USER MOD reduce.3.24.130724 H: found=0, std=0, add=1350, rem=0, adj=48 USER MOD reduce.3.24.130724 removed 1339 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 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 1.2: B1008 ASN : amide:sc= -3.94 K(o=-3.9,f=-12!) USER MOD Set 2.1: A 86 SER OG : rot -129:sc= 0.1 USER MOD Set 2.2: A 90 LYS NZ :NH3+ 140:sc= 0.501 (180deg=0) USER MOD Set 2.3: A 93 THR OG1 : rot 180:sc= -0.01 USER MOD Set 2.4: A 96 HIS : no HD1:sc= -0.573 K(o=0.018,f=-3.6) USER MOD Set 3.1: A 62 LYS NZ :NH3+ 175:sc= -0.967 (180deg=-1.21) USER MOD Set 3.2: A 116 SER OG : rot -163:sc= -1.71 USER MOD Set 3.3: A 117 ASN :FLIP amide:sc= 0.0513 F(o=-7.4!,f=-2.8) USER MOD Set 3.4: A 120 HIS : no HD1:sc= -0.218 X(o=-2.8,f=-3.3) USER MOD Set 4.1: A 57 CYS SG : rot -170:sc= -1.26 USER MOD Set 4.2: A 60 SER OG : rot -90:sc= -0.539 USER MOD Set 5.1: A 33 THR OG1 : rot 81:sc= 1.02 USER MOD Set 5.2: A 71 SER OG : rot -131:sc= 0.0578 USER MOD Set 5.3: B1007 TYR OH : rot 79:sc= 1.22 USER MOD Set 6.1: A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 6.2: A 2 GLN : amide:sc= -1.34 K(o=-1.3,f=-3.6!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 3 GLN : amide:sc= -0.472 K(o=-0.47,f=-3.7!) USER MOD Single : A 8 GLN : amide:sc= 0 X(o=0,f=-0.089) USER MOD Single : A 9 ASN :FLIP amide:sc= 0 F(o=-0.93,f=0) USER MOD Single : A 13 THR OG1 : rot 73:sc= 1.15 USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 LYS NZ :NH3+ -121:sc= 0.994 (180deg=-0.134) USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 25 SER OG : rot -39:sc= 0.519 USER MOD Single : A 27 SER OG : rot 148:sc= 0.307 USER MOD Single : A 30 LYS NZ :NH3+ 129:sc= 0.00936 (180deg=-0.0775) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 35 TYR OH : rot 125:sc= -2.2 USER MOD Single : A 39 HIS : no HD1:sc= -0.0925 K(o=-0.093,f=-1.1) USER MOD Single : A 44 SER OG : rot 180:sc=-0.00792 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 53 TYR OH : rot 180:sc= -0.203 USER MOD Single : A 54 SER OG : rot -94:sc= -1.97! USER MOD Single : A 61 HIS : no HE2:sc= -5.35! C(o=-5.3!,f=-8!) USER MOD Single : A 65 SER OG : rot -110:sc= -1.25 USER MOD Single : A 67 TYR OH : rot 180:sc= 0 USER MOD Single : A 76 TYR OH : rot 130:sc= -3.96! USER MOD Single : A 80 THR OG1 : rot 56:sc= 0.621 USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 83 ASN : amide:sc=-0.00477 K(o=-0.0048,f=-1.4) USER MOD Single : A 84 SER OG : rot 180:sc= 0 USER MOD Single : A 85 ASN : amide:sc= -0.1 X(o=-0.1,f=-0.064) USER MOD Single : A 87 SER OG : rot -116:sc= 0.297 USER MOD Single : A 88 SER OG : rot 44:sc= 0.912 USER MOD Single : A 89 ASN : amide:sc= -1.1 K(o=-1.1,f=-1.7) USER MOD Single : A 94 CYS SG : rot -63:sc= -0.529 USER MOD Single : A 99 ASN : amide:sc= -0.93 K(o=-0.93,f=-1.6) USER MOD Single : A 100 THR OG1 : rot 76:sc= 0.215 USER MOD Single : A 106 GLN : amide:sc=-0.00939 K(o=-0.0094,f=-1.5!) USER MOD Single : A 110 SER OG : rot -91:sc= 0.236 USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 121 LYS NZ :NH3+ -151:sc= -0.416 (180deg=-1.24) USER MOD Single : A 123 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.00263) USER MOD Single : A 134 SER OG : rot 180:sc= 0 USER MOD Single : A 138 GLN : amide:sc= -3.03! C(o=-3!,f=-9.3!) USER MOD Single : A 139 LYS NZ :NH3+ -140:sc= -2.61! (180deg=-4.59!) USER MOD Single : A 140 SER OG : rot -7:sc= 1.06 USER MOD Single : A 141 TYR OH : rot 180:sc= 0 USER MOD Single : A 143 ASN : amide:sc= -0.227 K(o=-0.23,f=-0.95) USER MOD Single : A 147 SER OG : rot 180:sc= 0 USER MOD Single : A 148 LYS NZ :NH3+ -166:sc= -0.0324 (180deg=-0.246) USER MOD Single : A 149 CYS SG : rot 180:sc= 0 USER MOD Single : A 152 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 156 HIS : no HD1:sc= 0 X(o=0,f=-0.034) USER MOD Single : A 157 HIS : no HD1:sc= 0 X(o=0,f=-0.097) USER MOD Single : A 158 HIS : no HD1:sc= -0.336 X(o=-0.34,f=0.00012) USER MOD Single : A 159 HIS : no HD1:sc=-0.00709 X(o=-0.0071,f=-0.042) USER MOD Single : A 160 HIS : no HD1:sc= -0.206 X(o=-0.21,f=-0.31) USER MOD Single : A 161 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B1010 TYR OH : rot -15:sc= -0.635 USER MOD Single : B1011 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 3.194 -2.172 -8.954 1.00 44.21 N ATOM 2 CA MET A 1 1.822 -1.679 -8.942 1.00 72.34 C ATOM 3 C MET A 1 0.835 -2.815 -9.194 1.00 13.43 C ATOM 4 O MET A 1 0.962 -3.554 -10.169 1.00 54.13 O ATOM 5 CB MET A 1 1.640 -0.587 -9.998 1.00 43.11 C ATOM 6 CG MET A 1 1.961 0.809 -9.489 1.00 54.22 C ATOM 7 SD MET A 1 1.533 2.097 -10.677 1.00 33.50 S ATOM 8 CE MET A 1 3.030 3.080 -10.665 1.00 31.50 C ATOM 0 H1 MET A 1 3.848 -1.382 -8.781 1.00 44.21 H new ATOM 0 H2 MET A 1 3.312 -2.889 -8.210 1.00 44.21 H new ATOM 0 H3 MET A 1 3.402 -2.597 -9.880 1.00 44.21 H new ATOM 0 HA MET A 1 1.622 -1.258 -7.957 1.00 72.34 H new ATOM 0 HB2 MET A 1 2.279 -0.809 -10.853 1.00 43.11 H new ATOM 0 HB3 MET A 1 0.611 -0.607 -10.356 1.00 43.11 H new ATOM 0 HG2 MET A 1 1.422 0.985 -8.558 1.00 54.22 H new ATOM 0 HG3 MET A 1 3.024 0.872 -9.258 1.00 54.22 H new ATOM 0 HE1 MET A 1 2.920 3.918 -11.353 1.00 31.50 H new ATOM 0 HE2 MET A 1 3.209 3.458 -9.658 1.00 31.50 H new ATOM 0 HE3 MET A 1 3.873 2.463 -10.976 1.00 31.50 H new ATOM 18 N GLN A 2 -0.147 -2.946 -8.308 1.00 31.45 N ATOM 19 CA GLN A 2 -1.155 -3.993 -8.434 1.00 45.22 C ATOM 20 C GLN A 2 -2.512 -3.505 -7.938 1.00 43.23 C ATOM 21 O GLN A 2 -2.650 -2.360 -7.508 1.00 71.04 O ATOM 22 CB GLN A 2 -0.730 -5.237 -7.652 1.00 5.43 C ATOM 23 CG GLN A 2 0.576 -5.845 -8.139 1.00 32.05 C ATOM 24 CD GLN A 2 1.792 -5.216 -7.487 1.00 74.10 C ATOM 25 OE1 GLN A 2 1.669 -4.414 -6.561 1.00 12.01 O ATOM 26 NE2 GLN A 2 2.975 -5.578 -7.969 1.00 1.45 N ATOM 0 H GLN A 2 -0.266 -2.341 -7.496 1.00 31.45 H new ATOM 0 HA GLN A 2 -1.245 -4.250 -9.489 1.00 45.22 H new ATOM 0 HB2 GLN A 2 -0.629 -4.977 -6.598 1.00 5.43 H new ATOM 0 HB3 GLN A 2 -1.518 -5.987 -7.721 1.00 5.43 H new ATOM 0 HG2 GLN A 2 0.572 -6.916 -7.935 1.00 32.05 H new ATOM 0 HG3 GLN A 2 0.646 -5.727 -9.220 1.00 32.05 H new ATOM 0 HE21 GLN A 2 3.030 -6.246 -8.738 1.00 1.45 H new ATOM 0 HE22 GLN A 2 3.829 -5.188 -7.571 1.00 1.45 H new ATOM 35 N GLN A 3 -3.509 -4.381 -8.002 1.00 13.41 N ATOM 36 CA GLN A 3 -4.856 -4.037 -7.560 1.00 62.41 C ATOM 37 C GLN A 3 -5.325 -4.982 -6.458 1.00 65.03 C ATOM 38 O GLN A 3 -6.343 -5.659 -6.599 1.00 61.34 O ATOM 39 CB GLN A 3 -5.830 -4.086 -8.738 1.00 60.14 C ATOM 40 CG GLN A 3 -5.808 -2.833 -9.598 1.00 43.33 C ATOM 41 CD GLN A 3 -6.463 -1.647 -8.918 1.00 54.25 C ATOM 42 OE1 GLN A 3 -5.820 -0.628 -8.665 1.00 40.02 O ATOM 43 NE2 GLN A 3 -7.751 -1.773 -8.619 1.00 61.20 N ATOM 0 H GLN A 3 -3.410 -5.333 -8.355 1.00 13.41 H new ATOM 0 HA GLN A 3 -4.832 -3.024 -7.159 1.00 62.41 H new ATOM 0 HB2 GLN A 3 -5.591 -4.948 -9.361 1.00 60.14 H new ATOM 0 HB3 GLN A 3 -6.840 -4.238 -8.357 1.00 60.14 H new ATOM 0 HG2 GLN A 3 -4.776 -2.582 -9.842 1.00 43.33 H new ATOM 0 HG3 GLN A 3 -6.318 -3.034 -10.540 1.00 43.33 H new ATOM 0 HE21 GLN A 3 -8.245 -2.636 -8.847 1.00 61.20 H new ATOM 0 HE22 GLN A 3 -8.246 -1.007 -8.162 1.00 61.20 H new ATOM 52 N ASP A 4 -4.575 -5.022 -5.362 1.00 71.42 N ATOM 53 CA ASP A 4 -4.914 -5.884 -4.235 1.00 52.24 C ATOM 54 C ASP A 4 -5.483 -5.067 -3.079 1.00 62.20 C ATOM 55 O ASP A 4 -6.251 -5.578 -2.264 1.00 71.20 O ATOM 56 CB ASP A 4 -3.681 -6.660 -3.770 1.00 52.01 C ATOM 57 CG ASP A 4 -3.157 -7.605 -4.833 1.00 45.34 C ATOM 58 OD1 ASP A 4 -3.890 -7.866 -5.810 1.00 14.02 O ATOM 59 OD2 ASP A 4 -2.012 -8.082 -4.690 1.00 22.14 O ATOM 0 H ASP A 4 -3.729 -4.468 -5.230 1.00 71.42 H new ATOM 0 HA ASP A 4 -5.675 -6.591 -4.565 1.00 52.24 H new ATOM 0 HB2 ASP A 4 -2.895 -5.957 -3.494 1.00 52.01 H new ATOM 0 HB3 ASP A 4 -3.930 -7.228 -2.874 1.00 52.01 H new ATOM 64 N ASP A 5 -5.099 -3.797 -3.014 1.00 34.01 N ATOM 65 CA ASP A 5 -5.571 -2.909 -1.957 1.00 61.33 C ATOM 66 C ASP A 5 -5.869 -1.518 -2.509 1.00 22.52 C ATOM 67 O ASP A 5 -5.262 -0.532 -2.092 1.00 43.35 O ATOM 68 CB ASP A 5 -4.532 -2.816 -0.839 1.00 20.23 C ATOM 69 CG ASP A 5 -5.157 -2.511 0.508 1.00 13.32 C ATOM 70 OD1 ASP A 5 -5.856 -1.481 0.619 1.00 63.13 O ATOM 71 OD2 ASP A 5 -4.949 -3.302 1.452 1.00 41.34 O ATOM 0 H ASP A 5 -4.463 -3.359 -3.680 1.00 34.01 H new ATOM 0 HA ASP A 5 -6.494 -3.324 -1.551 1.00 61.33 H new ATOM 0 HB2 ASP A 5 -3.984 -3.756 -0.777 1.00 20.23 H new ATOM 0 HB3 ASP A 5 -3.807 -2.040 -1.084 1.00 20.23 H new ATOM 76 N ASP A 6 -6.806 -1.448 -3.448 1.00 22.42 N ATOM 77 CA ASP A 6 -7.184 -0.179 -4.057 1.00 15.52 C ATOM 78 C ASP A 6 -8.298 0.495 -3.261 1.00 10.11 C ATOM 79 O ASP A 6 -8.550 0.145 -2.108 1.00 12.22 O ATOM 80 CB ASP A 6 -7.634 -0.396 -5.503 1.00 5.34 C ATOM 81 CG ASP A 6 -7.142 0.697 -6.432 1.00 15.03 C ATOM 82 OD1 ASP A 6 -5.939 1.025 -6.378 1.00 21.35 O ATOM 83 OD2 ASP A 6 -7.962 1.225 -7.212 1.00 50.24 O ATOM 0 H ASP A 6 -7.318 -2.256 -3.804 1.00 22.42 H new ATOM 0 HA ASP A 6 -6.311 0.473 -4.050 1.00 15.52 H new ATOM 0 HB2 ASP A 6 -7.266 -1.360 -5.854 1.00 5.34 H new ATOM 0 HB3 ASP A 6 -8.723 -0.437 -5.540 1.00 5.34 H new ATOM 88 N PHE A 7 -8.961 1.464 -3.884 1.00 23.01 N ATOM 89 CA PHE A 7 -10.046 2.189 -3.233 1.00 71.52 C ATOM 90 C PHE A 7 -11.049 1.222 -2.611 1.00 75.43 C ATOM 91 O PHE A 7 -11.754 1.567 -1.663 1.00 44.41 O ATOM 92 CB PHE A 7 -10.754 3.099 -4.238 1.00 52.52 C ATOM 93 CG PHE A 7 -11.366 4.320 -3.613 1.00 54.20 C ATOM 94 CD1 PHE A 7 -10.600 5.178 -2.841 1.00 21.24 C ATOM 95 CD2 PHE A 7 -12.709 4.610 -3.797 1.00 61.24 C ATOM 96 CE1 PHE A 7 -11.160 6.302 -2.264 1.00 51.32 C ATOM 97 CE2 PHE A 7 -13.274 5.733 -3.224 1.00 34.12 C ATOM 98 CZ PHE A 7 -12.499 6.579 -2.455 1.00 54.53 C ATOM 0 H PHE A 7 -8.766 1.765 -4.839 1.00 23.01 H new ATOM 0 HA PHE A 7 -9.617 2.800 -2.439 1.00 71.52 H new ATOM 0 HB2 PHE A 7 -10.040 3.410 -5.000 1.00 52.52 H new ATOM 0 HB3 PHE A 7 -11.534 2.530 -4.745 1.00 52.52 H new ATOM 0 HD1 PHE A 7 -9.552 4.966 -2.688 1.00 21.24 H new ATOM 0 HD2 PHE A 7 -13.321 3.951 -4.395 1.00 61.24 H new ATOM 0 HE1 PHE A 7 -10.551 6.963 -1.665 1.00 51.32 H new ATOM 0 HE2 PHE A 7 -14.321 5.949 -3.377 1.00 34.12 H new ATOM 0 HZ PHE A 7 -12.940 7.456 -2.004 1.00 54.53 H new ATOM 108 N GLN A 8 -11.108 0.009 -3.153 1.00 51.54 N ATOM 109 CA GLN A 8 -12.026 -1.007 -2.653 1.00 21.02 C ATOM 110 C GLN A 8 -11.933 -1.124 -1.135 1.00 14.10 C ATOM 111 O GLN A 8 -12.925 -0.952 -0.428 1.00 54.01 O ATOM 112 CB GLN A 8 -11.724 -2.360 -3.300 1.00 0.13 C ATOM 113 CG GLN A 8 -12.322 -3.540 -2.550 1.00 50.44 C ATOM 114 CD GLN A 8 -12.902 -4.588 -3.479 1.00 40.35 C ATOM 115 OE1 GLN A 8 -13.763 -4.291 -4.308 1.00 35.31 O ATOM 116 NE2 GLN A 8 -12.431 -5.822 -3.347 1.00 35.33 N ATOM 0 H GLN A 8 -10.531 -0.293 -3.938 1.00 51.54 H new ATOM 0 HA GLN A 8 -13.040 -0.705 -2.915 1.00 21.02 H new ATOM 0 HB2 GLN A 8 -12.105 -2.358 -4.321 1.00 0.13 H new ATOM 0 HB3 GLN A 8 -10.644 -2.490 -3.363 1.00 0.13 H new ATOM 0 HG2 GLN A 8 -11.553 -3.997 -1.927 1.00 50.44 H new ATOM 0 HG3 GLN A 8 -13.103 -3.182 -1.880 1.00 50.44 H new ATOM 0 HE21 GLN A 8 -11.717 -6.023 -2.647 1.00 35.33 H new ATOM 0 HE22 GLN A 8 -12.783 -6.569 -3.946 1.00 35.33 H new ATOM 125 N ASN A 9 -10.735 -1.418 -0.641 1.00 11.00 N ATOM 126 CA ASN A 9 -10.513 -1.559 0.794 1.00 54.14 C ATOM 127 C ASN A 9 -11.013 -0.329 1.545 1.00 50.43 C ATOM 128 O ASN A 9 -11.777 -0.441 2.503 1.00 34.13 O ATOM 129 CB ASN A 9 -9.027 -1.777 1.082 1.00 63.51 C ATOM 130 CG ASN A 9 -8.614 -3.228 0.921 1.00 2.25 C ATOM 131 OD1 ASN A 9 -9.060 -3.854 -0.162 1.00 1.44 O flip ATOM 132 ND2 ASN A 9 -7.902 -3.779 1.761 1.00 1.55 N flip ATOM 0 H ASN A 9 -9.903 -1.563 -1.213 1.00 11.00 H new ATOM 0 HA ASN A 9 -11.074 -2.427 1.140 1.00 54.14 H new ATOM 0 HB2 ASN A 9 -8.434 -1.157 0.410 1.00 63.51 H new ATOM 0 HB3 ASN A 9 -8.804 -1.449 2.097 1.00 63.51 H new ATOM 0 HD21 ASN A 9 -7.582 -3.259 2.578 1.00 1.55 H new ATOM 0 HD22 ASN A 9 -7.632 -4.755 1.640 1.00 1.55 H new ATOM 139 N PHE A 10 -10.576 0.846 1.102 1.00 34.11 N ATOM 140 CA PHE A 10 -10.979 2.098 1.732 1.00 24.12 C ATOM 141 C PHE A 10 -12.499 2.228 1.762 1.00 43.00 C ATOM 142 O PHE A 10 -13.119 2.151 2.822 1.00 31.55 O ATOM 143 CB PHE A 10 -10.368 3.287 0.988 1.00 52.31 C ATOM 144 CG PHE A 10 -10.486 4.586 1.734 1.00 72.34 C ATOM 145 CD1 PHE A 10 -9.860 4.756 2.958 1.00 51.33 C ATOM 146 CD2 PHE A 10 -11.224 5.636 1.211 1.00 62.45 C ATOM 147 CE1 PHE A 10 -9.966 5.950 3.646 1.00 13.04 C ATOM 148 CE2 PHE A 10 -11.333 6.832 1.894 1.00 32.33 C ATOM 149 CZ PHE A 10 -10.705 6.989 3.114 1.00 22.33 C ATOM 0 H PHE A 10 -9.943 0.957 0.310 1.00 34.11 H new ATOM 0 HA PHE A 10 -10.613 2.094 2.759 1.00 24.12 H new ATOM 0 HB2 PHE A 10 -9.315 3.082 0.795 1.00 52.31 H new ATOM 0 HB3 PHE A 10 -10.856 3.388 0.019 1.00 52.31 H new ATOM 0 HD1 PHE A 10 -9.283 3.946 3.379 1.00 51.33 H new ATOM 0 HD2 PHE A 10 -11.720 5.518 0.259 1.00 62.45 H new ATOM 0 HE1 PHE A 10 -9.472 6.071 4.599 1.00 13.04 H new ATOM 0 HE2 PHE A 10 -11.909 7.644 1.474 1.00 32.33 H new ATOM 0 HZ PHE A 10 -10.791 7.922 3.651 1.00 22.33 H new ATOM 159 N VAL A 11 -13.093 2.427 0.590 1.00 43.04 N ATOM 160 CA VAL A 11 -14.540 2.568 0.480 1.00 62.32 C ATOM 161 C VAL A 11 -15.259 1.469 1.254 1.00 60.53 C ATOM 162 O VAL A 11 -16.217 1.732 1.980 1.00 72.34 O ATOM 163 CB VAL A 11 -14.998 2.529 -0.990 1.00 65.03 C ATOM 164 CG1 VAL A 11 -16.206 1.619 -1.150 1.00 22.22 C ATOM 165 CG2 VAL A 11 -15.307 3.932 -1.488 1.00 55.55 C ATOM 0 H VAL A 11 -12.594 2.494 -0.297 1.00 43.04 H new ATOM 0 HA VAL A 11 -14.797 3.537 0.907 1.00 62.32 H new ATOM 0 HB VAL A 11 -14.187 2.124 -1.595 1.00 65.03 H new ATOM 0 HG11 VAL A 11 -16.515 1.605 -2.195 1.00 22.22 H new ATOM 0 HG12 VAL A 11 -15.945 0.609 -0.835 1.00 22.22 H new ATOM 0 HG13 VAL A 11 -17.025 1.991 -0.535 1.00 22.22 H new ATOM 0 HG21 VAL A 11 -15.629 3.886 -2.528 1.00 55.55 H new ATOM 0 HG22 VAL A 11 -16.101 4.367 -0.881 1.00 55.55 H new ATOM 0 HG23 VAL A 11 -14.413 4.550 -1.412 1.00 55.55 H new ATOM 175 N ALA A 12 -14.789 0.236 1.094 1.00 75.43 N ATOM 176 CA ALA A 12 -15.386 -0.904 1.779 1.00 11.04 C ATOM 177 C ALA A 12 -15.469 -0.658 3.282 1.00 32.41 C ATOM 178 O ALA A 12 -16.522 -0.840 3.895 1.00 70.33 O ATOM 179 CB ALA A 12 -14.590 -2.168 1.492 1.00 20.55 C ATOM 0 H ALA A 12 -13.997 0.001 0.496 1.00 75.43 H new ATOM 0 HA ALA A 12 -16.400 -1.034 1.402 1.00 11.04 H new ATOM 0 HB1 ALA A 12 -15.047 -3.011 2.010 1.00 20.55 H new ATOM 0 HB2 ALA A 12 -14.586 -2.360 0.419 1.00 20.55 H new ATOM 0 HB3 ALA A 12 -13.565 -2.040 1.841 1.00 20.55 H new ATOM 185 N THR A 13 -14.352 -0.245 3.872 1.00 11.33 N ATOM 186 CA THR A 13 -14.298 0.024 5.304 1.00 72.13 C ATOM 187 C THR A 13 -15.336 1.065 5.707 1.00 1.12 C ATOM 188 O THR A 13 -16.141 0.837 6.611 1.00 23.43 O ATOM 189 CB THR A 13 -12.902 0.515 5.731 1.00 31.31 C ATOM 190 OG1 THR A 13 -11.898 -0.388 5.253 1.00 11.42 O ATOM 191 CG2 THR A 13 -12.809 0.629 7.245 1.00 2.41 C ATOM 0 H THR A 13 -13.472 -0.089 3.380 1.00 11.33 H new ATOM 0 HA THR A 13 -14.515 -0.916 5.811 1.00 72.13 H new ATOM 0 HB THR A 13 -12.739 1.502 5.297 1.00 31.31 H new ATOM 0 HG1 THR A 13 -11.800 -0.285 4.283 1.00 11.42 H new ATOM 0 HG21 THR A 13 -11.814 0.977 7.523 1.00 2.41 H new ATOM 0 HG22 THR A 13 -13.555 1.338 7.603 1.00 2.41 H new ATOM 0 HG23 THR A 13 -12.991 -0.347 7.695 1.00 2.41 H new ATOM 199 N LEU A 14 -15.313 2.209 5.032 1.00 71.32 N ATOM 200 CA LEU A 14 -16.254 3.286 5.320 1.00 45.23 C ATOM 201 C LEU A 14 -17.694 2.797 5.204 1.00 3.33 C ATOM 202 O LEU A 14 -18.486 2.948 6.133 1.00 12.14 O ATOM 203 CB LEU A 14 -16.023 4.459 4.365 1.00 11.34 C ATOM 204 CG LEU A 14 -16.450 5.835 4.878 1.00 54.23 C ATOM 205 CD1 LEU A 14 -15.761 6.152 6.196 1.00 62.23 C ATOM 206 CD2 LEU A 14 -16.145 6.908 3.843 1.00 50.13 C ATOM 0 H LEU A 14 -14.653 2.415 4.282 1.00 71.32 H new ATOM 0 HA LEU A 14 -16.085 3.619 6.344 1.00 45.23 H new ATOM 0 HB2 LEU A 14 -14.962 4.498 4.119 1.00 11.34 H new ATOM 0 HB3 LEU A 14 -16.558 4.257 3.437 1.00 11.34 H new ATOM 0 HG LEU A 14 -17.526 5.819 5.050 1.00 54.23 H new ATOM 0 HD11 LEU A 14 -16.078 7.135 6.545 1.00 62.23 H new ATOM 0 HD12 LEU A 14 -16.030 5.400 6.937 1.00 62.23 H new ATOM 0 HD13 LEU A 14 -14.681 6.149 6.052 1.00 62.23 H new ATOM 0 HD21 LEU A 14 -16.455 7.881 4.225 1.00 50.13 H new ATOM 0 HD22 LEU A 14 -15.074 6.923 3.639 1.00 50.13 H new ATOM 0 HD23 LEU A 14 -16.687 6.690 2.922 1.00 50.13 H new ATOM 218 N GLU A 15 -18.024 2.209 4.059 1.00 42.45 N ATOM 219 CA GLU A 15 -19.369 1.697 3.823 1.00 4.13 C ATOM 220 C GLU A 15 -19.836 0.837 4.994 1.00 3.12 C ATOM 221 O GLU A 15 -20.845 1.135 5.633 1.00 72.43 O ATOM 222 CB GLU A 15 -19.408 0.881 2.529 1.00 14.34 C ATOM 223 CG GLU A 15 -19.012 1.676 1.296 1.00 32.04 C ATOM 224 CD GLU A 15 -20.206 2.077 0.452 1.00 33.02 C ATOM 225 OE1 GLU A 15 -21.094 1.226 0.238 1.00 55.05 O ATOM 226 OE2 GLU A 15 -20.252 3.243 0.006 1.00 31.23 O ATOM 0 H GLU A 15 -17.379 2.075 3.280 1.00 42.45 H new ATOM 0 HA GLU A 15 -20.043 2.548 3.728 1.00 4.13 H new ATOM 0 HB2 GLU A 15 -18.741 0.025 2.629 1.00 14.34 H new ATOM 0 HB3 GLU A 15 -20.414 0.486 2.389 1.00 14.34 H new ATOM 0 HG2 GLU A 15 -18.472 2.572 1.604 1.00 32.04 H new ATOM 0 HG3 GLU A 15 -18.327 1.083 0.691 1.00 32.04 H new ATOM 233 N SER A 16 -19.094 -0.231 5.269 1.00 1.14 N ATOM 234 CA SER A 16 -19.434 -1.137 6.360 1.00 24.21 C ATOM 235 C SER A 16 -19.540 -0.381 7.681 1.00 34.41 C ATOM 236 O SER A 16 -20.308 -0.760 8.566 1.00 72.01 O ATOM 237 CB SER A 16 -18.385 -2.245 6.476 1.00 3.25 C ATOM 238 OG SER A 16 -18.824 -3.274 7.346 1.00 2.44 O ATOM 0 H SER A 16 -18.254 -0.490 4.752 1.00 1.14 H new ATOM 0 HA SER A 16 -20.403 -1.585 6.139 1.00 24.21 H new ATOM 0 HB2 SER A 16 -18.180 -2.661 5.490 1.00 3.25 H new ATOM 0 HB3 SER A 16 -17.449 -1.827 6.846 1.00 3.25 H new ATOM 0 HG SER A 16 -18.137 -3.970 7.402 1.00 2.44 H new ATOM 244 N PHE A 17 -18.764 0.690 7.807 1.00 73.11 N ATOM 245 CA PHE A 17 -18.770 1.500 9.020 1.00 64.33 C ATOM 246 C PHE A 17 -20.174 2.012 9.326 1.00 72.54 C ATOM 247 O PHE A 17 -20.764 1.666 10.350 1.00 53.34 O ATOM 248 CB PHE A 17 -17.805 2.679 8.875 1.00 31.34 C ATOM 249 CG PHE A 17 -17.149 3.078 10.166 1.00 15.23 C ATOM 250 CD1 PHE A 17 -16.601 2.122 11.005 1.00 22.32 C ATOM 251 CD2 PHE A 17 -17.082 4.410 10.541 1.00 14.52 C ATOM 252 CE1 PHE A 17 -15.996 2.486 12.194 1.00 74.03 C ATOM 253 CE2 PHE A 17 -16.479 4.781 11.728 1.00 20.32 C ATOM 254 CZ PHE A 17 -15.936 3.817 12.556 1.00 54.30 C ATOM 0 H PHE A 17 -18.123 1.017 7.084 1.00 73.11 H new ATOM 0 HA PHE A 17 -18.444 0.871 9.849 1.00 64.33 H new ATOM 0 HB2 PHE A 17 -17.034 2.420 8.150 1.00 31.34 H new ATOM 0 HB3 PHE A 17 -18.347 3.535 8.472 1.00 31.34 H new ATOM 0 HD1 PHE A 17 -16.647 1.079 10.727 1.00 22.32 H new ATOM 0 HD2 PHE A 17 -17.506 5.167 9.898 1.00 14.52 H new ATOM 0 HE1 PHE A 17 -15.571 1.730 12.838 1.00 74.03 H new ATOM 0 HE2 PHE A 17 -16.432 5.823 12.008 1.00 20.32 H new ATOM 0 HZ PHE A 17 -15.465 4.104 13.485 1.00 54.30 H new ATOM 264 N LYS A 18 -20.704 2.838 8.430 1.00 32.03 N ATOM 265 CA LYS A 18 -22.039 3.398 8.602 1.00 53.42 C ATOM 266 C LYS A 18 -23.078 2.292 8.759 1.00 43.21 C ATOM 267 O LYS A 18 -24.026 2.423 9.533 1.00 40.40 O ATOM 268 CB LYS A 18 -22.400 4.285 7.408 1.00 42.13 C ATOM 269 CG LYS A 18 -22.056 3.665 6.064 1.00 12.33 C ATOM 270 CD LYS A 18 -22.605 4.491 4.913 1.00 60.14 C ATOM 271 CE LYS A 18 -22.829 3.639 3.673 1.00 64.42 C ATOM 272 NZ LYS A 18 -22.621 4.416 2.420 1.00 5.41 N ATOM 0 H LYS A 18 -20.229 3.134 7.577 1.00 32.03 H new ATOM 0 HA LYS A 18 -22.038 4.002 9.509 1.00 53.42 H new ATOM 0 HB2 LYS A 18 -23.468 4.501 7.436 1.00 42.13 H new ATOM 0 HB3 LYS A 18 -21.879 5.238 7.503 1.00 42.13 H new ATOM 0 HG2 LYS A 18 -20.974 3.579 5.968 1.00 12.33 H new ATOM 0 HG3 LYS A 18 -22.461 2.654 6.014 1.00 12.33 H new ATOM 0 HD2 LYS A 18 -23.545 4.954 5.212 1.00 60.14 H new ATOM 0 HD3 LYS A 18 -21.911 5.299 4.680 1.00 60.14 H new ATOM 0 HE2 LYS A 18 -22.148 2.788 3.690 1.00 64.42 H new ATOM 0 HE3 LYS A 18 -23.842 3.237 3.687 1.00 64.42 H new ATOM 0 HZ1 LYS A 18 -22.783 3.800 1.598 1.00 5.41 H new ATOM 0 HZ2 LYS A 18 -23.288 5.214 2.391 1.00 5.41 H new ATOM 0 HZ3 LYS A 18 -21.647 4.778 2.394 1.00 5.41 H new ATOM 286 N ASP A 19 -22.891 1.203 8.021 1.00 13.23 N ATOM 287 CA ASP A 19 -23.811 0.073 8.081 1.00 62.21 C ATOM 288 C ASP A 19 -23.957 -0.434 9.512 1.00 10.24 C ATOM 289 O ASP A 19 -25.000 -0.970 9.889 1.00 61.30 O ATOM 290 CB ASP A 19 -23.322 -1.058 7.174 1.00 53.30 C ATOM 291 CG ASP A 19 -24.407 -2.076 6.883 1.00 21.20 C ATOM 292 OD1 ASP A 19 -24.899 -2.709 7.841 1.00 60.53 O ATOM 293 OD2 ASP A 19 -24.764 -2.239 5.698 1.00 74.41 O ATOM 0 H ASP A 19 -22.112 1.079 7.375 1.00 13.23 H new ATOM 0 HA ASP A 19 -24.787 0.412 7.734 1.00 62.21 H new ATOM 0 HB2 ASP A 19 -22.961 -0.637 6.235 1.00 53.30 H new ATOM 0 HB3 ASP A 19 -22.476 -1.558 7.645 1.00 53.30 H new ATOM 298 N LEU A 20 -22.906 -0.261 10.306 1.00 64.32 N ATOM 299 CA LEU A 20 -22.916 -0.702 11.696 1.00 10.14 C ATOM 300 C LEU A 20 -24.147 -0.174 12.426 1.00 74.23 C ATOM 301 O LEU A 20 -24.793 0.772 11.973 1.00 23.22 O ATOM 302 CB LEU A 20 -21.647 -0.233 12.410 1.00 62.20 C ATOM 303 CG LEU A 20 -20.338 -0.870 11.940 1.00 55.01 C ATOM 304 CD1 LEU A 20 -19.162 0.047 12.236 1.00 41.12 C ATOM 305 CD2 LEU A 20 -20.139 -2.227 12.599 1.00 5.24 C ATOM 0 H LEU A 20 -22.036 0.182 10.011 1.00 64.32 H new ATOM 0 HA LEU A 20 -22.950 -1.791 11.705 1.00 10.14 H new ATOM 0 HB2 LEU A 20 -21.565 0.847 12.291 1.00 62.20 H new ATOM 0 HB3 LEU A 20 -21.761 -0.429 13.476 1.00 62.20 H new ATOM 0 HG LEU A 20 -20.394 -1.017 10.861 1.00 55.01 H new ATOM 0 HD11 LEU A 20 -18.239 -0.423 11.895 1.00 41.12 H new ATOM 0 HD12 LEU A 20 -19.300 0.995 11.716 1.00 41.12 H new ATOM 0 HD13 LEU A 20 -19.102 0.227 13.309 1.00 41.12 H new ATOM 0 HD21 LEU A 20 -19.203 -2.666 12.253 1.00 5.24 H new ATOM 0 HD22 LEU A 20 -20.104 -2.104 13.681 1.00 5.24 H new ATOM 0 HD23 LEU A 20 -20.967 -2.885 12.335 1.00 5.24 H new ATOM 317 N LYS A 21 -24.467 -0.791 13.559 1.00 51.55 N ATOM 318 CA LYS A 21 -25.619 -0.382 14.354 1.00 42.22 C ATOM 319 C LYS A 21 -25.403 1.005 14.951 1.00 51.21 C ATOM 320 O LYS A 21 -26.361 1.718 15.252 1.00 62.34 O ATOM 321 CB LYS A 21 -25.878 -1.395 15.471 1.00 14.21 C ATOM 322 CG LYS A 21 -24.651 -1.700 16.312 1.00 32.53 C ATOM 323 CD LYS A 21 -24.102 -3.085 16.014 1.00 23.43 C ATOM 324 CE LYS A 21 -22.606 -3.161 16.282 1.00 72.14 C ATOM 325 NZ LYS A 21 -22.108 -4.564 16.253 1.00 60.10 N ATOM 0 H LYS A 21 -23.944 -1.576 13.947 1.00 51.55 H new ATOM 0 HA LYS A 21 -26.488 -0.344 13.697 1.00 42.22 H new ATOM 0 HB2 LYS A 21 -26.667 -1.014 16.119 1.00 14.21 H new ATOM 0 HB3 LYS A 21 -26.246 -2.322 15.031 1.00 14.21 H new ATOM 0 HG2 LYS A 21 -23.881 -0.953 16.119 1.00 32.53 H new ATOM 0 HG3 LYS A 21 -24.906 -1.628 17.369 1.00 32.53 H new ATOM 0 HD2 LYS A 21 -24.620 -3.823 16.627 1.00 23.43 H new ATOM 0 HD3 LYS A 21 -24.300 -3.340 14.973 1.00 23.43 H new ATOM 0 HE2 LYS A 21 -22.073 -2.571 15.536 1.00 72.14 H new ATOM 0 HE3 LYS A 21 -22.388 -2.718 17.254 1.00 72.14 H new ATOM 0 HZ1 LYS A 21 -21.676 -4.798 17.170 1.00 60.10 H new ATOM 0 HZ2 LYS A 21 -22.902 -5.210 16.069 1.00 60.10 H new ATOM 0 HZ3 LYS A 21 -21.398 -4.665 15.500 1.00 60.10 H new ATOM 339 N SER A 22 -24.140 1.382 15.118 1.00 4.45 N ATOM 340 CA SER A 22 -23.799 2.684 15.682 1.00 64.53 C ATOM 341 C SER A 22 -22.965 3.500 14.698 1.00 31.43 C ATOM 342 O SER A 22 -23.275 4.656 14.415 1.00 60.13 O ATOM 343 CB SER A 22 -23.033 2.510 16.995 1.00 73.31 C ATOM 344 OG SER A 22 -23.190 3.644 17.830 1.00 21.44 O ATOM 0 H SER A 22 -23.336 0.805 14.871 1.00 4.45 H new ATOM 0 HA SER A 22 -24.727 3.221 15.879 1.00 64.53 H new ATOM 0 HB2 SER A 22 -23.391 1.620 17.513 1.00 73.31 H new ATOM 0 HB3 SER A 22 -21.975 2.353 16.785 1.00 73.31 H new ATOM 0 HG SER A 22 -22.693 3.508 18.663 1.00 21.44 H new ATOM 350 N GLY A 23 -21.904 2.887 14.181 1.00 52.51 N ATOM 351 CA GLY A 23 -21.041 3.571 13.235 1.00 34.11 C ATOM 352 C GLY A 23 -19.685 3.904 13.824 1.00 41.23 C ATOM 353 O GLY A 23 -19.074 4.910 13.461 1.00 11.24 O ATOM 0 H GLY A 23 -21.627 1.930 14.400 1.00 52.51 H new ATOM 0 HA2 GLY A 23 -20.907 2.946 12.352 1.00 34.11 H new ATOM 0 HA3 GLY A 23 -21.526 4.490 12.904 1.00 34.11 H new ATOM 357 N ILE A 24 -19.213 3.060 14.735 1.00 73.44 N ATOM 358 CA ILE A 24 -17.921 3.271 15.375 1.00 61.43 C ATOM 359 C ILE A 24 -17.155 1.959 15.512 1.00 42.31 C ATOM 360 O ILE A 24 -17.728 0.927 15.860 1.00 50.03 O ATOM 361 CB ILE A 24 -18.080 3.907 16.768 1.00 41.41 C ATOM 362 CG1 ILE A 24 -18.610 5.337 16.642 1.00 51.12 C ATOM 363 CG2 ILE A 24 -16.753 3.893 17.512 1.00 62.53 C ATOM 364 CD1 ILE A 24 -19.977 5.532 17.260 1.00 61.50 C ATOM 0 H ILE A 24 -19.706 2.223 15.046 1.00 73.44 H new ATOM 0 HA ILE A 24 -17.360 3.952 14.736 1.00 61.43 H new ATOM 0 HB ILE A 24 -18.800 3.321 17.338 1.00 41.41 H new ATOM 0 HG12 ILE A 24 -17.905 6.020 17.116 1.00 51.12 H new ATOM 0 HG13 ILE A 24 -18.655 5.607 15.587 1.00 51.12 H new ATOM 0 HG21 ILE A 24 -16.882 4.346 18.495 1.00 62.53 H new ATOM 0 HG22 ILE A 24 -16.412 2.864 17.629 1.00 62.53 H new ATOM 0 HG23 ILE A 24 -16.013 4.459 16.946 1.00 62.53 H new ATOM 0 HD11 ILE A 24 -20.289 6.569 17.133 1.00 61.50 H new ATOM 0 HD12 ILE A 24 -20.695 4.874 16.770 1.00 61.50 H new ATOM 0 HD13 ILE A 24 -19.933 5.294 18.323 1.00 61.50 H new ATOM 376 N SER A 25 -15.855 2.008 15.238 1.00 50.22 N ATOM 377 CA SER A 25 -15.010 0.824 15.329 1.00 64.54 C ATOM 378 C SER A 25 -13.569 1.154 14.952 1.00 4.30 C ATOM 379 O SER A 25 -13.293 1.600 13.839 1.00 3.42 O ATOM 380 CB SER A 25 -15.546 -0.283 14.418 1.00 43.42 C ATOM 381 OG SER A 25 -16.110 -1.339 15.176 1.00 44.23 O ATOM 0 H SER A 25 -15.365 2.855 14.951 1.00 50.22 H new ATOM 0 HA SER A 25 -15.027 0.475 16.362 1.00 64.54 H new ATOM 0 HB2 SER A 25 -16.299 0.128 13.745 1.00 43.42 H new ATOM 0 HB3 SER A 25 -14.739 -0.669 13.796 1.00 43.42 H new ATOM 0 HG SER A 25 -15.560 -1.502 15.970 1.00 44.23 H new ATOM 387 N GLY A 26 -12.652 0.932 15.890 1.00 74.24 N ATOM 388 CA GLY A 26 -11.251 1.211 15.638 1.00 3.53 C ATOM 389 C GLY A 26 -10.728 0.494 14.410 1.00 43.45 C ATOM 390 O GLY A 26 -10.065 1.098 13.566 1.00 62.53 O ATOM 0 H GLY A 26 -12.855 0.564 16.819 1.00 74.24 H new ATOM 0 HA2 GLY A 26 -11.115 2.285 15.513 1.00 3.53 H new ATOM 0 HA3 GLY A 26 -10.663 0.914 16.506 1.00 3.53 H new ATOM 394 N SER A 27 -11.025 -0.797 14.309 1.00 64.32 N ATOM 395 CA SER A 27 -10.575 -1.599 13.177 1.00 41.02 C ATOM 396 C SER A 27 -10.804 -0.859 11.862 1.00 25.12 C ATOM 397 O SER A 27 -9.862 -0.593 11.115 1.00 2.23 O ATOM 398 CB SER A 27 -11.307 -2.942 13.153 1.00 30.11 C ATOM 399 OG SER A 27 -10.983 -3.679 11.987 1.00 25.31 O ATOM 0 H SER A 27 -11.575 -1.311 14.997 1.00 64.32 H new ATOM 0 HA SER A 27 -9.506 -1.778 13.292 1.00 41.02 H new ATOM 0 HB2 SER A 27 -11.041 -3.520 14.038 1.00 30.11 H new ATOM 0 HB3 SER A 27 -12.383 -2.774 13.193 1.00 30.11 H new ATOM 0 HG SER A 27 -11.003 -4.638 12.190 1.00 25.31 H new ATOM 405 N ARG A 28 -12.061 -0.530 11.587 1.00 73.13 N ATOM 406 CA ARG A 28 -12.415 0.178 10.362 1.00 32.13 C ATOM 407 C ARG A 28 -11.556 1.427 10.189 1.00 13.10 C ATOM 408 O ARG A 28 -10.849 1.572 9.192 1.00 41.34 O ATOM 409 CB ARG A 28 -13.896 0.562 10.380 1.00 2.30 C ATOM 410 CG ARG A 28 -14.817 -0.539 9.881 1.00 10.11 C ATOM 411 CD ARG A 28 -15.283 -1.434 11.019 1.00 2.41 C ATOM 412 NE ARG A 28 -14.367 -2.548 11.249 1.00 74.10 N ATOM 413 CZ ARG A 28 -14.685 -3.626 11.957 1.00 31.02 C ATOM 414 NH1 ARG A 28 -15.889 -3.735 12.501 1.00 13.54 N ATOM 415 NH2 ARG A 28 -13.798 -4.599 12.122 1.00 44.51 N ATOM 0 H ARG A 28 -12.852 -0.742 12.195 1.00 73.13 H new ATOM 0 HA ARG A 28 -12.230 -0.489 9.520 1.00 32.13 H new ATOM 0 HB2 ARG A 28 -14.181 0.829 11.398 1.00 2.30 H new ATOM 0 HB3 ARG A 28 -14.040 1.451 9.765 1.00 2.30 H new ATOM 0 HG2 ARG A 28 -15.682 -0.096 9.388 1.00 10.11 H new ATOM 0 HG3 ARG A 28 -14.297 -1.139 9.134 1.00 10.11 H new ATOM 0 HD2 ARG A 28 -15.372 -0.844 11.931 1.00 2.41 H new ATOM 0 HD3 ARG A 28 -16.276 -1.822 10.792 1.00 2.41 H new ATOM 0 HE ARG A 28 -13.432 -2.495 10.844 1.00 74.10 H new ATOM 0 HH11 ARG A 28 -16.574 -2.990 12.376 1.00 13.54 H new ATOM 0 HH12 ARG A 28 -16.130 -4.564 13.044 1.00 13.54 H new ATOM 0 HH21 ARG A 28 -12.871 -4.520 11.705 1.00 44.51 H new ATOM 0 HH22 ARG A 28 -14.044 -5.426 12.666 1.00 44.51 H new ATOM 429 N ILE A 29 -11.624 2.325 11.166 1.00 51.54 N ATOM 430 CA ILE A 29 -10.853 3.561 11.121 1.00 45.31 C ATOM 431 C ILE A 29 -9.390 3.285 10.789 1.00 72.33 C ATOM 432 O ILE A 29 -8.793 3.962 9.952 1.00 41.21 O ATOM 433 CB ILE A 29 -10.929 4.321 12.458 1.00 3.23 C ATOM 434 CG1 ILE A 29 -12.383 4.649 12.801 1.00 12.44 C ATOM 435 CG2 ILE A 29 -10.094 5.592 12.394 1.00 73.22 C ATOM 436 CD1 ILE A 29 -12.568 5.178 14.207 1.00 72.43 C ATOM 0 H ILE A 29 -12.205 2.220 11.998 1.00 51.54 H new ATOM 0 HA ILE A 29 -11.291 4.178 10.336 1.00 45.31 H new ATOM 0 HB ILE A 29 -10.525 3.684 13.244 1.00 3.23 H new ATOM 0 HG12 ILE A 29 -12.758 5.387 12.092 1.00 12.44 H new ATOM 0 HG13 ILE A 29 -12.989 3.751 12.677 1.00 12.44 H new ATOM 0 HG21 ILE A 29 -10.158 6.118 13.347 1.00 73.22 H new ATOM 0 HG22 ILE A 29 -9.054 5.335 12.191 1.00 73.22 H new ATOM 0 HG23 ILE A 29 -10.471 6.235 11.599 1.00 73.22 H new ATOM 0 HD11 ILE A 29 -13.623 5.389 14.380 1.00 72.43 H new ATOM 0 HD12 ILE A 29 -12.224 4.433 14.924 1.00 72.43 H new ATOM 0 HD13 ILE A 29 -11.990 6.094 14.330 1.00 72.43 H new ATOM 448 N LYS A 30 -8.819 2.283 11.449 1.00 45.32 N ATOM 449 CA LYS A 30 -7.426 1.913 11.223 1.00 55.14 C ATOM 450 C LYS A 30 -7.160 1.677 9.739 1.00 34.24 C ATOM 451 O LYS A 30 -6.291 2.314 9.144 1.00 13.45 O ATOM 452 CB LYS A 30 -7.075 0.656 12.021 1.00 34.33 C ATOM 453 CG LYS A 30 -7.188 0.839 13.525 1.00 74.12 C ATOM 454 CD LYS A 30 -5.840 0.683 14.208 1.00 34.55 C ATOM 455 CE LYS A 30 -5.923 1.025 15.688 1.00 2.11 C ATOM 456 NZ LYS A 30 -6.846 0.113 16.418 1.00 21.32 N ATOM 0 H LYS A 30 -9.299 1.712 12.145 1.00 45.32 H new ATOM 0 HA LYS A 30 -6.798 2.737 11.560 1.00 55.14 H new ATOM 0 HB2 LYS A 30 -7.733 -0.156 11.712 1.00 34.33 H new ATOM 0 HB3 LYS A 30 -6.057 0.352 11.776 1.00 34.33 H new ATOM 0 HG2 LYS A 30 -7.595 1.826 13.743 1.00 74.12 H new ATOM 0 HG3 LYS A 30 -7.889 0.109 13.930 1.00 74.12 H new ATOM 0 HD2 LYS A 30 -5.487 -0.341 14.089 1.00 34.55 H new ATOM 0 HD3 LYS A 30 -5.109 1.330 13.724 1.00 34.55 H new ATOM 0 HE2 LYS A 30 -4.929 0.965 16.131 1.00 2.11 H new ATOM 0 HE3 LYS A 30 -6.263 2.054 15.804 1.00 2.11 H new ATOM 0 HZ1 LYS A 30 -6.364 -0.271 17.255 1.00 21.32 H new ATOM 0 HZ2 LYS A 30 -7.691 0.641 16.717 1.00 21.32 H new ATOM 0 HZ3 LYS A 30 -7.129 -0.668 15.792 1.00 21.32 H new ATOM 470 N LYS A 31 -7.915 0.757 9.147 1.00 42.52 N ATOM 471 CA LYS A 31 -7.763 0.438 7.732 1.00 11.32 C ATOM 472 C LYS A 31 -7.799 1.704 6.882 1.00 40.21 C ATOM 473 O LYS A 31 -6.953 1.902 6.009 1.00 41.12 O ATOM 474 CB LYS A 31 -8.867 -0.522 7.284 1.00 54.55 C ATOM 475 CG LYS A 31 -8.489 -1.987 7.412 1.00 42.11 C ATOM 476 CD LYS A 31 -8.666 -2.486 8.836 1.00 1.22 C ATOM 477 CE LYS A 31 -7.402 -2.285 9.658 1.00 31.13 C ATOM 478 NZ LYS A 31 -6.563 -3.515 9.694 1.00 3.33 N ATOM 0 H LYS A 31 -8.638 0.219 9.625 1.00 42.52 H new ATOM 0 HA LYS A 31 -6.794 -0.043 7.595 1.00 11.32 H new ATOM 0 HB2 LYS A 31 -9.763 -0.334 7.876 1.00 54.55 H new ATOM 0 HB3 LYS A 31 -9.121 -0.311 6.245 1.00 54.55 H new ATOM 0 HG2 LYS A 31 -9.104 -2.583 6.738 1.00 42.11 H new ATOM 0 HG3 LYS A 31 -7.453 -2.125 7.103 1.00 42.11 H new ATOM 0 HD2 LYS A 31 -9.495 -1.958 9.307 1.00 1.22 H new ATOM 0 HD3 LYS A 31 -8.928 -3.544 8.822 1.00 1.22 H new ATOM 0 HE2 LYS A 31 -6.823 -1.462 9.239 1.00 31.13 H new ATOM 0 HE3 LYS A 31 -7.671 -1.999 10.675 1.00 31.13 H new ATOM 0 HZ1 LYS A 31 -5.711 -3.338 10.264 1.00 3.33 H new ATOM 0 HZ2 LYS A 31 -7.107 -4.294 10.118 1.00 3.33 H new ATOM 0 HZ3 LYS A 31 -6.284 -3.774 8.726 1.00 3.33 H new ATOM 492 N LEU A 32 -8.782 2.559 7.143 1.00 3.01 N ATOM 493 CA LEU A 32 -8.927 3.808 6.403 1.00 62.55 C ATOM 494 C LEU A 32 -7.675 4.669 6.537 1.00 12.02 C ATOM 495 O LEU A 32 -7.102 5.112 5.541 1.00 31.50 O ATOM 496 CB LEU A 32 -10.148 4.581 6.902 1.00 33.12 C ATOM 497 CG LEU A 32 -11.504 3.906 6.688 1.00 4.11 C ATOM 498 CD1 LEU A 32 -12.427 4.177 7.866 1.00 23.30 C ATOM 499 CD2 LEU A 32 -12.138 4.384 5.390 1.00 32.01 C ATOM 0 H LEU A 32 -9.490 2.410 7.862 1.00 3.01 H new ATOM 0 HA LEU A 32 -9.066 3.563 5.350 1.00 62.55 H new ATOM 0 HB2 LEU A 32 -10.023 4.769 7.968 1.00 33.12 H new ATOM 0 HB3 LEU A 32 -10.166 5.552 6.407 1.00 33.12 H new ATOM 0 HG LEU A 32 -11.346 2.830 6.617 1.00 4.11 H new ATOM 0 HD11 LEU A 32 -13.387 3.689 7.696 1.00 23.30 H new ATOM 0 HD12 LEU A 32 -11.977 3.785 8.778 1.00 23.30 H new ATOM 0 HD13 LEU A 32 -12.579 5.251 7.969 1.00 23.30 H new ATOM 0 HD21 LEU A 32 -13.102 3.894 5.254 1.00 32.01 H new ATOM 0 HD22 LEU A 32 -12.283 5.464 5.432 1.00 32.01 H new ATOM 0 HD23 LEU A 32 -11.484 4.138 4.553 1.00 32.01 H new ATOM 511 N THR A 33 -7.254 4.902 7.776 1.00 0.34 N ATOM 512 CA THR A 33 -6.070 5.709 8.042 1.00 41.50 C ATOM 513 C THR A 33 -4.848 5.146 7.326 1.00 72.43 C ATOM 514 O THR A 33 -4.338 5.746 6.379 1.00 24.03 O ATOM 515 CB THR A 33 -5.773 5.792 9.551 1.00 13.22 C ATOM 516 OG1 THR A 33 -6.999 5.866 10.288 1.00 0.30 O ATOM 517 CG2 THR A 33 -4.911 7.005 9.868 1.00 54.14 C ATOM 0 H THR A 33 -7.716 4.543 8.612 1.00 0.34 H new ATOM 0 HA THR A 33 -6.280 6.710 7.665 1.00 41.50 H new ATOM 0 HB THR A 33 -5.228 4.894 9.841 1.00 13.22 H new ATOM 0 HG1 THR A 33 -7.375 4.967 10.389 1.00 0.30 H new ATOM 0 HG21 THR A 33 -4.715 7.042 10.940 1.00 54.14 H new ATOM 0 HG22 THR A 33 -3.967 6.931 9.329 1.00 54.14 H new ATOM 0 HG23 THR A 33 -5.433 7.912 9.563 1.00 54.14 H new ATOM 525 N THR A 34 -4.383 3.987 7.782 1.00 25.01 N ATOM 526 CA THR A 34 -3.220 3.342 7.185 1.00 0.01 C ATOM 527 C THR A 34 -3.299 3.365 5.663 1.00 55.30 C ATOM 528 O THR A 34 -2.318 3.672 4.985 1.00 33.40 O ATOM 529 CB THR A 34 -3.082 1.883 7.658 1.00 33.43 C ATOM 530 OG1 THR A 34 -1.931 1.279 7.058 1.00 40.34 O ATOM 531 CG2 THR A 34 -4.325 1.079 7.304 1.00 2.53 C ATOM 0 H THR A 34 -4.794 3.476 8.563 1.00 25.01 H new ATOM 0 HA THR A 34 -2.345 3.906 7.509 1.00 0.01 H new ATOM 0 HB THR A 34 -2.966 1.886 8.742 1.00 33.43 H new ATOM 0 HG1 THR A 34 -1.850 0.352 7.366 1.00 40.34 H new ATOM 0 HG21 THR A 34 -4.204 0.052 7.648 1.00 2.53 H new ATOM 0 HG22 THR A 34 -5.195 1.523 7.787 1.00 2.53 H new ATOM 0 HG23 THR A 34 -4.467 1.085 6.223 1.00 2.53 H new ATOM 539 N TYR A 35 -4.473 3.041 5.132 1.00 62.24 N ATOM 540 CA TYR A 35 -4.679 3.023 3.688 1.00 35.14 C ATOM 541 C TYR A 35 -4.376 4.388 3.078 1.00 62.44 C ATOM 542 O TYR A 35 -3.511 4.514 2.211 1.00 30.33 O ATOM 543 CB TYR A 35 -6.117 2.615 3.363 1.00 33.30 C ATOM 544 CG TYR A 35 -6.448 2.684 1.889 1.00 3.32 C ATOM 545 CD1 TYR A 35 -6.768 3.894 1.286 1.00 42.35 C ATOM 546 CD2 TYR A 35 -6.441 1.541 1.101 1.00 61.54 C ATOM 547 CE1 TYR A 35 -7.071 3.963 -0.061 1.00 31.25 C ATOM 548 CE2 TYR A 35 -6.741 1.600 -0.246 1.00 74.24 C ATOM 549 CZ TYR A 35 -7.056 2.813 -0.822 1.00 50.13 C ATOM 550 OH TYR A 35 -7.357 2.876 -2.163 1.00 54.15 O ATOM 0 H TYR A 35 -5.296 2.787 5.679 1.00 62.24 H new ATOM 0 HA TYR A 35 -3.994 2.292 3.257 1.00 35.14 H new ATOM 0 HB2 TYR A 35 -6.286 1.598 3.717 1.00 33.30 H new ATOM 0 HB3 TYR A 35 -6.802 3.262 3.911 1.00 33.30 H new ATOM 0 HD1 TYR A 35 -6.780 4.796 1.880 1.00 42.35 H new ATOM 0 HD2 TYR A 35 -6.197 0.589 1.549 1.00 61.54 H new ATOM 0 HE1 TYR A 35 -7.318 4.912 -0.515 1.00 31.25 H new ATOM 0 HE2 TYR A 35 -6.729 0.701 -0.845 1.00 74.24 H new ATOM 0 HH TYR A 35 -6.624 2.483 -2.682 1.00 54.15 H new ATOM 560 N ALA A 36 -5.094 5.407 3.537 1.00 40.10 N ATOM 561 CA ALA A 36 -4.901 6.763 3.039 1.00 3.41 C ATOM 562 C ALA A 36 -3.420 7.123 2.987 1.00 42.14 C ATOM 563 O ALA A 36 -2.893 7.477 1.931 1.00 54.32 O ATOM 564 CB ALA A 36 -5.657 7.757 3.908 1.00 2.42 C ATOM 0 H ALA A 36 -5.815 5.319 4.253 1.00 40.10 H new ATOM 0 HA ALA A 36 -5.296 6.810 2.024 1.00 3.41 H new ATOM 0 HB1 ALA A 36 -5.504 8.766 3.524 1.00 2.42 H new ATOM 0 HB2 ALA A 36 -6.721 7.520 3.891 1.00 2.42 H new ATOM 0 HB3 ALA A 36 -5.289 7.699 4.932 1.00 2.42 H new ATOM 570 N LEU A 37 -2.753 7.031 4.132 1.00 65.24 N ATOM 571 CA LEU A 37 -1.331 7.347 4.216 1.00 0.43 C ATOM 572 C LEU A 37 -0.524 6.493 3.244 1.00 50.44 C ATOM 573 O LEU A 37 0.308 7.006 2.495 1.00 24.02 O ATOM 574 CB LEU A 37 -0.824 7.132 5.643 1.00 35.55 C ATOM 575 CG LEU A 37 -1.187 8.219 6.656 1.00 60.41 C ATOM 576 CD1 LEU A 37 -2.516 7.903 7.325 1.00 41.42 C ATOM 577 CD2 LEU A 37 -0.086 8.367 7.696 1.00 12.11 C ATOM 0 H LEU A 37 -3.173 6.740 5.015 1.00 65.24 H new ATOM 0 HA LEU A 37 -1.201 8.395 3.944 1.00 0.43 H new ATOM 0 HB2 LEU A 37 -1.213 6.181 6.006 1.00 35.55 H new ATOM 0 HB3 LEU A 37 0.262 7.041 5.611 1.00 35.55 H new ATOM 0 HG LEU A 37 -1.287 9.165 6.125 1.00 60.41 H new ATOM 0 HD11 LEU A 37 -2.758 8.687 8.042 1.00 41.42 H new ATOM 0 HD12 LEU A 37 -3.300 7.848 6.569 1.00 41.42 H new ATOM 0 HD13 LEU A 37 -2.444 6.947 7.843 1.00 41.42 H new ATOM 0 HD21 LEU A 37 -0.361 9.145 8.409 1.00 12.11 H new ATOM 0 HD22 LEU A 37 0.046 7.422 8.223 1.00 12.11 H new ATOM 0 HD23 LEU A 37 0.846 8.641 7.202 1.00 12.11 H new ATOM 589 N ASP A 38 -0.778 5.190 3.259 1.00 64.55 N ATOM 590 CA ASP A 38 -0.077 4.264 2.375 1.00 12.24 C ATOM 591 C ASP A 38 -0.235 4.681 0.916 1.00 22.04 C ATOM 592 O ASP A 38 0.602 4.357 0.073 1.00 21.33 O ATOM 593 CB ASP A 38 -0.603 2.841 2.572 1.00 42.40 C ATOM 594 CG ASP A 38 0.238 1.808 1.848 1.00 40.41 C ATOM 595 OD1 ASP A 38 1.445 1.708 2.151 1.00 42.40 O ATOM 596 OD2 ASP A 38 -0.311 1.100 0.977 1.00 1.45 O ATOM 0 H ASP A 38 -1.464 4.750 3.873 1.00 64.55 H new ATOM 0 HA ASP A 38 0.983 4.290 2.629 1.00 12.24 H new ATOM 0 HB2 ASP A 38 -0.623 2.608 3.637 1.00 42.40 H new ATOM 0 HB3 ASP A 38 -1.631 2.784 2.214 1.00 42.40 H new ATOM 601 N HIS A 39 -1.314 5.401 0.625 1.00 22.31 N ATOM 602 CA HIS A 39 -1.582 5.861 -0.733 1.00 3.53 C ATOM 603 C HIS A 39 -1.891 7.355 -0.748 1.00 54.42 C ATOM 604 O HIS A 39 -3.055 7.758 -0.745 1.00 32.43 O ATOM 605 CB HIS A 39 -2.748 5.081 -1.338 1.00 35.40 C ATOM 606 CG HIS A 39 -2.447 3.631 -1.563 1.00 24.13 C ATOM 607 ND1 HIS A 39 -1.178 3.158 -1.827 1.00 54.52 N ATOM 608 CD2 HIS A 39 -3.257 2.547 -1.559 1.00 72.14 C ATOM 609 CE1 HIS A 39 -1.222 1.847 -1.979 1.00 33.13 C ATOM 610 NE2 HIS A 39 -2.472 1.451 -1.821 1.00 33.25 N ATOM 0 H HIS A 39 -2.016 5.678 1.311 1.00 22.31 H new ATOM 0 HA HIS A 39 -0.689 5.686 -1.333 1.00 3.53 H new ATOM 0 HB2 HIS A 39 -3.612 5.166 -0.679 1.00 35.40 H new ATOM 0 HB3 HIS A 39 -3.026 5.538 -2.288 1.00 35.40 H new ATOM 0 HD2 HIS A 39 -4.322 2.544 -1.383 1.00 72.14 H new ATOM 0 HE1 HIS A 39 -0.379 1.207 -2.196 1.00 33.13 H new ATOM 0 HE2 HIS A 39 -2.801 0.488 -1.883 1.00 33.25 H new ATOM 618 N ILE A 40 -0.843 8.172 -0.764 1.00 73.25 N ATOM 619 CA ILE A 40 -1.004 9.620 -0.781 1.00 11.43 C ATOM 620 C ILE A 40 -1.369 10.117 -2.175 1.00 41.45 C ATOM 621 O ILE A 40 -1.571 11.313 -2.386 1.00 52.43 O ATOM 622 CB ILE A 40 0.278 10.334 -0.312 1.00 54.55 C ATOM 623 CG1 ILE A 40 0.798 9.701 0.979 1.00 34.44 C ATOM 624 CG2 ILE A 40 0.013 11.819 -0.111 1.00 44.24 C ATOM 625 CD1 ILE A 40 -0.134 9.880 2.158 1.00 64.11 C ATOM 0 H ILE A 40 0.127 7.855 -0.766 1.00 73.25 H new ATOM 0 HA ILE A 40 -1.815 9.855 -0.091 1.00 11.43 H new ATOM 0 HB ILE A 40 1.041 10.221 -1.082 1.00 54.55 H new ATOM 0 HG12 ILE A 40 0.960 8.636 0.812 1.00 34.44 H new ATOM 0 HG13 ILE A 40 1.767 10.136 1.223 1.00 34.44 H new ATOM 0 HG21 ILE A 40 0.928 12.310 0.220 1.00 44.24 H new ATOM 0 HG22 ILE A 40 -0.316 12.261 -1.052 1.00 44.24 H new ATOM 0 HG23 ILE A 40 -0.763 11.951 0.643 1.00 44.24 H new ATOM 0 HD11 ILE A 40 0.299 9.406 3.039 1.00 64.11 H new ATOM 0 HD12 ILE A 40 -0.277 10.943 2.351 1.00 64.11 H new ATOM 0 HD13 ILE A 40 -1.096 9.420 1.934 1.00 64.11 H new ATOM 637 N ASP A 41 -1.453 9.191 -3.124 1.00 42.32 N ATOM 638 CA ASP A 41 -1.796 9.534 -4.499 1.00 55.43 C ATOM 639 C ASP A 41 -3.306 9.473 -4.714 1.00 4.44 C ATOM 640 O ASP A 41 -3.779 9.399 -5.848 1.00 45.11 O ATOM 641 CB ASP A 41 -1.092 8.590 -5.474 1.00 43.04 C ATOM 642 CG ASP A 41 -0.832 9.236 -6.821 1.00 55.40 C ATOM 643 OD1 ASP A 41 -0.700 10.477 -6.867 1.00 50.05 O ATOM 644 OD2 ASP A 41 -0.763 8.502 -7.829 1.00 21.43 O ATOM 0 H ASP A 41 -1.288 8.197 -2.966 1.00 42.32 H new ATOM 0 HA ASP A 41 -1.461 10.554 -4.687 1.00 55.43 H new ATOM 0 HB2 ASP A 41 -0.146 8.266 -5.041 1.00 43.04 H new ATOM 0 HB3 ASP A 41 -1.701 7.697 -5.614 1.00 43.04 H new ATOM 649 N ILE A 42 -4.055 9.504 -3.617 1.00 55.22 N ATOM 650 CA ILE A 42 -5.511 9.452 -3.686 1.00 5.42 C ATOM 651 C ILE A 42 -6.143 10.253 -2.553 1.00 11.32 C ATOM 652 O ILE A 42 -7.237 9.933 -2.089 1.00 51.24 O ATOM 653 CB ILE A 42 -6.026 8.002 -3.624 1.00 42.32 C ATOM 654 CG1 ILE A 42 -5.113 7.151 -2.739 1.00 60.24 C ATOM 655 CG2 ILE A 42 -6.116 7.413 -5.024 1.00 34.43 C ATOM 656 CD1 ILE A 42 -5.597 5.728 -2.565 1.00 4.24 C ATOM 0 H ILE A 42 -3.679 9.565 -2.671 1.00 55.22 H new ATOM 0 HA ILE A 42 -5.798 9.890 -4.642 1.00 5.42 H new ATOM 0 HB ILE A 42 -7.024 8.004 -3.187 1.00 42.32 H new ATOM 0 HG12 ILE A 42 -4.112 7.136 -3.171 1.00 60.24 H new ATOM 0 HG13 ILE A 42 -5.030 7.621 -1.759 1.00 60.24 H new ATOM 0 HG21 ILE A 42 -6.481 6.388 -4.965 1.00 34.43 H new ATOM 0 HG22 ILE A 42 -6.802 8.009 -5.626 1.00 34.43 H new ATOM 0 HG23 ILE A 42 -5.129 7.420 -5.486 1.00 34.43 H new ATOM 0 HD11 ILE A 42 -4.902 5.183 -1.926 1.00 4.24 H new ATOM 0 HD12 ILE A 42 -6.585 5.733 -2.104 1.00 4.24 H new ATOM 0 HD13 ILE A 42 -5.653 5.241 -3.539 1.00 4.24 H new ATOM 668 N GLU A 43 -5.447 11.297 -2.113 1.00 12.21 N ATOM 669 CA GLU A 43 -5.942 12.145 -1.034 1.00 72.35 C ATOM 670 C GLU A 43 -7.302 12.738 -1.390 1.00 14.43 C ATOM 671 O GLU A 43 -8.171 12.887 -0.530 1.00 24.42 O ATOM 672 CB GLU A 43 -4.945 13.267 -0.739 1.00 40.03 C ATOM 673 CG GLU A 43 -4.954 14.378 -1.776 1.00 73.20 C ATOM 674 CD GLU A 43 -4.509 13.902 -3.145 1.00 64.20 C ATOM 675 OE1 GLU A 43 -3.566 13.086 -3.212 1.00 60.32 O ATOM 676 OE2 GLU A 43 -5.103 14.346 -4.149 1.00 73.15 O ATOM 0 H GLU A 43 -4.540 11.576 -2.487 1.00 12.21 H new ATOM 0 HA GLU A 43 -6.056 11.527 -0.143 1.00 72.35 H new ATOM 0 HB2 GLU A 43 -5.169 13.693 0.239 1.00 40.03 H new ATOM 0 HB3 GLU A 43 -3.942 12.844 -0.681 1.00 40.03 H new ATOM 0 HG2 GLU A 43 -5.959 14.794 -1.849 1.00 73.20 H new ATOM 0 HG3 GLU A 43 -4.299 15.184 -1.445 1.00 73.20 H new ATOM 683 N SER A 44 -7.479 13.077 -2.663 1.00 35.12 N ATOM 684 CA SER A 44 -8.732 13.659 -3.132 1.00 64.41 C ATOM 685 C SER A 44 -9.906 12.732 -2.834 1.00 15.23 C ATOM 686 O SER A 44 -10.699 12.987 -1.927 1.00 11.03 O ATOM 687 CB SER A 44 -8.657 13.939 -4.634 1.00 60.22 C ATOM 688 OG SER A 44 -9.782 14.682 -5.071 1.00 4.22 O ATOM 0 H SER A 44 -6.771 12.959 -3.388 1.00 35.12 H new ATOM 0 HA SER A 44 -8.890 14.598 -2.602 1.00 64.41 H new ATOM 0 HB2 SER A 44 -7.744 14.490 -4.859 1.00 60.22 H new ATOM 0 HB3 SER A 44 -8.604 12.997 -5.181 1.00 60.22 H new ATOM 0 HG SER A 44 -9.709 14.849 -6.034 1.00 4.22 H new ATOM 694 N LYS A 45 -10.012 11.655 -3.604 1.00 74.31 N ATOM 695 CA LYS A 45 -11.089 10.688 -3.424 1.00 24.41 C ATOM 696 C LYS A 45 -11.254 10.326 -1.951 1.00 70.33 C ATOM 697 O LYS A 45 -12.370 10.298 -1.431 1.00 43.40 O ATOM 698 CB LYS A 45 -10.810 9.425 -4.242 1.00 64.21 C ATOM 699 CG LYS A 45 -9.331 9.105 -4.382 1.00 53.11 C ATOM 700 CD LYS A 45 -8.760 9.663 -5.675 1.00 10.53 C ATOM 701 CE LYS A 45 -8.786 8.628 -6.789 1.00 14.23 C ATOM 702 NZ LYS A 45 -9.833 8.932 -7.803 1.00 71.05 N ATOM 0 H LYS A 45 -9.365 11.429 -4.359 1.00 74.31 H new ATOM 0 HA LYS A 45 -12.015 11.143 -3.775 1.00 24.41 H new ATOM 0 HB2 LYS A 45 -11.313 8.580 -3.773 1.00 64.21 H new ATOM 0 HB3 LYS A 45 -11.243 9.542 -5.235 1.00 64.21 H new ATOM 0 HG2 LYS A 45 -8.786 9.520 -3.534 1.00 53.11 H new ATOM 0 HG3 LYS A 45 -9.187 8.025 -4.356 1.00 53.11 H new ATOM 0 HD2 LYS A 45 -9.332 10.540 -5.978 1.00 10.53 H new ATOM 0 HD3 LYS A 45 -7.735 9.994 -5.508 1.00 10.53 H new ATOM 0 HE2 LYS A 45 -7.810 8.591 -7.274 1.00 14.23 H new ATOM 0 HE3 LYS A 45 -8.968 7.641 -6.364 1.00 14.23 H new ATOM 0 HZ1 LYS A 45 -9.819 8.204 -8.546 1.00 71.05 H new ATOM 0 HZ2 LYS A 45 -10.767 8.942 -7.345 1.00 71.05 H new ATOM 0 HZ3 LYS A 45 -9.645 9.863 -8.227 1.00 71.05 H new ATOM 716 N ILE A 46 -10.138 10.050 -1.285 1.00 43.35 N ATOM 717 CA ILE A 46 -10.160 9.693 0.127 1.00 0.05 C ATOM 718 C ILE A 46 -10.836 10.779 0.958 1.00 24.44 C ATOM 719 O ILE A 46 -11.937 10.584 1.474 1.00 41.52 O ATOM 720 CB ILE A 46 -8.738 9.456 0.671 1.00 54.42 C ATOM 721 CG1 ILE A 46 -8.138 8.191 0.055 1.00 45.20 C ATOM 722 CG2 ILE A 46 -8.762 9.354 2.189 1.00 62.35 C ATOM 723 CD1 ILE A 46 -6.638 8.088 0.229 1.00 75.12 C ATOM 0 H ILE A 46 -9.207 10.067 -1.701 1.00 43.35 H new ATOM 0 HA ILE A 46 -10.730 8.768 0.209 1.00 0.05 H new ATOM 0 HB ILE A 46 -8.112 10.304 0.394 1.00 54.42 H new ATOM 0 HG12 ILE A 46 -8.609 7.318 0.507 1.00 45.20 H new ATOM 0 HG13 ILE A 46 -8.375 8.167 -1.009 1.00 45.20 H new ATOM 0 HG21 ILE A 46 -7.750 9.187 2.558 1.00 62.35 H new ATOM 0 HG22 ILE A 46 -9.153 10.280 2.610 1.00 62.35 H new ATOM 0 HG23 ILE A 46 -9.400 8.522 2.488 1.00 62.35 H new ATOM 0 HD11 ILE A 46 -6.281 7.167 -0.232 1.00 75.12 H new ATOM 0 HD12 ILE A 46 -6.157 8.942 -0.247 1.00 75.12 H new ATOM 0 HD13 ILE A 46 -6.395 8.080 1.291 1.00 75.12 H new ATOM 735 N ILE A 47 -10.169 11.921 1.083 1.00 53.44 N ATOM 736 CA ILE A 47 -10.707 13.039 1.848 1.00 1.14 C ATOM 737 C ILE A 47 -12.166 13.299 1.490 1.00 12.44 C ATOM 738 O ILE A 47 -13.019 13.423 2.369 1.00 11.43 O ATOM 739 CB ILE A 47 -9.895 14.326 1.612 1.00 44.11 C ATOM 740 CG1 ILE A 47 -8.475 14.167 2.159 1.00 22.23 C ATOM 741 CG2 ILE A 47 -10.587 15.516 2.259 1.00 13.00 C ATOM 742 CD1 ILE A 47 -8.429 13.865 3.641 1.00 43.22 C ATOM 0 H ILE A 47 -9.255 12.097 0.665 1.00 53.44 H new ATOM 0 HA ILE A 47 -10.637 12.763 2.900 1.00 1.14 H new ATOM 0 HB ILE A 47 -9.833 14.506 0.539 1.00 44.11 H new ATOM 0 HG12 ILE A 47 -7.973 13.365 1.617 1.00 22.23 H new ATOM 0 HG13 ILE A 47 -7.915 15.082 1.965 1.00 22.23 H new ATOM 0 HG21 ILE A 47 -10.000 16.418 2.083 1.00 13.00 H new ATOM 0 HG22 ILE A 47 -11.580 15.639 1.826 1.00 13.00 H new ATOM 0 HG23 ILE A 47 -10.677 15.345 3.332 1.00 13.00 H new ATOM 0 HD11 ILE A 47 -7.391 13.765 3.960 1.00 43.22 H new ATOM 0 HD12 ILE A 47 -8.902 14.678 4.193 1.00 43.22 H new ATOM 0 HD13 ILE A 47 -8.961 12.934 3.839 1.00 43.22 H new ATOM 754 N SER A 48 -12.446 13.379 0.194 1.00 55.45 N ATOM 755 CA SER A 48 -13.803 13.627 -0.282 1.00 22.24 C ATOM 756 C SER A 48 -14.762 12.559 0.234 1.00 34.24 C ATOM 757 O SER A 48 -15.881 12.862 0.651 1.00 33.30 O ATOM 758 CB SER A 48 -13.832 13.659 -1.811 1.00 12.12 C ATOM 759 OG SER A 48 -14.539 14.793 -2.283 1.00 72.45 O ATOM 0 H SER A 48 -11.752 13.276 -0.546 1.00 55.45 H new ATOM 0 HA SER A 48 -14.125 14.596 0.100 1.00 22.24 H new ATOM 0 HB2 SER A 48 -12.813 13.675 -2.197 1.00 12.12 H new ATOM 0 HB3 SER A 48 -14.302 12.751 -2.188 1.00 12.12 H new ATOM 0 HG SER A 48 -14.542 14.792 -3.263 1.00 72.45 H new ATOM 765 N LEU A 49 -14.317 11.308 0.204 1.00 62.35 N ATOM 766 CA LEU A 49 -15.135 10.193 0.668 1.00 62.41 C ATOM 767 C LEU A 49 -15.563 10.398 2.117 1.00 13.03 C ATOM 768 O LEU A 49 -16.746 10.583 2.405 1.00 73.23 O ATOM 769 CB LEU A 49 -14.364 8.878 0.533 1.00 1.24 C ATOM 770 CG LEU A 49 -15.198 7.599 0.617 1.00 41.30 C ATOM 771 CD1 LEU A 49 -16.069 7.448 -0.621 1.00 2.35 C ATOM 772 CD2 LEU A 49 -14.297 6.385 0.789 1.00 43.24 C ATOM 0 H LEU A 49 -13.394 11.040 -0.137 1.00 62.35 H new ATOM 0 HA LEU A 49 -16.030 10.148 0.047 1.00 62.41 H new ATOM 0 HB2 LEU A 49 -13.840 8.884 -0.423 1.00 1.24 H new ATOM 0 HB3 LEU A 49 -13.604 8.844 1.313 1.00 1.24 H new ATOM 0 HG LEU A 49 -15.849 7.669 1.488 1.00 41.30 H new ATOM 0 HD11 LEU A 49 -16.655 6.532 -0.544 1.00 2.35 H new ATOM 0 HD12 LEU A 49 -16.740 8.303 -0.700 1.00 2.35 H new ATOM 0 HD13 LEU A 49 -15.436 7.400 -1.507 1.00 2.35 H new ATOM 0 HD21 LEU A 49 -14.908 5.484 0.847 1.00 43.24 H new ATOM 0 HD22 LEU A 49 -13.620 6.311 -0.062 1.00 43.24 H new ATOM 0 HD23 LEU A 49 -13.717 6.490 1.706 1.00 43.24 H new ATOM 784 N ILE A 50 -14.594 10.367 3.025 1.00 21.45 N ATOM 785 CA ILE A 50 -14.871 10.553 4.444 1.00 22.24 C ATOM 786 C ILE A 50 -15.788 11.749 4.673 1.00 12.21 C ATOM 787 O ILE A 50 -16.753 11.668 5.434 1.00 72.34 O ATOM 788 CB ILE A 50 -13.573 10.754 5.250 1.00 74.44 C ATOM 789 CG1 ILE A 50 -12.684 11.798 4.572 1.00 3.14 C ATOM 790 CG2 ILE A 50 -12.832 9.433 5.397 1.00 42.41 C ATOM 791 CD1 ILE A 50 -11.333 11.962 5.234 1.00 33.11 C ATOM 0 H ILE A 50 -13.610 10.215 2.804 1.00 21.45 H new ATOM 0 HA ILE A 50 -15.367 9.646 4.790 1.00 22.24 H new ATOM 0 HB ILE A 50 -13.831 11.116 6.245 1.00 74.44 H new ATOM 0 HG12 ILE A 50 -12.537 11.516 3.529 1.00 3.14 H new ATOM 0 HG13 ILE A 50 -13.199 12.758 4.573 1.00 3.14 H new ATOM 0 HG21 ILE A 50 -11.917 9.591 5.968 1.00 42.41 H new ATOM 0 HG22 ILE A 50 -13.466 8.716 5.918 1.00 42.41 H new ATOM 0 HG23 ILE A 50 -12.581 9.045 4.410 1.00 42.41 H new ATOM 0 HD11 ILE A 50 -10.756 12.718 4.701 1.00 33.11 H new ATOM 0 HD12 ILE A 50 -11.471 12.274 6.269 1.00 33.11 H new ATOM 0 HD13 ILE A 50 -10.798 11.013 5.209 1.00 33.11 H new ATOM 803 N ILE A 51 -15.482 12.858 4.009 1.00 45.31 N ATOM 804 CA ILE A 51 -16.280 14.071 4.138 1.00 73.25 C ATOM 805 C ILE A 51 -17.741 13.807 3.788 1.00 61.50 C ATOM 806 O ILE A 51 -18.636 14.032 4.603 1.00 25.11 O ATOM 807 CB ILE A 51 -15.744 15.197 3.234 1.00 24.04 C ATOM 808 CG1 ILE A 51 -14.423 15.737 3.786 1.00 3.12 C ATOM 809 CG2 ILE A 51 -16.770 16.314 3.114 1.00 22.31 C ATOM 810 CD1 ILE A 51 -13.751 16.739 2.873 1.00 21.41 C ATOM 0 H ILE A 51 -14.687 12.942 3.376 1.00 45.31 H new ATOM 0 HA ILE A 51 -16.208 14.386 5.179 1.00 73.25 H new ATOM 0 HB ILE A 51 -15.562 14.789 2.240 1.00 24.04 H new ATOM 0 HG12 ILE A 51 -14.607 16.205 4.753 1.00 3.12 H new ATOM 0 HG13 ILE A 51 -13.743 14.903 3.960 1.00 3.12 H new ATOM 0 HG21 ILE A 51 -16.376 17.102 2.472 1.00 22.31 H new ATOM 0 HG22 ILE A 51 -17.689 15.919 2.681 1.00 22.31 H new ATOM 0 HG23 ILE A 51 -16.981 16.722 4.102 1.00 22.31 H new ATOM 0 HD11 ILE A 51 -12.821 17.079 3.328 1.00 21.41 H new ATOM 0 HD12 ILE A 51 -13.535 16.269 1.913 1.00 21.41 H new ATOM 0 HD13 ILE A 51 -14.412 17.592 2.719 1.00 21.41 H new ATOM 822 N ASP A 52 -17.975 13.326 2.572 1.00 64.22 N ATOM 823 CA ASP A 52 -19.327 13.027 2.114 1.00 2.45 C ATOM 824 C ASP A 52 -20.009 12.033 3.049 1.00 54.23 C ATOM 825 O ASP A 52 -21.140 12.252 3.485 1.00 22.52 O ATOM 826 CB ASP A 52 -19.295 12.469 0.691 1.00 51.42 C ATOM 827 CG ASP A 52 -20.330 13.117 -0.208 1.00 40.01 C ATOM 828 OD1 ASP A 52 -21.537 12.971 0.076 1.00 1.15 O ATOM 829 OD2 ASP A 52 -19.933 13.769 -1.197 1.00 10.13 O ATOM 0 H ASP A 52 -17.246 13.135 1.885 1.00 64.22 H new ATOM 0 HA ASP A 52 -19.900 13.955 2.118 1.00 2.45 H new ATOM 0 HB2 ASP A 52 -18.303 12.621 0.266 1.00 51.42 H new ATOM 0 HB3 ASP A 52 -19.467 11.393 0.722 1.00 51.42 H new ATOM 834 N TYR A 53 -19.316 10.941 3.350 1.00 12.13 N ATOM 835 CA TYR A 53 -19.857 9.911 4.230 1.00 42.32 C ATOM 836 C TYR A 53 -20.368 10.520 5.532 1.00 4.20 C ATOM 837 O TYR A 53 -21.381 10.085 6.078 1.00 13.12 O ATOM 838 CB TYR A 53 -18.790 8.857 4.531 1.00 74.23 C ATOM 839 CG TYR A 53 -18.877 8.290 5.930 1.00 74.34 C ATOM 840 CD1 TYR A 53 -18.375 8.993 7.018 1.00 51.03 C ATOM 841 CD2 TYR A 53 -19.461 7.051 6.163 1.00 23.44 C ATOM 842 CE1 TYR A 53 -18.452 8.479 8.298 1.00 64.33 C ATOM 843 CE2 TYR A 53 -19.543 6.529 7.440 1.00 41.31 C ATOM 844 CZ TYR A 53 -19.037 7.247 8.504 1.00 62.23 C ATOM 845 OH TYR A 53 -19.116 6.730 9.777 1.00 45.23 O ATOM 0 H TYR A 53 -18.379 10.746 2.998 1.00 12.13 H new ATOM 0 HA TYR A 53 -20.695 9.436 3.720 1.00 42.32 H new ATOM 0 HB2 TYR A 53 -18.882 8.043 3.812 1.00 74.23 H new ATOM 0 HB3 TYR A 53 -17.804 9.299 4.388 1.00 74.23 H new ATOM 0 HD1 TYR A 53 -17.917 9.958 6.860 1.00 51.03 H new ATOM 0 HD2 TYR A 53 -19.858 6.486 5.332 1.00 23.44 H new ATOM 0 HE1 TYR A 53 -18.056 9.039 9.133 1.00 64.33 H new ATOM 0 HE2 TYR A 53 -20.001 5.565 7.604 1.00 41.31 H new ATOM 0 HH TYR A 53 -19.557 5.855 9.748 1.00 45.23 H new ATOM 855 N SER A 54 -19.658 11.531 6.024 1.00 63.24 N ATOM 856 CA SER A 54 -20.036 12.199 7.263 1.00 30.03 C ATOM 857 C SER A 54 -21.397 12.874 7.123 1.00 10.01 C ATOM 858 O SER A 54 -22.393 12.410 7.679 1.00 25.11 O ATOM 859 CB SER A 54 -18.979 13.234 7.653 1.00 64.41 C ATOM 860 OG SER A 54 -19.201 14.465 6.988 1.00 1.32 O ATOM 0 H SER A 54 -18.818 11.905 5.583 1.00 63.24 H new ATOM 0 HA SER A 54 -20.102 11.445 8.047 1.00 30.03 H new ATOM 0 HB2 SER A 54 -19.000 13.391 8.731 1.00 64.41 H new ATOM 0 HB3 SER A 54 -17.987 12.857 7.405 1.00 64.41 H new ATOM 0 HG SER A 54 -18.673 14.491 6.163 1.00 1.32 H new ATOM 866 N ARG A 55 -21.431 13.973 6.376 1.00 34.40 N ATOM 867 CA ARG A 55 -22.669 14.713 6.163 1.00 0.30 C ATOM 868 C ARG A 55 -23.821 13.766 5.840 1.00 22.00 C ATOM 869 O ARG A 55 -24.971 14.025 6.197 1.00 41.54 O ATOM 870 CB ARG A 55 -22.494 15.726 5.029 1.00 22.55 C ATOM 871 CG ARG A 55 -22.720 15.137 3.647 1.00 72.43 C ATOM 872 CD ARG A 55 -21.891 15.854 2.593 1.00 53.40 C ATOM 873 NE ARG A 55 -22.435 15.671 1.250 1.00 33.11 N ATOM 874 CZ ARG A 55 -23.452 16.376 0.766 1.00 4.22 C ATOM 875 NH1 ARG A 55 -24.031 17.307 1.511 1.00 10.33 N ATOM 876 NH2 ARG A 55 -23.890 16.151 -0.466 1.00 31.13 N ATOM 0 H ARG A 55 -20.616 14.370 5.909 1.00 34.40 H new ATOM 0 HA ARG A 55 -22.907 15.245 7.084 1.00 0.30 H new ATOM 0 HB2 ARG A 55 -23.189 16.552 5.181 1.00 22.55 H new ATOM 0 HB3 ARG A 55 -21.488 16.143 5.077 1.00 22.55 H new ATOM 0 HG2 ARG A 55 -22.463 14.078 3.655 1.00 72.43 H new ATOM 0 HG3 ARG A 55 -23.777 15.206 3.389 1.00 72.43 H new ATOM 0 HD2 ARG A 55 -21.851 16.918 2.826 1.00 53.40 H new ATOM 0 HD3 ARG A 55 -20.867 15.482 2.623 1.00 53.40 H new ATOM 0 HE ARG A 55 -22.011 14.963 0.651 1.00 33.11 H new ATOM 0 HH11 ARG A 55 -23.696 17.484 2.458 1.00 10.33 H new ATOM 0 HH12 ARG A 55 -24.812 17.847 1.137 1.00 10.33 H new ATOM 0 HH21 ARG A 55 -23.446 15.436 -1.043 1.00 31.13 H new ATOM 0 HH22 ARG A 55 -24.671 16.693 -0.837 1.00 31.13 H new ATOM 890 N LEU A 56 -23.504 12.668 5.163 1.00 74.12 N ATOM 891 CA LEU A 56 -24.513 11.681 4.791 1.00 44.32 C ATOM 892 C LEU A 56 -25.185 11.096 6.029 1.00 42.23 C ATOM 893 O LEU A 56 -26.250 11.554 6.443 1.00 34.14 O ATOM 894 CB LEU A 56 -23.878 10.562 3.964 1.00 72.33 C ATOM 895 CG LEU A 56 -23.514 10.916 2.521 1.00 13.35 C ATOM 896 CD1 LEU A 56 -22.513 9.918 1.963 1.00 64.42 C ATOM 897 CD2 LEU A 56 -24.763 10.965 1.653 1.00 62.21 C ATOM 0 H LEU A 56 -22.557 12.438 4.860 1.00 74.12 H new ATOM 0 HA LEU A 56 -25.273 12.182 4.191 1.00 44.32 H new ATOM 0 HB2 LEU A 56 -22.974 10.229 4.474 1.00 72.33 H new ATOM 0 HB3 LEU A 56 -24.565 9.716 3.947 1.00 72.33 H new ATOM 0 HG LEU A 56 -23.053 11.903 2.514 1.00 13.35 H new ATOM 0 HD11 LEU A 56 -22.266 10.186 0.936 1.00 64.42 H new ATOM 0 HD12 LEU A 56 -21.608 9.933 2.570 1.00 64.42 H new ATOM 0 HD13 LEU A 56 -22.946 8.918 1.983 1.00 64.42 H new ATOM 0 HD21 LEU A 56 -24.485 11.218 0.630 1.00 62.21 H new ATOM 0 HD22 LEU A 56 -25.253 9.992 1.666 1.00 62.21 H new ATOM 0 HD23 LEU A 56 -25.446 11.720 2.041 1.00 62.21 H new ATOM 909 N CYS A 57 -24.555 10.085 6.615 1.00 24.41 N ATOM 910 CA CYS A 57 -25.091 9.438 7.807 1.00 31.43 C ATOM 911 C CYS A 57 -25.447 10.470 8.873 1.00 65.54 C ATOM 912 O CYS A 57 -24.742 11.459 9.074 1.00 65.35 O ATOM 913 CB CYS A 57 -24.081 8.436 8.368 1.00 64.45 C ATOM 914 SG CYS A 57 -24.695 6.737 8.454 1.00 13.41 S ATOM 0 H CYS A 57 -23.672 9.695 6.284 1.00 24.41 H new ATOM 0 HA CYS A 57 -25.999 8.907 7.523 1.00 31.43 H new ATOM 0 HB2 CYS A 57 -23.184 8.456 7.749 1.00 64.45 H new ATOM 0 HB3 CYS A 57 -23.786 8.755 9.368 1.00 64.45 H new ATOM 0 HG CYS A 57 -23.858 6.007 9.129 1.00 13.41 H new ATOM 920 N PRO A 58 -26.567 10.237 9.572 1.00 72.42 N ATOM 921 CA PRO A 58 -27.043 11.135 10.628 1.00 43.43 C ATOM 922 C PRO A 58 -26.149 11.103 11.863 1.00 63.14 C ATOM 923 O PRO A 58 -25.091 11.732 11.891 1.00 23.34 O ATOM 924 CB PRO A 58 -28.433 10.588 10.960 1.00 52.33 C ATOM 925 CG PRO A 58 -28.377 9.151 10.572 1.00 32.01 C ATOM 926 CD PRO A 58 -27.456 9.078 9.386 1.00 73.43 C ATOM 0 HA PRO A 58 -27.046 12.176 10.306 1.00 43.43 H new ATOM 0 HB2 PRO A 58 -28.661 10.703 12.020 1.00 52.33 H new ATOM 0 HB3 PRO A 58 -29.209 11.117 10.407 1.00 52.33 H new ATOM 0 HG2 PRO A 58 -28.004 8.539 11.394 1.00 32.01 H new ATOM 0 HG3 PRO A 58 -29.369 8.776 10.320 1.00 32.01 H new ATOM 0 HD2 PRO A 58 -26.898 8.142 9.368 1.00 73.43 H new ATOM 0 HD3 PRO A 58 -28.005 9.140 8.446 1.00 73.43 H new ATOM 934 N ASP A 59 -26.580 10.366 12.880 1.00 14.54 N ATOM 935 CA ASP A 59 -25.818 10.251 14.118 1.00 22.11 C ATOM 936 C ASP A 59 -24.532 9.461 13.893 1.00 52.35 C ATOM 937 O ASP A 59 -23.441 9.924 14.225 1.00 52.51 O ATOM 938 CB ASP A 59 -26.662 9.577 15.201 1.00 23.40 C ATOM 939 CG ASP A 59 -27.378 8.341 14.692 1.00 44.24 C ATOM 940 OD1 ASP A 59 -28.388 8.494 13.973 1.00 1.32 O ATOM 941 OD2 ASP A 59 -26.927 7.221 15.011 1.00 52.24 O ATOM 0 H ASP A 59 -27.453 9.839 12.872 1.00 14.54 H new ATOM 0 HA ASP A 59 -25.553 11.256 14.447 1.00 22.11 H new ATOM 0 HB2 ASP A 59 -26.021 9.303 16.039 1.00 23.40 H new ATOM 0 HB3 ASP A 59 -27.396 10.288 15.581 1.00 23.40 H new ATOM 946 N SER A 60 -24.669 8.266 13.327 1.00 50.55 N ATOM 947 CA SER A 60 -23.519 7.410 13.061 1.00 0.20 C ATOM 948 C SER A 60 -22.324 8.235 12.594 1.00 42.23 C ATOM 949 O SER A 60 -21.218 8.101 13.120 1.00 53.24 O ATOM 950 CB SER A 60 -23.871 6.359 12.006 1.00 15.44 C ATOM 951 OG SER A 60 -22.703 5.824 11.409 1.00 11.33 O ATOM 0 H SER A 60 -25.565 7.869 13.044 1.00 50.55 H new ATOM 0 HA SER A 60 -23.250 6.906 13.990 1.00 0.20 H new ATOM 0 HB2 SER A 60 -24.448 5.557 12.466 1.00 15.44 H new ATOM 0 HB3 SER A 60 -24.503 6.807 11.239 1.00 15.44 H new ATOM 0 HG SER A 60 -22.463 6.359 10.624 1.00 11.33 H new ATOM 957 N HIS A 61 -22.554 9.089 11.601 1.00 1.34 N ATOM 958 CA HIS A 61 -21.497 9.938 11.062 1.00 21.52 C ATOM 959 C HIS A 61 -20.877 10.797 12.160 1.00 61.12 C ATOM 960 O HIS A 61 -19.658 10.818 12.333 1.00 71.30 O ATOM 961 CB HIS A 61 -22.048 10.830 9.950 1.00 61.04 C ATOM 962 CG HIS A 61 -21.986 12.292 10.268 1.00 5.14 C ATOM 963 ND1 HIS A 61 -23.108 13.066 10.474 1.00 50.23 N ATOM 964 CD2 HIS A 61 -20.926 13.121 10.419 1.00 70.04 C ATOM 965 CE1 HIS A 61 -22.742 14.308 10.735 1.00 42.34 C ATOM 966 NE2 HIS A 61 -21.423 14.368 10.708 1.00 44.23 N ATOM 0 H HIS A 61 -23.462 9.211 11.154 1.00 1.34 H new ATOM 0 HA HIS A 61 -20.722 9.293 10.649 1.00 21.52 H new ATOM 0 HB2 HIS A 61 -21.488 10.642 9.034 1.00 61.04 H new ATOM 0 HB3 HIS A 61 -23.084 10.553 9.753 1.00 61.04 H new ATOM 0 HD1 HIS A 61 -24.071 12.732 10.431 1.00 50.23 H new ATOM 0 HD2 HIS A 61 -19.884 12.852 10.329 1.00 70.04 H new ATOM 0 HE1 HIS A 61 -23.408 15.134 10.936 1.00 42.34 H new ATOM 974 N LYS A 62 -21.724 11.506 12.899 1.00 64.23 N ATOM 975 CA LYS A 62 -21.260 12.367 13.980 1.00 13.11 C ATOM 976 C LYS A 62 -20.076 11.738 14.707 1.00 42.30 C ATOM 977 O LYS A 62 -18.929 12.143 14.513 1.00 41.43 O ATOM 978 CB LYS A 62 -22.397 12.634 14.970 1.00 64.40 C ATOM 979 CG LYS A 62 -23.599 13.319 14.345 1.00 13.11 C ATOM 980 CD LYS A 62 -24.376 14.127 15.371 1.00 41.40 C ATOM 981 CE LYS A 62 -25.524 13.323 15.961 1.00 52.11 C ATOM 982 NZ LYS A 62 -25.039 12.127 16.704 1.00 55.01 N ATOM 0 H LYS A 62 -22.736 11.501 12.769 1.00 64.23 H new ATOM 0 HA LYS A 62 -20.935 13.312 13.545 1.00 13.11 H new ATOM 0 HB2 LYS A 62 -22.716 11.688 15.408 1.00 64.40 H new ATOM 0 HB3 LYS A 62 -22.020 13.252 15.785 1.00 64.40 H new ATOM 0 HG2 LYS A 62 -23.267 13.974 13.540 1.00 13.11 H new ATOM 0 HG3 LYS A 62 -24.254 12.571 13.898 1.00 13.11 H new ATOM 0 HD2 LYS A 62 -23.705 14.445 16.169 1.00 41.40 H new ATOM 0 HD3 LYS A 62 -24.766 15.031 14.904 1.00 41.40 H new ATOM 0 HE2 LYS A 62 -26.104 13.957 16.632 1.00 52.11 H new ATOM 0 HE3 LYS A 62 -26.194 13.007 15.162 1.00 52.11 H new ATOM 0 HZ1 LYS A 62 -25.844 11.653 17.162 1.00 55.01 H new ATOM 0 HZ2 LYS A 62 -24.581 11.469 16.042 1.00 55.01 H new ATOM 0 HZ3 LYS A 62 -24.354 12.423 17.428 1.00 55.01 H new ATOM 996 N LEU A 63 -20.360 10.746 15.543 1.00 21.02 N ATOM 997 CA LEU A 63 -19.317 10.060 16.298 1.00 33.42 C ATOM 998 C LEU A 63 -18.325 9.379 15.361 1.00 22.11 C ATOM 999 O LEU A 63 -17.127 9.658 15.400 1.00 53.04 O ATOM 1000 CB LEU A 63 -19.938 9.026 17.240 1.00 54.23 C ATOM 1001 CG LEU A 63 -19.570 9.158 18.718 1.00 54.21 C ATOM 1002 CD1 LEU A 63 -18.111 9.556 18.871 1.00 3.41 C ATOM 1003 CD2 LEU A 63 -20.476 10.170 19.405 1.00 71.13 C ATOM 0 H LEU A 63 -21.303 10.398 15.715 1.00 21.02 H new ATOM 0 HA LEU A 63 -18.781 10.804 16.887 1.00 33.42 H new ATOM 0 HB2 LEU A 63 -21.023 9.087 17.149 1.00 54.23 H new ATOM 0 HB3 LEU A 63 -19.645 8.033 16.901 1.00 54.23 H new ATOM 0 HG LEU A 63 -19.713 8.189 19.196 1.00 54.21 H new ATOM 0 HD11 LEU A 63 -17.867 9.645 19.930 1.00 3.41 H new ATOM 0 HD12 LEU A 63 -17.477 8.796 18.415 1.00 3.41 H new ATOM 0 HD13 LEU A 63 -17.941 10.513 18.378 1.00 3.41 H new ATOM 0 HD21 LEU A 63 -20.200 10.251 20.456 1.00 71.13 H new ATOM 0 HD22 LEU A 63 -20.365 11.142 18.925 1.00 71.13 H new ATOM 0 HD23 LEU A 63 -21.513 9.842 19.327 1.00 71.13 H new ATOM 1015 N GLY A 64 -18.832 8.485 14.518 1.00 74.04 N ATOM 1016 CA GLY A 64 -17.977 7.780 13.581 1.00 72.02 C ATOM 1017 C GLY A 64 -17.060 8.714 12.817 1.00 52.24 C ATOM 1018 O GLY A 64 -15.869 8.804 13.112 1.00 44.21 O ATOM 0 H GLY A 64 -19.820 8.236 14.467 1.00 74.04 H new ATOM 0 HA2 GLY A 64 -17.377 7.048 14.122 1.00 72.02 H new ATOM 0 HA3 GLY A 64 -18.596 7.226 12.875 1.00 72.02 H new ATOM 1022 N SER A 65 -17.616 9.411 11.830 1.00 20.52 N ATOM 1023 CA SER A 65 -16.839 10.339 11.017 1.00 24.34 C ATOM 1024 C SER A 65 -15.778 11.042 11.860 1.00 74.34 C ATOM 1025 O SER A 65 -14.584 10.959 11.571 1.00 23.41 O ATOM 1026 CB SER A 65 -17.758 11.374 10.367 1.00 74.32 C ATOM 1027 OG SER A 65 -17.052 12.165 9.428 1.00 44.51 O ATOM 0 H SER A 65 -18.602 9.350 11.575 1.00 20.52 H new ATOM 0 HA SER A 65 -16.338 9.767 10.236 1.00 24.34 H new ATOM 0 HB2 SER A 65 -18.587 10.869 9.871 1.00 74.32 H new ATOM 0 HB3 SER A 65 -18.190 12.015 11.136 1.00 74.32 H new ATOM 0 HG SER A 65 -16.958 13.077 9.774 1.00 44.51 H new ATOM 1033 N LEU A 66 -16.224 11.734 12.902 1.00 3.20 N ATOM 1034 CA LEU A 66 -15.314 12.453 13.788 1.00 75.10 C ATOM 1035 C LEU A 66 -14.066 11.625 14.075 1.00 60.00 C ATOM 1036 O LEU A 66 -12.943 12.079 13.853 1.00 72.34 O ATOM 1037 CB LEU A 66 -16.020 12.804 15.099 1.00 1.21 C ATOM 1038 CG LEU A 66 -16.529 14.241 15.223 1.00 21.35 C ATOM 1039 CD1 LEU A 66 -17.866 14.272 15.947 1.00 10.42 C ATOM 1040 CD2 LEU A 66 -15.508 15.107 15.947 1.00 53.45 C ATOM 0 H LEU A 66 -17.209 11.813 13.155 1.00 3.20 H new ATOM 0 HA LEU A 66 -15.010 13.373 13.288 1.00 75.10 H new ATOM 0 HB2 LEU A 66 -16.866 12.128 15.225 1.00 1.21 H new ATOM 0 HB3 LEU A 66 -15.332 12.611 15.922 1.00 1.21 H new ATOM 0 HG LEU A 66 -16.672 14.644 14.220 1.00 21.35 H new ATOM 0 HD11 LEU A 66 -18.213 15.302 16.026 1.00 10.42 H new ATOM 0 HD12 LEU A 66 -18.596 13.685 15.389 1.00 10.42 H new ATOM 0 HD13 LEU A 66 -17.749 13.851 16.945 1.00 10.42 H new ATOM 0 HD21 LEU A 66 -15.886 16.126 16.026 1.00 53.45 H new ATOM 0 HD22 LEU A 66 -15.333 14.706 16.945 1.00 53.45 H new ATOM 0 HD23 LEU A 66 -14.572 15.110 15.388 1.00 53.45 H new ATOM 1052 N TYR A 67 -14.270 10.408 14.568 1.00 42.43 N ATOM 1053 CA TYR A 67 -13.161 9.517 14.885 1.00 23.33 C ATOM 1054 C TYR A 67 -12.274 9.294 13.664 1.00 4.41 C ATOM 1055 O TYR A 67 -11.047 9.363 13.753 1.00 34.53 O ATOM 1056 CB TYR A 67 -13.688 8.175 15.398 1.00 41.35 C ATOM 1057 CG TYR A 67 -14.169 8.221 16.830 1.00 14.21 C ATOM 1058 CD1 TYR A 67 -13.501 8.979 17.784 1.00 31.22 C ATOM 1059 CD2 TYR A 67 -15.292 7.506 17.230 1.00 43.51 C ATOM 1060 CE1 TYR A 67 -13.937 9.023 19.094 1.00 2.34 C ATOM 1061 CE2 TYR A 67 -15.735 7.546 18.537 1.00 14.35 C ATOM 1062 CZ TYR A 67 -15.055 8.306 19.466 1.00 64.20 C ATOM 1063 OH TYR A 67 -15.493 8.347 20.770 1.00 63.12 O ATOM 0 H TYR A 67 -15.193 10.017 14.756 1.00 42.43 H new ATOM 0 HA TYR A 67 -12.562 9.988 15.665 1.00 23.33 H new ATOM 0 HB2 TYR A 67 -14.508 7.848 14.759 1.00 41.35 H new ATOM 0 HB3 TYR A 67 -12.899 7.428 15.312 1.00 41.35 H new ATOM 0 HD1 TYR A 67 -12.626 9.543 17.496 1.00 31.22 H new ATOM 0 HD2 TYR A 67 -15.827 6.909 16.506 1.00 43.51 H new ATOM 0 HE1 TYR A 67 -13.405 9.616 19.823 1.00 2.34 H new ATOM 0 HE2 TYR A 67 -16.610 6.985 18.831 1.00 14.35 H new ATOM 0 HH TYR A 67 -16.292 7.788 20.864 1.00 63.12 H new ATOM 1073 N ILE A 68 -12.903 9.029 12.524 1.00 0.04 N ATOM 1074 CA ILE A 68 -12.172 8.798 11.285 1.00 52.45 C ATOM 1075 C ILE A 68 -11.254 9.972 10.961 1.00 24.14 C ATOM 1076 O ILE A 68 -10.046 9.800 10.792 1.00 71.51 O ATOM 1077 CB ILE A 68 -13.130 8.570 10.100 1.00 32.25 C ATOM 1078 CG1 ILE A 68 -13.892 7.255 10.279 1.00 13.23 C ATOM 1079 CG2 ILE A 68 -12.360 8.568 8.789 1.00 62.34 C ATOM 1080 CD1 ILE A 68 -14.971 7.036 9.242 1.00 14.40 C ATOM 0 H ILE A 68 -13.917 8.969 12.433 1.00 0.04 H new ATOM 0 HA ILE A 68 -11.572 7.901 11.436 1.00 52.45 H new ATOM 0 HB ILE A 68 -13.852 9.386 10.073 1.00 32.25 H new ATOM 0 HG12 ILE A 68 -13.185 6.426 10.237 1.00 13.23 H new ATOM 0 HG13 ILE A 68 -14.344 7.238 11.271 1.00 13.23 H new ATOM 0 HG21 ILE A 68 -13.051 8.406 7.962 1.00 62.34 H new ATOM 0 HG22 ILE A 68 -11.858 9.527 8.660 1.00 62.34 H new ATOM 0 HG23 ILE A 68 -11.618 7.770 8.804 1.00 62.34 H new ATOM 0 HD11 ILE A 68 -15.469 6.085 9.431 1.00 14.40 H new ATOM 0 HD12 ILE A 68 -15.699 7.845 9.299 1.00 14.40 H new ATOM 0 HD13 ILE A 68 -14.523 7.020 8.248 1.00 14.40 H new ATOM 1092 N ILE A 69 -11.833 11.165 10.879 1.00 32.35 N ATOM 1093 CA ILE A 69 -11.066 12.367 10.580 1.00 50.31 C ATOM 1094 C ILE A 69 -9.926 12.554 11.575 1.00 11.44 C ATOM 1095 O ILE A 69 -8.838 13.001 11.212 1.00 41.01 O ATOM 1096 CB ILE A 69 -11.958 13.623 10.596 1.00 30.31 C ATOM 1097 CG1 ILE A 69 -13.033 13.525 9.512 1.00 52.11 C ATOM 1098 CG2 ILE A 69 -11.115 14.874 10.402 1.00 2.14 C ATOM 1099 CD1 ILE A 69 -14.272 14.340 9.814 1.00 64.51 C ATOM 0 H ILE A 69 -12.831 11.325 11.016 1.00 32.35 H new ATOM 0 HA ILE A 69 -10.654 12.237 9.579 1.00 50.31 H new ATOM 0 HB ILE A 69 -12.451 13.688 11.566 1.00 30.31 H new ATOM 0 HG12 ILE A 69 -12.612 13.857 8.563 1.00 52.11 H new ATOM 0 HG13 ILE A 69 -13.317 12.480 9.387 1.00 52.11 H new ATOM 0 HG21 ILE A 69 -11.760 15.753 10.416 1.00 2.14 H new ATOM 0 HG22 ILE A 69 -10.383 14.948 11.207 1.00 2.14 H new ATOM 0 HG23 ILE A 69 -10.597 14.819 9.445 1.00 2.14 H new ATOM 0 HD11 ILE A 69 -14.991 14.223 9.003 1.00 64.51 H new ATOM 0 HD12 ILE A 69 -14.717 13.993 10.747 1.00 64.51 H new ATOM 0 HD13 ILE A 69 -14.001 15.391 9.910 1.00 64.51 H new ATOM 1111 N ASP A 70 -10.183 12.208 12.832 1.00 42.31 N ATOM 1112 CA ASP A 70 -9.177 12.335 13.881 1.00 53.14 C ATOM 1113 C ASP A 70 -7.928 11.531 13.535 1.00 2.03 C ATOM 1114 O ASP A 70 -6.825 12.075 13.472 1.00 54.15 O ATOM 1115 CB ASP A 70 -9.746 11.867 15.221 1.00 2.21 C ATOM 1116 CG ASP A 70 -8.663 11.436 16.190 1.00 22.04 C ATOM 1117 OD1 ASP A 70 -7.930 12.315 16.692 1.00 73.15 O ATOM 1118 OD2 ASP A 70 -8.548 10.220 16.449 1.00 73.24 O ATOM 0 H ASP A 70 -11.079 11.838 13.149 1.00 42.31 H new ATOM 0 HA ASP A 70 -8.900 13.386 13.960 1.00 53.14 H new ATOM 0 HB2 ASP A 70 -10.329 12.673 15.667 1.00 2.21 H new ATOM 0 HB3 ASP A 70 -10.430 11.035 15.052 1.00 2.21 H new ATOM 1123 N SER A 71 -8.108 10.233 13.315 1.00 61.34 N ATOM 1124 CA SER A 71 -6.994 9.352 12.981 1.00 54.42 C ATOM 1125 C SER A 71 -6.221 9.886 11.779 1.00 51.41 C ATOM 1126 O SER A 71 -5.050 10.248 11.892 1.00 5.30 O ATOM 1127 CB SER A 71 -7.504 7.940 12.687 1.00 24.12 C ATOM 1128 OG SER A 71 -6.592 6.961 13.156 1.00 12.42 O ATOM 0 H SER A 71 -9.014 9.767 13.362 1.00 61.34 H new ATOM 0 HA SER A 71 -6.321 9.317 13.838 1.00 54.42 H new ATOM 0 HB2 SER A 71 -8.475 7.794 13.161 1.00 24.12 H new ATOM 0 HB3 SER A 71 -7.652 7.819 11.614 1.00 24.12 H new ATOM 0 HG SER A 71 -6.417 6.309 12.445 1.00 12.42 H new ATOM 1134 N ILE A 72 -6.885 9.932 10.629 1.00 52.20 N ATOM 1135 CA ILE A 72 -6.262 10.423 9.406 1.00 25.33 C ATOM 1136 C ILE A 72 -5.700 11.827 9.601 1.00 51.14 C ATOM 1137 O ILE A 72 -4.675 12.183 9.021 1.00 23.24 O ATOM 1138 CB ILE A 72 -7.259 10.439 8.233 1.00 61.42 C ATOM 1139 CG1 ILE A 72 -7.597 9.010 7.803 1.00 63.42 C ATOM 1140 CG2 ILE A 72 -6.689 11.229 7.064 1.00 31.51 C ATOM 1141 CD1 ILE A 72 -8.766 8.927 6.846 1.00 22.25 C ATOM 0 H ILE A 72 -7.855 9.635 10.519 1.00 52.20 H new ATOM 0 HA ILE A 72 -5.448 9.738 9.170 1.00 25.33 H new ATOM 0 HB ILE A 72 -8.177 10.926 8.562 1.00 61.42 H new ATOM 0 HG12 ILE A 72 -6.721 8.564 7.333 1.00 63.42 H new ATOM 0 HG13 ILE A 72 -7.820 8.416 8.689 1.00 63.42 H new ATOM 0 HG21 ILE A 72 -7.405 11.231 6.243 1.00 31.51 H new ATOM 0 HG22 ILE A 72 -6.494 12.254 7.378 1.00 31.51 H new ATOM 0 HG23 ILE A 72 -5.758 10.768 6.733 1.00 31.51 H new ATOM 0 HD11 ILE A 72 -8.949 7.885 6.584 1.00 22.25 H new ATOM 0 HD12 ILE A 72 -9.655 9.343 7.320 1.00 22.25 H new ATOM 0 HD13 ILE A 72 -8.538 9.493 5.943 1.00 22.25 H new ATOM 1153 N GLY A 73 -6.379 12.622 10.422 1.00 34.23 N ATOM 1154 CA GLY A 73 -5.933 13.978 10.680 1.00 5.23 C ATOM 1155 C GLY A 73 -4.519 14.029 11.226 1.00 52.12 C ATOM 1156 O GLY A 73 -3.599 14.482 10.544 1.00 74.51 O ATOM 0 H GLY A 73 -7.231 12.351 10.913 1.00 34.23 H new ATOM 0 HA2 GLY A 73 -5.984 14.556 9.757 1.00 5.23 H new ATOM 0 HA3 GLY A 73 -6.611 14.451 11.390 1.00 5.23 H new ATOM 1160 N ARG A 74 -4.346 13.565 12.459 1.00 4.52 N ATOM 1161 CA ARG A 74 -3.035 13.563 13.097 1.00 64.11 C ATOM 1162 C ARG A 74 -2.013 12.827 12.236 1.00 65.43 C ATOM 1163 O ARG A 74 -0.856 13.236 12.141 1.00 22.03 O ATOM 1164 CB ARG A 74 -3.117 12.911 14.478 1.00 12.25 C ATOM 1165 CG ARG A 74 -3.796 11.551 14.471 1.00 51.32 C ATOM 1166 CD ARG A 74 -3.308 10.679 15.617 1.00 72.33 C ATOM 1167 NE ARG A 74 -4.396 9.918 16.227 1.00 45.13 N ATOM 1168 CZ ARG A 74 -4.825 8.750 15.763 1.00 34.23 C ATOM 1169 NH1 ARG A 74 -4.263 8.211 14.691 1.00 63.34 N ATOM 1170 NH2 ARG A 74 -5.820 8.118 16.373 1.00 10.04 N ATOM 0 H ARG A 74 -5.097 13.186 13.036 1.00 4.52 H new ATOM 0 HA ARG A 74 -2.712 14.598 13.210 1.00 64.11 H new ATOM 0 HB2 ARG A 74 -2.109 12.802 14.879 1.00 12.25 H new ATOM 0 HB3 ARG A 74 -3.659 13.575 15.152 1.00 12.25 H new ATOM 0 HG2 ARG A 74 -4.876 11.682 14.546 1.00 51.32 H new ATOM 0 HG3 ARG A 74 -3.601 11.050 13.523 1.00 51.32 H new ATOM 0 HD2 ARG A 74 -2.546 9.992 15.250 1.00 72.33 H new ATOM 0 HD3 ARG A 74 -2.835 11.305 16.373 1.00 72.33 H new ATOM 0 HE ARG A 74 -4.851 10.305 17.054 1.00 45.13 H new ATOM 0 HH11 ARG A 74 -3.498 8.693 14.219 1.00 63.34 H new ATOM 0 HH12 ARG A 74 -4.595 7.314 14.338 1.00 63.34 H new ATOM 0 HH21 ARG A 74 -6.256 8.529 17.199 1.00 10.04 H new ATOM 0 HH22 ARG A 74 -6.149 7.221 16.016 1.00 10.04 H new ATOM 1184 N ALA A 75 -2.448 11.738 11.610 1.00 12.10 N ATOM 1185 CA ALA A 75 -1.572 10.946 10.756 1.00 72.21 C ATOM 1186 C ALA A 75 -1.030 11.781 9.601 1.00 71.34 C ATOM 1187 O ALA A 75 0.180 11.963 9.468 1.00 64.41 O ATOM 1188 CB ALA A 75 -2.313 9.727 10.227 1.00 63.34 C ATOM 0 H ALA A 75 -3.402 11.384 11.679 1.00 12.10 H new ATOM 0 HA ALA A 75 -0.726 10.611 11.356 1.00 72.21 H new ATOM 0 HB1 ALA A 75 -1.647 9.144 9.591 1.00 63.34 H new ATOM 0 HB2 ALA A 75 -2.646 9.112 11.063 1.00 63.34 H new ATOM 0 HB3 ALA A 75 -3.178 10.050 9.648 1.00 63.34 H new ATOM 1194 N TYR A 76 -1.933 12.285 8.767 1.00 1.21 N ATOM 1195 CA TYR A 76 -1.545 13.098 7.621 1.00 44.42 C ATOM 1196 C TYR A 76 -0.660 14.264 8.054 1.00 34.20 C ATOM 1197 O TYR A 76 0.379 14.529 7.449 1.00 60.24 O ATOM 1198 CB TYR A 76 -2.786 13.626 6.899 1.00 1.14 C ATOM 1199 CG TYR A 76 -3.281 12.714 5.800 1.00 20.30 C ATOM 1200 CD1 TYR A 76 -3.040 11.346 5.844 1.00 42.24 C ATOM 1201 CD2 TYR A 76 -3.991 13.220 4.718 1.00 71.50 C ATOM 1202 CE1 TYR A 76 -3.490 10.509 4.841 1.00 43.21 C ATOM 1203 CE2 TYR A 76 -4.446 12.390 3.711 1.00 31.25 C ATOM 1204 CZ TYR A 76 -4.192 11.036 3.777 1.00 35.42 C ATOM 1205 OH TYR A 76 -4.644 10.205 2.777 1.00 24.11 O ATOM 0 H TYR A 76 -2.939 12.145 8.863 1.00 1.21 H new ATOM 0 HA TYR A 76 -0.976 12.468 6.937 1.00 44.42 H new ATOM 0 HB2 TYR A 76 -3.585 13.771 7.626 1.00 1.14 H new ATOM 0 HB3 TYR A 76 -2.560 14.604 6.474 1.00 1.14 H new ATOM 0 HD1 TYR A 76 -2.492 10.930 6.676 1.00 42.24 H new ATOM 0 HD2 TYR A 76 -4.191 14.280 4.663 1.00 71.50 H new ATOM 0 HE1 TYR A 76 -3.293 9.448 4.890 1.00 43.21 H new ATOM 0 HE2 TYR A 76 -4.997 12.799 2.877 1.00 31.25 H new ATOM 0 HH TYR A 76 -5.594 10.379 2.612 1.00 24.11 H new ATOM 1215 N LEU A 77 -1.080 14.957 9.107 1.00 74.33 N ATOM 1216 CA LEU A 77 -0.328 16.094 9.624 1.00 44.33 C ATOM 1217 C LEU A 77 1.127 15.713 9.881 1.00 51.45 C ATOM 1218 O LEU A 77 2.046 16.365 9.385 1.00 64.12 O ATOM 1219 CB LEU A 77 -0.967 16.610 10.914 1.00 11.20 C ATOM 1220 CG LEU A 77 -0.557 18.017 11.351 1.00 64.03 C ATOM 1221 CD1 LEU A 77 -1.130 19.059 10.403 1.00 70.22 C ATOM 1222 CD2 LEU A 77 -1.009 18.286 12.778 1.00 34.45 C ATOM 0 H LEU A 77 -1.938 14.751 9.619 1.00 74.33 H new ATOM 0 HA LEU A 77 -0.351 16.884 8.874 1.00 44.33 H new ATOM 0 HB2 LEU A 77 -2.050 16.590 10.792 1.00 11.20 H new ATOM 0 HB3 LEU A 77 -0.724 15.916 11.719 1.00 11.20 H new ATOM 0 HG LEU A 77 0.530 18.084 11.317 1.00 64.03 H new ATOM 0 HD11 LEU A 77 -0.828 20.054 10.730 1.00 70.22 H new ATOM 0 HD12 LEU A 77 -0.756 18.879 9.395 1.00 70.22 H new ATOM 0 HD13 LEU A 77 -2.218 18.992 10.403 1.00 70.22 H new ATOM 0 HD21 LEU A 77 -0.708 19.292 13.071 1.00 34.45 H new ATOM 0 HD22 LEU A 77 -2.094 18.199 12.838 1.00 34.45 H new ATOM 0 HD23 LEU A 77 -0.549 17.560 13.448 1.00 34.45 H new ATOM 1234 N ASP A 78 1.327 14.654 10.656 1.00 23.22 N ATOM 1235 CA ASP A 78 2.670 14.184 10.976 1.00 21.52 C ATOM 1236 C ASP A 78 3.464 13.899 9.705 1.00 75.42 C ATOM 1237 O ASP A 78 4.635 14.260 9.599 1.00 11.43 O ATOM 1238 CB ASP A 78 2.600 12.924 11.841 1.00 11.23 C ATOM 1239 CG ASP A 78 3.283 13.104 13.183 1.00 43.35 C ATOM 1240 OD1 ASP A 78 4.523 13.253 13.202 1.00 43.43 O ATOM 1241 OD2 ASP A 78 2.578 13.097 14.213 1.00 42.00 O ATOM 0 H ASP A 78 0.577 14.104 11.075 1.00 23.22 H new ATOM 0 HA ASP A 78 3.180 14.970 11.533 1.00 21.52 H new ATOM 0 HB2 ASP A 78 1.556 12.654 12.001 1.00 11.23 H new ATOM 0 HB3 ASP A 78 3.065 12.095 11.308 1.00 11.23 H new ATOM 1246 N GLU A 79 2.817 13.247 8.743 1.00 11.31 N ATOM 1247 CA GLU A 79 3.464 12.912 7.480 1.00 52.51 C ATOM 1248 C GLU A 79 4.036 14.161 6.814 1.00 73.31 C ATOM 1249 O GLU A 79 5.251 14.353 6.769 1.00 43.51 O ATOM 1250 CB GLU A 79 2.470 12.228 6.538 1.00 4.43 C ATOM 1251 CG GLU A 79 2.143 10.798 6.934 1.00 51.44 C ATOM 1252 CD GLU A 79 3.271 9.834 6.623 1.00 43.20 C ATOM 1253 OE1 GLU A 79 3.367 9.389 5.460 1.00 20.10 O ATOM 1254 OE2 GLU A 79 4.058 9.525 7.542 1.00 61.11 O ATOM 0 H GLU A 79 1.847 12.941 8.815 1.00 11.31 H new ATOM 0 HA GLU A 79 4.284 12.226 7.692 1.00 52.51 H new ATOM 0 HB2 GLU A 79 1.548 12.809 6.512 1.00 4.43 H new ATOM 0 HB3 GLU A 79 2.878 12.232 5.527 1.00 4.43 H new ATOM 0 HG2 GLU A 79 1.923 10.762 8.001 1.00 51.44 H new ATOM 0 HG3 GLU A 79 1.242 10.477 6.412 1.00 51.44 H new ATOM 1261 N THR A 80 3.150 15.007 6.296 1.00 24.25 N ATOM 1262 CA THR A 80 3.565 16.235 5.631 1.00 4.33 C ATOM 1263 C THR A 80 4.489 17.058 6.523 1.00 55.34 C ATOM 1264 O THR A 80 5.467 17.638 6.051 1.00 0.14 O ATOM 1265 CB THR A 80 2.352 17.097 5.234 1.00 32.22 C ATOM 1266 OG1 THR A 80 2.761 18.453 5.023 1.00 24.44 O ATOM 1267 CG2 THR A 80 1.278 17.048 6.310 1.00 31.44 C ATOM 0 H THR A 80 2.141 14.863 6.325 1.00 24.25 H new ATOM 0 HA THR A 80 4.102 15.940 4.729 1.00 4.33 H new ATOM 0 HB THR A 80 1.937 16.696 4.309 1.00 32.22 H new ATOM 0 HG1 THR A 80 3.475 18.479 4.353 1.00 24.44 H new ATOM 0 HG21 THR A 80 0.431 17.664 6.007 1.00 31.44 H new ATOM 0 HG22 THR A 80 0.947 16.019 6.447 1.00 31.44 H new ATOM 0 HG23 THR A 80 1.685 17.426 7.248 1.00 31.44 H new ATOM 1275 N ARG A 81 4.172 17.105 7.812 1.00 35.54 N ATOM 1276 CA ARG A 81 4.973 17.857 8.770 1.00 50.44 C ATOM 1277 C ARG A 81 6.431 17.409 8.730 1.00 70.04 C ATOM 1278 O ARG A 81 7.345 18.223 8.858 1.00 0.33 O ATOM 1279 CB ARG A 81 4.414 17.685 10.183 1.00 73.51 C ATOM 1280 CG ARG A 81 5.318 18.245 11.269 1.00 60.24 C ATOM 1281 CD ARG A 81 4.516 18.738 12.462 1.00 14.13 C ATOM 1282 NE ARG A 81 5.132 19.903 13.092 1.00 32.35 N ATOM 1283 CZ ARG A 81 4.650 20.489 14.183 1.00 41.34 C ATOM 1284 NH1 ARG A 81 3.552 20.022 14.761 1.00 41.23 N ATOM 1285 NH2 ARG A 81 5.267 21.545 14.697 1.00 43.30 N ATOM 0 H ARG A 81 3.365 16.631 8.218 1.00 35.54 H new ATOM 0 HA ARG A 81 4.927 18.911 8.495 1.00 50.44 H new ATOM 0 HB2 ARG A 81 3.442 18.176 10.242 1.00 73.51 H new ATOM 0 HB3 ARG A 81 4.248 16.624 10.372 1.00 73.51 H new ATOM 0 HG2 ARG A 81 6.019 17.476 11.593 1.00 60.24 H new ATOM 0 HG3 ARG A 81 5.910 19.065 10.864 1.00 60.24 H new ATOM 0 HD2 ARG A 81 3.506 18.992 12.140 1.00 14.13 H new ATOM 0 HD3 ARG A 81 4.425 17.936 13.194 1.00 14.13 H new ATOM 0 HE ARG A 81 5.978 20.288 12.672 1.00 32.35 H new ATOM 0 HH11 ARG A 81 3.075 19.211 14.368 1.00 41.23 H new ATOM 0 HH12 ARG A 81 3.185 20.474 15.598 1.00 41.23 H new ATOM 0 HH21 ARG A 81 6.112 21.907 14.255 1.00 43.30 H new ATOM 0 HH22 ARG A 81 4.897 21.994 15.534 1.00 43.30 H new ATOM 1299 N SER A 82 6.640 16.109 8.551 1.00 61.41 N ATOM 1300 CA SER A 82 7.986 15.551 8.498 1.00 24.04 C ATOM 1301 C SER A 82 8.859 16.330 7.520 1.00 44.45 C ATOM 1302 O SER A 82 10.065 16.468 7.721 1.00 42.44 O ATOM 1303 CB SER A 82 7.935 14.077 8.092 1.00 43.03 C ATOM 1304 OG SER A 82 9.072 13.377 8.567 1.00 0.02 O ATOM 0 H SER A 82 5.894 15.422 8.440 1.00 61.41 H new ATOM 0 HA SER A 82 8.425 15.631 9.493 1.00 24.04 H new ATOM 0 HB2 SER A 82 7.030 13.618 8.489 1.00 43.03 H new ATOM 0 HB3 SER A 82 7.883 13.997 7.006 1.00 43.03 H new ATOM 0 HG SER A 82 9.014 12.437 8.296 1.00 0.02 H new ATOM 1310 N ASN A 83 8.240 16.838 6.459 1.00 70.02 N ATOM 1311 CA ASN A 83 8.960 17.603 5.447 1.00 15.42 C ATOM 1312 C ASN A 83 8.404 19.020 5.340 1.00 52.14 C ATOM 1313 O ASN A 83 9.002 19.972 5.840 1.00 10.34 O ATOM 1314 CB ASN A 83 8.870 16.904 4.089 1.00 22.03 C ATOM 1315 CG ASN A 83 9.721 15.650 4.028 1.00 42.35 C ATOM 1316 OD1 ASN A 83 10.519 15.383 4.927 1.00 54.14 O ATOM 1317 ND2 ASN A 83 9.555 14.874 2.963 1.00 40.53 N ATOM 0 H ASN A 83 7.242 16.734 6.278 1.00 70.02 H new ATOM 0 HA ASN A 83 10.006 17.663 5.748 1.00 15.42 H new ATOM 0 HB2 ASN A 83 7.831 16.645 3.884 1.00 22.03 H new ATOM 0 HB3 ASN A 83 9.187 17.594 3.307 1.00 22.03 H new ATOM 0 HD21 ASN A 83 10.100 14.018 2.866 1.00 40.53 H new ATOM 0 HD22 ASN A 83 8.882 15.134 2.242 1.00 40.53 H new ATOM 1324 N SER A 84 7.255 19.151 4.683 1.00 4.23 N ATOM 1325 CA SER A 84 6.620 20.452 4.507 1.00 71.21 C ATOM 1326 C SER A 84 5.182 20.293 4.022 1.00 21.41 C ATOM 1327 O SER A 84 4.785 19.222 3.565 1.00 71.14 O ATOM 1328 CB SER A 84 7.414 21.301 3.513 1.00 64.45 C ATOM 1329 OG SER A 84 7.009 22.658 3.563 1.00 64.33 O ATOM 0 H SER A 84 6.746 18.373 4.264 1.00 4.23 H new ATOM 0 HA SER A 84 6.606 20.955 5.474 1.00 71.21 H new ATOM 0 HB2 SER A 84 8.478 21.228 3.736 1.00 64.45 H new ATOM 0 HB3 SER A 84 7.272 20.913 2.504 1.00 64.45 H new ATOM 0 HG SER A 84 7.533 23.180 2.920 1.00 64.33 H new ATOM 1335 N ASN A 85 4.407 21.367 4.126 1.00 12.13 N ATOM 1336 CA ASN A 85 3.012 21.348 3.699 1.00 24.34 C ATOM 1337 C ASN A 85 2.863 21.943 2.302 1.00 31.35 C ATOM 1338 O ASN A 85 3.852 22.190 1.613 1.00 60.43 O ATOM 1339 CB ASN A 85 2.143 22.122 4.692 1.00 53.44 C ATOM 1340 CG ASN A 85 2.428 23.612 4.671 1.00 62.44 C ATOM 1341 OD1 ASN A 85 3.304 24.097 5.387 1.00 14.31 O ATOM 1342 ND2 ASN A 85 1.688 24.344 3.847 1.00 41.25 N ATOM 0 H ASN A 85 4.721 22.262 4.502 1.00 12.13 H new ATOM 0 HA ASN A 85 2.680 20.310 3.669 1.00 24.34 H new ATOM 0 HB2 ASN A 85 1.092 21.953 4.459 1.00 53.44 H new ATOM 0 HB3 ASN A 85 2.313 21.736 5.697 1.00 53.44 H new ATOM 0 HD21 ASN A 85 1.835 25.352 3.789 1.00 41.25 H new ATOM 0 HD22 ASN A 85 0.973 23.899 3.272 1.00 41.25 H new ATOM 1349 N SER A 86 1.619 22.171 1.892 1.00 23.14 N ATOM 1350 CA SER A 86 1.339 22.734 0.577 1.00 45.03 C ATOM 1351 C SER A 86 0.259 23.807 0.664 1.00 53.31 C ATOM 1352 O SER A 86 -0.120 24.236 1.754 1.00 21.41 O ATOM 1353 CB SER A 86 0.903 21.632 -0.391 1.00 0.13 C ATOM 1354 OG SER A 86 1.202 21.982 -1.731 1.00 1.21 O ATOM 0 H SER A 86 0.789 21.974 2.452 1.00 23.14 H new ATOM 0 HA SER A 86 2.254 23.194 0.204 1.00 45.03 H new ATOM 0 HB2 SER A 86 1.405 20.699 -0.135 1.00 0.13 H new ATOM 0 HB3 SER A 86 -0.168 21.456 -0.288 1.00 0.13 H new ATOM 0 HG SER A 86 0.401 21.871 -2.285 1.00 1.21 H new ATOM 1360 N SER A 87 -0.234 24.238 -0.493 1.00 61.53 N ATOM 1361 CA SER A 87 -1.268 25.264 -0.549 1.00 75.45 C ATOM 1362 C SER A 87 -2.555 24.775 0.110 1.00 63.24 C ATOM 1363 O SER A 87 -2.574 23.730 0.760 1.00 62.45 O ATOM 1364 CB SER A 87 -1.545 25.660 -2.001 1.00 43.30 C ATOM 1365 OG SER A 87 -2.227 26.900 -2.070 1.00 1.52 O ATOM 0 H SER A 87 0.066 23.892 -1.404 1.00 61.53 H new ATOM 0 HA SER A 87 -0.909 26.137 -0.003 1.00 75.45 H new ATOM 0 HB2 SER A 87 -0.605 25.727 -2.549 1.00 43.30 H new ATOM 0 HB3 SER A 87 -2.141 24.886 -2.485 1.00 43.30 H new ATOM 0 HG SER A 87 -3.115 26.764 -2.462 1.00 1.52 H new ATOM 1371 N SER A 88 -3.628 25.539 -0.063 1.00 52.41 N ATOM 1372 CA SER A 88 -4.919 25.187 0.518 1.00 43.54 C ATOM 1373 C SER A 88 -6.061 25.613 -0.400 1.00 12.05 C ATOM 1374 O SER A 88 -6.519 26.754 -0.350 1.00 73.31 O ATOM 1375 CB SER A 88 -5.080 25.844 1.890 1.00 30.42 C ATOM 1376 OG SER A 88 -5.017 27.256 1.791 1.00 23.21 O ATOM 0 H SER A 88 -3.630 26.406 -0.601 1.00 52.41 H new ATOM 0 HA SER A 88 -4.955 24.104 0.635 1.00 43.54 H new ATOM 0 HB2 SER A 88 -6.034 25.549 2.328 1.00 30.42 H new ATOM 0 HB3 SER A 88 -4.298 25.488 2.561 1.00 30.42 H new ATOM 0 HG SER A 88 -5.548 27.554 1.023 1.00 23.21 H new ATOM 1382 N ASN A 89 -6.516 24.686 -1.236 1.00 54.35 N ATOM 1383 CA ASN A 89 -7.605 24.964 -2.166 1.00 51.31 C ATOM 1384 C ASN A 89 -8.091 23.682 -2.834 1.00 62.34 C ATOM 1385 O ASN A 89 -9.244 23.282 -2.673 1.00 52.52 O ATOM 1386 CB ASN A 89 -7.152 25.967 -3.230 1.00 20.35 C ATOM 1387 CG ASN A 89 -7.542 27.391 -2.885 1.00 53.11 C ATOM 1388 OD1 ASN A 89 -6.696 28.208 -2.522 1.00 22.12 O ATOM 1389 ND2 ASN A 89 -8.830 27.695 -2.998 1.00 0.22 N ATOM 0 H ASN A 89 -6.148 23.736 -1.289 1.00 54.35 H new ATOM 0 HA ASN A 89 -8.432 25.393 -1.600 1.00 51.31 H new ATOM 0 HB2 ASN A 89 -6.070 25.907 -3.344 1.00 20.35 H new ATOM 0 HB3 ASN A 89 -7.590 25.696 -4.191 1.00 20.35 H new ATOM 0 HD21 ASN A 89 -9.152 28.638 -2.780 1.00 0.22 H new ATOM 0 HD22 ASN A 89 -9.497 26.986 -3.303 1.00 0.22 H new ATOM 1396 N LYS A 90 -7.202 23.039 -3.585 1.00 54.42 N ATOM 1397 CA LYS A 90 -7.538 21.801 -4.277 1.00 61.43 C ATOM 1398 C LYS A 90 -6.700 20.640 -3.752 1.00 22.44 C ATOM 1399 O LYS A 90 -5.638 20.828 -3.158 1.00 21.01 O ATOM 1400 CB LYS A 90 -7.321 21.959 -5.784 1.00 1.11 C ATOM 1401 CG LYS A 90 -6.115 22.812 -6.138 1.00 53.33 C ATOM 1402 CD LYS A 90 -4.823 22.184 -5.645 1.00 20.14 C ATOM 1403 CE LYS A 90 -3.687 22.396 -6.633 1.00 62.24 C ATOM 1404 NZ LYS A 90 -2.361 22.434 -5.956 1.00 34.24 N ATOM 0 H LYS A 90 -6.243 23.356 -3.729 1.00 54.42 H new ATOM 0 HA LYS A 90 -8.589 21.583 -4.088 1.00 61.43 H new ATOM 0 HB2 LYS A 90 -7.201 20.972 -6.231 1.00 1.11 H new ATOM 0 HB3 LYS A 90 -8.213 22.403 -6.226 1.00 1.11 H new ATOM 0 HG2 LYS A 90 -6.067 22.944 -7.219 1.00 53.33 H new ATOM 0 HG3 LYS A 90 -6.229 23.804 -5.700 1.00 53.33 H new ATOM 0 HD2 LYS A 90 -4.553 22.615 -4.681 1.00 20.14 H new ATOM 0 HD3 LYS A 90 -4.974 21.116 -5.486 1.00 20.14 H new ATOM 0 HE2 LYS A 90 -3.694 21.595 -7.372 1.00 62.24 H new ATOM 0 HE3 LYS A 90 -3.845 23.329 -7.173 1.00 62.24 H new ATOM 0 HZ1 LYS A 90 -1.662 21.924 -6.533 1.00 34.24 H new ATOM 0 HZ2 LYS A 90 -2.059 23.422 -5.839 1.00 34.24 H new ATOM 0 HZ3 LYS A 90 -2.435 21.982 -5.022 1.00 34.24 H new ATOM 1418 N PRO A 91 -7.185 19.409 -3.975 1.00 14.40 N ATOM 1419 CA PRO A 91 -6.495 18.194 -3.533 1.00 73.35 C ATOM 1420 C PRO A 91 -5.214 17.937 -4.319 1.00 22.11 C ATOM 1421 O PRO A 91 -5.004 18.508 -5.388 1.00 54.41 O ATOM 1422 CB PRO A 91 -7.518 17.087 -3.803 1.00 14.42 C ATOM 1423 CG PRO A 91 -8.378 17.624 -4.895 1.00 11.14 C ATOM 1424 CD PRO A 91 -8.445 19.110 -4.676 1.00 53.32 C ATOM 0 HA PRO A 91 -6.182 18.259 -2.491 1.00 73.35 H new ATOM 0 HB2 PRO A 91 -7.029 16.161 -4.104 1.00 14.42 H new ATOM 0 HB3 PRO A 91 -8.104 16.863 -2.911 1.00 14.42 H new ATOM 0 HG2 PRO A 91 -7.957 17.392 -5.873 1.00 11.14 H new ATOM 0 HG3 PRO A 91 -9.373 17.179 -4.863 1.00 11.14 H new ATOM 0 HD2 PRO A 91 -8.519 19.652 -5.619 1.00 53.32 H new ATOM 0 HD3 PRO A 91 -9.313 19.389 -4.079 1.00 53.32 H new ATOM 1432 N GLY A 92 -4.358 17.072 -3.781 1.00 54.52 N ATOM 1433 CA GLY A 92 -3.108 16.755 -4.446 1.00 11.11 C ATOM 1434 C GLY A 92 -2.243 15.811 -3.635 1.00 34.25 C ATOM 1435 O GLY A 92 -1.583 14.930 -4.187 1.00 54.34 O ATOM 0 H GLY A 92 -4.509 16.586 -2.897 1.00 54.52 H new ATOM 0 HA2 GLY A 92 -3.320 16.306 -5.416 1.00 11.11 H new ATOM 0 HA3 GLY A 92 -2.557 17.676 -4.635 1.00 11.11 H new ATOM 1439 N THR A 93 -2.244 15.994 -2.318 1.00 33.23 N ATOM 1440 CA THR A 93 -1.452 15.154 -1.429 1.00 32.53 C ATOM 1441 C THR A 93 -1.834 15.382 0.029 1.00 13.12 C ATOM 1442 O THR A 93 -2.777 16.117 0.326 1.00 72.22 O ATOM 1443 CB THR A 93 0.055 15.419 -1.600 1.00 64.01 C ATOM 1444 OG1 THR A 93 0.262 16.712 -2.179 1.00 44.05 O ATOM 1445 CG2 THR A 93 0.696 14.355 -2.479 1.00 54.44 C ATOM 0 H THR A 93 -2.785 16.717 -1.844 1.00 33.23 H new ATOM 0 HA THR A 93 -1.665 14.120 -1.700 1.00 32.53 H new ATOM 0 HB THR A 93 0.522 15.383 -0.616 1.00 64.01 H new ATOM 0 HG1 THR A 93 1.223 16.874 -2.283 1.00 44.05 H new ATOM 0 HG21 THR A 93 1.761 14.564 -2.585 1.00 54.44 H new ATOM 0 HG22 THR A 93 0.562 13.375 -2.020 1.00 54.44 H new ATOM 0 HG23 THR A 93 0.225 14.363 -3.462 1.00 54.44 H new ATOM 1453 N CYS A 94 -1.097 14.750 0.935 1.00 20.42 N ATOM 1454 CA CYS A 94 -1.359 14.884 2.364 1.00 52.33 C ATOM 1455 C CYS A 94 -1.664 16.334 2.726 1.00 0.11 C ATOM 1456 O CYS A 94 -2.662 16.623 3.385 1.00 33.11 O ATOM 1457 CB CYS A 94 -0.161 14.385 3.173 1.00 73.34 C ATOM 1458 SG CYS A 94 1.443 14.785 2.440 1.00 33.02 S ATOM 0 H CYS A 94 -0.313 14.139 0.706 1.00 20.42 H new ATOM 0 HA CYS A 94 -2.230 14.276 2.607 1.00 52.33 H new ATOM 0 HB2 CYS A 94 -0.208 14.814 4.174 1.00 73.34 H new ATOM 0 HB3 CYS A 94 -0.237 13.304 3.286 1.00 73.34 H new ATOM 0 HG CYS A 94 1.554 14.192 1.288 1.00 33.02 H new ATOM 1464 N ALA A 95 -0.796 17.242 2.292 1.00 2.14 N ATOM 1465 CA ALA A 95 -0.972 18.662 2.571 1.00 72.12 C ATOM 1466 C ALA A 95 -2.376 19.125 2.196 1.00 70.42 C ATOM 1467 O ALA A 95 -3.162 19.519 3.058 1.00 4.32 O ATOM 1468 CB ALA A 95 0.072 19.480 1.825 1.00 31.30 C ATOM 0 H ALA A 95 0.036 17.019 1.746 1.00 2.14 H new ATOM 0 HA ALA A 95 -0.841 18.816 3.642 1.00 72.12 H new ATOM 0 HB1 ALA A 95 -0.071 20.538 2.043 1.00 31.30 H new ATOM 0 HB2 ALA A 95 1.069 19.176 2.144 1.00 31.30 H new ATOM 0 HB3 ALA A 95 -0.033 19.313 0.753 1.00 31.30 H new ATOM 1474 N HIS A 96 -2.686 19.074 0.904 1.00 5.30 N ATOM 1475 CA HIS A 96 -3.996 19.489 0.415 1.00 23.31 C ATOM 1476 C HIS A 96 -5.110 18.799 1.196 1.00 72.31 C ATOM 1477 O HIS A 96 -6.116 19.419 1.540 1.00 22.11 O ATOM 1478 CB HIS A 96 -4.131 19.174 -1.075 1.00 25.50 C ATOM 1479 CG HIS A 96 -3.132 19.889 -1.931 1.00 42.33 C ATOM 1480 ND1 HIS A 96 -2.167 19.236 -2.669 1.00 31.23 N ATOM 1481 CD2 HIS A 96 -2.953 21.210 -2.167 1.00 3.22 C ATOM 1482 CE1 HIS A 96 -1.437 20.124 -3.319 1.00 63.23 C ATOM 1483 NE2 HIS A 96 -1.893 21.330 -3.032 1.00 72.52 N ATOM 0 H HIS A 96 -2.048 18.750 0.177 1.00 5.30 H new ATOM 0 HA HIS A 96 -4.087 20.565 0.560 1.00 23.31 H new ATOM 0 HB2 HIS A 96 -4.021 18.100 -1.222 1.00 25.50 H new ATOM 0 HB3 HIS A 96 -5.136 19.439 -1.405 1.00 25.50 H new ATOM 0 HD2 HIS A 96 -3.536 22.019 -1.752 1.00 3.22 H new ATOM 0 HE1 HIS A 96 -0.608 19.902 -3.974 1.00 63.23 H new ATOM 0 HE2 HIS A 96 -1.519 22.207 -3.394 1.00 72.52 H new ATOM 1491 N ALA A 97 -4.924 17.512 1.471 1.00 31.13 N ATOM 1492 CA ALA A 97 -5.913 16.739 2.212 1.00 22.52 C ATOM 1493 C ALA A 97 -6.244 17.403 3.544 1.00 1.11 C ATOM 1494 O ALA A 97 -7.402 17.716 3.821 1.00 11.31 O ATOM 1495 CB ALA A 97 -5.412 15.320 2.438 1.00 22.21 C ATOM 0 H ALA A 97 -4.098 16.983 1.192 1.00 31.13 H new ATOM 0 HA ALA A 97 -6.826 16.701 1.618 1.00 22.52 H new ATOM 0 HB1 ALA A 97 -6.160 14.754 2.993 1.00 22.21 H new ATOM 0 HB2 ALA A 97 -5.233 14.840 1.476 1.00 22.21 H new ATOM 0 HB3 ALA A 97 -4.483 15.348 3.008 1.00 22.21 H new ATOM 1501 N ILE A 98 -5.221 17.615 4.365 1.00 63.41 N ATOM 1502 CA ILE A 98 -5.404 18.242 5.668 1.00 51.44 C ATOM 1503 C ILE A 98 -6.166 19.557 5.542 1.00 52.22 C ATOM 1504 O ILE A 98 -7.141 19.792 6.255 1.00 61.23 O ATOM 1505 CB ILE A 98 -4.054 18.509 6.359 1.00 31.33 C ATOM 1506 CG1 ILE A 98 -3.382 17.188 6.739 1.00 24.22 C ATOM 1507 CG2 ILE A 98 -4.252 19.382 7.589 1.00 33.55 C ATOM 1508 CD1 ILE A 98 -1.870 17.255 6.732 1.00 55.04 C ATOM 0 H ILE A 98 -4.256 17.362 4.151 1.00 63.41 H new ATOM 0 HA ILE A 98 -5.982 17.545 6.275 1.00 51.44 H new ATOM 0 HB ILE A 98 -3.404 19.039 5.663 1.00 31.33 H new ATOM 0 HG12 ILE A 98 -3.720 16.890 7.732 1.00 24.22 H new ATOM 0 HG13 ILE A 98 -3.706 16.412 6.046 1.00 24.22 H new ATOM 0 HG21 ILE A 98 -3.289 19.562 8.066 1.00 33.55 H new ATOM 0 HG22 ILE A 98 -4.693 20.334 7.293 1.00 33.55 H new ATOM 0 HG23 ILE A 98 -4.916 18.877 8.291 1.00 33.55 H new ATOM 0 HD11 ILE A 98 -1.461 16.284 7.011 1.00 55.04 H new ATOM 0 HD12 ILE A 98 -1.522 17.522 5.734 1.00 55.04 H new ATOM 0 HD13 ILE A 98 -1.536 18.008 7.446 1.00 55.04 H new ATOM 1520 N ASN A 99 -5.715 20.411 4.628 1.00 14.04 N ATOM 1521 CA ASN A 99 -6.356 21.703 4.408 1.00 62.43 C ATOM 1522 C ASN A 99 -7.841 21.529 4.105 1.00 60.22 C ATOM 1523 O ASN A 99 -8.695 22.112 4.773 1.00 13.20 O ATOM 1524 CB ASN A 99 -5.673 22.444 3.257 1.00 65.02 C ATOM 1525 CG ASN A 99 -4.361 23.080 3.676 1.00 14.24 C ATOM 1526 OD1 ASN A 99 -4.345 24.076 4.400 1.00 54.45 O ATOM 1527 ND2 ASN A 99 -3.253 22.506 3.223 1.00 74.31 N ATOM 0 H ASN A 99 -4.909 20.232 4.029 1.00 14.04 H new ATOM 0 HA ASN A 99 -6.256 22.291 5.321 1.00 62.43 H new ATOM 0 HB2 ASN A 99 -5.491 21.748 2.438 1.00 65.02 H new ATOM 0 HB3 ASN A 99 -6.343 23.216 2.877 1.00 65.02 H new ATOM 0 HD21 ASN A 99 -2.341 22.889 3.473 1.00 74.31 H new ATOM 0 HD22 ASN A 99 -3.313 21.682 2.625 1.00 74.31 H new ATOM 1534 N THR A 100 -8.142 20.721 3.093 1.00 55.45 N ATOM 1535 CA THR A 100 -9.523 20.471 2.700 1.00 35.52 C ATOM 1536 C THR A 100 -10.376 20.087 3.904 1.00 30.31 C ATOM 1537 O THR A 100 -11.381 20.735 4.198 1.00 74.21 O ATOM 1538 CB THR A 100 -9.613 19.352 1.644 1.00 13.54 C ATOM 1539 OG1 THR A 100 -8.969 19.768 0.435 1.00 21.20 O ATOM 1540 CG2 THR A 100 -11.064 18.996 1.356 1.00 43.13 C ATOM 0 H THR A 100 -7.448 20.229 2.531 1.00 55.45 H new ATOM 0 HA THR A 100 -9.902 21.398 2.270 1.00 35.52 H new ATOM 0 HB THR A 100 -9.110 18.469 2.038 1.00 13.54 H new ATOM 0 HG1 THR A 100 -7.997 19.723 0.550 1.00 21.20 H new ATOM 0 HG21 THR A 100 -11.103 18.204 0.608 1.00 43.13 H new ATOM 0 HG22 THR A 100 -11.543 18.653 2.273 1.00 43.13 H new ATOM 0 HG23 THR A 100 -11.587 19.876 0.981 1.00 43.13 H new ATOM 1548 N LEU A 101 -9.969 19.030 4.599 1.00 62.04 N ATOM 1549 CA LEU A 101 -10.696 18.560 5.773 1.00 64.22 C ATOM 1550 C LEU A 101 -10.980 19.710 6.734 1.00 25.40 C ATOM 1551 O LEU A 101 -12.134 20.008 7.038 1.00 62.41 O ATOM 1552 CB LEU A 101 -9.898 17.468 6.487 1.00 23.25 C ATOM 1553 CG LEU A 101 -9.878 16.098 5.809 1.00 71.33 C ATOM 1554 CD1 LEU A 101 -8.851 15.190 6.468 1.00 51.11 C ATOM 1555 CD2 LEU A 101 -11.260 15.462 5.851 1.00 21.31 C ATOM 0 H LEU A 101 -9.140 18.482 4.370 1.00 62.04 H new ATOM 0 HA LEU A 101 -11.648 18.147 5.440 1.00 64.22 H new ATOM 0 HB2 LEU A 101 -8.869 17.811 6.597 1.00 23.25 H new ATOM 0 HB3 LEU A 101 -10.304 17.348 7.492 1.00 23.25 H new ATOM 0 HG LEU A 101 -9.594 16.235 4.766 1.00 71.33 H new ATOM 0 HD11 LEU A 101 -8.852 14.220 5.972 1.00 51.11 H new ATOM 0 HD12 LEU A 101 -7.861 15.639 6.385 1.00 51.11 H new ATOM 0 HD13 LEU A 101 -9.103 15.059 7.520 1.00 51.11 H new ATOM 0 HD21 LEU A 101 -11.227 14.487 5.364 1.00 21.31 H new ATOM 0 HD22 LEU A 101 -11.573 15.339 6.888 1.00 21.31 H new ATOM 0 HD23 LEU A 101 -11.972 16.103 5.331 1.00 21.31 H new ATOM 1567 N GLY A 102 -9.917 20.354 7.208 1.00 15.02 N ATOM 1568 CA GLY A 102 -10.074 21.465 8.128 1.00 2.42 C ATOM 1569 C GLY A 102 -10.910 22.587 7.545 1.00 0.34 C ATOM 1570 O GLY A 102 -11.358 23.476 8.269 1.00 34.43 O ATOM 0 H GLY A 102 -8.951 20.126 6.971 1.00 15.02 H new ATOM 0 HA2 GLY A 102 -10.540 21.109 9.047 1.00 2.42 H new ATOM 0 HA3 GLY A 102 -9.091 21.851 8.398 1.00 2.42 H new ATOM 1574 N GLU A 103 -11.119 22.548 6.233 1.00 24.31 N ATOM 1575 CA GLU A 103 -11.904 23.571 5.554 1.00 55.20 C ATOM 1576 C GLU A 103 -13.387 23.208 5.553 1.00 25.40 C ATOM 1577 O GLU A 103 -14.239 24.029 5.214 1.00 64.12 O ATOM 1578 CB GLU A 103 -11.412 23.754 4.117 1.00 70.11 C ATOM 1579 CG GLU A 103 -12.430 23.340 3.067 1.00 0.24 C ATOM 1580 CD GLU A 103 -11.884 23.436 1.656 1.00 55.22 C ATOM 1581 OE1 GLU A 103 -11.000 24.285 1.419 1.00 44.21 O ATOM 1582 OE2 GLU A 103 -12.342 22.663 0.788 1.00 11.44 O ATOM 0 H GLU A 103 -10.755 21.819 5.619 1.00 24.31 H new ATOM 0 HA GLU A 103 -11.777 24.508 6.096 1.00 55.20 H new ATOM 0 HB2 GLU A 103 -11.149 24.800 3.963 1.00 70.11 H new ATOM 0 HB3 GLU A 103 -10.501 23.172 3.977 1.00 70.11 H new ATOM 0 HG2 GLU A 103 -12.750 22.316 3.260 1.00 0.24 H new ATOM 0 HG3 GLU A 103 -13.314 23.972 3.154 1.00 0.24 H new ATOM 1589 N VAL A 104 -13.687 21.970 5.935 1.00 44.22 N ATOM 1590 CA VAL A 104 -15.065 21.497 5.979 1.00 62.31 C ATOM 1591 C VAL A 104 -15.429 20.995 7.372 1.00 72.34 C ATOM 1592 O VAL A 104 -16.606 20.910 7.724 1.00 51.05 O ATOM 1593 CB VAL A 104 -15.303 20.367 4.959 1.00 11.04 C ATOM 1594 CG1 VAL A 104 -14.660 20.709 3.624 1.00 72.42 C ATOM 1595 CG2 VAL A 104 -14.771 19.046 5.494 1.00 0.13 C ATOM 0 H VAL A 104 -12.994 21.277 6.218 1.00 44.22 H new ATOM 0 HA VAL A 104 -15.700 22.346 5.724 1.00 62.31 H new ATOM 0 HB VAL A 104 -16.377 20.263 4.802 1.00 11.04 H new ATOM 0 HG11 VAL A 104 -14.838 19.899 2.916 1.00 72.42 H new ATOM 0 HG12 VAL A 104 -15.093 21.631 3.237 1.00 72.42 H new ATOM 0 HG13 VAL A 104 -13.587 20.842 3.760 1.00 72.42 H new ATOM 0 HG21 VAL A 104 -14.947 18.259 4.761 1.00 0.13 H new ATOM 0 HG22 VAL A 104 -13.701 19.134 5.682 1.00 0.13 H new ATOM 0 HG23 VAL A 104 -15.283 18.797 6.424 1.00 0.13 H new ATOM 1605 N ILE A 105 -14.412 20.663 8.160 1.00 51.42 N ATOM 1606 CA ILE A 105 -14.625 20.171 9.515 1.00 15.21 C ATOM 1607 C ILE A 105 -15.612 21.054 10.272 1.00 51.14 C ATOM 1608 O ILE A 105 -16.348 20.579 11.136 1.00 74.24 O ATOM 1609 CB ILE A 105 -13.305 20.104 10.304 1.00 4.01 C ATOM 1610 CG1 ILE A 105 -13.451 19.172 11.508 1.00 34.34 C ATOM 1611 CG2 ILE A 105 -12.884 21.496 10.753 1.00 72.41 C ATOM 1612 CD1 ILE A 105 -13.204 17.716 11.179 1.00 14.14 C ATOM 0 H ILE A 105 -13.432 20.726 7.883 1.00 51.42 H new ATOM 0 HA ILE A 105 -15.036 19.165 9.424 1.00 15.21 H new ATOM 0 HB ILE A 105 -12.529 19.704 9.651 1.00 4.01 H new ATOM 0 HG12 ILE A 105 -12.753 19.484 12.285 1.00 34.34 H new ATOM 0 HG13 ILE A 105 -14.455 19.278 11.920 1.00 34.34 H new ATOM 0 HG21 ILE A 105 -11.949 21.432 11.310 1.00 72.41 H new ATOM 0 HG22 ILE A 105 -12.743 22.133 9.880 1.00 72.41 H new ATOM 0 HG23 ILE A 105 -13.658 21.922 11.392 1.00 72.41 H new ATOM 0 HD11 ILE A 105 -13.325 17.114 12.080 1.00 14.14 H new ATOM 0 HD12 ILE A 105 -13.918 17.387 10.424 1.00 14.14 H new ATOM 0 HD13 ILE A 105 -12.191 17.596 10.796 1.00 14.14 H new ATOM 1624 N GLN A 106 -15.622 22.341 9.939 1.00 22.10 N ATOM 1625 CA GLN A 106 -16.519 23.290 10.587 1.00 54.13 C ATOM 1626 C GLN A 106 -17.949 22.758 10.611 1.00 44.30 C ATOM 1627 O GLN A 106 -18.478 22.424 11.670 1.00 22.42 O ATOM 1628 CB GLN A 106 -16.476 24.638 9.866 1.00 55.43 C ATOM 1629 CG GLN A 106 -16.170 24.525 8.381 1.00 23.01 C ATOM 1630 CD GLN A 106 -16.909 25.556 7.552 1.00 53.12 C ATOM 1631 OE1 GLN A 106 -18.014 25.974 7.901 1.00 61.04 O ATOM 1632 NE2 GLN A 106 -16.303 25.973 6.446 1.00 21.05 N ATOM 0 H GLN A 106 -15.019 22.750 9.225 1.00 22.10 H new ATOM 0 HA GLN A 106 -16.184 23.425 11.615 1.00 54.13 H new ATOM 0 HB2 GLN A 106 -17.435 25.139 9.994 1.00 55.43 H new ATOM 0 HB3 GLN A 106 -15.722 25.268 10.337 1.00 55.43 H new ATOM 0 HG2 GLN A 106 -15.097 24.641 8.225 1.00 23.01 H new ATOM 0 HG3 GLN A 106 -16.437 23.527 8.034 1.00 23.01 H new ATOM 0 HE21 GLN A 106 -15.388 25.600 6.195 1.00 21.05 H new ATOM 0 HE22 GLN A 106 -16.753 26.666 5.848 1.00 21.05 H new ATOM 1641 N GLU A 107 -18.567 22.684 9.437 1.00 52.04 N ATOM 1642 CA GLU A 107 -19.936 22.194 9.325 1.00 60.13 C ATOM 1643 C GLU A 107 -20.063 20.794 9.918 1.00 63.40 C ATOM 1644 O GLU A 107 -21.051 20.475 10.580 1.00 31.52 O ATOM 1645 CB GLU A 107 -20.379 22.181 7.860 1.00 5.11 C ATOM 1646 CG GLU A 107 -19.859 20.986 7.078 1.00 53.53 C ATOM 1647 CD GLU A 107 -19.940 21.192 5.578 1.00 70.25 C ATOM 1648 OE1 GLU A 107 -21.006 20.900 4.996 1.00 71.21 O ATOM 1649 OE2 GLU A 107 -18.938 21.644 4.985 1.00 31.12 O ATOM 0 H GLU A 107 -18.142 22.957 8.551 1.00 52.04 H new ATOM 0 HA GLU A 107 -20.583 22.868 9.887 1.00 60.13 H new ATOM 0 HB2 GLU A 107 -21.468 22.186 7.818 1.00 5.11 H new ATOM 0 HB3 GLU A 107 -20.037 23.097 7.378 1.00 5.11 H new ATOM 0 HG2 GLU A 107 -18.824 20.795 7.360 1.00 53.53 H new ATOM 0 HG3 GLU A 107 -20.432 20.100 7.351 1.00 53.53 H new ATOM 1656 N LEU A 108 -19.056 19.962 9.675 1.00 21.44 N ATOM 1657 CA LEU A 108 -19.053 18.595 10.185 1.00 74.44 C ATOM 1658 C LEU A 108 -19.241 18.577 11.698 1.00 31.12 C ATOM 1659 O LEU A 108 -20.267 18.118 12.202 1.00 30.41 O ATOM 1660 CB LEU A 108 -17.746 17.893 9.813 1.00 5.43 C ATOM 1661 CG LEU A 108 -17.409 17.847 8.322 1.00 23.15 C ATOM 1662 CD1 LEU A 108 -16.083 17.136 8.097 1.00 54.14 C ATOM 1663 CD2 LEU A 108 -18.523 17.161 7.545 1.00 1.41 C ATOM 0 H LEU A 108 -18.231 20.210 9.128 1.00 21.44 H new ATOM 0 HA LEU A 108 -19.887 18.062 9.728 1.00 74.44 H new ATOM 0 HB2 LEU A 108 -16.928 18.391 10.335 1.00 5.43 H new ATOM 0 HB3 LEU A 108 -17.787 16.870 10.187 1.00 5.43 H new ATOM 0 HG LEU A 108 -17.316 18.870 7.958 1.00 23.15 H new ATOM 0 HD11 LEU A 108 -15.859 17.113 7.031 1.00 54.14 H new ATOM 0 HD12 LEU A 108 -15.291 17.669 8.623 1.00 54.14 H new ATOM 0 HD13 LEU A 108 -16.148 16.116 8.477 1.00 54.14 H new ATOM 0 HD21 LEU A 108 -18.267 17.137 6.486 1.00 1.41 H new ATOM 0 HD22 LEU A 108 -18.648 16.142 7.911 1.00 1.41 H new ATOM 0 HD23 LEU A 108 -19.454 17.712 7.681 1.00 1.41 H new ATOM 1675 N LEU A 109 -18.246 19.082 12.418 1.00 25.55 N ATOM 1676 CA LEU A 109 -18.301 19.126 13.876 1.00 54.25 C ATOM 1677 C LEU A 109 -19.578 19.812 14.351 1.00 53.13 C ATOM 1678 O LEU A 109 -20.424 19.193 14.997 1.00 43.22 O ATOM 1679 CB LEU A 109 -17.079 19.859 14.430 1.00 4.02 C ATOM 1680 CG LEU A 109 -15.886 18.981 14.812 1.00 51.31 C ATOM 1681 CD1 LEU A 109 -14.579 19.665 14.441 1.00 14.42 C ATOM 1682 CD2 LEU A 109 -15.917 18.656 16.298 1.00 12.42 C ATOM 0 H LEU A 109 -17.391 19.467 12.017 1.00 25.55 H new ATOM 0 HA LEU A 109 -18.301 18.101 14.247 1.00 54.25 H new ATOM 0 HB2 LEU A 109 -16.748 20.584 13.687 1.00 4.02 H new ATOM 0 HB3 LEU A 109 -17.387 20.423 15.311 1.00 4.02 H new ATOM 0 HG LEU A 109 -15.954 18.047 14.255 1.00 51.31 H new ATOM 0 HD11 LEU A 109 -13.742 19.026 14.720 1.00 14.42 H new ATOM 0 HD12 LEU A 109 -14.555 19.846 13.366 1.00 14.42 H new ATOM 0 HD13 LEU A 109 -14.502 20.615 14.970 1.00 14.42 H new ATOM 0 HD21 LEU A 109 -15.061 18.031 16.552 1.00 12.42 H new ATOM 0 HD22 LEU A 109 -15.874 19.581 16.874 1.00 12.42 H new ATOM 0 HD23 LEU A 109 -16.838 18.123 16.535 1.00 12.42 H new ATOM 1694 N SER A 110 -19.712 21.094 14.024 1.00 31.44 N ATOM 1695 CA SER A 110 -20.885 21.864 14.419 1.00 14.42 C ATOM 1696 C SER A 110 -22.147 21.010 14.345 1.00 20.31 C ATOM 1697 O SER A 110 -22.761 20.700 15.366 1.00 22.42 O ATOM 1698 CB SER A 110 -21.037 23.096 13.525 1.00 50.42 C ATOM 1699 OG SER A 110 -21.121 22.728 12.159 1.00 24.10 O ATOM 0 H SER A 110 -19.023 21.620 13.487 1.00 31.44 H new ATOM 0 HA SER A 110 -20.746 22.187 15.451 1.00 14.42 H new ATOM 0 HB2 SER A 110 -21.932 23.649 13.812 1.00 50.42 H new ATOM 0 HB3 SER A 110 -20.188 23.764 13.673 1.00 50.42 H new ATOM 0 HG SER A 110 -20.222 22.715 11.768 1.00 24.10 H new ATOM 1705 N ASP A 111 -22.528 20.633 13.130 1.00 63.45 N ATOM 1706 CA ASP A 111 -23.715 19.813 12.920 1.00 35.23 C ATOM 1707 C ASP A 111 -23.723 18.616 13.866 1.00 60.21 C ATOM 1708 O ASP A 111 -24.740 18.310 14.488 1.00 2.21 O ATOM 1709 CB ASP A 111 -23.781 19.333 11.470 1.00 61.15 C ATOM 1710 CG ASP A 111 -24.392 20.367 10.545 1.00 74.03 C ATOM 1711 OD1 ASP A 111 -24.700 21.480 11.020 1.00 31.44 O ATOM 1712 OD2 ASP A 111 -24.564 20.063 9.345 1.00 11.24 O ATOM 0 H ASP A 111 -22.032 20.882 12.275 1.00 63.45 H new ATOM 0 HA ASP A 111 -24.591 20.426 13.131 1.00 35.23 H new ATOM 0 HB2 ASP A 111 -22.776 19.090 11.125 1.00 61.15 H new ATOM 0 HB3 ASP A 111 -24.366 18.415 11.421 1.00 61.15 H new ATOM 1717 N ALA A 112 -22.582 17.941 13.968 1.00 54.34 N ATOM 1718 CA ALA A 112 -22.457 16.778 14.838 1.00 54.54 C ATOM 1719 C ALA A 112 -22.826 17.127 16.276 1.00 73.33 C ATOM 1720 O ALA A 112 -23.742 16.538 16.851 1.00 24.44 O ATOM 1721 CB ALA A 112 -21.043 16.221 14.774 1.00 52.04 C ATOM 0 H ALA A 112 -21.731 18.180 13.459 1.00 54.34 H new ATOM 0 HA ALA A 112 -23.152 16.015 14.487 1.00 54.54 H new ATOM 0 HB1 ALA A 112 -20.964 15.353 15.428 1.00 52.04 H new ATOM 0 HB2 ALA A 112 -20.814 15.925 13.750 1.00 52.04 H new ATOM 0 HB3 ALA A 112 -20.336 16.985 15.098 1.00 52.04 H new ATOM 1727 N ILE A 113 -22.108 18.086 16.850 1.00 33.20 N ATOM 1728 CA ILE A 113 -22.361 18.512 18.221 1.00 72.21 C ATOM 1729 C ILE A 113 -23.829 18.873 18.422 1.00 1.32 C ATOM 1730 O ILE A 113 -24.470 18.407 19.363 1.00 32.51 O ATOM 1731 CB ILE A 113 -21.489 19.722 18.604 1.00 21.45 C ATOM 1732 CG1 ILE A 113 -20.058 19.528 18.098 1.00 73.33 C ATOM 1733 CG2 ILE A 113 -21.499 19.925 20.112 1.00 15.51 C ATOM 1734 CD1 ILE A 113 -19.044 20.401 18.802 1.00 0.13 C ATOM 0 H ILE A 113 -21.347 18.583 16.387 1.00 33.20 H new ATOM 0 HA ILE A 113 -22.105 17.671 18.866 1.00 72.21 H new ATOM 0 HB ILE A 113 -21.904 20.613 18.133 1.00 21.45 H new ATOM 0 HG12 ILE A 113 -19.775 18.483 18.224 1.00 73.33 H new ATOM 0 HG13 ILE A 113 -20.028 19.740 17.029 1.00 73.33 H new ATOM 0 HG21 ILE A 113 -20.878 20.784 20.368 1.00 15.51 H new ATOM 0 HG22 ILE A 113 -22.520 20.103 20.448 1.00 15.51 H new ATOM 0 HG23 ILE A 113 -21.105 19.034 20.602 1.00 15.51 H new ATOM 0 HD11 ILE A 113 -18.052 20.210 18.392 1.00 0.13 H new ATOM 0 HD12 ILE A 113 -19.302 21.450 18.654 1.00 0.13 H new ATOM 0 HD13 ILE A 113 -19.046 20.174 19.868 1.00 0.13 H new ATOM 1746 N ALA A 114 -24.355 19.707 17.531 1.00 71.44 N ATOM 1747 CA ALA A 114 -25.748 20.128 17.608 1.00 74.21 C ATOM 1748 C ALA A 114 -26.685 18.925 17.637 1.00 62.42 C ATOM 1749 O ALA A 114 -27.315 18.639 18.655 1.00 4.15 O ATOM 1750 CB ALA A 114 -26.091 21.037 16.437 1.00 5.30 C ATOM 0 H ALA A 114 -23.837 20.104 16.747 1.00 71.44 H new ATOM 0 HA ALA A 114 -25.882 20.683 18.536 1.00 74.21 H new ATOM 0 HB1 ALA A 114 -27.135 21.343 16.508 1.00 5.30 H new ATOM 0 HB2 ALA A 114 -25.451 21.919 16.462 1.00 5.30 H new ATOM 0 HB3 ALA A 114 -25.933 20.500 15.501 1.00 5.30 H new ATOM 1756 N LYS A 115 -26.773 18.222 16.512 1.00 1.24 N ATOM 1757 CA LYS A 115 -27.632 17.049 16.408 1.00 31.21 C ATOM 1758 C LYS A 115 -27.369 16.078 17.555 1.00 13.21 C ATOM 1759 O LYS A 115 -28.269 15.360 17.991 1.00 23.13 O ATOM 1760 CB LYS A 115 -27.408 16.344 15.068 1.00 4.32 C ATOM 1761 CG LYS A 115 -28.695 15.992 14.343 1.00 21.43 C ATOM 1762 CD LYS A 115 -29.598 15.122 15.202 1.00 52.31 C ATOM 1763 CE LYS A 115 -28.908 13.827 15.603 1.00 55.41 C ATOM 1764 NZ LYS A 115 -29.772 12.986 16.477 1.00 14.40 N ATOM 0 H LYS A 115 -26.259 18.445 15.659 1.00 1.24 H new ATOM 0 HA LYS A 115 -28.668 17.382 16.468 1.00 31.21 H new ATOM 0 HB2 LYS A 115 -26.803 16.985 14.427 1.00 4.32 H new ATOM 0 HB3 LYS A 115 -26.836 15.432 15.238 1.00 4.32 H new ATOM 0 HG2 LYS A 115 -29.222 16.906 14.070 1.00 21.43 H new ATOM 0 HG3 LYS A 115 -28.460 15.470 13.415 1.00 21.43 H new ATOM 0 HD2 LYS A 115 -29.891 15.672 16.097 1.00 52.31 H new ATOM 0 HD3 LYS A 115 -30.513 14.894 14.655 1.00 52.31 H new ATOM 0 HE2 LYS A 115 -28.641 13.265 14.708 1.00 55.41 H new ATOM 0 HE3 LYS A 115 -27.979 14.057 16.124 1.00 55.41 H new ATOM 0 HZ1 LYS A 115 -29.266 12.113 16.728 1.00 14.40 H new ATOM 0 HZ2 LYS A 115 -30.006 13.512 17.343 1.00 14.40 H new ATOM 0 HZ3 LYS A 115 -30.648 12.745 15.971 1.00 14.40 H new ATOM 1778 N SER A 116 -26.132 16.063 18.040 1.00 42.40 N ATOM 1779 CA SER A 116 -25.750 15.179 19.135 1.00 14.31 C ATOM 1780 C SER A 116 -26.403 15.620 20.442 1.00 73.03 C ATOM 1781 O SER A 116 -26.672 16.803 20.646 1.00 41.03 O ATOM 1782 CB SER A 116 -24.229 15.157 19.294 1.00 20.32 C ATOM 1783 OG SER A 116 -23.639 14.211 18.420 1.00 63.24 O ATOM 0 H SER A 116 -25.377 16.653 17.692 1.00 42.40 H new ATOM 0 HA SER A 116 -26.098 14.174 18.896 1.00 14.31 H new ATOM 0 HB2 SER A 116 -23.824 16.148 19.089 1.00 20.32 H new ATOM 0 HB3 SER A 116 -23.971 14.915 20.325 1.00 20.32 H new ATOM 0 HG SER A 116 -22.725 14.017 18.716 1.00 63.24 H new ATOM 1789 N ASN A 117 -26.656 14.658 21.324 1.00 43.24 N ATOM 1790 CA ASN A 117 -27.278 14.946 22.611 1.00 62.31 C ATOM 1791 C ASN A 117 -26.228 15.039 23.714 1.00 43.13 C ATOM 1792 O ASN A 117 -25.027 15.009 23.445 1.00 72.44 O ATOM 1793 CB ASN A 117 -28.303 13.865 22.958 1.00 34.31 C ATOM 1794 CG ASN A 117 -27.833 12.476 22.572 1.00 63.22 C ATOM 1795 OD1 ASN A 117 -26.742 12.029 23.184 1.00 65.42 O flip ATOM 1796 ND2 ASN A 117 -28.443 11.813 21.733 1.00 13.22 N flip ATOM 0 H ASN A 117 -26.440 13.673 21.171 1.00 43.24 H new ATOM 0 HA ASN A 117 -27.785 15.908 22.534 1.00 62.31 H new ATOM 0 HB2 ASN A 117 -28.507 13.892 24.028 1.00 34.31 H new ATOM 0 HB3 ASN A 117 -29.242 14.082 22.449 1.00 34.31 H new ATOM 0 HD21 ASN A 117 -29.277 12.196 21.288 1.00 13.22 H new ATOM 0 HD22 ASN A 117 -28.115 10.880 21.483 1.00 13.22 H new ATOM 1803 N GLN A 118 -26.689 15.152 24.955 1.00 54.31 N ATOM 1804 CA GLN A 118 -25.790 15.250 26.098 1.00 3.12 C ATOM 1805 C GLN A 118 -24.659 14.232 25.990 1.00 40.43 C ATOM 1806 O GLN A 118 -23.484 14.581 26.102 1.00 43.43 O ATOM 1807 CB GLN A 118 -26.562 15.036 27.401 1.00 24.43 C ATOM 1808 CG GLN A 118 -27.776 15.939 27.545 1.00 71.53 C ATOM 1809 CD GLN A 118 -28.331 15.951 28.955 1.00 31.53 C ATOM 1810 OE1 GLN A 118 -27.829 15.255 29.838 1.00 22.44 O ATOM 1811 NE2 GLN A 118 -29.373 16.744 29.175 1.00 31.31 N ATOM 0 H GLN A 118 -27.680 15.178 25.195 1.00 54.31 H new ATOM 0 HA GLN A 118 -25.355 16.250 26.102 1.00 3.12 H new ATOM 0 HB2 GLN A 118 -26.885 13.996 27.456 1.00 24.43 H new ATOM 0 HB3 GLN A 118 -25.891 15.206 28.243 1.00 24.43 H new ATOM 0 HG2 GLN A 118 -27.505 16.955 27.257 1.00 71.53 H new ATOM 0 HG3 GLN A 118 -28.553 15.609 26.856 1.00 71.53 H new ATOM 0 HE21 GLN A 118 -29.757 17.304 28.414 1.00 31.31 H new ATOM 0 HE22 GLN A 118 -29.789 16.793 30.105 1.00 31.31 H new ATOM 1820 N ASP A 119 -25.022 12.973 25.772 1.00 50.35 N ATOM 1821 CA ASP A 119 -24.038 11.904 25.647 1.00 1.41 C ATOM 1822 C ASP A 119 -23.137 12.133 24.437 1.00 33.12 C ATOM 1823 O ASP A 119 -21.937 12.366 24.579 1.00 5.52 O ATOM 1824 CB ASP A 119 -24.737 10.549 25.529 1.00 13.32 C ATOM 1825 CG ASP A 119 -25.560 10.213 26.758 1.00 42.54 C ATOM 1826 OD1 ASP A 119 -25.636 11.062 27.671 1.00 65.15 O ATOM 1827 OD2 ASP A 119 -26.127 9.102 26.807 1.00 71.35 O ATOM 0 H ASP A 119 -25.991 12.667 25.678 1.00 50.35 H new ATOM 0 HA ASP A 119 -23.419 11.907 26.544 1.00 1.41 H new ATOM 0 HB2 ASP A 119 -25.384 10.552 24.652 1.00 13.32 H new ATOM 0 HB3 ASP A 119 -23.990 9.771 25.371 1.00 13.32 H new ATOM 1832 N HIS A 120 -23.725 12.063 23.247 1.00 42.11 N ATOM 1833 CA HIS A 120 -22.975 12.262 22.012 1.00 73.15 C ATOM 1834 C HIS A 120 -22.117 13.521 22.093 1.00 32.23 C ATOM 1835 O HIS A 120 -20.893 13.460 21.976 1.00 31.42 O ATOM 1836 CB HIS A 120 -23.930 12.358 20.821 1.00 63.41 C ATOM 1837 CG HIS A 120 -24.762 11.129 20.620 1.00 64.42 C ATOM 1838 ND1 HIS A 120 -25.721 11.022 19.635 1.00 21.10 N ATOM 1839 CD2 HIS A 120 -24.773 9.949 21.283 1.00 65.41 C ATOM 1840 CE1 HIS A 120 -26.287 9.830 19.702 1.00 11.22 C ATOM 1841 NE2 HIS A 120 -25.729 9.159 20.694 1.00 52.24 N ATOM 0 H HIS A 120 -24.717 11.870 23.112 1.00 42.11 H new ATOM 0 HA HIS A 120 -22.317 11.404 21.874 1.00 73.15 H new ATOM 0 HB2 HIS A 120 -24.590 13.214 20.963 1.00 63.41 H new ATOM 0 HB3 HIS A 120 -23.352 12.547 19.917 1.00 63.41 H new ATOM 0 HD2 HIS A 120 -24.146 9.679 22.120 1.00 65.41 H new ATOM 0 HE1 HIS A 120 -27.072 9.466 19.056 1.00 11.22 H new ATOM 0 HE2 HIS A 120 -25.969 8.209 20.976 1.00 52.24 H new ATOM 1849 N LYS A 121 -22.767 14.662 22.294 1.00 14.13 N ATOM 1850 CA LYS A 121 -22.065 15.936 22.392 1.00 13.23 C ATOM 1851 C LYS A 121 -20.849 15.818 23.305 1.00 42.21 C ATOM 1852 O LYS A 121 -19.801 16.404 23.035 1.00 63.51 O ATOM 1853 CB LYS A 121 -23.007 17.022 22.918 1.00 31.20 C ATOM 1854 CG LYS A 121 -23.231 16.958 24.419 1.00 41.20 C ATOM 1855 CD LYS A 121 -22.235 17.828 25.169 1.00 74.44 C ATOM 1856 CE LYS A 121 -21.892 17.237 26.528 1.00 55.22 C ATOM 1857 NZ LYS A 121 -20.580 17.728 27.031 1.00 44.24 N ATOM 0 H LYS A 121 -23.780 14.731 22.392 1.00 14.13 H new ATOM 0 HA LYS A 121 -21.723 16.212 21.394 1.00 13.23 H new ATOM 0 HB2 LYS A 121 -22.600 18.000 22.661 1.00 31.20 H new ATOM 0 HB3 LYS A 121 -23.968 16.934 22.412 1.00 31.20 H new ATOM 0 HG2 LYS A 121 -24.246 17.282 24.651 1.00 41.20 H new ATOM 0 HG3 LYS A 121 -23.141 15.926 24.758 1.00 41.20 H new ATOM 0 HD2 LYS A 121 -21.326 17.935 24.577 1.00 74.44 H new ATOM 0 HD3 LYS A 121 -22.649 18.828 25.300 1.00 74.44 H new ATOM 0 HE2 LYS A 121 -22.674 17.493 27.243 1.00 55.22 H new ATOM 0 HE3 LYS A 121 -21.869 16.150 26.456 1.00 55.22 H new ATOM 0 HZ1 LYS A 121 -20.151 17.006 27.644 1.00 44.24 H new ATOM 0 HZ2 LYS A 121 -19.949 17.919 26.227 1.00 44.24 H new ATOM 0 HZ3 LYS A 121 -20.722 18.603 27.575 1.00 44.24 H new ATOM 1871 N GLU A 122 -20.996 15.057 24.385 1.00 70.44 N ATOM 1872 CA GLU A 122 -19.908 14.862 25.336 1.00 40.33 C ATOM 1873 C GLU A 122 -18.711 14.195 24.664 1.00 31.03 C ATOM 1874 O GLU A 122 -17.568 14.615 24.847 1.00 71.23 O ATOM 1875 CB GLU A 122 -20.381 14.015 26.519 1.00 5.31 C ATOM 1876 CG GLU A 122 -19.681 12.670 26.623 1.00 53.33 C ATOM 1877 CD GLU A 122 -20.062 11.910 27.878 1.00 75.31 C ATOM 1878 OE1 GLU A 122 -21.247 11.967 28.269 1.00 53.32 O ATOM 1879 OE2 GLU A 122 -19.177 11.258 28.469 1.00 21.42 O ATOM 0 H GLU A 122 -21.858 14.566 24.623 1.00 70.44 H new ATOM 0 HA GLU A 122 -19.598 15.841 25.701 1.00 40.33 H new ATOM 0 HB2 GLU A 122 -20.219 14.572 27.442 1.00 5.31 H new ATOM 0 HB3 GLU A 122 -21.455 13.850 26.431 1.00 5.31 H new ATOM 0 HG2 GLU A 122 -19.928 12.068 25.749 1.00 53.33 H new ATOM 0 HG3 GLU A 122 -18.602 12.824 26.609 1.00 53.33 H new ATOM 1886 N LYS A 123 -18.982 13.152 23.887 1.00 40.12 N ATOM 1887 CA LYS A 123 -17.930 12.425 23.187 1.00 44.34 C ATOM 1888 C LYS A 123 -17.143 13.356 22.269 1.00 11.34 C ATOM 1889 O LYS A 123 -15.913 13.383 22.305 1.00 45.42 O ATOM 1890 CB LYS A 123 -18.530 11.277 22.372 1.00 24.12 C ATOM 1891 CG LYS A 123 -19.196 10.210 23.224 1.00 1.40 C ATOM 1892 CD LYS A 123 -18.171 9.357 23.952 1.00 62.25 C ATOM 1893 CE LYS A 123 -18.726 8.811 25.258 1.00 34.00 C ATOM 1894 NZ LYS A 123 -19.837 7.846 25.028 1.00 13.33 N ATOM 0 H LYS A 123 -19.922 12.791 23.726 1.00 40.12 H new ATOM 0 HA LYS A 123 -17.248 12.016 23.933 1.00 44.34 H new ATOM 0 HB2 LYS A 123 -19.262 11.682 21.674 1.00 24.12 H new ATOM 0 HB3 LYS A 123 -17.743 10.815 21.776 1.00 24.12 H new ATOM 0 HG2 LYS A 123 -19.858 10.683 23.949 1.00 1.40 H new ATOM 0 HG3 LYS A 123 -19.817 9.574 22.593 1.00 1.40 H new ATOM 0 HD2 LYS A 123 -17.864 8.530 23.312 1.00 62.25 H new ATOM 0 HD3 LYS A 123 -17.280 9.951 24.154 1.00 62.25 H new ATOM 0 HE2 LYS A 123 -17.928 8.320 25.815 1.00 34.00 H new ATOM 0 HE3 LYS A 123 -19.083 9.636 25.874 1.00 34.00 H new ATOM 0 HZ1 LYS A 123 -20.177 7.484 25.942 1.00 13.33 H new ATOM 0 HZ2 LYS A 123 -20.617 8.325 24.534 1.00 13.33 H new ATOM 0 HZ3 LYS A 123 -19.494 7.054 24.447 1.00 13.33 H new ATOM 1908 N ILE A 124 -17.861 14.118 21.451 1.00 42.21 N ATOM 1909 CA ILE A 124 -17.229 15.052 20.527 1.00 72.01 C ATOM 1910 C ILE A 124 -16.348 16.050 21.271 1.00 54.14 C ATOM 1911 O ILE A 124 -15.195 16.271 20.902 1.00 63.51 O ATOM 1912 CB ILE A 124 -18.277 15.823 19.702 1.00 3.45 C ATOM 1913 CG1 ILE A 124 -19.248 14.850 19.031 1.00 25.45 C ATOM 1914 CG2 ILE A 124 -17.593 16.698 18.663 1.00 44.52 C ATOM 1915 CD1 ILE A 124 -20.384 15.534 18.305 1.00 14.03 C ATOM 0 H ILE A 124 -18.880 14.107 21.409 1.00 42.21 H new ATOM 0 HA ILE A 124 -16.611 14.460 19.852 1.00 72.01 H new ATOM 0 HB ILE A 124 -18.845 16.466 20.374 1.00 3.45 H new ATOM 0 HG12 ILE A 124 -18.697 14.230 18.324 1.00 25.45 H new ATOM 0 HG13 ILE A 124 -19.661 14.182 19.787 1.00 25.45 H new ATOM 0 HG21 ILE A 124 -18.346 17.236 18.088 1.00 44.52 H new ATOM 0 HG22 ILE A 124 -16.939 17.412 19.163 1.00 44.52 H new ATOM 0 HG23 ILE A 124 -17.003 16.073 17.993 1.00 44.52 H new ATOM 0 HD11 ILE A 124 -21.032 14.783 17.854 1.00 14.03 H new ATOM 0 HD12 ILE A 124 -20.959 16.133 19.011 1.00 14.03 H new ATOM 0 HD13 ILE A 124 -19.981 16.181 17.526 1.00 14.03 H new ATOM 1927 N ARG A 125 -16.900 16.650 22.321 1.00 63.13 N ATOM 1928 CA ARG A 125 -16.164 17.624 23.117 1.00 10.43 C ATOM 1929 C ARG A 125 -14.818 17.059 23.562 1.00 73.34 C ATOM 1930 O ARG A 125 -13.777 17.688 23.375 1.00 14.34 O ATOM 1931 CB ARG A 125 -16.984 18.038 24.341 1.00 51.45 C ATOM 1932 CG ARG A 125 -16.503 19.326 24.990 1.00 65.45 C ATOM 1933 CD ARG A 125 -15.777 19.052 26.298 1.00 51.42 C ATOM 1934 NE ARG A 125 -15.678 20.249 27.129 1.00 13.01 N ATOM 1935 CZ ARG A 125 -14.996 20.298 28.268 1.00 53.51 C ATOM 1936 NH1 ARG A 125 -14.356 19.224 28.708 1.00 1.22 N ATOM 1937 NH2 ARG A 125 -14.953 21.425 28.969 1.00 73.54 N ATOM 0 H ARG A 125 -17.854 16.479 22.640 1.00 63.13 H new ATOM 0 HA ARG A 125 -15.983 18.500 22.495 1.00 10.43 H new ATOM 0 HB2 ARG A 125 -18.026 18.157 24.046 1.00 51.45 H new ATOM 0 HB3 ARG A 125 -16.951 17.236 25.078 1.00 51.45 H new ATOM 0 HG2 ARG A 125 -15.837 19.853 24.306 1.00 65.45 H new ATOM 0 HG3 ARG A 125 -17.354 19.982 25.175 1.00 65.45 H new ATOM 0 HD2 ARG A 125 -16.303 18.271 26.848 1.00 51.42 H new ATOM 0 HD3 ARG A 125 -14.777 18.674 26.085 1.00 51.42 H new ATOM 0 HE ARG A 125 -16.159 21.093 26.818 1.00 13.01 H new ATOM 0 HH11 ARG A 125 -14.386 18.357 28.172 1.00 1.22 H new ATOM 0 HH12 ARG A 125 -13.833 19.265 29.583 1.00 1.22 H new ATOM 0 HH21 ARG A 125 -15.444 22.254 28.633 1.00 73.54 H new ATOM 0 HH22 ARG A 125 -14.429 21.462 29.843 1.00 73.54 H new ATOM 1951 N MET A 126 -14.848 15.867 24.150 1.00 52.40 N ATOM 1952 CA MET A 126 -13.631 15.217 24.620 1.00 24.11 C ATOM 1953 C MET A 126 -12.616 15.081 23.489 1.00 23.25 C ATOM 1954 O MET A 126 -11.470 15.516 23.614 1.00 30.33 O ATOM 1955 CB MET A 126 -13.954 13.838 25.199 1.00 13.42 C ATOM 1956 CG MET A 126 -12.972 12.757 24.780 1.00 41.03 C ATOM 1957 SD MET A 126 -13.050 11.299 25.838 1.00 4.43 S ATOM 1958 CE MET A 126 -11.840 11.724 27.089 1.00 41.31 C ATOM 0 H MET A 126 -15.702 15.332 24.312 1.00 52.40 H new ATOM 0 HA MET A 126 -13.196 15.839 25.403 1.00 24.11 H new ATOM 0 HB2 MET A 126 -13.966 13.904 26.287 1.00 13.42 H new ATOM 0 HB3 MET A 126 -14.957 13.547 24.886 1.00 13.42 H new ATOM 0 HG2 MET A 126 -13.177 12.465 23.750 1.00 41.03 H new ATOM 0 HG3 MET A 126 -11.960 13.163 24.801 1.00 41.03 H new ATOM 0 HE1 MET A 126 -11.773 10.917 27.819 1.00 41.31 H new ATOM 0 HE2 MET A 126 -10.867 11.870 26.619 1.00 41.31 H new ATOM 0 HE3 MET A 126 -12.143 12.643 27.591 1.00 41.31 H new ATOM 1968 N LEU A 127 -13.043 14.475 22.387 1.00 24.32 N ATOM 1969 CA LEU A 127 -12.171 14.281 21.234 1.00 45.12 C ATOM 1970 C LEU A 127 -11.490 15.588 20.840 1.00 55.32 C ATOM 1971 O LEU A 127 -10.285 15.622 20.587 1.00 55.05 O ATOM 1972 CB LEU A 127 -12.971 13.732 20.051 1.00 4.41 C ATOM 1973 CG LEU A 127 -12.219 13.625 18.724 1.00 4.40 C ATOM 1974 CD1 LEU A 127 -11.411 12.338 18.671 1.00 44.13 C ATOM 1975 CD2 LEU A 127 -13.189 13.697 17.554 1.00 41.11 C ATOM 0 H LEU A 127 -13.988 14.109 22.267 1.00 24.32 H new ATOM 0 HA LEU A 127 -11.401 13.560 21.509 1.00 45.12 H new ATOM 0 HB2 LEU A 127 -13.341 12.742 20.317 1.00 4.41 H new ATOM 0 HB3 LEU A 127 -13.843 14.369 19.901 1.00 4.41 H new ATOM 0 HG LEU A 127 -11.529 14.466 18.650 1.00 4.40 H new ATOM 0 HD11 LEU A 127 -10.883 12.279 17.719 1.00 44.13 H new ATOM 0 HD12 LEU A 127 -10.690 12.327 19.488 1.00 44.13 H new ATOM 0 HD13 LEU A 127 -12.081 11.484 18.768 1.00 44.13 H new ATOM 0 HD21 LEU A 127 -12.636 13.619 16.618 1.00 41.11 H new ATOM 0 HD22 LEU A 127 -13.903 12.877 17.623 1.00 41.11 H new ATOM 0 HD23 LEU A 127 -13.723 14.647 17.582 1.00 41.11 H new ATOM 1987 N LEU A 128 -12.269 16.663 20.792 1.00 54.31 N ATOM 1988 CA LEU A 128 -11.742 17.975 20.431 1.00 32.21 C ATOM 1989 C LEU A 128 -10.605 18.380 21.364 1.00 71.15 C ATOM 1990 O LEU A 128 -9.537 18.794 20.913 1.00 51.43 O ATOM 1991 CB LEU A 128 -12.854 19.024 20.479 1.00 53.05 C ATOM 1992 CG LEU A 128 -12.979 19.926 19.250 1.00 73.41 C ATOM 1993 CD1 LEU A 128 -14.427 20.341 19.038 1.00 63.04 C ATOM 1994 CD2 LEU A 128 -12.087 21.150 19.394 1.00 62.24 C ATOM 0 H LEU A 128 -13.268 16.652 20.998 1.00 54.31 H new ATOM 0 HA LEU A 128 -11.351 17.915 19.415 1.00 32.21 H new ATOM 0 HB2 LEU A 128 -13.804 18.511 20.626 1.00 53.05 H new ATOM 0 HB3 LEU A 128 -12.694 19.655 21.353 1.00 53.05 H new ATOM 0 HG LEU A 128 -12.652 19.364 18.375 1.00 73.41 H new ATOM 0 HD11 LEU A 128 -14.497 20.982 18.159 1.00 63.04 H new ATOM 0 HD12 LEU A 128 -15.042 19.453 18.889 1.00 63.04 H new ATOM 0 HD13 LEU A 128 -14.781 20.885 19.913 1.00 63.04 H new ATOM 0 HD21 LEU A 128 -12.189 21.780 18.511 1.00 62.24 H new ATOM 0 HD22 LEU A 128 -12.383 21.714 20.278 1.00 62.24 H new ATOM 0 HD23 LEU A 128 -11.049 20.834 19.496 1.00 62.24 H new ATOM 2006 N ASP A 129 -10.841 18.255 22.665 1.00 53.22 N ATOM 2007 CA ASP A 129 -9.836 18.605 23.661 1.00 3.14 C ATOM 2008 C ASP A 129 -8.508 17.917 23.359 1.00 74.20 C ATOM 2009 O ASP A 129 -7.459 18.560 23.320 1.00 52.42 O ATOM 2010 CB ASP A 129 -10.318 18.219 25.061 1.00 64.14 C ATOM 2011 CG ASP A 129 -9.756 19.126 26.137 1.00 4.14 C ATOM 2012 OD1 ASP A 129 -8.583 18.935 26.522 1.00 44.42 O ATOM 2013 OD2 ASP A 129 -10.489 20.027 26.595 1.00 5.42 O ATOM 0 H ASP A 129 -11.720 17.914 23.054 1.00 53.22 H new ATOM 0 HA ASP A 129 -9.683 19.683 23.622 1.00 3.14 H new ATOM 0 HB2 ASP A 129 -11.407 18.257 25.090 1.00 64.14 H new ATOM 0 HB3 ASP A 129 -10.029 17.189 25.271 1.00 64.14 H new ATOM 2018 N ILE A 130 -8.562 16.606 23.147 1.00 12.21 N ATOM 2019 CA ILE A 130 -7.364 15.831 22.848 1.00 12.44 C ATOM 2020 C ILE A 130 -6.678 16.344 21.587 1.00 0.50 C ATOM 2021 O ILE A 130 -5.451 16.411 21.520 1.00 44.44 O ATOM 2022 CB ILE A 130 -7.690 14.337 22.670 1.00 34.21 C ATOM 2023 CG1 ILE A 130 -8.419 13.801 23.904 1.00 31.31 C ATOM 2024 CG2 ILE A 130 -6.418 13.544 22.414 1.00 64.13 C ATOM 2025 CD1 ILE A 130 -9.022 12.428 23.701 1.00 11.40 C ATOM 0 H ILE A 130 -9.422 16.059 23.177 1.00 12.21 H new ATOM 0 HA ILE A 130 -6.692 15.949 23.698 1.00 12.44 H new ATOM 0 HB ILE A 130 -8.345 14.224 21.806 1.00 34.21 H new ATOM 0 HG12 ILE A 130 -7.721 13.762 24.740 1.00 31.31 H new ATOM 0 HG13 ILE A 130 -9.209 14.499 24.181 1.00 31.31 H new ATOM 0 HG21 ILE A 130 -6.665 12.490 22.290 1.00 64.13 H new ATOM 0 HG22 ILE A 130 -5.936 13.912 21.509 1.00 64.13 H new ATOM 0 HG23 ILE A 130 -5.740 13.661 23.259 1.00 64.13 H new ATOM 0 HD11 ILE A 130 -9.523 12.112 24.616 1.00 11.40 H new ATOM 0 HD12 ILE A 130 -9.745 12.465 22.886 1.00 11.40 H new ATOM 0 HD13 ILE A 130 -8.233 11.717 23.454 1.00 11.40 H new ATOM 2037 N TRP A 131 -7.478 16.707 20.591 1.00 30.00 N ATOM 2038 CA TRP A 131 -6.948 17.216 19.331 1.00 5.45 C ATOM 2039 C TRP A 131 -5.974 18.364 19.575 1.00 13.44 C ATOM 2040 O TRP A 131 -4.790 18.265 19.255 1.00 63.31 O ATOM 2041 CB TRP A 131 -8.088 17.682 18.425 1.00 12.22 C ATOM 2042 CG TRP A 131 -8.826 16.553 17.771 1.00 1.50 C ATOM 2043 CD1 TRP A 131 -8.669 15.219 18.018 1.00 1.50 C ATOM 2044 CD2 TRP A 131 -9.835 16.660 16.761 1.00 43.53 C ATOM 2045 NE1 TRP A 131 -9.519 14.491 17.222 1.00 74.30 N ATOM 2046 CE2 TRP A 131 -10.246 15.351 16.442 1.00 1.33 C ATOM 2047 CE3 TRP A 131 -10.432 17.734 16.096 1.00 52.44 C ATOM 2048 CZ2 TRP A 131 -11.225 15.091 15.488 1.00 73.53 C ATOM 2049 CZ3 TRP A 131 -11.404 17.474 15.148 1.00 22.12 C ATOM 2050 CH2 TRP A 131 -11.793 16.161 14.852 1.00 72.12 C ATOM 0 H TRP A 131 -8.496 16.658 20.631 1.00 30.00 H new ATOM 0 HA TRP A 131 -6.410 16.406 18.838 1.00 5.45 H new ATOM 0 HB2 TRP A 131 -8.790 18.274 19.012 1.00 12.22 H new ATOM 0 HB3 TRP A 131 -7.685 18.338 17.654 1.00 12.22 H new ATOM 0 HD1 TRP A 131 -7.978 14.799 18.734 1.00 1.50 H new ATOM 0 HE1 TRP A 131 -9.596 13.474 17.213 1.00 74.30 H new ATOM 0 HE3 TRP A 131 -10.139 18.749 16.319 1.00 52.44 H new ATOM 0 HZ2 TRP A 131 -11.526 14.080 15.258 1.00 73.53 H new ATOM 0 HZ3 TRP A 131 -11.871 18.297 14.627 1.00 22.12 H new ATOM 0 HH2 TRP A 131 -12.556 15.990 14.107 1.00 72.12 H new ATOM 2061 N ASP A 132 -6.481 19.453 20.144 1.00 63.11 N ATOM 2062 CA ASP A 132 -5.655 20.620 20.432 1.00 61.21 C ATOM 2063 C ASP A 132 -4.458 20.238 21.298 1.00 14.40 C ATOM 2064 O ASP A 132 -3.321 20.598 20.995 1.00 64.31 O ATOM 2065 CB ASP A 132 -6.484 21.698 21.132 1.00 60.22 C ATOM 2066 CG ASP A 132 -7.286 21.147 22.294 1.00 12.35 C ATOM 2067 OD1 ASP A 132 -6.727 21.049 23.407 1.00 73.04 O ATOM 2068 OD2 ASP A 132 -8.473 20.814 22.092 1.00 62.10 O ATOM 0 H ASP A 132 -7.459 19.552 20.415 1.00 63.11 H new ATOM 0 HA ASP A 132 -5.285 21.015 19.486 1.00 61.21 H new ATOM 0 HB2 ASP A 132 -5.822 22.485 21.492 1.00 60.22 H new ATOM 0 HB3 ASP A 132 -7.161 22.156 20.412 1.00 60.22 H new ATOM 2073 N ARG A 133 -4.724 19.510 22.377 1.00 20.32 N ATOM 2074 CA ARG A 133 -3.670 19.082 23.289 1.00 64.34 C ATOM 2075 C ARG A 133 -2.582 18.316 22.541 1.00 74.44 C ATOM 2076 O ARG A 133 -1.476 18.818 22.348 1.00 45.53 O ATOM 2077 CB ARG A 133 -4.251 18.207 24.401 1.00 53.22 C ATOM 2078 CG ARG A 133 -4.798 19.001 25.576 1.00 31.43 C ATOM 2079 CD ARG A 133 -4.727 18.202 26.868 1.00 14.05 C ATOM 2080 NE ARG A 133 -3.350 17.990 27.306 1.00 33.11 N ATOM 2081 CZ ARG A 133 -3.019 17.625 28.540 1.00 51.51 C ATOM 2082 NH1 ARG A 133 -3.961 17.433 29.453 1.00 2.42 N ATOM 2083 NH2 ARG A 133 -1.744 17.452 28.862 1.00 44.01 N ATOM 0 H ARG A 133 -5.660 19.204 22.641 1.00 20.32 H new ATOM 0 HA ARG A 133 -3.225 19.973 23.733 1.00 64.34 H new ATOM 0 HB2 ARG A 133 -5.049 17.590 23.987 1.00 53.22 H new ATOM 0 HB3 ARG A 133 -3.477 17.529 24.760 1.00 53.22 H new ATOM 0 HG2 ARG A 133 -4.232 19.926 25.687 1.00 31.43 H new ATOM 0 HG3 ARG A 133 -5.832 19.282 25.377 1.00 31.43 H new ATOM 0 HD2 ARG A 133 -5.279 18.725 27.649 1.00 14.05 H new ATOM 0 HD3 ARG A 133 -5.214 17.238 26.725 1.00 14.05 H new ATOM 0 HE ARG A 133 -2.601 18.130 26.627 1.00 33.11 H new ATOM 0 HH11 ARG A 133 -4.942 17.565 29.209 1.00 2.42 H new ATOM 0 HH12 ARG A 133 -3.704 17.153 30.400 1.00 2.42 H new ATOM 0 HH21 ARG A 133 -1.017 17.599 28.162 1.00 44.01 H new ATOM 0 HH22 ARG A 133 -1.491 17.172 29.810 1.00 44.01 H new ATOM 2097 N SER A 134 -2.906 17.096 22.122 1.00 10.14 N ATOM 2098 CA SER A 134 -1.956 16.259 21.400 1.00 70.35 C ATOM 2099 C SER A 134 -1.445 16.971 20.151 1.00 62.43 C ATOM 2100 O SER A 134 -0.312 17.449 20.115 1.00 21.10 O ATOM 2101 CB SER A 134 -2.607 14.930 21.012 1.00 32.42 C ATOM 2102 OG SER A 134 -1.752 14.167 20.179 1.00 71.44 O ATOM 0 H SER A 134 -3.819 16.666 22.271 1.00 10.14 H new ATOM 0 HA SER A 134 -1.109 16.063 22.058 1.00 70.35 H new ATOM 0 HB2 SER A 134 -2.845 14.362 21.911 1.00 32.42 H new ATOM 0 HB3 SER A 134 -3.548 15.120 20.496 1.00 32.42 H new ATOM 0 HG SER A 134 -2.190 13.322 19.947 1.00 71.44 H new ATOM 2108 N GLY A 135 -2.290 17.036 19.127 1.00 53.44 N ATOM 2109 CA GLY A 135 -1.907 17.691 17.889 1.00 33.13 C ATOM 2110 C GLY A 135 -2.868 17.394 16.755 1.00 50.30 C ATOM 2111 O GLY A 135 -3.331 16.263 16.603 1.00 11.02 O ATOM 0 H GLY A 135 -3.233 16.647 19.132 1.00 53.44 H new ATOM 0 HA2 GLY A 135 -1.862 18.768 18.050 1.00 33.13 H new ATOM 0 HA3 GLY A 135 -0.905 17.369 17.606 1.00 33.13 H new ATOM 2115 N LEU A 136 -3.170 18.412 15.957 1.00 54.13 N ATOM 2116 CA LEU A 136 -4.084 18.256 14.830 1.00 33.14 C ATOM 2117 C LEU A 136 -4.175 19.545 14.020 1.00 72.21 C ATOM 2118 O LEU A 136 -3.384 20.468 14.212 1.00 43.24 O ATOM 2119 CB LEU A 136 -5.474 17.854 15.328 1.00 61.32 C ATOM 2120 CG LEU A 136 -6.218 16.821 14.480 1.00 45.33 C ATOM 2121 CD1 LEU A 136 -5.991 15.420 15.025 1.00 71.20 C ATOM 2122 CD2 LEU A 136 -7.704 17.143 14.430 1.00 31.35 C ATOM 0 H LEU A 136 -2.796 19.354 16.069 1.00 54.13 H new ATOM 0 HA LEU A 136 -3.694 17.470 14.184 1.00 33.14 H new ATOM 0 HB2 LEU A 136 -5.376 17.461 16.340 1.00 61.32 H new ATOM 0 HB3 LEU A 136 -6.089 18.752 15.393 1.00 61.32 H new ATOM 0 HG LEU A 136 -5.824 16.861 13.464 1.00 45.33 H new ATOM 0 HD11 LEU A 136 -6.528 14.699 14.409 1.00 71.20 H new ATOM 0 HD12 LEU A 136 -4.926 15.191 15.007 1.00 71.20 H new ATOM 0 HD13 LEU A 136 -6.357 15.365 16.050 1.00 71.20 H new ATOM 0 HD21 LEU A 136 -8.218 16.398 13.822 1.00 31.35 H new ATOM 0 HD22 LEU A 136 -8.113 17.132 15.440 1.00 31.35 H new ATOM 0 HD23 LEU A 136 -7.848 18.130 13.991 1.00 31.35 H new ATOM 2134 N PHE A 137 -5.147 19.601 13.115 1.00 43.40 N ATOM 2135 CA PHE A 137 -5.342 20.778 12.276 1.00 73.12 C ATOM 2136 C PHE A 137 -5.406 22.046 13.123 1.00 60.42 C ATOM 2137 O PHE A 137 -5.007 23.121 12.678 1.00 12.51 O ATOM 2138 CB PHE A 137 -6.624 20.636 11.453 1.00 53.13 C ATOM 2139 CG PHE A 137 -6.718 19.334 10.709 1.00 14.33 C ATOM 2140 CD1 PHE A 137 -5.574 18.633 10.366 1.00 22.13 C ATOM 2141 CD2 PHE A 137 -7.952 18.812 10.353 1.00 5.42 C ATOM 2142 CE1 PHE A 137 -5.657 17.435 9.683 1.00 61.55 C ATOM 2143 CE2 PHE A 137 -8.041 17.614 9.670 1.00 42.42 C ATOM 2144 CZ PHE A 137 -6.892 16.925 9.333 1.00 51.20 C ATOM 0 H PHE A 137 -5.811 18.846 12.944 1.00 43.40 H new ATOM 0 HA PHE A 137 -4.491 20.857 11.600 1.00 73.12 H new ATOM 0 HB2 PHE A 137 -7.484 20.729 12.116 1.00 53.13 H new ATOM 0 HB3 PHE A 137 -6.681 21.458 10.739 1.00 53.13 H new ATOM 0 HD1 PHE A 137 -4.605 19.028 10.636 1.00 22.13 H new ATOM 0 HD2 PHE A 137 -8.853 19.347 10.612 1.00 5.42 H new ATOM 0 HE1 PHE A 137 -4.757 16.898 9.423 1.00 61.55 H new ATOM 0 HE2 PHE A 137 -9.008 17.217 9.400 1.00 42.42 H new ATOM 0 HZ PHE A 137 -6.959 15.990 8.797 1.00 51.20 H new ATOM 2154 N GLN A 138 -5.911 21.909 14.345 1.00 62.13 N ATOM 2155 CA GLN A 138 -6.028 23.043 15.253 1.00 11.15 C ATOM 2156 C GLN A 138 -4.654 23.506 15.726 1.00 11.14 C ATOM 2157 O GLN A 138 -4.182 23.100 16.789 1.00 42.54 O ATOM 2158 CB GLN A 138 -6.896 22.672 16.457 1.00 74.21 C ATOM 2159 CG GLN A 138 -8.125 21.855 16.092 1.00 70.45 C ATOM 2160 CD GLN A 138 -9.127 21.769 17.226 1.00 73.23 C ATOM 2161 OE1 GLN A 138 -10.127 22.487 17.241 1.00 35.23 O ATOM 2162 NE2 GLN A 138 -8.864 20.887 18.183 1.00 11.22 N ATOM 0 H GLN A 138 -6.245 21.025 14.728 1.00 62.13 H new ATOM 0 HA GLN A 138 -6.501 23.862 14.711 1.00 11.15 H new ATOM 0 HB2 GLN A 138 -6.293 22.108 17.169 1.00 74.21 H new ATOM 0 HB3 GLN A 138 -7.213 23.585 16.961 1.00 74.21 H new ATOM 0 HG2 GLN A 138 -8.606 22.299 15.220 1.00 70.45 H new ATOM 0 HG3 GLN A 138 -7.816 20.849 15.808 1.00 70.45 H new ATOM 0 HE21 GLN A 138 -8.023 20.312 18.130 1.00 11.22 H new ATOM 0 HE22 GLN A 138 -9.503 20.784 18.971 1.00 11.22 H new ATOM 2171 N LYS A 139 -4.016 24.358 14.931 1.00 71.22 N ATOM 2172 CA LYS A 139 -2.696 24.878 15.267 1.00 31.33 C ATOM 2173 C LYS A 139 -2.733 25.646 16.585 1.00 74.23 C ATOM 2174 O LYS A 139 -1.701 25.854 17.222 1.00 32.22 O ATOM 2175 CB LYS A 139 -2.183 25.788 14.149 1.00 72.53 C ATOM 2176 CG LYS A 139 -1.921 25.057 12.843 1.00 52.31 C ATOM 2177 CD LYS A 139 -0.752 24.094 12.967 1.00 13.43 C ATOM 2178 CE LYS A 139 -1.223 22.685 13.294 1.00 52.52 C ATOM 2179 NZ LYS A 139 -0.440 21.654 12.559 1.00 44.43 N ATOM 0 H LYS A 139 -4.392 24.703 14.048 1.00 71.22 H new ATOM 0 HA LYS A 139 -2.018 24.032 15.378 1.00 31.33 H new ATOM 0 HB2 LYS A 139 -2.911 26.580 13.973 1.00 72.53 H new ATOM 0 HB3 LYS A 139 -1.262 26.270 14.477 1.00 72.53 H new ATOM 0 HG2 LYS A 139 -2.815 24.509 12.546 1.00 52.31 H new ATOM 0 HG3 LYS A 139 -1.715 25.781 12.055 1.00 52.31 H new ATOM 0 HD2 LYS A 139 -0.188 24.083 12.034 1.00 13.43 H new ATOM 0 HD3 LYS A 139 -0.074 24.442 13.746 1.00 13.43 H new ATOM 0 HE2 LYS A 139 -1.134 22.512 14.367 1.00 52.52 H new ATOM 0 HE3 LYS A 139 -2.279 22.587 13.042 1.00 52.52 H new ATOM 0 HZ1 LYS A 139 -1.078 20.900 12.234 1.00 44.43 H new ATOM 0 HZ2 LYS A 139 0.026 22.091 11.738 1.00 44.43 H new ATOM 0 HZ3 LYS A 139 0.280 21.249 13.191 1.00 44.43 H new ATOM 2193 N SER A 140 -3.929 26.063 16.987 1.00 13.43 N ATOM 2194 CA SER A 140 -4.100 26.810 18.228 1.00 53.30 C ATOM 2195 C SER A 140 -5.559 26.795 18.675 1.00 51.04 C ATOM 2196 O SER A 140 -5.856 26.629 19.858 1.00 60.11 O ATOM 2197 CB SER A 140 -3.625 28.253 18.049 1.00 51.52 C ATOM 2198 OG SER A 140 -2.222 28.309 17.861 1.00 63.44 O ATOM 0 H SER A 140 -4.794 25.897 16.472 1.00 13.43 H new ATOM 0 HA SER A 140 -3.497 26.329 18.998 1.00 53.30 H new ATOM 0 HB2 SER A 140 -4.128 28.701 17.192 1.00 51.52 H new ATOM 0 HB3 SER A 140 -3.901 28.841 18.924 1.00 51.52 H new ATOM 0 HG SER A 140 -1.839 27.417 17.992 1.00 63.44 H new ATOM 2204 N TYR A 141 -6.465 26.970 17.719 1.00 33.43 N ATOM 2205 CA TYR A 141 -7.893 26.979 18.013 1.00 35.41 C ATOM 2206 C TYR A 141 -8.714 27.044 16.728 1.00 4.13 C ATOM 2207 O TYR A 141 -8.715 28.059 16.030 1.00 74.44 O ATOM 2208 CB TYR A 141 -8.243 28.164 18.915 1.00 25.30 C ATOM 2209 CG TYR A 141 -7.459 29.417 18.598 1.00 51.42 C ATOM 2210 CD1 TYR A 141 -7.893 30.303 17.619 1.00 71.31 C ATOM 2211 CD2 TYR A 141 -6.285 29.717 19.278 1.00 50.11 C ATOM 2212 CE1 TYR A 141 -7.180 31.449 17.325 1.00 30.24 C ATOM 2213 CE2 TYR A 141 -5.566 30.862 18.992 1.00 32.31 C ATOM 2214 CZ TYR A 141 -6.017 31.724 18.015 1.00 55.02 C ATOM 2215 OH TYR A 141 -5.305 32.865 17.726 1.00 0.43 O ATOM 0 H TYR A 141 -6.236 27.107 16.735 1.00 33.43 H new ATOM 0 HA TYR A 141 -8.136 26.052 18.532 1.00 35.41 H new ATOM 0 HB2 TYR A 141 -9.308 28.378 18.823 1.00 25.30 H new ATOM 0 HB3 TYR A 141 -8.063 27.885 19.953 1.00 25.30 H new ATOM 0 HD1 TYR A 141 -8.804 30.092 17.079 1.00 71.31 H new ATOM 0 HD2 TYR A 141 -5.928 29.044 20.043 1.00 50.11 H new ATOM 0 HE1 TYR A 141 -7.531 32.126 16.560 1.00 30.24 H new ATOM 0 HE2 TYR A 141 -4.656 31.080 19.531 1.00 32.31 H new ATOM 0 HH TYR A 141 -4.513 32.911 18.301 1.00 0.43 H new ATOM 2225 N LEU A 142 -9.410 25.955 16.423 1.00 13.00 N ATOM 2226 CA LEU A 142 -10.236 25.887 15.223 1.00 74.24 C ATOM 2227 C LEU A 142 -11.444 26.812 15.339 1.00 64.20 C ATOM 2228 O LEU A 142 -12.384 26.531 16.081 1.00 61.33 O ATOM 2229 CB LEU A 142 -10.702 24.450 14.981 1.00 30.21 C ATOM 2230 CG LEU A 142 -10.976 24.069 13.526 1.00 62.42 C ATOM 2231 CD1 LEU A 142 -9.670 23.858 12.775 1.00 74.24 C ATOM 2232 CD2 LEU A 142 -11.841 22.819 13.456 1.00 74.13 C ATOM 0 H LEU A 142 -9.419 25.107 16.990 1.00 13.00 H new ATOM 0 HA LEU A 142 -9.631 26.214 14.377 1.00 74.24 H new ATOM 0 HB2 LEU A 142 -9.945 23.772 15.377 1.00 30.21 H new ATOM 0 HB3 LEU A 142 -11.612 24.283 15.557 1.00 30.21 H new ATOM 0 HG LEU A 142 -11.517 24.888 13.051 1.00 62.42 H new ATOM 0 HD11 LEU A 142 -9.884 23.587 11.741 1.00 74.24 H new ATOM 0 HD12 LEU A 142 -9.086 24.778 12.796 1.00 74.24 H new ATOM 0 HD13 LEU A 142 -9.103 23.057 13.249 1.00 74.24 H new ATOM 0 HD21 LEU A 142 -12.026 22.562 12.413 1.00 74.13 H new ATOM 0 HD22 LEU A 142 -11.327 21.993 13.947 1.00 74.13 H new ATOM 0 HD23 LEU A 142 -12.791 23.005 13.958 1.00 74.13 H new ATOM 2244 N ASN A 143 -11.411 27.915 14.599 1.00 5.41 N ATOM 2245 CA ASN A 143 -12.503 28.881 14.618 1.00 0.40 C ATOM 2246 C ASN A 143 -13.854 28.174 14.638 1.00 35.25 C ATOM 2247 O ASN A 143 -14.780 28.601 15.328 1.00 50.44 O ATOM 2248 CB ASN A 143 -12.416 29.805 13.401 1.00 74.50 C ATOM 2249 CG ASN A 143 -13.713 30.548 13.146 1.00 12.30 C ATOM 2250 OD1 ASN A 143 -14.656 29.997 12.578 1.00 14.34 O ATOM 2251 ND2 ASN A 143 -13.765 31.807 13.566 1.00 53.14 N ATOM 0 H ASN A 143 -10.640 28.162 13.979 1.00 5.41 H new ATOM 0 HA ASN A 143 -12.411 29.477 15.526 1.00 0.40 H new ATOM 0 HB2 ASN A 143 -11.612 30.525 13.551 1.00 74.50 H new ATOM 0 HB3 ASN A 143 -12.158 29.218 12.520 1.00 74.50 H new ATOM 0 HD21 ASN A 143 -14.611 32.358 13.422 1.00 53.14 H new ATOM 0 HD22 ASN A 143 -12.959 32.223 14.032 1.00 53.14 H new ATOM 2258 N ALA A 144 -13.960 27.089 13.878 1.00 24.45 N ATOM 2259 CA ALA A 144 -15.196 26.320 13.811 1.00 33.02 C ATOM 2260 C ALA A 144 -15.842 26.197 15.187 1.00 24.23 C ATOM 2261 O ALA A 144 -16.654 27.035 15.579 1.00 33.21 O ATOM 2262 CB ALA A 144 -14.929 24.941 13.226 1.00 55.11 C ATOM 0 H ALA A 144 -13.204 26.723 13.300 1.00 24.45 H new ATOM 0 HA ALA A 144 -15.890 26.851 13.159 1.00 33.02 H new ATOM 0 HB1 ALA A 144 -15.861 24.378 13.182 1.00 55.11 H new ATOM 0 HB2 ALA A 144 -14.520 25.045 12.221 1.00 55.11 H new ATOM 0 HB3 ALA A 144 -14.214 24.411 13.855 1.00 55.11 H new ATOM 2268 N ILE A 145 -15.475 25.148 15.916 1.00 74.44 N ATOM 2269 CA ILE A 145 -16.019 24.916 17.248 1.00 20.01 C ATOM 2270 C ILE A 145 -15.595 26.018 18.214 1.00 75.43 C ATOM 2271 O ILE A 145 -16.299 26.316 19.179 1.00 74.43 O ATOM 2272 CB ILE A 145 -15.569 23.555 17.811 1.00 72.22 C ATOM 2273 CG1 ILE A 145 -14.060 23.377 17.630 1.00 74.24 C ATOM 2274 CG2 ILE A 145 -16.327 22.424 17.131 1.00 42.11 C ATOM 2275 CD1 ILE A 145 -13.694 22.452 16.490 1.00 45.30 C ATOM 0 H ILE A 145 -14.803 24.446 15.606 1.00 74.44 H new ATOM 0 HA ILE A 145 -17.105 24.919 17.150 1.00 20.01 H new ATOM 0 HB ILE A 145 -15.793 23.527 18.877 1.00 72.22 H new ATOM 0 HG12 ILE A 145 -13.605 24.352 17.456 1.00 74.24 H new ATOM 0 HG13 ILE A 145 -13.635 22.987 18.555 1.00 74.24 H new ATOM 0 HG21 ILE A 145 -15.998 21.468 17.539 1.00 42.11 H new ATOM 0 HG22 ILE A 145 -17.396 22.545 17.307 1.00 42.11 H new ATOM 0 HG23 ILE A 145 -16.131 22.447 16.059 1.00 42.11 H new ATOM 0 HD11 ILE A 145 -12.609 22.372 16.420 1.00 45.30 H new ATOM 0 HD12 ILE A 145 -14.119 21.465 16.671 1.00 45.30 H new ATOM 0 HD13 ILE A 145 -14.090 22.851 15.556 1.00 45.30 H new ATOM 2287 N ARG A 146 -14.442 26.620 17.946 1.00 44.31 N ATOM 2288 CA ARG A 146 -13.924 27.690 18.791 1.00 72.14 C ATOM 2289 C ARG A 146 -15.058 28.567 19.313 1.00 53.35 C ATOM 2290 O ARG A 146 -15.184 28.785 20.518 1.00 72.34 O ATOM 2291 CB ARG A 146 -12.921 28.544 18.012 1.00 35.33 C ATOM 2292 CG ARG A 146 -13.003 30.026 18.336 1.00 11.44 C ATOM 2293 CD ARG A 146 -11.673 30.723 18.097 1.00 24.13 C ATOM 2294 NE ARG A 146 -11.519 31.911 18.933 1.00 24.30 N ATOM 2295 CZ ARG A 146 -10.680 32.902 18.654 1.00 65.11 C ATOM 2296 NH1 ARG A 146 -9.923 32.848 17.566 1.00 12.23 N ATOM 2297 NH2 ARG A 146 -10.596 33.950 19.463 1.00 12.04 N ATOM 0 H ARG A 146 -13.848 26.386 17.151 1.00 44.31 H new ATOM 0 HA ARG A 146 -13.418 27.234 19.642 1.00 72.14 H new ATOM 0 HB2 ARG A 146 -11.912 28.189 18.225 1.00 35.33 H new ATOM 0 HB3 ARG A 146 -13.090 28.404 16.944 1.00 35.33 H new ATOM 0 HG2 ARG A 146 -13.774 30.492 17.722 1.00 11.44 H new ATOM 0 HG3 ARG A 146 -13.301 30.156 19.376 1.00 11.44 H new ATOM 0 HD2 ARG A 146 -10.858 30.028 18.301 1.00 24.13 H new ATOM 0 HD3 ARG A 146 -11.596 31.006 17.047 1.00 24.13 H new ATOM 0 HE ARG A 146 -12.087 31.983 19.777 1.00 24.30 H new ATOM 0 HH11 ARG A 146 -9.984 32.044 16.941 1.00 12.23 H new ATOM 0 HH12 ARG A 146 -9.279 33.610 17.354 1.00 12.23 H new ATOM 0 HH21 ARG A 146 -11.176 33.995 20.301 1.00 12.04 H new ATOM 0 HH22 ARG A 146 -9.951 34.710 19.247 1.00 12.04 H new ATOM 2311 N SER A 147 -15.881 29.069 18.397 1.00 61.02 N ATOM 2312 CA SER A 147 -17.002 29.926 18.764 1.00 40.20 C ATOM 2313 C SER A 147 -17.842 29.281 19.862 1.00 11.41 C ATOM 2314 O SER A 147 -18.635 28.376 19.603 1.00 73.00 O ATOM 2315 CB SER A 147 -17.874 30.213 17.540 1.00 35.43 C ATOM 2316 OG SER A 147 -18.690 31.352 17.751 1.00 12.10 O ATOM 0 H SER A 147 -15.792 28.897 17.396 1.00 61.02 H new ATOM 0 HA SER A 147 -16.600 30.866 19.143 1.00 40.20 H new ATOM 0 HB2 SER A 147 -17.240 30.372 16.667 1.00 35.43 H new ATOM 0 HB3 SER A 147 -18.501 29.348 17.325 1.00 35.43 H new ATOM 0 HG SER A 147 -19.236 31.515 16.954 1.00 12.10 H new ATOM 2322 N LYS A 148 -17.662 29.754 21.091 1.00 52.44 N ATOM 2323 CA LYS A 148 -18.403 29.227 22.230 1.00 31.23 C ATOM 2324 C LYS A 148 -19.892 29.132 21.914 1.00 33.23 C ATOM 2325 O LYS A 148 -20.595 28.270 22.444 1.00 50.10 O ATOM 2326 CB LYS A 148 -18.187 30.113 23.459 1.00 31.54 C ATOM 2327 CG LYS A 148 -16.723 30.346 23.791 1.00 14.40 C ATOM 2328 CD LYS A 148 -16.558 31.006 25.150 1.00 50.33 C ATOM 2329 CE LYS A 148 -17.203 32.383 25.183 1.00 55.21 C ATOM 2330 NZ LYS A 148 -16.593 33.306 24.186 1.00 10.13 N ATOM 0 H LYS A 148 -17.009 30.502 21.323 1.00 52.44 H new ATOM 0 HA LYS A 148 -18.030 28.225 22.442 1.00 31.23 H new ATOM 0 HB2 LYS A 148 -18.671 31.075 23.292 1.00 31.54 H new ATOM 0 HB3 LYS A 148 -18.677 29.654 24.318 1.00 31.54 H new ATOM 0 HG2 LYS A 148 -16.191 29.395 23.780 1.00 14.40 H new ATOM 0 HG3 LYS A 148 -16.270 30.973 23.023 1.00 14.40 H new ATOM 0 HD2 LYS A 148 -17.005 30.375 25.919 1.00 50.33 H new ATOM 0 HD3 LYS A 148 -15.498 31.094 25.387 1.00 50.33 H new ATOM 0 HE2 LYS A 148 -18.271 32.289 24.985 1.00 55.21 H new ATOM 0 HE3 LYS A 148 -17.101 32.808 26.181 1.00 55.21 H new ATOM 0 HZ1 LYS A 148 -16.884 34.283 24.394 1.00 10.13 H new ATOM 0 HZ2 LYS A 148 -15.557 33.235 24.236 1.00 10.13 H new ATOM 0 HZ3 LYS A 148 -16.912 33.046 23.231 1.00 10.13 H new ATOM 2344 N CYS A 149 -20.366 30.021 21.048 1.00 34.44 N ATOM 2345 CA CYS A 149 -21.773 30.036 20.661 1.00 3.15 C ATOM 2346 C CYS A 149 -22.230 28.651 20.217 1.00 65.45 C ATOM 2347 O CYS A 149 -23.393 28.285 20.386 1.00 23.33 O ATOM 2348 CB CYS A 149 -22.003 31.048 19.538 1.00 63.43 C ATOM 2349 SG CYS A 149 -22.479 32.694 20.113 1.00 50.32 S ATOM 0 H CYS A 149 -19.798 30.740 20.601 1.00 34.44 H new ATOM 0 HA CYS A 149 -22.361 30.330 21.531 1.00 3.15 H new ATOM 0 HB2 CYS A 149 -21.091 31.131 18.946 1.00 63.43 H new ATOM 0 HB3 CYS A 149 -22.780 30.668 18.875 1.00 63.43 H new ATOM 0 HG CYS A 149 -22.648 33.479 19.090 1.00 50.32 H new ATOM 2355 N PHE A 150 -21.307 27.884 19.645 1.00 44.44 N ATOM 2356 CA PHE A 150 -21.615 26.540 19.172 1.00 20.32 C ATOM 2357 C PHE A 150 -22.195 25.688 20.298 1.00 65.55 C ATOM 2358 O PHE A 150 -23.411 25.607 20.466 1.00 21.01 O ATOM 2359 CB PHE A 150 -20.358 25.874 18.608 1.00 32.43 C ATOM 2360 CG PHE A 150 -20.069 26.249 17.183 1.00 4.42 C ATOM 2361 CD1 PHE A 150 -20.380 27.514 16.709 1.00 21.34 C ATOM 2362 CD2 PHE A 150 -19.485 25.339 16.318 1.00 63.34 C ATOM 2363 CE1 PHE A 150 -20.115 27.862 15.398 1.00 32.33 C ATOM 2364 CE2 PHE A 150 -19.217 25.681 15.005 1.00 12.25 C ATOM 2365 CZ PHE A 150 -19.532 26.945 14.546 1.00 70.23 C ATOM 0 H PHE A 150 -20.339 28.171 19.498 1.00 44.44 H new ATOM 0 HA PHE A 150 -22.360 26.621 18.380 1.00 20.32 H new ATOM 0 HB2 PHE A 150 -19.503 26.146 19.227 1.00 32.43 H new ATOM 0 HB3 PHE A 150 -20.469 24.792 18.675 1.00 32.43 H new ATOM 0 HD1 PHE A 150 -20.834 28.236 17.372 1.00 21.34 H new ATOM 0 HD2 PHE A 150 -19.236 24.350 16.673 1.00 63.34 H new ATOM 0 HE1 PHE A 150 -20.364 28.850 15.040 1.00 32.33 H new ATOM 0 HE2 PHE A 150 -18.762 24.961 14.340 1.00 12.25 H new ATOM 0 HZ PHE A 150 -19.323 27.216 13.522 1.00 70.23 H new ATOM 2375 N ALA A 151 -21.314 25.053 21.064 1.00 31.35 N ATOM 2376 CA ALA A 151 -21.737 24.208 22.174 1.00 31.24 C ATOM 2377 C ALA A 151 -22.762 24.922 23.049 1.00 52.24 C ATOM 2378 O ALA A 151 -23.761 24.332 23.458 1.00 73.10 O ATOM 2379 CB ALA A 151 -20.534 23.787 23.005 1.00 31.42 C ATOM 0 H ALA A 151 -20.303 25.108 20.936 1.00 31.35 H new ATOM 0 HA ALA A 151 -22.209 23.317 21.760 1.00 31.24 H new ATOM 0 HB1 ALA A 151 -20.865 23.156 23.830 1.00 31.42 H new ATOM 0 HB2 ALA A 151 -19.837 23.230 22.379 1.00 31.42 H new ATOM 0 HB3 ALA A 151 -20.038 24.673 23.401 1.00 31.42 H new ATOM 2385 N MET A 152 -22.507 26.196 23.331 1.00 31.52 N ATOM 2386 CA MET A 152 -23.409 26.990 24.157 1.00 51.10 C ATOM 2387 C MET A 152 -24.832 26.944 23.608 1.00 25.52 C ATOM 2388 O MET A 152 -25.780 26.661 24.340 1.00 33.11 O ATOM 2389 CB MET A 152 -22.925 28.440 24.229 1.00 20.43 C ATOM 2390 CG MET A 152 -21.705 28.629 25.117 1.00 55.54 C ATOM 2391 SD MET A 152 -21.197 30.355 25.239 1.00 52.14 S ATOM 2392 CE MET A 152 -21.419 30.650 26.991 1.00 1.33 C ATOM 0 H MET A 152 -21.684 26.700 23.000 1.00 31.52 H new ATOM 0 HA MET A 152 -23.412 26.564 25.160 1.00 51.10 H new ATOM 0 HB2 MET A 152 -22.689 28.786 23.223 1.00 20.43 H new ATOM 0 HB3 MET A 152 -23.735 29.067 24.600 1.00 20.43 H new ATOM 0 HG2 MET A 152 -21.923 28.247 26.114 1.00 55.54 H new ATOM 0 HG3 MET A 152 -20.878 28.038 24.723 1.00 55.54 H new ATOM 0 HE1 MET A 152 -21.145 31.679 27.224 1.00 1.33 H new ATOM 0 HE2 MET A 152 -22.462 30.483 27.259 1.00 1.33 H new ATOM 0 HE3 MET A 152 -20.785 29.968 27.558 1.00 1.33 H new ATOM 2402 N ASP A 153 -24.972 27.223 22.317 1.00 31.41 N ATOM 2403 CA ASP A 153 -26.279 27.212 21.670 1.00 31.23 C ATOM 2404 C ASP A 153 -26.886 25.812 21.694 1.00 3.35 C ATOM 2405 O ASP A 153 -27.894 25.573 22.360 1.00 73.43 O ATOM 2406 CB ASP A 153 -26.162 27.706 20.227 1.00 20.55 C ATOM 2407 CG ASP A 153 -27.515 27.946 19.586 1.00 25.03 C ATOM 2408 OD1 ASP A 153 -28.537 27.812 20.291 1.00 43.33 O ATOM 2409 OD2 ASP A 153 -27.551 28.267 18.380 1.00 61.13 O ATOM 0 H ASP A 153 -24.197 27.460 21.698 1.00 31.41 H new ATOM 0 HA ASP A 153 -26.936 27.883 22.223 1.00 31.23 H new ATOM 0 HB2 ASP A 153 -25.585 28.631 20.208 1.00 20.55 H new ATOM 0 HB3 ASP A 153 -25.609 26.973 19.639 1.00 20.55 H new ATOM 2414 N LEU A 154 -26.266 24.892 20.964 1.00 23.24 N ATOM 2415 CA LEU A 154 -26.745 23.515 20.901 1.00 41.32 C ATOM 2416 C LEU A 154 -26.995 22.961 22.300 1.00 74.25 C ATOM 2417 O LEU A 154 -27.892 22.143 22.501 1.00 31.32 O ATOM 2418 CB LEU A 154 -25.733 22.636 20.165 1.00 63.31 C ATOM 2419 CG LEU A 154 -24.281 22.749 20.631 1.00 42.21 C ATOM 2420 CD1 LEU A 154 -23.879 21.519 21.429 1.00 24.11 C ATOM 2421 CD2 LEU A 154 -23.352 22.942 19.441 1.00 53.12 C ATOM 0 H LEU A 154 -25.431 25.074 20.407 1.00 23.24 H new ATOM 0 HA LEU A 154 -27.688 23.509 20.354 1.00 41.32 H new ATOM 0 HB2 LEU A 154 -26.045 21.596 20.264 1.00 63.31 H new ATOM 0 HB3 LEU A 154 -25.773 22.881 19.104 1.00 63.31 H new ATOM 0 HG LEU A 154 -24.195 23.621 21.279 1.00 42.21 H new ATOM 0 HD11 LEU A 154 -22.843 21.618 21.752 1.00 24.11 H new ATOM 0 HD12 LEU A 154 -24.524 21.425 22.303 1.00 24.11 H new ATOM 0 HD13 LEU A 154 -23.982 20.631 20.805 1.00 24.11 H new ATOM 0 HD21 LEU A 154 -22.323 23.020 19.792 1.00 53.12 H new ATOM 0 HD22 LEU A 154 -23.442 22.090 18.767 1.00 53.12 H new ATOM 0 HD23 LEU A 154 -23.625 23.854 18.910 1.00 53.12 H new ATOM 2433 N GLU A 155 -26.198 23.414 23.262 1.00 51.01 N ATOM 2434 CA GLU A 155 -26.335 22.964 24.642 1.00 73.40 C ATOM 2435 C GLU A 155 -27.791 23.035 25.095 1.00 24.44 C ATOM 2436 O GLU A 155 -28.298 24.107 25.425 1.00 33.02 O ATOM 2437 CB GLU A 155 -25.459 23.810 25.568 1.00 54.43 C ATOM 2438 CG GLU A 155 -24.163 23.128 25.972 1.00 72.05 C ATOM 2439 CD GLU A 155 -24.045 22.941 27.472 1.00 41.53 C ATOM 2440 OE1 GLU A 155 -24.200 23.938 28.208 1.00 23.11 O ATOM 2441 OE2 GLU A 155 -23.798 21.798 27.909 1.00 4.01 O ATOM 0 H GLU A 155 -25.451 24.092 23.111 1.00 51.01 H new ATOM 0 HA GLU A 155 -26.007 21.926 24.693 1.00 73.40 H new ATOM 0 HB2 GLU A 155 -25.225 24.752 25.072 1.00 54.43 H new ATOM 0 HB3 GLU A 155 -26.026 24.055 26.466 1.00 54.43 H new ATOM 0 HG2 GLU A 155 -24.100 22.156 25.482 1.00 72.05 H new ATOM 0 HG3 GLU A 155 -23.319 23.719 25.616 1.00 72.05 H new ATOM 2448 N HIS A 156 -28.457 21.884 25.109 1.00 50.55 N ATOM 2449 CA HIS A 156 -29.854 21.815 25.521 1.00 13.22 C ATOM 2450 C HIS A 156 -30.008 22.212 26.986 1.00 14.42 C ATOM 2451 O HIS A 156 -31.026 22.783 27.382 1.00 64.12 O ATOM 2452 CB HIS A 156 -30.403 20.405 25.303 1.00 53.04 C ATOM 2453 CG HIS A 156 -31.872 20.373 25.011 1.00 70.40 C ATOM 2454 ND1 HIS A 156 -32.830 20.744 25.930 1.00 32.04 N ATOM 2455 CD2 HIS A 156 -32.545 20.012 23.893 1.00 21.44 C ATOM 2456 CE1 HIS A 156 -34.029 20.611 25.392 1.00 51.14 C ATOM 2457 NE2 HIS A 156 -33.884 20.169 24.156 1.00 63.54 N ATOM 0 H HIS A 156 -28.052 20.988 24.840 1.00 50.55 H new ATOM 0 HA HIS A 156 -30.422 22.517 24.910 1.00 13.22 H new ATOM 0 HB2 HIS A 156 -29.866 19.939 24.477 1.00 53.04 H new ATOM 0 HB3 HIS A 156 -30.204 19.805 26.191 1.00 53.04 H new ATOM 0 HD2 HIS A 156 -32.110 19.665 22.967 1.00 21.44 H new ATOM 0 HE1 HIS A 156 -34.968 20.827 25.880 1.00 51.14 H new ATOM 0 HE2 HIS A 156 -34.643 19.976 23.503 1.00 63.54 H new ATOM 2465 N HIS A 157 -28.993 21.907 27.787 1.00 23.54 N ATOM 2466 CA HIS A 157 -29.016 22.232 29.209 1.00 23.41 C ATOM 2467 C HIS A 157 -29.350 23.705 29.424 1.00 25.22 C ATOM 2468 O HIS A 157 -28.894 24.571 28.677 1.00 62.23 O ATOM 2469 CB HIS A 157 -27.667 21.903 29.851 1.00 54.22 C ATOM 2470 CG HIS A 157 -27.595 20.519 30.417 1.00 30.34 C ATOM 2471 ND1 HIS A 157 -28.265 20.137 31.560 1.00 14.34 N ATOM 2472 CD2 HIS A 157 -26.927 19.421 29.991 1.00 54.33 C ATOM 2473 CE1 HIS A 157 -28.012 18.866 31.813 1.00 21.33 C ATOM 2474 NE2 HIS A 157 -27.203 18.408 30.875 1.00 23.42 N ATOM 0 H HIS A 157 -28.144 21.435 27.476 1.00 23.54 H new ATOM 0 HA HIS A 157 -29.791 21.629 29.682 1.00 23.41 H new ATOM 0 HB2 HIS A 157 -26.880 22.023 29.106 1.00 54.22 H new ATOM 0 HB3 HIS A 157 -27.467 22.622 30.645 1.00 54.22 H new ATOM 0 HD2 HIS A 157 -26.295 19.355 29.118 1.00 54.33 H new ATOM 0 HE1 HIS A 157 -28.400 18.298 32.645 1.00 21.33 H new ATOM 0 HE2 HIS A 157 -26.842 17.456 30.817 1.00 23.42 H new ATOM 2482 N HIS A 158 -30.148 23.982 30.450 1.00 33.00 N ATOM 2483 CA HIS A 158 -30.543 25.351 30.763 1.00 33.32 C ATOM 2484 C HIS A 158 -29.441 26.072 31.533 1.00 64.15 C ATOM 2485 O HIS A 158 -28.623 25.441 32.204 1.00 51.14 O ATOM 2486 CB HIS A 158 -31.837 25.357 31.578 1.00 72.23 C ATOM 2487 CG HIS A 158 -31.657 24.896 32.991 1.00 12.14 C ATOM 2488 ND1 HIS A 158 -32.038 25.649 34.082 1.00 22.45 N ATOM 2489 CD2 HIS A 158 -31.135 23.751 33.490 1.00 71.03 C ATOM 2490 CE1 HIS A 158 -31.756 24.987 35.191 1.00 41.13 C ATOM 2491 NE2 HIS A 158 -31.208 23.832 34.859 1.00 43.24 N ATOM 0 H HIS A 158 -30.534 23.277 31.079 1.00 33.00 H new ATOM 0 HA HIS A 158 -30.711 25.878 29.824 1.00 33.32 H new ATOM 0 HB2 HIS A 158 -32.249 26.366 31.583 1.00 72.23 H new ATOM 0 HB3 HIS A 158 -32.569 24.717 31.086 1.00 72.23 H new ATOM 0 HD2 HIS A 158 -30.735 22.927 32.918 1.00 71.03 H new ATOM 0 HE1 HIS A 158 -31.942 25.332 36.197 1.00 41.13 H new ATOM 0 HE2 HIS A 158 -30.891 23.117 35.513 1.00 43.24 H new ATOM 2499 N HIS A 159 -29.423 27.397 31.430 1.00 54.10 N ATOM 2500 CA HIS A 159 -28.421 28.204 32.116 1.00 3.11 C ATOM 2501 C HIS A 159 -29.052 29.006 33.250 1.00 50.41 C ATOM 2502 O HIS A 159 -30.272 29.008 33.419 1.00 41.23 O ATOM 2503 CB HIS A 159 -27.733 29.148 31.129 1.00 23.14 C ATOM 2504 CG HIS A 159 -26.277 29.356 31.415 1.00 32.21 C ATOM 2505 ND1 HIS A 159 -25.332 28.362 31.271 1.00 35.31 N ATOM 2506 CD2 HIS A 159 -25.606 30.453 31.837 1.00 23.31 C ATOM 2507 CE1 HIS A 159 -24.143 28.838 31.594 1.00 71.41 C ATOM 2508 NE2 HIS A 159 -24.281 30.105 31.941 1.00 74.45 N ATOM 0 H HIS A 159 -30.091 27.935 30.878 1.00 54.10 H new ATOM 0 HA HIS A 159 -27.677 27.530 32.542 1.00 3.11 H new ATOM 0 HB2 HIS A 159 -27.843 28.749 30.121 1.00 23.14 H new ATOM 0 HB3 HIS A 159 -28.240 30.113 31.148 1.00 23.14 H new ATOM 0 HD2 HIS A 159 -26.033 31.422 32.052 1.00 23.31 H new ATOM 0 HE1 HIS A 159 -23.215 28.285 31.577 1.00 71.41 H new ATOM 0 HE2 HIS A 159 -23.527 30.724 32.238 1.00 74.45 H new ATOM 2516 N HIS A 160 -28.214 29.687 34.025 1.00 24.23 N ATOM 2517 CA HIS A 160 -28.690 30.493 35.144 1.00 41.15 C ATOM 2518 C HIS A 160 -29.780 31.460 34.691 1.00 42.03 C ATOM 2519 O HIS A 160 -30.021 31.624 33.494 1.00 4.12 O ATOM 2520 CB HIS A 160 -27.531 31.269 35.770 1.00 52.40 C ATOM 2521 CG HIS A 160 -27.737 31.587 37.219 1.00 53.50 C ATOM 2522 ND1 HIS A 160 -28.070 30.635 38.159 1.00 64.33 N ATOM 2523 CD2 HIS A 160 -27.655 32.761 37.888 1.00 3.12 C ATOM 2524 CE1 HIS A 160 -28.184 31.209 39.343 1.00 73.30 C ATOM 2525 NE2 HIS A 160 -27.937 32.499 39.206 1.00 20.03 N ATOM 0 H HIS A 160 -27.202 29.697 33.899 1.00 24.23 H new ATOM 0 HA HIS A 160 -29.112 29.821 35.891 1.00 41.15 H new ATOM 0 HB2 HIS A 160 -26.615 30.689 35.660 1.00 52.40 H new ATOM 0 HB3 HIS A 160 -27.387 32.199 35.219 1.00 52.40 H new ATOM 0 HD2 HIS A 160 -27.413 33.724 37.464 1.00 3.12 H new ATOM 0 HE1 HIS A 160 -28.436 30.709 40.266 1.00 73.30 H new ATOM 0 HE2 HIS A 160 -27.953 33.189 39.957 1.00 20.03 H new ATOM 2533 N HIS A 161 -30.436 32.098 35.655 1.00 75.42 N ATOM 2534 CA HIS A 161 -31.501 33.048 35.355 1.00 52.31 C ATOM 2535 C HIS A 161 -31.015 34.120 34.384 1.00 71.13 C ATOM 2536 O HIS A 161 -29.909 34.630 34.555 1.00 13.52 O ATOM 2537 CB HIS A 161 -32.008 33.701 36.641 1.00 1.32 C ATOM 2538 CG HIS A 161 -33.201 34.583 36.435 1.00 3.55 C ATOM 2539 ND1 HIS A 161 -33.394 35.760 37.127 1.00 15.42 N ATOM 2540 CD2 HIS A 161 -34.264 34.456 35.608 1.00 32.40 C ATOM 2541 CE1 HIS A 161 -34.526 36.318 36.735 1.00 35.55 C ATOM 2542 NE2 HIS A 161 -35.073 35.546 35.814 1.00 75.23 N ATOM 0 H HIS A 161 -30.249 31.974 36.650 1.00 75.42 H new ATOM 0 HA HIS A 161 -32.320 32.502 34.886 1.00 52.31 H new ATOM 0 HB2 HIS A 161 -32.263 32.921 37.359 1.00 1.32 H new ATOM 0 HB3 HIS A 161 -31.203 34.289 37.082 1.00 1.32 H new ATOM 0 HD2 HIS A 161 -34.443 33.648 34.915 1.00 32.40 H new ATOM 0 HE1 HIS A 161 -34.934 37.247 37.105 1.00 35.55 H new ATOM 0 HE2 HIS A 161 -35.954 35.730 35.333 1.00 75.23 H new TER 2550 HIS A 161 ATOM 2551 N ASP B1001 -19.332 -6.517 22.511 1.00 12.43 N ATOM 2552 CA ASP B1001 -18.647 -6.624 21.229 1.00 63.44 C ATOM 2553 C ASP B1001 -17.151 -6.369 21.388 1.00 14.54 C ATOM 2554 O ASP B1001 -16.739 -5.495 22.152 1.00 71.11 O ATOM 2555 CB ASP B1001 -19.241 -5.636 20.224 1.00 73.32 C ATOM 2556 CG ASP B1001 -19.829 -6.328 19.010 1.00 75.40 C ATOM 2557 OD1 ASP B1001 -19.300 -7.390 18.617 1.00 14.42 O ATOM 2558 OD2 ASP B1001 -20.819 -5.810 18.453 1.00 13.53 O ATOM 0 HA ASP B1001 -18.787 -7.638 20.855 1.00 63.44 H new ATOM 0 HB2 ASP B1001 -20.016 -5.046 20.713 1.00 73.32 H new ATOM 0 HB3 ASP B1001 -18.466 -4.940 19.902 1.00 73.32 H new ATOM 2563 N ASP B1002 -16.344 -7.136 20.664 1.00 35.34 N ATOM 2564 CA ASP B1002 -14.894 -6.993 20.726 1.00 75.03 C ATOM 2565 C ASP B1002 -14.375 -6.208 19.526 1.00 41.35 C ATOM 2566 O ASP B1002 -13.239 -6.399 19.090 1.00 34.41 O ATOM 2567 CB ASP B1002 -14.227 -8.368 20.779 1.00 4.11 C ATOM 2568 CG ASP B1002 -14.264 -8.976 22.167 1.00 31.23 C ATOM 2569 OD1 ASP B1002 -13.625 -8.412 23.080 1.00 0.02 O ATOM 2570 OD2 ASP B1002 -14.933 -10.016 22.341 1.00 12.11 O ATOM 0 H ASP B1002 -16.669 -7.863 20.027 1.00 35.34 H new ATOM 0 HA ASP B1002 -14.645 -6.442 21.633 1.00 75.03 H new ATOM 0 HB2 ASP B1002 -14.726 -9.038 20.079 1.00 4.11 H new ATOM 0 HB3 ASP B1002 -13.191 -8.279 20.452 1.00 4.11 H new ATOM 2575 N ASP B1003 -15.213 -5.324 18.995 1.00 34.50 N ATOM 2576 CA ASP B1003 -14.839 -4.510 17.845 1.00 51.21 C ATOM 2577 C ASP B1003 -14.429 -3.107 18.283 1.00 71.22 C ATOM 2578 O ASP B1003 -14.608 -2.140 17.544 1.00 1.51 O ATOM 2579 CB ASP B1003 -15.999 -4.429 16.851 1.00 0.32 C ATOM 2580 CG ASP B1003 -16.150 -5.696 16.033 1.00 31.00 C ATOM 2581 OD1 ASP B1003 -16.119 -6.794 16.628 1.00 54.11 O ATOM 2582 OD2 ASP B1003 -16.300 -5.590 14.798 1.00 31.00 O ATOM 0 H ASP B1003 -16.156 -5.153 19.343 1.00 34.50 H new ATOM 0 HA ASP B1003 -13.986 -4.983 17.358 1.00 51.21 H new ATOM 0 HB2 ASP B1003 -16.925 -4.237 17.393 1.00 0.32 H new ATOM 0 HB3 ASP B1003 -15.841 -3.584 16.181 1.00 0.32 H new ATOM 2587 N GLU B1004 -13.880 -3.006 19.489 1.00 24.21 N ATOM 2588 CA GLU B1004 -13.446 -1.721 20.025 1.00 34.22 C ATOM 2589 C GLU B1004 -14.645 -0.829 20.334 1.00 50.52 C ATOM 2590 O GLU B1004 -15.018 -0.650 21.494 1.00 65.43 O ATOM 2591 CB GLU B1004 -12.515 -1.019 19.036 1.00 43.54 C ATOM 2592 CG GLU B1004 -11.096 -0.847 19.552 1.00 11.32 C ATOM 2593 CD GLU B1004 -10.051 -1.293 18.548 1.00 54.53 C ATOM 2594 OE1 GLU B1004 -10.007 -2.501 18.236 1.00 61.11 O ATOM 2595 OE2 GLU B1004 -9.279 -0.434 18.074 1.00 44.12 O ATOM 0 H GLU B1004 -13.725 -3.798 20.113 1.00 24.21 H new ATOM 0 HA GLU B1004 -12.904 -1.907 20.952 1.00 34.22 H new ATOM 0 HB2 GLU B1004 -12.488 -1.590 18.108 1.00 43.54 H new ATOM 0 HB3 GLU B1004 -12.927 -0.039 18.796 1.00 43.54 H new ATOM 0 HG2 GLU B1004 -10.929 0.201 19.803 1.00 11.32 H new ATOM 0 HG3 GLU B1004 -10.977 -1.418 20.473 1.00 11.32 H new ATOM 2602 N ASP B1005 -15.244 -0.270 19.288 1.00 42.11 N ATOM 2603 CA ASP B1005 -16.400 0.604 19.446 1.00 54.13 C ATOM 2604 C ASP B1005 -16.092 1.744 20.411 1.00 13.23 C ATOM 2605 O ASP B1005 -16.528 1.732 21.562 1.00 61.23 O ATOM 2606 CB ASP B1005 -17.605 -0.194 19.947 1.00 21.13 C ATOM 2607 CG ASP B1005 -18.162 -1.126 18.890 1.00 75.51 C ATOM 2608 OD1 ASP B1005 -17.537 -1.247 17.816 1.00 2.21 O ATOM 2609 OD2 ASP B1005 -19.225 -1.735 19.136 1.00 70.31 O ATOM 0 H ASP B1005 -14.948 -0.407 18.322 1.00 42.11 H new ATOM 0 HA ASP B1005 -16.637 1.031 18.472 1.00 54.13 H new ATOM 0 HB2 ASP B1005 -17.314 -0.775 20.822 1.00 21.13 H new ATOM 0 HB3 ASP B1005 -18.386 0.496 20.267 1.00 21.13 H new ATOM 2614 N GLY B1006 -15.337 2.729 19.935 1.00 42.15 N ATOM 2615 CA GLY B1006 -14.982 3.862 20.769 1.00 51.42 C ATOM 2616 C GLY B1006 -13.534 3.823 21.215 1.00 30.13 C ATOM 2617 O GLY B1006 -13.206 3.203 22.227 1.00 62.51 O ATOM 0 H GLY B1006 -14.965 2.763 18.986 1.00 42.15 H new ATOM 0 HA2 GLY B1006 -15.165 4.785 20.219 1.00 51.42 H new ATOM 0 HA3 GLY B1006 -15.629 3.880 21.646 1.00 51.42 H new ATOM 2621 N TYR B1007 -12.665 4.485 20.459 1.00 34.12 N ATOM 2622 CA TYR B1007 -11.244 4.520 20.780 1.00 25.53 C ATOM 2623 C TYR B1007 -10.774 5.951 21.019 1.00 44.21 C ATOM 2624 O TYR B1007 -11.286 6.893 20.416 1.00 40.03 O ATOM 2625 CB TYR B1007 -10.429 3.885 19.652 1.00 62.10 C ATOM 2626 CG TYR B1007 -9.970 4.875 18.605 1.00 12.14 C ATOM 2627 CD1 TYR B1007 -10.888 5.561 17.820 1.00 51.11 C ATOM 2628 CD2 TYR B1007 -8.618 5.125 18.403 1.00 54.32 C ATOM 2629 CE1 TYR B1007 -10.473 6.466 16.862 1.00 34.10 C ATOM 2630 CE2 TYR B1007 -8.195 6.030 17.448 1.00 24.43 C ATOM 2631 CZ TYR B1007 -9.126 6.697 16.680 1.00 22.11 C ATOM 2632 OH TYR B1007 -8.709 7.599 15.728 1.00 23.40 O ATOM 0 H TYR B1007 -12.920 5.005 19.619 1.00 34.12 H new ATOM 0 HA TYR B1007 -11.091 3.949 21.696 1.00 25.53 H new ATOM 0 HB2 TYR B1007 -9.557 3.390 20.079 1.00 62.10 H new ATOM 0 HB3 TYR B1007 -11.030 3.113 19.171 1.00 62.10 H new ATOM 0 HD1 TYR B1007 -11.944 5.384 17.961 1.00 51.11 H new ATOM 0 HD2 TYR B1007 -7.886 4.604 19.002 1.00 54.32 H new ATOM 0 HE1 TYR B1007 -11.200 6.990 16.259 1.00 34.10 H new ATOM 0 HE2 TYR B1007 -7.141 6.214 17.304 1.00 24.43 H new ATOM 0 HH TYR B1007 -8.802 8.510 16.077 1.00 23.40 H new ATOM 2642 N ASN B1008 -9.794 6.106 21.904 1.00 61.23 N ATOM 2643 CA ASN B1008 -9.253 7.422 22.223 1.00 13.03 C ATOM 2644 C ASN B1008 -8.219 7.852 21.187 1.00 31.42 C ATOM 2645 O ASN B1008 -7.372 7.068 20.757 1.00 10.34 O ATOM 2646 CB ASN B1008 -8.622 7.412 23.617 1.00 40.41 C ATOM 2647 CG ASN B1008 -8.730 8.757 24.310 1.00 34.21 C ATOM 2648 OD1 ASN B1008 -7.922 9.655 24.076 1.00 52.52 O ATOM 2649 ND2 ASN B1008 -9.733 8.900 25.169 1.00 3.23 N ATOM 0 H ASN B1008 -9.359 5.336 22.413 1.00 61.23 H new ATOM 0 HA ASN B1008 -10.074 8.138 22.208 1.00 13.03 H new ATOM 0 HB2 ASN B1008 -9.109 6.652 24.228 1.00 40.41 H new ATOM 0 HB3 ASN B1008 -7.572 7.132 23.536 1.00 40.41 H new ATOM 0 HD21 ASN B1008 -9.857 9.782 25.666 1.00 3.23 H new ATOM 0 HD22 ASN B1008 -10.379 8.128 25.332 1.00 3.23 H new ATOM 2656 N PRO B1009 -8.288 9.126 20.776 1.00 43.41 N ATOM 2657 CA PRO B1009 -7.364 9.690 19.786 1.00 35.24 C ATOM 2658 C PRO B1009 -5.949 9.840 20.334 1.00 71.13 C ATOM 2659 O PRO B1009 -4.980 9.875 19.575 1.00 52.23 O ATOM 2660 CB PRO B1009 -7.968 11.063 19.480 1.00 63.11 C ATOM 2661 CG PRO B1009 -8.747 11.415 20.700 1.00 44.31 C ATOM 2662 CD PRO B1009 -9.272 10.116 21.246 1.00 44.23 C ATOM 0 HA PRO B1009 -7.263 9.049 18.910 1.00 35.24 H new ATOM 0 HB2 PRO B1009 -7.192 11.801 19.280 1.00 63.11 H new ATOM 0 HB3 PRO B1009 -8.608 11.026 18.599 1.00 63.11 H new ATOM 0 HG2 PRO B1009 -8.117 11.920 21.433 1.00 44.31 H new ATOM 0 HG3 PRO B1009 -9.564 12.095 20.459 1.00 44.31 H new ATOM 0 HD2 PRO B1009 -9.336 10.134 22.334 1.00 44.23 H new ATOM 0 HD3 PRO B1009 -10.272 9.898 20.872 1.00 44.23 H new ATOM 2670 N TYR B1010 -5.837 9.927 21.654 1.00 2.33 N ATOM 2671 CA TYR B1010 -4.539 10.076 22.303 1.00 73.42 C ATOM 2672 C TYR B1010 -3.610 8.924 21.932 1.00 33.53 C ATOM 2673 O TYR B1010 -2.390 9.025 22.067 1.00 53.13 O ATOM 2674 CB TYR B1010 -4.709 10.140 23.822 1.00 52.24 C ATOM 2675 CG TYR B1010 -4.552 11.533 24.390 1.00 75.42 C ATOM 2676 CD1 TYR B1010 -3.426 12.296 24.109 1.00 12.22 C ATOM 2677 CD2 TYR B1010 -5.532 12.085 25.207 1.00 65.14 C ATOM 2678 CE1 TYR B1010 -3.279 13.568 24.627 1.00 43.42 C ATOM 2679 CE2 TYR B1010 -5.393 13.357 25.727 1.00 31.05 C ATOM 2680 CZ TYR B1010 -4.265 14.094 25.435 1.00 2.41 C ATOM 2681 OH TYR B1010 -4.122 15.362 25.952 1.00 72.14 O ATOM 0 H TYR B1010 -6.629 9.897 22.296 1.00 2.33 H new ATOM 0 HA TYR B1010 -4.091 11.007 21.955 1.00 73.42 H new ATOM 0 HB2 TYR B1010 -5.695 9.758 24.085 1.00 52.24 H new ATOM 0 HB3 TYR B1010 -3.977 9.481 24.289 1.00 52.24 H new ATOM 0 HD1 TYR B1010 -2.653 11.888 23.475 1.00 12.22 H new ATOM 0 HD2 TYR B1010 -6.416 11.510 25.439 1.00 65.14 H new ATOM 0 HE1 TYR B1010 -2.396 14.148 24.400 1.00 43.42 H new ATOM 0 HE2 TYR B1010 -6.164 13.772 26.359 1.00 31.05 H new ATOM 0 HH TYR B1010 -3.190 15.651 25.858 1.00 72.14 H new ATOM 2691 N THR B1011 -4.197 7.826 21.464 1.00 44.22 N ATOM 2692 CA THR B1011 -3.424 6.654 21.074 1.00 62.23 C ATOM 2693 C THR B1011 -2.168 7.053 20.307 1.00 54.03 C ATOM 2694 O THR B1011 -1.072 6.573 20.597 1.00 21.11 O ATOM 2695 CB THR B1011 -4.259 5.694 20.205 1.00 22.02 C ATOM 2696 OG1 THR B1011 -3.407 4.717 19.597 1.00 42.24 O ATOM 2697 CG2 THR B1011 -5.014 6.457 19.128 1.00 40.42 C ATOM 0 H THR B1011 -5.205 7.725 21.346 1.00 44.22 H new ATOM 0 HA THR B1011 -3.138 6.144 21.994 1.00 62.23 H new ATOM 0 HB THR B1011 -4.983 5.194 20.848 1.00 22.02 H new ATOM 0 HG1 THR B1011 -3.946 4.110 19.048 1.00 42.24 H new ATOM 0 HG21 THR B1011 -5.596 5.758 18.527 1.00 40.42 H new ATOM 0 HG22 THR B1011 -5.684 7.179 19.595 1.00 40.42 H new ATOM 0 HG23 THR B1011 -4.304 6.981 18.488 1.00 40.42 H new ATOM 2705 N LEU B1012 -2.335 7.934 19.327 1.00 41.41 N ATOM 2706 CA LEU B1012 -1.214 8.400 18.518 1.00 63.44 C ATOM 2707 C LEU B1012 -0.953 9.884 18.750 1.00 11.34 C ATOM 2708 O LEU B1012 -1.881 10.659 18.981 1.00 52.34 O ATOM 2709 CB LEU B1012 -1.489 8.145 17.035 1.00 74.14 C ATOM 2710 CG LEU B1012 -1.381 6.692 16.572 1.00 63.34 C ATOM 2711 CD1 LEU B1012 -1.658 6.585 15.080 1.00 24.41 C ATOM 2712 CD2 LEU B1012 -0.007 6.128 16.903 1.00 63.23 C ATOM 0 H LEU B1012 -3.236 8.340 19.073 1.00 41.41 H new ATOM 0 HA LEU B1012 -0.326 7.843 18.818 1.00 63.44 H new ATOM 0 HB2 LEU B1012 -2.492 8.505 16.805 1.00 74.14 H new ATOM 0 HB3 LEU B1012 -0.793 8.745 16.449 1.00 74.14 H new ATOM 0 HG LEU B1012 -2.130 6.105 17.103 1.00 63.34 H new ATOM 0 HD11 LEU B1012 -1.577 5.544 14.769 1.00 24.41 H new ATOM 0 HD12 LEU B1012 -2.664 6.949 14.870 1.00 24.41 H new ATOM 0 HD13 LEU B1012 -0.933 7.186 14.531 1.00 24.41 H new ATOM 0 HD21 LEU B1012 0.052 5.093 16.566 1.00 63.23 H new ATOM 0 HD22 LEU B1012 0.759 6.718 16.400 1.00 63.23 H new ATOM 0 HD23 LEU B1012 0.153 6.169 17.980 1.00 63.23 H new TER 2724 LEU B1012