOM 0 HD2 PRO B 74 2.775 -1.489 31.529 1.00 51.43 H new ATOM 0 HD3 PRO B 74 1.933 -0.752 32.878 1.00 51.43 H new ATOM 3097 N ALA B 75 6.015 -4.549 33.837 1.00 24.41 N ATOM 3098 CA ALA B 75 7.321 -5.062 33.434 1.00 71.53 C ATOM 3099 C ALA B 75 7.203 -6.001 32.242 1.00 71.01 C ATOM 3100 O ALA B 75 8.148 -6.184 31.475 1.00 12.42 O ATOM 3101 CB ALA B 75 7.968 -5.786 34.602 1.00 50.55 C ATOM 0 H ALA B 75 5.630 -4.998 34.668 1.00 24.41 H new ATOM 0 HA ALA B 75 7.942 -4.218 33.136 1.00 71.53 H new ATOM 0 HB1 ALA B 75 8.943 -6.168 34.298 1.00 50.55 H new ATOM 0 HB2 ALA B 75 8.093 -5.094 35.435 1.00 50.55 H new ATOM 0 HB3 ALA B 75 7.333 -6.616 34.912 1.00 50.55 H new ATOM 3107 N ASP B 76 6.022 -6.576 32.094 1.00 24.20 N ATOM 3108 CA ASP B 76 5.761 -7.602 31.088 1.00 60.22 C ATOM 3109 C ASP B 76 5.458 -6.992 29.716 1.00 14.12 C ATOM 3110 O ASP B 76 4.826 -7.629 28.871 1.00 34.13 O ATOM 3111 CB ASP B 76 4.572 -8.446 31.551 1.00 21.51 C ATOM 3112 CG ASP B 76 4.866 -9.255 32.801 1.00 33.51 C ATOM 3113 OD1 ASP B 76 5.321 -10.411 32.677 1.00 23.44 O ATOM 3114 OD2 ASP B 76 4.627 -8.746 33.915 1.00 41.11 O1- ATOM 0 H ASP B 76 5.211 -6.346 32.668 1.00 24.20 H new ATOM 0 HA ASP B 76 6.654 -8.218 30.981 1.00 60.22 H new ATOM 0 HB2 ASP B 76 3.722 -7.791 31.741 1.00 21.51 H new ATOM 0 HB3 ASP B 76 4.280 -9.123 30.748 1.00 21.51 H new ATOM 3119 N THR B 77 5.922 -5.771 29.491 1.00 44.41 N ATOM 3120 CA THR B 77 5.625 -5.047 28.262 1.00 1.21 C ATOM 3121 C THR B 77 6.735 -5.221 27.216 1.00 31.44 C ATOM 3122 O THR B 77 7.870 -5.588 27.544 1.00 72.52 O ATOM 3123 CB THR B 77 5.403 -3.547 28.558 1.00 44.03 C ATOM 3124 OG1 THR B 77 5.128 -2.829 27.350 1.00 73.25 O ATOM 3125 CG2 THR B 77 6.613 -2.926 29.249 1.00 30.02 C ATOM 0 H THR B 77 6.510 -5.258 30.148 1.00 44.41 H new ATOM 0 HA THR B 77 4.709 -5.469 27.848 1.00 1.21 H new ATOM 0 HB THR B 77 4.546 -3.475 29.228 1.00 44.03 H new ATOM 0 HG1 THR B 77 4.354 -3.229 26.901 1.00 73.25 H new ATOM 0 HG21 THR B 77 6.420 -1.871 29.441 1.00 30.02 H new ATOM 0 HG22 THR B 77 6.796 -3.439 30.193 1.00 30.02 H new ATOM 0 HG23 THR B 77 7.488 -3.024 28.607 1.00 30.02 H new ATOM 3133 N THR B 78 6.391 -4.965 25.955 1.00 70.31 N ATOM 3134 CA THR B 78 7.312 -5.111 24.829 1.00 64.53 C ATOM 3135 C THR B 78 6.878 -4.187 23.681 1.00 71.23 C ATOM 3136 O THR B 78 5.691 -3.891 23.532 1.00 64.44 O ATOM 3137 CB THR B 78 7.323 -6.568 24.310 1.00 53.44 C ATOM 3138 OG1 THR B 78 7.542 -7.486 25.393 1.00 34.22 O ATOM 3139 CG2 THR B 78 8.397 -6.770 23.251 1.00 23.30 C ATOM 0 H THR B 78 5.460 -4.649 25.684 1.00 70.31 H new ATOM 0 HA THR B 78 8.311 -4.845 25.174 1.00 64.53 H new ATOM 0 HB THR B 78 6.350 -6.763 23.860 1.00 53.44 H new ATOM 0 HG1 THR B 78 7.545 -8.404 25.049 1.00 34.22 H new ATOM 0 HG21 THR B 78 8.379 -7.804 22.907 1.00 23.30 H new ATOM 0 HG22 THR B 78 8.208 -6.104 22.409 1.00 23.30 H new ATOM 0 HG23 THR B 78 9.375 -6.547 23.677 1.00 23.30 H new ATOM 3147 N VAL B 79 7.834 -3.737 22.879 1.00 22.45 N ATOM 3148 CA VAL B 79 7.539 -2.934 21.691 1.00 23.02 C ATOM 3149 C VAL B 79 8.160 -3.576 20.463 1.00 31.21 C ATOM 3150 O VAL B 79 9.376 -3.720 20.379 1.00 14.34 O ATOM 3151 CB VAL B 79 8.056 -1.479 21.821 1.00 21.11 C ATOM 3152 CG1 VAL B 79 7.910 -0.725 20.497 1.00 1.41 C ATOM 3153 CG2 VAL B 79 7.312 -0.752 22.930 1.00 54.24 C ATOM 0 H VAL B 79 8.827 -3.914 23.028 1.00 22.45 H new ATOM 0 HA VAL B 79 6.454 -2.897 21.591 1.00 23.02 H new ATOM 0 HB VAL B 79 9.116 -1.516 22.074 1.00 21.11 H new ATOM 0 HG11 VAL B 79 8.280 0.293 20.616 1.00 1.41 H new ATOM 0 HG12 VAL B 79 8.486 -1.233 19.724 1.00 1.41 H new ATOM 0 HG13 VAL B 79 6.859 -0.698 20.208 1.00 1.41 H new ATOM 0 HG21 VAL B 79 7.685 0.269 23.010 1.00 54.24 H new ATOM 0 HG22 VAL B 79 6.247 -0.732 22.701 1.00 54.24 H new ATOM 0 HG23 VAL B 79 7.470 -1.271 23.875 1.00 54.24 H new ATOM 3163 N THR B 80 7.331 -3.968 19.515 1.00 72.42 N ATOM 3164 CA THR B 80 7.828 -4.608 18.306 1.00 23.21 C ATOM 3165 C THR B 80 7.854 -3.613 17.148 1.00 63.22 C ATOM 3166 O THR B 80 6.808 -3.175 16.665 1.00 42.43 O ATOM 3167 CB THR B 80 6.984 -5.846 17.932 1.00 22.40 C ATOM 3168 OG1 THR B 80 6.838 -6.691 19.086 1.00 71.34 O ATOM 3169 CG2 THR B 80 7.654 -6.635 16.810 1.00 64.25 C ATOM 0 H THR B 80 6.318 -3.857 19.555 1.00 72.42 H new ATOM 0 HA THR B 80 8.845 -4.946 18.504 1.00 23.21 H new ATOM 0 HB THR B 80 6.005 -5.511 17.589 1.00 22.40 H new ATOM 0 HG1 THR B 80 6.301 -7.476 18.851 1.00 71.34 H new ATOM 0 HG21 THR B 80 7.044 -7.503 16.561 1.00 64.25 H new ATOM 0 HG22 THR B 80 7.757 -6.000 15.930 1.00 64.25 H new ATOM 0 HG23 THR B 80 8.640 -6.966 17.136 1.00 64.25 H new ATOM 3177 N ALA B 81 9.062 -3.241 16.731 1.00 41.34 N ATOM 3178 CA ALA B 81 9.255 -2.284 15.651 1.00 73.43 C ATOM 3179 C ALA B 81 9.434 -3.001 14.315 1.00 13.31 C ATOM 3180 O ALA B 81 10.462 -3.637 14.075 1.00 32.14 O ATOM 3181 CB ALA B 81 10.466 -1.397 15.940 1.00 31.52 C ATOM 0 H ALA B 81 9.930 -3.595 17.133 1.00 41.34 H new ATOM 0 HA ALA B 81 8.365 -1.658 15.587 1.00 73.43 H new ATOM 0 HB1 ALA B 81 10.599 -0.686 15.125 1.00 31.52 H new ATOM 0 HB2 ALA B 81 10.306 -0.855 16.872 1.00 31.52 H new ATOM 0 HB3 ALA B 81 11.358 -2.017 16.030 1.00 31.52 H new ATOM 3187 N GLU B 82 8.416 -2.923 13.469 1.00 50.12 N ATOM 3188 CA GLU B 82 8.504 -3.425 12.103 1.00 53.10 C ATOM 3189 C GLU B 82 8.983 -2.302 11.186 1.00 51.21 C ATOM 3190 O GLU B 82 8.569 -1.152 11.343 1.00 13.21 O ATOM 3191 CB GLU B 82 7.139 -3.944 11.629 1.00 51.24 C ATOM 3192 CG GLU B 82 7.151 -4.482 10.202 1.00 31.41 C ATOM 3193 CD GLU B 82 5.771 -4.877 9.698 1.00 63.34 C ATOM 3194 OE1 GLU B 82 5.113 -4.050 9.028 1.00 35.34 O ATOM 3195 OE2 GLU B 82 5.348 -6.026 9.946 1.00 71.23 O1- ATOM 0 H GLU B 82 7.512 -2.514 13.707 1.00 50.12 H new ATOM 0 HA GLU B 82 9.213 -4.252 12.072 1.00 53.10 H new ATOM 0 HB2 GLU B 82 6.806 -4.733 12.303 1.00 51.24 H new ATOM 0 HB3 GLU B 82 6.409 -3.137 11.698 1.00 51.24 H new ATOM 0 HG2 GLU B 82 7.570 -3.725 9.539 1.00 31.41 H new ATOM 0 HG3 GLU B 82 7.810 -5.349 10.153 1.00 31.41 H new ATOM 3202 N VAL B 83 9.852 -2.631 10.240 1.00 40.31 N ATOM 3203 CA VAL B 83 10.377 -1.648 9.301 1.00 71.44 C ATOM 3204 C VAL B 83 10.529 -2.271 7.915 1.00 35.11 C ATOM 3205 O VAL B 83 10.966 -3.414 7.782 1.00 1.44 O ATOM 3206 CB VAL B 83 11.738 -1.072 9.776 1.00 65.23 C ATOM 3207 CG1 VAL B 83 12.786 -2.179 9.910 1.00 71.22 C ATOM 3208 CG2 VAL B 83 12.219 0.035 8.833 1.00 51.35 C ATOM 0 H VAL B 83 10.210 -3.576 10.102 1.00 40.31 H new ATOM 0 HA VAL B 83 9.664 -0.825 9.251 1.00 71.44 H new ATOM 0 HB VAL B 83 11.594 -0.632 10.763 1.00 65.23 H new ATOM 0 HG11 VAL B 83 13.730 -1.748 10.244 1.00 71.22 H new ATOM 0 HG12 VAL B 83 12.446 -2.916 10.638 1.00 71.22 H new ATOM 0 HG13 VAL B 83 12.930 -2.663 8.944 1.00 71.22 H new ATOM 0 HG21 VAL B 83 13.174 0.424 9.186 1.00 51.35 H new ATOM 0 HG22 VAL B 83 12.341 -0.370 7.828 1.00 51.35 H new ATOM 0 HG23 VAL B 83 11.485 0.840 8.813 1.00 51.35 H new ATOM 3218 N GLY B 84 10.127 -1.531 6.896 1.00 51.11 N ATOM 3219 CA GLY B 84 10.240 -1.998 5.531 1.00 52.45 C ATOM 3220 C GLY B 84 10.657 -0.891 4.592 1.00 30.33 C ATOM 3221 O GLY B 84 10.582 0.284 4.945 1.00 4.21 O ATOM 0 H GLY B 84 9.718 -0.601 6.992 1.00 51.11 H new ATOM 0 HA2 GLY B 84 10.967 -2.808 5.483 1.00 52.45 H new ATOM 0 HA3 GLY B 84 9.284 -2.408 5.207 1.00 52.45 H new ATOM 3225 N ILE B 85 11.073 -1.264 3.394 1.00 72.33 N ATOM 3226 CA ILE B 85 11.542 -0.314 2.401 1.00 70.35 C ATOM 3227 C ILE B 85 11.138 -0.788 1.012 1.00 24.30 C ATOM 3228 O ILE B 85 11.321 -1.965 0.667 1.00 65.43 O ATOM 3229 CB ILE B 85 13.086 -0.109 2.482 1.00 43.15 C ATOM 3230 CG1 ILE B 85 13.587 0.916 1.435 1.00 73.10 C ATOM 3231 CG2 ILE B 85 13.816 -1.443 2.325 1.00 2.22 C ATOM 3232 CD1 ILE B 85 13.908 0.320 0.075 1.00 22.31 C ATOM 0 H ILE B 85 11.095 -2.235 3.082 1.00 72.33 H new ATOM 0 HA ILE B 85 11.078 0.651 2.605 1.00 70.35 H new ATOM 0 HB ILE B 85 13.310 0.297 3.468 1.00 43.15 H new ATOM 0 HG12 ILE B 85 12.828 1.689 1.309 1.00 73.10 H new ATOM 0 HG13 ILE B 85 14.480 1.406 1.823 1.00 73.10 H new ATOM 0 HG21 ILE B 85 14.892 -1.278 2.384 1.00 2.22 H new ATOM 0 HG22 ILE B 85 13.508 -2.122 3.120 1.00 2.22 H new ATOM 0 HG23 ILE B 85 13.569 -1.881 1.358 1.00 2.22 H new ATOM 0 HD11 ILE B 85 14.251 1.108 -0.596 1.00 22.31 H new ATOM 0 HD12 ILE B 85 14.690 -0.431 0.183 1.00 22.31 H new ATOM 0 HD13 ILE B 85 13.013 -0.144 -0.339 1.00 22.31 H new ATOM 3244 N GLY B 86 10.556 0.126 0.243 1.00 43.24 N ATOM 3245 CA GLY B 86 10.154 -0.159 -1.123 1.00 50.02 C ATOM 3246 C GLY B 86 10.083 1.110 -1.951 1.00 52.30 C ATOM 3247 O GLY B 86 10.173 2.206 -1.396 1.00 42.02 O ATOM 0 H GLY B 86 10.352 1.077 0.549 1.00 43.24 H new ATOM 0 HA2 GLY B 86 10.862 -0.853 -1.576 1.00 50.02 H new ATOM 0 HA3 GLY B 86 9.181 -0.651 -1.123 1.00 50.02 H new ATOM 3251 N PRO B 87 9.933 1.005 -3.283 1.00 42.21 N ATOM 3252 CA PRO B 87 9.790 2.165 -4.154 1.00 30.25 C ATOM 3253 C PRO B 87 8.362 2.711 -4.108 1.00 61.30 C ATOM 3254 O PRO B 87 7.399 1.977 -4.353 1.00 52.32 O ATOM 3255 CB PRO B 87 10.126 1.621 -5.562 1.00 44.10 C ATOM 3256 CG PRO B 87 10.482 0.176 -5.369 1.00 14.42 C ATOM 3257 CD PRO B 87 9.877 -0.237 -4.055 1.00 45.13 C ATOM 0 HA PRO B 87 10.436 2.991 -3.858 1.00 30.25 H new ATOM 0 HB2 PRO B 87 9.275 1.727 -6.235 1.00 44.10 H new ATOM 0 HB3 PRO B 87 10.955 2.172 -6.006 1.00 44.10 H new ATOM 0 HG2 PRO B 87 10.092 -0.433 -6.185 1.00 14.42 H new ATOM 0 HG3 PRO B 87 11.563 0.040 -5.359 1.00 14.42 H new ATOM 0 HD2 PRO B 87 8.855 -0.597 -4.173 1.00 45.13 H new ATOM 0 HD3 PRO B 87 10.444 -1.037 -3.580 1.00 45.13 H new ATOM 3265 N ASN B 88 8.229 3.988 -3.780 1.00 53.24 N ATOM 3266 CA ASN B 88 6.916 4.630 -3.728 1.00 21.43 C ATOM 3267 C ASN B 88 6.414 4.932 -5.141 1.00 21.10 C ATOM 3268 O ASN B 88 7.171 4.848 -6.111 1.00 51.23 O ATOM 3269 CB ASN B 88 6.962 5.915 -2.876 1.00 72.30 C ATOM 3270 CG ASN B 88 7.934 6.966 -3.397 1.00 63.22 C ATOM 3271 OD1 ASN B 88 8.209 7.044 -4.593 1.00 5.32 O ATOM 3272 ND2 ASN B 88 8.452 7.793 -2.501 1.00 3.11 N ATOM 0 H ASN B 88 9.009 4.602 -3.546 1.00 53.24 H new ATOM 0 HA ASN B 88 6.217 3.941 -3.254 1.00 21.43 H new ATOM 0 HB2 ASN B 88 5.962 6.348 -2.834 1.00 72.30 H new ATOM 0 HB3 ASN B 88 7.239 5.653 -1.855 1.00 72.30 H new ATOM 0 HD21 ASN B 88 9.101 8.523 -2.796 1.00 3.11 H new ATOM 0 HD22 ASN B 88 8.202 7.700 -1.517 1.00 3.11 H new ATOM 3279 N GLU B 89 5.135 5.274 -5.249 1.00 65.22 N ATOM 3280 CA GLU B 89 4.513 5.593 -6.537 1.00 51.32 C ATOM 3281 C GLU B 89 5.092 6.881 -7.135 1.00 22.42 C ATOM 3282 O GLU B 89 4.931 7.156 -8.324 1.00 11.02 O ATOM 3283 CB GLU B 89 2.993 5.725 -6.358 1.00 62.31 C ATOM 3284 CG GLU B 89 2.595 6.682 -5.240 1.00 11.15 C ATOM 3285 CD GLU B 89 1.089 6.807 -5.069 1.00 24.23 C ATOM 3286 OE1 GLU B 89 0.463 5.869 -4.531 1.00 4.32 O ATOM 3287 OE2 GLU B 89 0.528 7.852 -5.463 1.00 35.35 O1- ATOM 0 H GLU B 89 4.500 5.339 -4.454 1.00 65.22 H new ATOM 0 HA GLU B 89 4.728 4.781 -7.231 1.00 51.32 H new ATOM 0 HB2 GLU B 89 2.553 6.069 -7.294 1.00 62.31 H new ATOM 0 HB3 GLU B 89 2.572 4.741 -6.151 1.00 62.31 H new ATOM 0 HG2 GLU B 89 3.034 6.339 -4.303 1.00 11.15 H new ATOM 0 HG3 GLU B 89 3.014 7.667 -5.447 1.00 11.15 H new ATOM 3294 N GLU B 90 5.778 7.650 -6.297 1.00 52.12 N ATOM 3295 CA GLU B 90 6.348 8.936 -6.694 1.00 15.12 C ATOM 3296 C GLU B 90 7.646 8.754 -7.493 1.00 74.05 C ATOM 3297 O GLU B 90 8.063 9.645 -8.242 1.00 53.12 O ATOM 3298 CB GLU B 90 6.587 9.782 -5.440 1.00 14.23 C ATOM 3299 CG GLU B 90 7.346 11.073 -5.686 1.00 30.33 C ATOM 3300 CD GLU B 90 7.459 11.916 -4.429 1.00 5.15 C ATOM 3301 OE1 GLU B 90 6.778 12.960 -4.338 1.00 54.43 O ATOM 3302 OE2 GLU B 90 8.201 11.521 -3.506 1.00 12.50 O1- ATOM 0 H GLU B 90 5.956 7.402 -5.324 1.00 52.12 H new ATOM 0 HA GLU B 90 5.644 9.449 -7.350 1.00 15.12 H new ATOM 0 HB2 GLU B 90 5.624 10.022 -4.990 1.00 14.23 H new ATOM 0 HB3 GLU B 90 7.138 9.184 -4.714 1.00 14.23 H new ATOM 0 HG2 GLU B 90 8.344 10.841 -6.058 1.00 30.33 H new ATOM 0 HG3 GLU B 90 6.842 11.647 -6.463 1.00 30.33 H new ATOM 3309 N GLY B 91 8.273 7.596 -7.336 1.00 72.20 N ATOM 3310 CA GLY B 91 9.485 7.282 -8.083 1.00 12.11 C ATOM 3311 C GLY B 91 10.739 7.391 -7.237 1.00 71.02 C ATOM 3312 O GLY B 91 11.797 7.792 -7.722 1.00 5.53 O ATOM 0 H GLY B 91 7.964 6.860 -6.701 1.00 72.20 H new ATOM 0 HA2 GLY B 91 9.408 6.271 -8.483 1.00 12.11 H new ATOM 0 HA3 GLY B 91 9.567 7.957 -8.935 1.00 12.11 H new ATOM 3316 N GLY B 92 10.616 7.030 -5.969 1.00 60.34 N ATOM 3317 CA GLY B 92 11.749 7.029 -5.061 1.00 61.32 C ATOM 3318 C GLY B 92 11.637 5.907 -4.052 1.00 12.52 C ATOM 3319 O GLY B 92 10.806 5.016 -4.214 1.00 70.13 O ATOM 0 H GLY B 92 9.737 6.733 -5.545 1.00 60.34 H new ATOM 0 HA2 GLY B 92 12.674 6.921 -5.628 1.00 61.32 H new ATOM 0 HA3 GLY B 92 11.803 7.986 -4.541 1.00 61.32 H new ATOM 3323 N PHE B 93 12.452 5.949 -3.004 1.00 71.13 N ATOM 3324 CA PHE B 93 12.406 4.927 -1.960 1.00 4.00 C ATOM 3325 C PHE B 93 11.577 5.430 -0.790 1.00 73.12 C ATOM 3326 O PHE B 93 11.536 6.634 -0.523 1.00 63.14 O ATOM 3327 CB PHE B 93 13.816 4.559 -1.479 1.00 42.41 C ATOM 3328 CG PHE B 93 14.694 3.965 -2.551 1.00 52.32 C ATOM 3329 CD1 PHE B 93 15.876 4.586 -2.928 1.00 72.40 C ATOM 3330 CD2 PHE B 93 14.335 2.780 -3.179 1.00 72.15 C ATOM 3331 CE1 PHE B 93 16.681 4.040 -3.908 1.00 54.33 C ATOM 3332 CE2 PHE B 93 15.137 2.230 -4.161 1.00 20.53 C ATOM 3333 CZ PHE B 93 16.312 2.861 -4.526 1.00 20.53 C ATOM 0 H PHE B 93 13.151 6.676 -2.853 1.00 71.13 H new ATOM 0 HA PHE B 93 11.947 4.031 -2.378 1.00 4.00 H new ATOM 0 HB2 PHE B 93 14.298 5.453 -1.083 1.00 42.41 H new ATOM 0 HB3 PHE B 93 13.734 3.849 -0.656 1.00 42.41 H new ATOM 0 HD1 PHE B 93 16.170 5.508 -2.449 1.00 72.40 H new ATOM 0 HD2 PHE B 93 13.419 2.282 -2.897 1.00 72.15 H new ATOM 0 HE1 PHE B 93 17.599 4.534 -4.191 1.00 54.33 H new ATOM 0 HE2 PHE B 93 14.846 1.308 -4.643 1.00 20.53 H new ATOM 0 HZ PHE B 93 16.940 2.433 -5.293 1.00 20.53 H new ATOM 3343 N ALA B 94 10.922 4.514 -0.095 1.00 22.42 N ATOM 3344 CA ALA B 94 10.047 4.872 1.008 1.00 62.21 C ATOM 3345 C ALA B 94 10.127 3.820 2.102 1.00 42.21 C ATOM 3346 O ALA B 94 10.214 2.620 1.817 1.00 61.15 O ATOM 3347 CB ALA B 94 8.613 5.031 0.517 1.00 43.22 C ATOM 0 H ALA B 94 10.981 3.512 -0.277 1.00 22.42 H new ATOM 0 HA ALA B 94 10.374 5.826 1.422 1.00 62.21 H new ATOM 0 HB1 ALA B 94 7.969 5.299 1.355 1.00 43.22 H new ATOM 0 HB2 ALA B 94 8.572 5.816 -0.238 1.00 43.22 H new ATOM 0 HB3 ALA B 94 8.271 4.092 0.083 1.00 43.22 H new ATOM 3353 N LEU B 95 10.120 4.282 3.345 1.00 51.40 N ATOM 3354 CA LEU B 95 10.173 3.404 4.506 1.00 52.52 C ATOM 3355 C LEU B 95 8.777 3.227 5.087 1.00 31.45 C ATOM 3356 O LEU B 95 8.076 4.203 5.357 1.00 74.21 O ATOM 3357 CB LEU B 95 11.130 3.969 5.574 1.00 5.44 C ATOM 3358 CG LEU B 95 12.634 3.713 5.337 1.00 70.54 C ATOM 3359 CD1 LEU B 95 12.973 2.241 5.549 1.00 3.52 C ATOM 3360 CD2 LEU B 95 13.049 4.155 3.935 1.00 13.14 C ATOM 0 H LEU B 95 10.077 5.274 3.577 1.00 51.40 H new ATOM 0 HA LEU B 95 10.552 2.432 4.190 1.00 52.52 H new ATOM 0 HB2 LEU B 95 10.971 5.045 5.643 1.00 5.44 H new ATOM 0 HB3 LEU B 95 10.857 3.544 6.540 1.00 5.44 H new ATOM 0 HG LEU B 95 13.191 4.305 6.063 1.00 70.54 H new ATOM 0 HD11 LEU B 95 14.038 2.084 5.377 1.00 3.52 H new ATOM 0 HD12 LEU B 95 12.725 1.954 6.571 1.00 3.52 H new ATOM 0 HD13 LEU B 95 12.399 1.631 4.851 1.00 3.52 H new ATOM 0 HD21 LEU B 95 14.113 3.964 3.793 1.00 13.14 H new ATOM 0 HD22 LEU B 95 12.478 3.596 3.193 1.00 13.14 H new ATOM 0 HD23 LEU B 95 12.853 5.221 3.816 1.00 13.14 H new ATOM 3372 N ASP B 96 8.392 1.977 5.266 1.00 51.23 N ATOM 3373 CA ASP B 96 7.107 1.625 5.863 1.00 11.24 C ATOM 3374 C ASP B 96 7.365 1.035 7.236 1.00 14.30 C ATOM 3375 O ASP B 96 7.908 -0.065 7.355 1.00 55.22 O ATOM 3376 CB ASP B 96 6.388 0.596 4.985 1.00 22.11 C ATOM 3377 CG ASP B 96 4.999 0.220 5.487 1.00 4.43 C ATOM 3378 OD1 ASP B 96 4.880 -0.742 6.283 1.00 73.12 O ATOM 3379 OD2 ASP B 96 4.012 0.861 5.064 1.00 73.53 O1- ATOM 0 H ASP B 96 8.960 1.172 5.002 1.00 51.23 H new ATOM 0 HA ASP B 96 6.479 2.512 5.946 1.00 11.24 H new ATOM 0 HB2 ASP B 96 6.303 0.992 3.973 1.00 22.11 H new ATOM 0 HB3 ASP B 96 6.998 -0.305 4.924 1.00 22.11 H new ATOM 3384 N VAL B 97 6.993 1.771 8.266 1.00 43.21 N ATOM 3385 CA VAL B 97 7.291 1.377 9.639 1.00 65.34 C ATOM 3386 C VAL B 97 6.005 1.129 10.417 1.00 4.12 C ATOM 3387 O VAL B 97 4.987 1.779 10.177 1.00 1.23 O ATOM 3388 CB VAL B 97 8.146 2.452 10.363 1.00 44.15 C ATOM 3389 CG1 VAL B 97 8.524 2.007 11.778 1.00 31.14 C ATOM 3390 CG2 VAL B 97 9.395 2.787 9.545 1.00 13.32 C ATOM 0 H VAL B 97 6.482 2.649 8.182 1.00 43.21 H new ATOM 0 HA VAL B 97 7.867 0.452 9.597 1.00 65.34 H new ATOM 0 HB VAL B 97 7.541 3.354 10.453 1.00 44.15 H new ATOM 0 HG11 VAL B 97 9.122 2.783 12.256 1.00 31.14 H new ATOM 0 HG12 VAL B 97 7.618 1.837 12.360 1.00 31.14 H new ATOM 0 HG13 VAL B 97 9.101 1.084 11.727 1.00 31.14 H new ATOM 0 HG21 VAL B 97 9.981 3.542 10.069 1.00 13.32 H new ATOM 0 HG22 VAL B 97 9.996 1.887 9.414 1.00 13.32 H new ATOM 0 HG23 VAL B 97 9.098 3.171 8.569 1.00 13.32 H new ATOM 3400 N GLU B 98 6.055 0.179 11.338 1.00 55.41 N ATOM 3401 CA GLU B 98 4.901 -0.192 12.140 1.00 61.25 C ATOM 3402 C GLU B 98 5.337 -0.453 13.581 1.00 55.42 C ATOM 3403 O GLU B 98 6.020 -1.438 13.863 1.00 74.01 O ATOM 3404 CB GLU B 98 4.236 -1.435 11.536 1.00 43.20 C ATOM 3405 CG GLU B 98 2.940 -1.841 12.218 1.00 33.43 C ATOM 3406 CD GLU B 98 2.256 -3.006 11.526 1.00 35.25 C ATOM 3407 OE1 GLU B 98 2.354 -4.147 12.022 1.00 70.42 O ATOM 3408 OE2 GLU B 98 1.616 -2.784 10.476 1.00 74.42 O1- ATOM 0 H GLU B 98 6.897 -0.356 11.550 1.00 55.41 H new ATOM 0 HA GLU B 98 4.177 0.622 12.143 1.00 61.25 H new ATOM 0 HB2 GLU B 98 4.036 -1.250 10.481 1.00 43.20 H new ATOM 0 HB3 GLU B 98 4.936 -2.269 11.586 1.00 43.20 H new ATOM 0 HG2 GLU B 98 3.148 -2.110 13.254 1.00 33.43 H new ATOM 0 HG3 GLU B 98 2.262 -0.988 12.240 1.00 33.43 H new ATOM 3415 N LEU B 99 4.965 0.447 14.485 1.00 61.12 N ATOM 3416 CA LEU B 99 5.349 0.337 15.891 1.00 54.24 C ATOM 3417 C LEU B 99 4.229 -0.306 16.696 1.00 51.12 C ATOM 3418 O LEU B 99 3.175 0.302 16.899 1.00 12.44 O ATOM 3419 CB LEU B 99 5.683 1.719 16.472 1.00 60.12 C ATOM 3420 CG LEU B 99 6.906 2.420 15.856 1.00 42.10 C ATOM 3421 CD1 LEU B 99 7.087 3.811 16.457 1.00 24.34 C ATOM 3422 CD2 LEU B 99 8.169 1.581 16.051 1.00 1.13 C ATOM 0 H LEU B 99 4.395 1.265 14.269 1.00 61.12 H new ATOM 0 HA LEU B 99 6.237 -0.291 15.953 1.00 54.24 H new ATOM 0 HB2 LEU B 99 4.815 2.366 16.347 1.00 60.12 H new ATOM 0 HB3 LEU B 99 5.849 1.612 17.544 1.00 60.12 H new ATOM 0 HG LEU B 99 6.732 2.528 14.785 1.00 42.10 H new ATOM 0 HD11 LEU B 99 7.957 4.291 16.009 1.00 24.34 H new ATOM 0 HD12 LEU B 99 6.199 4.411 16.259 1.00 24.34 H new ATOM 0 HD13 LEU B 99 7.234 3.726 17.534 1.00 24.34 H new ATOM 0 HD21 LEU B 99 9.021 2.097 15.607 1.00 1.13 H new ATOM 0 HD22 LEU B 99 8.348 1.435 17.116 1.00 1.13 H new ATOM 0 HD23 LEU B 99 8.040 0.612 15.569 1.00 1.13 H new ATOM 3434 N ARG B 100 4.469 -1.528 17.159 1.00 53.41 N ATOM 3435 CA ARG B 100 3.478 -2.272 17.926 1.00 2.45 C ATOM 3436 C ARG B 100 3.781 -2.164 19.409 1.00 14.01 C ATOM 3437 O ARG B 100 4.838 -2.604 19.869 1.00 24.14 O ATOM 3438 CB ARG B 100 3.478 -3.744 17.516 1.00 53.52 C ATOM 3439 CG ARG B 100 3.143 -3.979 16.052 1.00 13.43 C ATOM 3440 CD ARG B 100 3.168 -5.458 15.719 1.00 64.11 C ATOM 3441 NE ARG B 100 2.817 -5.716 14.323 1.00 3.43 N ATOM 3442 CZ ARG B 100 2.592 -6.925 13.809 1.00 52.33 C ATOM 3443 NH1 ARG B 100 2.582 -8.001 14.588 1.00 41.53 N1+ ATOM 3444 NH2 ARG B 100 2.350 -7.053 12.515 1.00 11.32 N ATOM 0 H ARG B 100 5.347 -2.026 17.015 1.00 53.41 H new ATOM 0 HA ARG B 100 2.496 -1.846 17.722 1.00 2.45 H new ATOM 0 HB2 ARG B 100 4.460 -4.169 17.726 1.00 53.52 H new ATOM 0 HB3 ARG B 100 2.759 -4.282 18.133 1.00 53.52 H new ATOM 0 HG2 ARG B 100 2.157 -3.569 15.831 1.00 13.43 H new ATOM 0 HG3 ARG B 100 3.857 -3.449 15.422 1.00 13.43 H new ATOM 0 HD2 ARG B 100 4.162 -5.858 15.922 1.00 64.11 H new ATOM 0 HD3 ARG B 100 2.473 -5.987 16.370 1.00 64.11 H new ATOM 0 HE ARG B 100 2.739 -4.914 13.698 1.00 3.43 H new ATOM 0 HH11 ARG B 100 2.748 -7.907 15.590 1.00 41.53 H new ATOM 0 HH12 ARG B 100 2.409 -8.921 14.184 1.00 41.53 H new ATOM 0 HH21 ARG B 100 2.336 -6.228 11.915 1.00 11.32 H new ATOM 0 HH22 ARG B 100 2.177 -7.976 12.117 1.00 11.32 H new ATOM 3458 N VAL B 101 2.852 -1.583 20.153 1.00 41.00 N ATOM 3459 CA VAL B 101 3.028 -1.373 21.579 1.00 50.20 C ATOM 3460 C VAL B 101 2.272 -2.434 22.362 1.00 3.30 C ATOM 3461 O VAL B 101 1.058 -2.339 22.526 1.00 1.54 O ATOM 3462 CB VAL B 101 2.522 0.028 22.000 1.00 60.12 C ATOM 3463 CG1 VAL B 101 2.638 0.221 23.513 1.00 22.35 C ATOM 3464 CG2 VAL B 101 3.277 1.122 21.244 1.00 51.31 C ATOM 0 H VAL B 101 1.961 -1.246 19.787 1.00 41.00 H new ATOM 0 HA VAL B 101 4.093 -1.443 21.799 1.00 50.20 H new ATOM 0 HB VAL B 101 1.467 0.103 21.738 1.00 60.12 H new ATOM 0 HG11 VAL B 101 2.276 1.213 23.782 1.00 22.35 H new ATOM 0 HG12 VAL B 101 2.040 -0.534 24.023 1.00 22.35 H new ATOM 0 HG13 VAL B 101 3.681 0.122 23.814 1.00 22.35 H new ATOM 0 HG21 VAL B 101 2.907 2.100 21.553 1.00 51.31 H new ATOM 0 HG22 VAL B 101 4.342 1.050 21.466 1.00 51.31 H new ATOM 0 HG23 VAL B 101 3.121 0.998 20.172 1.00 51.31 H new ATOM 3474 N ALA B 102 2.984 -3.448 22.834 1.00 24.03 N ATOM 3475 CA ALA B 102 2.364 -4.478 23.649 1.00 53.32 C ATOM 3476 C ALA B 102 2.489 -4.091 25.112 1.00 44.40 C ATOM 3477 O ALA B 102 3.543 -4.253 25.725 1.00 4.42 O ATOM 3478 CB ALA B 102 3.016 -5.835 23.386 1.00 42.24 C ATOM 0 H ALA B 102 3.982 -3.577 22.668 1.00 24.03 H new ATOM 0 HA ALA B 102 1.309 -4.564 23.389 1.00 53.32 H new ATOM 0 HB1 ALA B 102 2.539 -6.594 24.005 1.00 42.24 H new ATOM 0 HB2 ALA B 102 2.898 -6.098 22.335 1.00 42.24 H new ATOM 0 HB3 ALA B 102 4.077 -5.782 23.630 1.00 42.24 H new ATOM 3484 N LEU B 103 1.402 -3.573 25.664 1.00 61.44 N ATOM 3485 CA LEU B 103 1.391 -3.081 27.033 1.00 72.24 C ATOM 3486 C LEU B 103 0.285 -3.795 27.807 1.00 41.41 C ATOM 3487 O LEU B 103 -0.904 -3.552 27.583 1.00 40.11 O ATOM 3488 CB LEU B 103 1.210 -1.549 27.044 1.00 55.34 C ATOM 3489 CG LEU B 103 1.503 -0.836 28.384 1.00 34.43 C ATOM 3490 CD1 LEU B 103 2.854 -1.258 28.948 1.00 40.33 C ATOM 3491 CD2 LEU B 103 1.475 0.682 28.204 1.00 1.40 C ATOM 0 H LEU B 103 0.509 -3.482 25.180 1.00 61.44 H new ATOM 0 HA LEU B 103 2.342 -3.295 27.520 1.00 72.24 H new ATOM 0 HB2 LEU B 103 1.859 -1.122 26.280 1.00 55.34 H new ATOM 0 HB3 LEU B 103 0.184 -1.323 26.753 1.00 55.34 H new ATOM 0 HG LEU B 103 0.724 -1.128 29.089 1.00 34.43 H new ATOM 0 HD11 LEU B 103 3.033 -0.740 29.890 1.00 40.33 H new ATOM 0 HD12 LEU B 103 2.857 -2.334 29.119 1.00 40.33 H new ATOM 0 HD13 LEU B 103 3.641 -1.001 28.238 1.00 40.33 H new ATOM 0 HD21 LEU B 103 1.683 1.165 29.158 1.00 1.40 H new ATOM 0 HD22 LEU B 103 2.231 0.976 27.476 1.00 1.40 H new ATOM 0 HD23 LEU B 103 0.491 0.988 27.850 1.00 1.40 H new ATOM 3503 N PRO B 104 0.676 -4.724 28.701 1.00 3.11 N ATOM 3504 CA PRO B 104 -0.262 -5.595 29.416 1.00 24.44 C ATOM 3505 C PRO B 104 -1.054 -4.859 30.497 1.00 5.10 C ATOM 3506 O PRO B 104 -0.594 -3.853 31.041 1.00 15.44 O ATOM 3507 CB PRO B 104 0.659 -6.655 30.033 1.00 10.11 C ATOM 3508 CG PRO B 104 1.962 -5.962 30.223 1.00 31.23 C ATOM 3509 CD PRO B 104 2.077 -4.989 29.086 1.00 74.24 C ATOM 0 HA PRO B 104 -1.028 -6.003 28.757 1.00 24.44 H new ATOM 0 HB2 PRO B 104 0.263 -7.020 30.981 1.00 10.11 H new ATOM 0 HB3 PRO B 104 0.763 -7.519 29.377 1.00 10.11 H new ATOM 0 HG2 PRO B 104 1.995 -5.447 31.183 1.00 31.23 H new ATOM 0 HG3 PRO B 104 2.788 -6.673 30.214 1.00 31.23 H new ATOM 0 HD2 PRO B 104 2.587 -4.075 29.392 1.00 74.24 H new ATOM 0 HD3 PRO B 104 2.646 -5.409 28.257 1.00 74.24 H new ATOM 3517 N GLY B 105 -2.243 -5.373 30.801 1.00 72.34 N ATOM 3518 CA GLY B 105 -3.093 -4.768 31.814 1.00 21.00 C ATOM 3519 C GLY B 105 -3.708 -3.463 31.350 1.00 53.31 C ATOM 3520 O GLY B 105 -4.234 -2.690 32.156 1.00 21.33 O ATOM 0 H GLY B 105 -2.636 -6.205 30.360 1.00 72.34 H new ATOM 0 HA2 GLY B 105 -3.887 -5.465 32.082 1.00 21.00 H new ATOM 0 HA3 GLY B 105 -2.508 -4.590 32.716 1.00 21.00 H new ATOM 3524 N LEU B 106 -3.655 -3.229 30.044 1.00 45.40 N ATOM 3525 CA LEU B 106 -4.093 -1.971 29.448 1.00 45.21 C ATOM 3526 C LEU B 106 -5.028 -2.232 28.262 1.00 60.53 C ATOM 3527 O LEU B 106 -4.856 -3.209 27.529 1.00 55.33 O ATOM 3528 CB LEU B 106 -2.853 -1.173 29.004 1.00 22.13 C ATOM 3529 CG LEU B 106 -3.109 -0.007 28.036 1.00 5.55 C ATOM 3530 CD1 LEU B 106 -3.968 1.075 28.676 1.00 53.52 C ATOM 3531 CD2 LEU B 106 -1.791 0.577 27.545 1.00 55.01 C ATOM 0 H LEU B 106 -3.306 -3.907 29.367 1.00 45.40 H new ATOM 0 HA LEU B 106 -4.651 -1.392 30.184 1.00 45.21 H new ATOM 0 HB2 LEU B 106 -2.362 -0.778 29.894 1.00 22.13 H new ATOM 0 HB3 LEU B 106 -2.152 -1.862 28.533 1.00 22.13 H new ATOM 0 HG LEU B 106 -3.659 -0.401 27.181 1.00 5.55 H new ATOM 0 HD11 LEU B 106 -4.128 1.883 27.962 1.00 53.52 H new ATOM 0 HD12 LEU B 106 -4.930 0.652 28.966 1.00 53.52 H new ATOM 0 HD13 LEU B 106 -3.462 1.466 29.559 1.00 53.52 H new ATOM 0 HD21 LEU B 106 -1.991 1.401 26.861 1.00 55.01 H new ATOM 0 HD22 LEU B 106 -1.216 0.943 28.396 1.00 55.01 H new ATOM 0 HD23 LEU B 106 -1.222 -0.195 27.027 1.00 55.01 H new ATOM 3543 N ASP B 107 -6.031 -1.363 28.092 1.00 0.12 N ATOM 3544 CA ASP B 107 -6.978 -1.477 26.977 1.00 50.41 C ATOM 3545 C ASP B 107 -6.337 -1.036 25.682 1.00 24.13 C ATOM 3546 O ASP B 107 -5.349 -0.314 25.685 1.00 45.41 O ATOM 3547 CB ASP B 107 -8.202 -0.585 27.176 1.00 1.44 C ATOM 3548 CG ASP B 107 -9.462 -1.168 26.560 1.00 20.21 C ATOM 3549 OD1 ASP B 107 -10.305 -1.708 27.304 1.00 63.12 O ATOM 3550 OD2 ASP B 107 -9.616 -1.079 25.325 1.00 14.11 O1- ATOM 0 H ASP B 107 -6.208 -0.573 28.712 1.00 0.12 H new ATOM 0 HA ASP B 107 -7.273 -2.526 26.941 1.00 50.41 H new ATOM 0 HB2 ASP B 107 -8.363 -0.430 28.243 1.00 1.44 H new ATOM 0 HB3 ASP B 107 -8.008 0.394 26.737 1.00 1.44 H new ATOM 3555 N ALA B 108 -6.963 -1.414 24.587 1.00 12.24 N ATOM 3556 CA ALA B 108 -6.606 -0.913 23.275 1.00 21.33 C ATOM 3557 C ALA B 108 -6.965 0.564 23.165 1.00 4.44 C ATOM 3558 O ALA B 108 -6.167 1.378 22.701 1.00 12.01 O ATOM 3559 CB ALA B 108 -7.354 -1.702 22.224 1.00 34.32 C ATOM 0 H ALA B 108 -7.736 -2.079 24.581 1.00 12.24 H new ATOM 0 HA ALA B 108 -5.532 -1.025 23.123 1.00 21.33 H new ATOM 0 HB1 ALA B 108 -7.090 -1.330 21.234 1.00 34.32 H new ATOM 0 HB2 ALA B 108 -7.085 -2.756 22.300 1.00 34.32 H new ATOM 0 HB3 ALA B 108 -8.427 -1.590 22.380 1.00 34.32 H new ATOM 3565 N ALA B 109 -8.170 0.901 23.624 1.00 61.34 N ATOM 3566 CA ALA B 109 -8.688 2.263 23.520 1.00 64.51 C ATOM 3567 C ALA B 109 -7.786 3.234 24.268 1.00 34.40 C ATOM 3568 O ALA B 109 -7.367 4.262 23.729 1.00 22.24 O ATOM 3569 CB ALA B 109 -10.114 2.330 24.057 1.00 34.53 C ATOM 0 H ALA B 109 -8.808 0.245 24.074 1.00 61.34 H new ATOM 0 HA ALA B 109 -8.702 2.551 22.469 1.00 64.51 H new ATOM 0 HB1 ALA B 109 -10.487 3.351 23.973 1.00 34.53 H new ATOM 0 HB2 ALA B 109 -10.752 1.662 23.479 1.00 34.53 H new ATOM 0 HB3 ALA B 109 -10.123 2.025 25.103 1.00 34.53 H new ATOM 3575 N ALA B 110 -7.471 2.882 25.508 1.00 13.42 N ATOM 3576 CA ALA B 110 -6.604 3.699 26.338 1.00 72.03 C ATOM 3577 C ALA B 110 -5.178 3.662 25.801 1.00 4.25 C ATOM 3578 O ALA B 110 -4.501 4.693 25.727 1.00 22.41 O ATOM 3579 CB ALA B 110 -6.655 3.225 27.788 1.00 4.12 C ATOM 0 H ALA B 110 -7.806 2.031 25.960 1.00 13.42 H new ATOM 0 HA ALA B 110 -6.955 4.731 26.308 1.00 72.03 H new ATOM 0 HB1 ALA B 110 -6.000 3.847 28.398 1.00 4.12 H new ATOM 0 HB2 ALA B 110 -7.677 3.301 28.160 1.00 4.12 H new ATOM 0 HB3 ALA B 110 -6.325 2.188 27.844 1.00 4.12 H new ATOM 3585 N ALA B 111 -4.738 2.469 25.392 1.00 64.14 N ATOM 3586 CA ALA B 111 -3.391 2.298 24.848 1.00 51.51 C ATOM 3587 C ALA B 111 -3.141 3.245 23.684 1.00 2.23 C ATOM 3588 O ALA B 111 -2.069 3.835 23.593 1.00 42.41 O ATOM 3589 CB ALA B 111 -3.165 0.858 24.408 1.00 4.22 C ATOM 0 H ALA B 111 -5.292 1.613 25.427 1.00 64.14 H new ATOM 0 HA ALA B 111 -2.684 2.538 25.642 1.00 51.51 H new ATOM 0 HB1 ALA B 111 -2.157 0.754 24.007 1.00 4.22 H new ATOM 0 HB2 ALA B 111 -3.286 0.193 25.263 1.00 4.22 H new ATOM 0 HB3 ALA B 111 -3.891 0.595 23.639 1.00 4.22 H new ATOM 3595 N LYS B 112 -4.132 3.403 22.809 1.00 32.30 N ATOM 3596 CA LYS B 112 -3.996 4.292 21.656 1.00 34.20 C ATOM 3597 C LYS B 112 -3.586 5.697 22.090 1.00 24.41 C ATOM 3598 O LYS B 112 -2.639 6.272 21.552 1.00 32.01 O ATOM 3599 CB LYS B 112 -5.300 4.376 20.862 1.00 45.31 C ATOM 3600 CG LYS B 112 -5.695 3.082 20.164 1.00 74.45 C ATOM 3601 CD LYS B 112 -6.874 3.306 19.226 1.00 63.04 C ATOM 3602 CE LYS B 112 -8.106 3.822 19.963 1.00 72.33 C ATOM 3603 NZ LYS B 112 -9.189 4.217 19.026 1.00 62.21 N1+ ATOM 0 H LYS B 112 -5.033 2.930 22.875 1.00 32.30 H new ATOM 0 HA LYS B 112 -3.218 3.870 21.020 1.00 34.20 H new ATOM 0 HB2 LYS B 112 -6.104 4.671 21.537 1.00 45.31 H new ATOM 0 HB3 LYS B 112 -5.206 5.164 20.115 1.00 45.31 H new ATOM 0 HG2 LYS B 112 -4.846 2.695 19.601 1.00 74.45 H new ATOM 0 HG3 LYS B 112 -5.955 2.328 20.907 1.00 74.45 H new ATOM 0 HD2 LYS B 112 -6.590 4.019 18.452 1.00 63.04 H new ATOM 0 HD3 LYS B 112 -7.119 2.371 18.723 1.00 63.04 H new ATOM 0 HE2 LYS B 112 -8.474 3.050 20.638 1.00 72.33 H new ATOM 0 HE3 LYS B 112 -7.829 4.678 20.578 1.00 72.33 H new ATOM 0 HZ1 LYS B 112 -10.008 4.562 19.567 1.00 62.21 H new ATOM 0 HZ2 LYS B 112 -8.846 4.972 18.398 1.00 62.21 H new ATOM 0 HZ3 LYS B 112 -9.472 3.394 18.456 1.00 62.21 H new ATOM 3617 N THR B 113 -4.297 6.239 23.071 1.00 71.03 N ATOM 3618 CA THR B 113 -4.034 7.599 23.525 1.00 12.30 C ATOM 3619 C THR B 113 -2.702 7.665 24.271 1.00 72.03 C ATOM 3620 O THR B 113 -1.987 8.665 24.189 1.00 34.03 O ATOM 3621 CB THR B 113 -5.178 8.155 24.414 1.00 51.23 C ATOM 3622 OG1 THR B 113 -5.239 9.587 24.294 1.00 15.33 O ATOM 3623 CG2 THR B 113 -4.990 7.790 25.883 1.00 55.23 C ATOM 0 H THR B 113 -5.053 5.763 23.563 1.00 71.03 H new ATOM 0 HA THR B 113 -3.980 8.229 22.637 1.00 12.30 H new ATOM 0 HB THR B 113 -6.107 7.703 24.066 1.00 51.23 H new ATOM 0 HG1 THR B 113 -5.964 9.932 24.856 1.00 15.33 H new ATOM 0 HG21 THR B 113 -5.814 8.200 26.468 1.00 55.23 H new ATOM 0 HG22 THR B 113 -4.974 6.705 25.989 1.00 55.23 H new ATOM 0 HG23 THR B 113 -4.048 8.204 26.243 1.00 55.23 H new ATOM 3631 N LEU B 114 -2.364 6.596 24.991 1.00 42.02 N ATOM 3632 CA LEU B 114 -1.089 6.534 25.696 1.00 34.43 C ATOM 3633 C LEU B 114 0.060 6.504 24.691 1.00 70.23 C ATOM 3634 O LEU B 114 1.093 7.146 24.885 1.00 14.10 O ATOM 3635 CB LEU B 114 -1.036 5.315 26.625 1.00 61.41 C ATOM 3636 CG LEU B 114 -2.154 5.253 27.683 1.00 44.12 C ATOM 3637 CD1 LEU B 114 -1.904 4.120 28.674 1.00 65.44 C ATOM 3638 CD2 LEU B 114 -2.298 6.590 28.410 1.00 20.12 C ATOM 0 H LEU B 114 -2.951 5.769 25.100 1.00 42.02 H new ATOM 0 HA LEU B 114 -0.988 7.426 26.315 1.00 34.43 H new ATOM 0 HB2 LEU B 114 -1.082 4.412 26.017 1.00 61.41 H new ATOM 0 HB3 LEU B 114 -0.073 5.308 27.135 1.00 61.41 H new ATOM 0 HG LEU B 114 -3.092 5.050 27.166 1.00 44.12 H new ATOM 0 HD11 LEU B 114 -2.707 4.097 29.411 1.00 65.44 H new ATOM 0 HD12 LEU B 114 -1.874 3.170 28.140 1.00 65.44 H new ATOM 0 HD13 LEU B 114 -0.952 4.282 29.180 1.00 65.44 H new ATOM 0 HD21 LEU B 114 -3.094 6.517 29.151 1.00 20.12 H new ATOM 0 HD22 LEU B 114 -1.360 6.836 28.908 1.00 20.12 H new ATOM 0 HD23 LEU B 114 -2.542 7.371 27.690 1.00 20.12 H new ATOM 3650 N VAL B 115 -0.148 5.774 23.599 1.00 61.11 N ATOM 3651 CA VAL B 115 0.815 5.713 22.508 1.00 23.35 C ATOM 3652 C VAL B 115 0.915 7.071 21.822 1.00 63.55 C ATOM 3653 O VAL B 115 2.002 7.495 21.425 1.00 10.54 O ATOM 3654 CB VAL B 115 0.424 4.626 21.469 1.00 32.23 C ATOM 3655 CG1 VAL B 115 1.319 4.684 20.232 1.00 53.51 C ATOM 3656 CG2 VAL B 115 0.486 3.236 22.099 1.00 32.34 C ATOM 0 H VAL B 115 -0.985 5.211 23.447 1.00 61.11 H new ATOM 0 HA VAL B 115 1.784 5.447 22.931 1.00 23.35 H new ATOM 0 HB VAL B 115 -0.599 4.827 21.152 1.00 32.23 H new ATOM 0 HG11 VAL B 115 1.016 3.909 19.527 1.00 53.51 H new ATOM 0 HG12 VAL B 115 1.224 5.662 19.760 1.00 53.51 H new ATOM 0 HG13 VAL B 115 2.356 4.522 20.525 1.00 53.51 H new ATOM 0 HG21 VAL B 115 0.209 2.487 21.357 1.00 32.34 H new ATOM 0 HG22 VAL B 115 1.499 3.041 22.451 1.00 32.34 H new ATOM 0 HG23 VAL B 115 -0.206 3.186 22.940 1.00 32.34 H new ATOM 3666 N ASP B 116 -0.225 7.747 21.696 1.00 33.05 N ATOM 3667 CA ASP B 116 -0.280 9.081 21.099 1.00 4.03 C ATOM 3668 C ASP B 116 0.602 10.058 21.866 1.00 43.14 C ATOM 3669 O ASP B 116 1.550 10.618 21.312 1.00 21.31 O ATOM 3670 CB ASP B 116 -1.720 9.610 21.077 1.00 75.43 C ATOM 3671 CG ASP B 116 -1.795 11.069 20.643 1.00 20.42 C ATOM 3672 OD1 ASP B 116 -1.487 11.367 19.468 1.00 45.35 O ATOM 3673 OD2 ASP B 116 -2.159 11.925 21.476 1.00 32.45 O1- ATOM 0 H ASP B 116 -1.130 7.390 22.002 1.00 33.05 H new ATOM 0 HA ASP B 116 0.087 8.997 20.076 1.00 4.03 H new ATOM 0 HB2 ASP B 116 -2.318 9.001 20.399 1.00 75.43 H new ATOM 0 HB3 ASP B 116 -2.158 9.506 22.070 1.00 75.43 H new ATOM 3678 N ARG B 117 0.287 10.247 23.146 1.00 65.05 N ATOM 3679 CA ARG B 117 1.013 11.192 23.989 1.00 30.34 C ATOM 3680 C ARG B 117 2.478 10.783 24.121 1.00 41.22 C ATOM 3681 O ARG B 117 3.374 11.629 24.087 1.00 22.44 O ATOM 3682 CB ARG B 117 0.342 11.297 25.364 1.00 5.33 C ATOM 3683 CG ARG B 117 0.209 9.969 26.093 1.00 52.02 C ATOM 3684 CD ARG B 117 -0.768 10.058 27.257 1.00 70.20 C ATOM 3685 NE ARG B 117 -0.267 10.900 28.346 1.00 35.41 N ATOM 3686 CZ ARG B 117 -1.037 11.406 29.315 1.00 33.14 C ATOM 3687 NH1 ARG B 117 -2.360 11.289 29.254 1.00 12.31 N1+ ATOM 3688 NH2 ARG B 117 -0.488 12.066 30.324 1.00 12.43 N ATOM 0 H ARG B 117 -0.469 9.756 23.622 1.00 65.05 H new ATOM 0 HA ARG B 117 0.984 12.175 23.518 1.00 30.34 H new ATOM 0 HB2 ARG B 117 0.916 11.984 25.985 1.00 5.33 H new ATOM 0 HB3 ARG B 117 -0.650 11.732 25.240 1.00 5.33 H new ATOM 0 HG2 ARG B 117 -0.127 9.203 25.394 1.00 52.02 H new ATOM 0 HG3 ARG B 117 1.186 9.657 26.462 1.00 52.02 H new ATOM 0 HD2 ARG B 117 -1.718 10.457 26.901 1.00 70.20 H new ATOM 0 HD3 ARG B 117 -0.966 9.056 27.638 1.00 70.20 H new ATOM 0 HE ARG B 117 0.730 11.113 28.366 1.00 35.41 H new ATOM 0 HH11 ARG B 117 -2.794 10.811 28.464 1.00 12.31 H new ATOM 0 HH12 ARG B 117 -2.941 11.677 29.997 1.00 12.31 H new ATOM 0 HH21 ARG B 117 0.524 12.189 30.363 1.00 12.43 H new ATOM 0 HH22 ARG B 117 -1.077 12.451 31.062 1.00 12.43 H new ATOM 3702 N ALA B 118 2.718 9.479 24.249 1.00 61.11 N ATOM 3703 CA ALA B 118 4.080 8.953 24.302 1.00 4.01 C ATOM 3704 C ALA B 118 4.830 9.300 23.017 1.00 4.12 C ATOM 3705 O ALA B 118 6.007 9.657 23.047 1.00 22.32 O ATOM 3706 CB ALA B 118 4.067 7.444 24.528 1.00 4.44 C ATOM 0 H ALA B 118 1.989 8.769 24.318 1.00 61.11 H new ATOM 0 HA ALA B 118 4.598 9.416 25.142 1.00 4.01 H new ATOM 0 HB1 ALA B 118 5.091 7.073 24.564 1.00 4.44 H new ATOM 0 HB2 ALA B 118 3.567 7.222 25.471 1.00 4.44 H new ATOM 0 HB3 ALA B 118 3.534 6.958 23.711 1.00 4.44 H new ATOM 3712 N HIS B 119 4.124 9.216 21.887 1.00 53.54 N ATOM 3713 CA HIS B 119 4.699 9.547 20.584 1.00 31.05 C ATOM 3714 C HIS B 119 4.522 11.029 20.262 1.00 22.51 C ATOM 3715 O HIS B 119 4.765 11.461 19.136 1.00 73.21 O ATOM 3716 CB HIS B 119 4.073 8.684 19.475 1.00 24.30 C ATOM 3717 CG HIS B 119 4.607 7.283 19.428 1.00 50.32 C ATOM 3718 ND1 HIS B 119 4.130 6.264 20.222 1.00 33.22 N ATOM 3719 CD2 HIS B 119 5.591 6.736 18.671 1.00 55.12 C ATOM 3720 CE1 HIS B 119 4.796 5.153 19.960 1.00 74.31 C ATOM 3721 NE2 HIS B 119 5.691 5.415 19.024 1.00 22.51 N ATOM 0 H HIS B 119 3.149 8.920 21.850 1.00 53.54 H new ATOM 0 HA HIS B 119 5.767 9.333 20.631 1.00 31.05 H new ATOM 0 HB2 HIS B 119 2.993 8.647 19.621 1.00 24.30 H new ATOM 0 HB3 HIS B 119 4.248 9.163 18.512 1.00 24.30 H new ATOM 0 HD1 HIS B 119 3.379 6.353 20.906 1.00 33.22 H new ATOM 0 HD2 HIS B 119 6.186 7.247 17.928 1.00 55.12 H new ATOM 0 HE1 HIS B 119 4.636 4.194 20.431 1.00 74.31 H new ATOM 3730 N HIS B 120 4.103 11.798 21.258 1.00 35.12 N ATOM 3731 CA HIS B 120 3.908 13.238 21.104 1.00 61.52 C ATOM 3732 C HIS B 120 4.996 13.997 21.860 1.00 22.12 C ATOM 3733 O HIS B 120 5.519 15.000 21.372 1.00 21.30 O ATOM 3734 CB HIS B 120 2.515 13.634 21.626 1.00 61.10 C ATOM 3735 CG HIS B 120 2.144 15.073 21.405 1.00 45.20 C ATOM 3736 ND1 HIS B 120 1.152 15.464 20.532 1.00 23.40 N ATOM 3737 CD2 HIS B 120 2.612 16.212 21.969 1.00 61.34 C ATOM 3738 CE1 HIS B 120 1.028 16.776 20.569 1.00 14.23 C ATOM 3739 NE2 HIS B 120 1.901 17.257 21.435 1.00 33.30 N ATOM 0 H HIS B 120 3.889 11.446 22.191 1.00 35.12 H new ATOM 0 HA HIS B 120 3.974 13.498 20.047 1.00 61.52 H new ATOM 0 HB2 HIS B 120 1.769 13.003 21.143 1.00 61.10 H new ATOM 0 HB3 HIS B 120 2.469 13.422 22.694 1.00 61.10 H new ATOM 0 HD2 HIS B 120 3.400 16.284 22.704 1.00 61.34 H new ATOM 0 HE1 HIS B 120 0.329 17.360 19.988 1.00 14.23 H new ATOM 0 HE2 HIS B 120 2.026 18.242 21.668 1.00 33.30 H new ATOM 3748 N VAL B 121 5.336 13.503 23.049 1.00 53.34 N ATOM 3749 CA VAL B 121 6.301 14.175 23.921 1.00 2.11 C ATOM 3750 C VAL B 121 7.744 13.774 23.601 1.00 31.12 C ATOM 3751 O VAL B 121 8.658 14.591 23.717 1.00 43.14 O ATOM 3752 CB VAL B 121 6.004 13.891 25.418 1.00 52.03 C ATOM 3753 CG1 VAL B 121 4.622 14.421 25.800 1.00 41.33 C ATOM 3754 CG2 VAL B 121 6.121 12.396 25.730 1.00 63.42 C ATOM 0 H VAL B 121 4.957 12.637 23.433 1.00 53.34 H new ATOM 0 HA VAL B 121 6.193 15.243 23.732 1.00 2.11 H new ATOM 0 HB VAL B 121 6.750 14.414 26.017 1.00 52.03 H new ATOM 0 HG11 VAL B 121 4.431 14.213 26.853 1.00 41.33 H new ATOM 0 HG12 VAL B 121 4.585 15.497 25.630 1.00 41.33 H new ATOM 0 HG13 VAL B 121 3.863 13.931 25.190 1.00 41.33 H new ATOM 0 HG21 VAL B 121 5.908 12.227 26.785 1.00 63.42 H new ATOM 0 HG22 VAL B 121 5.407 11.840 25.122 1.00 63.42 H new ATOM 0 HG23 VAL B 121 7.132 12.055 25.505 1.00 63.42 H new ATOM 3764 N CYS B 122 7.951 12.521 23.200 1.00 64.23 N ATOM 3765 CA CYS B 122 9.296 12.024 22.917 1.00 24.42 C ATOM 3766 C CYS B 122 9.780 12.514 21.543 1.00 23.34 C ATOM 3767 O CYS B 122 9.031 12.468 20.560 1.00 74.53 O ATOM 3768 CB CYS B 122 9.322 10.492 22.989 1.00 15.34 C ATOM 3769 SG CYS B 122 8.738 9.822 24.564 1.00 14.44 S ATOM 0 H CYS B 122 7.209 11.835 23.064 1.00 64.23 H new ATOM 0 HA CYS B 122 9.976 12.417 23.673 1.00 24.42 H new ATOM 0 HB2 CYS B 122 8.707 10.090 22.184 1.00 15.34 H new ATOM 0 HB3 CYS B 122 10.341 10.147 22.814 1.00 15.34 H new ATOM 0 HG CYS B 122 7.482 9.504 24.461 1.00 14.44 H new ATOM 3775 N PRO B 123 11.040 12.990 21.460 1.00 45.45 N ATOM 3776 CA PRO B 123 11.607 13.557 20.222 1.00 1.30 C ATOM 3777 C PRO B 123 11.495 12.606 19.024 1.00 21.43 C ATOM 3778 O PRO B 123 10.794 12.898 18.050 1.00 1.12 O ATOM 3779 CB PRO B 123 13.081 13.808 20.586 1.00 65.25 C ATOM 3780 CG PRO B 123 13.077 13.966 22.068 1.00 12.41 C ATOM 3781 CD PRO B 123 12.015 13.026 22.573 1.00 30.51 C ATOM 0 HA PRO B 123 11.073 14.454 19.908 1.00 1.30 H new ATOM 0 HB2 PRO B 123 13.713 12.976 20.277 1.00 65.25 H new ATOM 0 HB3 PRO B 123 13.465 14.701 20.093 1.00 65.25 H new ATOM 0 HG2 PRO B 123 14.051 13.720 22.491 1.00 12.41 H new ATOM 0 HG3 PRO B 123 12.857 14.995 22.352 1.00 12.41 H new ATOM 0 HD2 PRO B 123 12.421 12.037 22.786 1.00 30.51 H new ATOM 0 HD3 PRO B 123 11.561 13.389 23.495 1.00 30.51 H new ATOM 3789 N TYR B 124 12.163 11.454 19.123 1.00 44.15 N ATOM 3790 CA TYR B 124 12.210 10.479 18.030 1.00 41.53 C ATOM 3791 C TYR B 124 10.808 10.124 17.539 1.00 41.03 C ATOM 3792 O TYR B 124 10.611 9.821 16.365 1.00 24.42 O ATOM 3793 CB TYR B 124 12.930 9.193 18.473 1.00 11.44 C ATOM 3794 CG TYR B 124 14.410 9.368 18.779 1.00 34.02 C ATOM 3795 CD1 TYR B 124 15.391 8.848 17.932 1.00 62.34 C ATOM 3796 CD2 TYR B 124 14.827 10.050 19.919 1.00 4.11 C ATOM 3797 CE1 TYR B 124 16.730 9.004 18.215 1.00 22.14 C ATOM 3798 CE2 TYR B 124 16.169 10.210 20.205 1.00 2.53 C ATOM 3799 CZ TYR B 124 17.116 9.687 19.351 1.00 65.35 C ATOM 3800 OH TYR B 124 18.453 9.844 19.636 1.00 21.31 O ATOM 0 H TYR B 124 12.682 11.172 19.955 1.00 44.15 H new ATOM 0 HA TYR B 124 12.763 10.941 17.213 1.00 41.53 H new ATOM 0 HB2 TYR B 124 12.433 8.802 19.361 1.00 11.44 H new ATOM 0 HB3 TYR B 124 12.821 8.443 17.690 1.00 11.44 H new ATOM 0 HD1 TYR B 124 15.095 8.315 17.041 1.00 62.34 H new ATOM 0 HD2 TYR B 124 14.088 10.461 20.591 1.00 4.11 H new ATOM 0 HE1 TYR B 124 17.476 8.593 17.550 1.00 22.14 H new ATOM 0 HE2 TYR B 124 16.475 10.742 21.094 1.00 2.53 H new ATOM 0 HH TYR B 124 18.986 9.588 18.855 1.00 21.31 H new ATOM 3810 N SER B 125 9.836 10.166 18.440 1.00 44.35 N ATOM 3811 CA SER B 125 8.482 9.753 18.114 1.00 1.10 C ATOM 3812 C SER B 125 7.689 10.880 17.463 1.00 64.23 C ATOM 3813 O SER B 125 6.871 10.639 16.572 1.00 63.41 O ATOM 3814 CB SER B 125 7.786 9.240 19.366 1.00 3.32 C ATOM 3815 OG SER B 125 7.822 10.193 20.408 1.00 24.10 O ATOM 0 H SER B 125 9.962 10.482 19.402 1.00 44.35 H new ATOM 0 HA SER B 125 8.536 8.945 17.384 1.00 1.10 H new ATOM 0 HB2 SER B 125 6.750 8.994 19.132 1.00 3.32 H new ATOM 0 HB3 SER B 125 8.265 8.319 19.698 1.00 3.32 H new ATOM 0 HG SER B 125 8.185 11.037 20.067 1.00 24.10 H new ATOM 3821 N ASN B 126 7.937 12.111 17.893 1.00 74.24 N ATOM 3822 CA ASN B 126 7.301 13.271 17.279 1.00 34.45 C ATOM 3823 C ASN B 126 7.676 13.311 15.799 1.00 33.32 C ATOM 3824 O ASN B 126 6.837 13.537 14.921 1.00 24.11 O ATOM 3825 CB ASN B 126 7.749 14.561 17.990 1.00 64.21 C ATOM 3826 CG ASN B 126 7.117 15.822 17.413 1.00 24.21 C ATOM 3827 OD1 ASN B 126 6.002 15.793 16.886 1.00 13.11 O ATOM 3828 ND2 ASN B 126 7.819 16.943 17.523 1.00 21.23 N ATOM 0 H ASN B 126 8.571 12.332 18.661 1.00 74.24 H new ATOM 0 HA ASN B 126 6.218 13.194 17.375 1.00 34.45 H new ATOM 0 HB2 ASN B 126 7.498 14.489 19.048 1.00 64.21 H new ATOM 0 HB3 ASN B 126 8.834 14.645 17.925 1.00 64.21 H new ATOM 0 HD21 ASN B 126 7.439 17.820 17.165 1.00 21.23 H new ATOM 0 HD22 ASN B 126 8.738 16.928 17.965 1.00 21.23 H new ATOM 3835 N ALA B 127 8.947 13.025 15.543 1.00 42.24 N ATOM 3836 CA ALA B 127 9.509 13.028 14.203 1.00 65.30 C ATOM 3837 C ALA B 127 9.353 11.670 13.507 1.00 53.42 C ATOM 3838 O ALA B 127 9.881 11.474 12.419 1.00 63.33 O ATOM 3839 CB ALA B 127 10.976 13.428 14.274 1.00 44.52 C ATOM 0 H ALA B 127 9.621 12.782 16.269 1.00 42.24 H new ATOM 0 HA ALA B 127 8.957 13.753 13.605 1.00 65.30 H new ATOM 0 HB1 ALA B 127 11.401 13.431 13.270 1.00 44.52 H new ATOM 0 HB2 ALA B 127 11.061 14.425 14.707 1.00 44.52 H new ATOM 0 HB3 ALA B 127 11.518 12.715 14.895 1.00 44.52 H new ATOM 3845 N THR B 128 8.638 10.725 14.118 1.00 13.32 N ATOM 3846 CA THR B 128 8.458 9.412 13.495 1.00 55.14 C ATOM 3847 C THR B 128 7.067 9.323 12.895 1.00 13.14 C ATOM 3848 O THR B 128 6.822 8.551 11.977 1.00 21.45 O ATOM 3849 CB THR B 128 8.672 8.238 14.491 1.00 41.45 C ATOM 3850 OG1 THR B 128 9.101 7.066 13.785 1.00 41.22 O ATOM 3851 CG2 THR B 128 7.396 7.903 15.265 1.00 11.25 C ATOM 0 H THR B 128 8.183 10.838 15.024 1.00 13.32 H new ATOM 0 HA THR B 128 9.217 9.316 12.719 1.00 55.14 H new ATOM 0 HB THR B 128 9.434 8.557 15.202 1.00 41.45 H new ATOM 0 HG1 THR B 128 9.604 6.484 14.392 1.00 41.22 H new ATOM 0 HG21 THR B 128 7.592 7.077 15.949 1.00 11.25 H new ATOM 0 HG22 THR B 128 7.075 8.776 15.833 1.00 11.25 H new ATOM 0 HG23 THR B 128 6.611 7.616 14.565 1.00 11.25 H new ATOM 3859 N ARG B 129 6.166 10.149 13.410 1.00 41.51 N ATOM 3860 CA ARG B 129 4.771 10.111 13.012 1.00 75.21 C ATOM 3861 C ARG B 129 4.490 11.255 12.051 1.00 73.32 C ATOM 3862 O ARG B 129 3.851 11.080 11.016 1.00 44.41 O ATOM 3863 CB ARG B 129 3.873 10.202 14.263 1.00 21.01 C ATOM 3864 CG ARG B 129 3.997 11.511 15.043 1.00 45.10 C ATOM 3865 CD ARG B 129 3.260 11.460 16.379 1.00 21.21 C ATOM 3866 NE ARG B 129 1.835 11.145 16.230 1.00 2.44 N ATOM 3867 CZ ARG B 129 0.948 11.203 17.227 1.00 0.21 C ATOM 3868 NH1 ARG B 129 1.322 11.601 18.436 1.00 5.12 N1+ ATOM 3869 NH2 ARG B 129 -0.315 10.862 17.017 1.00 44.44 N ATOM 0 H ARG B 129 6.382 10.858 14.110 1.00 41.51 H new ATOM 0 HA ARG B 129 4.553 9.172 12.504 1.00 75.21 H new ATOM 0 HB2 ARG B 129 2.834 10.073 13.958 1.00 21.01 H new ATOM 0 HB3 ARG B 129 4.115 9.374 14.929 1.00 21.01 H new ATOM 0 HG2 ARG B 129 5.050 11.728 15.220 1.00 45.10 H new ATOM 0 HG3 ARG B 129 3.599 12.329 14.442 1.00 45.10 H new ATOM 0 HD2 ARG B 129 3.728 10.712 17.019 1.00 21.21 H new ATOM 0 HD3 ARG B 129 3.364 12.421 16.883 1.00 21.21 H new ATOM 0 HE ARG B 129 1.501 10.864 15.308 1.00 2.44 H new ATOM 0 HH11 ARG B 129 2.292 11.865 18.609 1.00 5.12 H new ATOM 0 HH12 ARG B 129 0.640 11.643 19.193 1.00 5.12 H new ATOM 0 HH21 ARG B 129 -0.613 10.554 16.091 1.00 44.44 H new ATOM 0 HH22 ARG B 129 -0.989 10.908 17.781 1.00 44.44 H new ATOM 3883 N ASN B 130 4.988 12.429 12.411 1.00 21.53 N ATOM 3884 CA ASN B 130 4.797 13.630 11.616 1.00 53.34 C ATOM 3885 C ASN B 130 5.750 13.667 10.423 1.00 22.35 C ATOM 3886 O ASN B 130 5.441 14.249 9.380 1.00 70.41 O ATOM 3887 CB ASN B 130 4.976 14.865 12.510 1.00 70.21 C ATOM 3888 CG ASN B 130 3.898 14.945 13.582 1.00 33.52 C ATOM 3889 OD1 ASN B 130 2.720 14.707 13.312 1.00 60.32 O ATOM 3890 ND2 ASN B 130 4.294 15.227 14.811 1.00 74.14 N ATOM 0 H ASN B 130 5.534 12.574 13.260 1.00 21.53 H new ATOM 0 HA ASN B 130 3.785 13.628 11.212 1.00 53.34 H new ATOM 0 HB2 ASN B 130 5.958 14.833 12.983 1.00 70.21 H new ATOM 0 HB3 ASN B 130 4.947 15.766 11.897 1.00 70.21 H new ATOM 0 HD21 ASN B 130 3.616 15.253 15.572 1.00 74.14 H new ATOM 0 HD22 ASN B 130 5.278 15.419 14.998 1.00 74.14 H new ATOM 3897 N ASN B 131 6.907 13.029 10.577 1.00 34.23 N ATOM 3898 CA ASN B 131 7.962 13.078 9.561 1.00 31.43 C ATOM 3899 C ASN B 131 7.995 11.777 8.747 1.00 54.44 C ATOM 3900 O ASN B 131 8.161 11.810 7.526 1.00 13.44 O ATOM 3901 CB ASN B 131 9.321 13.332 10.249 1.00 3.33 C ATOM 3902 CG ASN B 131 10.474 13.724 9.313 1.00 61.21 C ATOM 3903 OD1 ASN B 131 11.384 14.439 9.726 1.00 75.43 O ATOM 3904 ND2 ASN B 131 10.468 13.270 8.065 1.00 34.33 N ATOM 0 H ASN B 131 7.141 12.470 11.397 1.00 34.23 H new ATOM 0 HA ASN B 131 7.755 13.894 8.868 1.00 31.43 H new ATOM 0 HB2 ASN B 131 9.192 14.122 10.988 1.00 3.33 H new ATOM 0 HB3 ASN B 131 9.607 12.431 10.792 1.00 3.33 H new ATOM 0 HD21 ASN B 131 11.228 13.514 7.430 1.00 34.33 H new ATOM 0 HD22 ASN B 131 9.703 12.678 7.741 1.00 34.33 H new ATOM 3911 N VAL B 132 7.798 10.643 9.411 1.00 52.13 N ATOM 3912 CA VAL B 132 7.976 9.329 8.776 1.00 11.30 C ATOM 3913 C VAL B 132 6.653 8.567 8.703 1.00 11.32 C ATOM 3914 O VAL B 132 5.717 8.850 9.452 1.00 35.23 O ATOM 3915 CB VAL B 132 9.030 8.481 9.547 1.00 15.30 C ATOM 3916 CG1 VAL B 132 9.336 7.169 8.823 1.00 32.53 C ATOM 3917 CG2 VAL B 132 10.312 9.283 9.771 1.00 3.12 C ATOM 0 H VAL B 132 7.515 10.601 10.390 1.00 52.13 H new ATOM 0 HA VAL B 132 8.334 9.501 7.761 1.00 11.30 H new ATOM 0 HB VAL B 132 8.603 8.231 10.518 1.00 15.30 H new ATOM 0 HG11 VAL B 132 10.075 6.604 9.391 1.00 32.53 H new ATOM 0 HG12 VAL B 132 8.422 6.582 8.732 1.00 32.53 H new ATOM 0 HG13 VAL B 132 9.729 7.385 7.829 1.00 32.53 H new ATOM 0 HG21 VAL B 132 11.034 8.671 10.311 1.00 3.12 H new ATOM 0 HG22 VAL B 132 10.732 9.575 8.808 1.00 3.12 H new ATOM 0 HG23 VAL B 132 10.085 10.176 10.353 1.00 3.12 H new ATOM 3927 N ALA B 133 6.582 7.612 7.780 1.00 53.04 N ATOM 3928 CA ALA B 133 5.395 6.787 7.610 1.00 53.01 C ATOM 3929 C ALA B 133 5.418 5.615 8.582 1.00 72.23 C ATOM 3930 O ALA B 133 5.964 4.539 8.292 1.00 0.23 O ATOM 3931 CB ALA B 133 5.291 6.312 6.168 1.00 11.23 C ATOM 0 H ALA B 133 7.340 7.391 7.135 1.00 53.04 H new ATOM 0 HA ALA B 133 4.511 7.384 7.833 1.00 53.01 H new ATOM 0 HB1 ALA B 133 4.400 5.696 6.051 1.00 11.23 H new ATOM 0 HB2 ALA B 133 5.225 7.174 5.505 1.00 11.23 H new ATOM 0 HB3 ALA B 133 6.174 5.725 5.914 1.00 11.23 H new ATOM 3937 N VAL B 134 4.841 5.850 9.751 1.00 34.41 N ATOM 3938 CA VAL B 134 4.828 4.874 10.823 1.00 31.34 C ATOM 3939 C VAL B 134 3.408 4.644 11.335 1.00 33.12 C ATOM 3940 O VAL B 134 2.727 5.585 11.747 1.00 12.15 O ATOM 3941 CB VAL B 134 5.721 5.337 11.998 1.00 33.43 C ATOM 3942 CG1 VAL B 134 5.722 4.302 13.110 1.00 61.10 C ATOM 3943 CG2 VAL B 134 7.144 5.623 11.526 1.00 5.41 C ATOM 0 H VAL B 134 4.369 6.725 9.980 1.00 34.41 H new ATOM 0 HA VAL B 134 5.219 3.940 10.419 1.00 31.34 H new ATOM 0 HB VAL B 134 5.305 6.264 12.392 1.00 33.43 H new ATOM 0 HG11 VAL B 134 6.356 4.646 13.927 1.00 61.10 H new ATOM 0 HG12 VAL B 134 4.705 4.159 13.475 1.00 61.10 H new ATOM 0 HG13 VAL B 134 6.106 3.357 12.727 1.00 61.10 H new ATOM 0 HG21 VAL B 134 7.750 5.947 12.372 1.00 5.41 H new ATOM 0 HG22 VAL B 134 7.574 4.718 11.097 1.00 5.41 H new ATOM 0 HG23 VAL B 134 7.126 6.409 10.771 1.00 5.41 H new ATOM 3953 N ARG B 135 2.963 3.394 11.294 1.00 11.21 N ATOM 3954 CA ARG B 135 1.669 3.018 11.849 1.00 24.23 C ATOM 3955 C ARG B 135 1.800 2.744 13.342 1.00 24.22 C ATOM 3956 O ARG B 135 2.567 1.870 13.756 1.00 54.44 O ATOM 3957 CB ARG B 135 1.112 1.774 11.144 1.00 74.32 C ATOM 3958 CG ARG B 135 0.728 2.004 9.688 1.00 34.13 C ATOM 3959 CD ARG B 135 0.225 0.721 9.032 1.00 2.43 C ATOM 3960 NE ARG B 135 1.232 -0.339 9.076 1.00 1.50 N ATOM 3961 CZ ARG B 135 2.228 -0.460 8.197 1.00 23.13 C ATOM 3962 NH1 ARG B 135 2.291 0.351 7.147 1.00 1.54 N1+ ATOM 3963 NH2 ARG B 135 3.138 -1.414 8.347 1.00 14.33 N ATOM 0 H ARG B 135 3.482 2.620 10.880 1.00 11.21 H new ATOM 0 HA ARG B 135 0.978 3.846 11.691 1.00 24.23 H new ATOM 0 HB2 ARG B 135 1.856 0.979 11.191 1.00 74.32 H new ATOM 0 HB3 ARG B 135 0.236 1.423 11.689 1.00 74.32 H new ATOM 0 HG2 ARG B 135 -0.045 2.770 9.631 1.00 34.13 H new ATOM 0 HG3 ARG B 135 1.591 2.381 9.138 1.00 34.13 H new ATOM 0 HD2 ARG B 135 -0.680 0.384 9.537 1.00 2.43 H new ATOM 0 HD3 ARG B 135 -0.045 0.924 7.996 1.00 2.43 H new ATOM 0 HE ARG B 135 1.169 -1.028 9.825 1.00 1.50 H new ATOM 0 HH11 ARG B 135 1.577 1.067 7.012 1.00 1.54 H new ATOM 0 HH12 ARG B 135 3.053 0.258 6.475 1.00 1.54 H new ATOM 0 HH21 ARG B 135 3.077 -2.057 9.136 1.00 14.33 H new ATOM 0 HH22 ARG B 135 3.898 -1.504 7.673 1.00 14.33 H new ATOM 3977 N LEU B 136 1.074 3.512 14.143 1.00 62.51 N ATOM 3978 CA LEU B 136 1.018 3.294 15.574 1.00 72.41 C ATOM 3979 C LEU B 136 -0.053 2.266 15.896 1.00 41.21 C ATOM 3980 O LEU B 136 -1.251 2.551 15.833 1.00 33.52 O ATOM 3981 CB LEU B 136 0.760 4.614 16.303 1.00 60.04 C ATOM 3982 CG LEU B 136 1.934 5.601 16.254 1.00 34.22 C ATOM 3983 CD1 LEU B 136 1.592 6.901 16.978 1.00 41.31 C ATOM 3984 CD2 LEU B 136 3.192 4.961 16.843 1.00 0.00 C ATOM 0 H LEU B 136 0.512 4.298 13.817 1.00 62.51 H new ATOM 0 HA LEU B 136 1.977 2.907 15.918 1.00 72.41 H new ATOM 0 HB2 LEU B 136 -0.119 5.090 15.868 1.00 60.04 H new ATOM 0 HB3 LEU B 136 0.523 4.400 17.345 1.00 60.04 H new ATOM 0 HG LEU B 136 2.129 5.847 15.210 1.00 34.22 H new ATOM 0 HD11 LEU B 136 2.443 7.581 16.927 1.00 41.31 H new ATOM 0 HD12 LEU B 136 0.727 7.365 16.503 1.00 41.31 H new ATOM 0 HD13 LEU B 136 1.361 6.687 18.022 1.00 41.31 H new ATOM 0 HD21 LEU B 136 4.016 5.673 16.801 1.00 0.00 H new ATOM 0 HD22 LEU B 136 3.006 4.681 17.880 1.00 0.00 H new ATOM 0 HD23 LEU B 136 3.451 4.072 16.268 1.00 0.00 H new ATOM 3996 N VAL B 137 0.405 1.068 16.210 1.00 22.01 N ATOM 3997 CA VAL B 137 -0.463 -0.070 16.478 1.00 61.13 C ATOM 3998 C VAL B 137 -0.296 -0.516 17.924 1.00 31.22 C ATOM 3999 O VAL B 137 0.822 -0.735 18.395 1.00 63.04 O ATOM 4000 CB VAL B 137 -0.160 -1.245 15.496 1.00 72.22 C ATOM 4001 CG1 VAL B 137 1.298 -1.212 15.064 1.00 20.11 C ATOM 4002 CG2 VAL B 137 -0.498 -2.613 16.104 1.00 5.14 C ATOM 0 H VAL B 137 1.399 0.853 16.288 1.00 22.01 H new ATOM 0 HA VAL B 137 -1.498 0.234 16.321 1.00 61.13 H new ATOM 0 HB VAL B 137 -0.800 -1.107 14.624 1.00 72.22 H new ATOM 0 HG11 VAL B 137 1.493 -2.038 14.380 1.00 20.11 H new ATOM 0 HG12 VAL B 137 1.508 -0.267 14.562 1.00 20.11 H new ATOM 0 HG13 VAL B 137 1.939 -1.308 15.940 1.00 20.11 H new ATOM 0 HG21 VAL B 137 -0.270 -3.398 15.383 1.00 5.14 H new ATOM 0 HG22 VAL B 137 0.094 -2.766 17.007 1.00 5.14 H new ATOM 0 HG23 VAL B 137 -1.558 -2.648 16.355 1.00 5.14 H new ATOM 4012 N VAL B 138 -1.408 -0.630 18.628 1.00 51.04 N ATOM 4013 CA VAL B 138 -1.399 -1.025 20.026 1.00 24.22 C ATOM 4014 C VAL B 138 -1.757 -2.501 20.139 1.00 70.52 C ATOM 4015 O VAL B 138 -2.633 -2.998 19.424 1.00 62.24 O ATOM 4016 CB VAL B 138 -2.361 -0.171 20.883 1.00 51.45 C ATOM 4017 CG1 VAL B 138 -2.186 1.311 20.564 1.00 13.13 C ATOM 4018 CG2 VAL B 138 -3.800 -0.622 20.693 1.00 0.20 C ATOM 0 H VAL B 138 -2.338 -0.453 18.250 1.00 51.04 H new ATOM 0 HA VAL B 138 -0.394 -0.857 20.414 1.00 24.22 H new ATOM 0 HB VAL B 138 -2.113 -0.315 21.935 1.00 51.45 H new ATOM 0 HG11 VAL B 138 -2.871 1.898 21.176 1.00 13.13 H new ATOM 0 HG12 VAL B 138 -1.160 1.611 20.778 1.00 13.13 H new ATOM 0 HG13 VAL B 138 -2.402 1.484 19.510 1.00 13.13 H new ATOM 0 HG21 VAL B 138 -4.458 -0.006 21.306 1.00 0.20 H new ATOM 0 HG22 VAL B 138 -4.078 -0.518 19.644 1.00 0.20 H new ATOM 0 HG23 VAL B 138 -3.897 -1.666 20.992 1.00 0.20 H new ATOM 4028 N ALA B 139 -1.053 -3.199 20.999 1.00 41.23 N ATOM 4029 CA ALA B 139 -1.171 -4.650 21.101 1.00 52.34 C ATOM 4030 C ALA B 139 -1.765 -5.049 22.450 1.00 22.31 C ATOM 4031 O ALA B 139 -1.100 -4.828 23.485 1.00 10.42 O ATOM 4032 CB ALA B 139 0.187 -5.309 20.885 1.00 71.35 C ATOM 4033 OXT ALA B 139 -2.890 -5.601 22.469 1.00 0.00 O1- ATOM 0 H ALA B 139 -0.383 -2.787 21.649 1.00 41.23 H new ATOM 0 HA ALA B 139 -1.847 -4.999 20.321 1.00 52.34 H new ATOM 0 HB1 ALA B 139 0.083 -6.391 20.964 1.00 71.35 H new ATOM 0 HB2 ALA B 139 0.563 -5.052 19.895 1.00 71.35 H new ATOM 0 HB3 ALA B 139 0.887 -4.956 21.642 1.00 71.35 H new TER 4039 ALA B 139