USER MOD reduce.3.24.130724 H: found=0, std=0, add=1306, rem=0, adj=53 USER MOD reduce.3.24.130724 removed 1309 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 56 THR OG1 : rot -3:sc= -1.75! USER MOD Set 1.2: A 159 SER OG : rot 59:sc= 0.901 USER MOD Set 2.1: A 82 GLN :FLIP amide:sc= -4.45! C(o=-6.9!,f=-5.6!) USER MOD Set 2.2: A 109 ASN :FLIP amide:sc= -1.16 F(o=-9.8!,f=-5.6) USER MOD Set 3.1: A 61 TYR OH : rot 180:sc= 0.298 USER MOD Set 3.2: A 65 LYS NZ :NH3+ 179:sc= 0.419 (180deg=0.0557) USER MOD Set 4.1: A 46 LYS NZ :NH3+ -120:sc= 1.72! (180deg=-1.22) USER MOD Set 4.2: A 138 ASN : amide:sc= 0.65 K(o=2.4,f=0.48) USER MOD Set 5.1: A 28 TYR OH : rot -134:sc= 0.783 USER MOD Set 5.2: A 33 HIS : no HE2:sc= -5.51! C(o=-6.3!,f=-11!) USER MOD Set 5.3: A 70 THR OG1 : rot 42:sc= -1.57! USER MOD Single : A 11 MET CE :methyl -159:sc= -0.149 (180deg=-0.662) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 14 SER OG : rot -146:sc= 0.8 USER MOD Single : A 25 HIS :FLIP no HD1:sc= -2.04! C(o=-3.7!,f=-2!) USER MOD Single : A 26 LYS NZ :NH3+ 177:sc= 1.23 (180deg=1.16) USER MOD Single : A 29 ASN : amide:sc= -4.65! C(o=-4.7!,f=-4.3!) USER MOD Single : A 32 GLN :FLIP amide:sc= -0.144 F(o=-1.6!,f=-0.14) USER MOD Single : A 34 LYS NZ :NH3+ -170:sc= -2.36! (180deg=-2.95!) USER MOD Single : A 36 SER OG : rot 144:sc= 0.305 USER MOD Single : A 41 TYR OH : rot 0:sc= -0.363 USER MOD Single : A 42 ASN : amide:sc= -7.45! C(o=-7.4!,f=-9.8!) USER MOD Single : A 45 SER OG : rot 175:sc= -1.94! USER MOD Single : A 47 CYS SG : rot 180:sc= 0 USER MOD Single : A 49 TYR OH : rot 180:sc= 0 USER MOD Single : A 50 THR OG1 : rot 81:sc= -3.21! USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 TYR OH : rot 72:sc= 0.873 USER MOD Single : A 58 THR OG1 : rot 92:sc= 1.25 USER MOD Single : A 59 THR OG1 : rot 90:sc= 1.26 USER MOD Single : A 62 ASN : amide:sc= 0.0427 X(o=0.043,f=0) USER MOD Single : A 63 LYS NZ :NH3+ -144:sc= 0.838 (180deg=0.0125) USER MOD Single : A 64 TYR OH : rot -173:sc= 1.04 USER MOD Single : A 66 SER OG : rot 180:sc= 0.0629 USER MOD Single : A 67 GLN :FLIP amide:sc= -0.54 F(o=-2.1!,f=-0.54) USER MOD Single : A 76 SER OG : rot 19:sc= 0.119 USER MOD Single : A 77 ASN : amide:sc= -0.417 K(o=-0.42,f=-2.4) USER MOD Single : A 78 GLN : amide:sc= -3.37! C(o=-3.4!,f=-14!) USER MOD Single : A 86 ASN :FLIP amide:sc= -2.41 F(o=-4.5!,f=-2.4) USER MOD Single : A 91 LYS NZ :NH3+ 167:sc= 1.26 (180deg=0.993) USER MOD Single : A 95 CYS SG : rot -100:sc= -5.03! USER MOD Single : A 96 THR OG1 : rot -91:sc= 0.059 USER MOD Single : A 97 LYS NZ :NH3+ 150:sc= 1.22 (180deg=1.14) USER MOD Single : A 99 LYS NZ :NH3+ -167:sc= -0.0325 (180deg=-0.215) USER MOD Single : A 105 MET CE :methyl 163:sc= -9.81! (180deg=-9.88!) USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 ASN :FLIP amide:sc= -2.45 F(o=-4.2!,f=-2.5) USER MOD Single : A 114 ASN : amide:sc= 0 K(o=0,f=-0.64) USER MOD Single : A 116 HIS : no HD1:sc= -3.93! C(o=-3.9!,f=-12!) USER MOD Single : A 119 TYR OH : rot 6:sc= -2.37! USER MOD Single : A 121 TYR OH : rot 15:sc= 0 USER MOD Single : A 122 MET CE :methyl -118:sc= -6.42! (180deg=-10.5!) USER MOD Single : A 123 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.111) USER MOD Single : A 124 LYS NZ :NH3+ 158:sc= 1.1 (180deg=0.75) USER MOD Single : A 125 THR OG1 : rot 56:sc= 1.23 USER MOD Single : A 126 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0363) USER MOD Single : A 132 THR OG1 : rot 180:sc= 0 USER MOD Single : A 133 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 LYS NZ :NH3+ -164:sc= -0.0532 (180deg=-0.365) USER MOD Single : A 140 THR OG1 : rot 95:sc= -0.705 USER MOD Single : A 141 SER OG : rot -78:sc= 2.03 USER MOD Single : A 155 SER OG : rot 180:sc= 0 USER MOD Single : A 161 LYS NZ :NH3+ -155:sc= 2.29 (180deg=1.45) USER MOD Single : A 166 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 173 SER OG : rot -160:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 10 -10.021 21.786 2.815 1.00 5.22 N ATOM 2 CA GLY A 10 -8.736 21.051 2.772 1.00 4.42 C ATOM 3 C GLY A 10 -8.535 20.348 1.449 1.00 3.29 C ATOM 4 O GLY A 10 -9.379 20.439 0.556 1.00 3.60 O ATOM 0 HA2 GLY A 10 -7.914 21.746 2.943 1.00 4.42 H new ATOM 0 HA3 GLY A 10 -8.708 20.320 3.580 1.00 4.42 H new ATOM 10 N MET A 11 -7.422 19.642 1.321 1.00 2.49 N ATOM 11 CA MET A 11 -7.106 18.933 0.092 1.00 1.84 C ATOM 12 C MET A 11 -7.285 17.433 0.271 1.00 1.40 C ATOM 13 O MET A 11 -6.965 16.880 1.329 1.00 2.20 O ATOM 14 CB MET A 11 -5.672 19.235 -0.343 1.00 2.43 C ATOM 15 CG MET A 11 -5.446 20.686 -0.731 1.00 3.11 C ATOM 16 SD MET A 11 -6.387 21.169 -2.194 1.00 4.02 S ATOM 17 CE MET A 11 -5.645 20.109 -3.435 1.00 4.85 C ATOM 0 H MET A 11 -6.721 19.545 2.056 1.00 2.49 H new ATOM 0 HA MET A 11 -7.793 19.276 -0.681 1.00 1.84 H new ATOM 0 HB2 MET A 11 -4.993 18.975 0.469 1.00 2.43 H new ATOM 0 HB3 MET A 11 -5.416 18.597 -1.189 1.00 2.43 H new ATOM 0 HG2 MET A 11 -5.724 21.329 0.104 1.00 3.11 H new ATOM 0 HG3 MET A 11 -4.384 20.847 -0.917 1.00 3.11 H new ATOM 0 HE1 MET A 11 -5.830 20.524 -4.426 1.00 4.85 H new ATOM 0 HE2 MET A 11 -4.571 20.045 -3.263 1.00 4.85 H new ATOM 0 HE3 MET A 11 -6.083 19.113 -3.372 1.00 4.85 H new ATOM 27 N GLY A 12 -7.803 16.782 -0.763 1.00 0.92 N ATOM 28 CA GLY A 12 -7.962 15.345 -0.732 1.00 0.85 C ATOM 29 C GLY A 12 -9.289 14.912 -0.148 1.00 0.79 C ATOM 30 O GLY A 12 -9.528 15.065 1.053 1.00 1.55 O ATOM 0 H GLY A 12 -8.116 17.228 -1.625 1.00 0.92 H new ATOM 0 HA2 GLY A 12 -7.871 14.953 -1.745 1.00 0.85 H new ATOM 0 HA3 GLY A 12 -7.153 14.908 -0.147 1.00 0.85 H new ATOM 34 N SER A 13 -10.151 14.379 -0.997 1.00 0.52 N ATOM 35 CA SER A 13 -11.422 13.826 -0.560 1.00 0.53 C ATOM 36 C SER A 13 -11.289 12.315 -0.431 1.00 0.41 C ATOM 37 O SER A 13 -11.883 11.689 0.448 1.00 0.53 O ATOM 38 CB SER A 13 -12.521 14.174 -1.567 1.00 0.79 C ATOM 39 OG SER A 13 -12.558 15.572 -1.820 1.00 1.58 O ATOM 0 H SER A 13 -9.991 14.317 -2.003 1.00 0.52 H new ATOM 0 HA SER A 13 -11.692 14.252 0.407 1.00 0.53 H new ATOM 0 HB2 SER A 13 -12.348 13.637 -2.499 1.00 0.79 H new ATOM 0 HB3 SER A 13 -13.487 13.845 -1.184 1.00 0.79 H new ATOM 0 HG SER A 13 -13.267 15.769 -2.467 1.00 1.58 H new ATOM 45 N SER A 14 -10.460 11.751 -1.298 1.00 0.32 N ATOM 46 CA SER A 14 -10.195 10.350 -1.355 1.00 0.22 C ATOM 47 C SER A 14 -8.794 10.237 -1.874 1.00 0.21 C ATOM 48 O SER A 14 -8.203 11.233 -2.293 1.00 0.35 O ATOM 49 CB SER A 14 -11.181 9.643 -2.287 1.00 0.25 C ATOM 50 OG SER A 14 -12.519 10.018 -2.000 1.00 1.17 O ATOM 0 H SER A 14 -9.945 12.287 -1.996 1.00 0.32 H new ATOM 0 HA SER A 14 -10.307 9.877 -0.380 1.00 0.22 H new ATOM 0 HB2 SER A 14 -10.946 9.889 -3.323 1.00 0.25 H new ATOM 0 HB3 SER A 14 -11.073 8.563 -2.183 1.00 0.25 H new ATOM 0 HG SER A 14 -13.114 9.257 -2.165 1.00 1.17 H new ATOM 56 N ILE A 15 -8.253 9.069 -1.840 1.00 0.18 N ATOM 57 CA ILE A 15 -6.933 8.857 -2.351 1.00 0.18 C ATOM 58 C ILE A 15 -6.890 9.131 -3.860 1.00 0.17 C ATOM 59 O ILE A 15 -5.845 9.433 -4.425 1.00 0.19 O ATOM 60 CB ILE A 15 -6.496 7.429 -2.052 1.00 0.17 C ATOM 61 CG1 ILE A 15 -7.463 6.444 -2.692 1.00 0.18 C ATOM 62 CG2 ILE A 15 -6.439 7.210 -0.551 1.00 0.23 C ATOM 63 CD1 ILE A 15 -6.814 5.138 -3.080 1.00 0.38 C ATOM 0 H ILE A 15 -8.704 8.236 -1.462 1.00 0.18 H new ATOM 0 HA ILE A 15 -6.245 9.549 -1.864 1.00 0.18 H new ATOM 0 HB ILE A 15 -5.503 7.265 -2.469 1.00 0.17 H new ATOM 0 HG12 ILE A 15 -8.280 6.244 -1.998 1.00 0.18 H new ATOM 0 HG13 ILE A 15 -7.903 6.901 -3.579 1.00 0.18 H new ATOM 0 HG21 ILE A 15 -6.126 6.187 -0.344 1.00 0.23 H new ATOM 0 HG22 ILE A 15 -5.725 7.904 -0.109 1.00 0.23 H new ATOM 0 HG23 ILE A 15 -7.426 7.381 -0.121 1.00 0.23 H new ATOM 0 HD11 ILE A 15 -7.558 4.481 -3.530 1.00 0.38 H new ATOM 0 HD12 ILE A 15 -6.016 5.327 -3.798 1.00 0.38 H new ATOM 0 HD13 ILE A 15 -6.398 4.660 -2.193 1.00 0.38 H new ATOM 75 N PHE A 16 -8.060 9.104 -4.487 1.00 0.18 N ATOM 76 CA PHE A 16 -8.174 9.239 -5.934 1.00 0.19 C ATOM 77 C PHE A 16 -7.923 10.665 -6.394 1.00 0.21 C ATOM 78 O PHE A 16 -7.989 10.966 -7.585 1.00 0.30 O ATOM 79 CB PHE A 16 -9.552 8.818 -6.389 1.00 0.20 C ATOM 80 CG PHE A 16 -9.905 7.416 -6.030 1.00 0.19 C ATOM 81 CD1 PHE A 16 -9.098 6.370 -6.428 1.00 0.22 C ATOM 82 CD2 PHE A 16 -11.065 7.141 -5.339 1.00 0.18 C ATOM 83 CE1 PHE A 16 -9.446 5.070 -6.152 1.00 0.22 C ATOM 84 CE2 PHE A 16 -11.410 5.844 -5.048 1.00 0.19 C ATOM 85 CZ PHE A 16 -10.602 4.807 -5.460 1.00 0.19 C ATOM 0 H PHE A 16 -8.953 8.988 -4.009 1.00 0.18 H new ATOM 0 HA PHE A 16 -7.414 8.594 -6.376 1.00 0.19 H new ATOM 0 HB2 PHE A 16 -10.289 9.491 -5.952 1.00 0.20 H new ATOM 0 HB3 PHE A 16 -9.617 8.933 -7.471 1.00 0.20 H new ATOM 0 HD1 PHE A 16 -8.182 6.576 -6.963 1.00 0.22 H new ATOM 0 HD2 PHE A 16 -11.707 7.951 -5.024 1.00 0.18 H new ATOM 0 HE1 PHE A 16 -8.813 4.258 -6.478 1.00 0.22 H new ATOM 0 HE2 PHE A 16 -12.315 5.637 -4.496 1.00 0.19 H new ATOM 0 HZ PHE A 16 -10.878 3.787 -5.238 1.00 0.19 H new ATOM 95 N ASP A 17 -7.630 11.537 -5.448 1.00 0.21 N ATOM 96 CA ASP A 17 -7.304 12.911 -5.758 1.00 0.26 C ATOM 97 C ASP A 17 -5.868 12.965 -6.198 1.00 0.25 C ATOM 98 O ASP A 17 -5.376 13.990 -6.675 1.00 0.32 O ATOM 99 CB ASP A 17 -7.492 13.808 -4.537 1.00 0.32 C ATOM 100 CG ASP A 17 -8.941 14.158 -4.273 1.00 1.13 C ATOM 101 OD1 ASP A 17 -9.427 15.160 -4.836 1.00 1.30 O ATOM 102 OD2 ASP A 17 -9.603 13.436 -3.500 1.00 2.11 O ATOM 0 H ASP A 17 -7.612 11.314 -4.453 1.00 0.21 H new ATOM 0 HA ASP A 17 -7.967 13.268 -6.546 1.00 0.26 H new ATOM 0 HB2 ASP A 17 -7.080 13.309 -3.660 1.00 0.32 H new ATOM 0 HB3 ASP A 17 -6.923 14.727 -4.678 1.00 0.32 H new ATOM 107 N PHE A 18 -5.200 11.836 -6.032 1.00 0.22 N ATOM 108 CA PHE A 18 -3.793 11.748 -6.289 1.00 0.23 C ATOM 109 C PHE A 18 -3.489 10.705 -7.324 1.00 0.26 C ATOM 110 O PHE A 18 -3.777 9.521 -7.159 1.00 0.29 O ATOM 111 CB PHE A 18 -3.047 11.463 -5.007 1.00 0.21 C ATOM 112 CG PHE A 18 -3.213 12.567 -4.027 1.00 0.22 C ATOM 113 CD1 PHE A 18 -2.756 13.838 -4.320 1.00 0.27 C ATOM 114 CD2 PHE A 18 -3.854 12.348 -2.834 1.00 0.23 C ATOM 115 CE1 PHE A 18 -2.927 14.871 -3.427 1.00 0.31 C ATOM 116 CE2 PHE A 18 -4.036 13.374 -1.944 1.00 0.29 C ATOM 117 CZ PHE A 18 -3.570 14.639 -2.232 1.00 0.31 C ATOM 0 H PHE A 18 -5.625 10.964 -5.716 1.00 0.22 H new ATOM 0 HA PHE A 18 -3.460 12.708 -6.684 1.00 0.23 H new ATOM 0 HB2 PHE A 18 -3.409 10.531 -4.573 1.00 0.21 H new ATOM 0 HB3 PHE A 18 -1.988 11.323 -5.224 1.00 0.21 H new ATOM 0 HD1 PHE A 18 -2.259 14.023 -5.261 1.00 0.27 H new ATOM 0 HD2 PHE A 18 -4.218 11.360 -2.594 1.00 0.23 H new ATOM 0 HE1 PHE A 18 -2.559 15.859 -3.662 1.00 0.31 H new ATOM 0 HE2 PHE A 18 -4.548 13.190 -1.011 1.00 0.29 H new ATOM 0 HZ PHE A 18 -3.708 15.443 -1.524 1.00 0.31 H new ATOM 127 N GLU A 19 -2.942 11.203 -8.402 1.00 0.35 N ATOM 128 CA GLU A 19 -2.423 10.386 -9.481 1.00 0.43 C ATOM 129 C GLU A 19 -1.517 9.289 -8.933 1.00 0.34 C ATOM 130 O GLU A 19 -0.711 9.521 -8.025 1.00 0.37 O ATOM 131 CB GLU A 19 -1.630 11.267 -10.451 1.00 0.63 C ATOM 132 CG GLU A 19 -1.232 10.573 -11.740 1.00 1.08 C ATOM 133 CD GLU A 19 -2.406 10.372 -12.672 1.00 2.04 C ATOM 134 OE1 GLU A 19 -3.140 9.382 -12.509 1.00 2.86 O ATOM 135 OE2 GLU A 19 -2.599 11.218 -13.572 1.00 2.30 O ATOM 0 H GLU A 19 -2.840 12.205 -8.563 1.00 0.35 H new ATOM 0 HA GLU A 19 -3.259 9.921 -10.003 1.00 0.43 H new ATOM 0 HB2 GLU A 19 -2.226 12.147 -10.694 1.00 0.63 H new ATOM 0 HB3 GLU A 19 -0.729 11.621 -9.949 1.00 0.63 H new ATOM 0 HG2 GLU A 19 -0.467 11.162 -12.246 1.00 1.08 H new ATOM 0 HG3 GLU A 19 -0.787 9.606 -11.506 1.00 1.08 H new ATOM 142 N VAL A 20 -1.653 8.101 -9.487 1.00 0.29 N ATOM 143 CA VAL A 20 -0.794 6.994 -9.124 1.00 0.26 C ATOM 144 C VAL A 20 0.065 6.655 -10.317 1.00 0.25 C ATOM 145 O VAL A 20 -0.219 7.108 -11.414 1.00 0.28 O ATOM 146 CB VAL A 20 -1.605 5.760 -8.651 1.00 0.31 C ATOM 147 CG1 VAL A 20 -0.712 4.582 -8.357 1.00 0.67 C ATOM 148 CG2 VAL A 20 -2.393 6.129 -7.421 1.00 0.49 C ATOM 0 H VAL A 20 -2.354 7.878 -10.194 1.00 0.29 H new ATOM 0 HA VAL A 20 -0.168 7.287 -8.281 1.00 0.26 H new ATOM 0 HB VAL A 20 -2.279 5.465 -9.455 1.00 0.31 H new ATOM 0 HG11 VAL A 20 -1.319 3.738 -8.029 1.00 0.67 H new ATOM 0 HG12 VAL A 20 -0.165 4.306 -9.258 1.00 0.67 H new ATOM 0 HG13 VAL A 20 -0.005 4.848 -7.571 1.00 0.67 H new ATOM 0 HG21 VAL A 20 -2.966 5.265 -7.083 1.00 0.49 H new ATOM 0 HG22 VAL A 20 -1.710 6.443 -6.632 1.00 0.49 H new ATOM 0 HG23 VAL A 20 -3.074 6.946 -7.657 1.00 0.49 H new ATOM 158 N LEU A 21 1.134 5.915 -10.108 1.00 0.28 N ATOM 159 CA LEU A 21 2.061 5.626 -11.175 1.00 0.35 C ATOM 160 C LEU A 21 2.428 4.158 -11.155 1.00 0.38 C ATOM 161 O LEU A 21 2.949 3.669 -10.159 1.00 0.58 O ATOM 162 CB LEU A 21 3.309 6.487 -11.007 1.00 0.45 C ATOM 163 CG LEU A 21 3.026 7.961 -10.700 1.00 0.46 C ATOM 164 CD1 LEU A 21 4.298 8.699 -10.367 1.00 0.69 C ATOM 165 CD2 LEU A 21 2.317 8.625 -11.862 1.00 0.68 C ATOM 0 H LEU A 21 1.380 5.504 -9.208 1.00 0.28 H new ATOM 0 HA LEU A 21 1.596 5.854 -12.134 1.00 0.35 H new ATOM 0 HB2 LEU A 21 3.916 6.071 -10.203 1.00 0.45 H new ATOM 0 HB3 LEU A 21 3.903 6.426 -11.919 1.00 0.45 H new ATOM 0 HG LEU A 21 2.372 8.001 -9.829 1.00 0.46 H new ATOM 0 HD11 LEU A 21 4.068 9.743 -10.153 1.00 0.69 H new ATOM 0 HD12 LEU A 21 4.764 8.244 -9.493 1.00 0.69 H new ATOM 0 HD13 LEU A 21 4.983 8.644 -11.213 1.00 0.69 H new ATOM 0 HD21 LEU A 21 2.126 9.671 -11.622 1.00 0.68 H new ATOM 0 HD22 LEU A 21 2.943 8.565 -12.752 1.00 0.68 H new ATOM 0 HD23 LEU A 21 1.371 8.117 -12.049 1.00 0.68 H new ATOM 177 N ASP A 22 2.170 3.471 -12.266 1.00 0.33 N ATOM 178 CA ASP A 22 2.460 2.044 -12.390 1.00 0.37 C ATOM 179 C ASP A 22 3.972 1.849 -12.286 1.00 0.35 C ATOM 180 O ASP A 22 4.701 2.827 -12.163 1.00 0.40 O ATOM 181 CB ASP A 22 1.887 1.524 -13.721 1.00 0.50 C ATOM 182 CG ASP A 22 2.064 0.033 -13.927 1.00 1.16 C ATOM 183 OD1 ASP A 22 1.299 -0.750 -13.332 1.00 1.48 O ATOM 184 OD2 ASP A 22 2.965 -0.357 -14.698 1.00 1.87 O ATOM 0 H ASP A 22 1.756 3.885 -13.101 1.00 0.33 H new ATOM 0 HA ASP A 22 1.990 1.470 -11.591 1.00 0.37 H new ATOM 0 HB2 ASP A 22 0.824 1.763 -13.766 1.00 0.50 H new ATOM 0 HB3 ASP A 22 2.368 2.054 -14.543 1.00 0.50 H new ATOM 189 N ALA A 23 4.437 0.606 -12.322 1.00 0.39 N ATOM 190 CA ALA A 23 5.797 0.259 -11.888 1.00 0.42 C ATOM 191 C ALA A 23 6.906 0.971 -12.663 1.00 0.47 C ATOM 192 O ALA A 23 8.083 0.810 -12.330 1.00 0.59 O ATOM 193 CB ALA A 23 6.002 -1.246 -11.960 1.00 0.52 C ATOM 0 H ALA A 23 3.890 -0.190 -12.650 1.00 0.39 H new ATOM 0 HA ALA A 23 5.876 0.608 -10.858 1.00 0.42 H new ATOM 0 HB1 ALA A 23 7.013 -1.491 -11.636 1.00 0.52 H new ATOM 0 HB2 ALA A 23 5.282 -1.743 -11.310 1.00 0.52 H new ATOM 0 HB3 ALA A 23 5.858 -1.584 -12.986 1.00 0.52 H new ATOM 199 N ASP A 24 6.547 1.740 -13.682 1.00 0.46 N ATOM 200 CA ASP A 24 7.523 2.563 -14.385 1.00 0.54 C ATOM 201 C ASP A 24 7.200 4.057 -14.312 1.00 0.51 C ATOM 202 O ASP A 24 7.738 4.843 -15.088 1.00 0.62 O ATOM 203 CB ASP A 24 7.655 2.119 -15.841 1.00 0.69 C ATOM 204 CG ASP A 24 8.484 0.860 -15.988 1.00 1.43 C ATOM 205 OD1 ASP A 24 9.543 0.758 -15.338 1.00 1.51 O ATOM 206 OD2 ASP A 24 8.078 -0.039 -16.752 1.00 2.34 O ATOM 0 H ASP A 24 5.594 1.812 -14.039 1.00 0.46 H new ATOM 0 HA ASP A 24 8.477 2.418 -13.877 1.00 0.54 H new ATOM 0 HB2 ASP A 24 6.662 1.948 -16.257 1.00 0.69 H new ATOM 0 HB3 ASP A 24 8.110 2.921 -16.423 1.00 0.69 H new ATOM 211 N HIS A 25 6.297 4.446 -13.403 1.00 0.43 N ATOM 212 CA HIS A 25 5.997 5.854 -13.151 1.00 0.44 C ATOM 213 C HIS A 25 5.193 6.419 -14.304 1.00 0.47 C ATOM 214 O HIS A 25 5.201 7.615 -14.583 1.00 0.54 O ATOM 215 CB HIS A 25 7.264 6.682 -12.856 1.00 0.54 C ATOM 216 CG HIS A 25 7.680 6.619 -11.413 1.00 0.64 C ATOM 217 ND1 HIS A 25 6.929 6.606 -10.290 1.00 0.73 N flip ATOM 218 CD2 HIS A 25 8.990 6.565 -10.986 1.00 1.47 C flip ATOM 219 CE1 HIS A 25 7.780 6.552 -9.214 1.00 0.59 C flip ATOM 220 NE2 HIS A 25 9.018 6.520 -9.660 1.00 1.26 N flip ATOM 0 H HIS A 25 5.760 3.797 -12.828 1.00 0.43 H new ATOM 0 HA HIS A 25 5.392 5.919 -12.246 1.00 0.44 H new ATOM 0 HB2 HIS A 25 8.081 6.322 -13.481 1.00 0.54 H new ATOM 0 HB3 HIS A 25 7.086 7.721 -13.133 1.00 0.54 H new ATOM 0 HD2 HIS A 25 9.857 6.560 -11.630 1.00 1.47 H new ATOM 0 HE1 HIS A 25 7.483 6.538 -8.176 1.00 0.59 H new ATOM 0 HE2 HIS A 25 9.858 6.469 -9.083 1.00 1.26 H new ATOM 229 N LYS A 26 4.521 5.507 -14.983 1.00 0.48 N ATOM 230 CA LYS A 26 3.478 5.834 -15.932 1.00 0.53 C ATOM 231 C LYS A 26 2.197 5.979 -15.145 1.00 0.41 C ATOM 232 O LYS A 26 1.877 5.085 -14.365 1.00 0.38 O ATOM 233 CB LYS A 26 3.312 4.694 -16.927 1.00 0.67 C ATOM 234 CG LYS A 26 4.628 4.121 -17.412 1.00 1.00 C ATOM 235 CD LYS A 26 4.469 2.690 -17.897 1.00 2.12 C ATOM 236 CE LYS A 26 3.957 1.794 -16.778 1.00 3.15 C ATOM 237 NZ LYS A 26 3.957 0.356 -17.151 1.00 4.25 N ATOM 0 H LYS A 26 4.688 4.505 -14.888 1.00 0.48 H new ATOM 0 HA LYS A 26 3.724 6.747 -16.475 1.00 0.53 H new ATOM 0 HB2 LYS A 26 2.727 3.899 -16.463 1.00 0.67 H new ATOM 0 HB3 LYS A 26 2.742 5.051 -17.785 1.00 0.67 H new ATOM 0 HG2 LYS A 26 5.019 4.739 -18.221 1.00 1.00 H new ATOM 0 HG3 LYS A 26 5.359 4.153 -16.604 1.00 1.00 H new ATOM 0 HD2 LYS A 26 3.776 2.661 -18.738 1.00 2.12 H new ATOM 0 HD3 LYS A 26 5.426 2.316 -18.260 1.00 2.12 H new ATOM 0 HE2 LYS A 26 4.576 1.936 -15.892 1.00 3.15 H new ATOM 0 HE3 LYS A 26 2.944 2.096 -16.511 1.00 3.15 H new ATOM 0 HZ1 LYS A 26 3.648 -0.214 -16.338 1.00 4.25 H new ATOM 0 HZ2 LYS A 26 3.306 0.204 -17.948 1.00 4.25 H new ATOM 0 HZ3 LYS A 26 4.917 0.070 -17.429 1.00 4.25 H new ATOM 251 N PRO A 27 1.468 7.086 -15.293 1.00 0.41 N ATOM 252 CA PRO A 27 0.279 7.329 -14.477 1.00 0.37 C ATOM 253 C PRO A 27 -0.684 6.146 -14.477 1.00 0.32 C ATOM 254 O PRO A 27 -1.315 5.810 -15.480 1.00 0.36 O ATOM 255 CB PRO A 27 -0.337 8.558 -15.138 1.00 0.46 C ATOM 256 CG PRO A 27 0.844 9.277 -15.685 1.00 0.54 C ATOM 257 CD PRO A 27 1.741 8.198 -16.219 1.00 0.50 C ATOM 0 HA PRO A 27 0.515 7.474 -13.423 1.00 0.37 H new ATOM 0 HB2 PRO A 27 -1.040 8.283 -15.924 1.00 0.46 H new ATOM 0 HB3 PRO A 27 -0.884 9.170 -14.421 1.00 0.46 H new ATOM 0 HG2 PRO A 27 0.553 9.974 -16.471 1.00 0.54 H new ATOM 0 HG3 PRO A 27 1.344 9.860 -14.912 1.00 0.54 H new ATOM 0 HD2 PRO A 27 1.499 7.939 -17.250 1.00 0.50 H new ATOM 0 HD3 PRO A 27 2.790 8.494 -16.203 1.00 0.50 H new ATOM 265 N TYR A 28 -0.777 5.544 -13.307 1.00 0.28 N ATOM 266 CA TYR A 28 -1.645 4.416 -13.041 1.00 0.26 C ATOM 267 C TYR A 28 -3.076 4.848 -12.766 1.00 0.25 C ATOM 268 O TYR A 28 -3.332 5.860 -12.113 1.00 0.37 O ATOM 269 CB TYR A 28 -1.088 3.646 -11.844 1.00 0.30 C ATOM 270 CG TYR A 28 -1.910 2.462 -11.427 1.00 0.37 C ATOM 271 CD1 TYR A 28 -2.331 1.523 -12.354 1.00 0.50 C ATOM 272 CD2 TYR A 28 -2.259 2.282 -10.100 1.00 0.82 C ATOM 273 CE1 TYR A 28 -3.092 0.444 -11.973 1.00 0.64 C ATOM 274 CE2 TYR A 28 -3.009 1.207 -9.704 1.00 1.10 C ATOM 275 CZ TYR A 28 -3.432 0.285 -10.641 1.00 0.92 C ATOM 276 OH TYR A 28 -4.211 -0.785 -10.247 1.00 1.20 O ATOM 0 H TYR A 28 -0.235 5.835 -12.493 1.00 0.28 H new ATOM 0 HA TYR A 28 -1.670 3.781 -13.927 1.00 0.26 H new ATOM 0 HB2 TYR A 28 -0.081 3.306 -12.084 1.00 0.30 H new ATOM 0 HB3 TYR A 28 -1.001 4.328 -10.998 1.00 0.30 H new ATOM 0 HD1 TYR A 28 -2.057 1.641 -13.392 1.00 0.50 H new ATOM 0 HD2 TYR A 28 -1.934 3.002 -9.364 1.00 0.82 H new ATOM 0 HE1 TYR A 28 -3.422 -0.275 -12.708 1.00 0.64 H new ATOM 0 HE2 TYR A 28 -3.269 1.081 -8.663 1.00 1.10 H new ATOM 0 HH TYR A 28 -4.914 -0.472 -9.640 1.00 1.20 H new ATOM 286 N ASN A 29 -4.000 4.041 -13.259 1.00 0.34 N ATOM 287 CA ASN A 29 -5.418 4.265 -13.070 1.00 0.42 C ATOM 288 C ASN A 29 -5.829 3.836 -11.664 1.00 0.34 C ATOM 289 O ASN A 29 -6.308 2.724 -11.456 1.00 0.44 O ATOM 290 CB ASN A 29 -6.207 3.488 -14.128 1.00 0.67 C ATOM 291 CG ASN A 29 -7.710 3.674 -14.022 1.00 0.73 C ATOM 292 OD1 ASN A 29 -8.477 2.773 -14.351 1.00 1.18 O ATOM 293 ND2 ASN A 29 -8.139 4.838 -13.571 1.00 1.51 N ATOM 0 H ASN A 29 -3.783 3.207 -13.805 1.00 0.34 H new ATOM 0 HA ASN A 29 -5.637 5.327 -13.182 1.00 0.42 H new ATOM 0 HB2 ASN A 29 -5.879 3.803 -15.118 1.00 0.67 H new ATOM 0 HB3 ASN A 29 -5.973 2.427 -14.038 1.00 0.67 H new ATOM 0 HD21 ASN A 29 -9.140 5.014 -13.486 1.00 1.51 H new ATOM 0 HD22 ASN A 29 -7.469 5.561 -13.308 1.00 1.51 H new ATOM 300 N LEU A 30 -5.612 4.717 -10.700 1.00 0.25 N ATOM 301 CA LEU A 30 -5.958 4.441 -9.312 1.00 0.20 C ATOM 302 C LEU A 30 -7.461 4.265 -9.154 1.00 0.19 C ATOM 303 O LEU A 30 -7.936 3.335 -8.501 1.00 0.19 O ATOM 304 CB LEU A 30 -5.518 5.595 -8.415 1.00 0.22 C ATOM 305 CG LEU A 30 -5.916 5.490 -6.963 1.00 0.22 C ATOM 306 CD1 LEU A 30 -5.261 4.292 -6.307 1.00 0.23 C ATOM 307 CD2 LEU A 30 -5.572 6.767 -6.223 1.00 0.28 C ATOM 0 H LEU A 30 -5.195 5.635 -10.854 1.00 0.25 H new ATOM 0 HA LEU A 30 -5.447 3.523 -9.023 1.00 0.20 H new ATOM 0 HB2 LEU A 30 -4.433 5.678 -8.469 1.00 0.22 H new ATOM 0 HB3 LEU A 30 -5.929 6.520 -8.818 1.00 0.22 H new ATOM 0 HG LEU A 30 -6.996 5.348 -6.915 1.00 0.22 H new ATOM 0 HD11 LEU A 30 -5.564 4.239 -5.261 1.00 0.23 H new ATOM 0 HD12 LEU A 30 -5.570 3.382 -6.821 1.00 0.23 H new ATOM 0 HD13 LEU A 30 -4.177 4.392 -6.366 1.00 0.23 H new ATOM 0 HD21 LEU A 30 -5.866 6.672 -5.178 1.00 0.28 H new ATOM 0 HD22 LEU A 30 -4.498 6.944 -6.283 1.00 0.28 H new ATOM 0 HD23 LEU A 30 -6.104 7.604 -6.675 1.00 0.28 H new ATOM 319 N VAL A 31 -8.195 5.172 -9.782 1.00 0.20 N ATOM 320 CA VAL A 31 -9.641 5.284 -9.615 1.00 0.19 C ATOM 321 C VAL A 31 -10.414 4.081 -10.154 1.00 0.20 C ATOM 322 O VAL A 31 -11.640 4.075 -10.120 1.00 0.23 O ATOM 323 CB VAL A 31 -10.189 6.573 -10.258 1.00 0.22 C ATOM 324 CG1 VAL A 31 -10.422 7.648 -9.227 1.00 1.02 C ATOM 325 CG2 VAL A 31 -9.241 7.097 -11.294 1.00 0.87 C ATOM 0 H VAL A 31 -7.803 5.858 -10.427 1.00 0.20 H new ATOM 0 HA VAL A 31 -9.798 5.318 -8.537 1.00 0.19 H new ATOM 0 HB VAL A 31 -11.139 6.315 -10.725 1.00 0.22 H new ATOM 0 HG11 VAL A 31 -10.808 8.543 -9.715 1.00 1.02 H new ATOM 0 HG12 VAL A 31 -11.144 7.296 -8.491 1.00 1.02 H new ATOM 0 HG13 VAL A 31 -9.482 7.884 -8.729 1.00 1.02 H new ATOM 0 HG21 VAL A 31 -9.649 8.007 -11.734 1.00 0.87 H new ATOM 0 HG22 VAL A 31 -8.280 7.318 -10.829 1.00 0.87 H new ATOM 0 HG23 VAL A 31 -9.103 6.348 -12.073 1.00 0.87 H new ATOM 335 N GLN A 32 -9.716 3.076 -10.669 1.00 0.21 N ATOM 336 CA GLN A 32 -10.376 1.833 -11.060 1.00 0.23 C ATOM 337 C GLN A 32 -10.745 1.031 -9.834 1.00 0.22 C ATOM 338 O GLN A 32 -11.394 -0.010 -9.922 1.00 0.28 O ATOM 339 CB GLN A 32 -9.504 1.001 -12.007 1.00 0.26 C ATOM 340 CG GLN A 32 -8.244 0.449 -11.359 1.00 0.29 C ATOM 341 CD GLN A 32 -7.414 -0.386 -12.316 1.00 0.35 C ATOM 342 OE1 GLN A 32 -6.516 0.264 -13.034 1.00 1.02 O flip ATOM 343 NE2 GLN A 32 -7.577 -1.601 -12.403 1.00 0.75 N flip ATOM 0 H GLN A 32 -8.708 3.094 -10.825 1.00 0.21 H new ATOM 0 HA GLN A 32 -11.286 2.094 -11.601 1.00 0.23 H new ATOM 0 HB2 GLN A 32 -10.095 0.171 -12.394 1.00 0.26 H new ATOM 0 HB3 GLN A 32 -9.222 1.617 -12.861 1.00 0.26 H new ATOM 0 HG2 GLN A 32 -7.640 1.276 -10.986 1.00 0.29 H new ATOM 0 HG3 GLN A 32 -8.519 -0.159 -10.497 1.00 0.29 H new ATOM 0 HE21 GLN A 32 -8.282 -2.063 -11.829 1.00 0.75 H new ATOM 0 HE22 GLN A 32 -7.007 -2.147 -13.049 1.00 0.75 H new ATOM 352 N HIS A 33 -10.321 1.523 -8.689 1.00 0.17 N ATOM 353 CA HIS A 33 -10.700 0.918 -7.429 1.00 0.16 C ATOM 354 C HIS A 33 -11.755 1.770 -6.759 1.00 0.16 C ATOM 355 O HIS A 33 -11.925 1.753 -5.545 1.00 0.17 O ATOM 356 CB HIS A 33 -9.475 0.723 -6.541 1.00 0.16 C ATOM 357 CG HIS A 33 -8.350 0.050 -7.267 1.00 0.16 C ATOM 358 ND1 HIS A 33 -8.464 -1.244 -7.707 1.00 0.21 N ATOM 359 CD2 HIS A 33 -7.114 0.482 -7.675 1.00 0.22 C ATOM 360 CE1 HIS A 33 -7.370 -1.593 -8.341 1.00 0.27 C ATOM 361 NE2 HIS A 33 -6.533 -0.568 -8.349 1.00 0.28 N ATOM 0 H HIS A 33 -9.715 2.339 -8.604 1.00 0.17 H new ATOM 0 HA HIS A 33 -11.125 -0.070 -7.608 1.00 0.16 H new ATOM 0 HB2 HIS A 33 -9.139 1.692 -6.171 1.00 0.16 H new ATOM 0 HB3 HIS A 33 -9.751 0.128 -5.670 1.00 0.16 H new ATOM 0 HD1 HIS A 33 -9.276 -1.844 -7.563 1.00 0.21 H new ATOM 0 HD2 HIS A 33 -6.681 1.456 -7.501 1.00 0.22 H new ATOM 0 HE1 HIS A 33 -7.183 -2.560 -8.784 1.00 0.27 H new ATOM 370 N LYS A 34 -12.455 2.529 -7.584 1.00 0.19 N ATOM 371 CA LYS A 34 -13.610 3.273 -7.136 1.00 0.19 C ATOM 372 C LYS A 34 -14.823 2.365 -7.121 1.00 0.21 C ATOM 373 O LYS A 34 -15.329 1.965 -8.172 1.00 0.33 O ATOM 374 CB LYS A 34 -13.884 4.457 -8.051 1.00 0.22 C ATOM 375 CG LYS A 34 -12.956 5.642 -7.856 1.00 0.28 C ATOM 376 CD LYS A 34 -13.617 6.927 -8.327 1.00 0.69 C ATOM 377 CE LYS A 34 -14.289 6.723 -9.668 1.00 1.01 C ATOM 378 NZ LYS A 34 -13.328 6.702 -10.800 1.00 1.56 N ATOM 0 H LYS A 34 -12.238 2.644 -8.574 1.00 0.19 H new ATOM 0 HA LYS A 34 -13.408 3.647 -6.132 1.00 0.19 H new ATOM 0 HB2 LYS A 34 -13.811 4.123 -9.086 1.00 0.22 H new ATOM 0 HB3 LYS A 34 -14.911 4.788 -7.895 1.00 0.22 H new ATOM 0 HG2 LYS A 34 -12.688 5.730 -6.803 1.00 0.28 H new ATOM 0 HG3 LYS A 34 -12.030 5.480 -8.408 1.00 0.28 H new ATOM 0 HD2 LYS A 34 -14.353 7.254 -7.592 1.00 0.69 H new ATOM 0 HD3 LYS A 34 -12.871 7.718 -8.405 1.00 0.69 H new ATOM 0 HE2 LYS A 34 -14.843 5.785 -9.652 1.00 1.01 H new ATOM 0 HE3 LYS A 34 -15.015 7.520 -9.830 1.00 1.01 H new ATOM 0 HZ1 LYS A 34 -13.850 6.730 -11.699 1.00 1.56 H new ATOM 0 HZ2 LYS A 34 -12.700 7.529 -10.738 1.00 1.56 H new ATOM 0 HZ3 LYS A 34 -12.760 5.832 -10.757 1.00 1.56 H new ATOM 392 N GLY A 35 -15.288 2.043 -5.937 1.00 0.18 N ATOM 393 CA GLY A 35 -16.435 1.182 -5.811 1.00 0.20 C ATOM 394 C GLY A 35 -16.183 0.040 -4.860 1.00 0.17 C ATOM 395 O GLY A 35 -17.084 -0.376 -4.130 1.00 0.20 O ATOM 0 H GLY A 35 -14.891 2.363 -5.053 1.00 0.18 H new ATOM 0 HA2 GLY A 35 -17.288 1.764 -5.461 1.00 0.20 H new ATOM 0 HA3 GLY A 35 -16.700 0.786 -6.791 1.00 0.20 H new ATOM 399 N SER A 36 -14.963 -0.483 -4.865 1.00 0.16 N ATOM 400 CA SER A 36 -14.572 -1.474 -3.904 1.00 0.16 C ATOM 401 C SER A 36 -13.253 -1.060 -3.308 1.00 0.14 C ATOM 402 O SER A 36 -12.354 -0.635 -4.031 1.00 0.16 O ATOM 403 CB SER A 36 -14.453 -2.841 -4.568 1.00 0.20 C ATOM 404 OG SER A 36 -15.673 -3.197 -5.193 1.00 0.29 O ATOM 0 H SER A 36 -14.234 -0.228 -5.531 1.00 0.16 H new ATOM 0 HA SER A 36 -15.325 -1.550 -3.120 1.00 0.16 H new ATOM 0 HB2 SER A 36 -13.651 -2.825 -5.306 1.00 0.20 H new ATOM 0 HB3 SER A 36 -14.186 -3.591 -3.824 1.00 0.20 H new ATOM 0 HG SER A 36 -15.486 -3.692 -6.018 1.00 0.29 H new ATOM 410 N PRO A 37 -13.151 -1.130 -1.980 1.00 0.12 N ATOM 411 CA PRO A 37 -11.935 -0.830 -1.246 1.00 0.12 C ATOM 412 C PRO A 37 -10.700 -1.408 -1.906 1.00 0.12 C ATOM 413 O PRO A 37 -10.761 -2.406 -2.617 1.00 0.15 O ATOM 414 CB PRO A 37 -12.172 -1.487 0.126 1.00 0.15 C ATOM 415 CG PRO A 37 -13.447 -2.232 -0.016 1.00 0.18 C ATOM 416 CD PRO A 37 -14.216 -1.502 -1.063 1.00 0.15 C ATOM 0 HA PRO A 37 -11.749 0.243 -1.193 1.00 0.12 H new ATOM 0 HB2 PRO A 37 -11.352 -2.155 0.390 1.00 0.15 H new ATOM 0 HB3 PRO A 37 -12.239 -0.738 0.915 1.00 0.15 H new ATOM 0 HG2 PRO A 37 -13.267 -3.266 -0.310 1.00 0.18 H new ATOM 0 HG3 PRO A 37 -13.994 -2.259 0.927 1.00 0.18 H new ATOM 0 HD2 PRO A 37 -14.968 -2.133 -1.538 1.00 0.15 H new ATOM 0 HD3 PRO A 37 -14.737 -0.633 -0.661 1.00 0.15 H new ATOM 424 N LEU A 38 -9.602 -0.748 -1.667 1.00 0.14 N ATOM 425 CA LEU A 38 -8.312 -1.129 -2.184 1.00 0.13 C ATOM 426 C LEU A 38 -7.320 -0.968 -1.052 1.00 0.13 C ATOM 427 O LEU A 38 -7.433 -0.059 -0.259 1.00 0.20 O ATOM 428 CB LEU A 38 -7.910 -0.253 -3.379 1.00 0.16 C ATOM 429 CG LEU A 38 -8.068 1.258 -3.217 1.00 0.20 C ATOM 430 CD1 LEU A 38 -7.302 1.966 -4.311 1.00 0.31 C ATOM 431 CD2 LEU A 38 -9.532 1.687 -3.261 1.00 0.26 C ATOM 0 H LEU A 38 -9.576 0.094 -1.091 1.00 0.14 H new ATOM 0 HA LEU A 38 -8.336 -2.158 -2.543 1.00 0.13 H new ATOM 0 HB2 LEU A 38 -6.866 -0.461 -3.615 1.00 0.16 H new ATOM 0 HB3 LEU A 38 -8.500 -0.565 -4.241 1.00 0.16 H new ATOM 0 HG LEU A 38 -7.671 1.531 -2.239 1.00 0.20 H new ATOM 0 HD11 LEU A 38 -7.415 3.044 -4.195 1.00 0.31 H new ATOM 0 HD12 LEU A 38 -6.246 1.703 -4.245 1.00 0.31 H new ATOM 0 HD13 LEU A 38 -7.692 1.663 -5.283 1.00 0.31 H new ATOM 0 HD21 LEU A 38 -9.598 2.768 -3.142 1.00 0.26 H new ATOM 0 HD22 LEU A 38 -9.967 1.400 -4.219 1.00 0.26 H new ATOM 0 HD23 LEU A 38 -10.078 1.199 -2.454 1.00 0.26 H new ATOM 443 N LEU A 39 -6.394 -1.862 -0.933 1.00 0.18 N ATOM 444 CA LEU A 39 -5.376 -1.742 0.068 1.00 0.19 C ATOM 445 C LEU A 39 -4.097 -1.360 -0.613 1.00 0.18 C ATOM 446 O LEU A 39 -3.539 -2.132 -1.388 1.00 0.21 O ATOM 447 CB LEU A 39 -5.174 -3.051 0.815 1.00 0.23 C ATOM 448 CG LEU A 39 -5.912 -3.225 2.151 1.00 0.35 C ATOM 449 CD1 LEU A 39 -5.159 -2.545 3.281 1.00 1.10 C ATOM 450 CD2 LEU A 39 -7.327 -2.692 2.066 1.00 1.19 C ATOM 0 H LEU A 39 -6.318 -2.692 -1.521 1.00 0.18 H new ATOM 0 HA LEU A 39 -5.678 -0.986 0.793 1.00 0.19 H new ATOM 0 HB2 LEU A 39 -5.475 -3.865 0.156 1.00 0.23 H new ATOM 0 HB3 LEU A 39 -4.107 -3.171 1.002 1.00 0.23 H new ATOM 0 HG LEU A 39 -5.961 -4.293 2.364 1.00 0.35 H new ATOM 0 HD11 LEU A 39 -5.703 -2.683 4.216 1.00 1.10 H new ATOM 0 HD12 LEU A 39 -4.165 -2.983 3.371 1.00 1.10 H new ATOM 0 HD13 LEU A 39 -5.068 -1.480 3.068 1.00 1.10 H new ATOM 0 HD21 LEU A 39 -7.825 -2.828 3.026 1.00 1.19 H new ATOM 0 HD22 LEU A 39 -7.302 -1.631 1.818 1.00 1.19 H new ATOM 0 HD23 LEU A 39 -7.874 -3.233 1.293 1.00 1.19 H new ATOM 462 N ILE A 40 -3.664 -0.158 -0.373 1.00 0.19 N ATOM 463 CA ILE A 40 -2.410 0.289 -0.911 1.00 0.20 C ATOM 464 C ILE A 40 -1.315 0.081 0.118 1.00 0.18 C ATOM 465 O ILE A 40 -1.413 0.564 1.248 1.00 0.20 O ATOM 466 CB ILE A 40 -2.491 1.759 -1.309 1.00 0.23 C ATOM 467 CG1 ILE A 40 -3.884 2.076 -1.833 1.00 0.30 C ATOM 468 CG2 ILE A 40 -1.454 2.075 -2.366 1.00 0.37 C ATOM 469 CD1 ILE A 40 -3.978 3.478 -2.368 1.00 0.35 C ATOM 0 H ILE A 40 -4.159 0.532 0.192 1.00 0.19 H new ATOM 0 HA ILE A 40 -2.179 -0.292 -1.804 1.00 0.20 H new ATOM 0 HB ILE A 40 -2.292 2.373 -0.431 1.00 0.23 H new ATOM 0 HG12 ILE A 40 -4.145 1.369 -2.621 1.00 0.30 H new ATOM 0 HG13 ILE A 40 -4.612 1.944 -1.032 1.00 0.30 H new ATOM 0 HG21 ILE A 40 -1.523 3.128 -2.641 1.00 0.37 H new ATOM 0 HG22 ILE A 40 -0.459 1.867 -1.973 1.00 0.37 H new ATOM 0 HG23 ILE A 40 -1.632 1.458 -3.247 1.00 0.37 H new ATOM 0 HD11 ILE A 40 -4.989 3.662 -2.732 1.00 0.35 H new ATOM 0 HD12 ILE A 40 -3.744 4.187 -1.574 1.00 0.35 H new ATOM 0 HD13 ILE A 40 -3.270 3.603 -3.187 1.00 0.35 H new ATOM 481 N TYR A 41 -0.295 -0.666 -0.263 1.00 0.18 N ATOM 482 CA TYR A 41 0.774 -1.009 0.646 1.00 0.19 C ATOM 483 C TYR A 41 2.056 -0.297 0.232 1.00 0.20 C ATOM 484 O TYR A 41 2.472 -0.383 -0.918 1.00 0.27 O ATOM 485 CB TYR A 41 1.069 -2.528 0.640 1.00 0.20 C ATOM 486 CG TYR A 41 -0.070 -3.477 0.981 1.00 0.20 C ATOM 487 CD1 TYR A 41 -1.351 -3.271 0.511 1.00 0.27 C ATOM 488 CD2 TYR A 41 0.161 -4.621 1.745 1.00 0.29 C ATOM 489 CE1 TYR A 41 -2.364 -4.161 0.790 1.00 0.32 C ATOM 490 CE2 TYR A 41 -0.857 -5.516 2.033 1.00 0.35 C ATOM 491 CZ TYR A 41 -2.117 -5.277 1.549 1.00 0.33 C ATOM 492 OH TYR A 41 -3.136 -6.159 1.815 1.00 0.42 O ATOM 0 H TYR A 41 -0.188 -1.047 -1.203 1.00 0.18 H new ATOM 0 HA TYR A 41 0.453 -0.704 1.642 1.00 0.19 H new ATOM 0 HB2 TYR A 41 1.439 -2.793 -0.351 1.00 0.20 H new ATOM 0 HB3 TYR A 41 1.881 -2.714 1.344 1.00 0.20 H new ATOM 0 HD1 TYR A 41 -1.563 -2.396 -0.086 1.00 0.27 H new ATOM 0 HD2 TYR A 41 1.155 -4.813 2.120 1.00 0.29 H new ATOM 0 HE1 TYR A 41 -3.358 -3.980 0.409 1.00 0.32 H new ATOM 0 HE2 TYR A 41 -0.660 -6.392 2.632 1.00 0.35 H new ATOM 0 HH TYR A 41 -3.961 -5.844 1.390 1.00 0.42 H new ATOM 502 N ASN A 42 2.676 0.394 1.167 1.00 0.28 N ATOM 503 CA ASN A 42 4.032 0.901 0.978 1.00 0.34 C ATOM 504 C ASN A 42 5.004 -0.232 1.286 1.00 0.37 C ATOM 505 O ASN A 42 5.390 -0.451 2.426 1.00 0.54 O ATOM 506 CB ASN A 42 4.287 2.107 1.891 1.00 0.46 C ATOM 507 CG ASN A 42 3.809 1.913 3.316 1.00 1.50 C ATOM 508 OD1 ASN A 42 4.544 1.449 4.180 1.00 2.27 O ATOM 509 ND2 ASN A 42 2.571 2.296 3.577 1.00 2.35 N ATOM 0 H ASN A 42 2.265 0.621 2.072 1.00 0.28 H new ATOM 0 HA ASN A 42 4.170 1.238 -0.049 1.00 0.34 H new ATOM 0 HB2 ASN A 42 5.356 2.321 1.903 1.00 0.46 H new ATOM 0 HB3 ASN A 42 3.792 2.981 1.468 1.00 0.46 H new ATOM 0 HD21 ASN A 42 2.199 2.210 4.523 1.00 2.35 H new ATOM 0 HD22 ASN A 42 1.988 2.678 2.833 1.00 2.35 H new ATOM 516 N VAL A 43 5.425 -0.944 0.259 1.00 0.36 N ATOM 517 CA VAL A 43 6.104 -2.207 0.471 1.00 0.38 C ATOM 518 C VAL A 43 7.594 -2.048 0.282 1.00 0.42 C ATOM 519 O VAL A 43 8.054 -1.369 -0.624 1.00 0.50 O ATOM 520 CB VAL A 43 5.586 -3.316 -0.484 1.00 0.39 C ATOM 521 CG1 VAL A 43 4.091 -3.492 -0.348 1.00 1.03 C ATOM 522 CG2 VAL A 43 5.938 -3.030 -1.933 1.00 0.98 C ATOM 0 H VAL A 43 5.311 -0.674 -0.718 1.00 0.36 H new ATOM 0 HA VAL A 43 5.891 -2.510 1.496 1.00 0.38 H new ATOM 0 HB VAL A 43 6.084 -4.240 -0.191 1.00 0.39 H new ATOM 0 HG11 VAL A 43 3.753 -4.275 -1.028 1.00 1.03 H new ATOM 0 HG12 VAL A 43 3.849 -3.773 0.677 1.00 1.03 H new ATOM 0 HG13 VAL A 43 3.590 -2.556 -0.595 1.00 1.03 H new ATOM 0 HG21 VAL A 43 5.556 -3.832 -2.565 1.00 0.98 H new ATOM 0 HG22 VAL A 43 5.490 -2.084 -2.236 1.00 0.98 H new ATOM 0 HG23 VAL A 43 7.021 -2.969 -2.039 1.00 0.98 H new ATOM 532 N ALA A 44 8.353 -2.654 1.167 1.00 0.50 N ATOM 533 CA ALA A 44 9.785 -2.611 1.047 1.00 0.59 C ATOM 534 C ALA A 44 10.262 -3.768 0.184 1.00 0.58 C ATOM 535 O ALA A 44 10.315 -4.908 0.642 1.00 0.88 O ATOM 536 CB ALA A 44 10.433 -2.635 2.420 1.00 0.83 C ATOM 0 H ALA A 44 8.003 -3.177 1.970 1.00 0.50 H new ATOM 0 HA ALA A 44 10.080 -1.680 0.562 1.00 0.59 H new ATOM 0 HB1 ALA A 44 11.517 -2.602 2.311 1.00 0.83 H new ATOM 0 HB2 ALA A 44 10.099 -1.771 2.995 1.00 0.83 H new ATOM 0 HB3 ALA A 44 10.148 -3.549 2.941 1.00 0.83 H new ATOM 542 N SER A 45 10.543 -3.433 -1.074 1.00 0.57 N ATOM 543 CA SER A 45 11.016 -4.363 -2.109 1.00 0.63 C ATOM 544 C SER A 45 11.817 -5.545 -1.553 1.00 1.01 C ATOM 545 O SER A 45 11.266 -6.635 -1.374 1.00 1.78 O ATOM 546 CB SER A 45 11.837 -3.583 -3.140 1.00 0.73 C ATOM 547 OG SER A 45 12.710 -2.656 -2.516 1.00 1.62 O ATOM 0 H SER A 45 10.446 -2.477 -1.416 1.00 0.57 H new ATOM 0 HA SER A 45 10.137 -4.805 -2.579 1.00 0.63 H new ATOM 0 HB2 SER A 45 12.417 -4.279 -3.747 1.00 0.73 H new ATOM 0 HB3 SER A 45 11.166 -3.054 -3.816 1.00 0.73 H new ATOM 0 HG SER A 45 13.277 -2.233 -3.194 1.00 1.62 H new ATOM 553 N LYS A 46 13.102 -5.318 -1.286 1.00 1.32 N ATOM 554 CA LYS A 46 13.992 -6.352 -0.757 1.00 1.69 C ATOM 555 C LYS A 46 14.039 -7.593 -1.645 1.00 1.14 C ATOM 556 O LYS A 46 13.585 -7.586 -2.793 1.00 1.47 O ATOM 557 CB LYS A 46 13.587 -6.761 0.660 1.00 2.68 C ATOM 558 CG LYS A 46 14.191 -5.879 1.737 1.00 3.45 C ATOM 559 CD LYS A 46 13.270 -4.741 2.124 1.00 4.39 C ATOM 560 CE LYS A 46 12.425 -5.102 3.338 1.00 5.19 C ATOM 561 NZ LYS A 46 13.262 -5.340 4.545 1.00 5.84 N ATOM 0 H LYS A 46 13.555 -4.415 -1.429 1.00 1.32 H new ATOM 0 HA LYS A 46 14.988 -5.910 -0.737 1.00 1.69 H new ATOM 0 HB2 LYS A 46 12.501 -6.730 0.743 1.00 2.68 H new ATOM 0 HB3 LYS A 46 13.891 -7.793 0.833 1.00 2.68 H new ATOM 0 HG2 LYS A 46 14.411 -6.482 2.618 1.00 3.45 H new ATOM 0 HG3 LYS A 46 15.139 -5.473 1.383 1.00 3.45 H new ATOM 0 HD2 LYS A 46 13.860 -3.850 2.341 1.00 4.39 H new ATOM 0 HD3 LYS A 46 12.619 -4.496 1.285 1.00 4.39 H new ATOM 0 HE2 LYS A 46 11.717 -4.298 3.540 1.00 5.19 H new ATOM 0 HE3 LYS A 46 11.839 -5.995 3.120 1.00 5.19 H new ATOM 0 HZ1 LYS A 46 13.113 -6.312 4.885 1.00 5.84 H new ATOM 0 HZ2 LYS A 46 14.265 -5.208 4.304 1.00 5.84 H new ATOM 0 HZ3 LYS A 46 12.994 -4.667 5.291 1.00 5.84 H new ATOM 575 N CYS A 47 14.631 -8.645 -1.107 1.00 1.21 N ATOM 576 CA CYS A 47 14.735 -9.910 -1.800 1.00 1.53 C ATOM 577 C CYS A 47 14.639 -11.054 -0.801 1.00 1.99 C ATOM 578 O CYS A 47 15.484 -11.189 0.085 1.00 2.46 O ATOM 579 CB CYS A 47 16.065 -9.976 -2.550 1.00 2.04 C ATOM 580 SG CYS A 47 16.417 -11.583 -3.306 1.00 3.55 S ATOM 0 H CYS A 47 15.052 -8.643 -0.178 1.00 1.21 H new ATOM 0 HA CYS A 47 13.918 -9.999 -2.516 1.00 1.53 H new ATOM 0 HB2 CYS A 47 16.068 -9.213 -3.329 1.00 2.04 H new ATOM 0 HB3 CYS A 47 16.871 -9.729 -1.859 1.00 2.04 H new ATOM 0 HG CYS A 47 17.563 -11.533 -3.917 1.00 3.55 H new ATOM 586 N GLY A 48 13.599 -11.864 -0.933 1.00 2.39 N ATOM 587 CA GLY A 48 13.433 -13.014 -0.066 1.00 2.91 C ATOM 588 C GLY A 48 12.825 -12.664 1.284 1.00 2.40 C ATOM 589 O GLY A 48 12.197 -13.507 1.919 1.00 2.46 O ATOM 0 H GLY A 48 12.863 -11.745 -1.629 1.00 2.39 H new ATOM 0 HA2 GLY A 48 12.799 -13.748 -0.564 1.00 2.91 H new ATOM 0 HA3 GLY A 48 14.403 -13.486 0.091 1.00 2.91 H new ATOM 593 N TYR A 49 13.008 -11.425 1.727 1.00 2.15 N ATOM 594 CA TYR A 49 12.495 -11.011 3.025 1.00 1.79 C ATOM 595 C TYR A 49 11.191 -10.233 2.894 1.00 1.42 C ATOM 596 O TYR A 49 11.145 -9.143 2.322 1.00 1.67 O ATOM 597 CB TYR A 49 13.527 -10.177 3.794 1.00 2.10 C ATOM 598 CG TYR A 49 12.992 -9.607 5.097 1.00 2.40 C ATOM 599 CD1 TYR A 49 12.882 -10.391 6.242 1.00 2.66 C ATOM 600 CD2 TYR A 49 12.579 -8.283 5.174 1.00 3.01 C ATOM 601 CE1 TYR A 49 12.379 -9.866 7.421 1.00 3.26 C ATOM 602 CE2 TYR A 49 12.075 -7.756 6.345 1.00 3.74 C ATOM 603 CZ TYR A 49 11.976 -8.547 7.464 1.00 3.76 C ATOM 604 OH TYR A 49 11.471 -8.013 8.627 1.00 4.63 O ATOM 0 H TYR A 49 13.503 -10.697 1.211 1.00 2.15 H new ATOM 0 HA TYR A 49 12.294 -11.922 3.588 1.00 1.79 H new ATOM 0 HB2 TYR A 49 14.398 -10.797 4.008 1.00 2.10 H new ATOM 0 HB3 TYR A 49 13.867 -9.358 3.160 1.00 2.10 H new ATOM 0 HD1 TYR A 49 13.194 -11.425 6.211 1.00 2.66 H new ATOM 0 HD2 TYR A 49 12.654 -7.654 4.300 1.00 3.01 H new ATOM 0 HE1 TYR A 49 12.303 -10.486 8.302 1.00 3.26 H new ATOM 0 HE2 TYR A 49 11.759 -6.724 6.382 1.00 3.74 H new ATOM 0 HH TYR A 49 11.238 -7.073 8.481 1.00 4.63 H new ATOM 614 N THR A 50 10.140 -10.814 3.436 1.00 1.05 N ATOM 615 CA THR A 50 8.857 -10.154 3.570 1.00 0.81 C ATOM 616 C THR A 50 8.432 -10.268 5.033 1.00 0.77 C ATOM 617 O THR A 50 9.237 -10.666 5.873 1.00 1.44 O ATOM 618 CB THR A 50 7.799 -10.787 2.639 1.00 1.09 C ATOM 619 OG1 THR A 50 6.580 -10.028 2.689 1.00 1.93 O ATOM 620 CG2 THR A 50 7.523 -12.238 3.014 1.00 1.87 C ATOM 0 H THR A 50 10.153 -11.767 3.799 1.00 1.05 H new ATOM 0 HA THR A 50 8.943 -9.107 3.278 1.00 0.81 H new ATOM 0 HB THR A 50 8.195 -10.771 1.624 1.00 1.09 H new ATOM 0 HG1 THR A 50 6.659 -9.243 2.107 1.00 1.93 H new ATOM 0 HG21 THR A 50 6.774 -12.652 2.339 1.00 1.87 H new ATOM 0 HG22 THR A 50 8.444 -12.816 2.933 1.00 1.87 H new ATOM 0 HG23 THR A 50 7.154 -12.285 4.038 1.00 1.87 H new ATOM 628 N LYS A 51 7.199 -9.921 5.349 1.00 0.61 N ATOM 629 CA LYS A 51 6.724 -10.043 6.718 1.00 0.56 C ATOM 630 C LYS A 51 5.230 -10.340 6.724 1.00 0.76 C ATOM 631 O LYS A 51 4.428 -9.518 7.173 1.00 1.55 O ATOM 632 CB LYS A 51 7.019 -8.762 7.515 1.00 0.59 C ATOM 633 CG LYS A 51 7.034 -8.988 9.019 1.00 1.22 C ATOM 634 CD LYS A 51 7.818 -7.906 9.742 1.00 1.39 C ATOM 635 CE LYS A 51 7.726 -8.068 11.251 1.00 1.46 C ATOM 636 NZ LYS A 51 8.664 -7.162 11.967 1.00 2.01 N ATOM 0 H LYS A 51 6.514 -9.556 4.687 1.00 0.61 H new ATOM 0 HA LYS A 51 7.252 -10.868 7.197 1.00 0.56 H new ATOM 0 HB2 LYS A 51 7.984 -8.361 7.204 1.00 0.59 H new ATOM 0 HB3 LYS A 51 6.268 -8.010 7.274 1.00 0.59 H new ATOM 0 HG2 LYS A 51 6.011 -9.008 9.394 1.00 1.22 H new ATOM 0 HG3 LYS A 51 7.473 -9.962 9.236 1.00 1.22 H new ATOM 0 HD2 LYS A 51 8.863 -7.944 9.434 1.00 1.39 H new ATOM 0 HD3 LYS A 51 7.437 -6.926 9.456 1.00 1.39 H new ATOM 0 HE2 LYS A 51 6.706 -7.864 11.576 1.00 1.46 H new ATOM 0 HE3 LYS A 51 7.945 -9.102 11.519 1.00 1.46 H new ATOM 0 HZ1 LYS A 51 8.569 -7.304 12.993 1.00 2.01 H new ATOM 0 HZ2 LYS A 51 9.640 -7.373 11.677 1.00 2.01 H new ATOM 0 HZ3 LYS A 51 8.439 -6.174 11.732 1.00 2.01 H new ATOM 650 N GLY A 52 4.856 -11.499 6.178 1.00 0.45 N ATOM 651 CA GLY A 52 3.459 -11.894 6.137 1.00 0.51 C ATOM 652 C GLY A 52 2.681 -11.162 5.061 1.00 0.41 C ATOM 653 O GLY A 52 1.968 -11.777 4.271 1.00 0.41 O ATOM 0 H GLY A 52 5.501 -12.172 5.763 1.00 0.45 H new ATOM 0 HA2 GLY A 52 3.393 -12.968 5.962 1.00 0.51 H new ATOM 0 HA3 GLY A 52 3.001 -11.701 7.107 1.00 0.51 H new ATOM 657 N GLY A 53 2.862 -9.847 5.016 1.00 0.44 N ATOM 658 CA GLY A 53 2.114 -8.992 4.116 1.00 0.50 C ATOM 659 C GLY A 53 2.179 -9.408 2.656 1.00 0.36 C ATOM 660 O GLY A 53 1.296 -9.060 1.893 1.00 0.32 O ATOM 0 H GLY A 53 3.531 -9.349 5.603 1.00 0.44 H new ATOM 0 HA2 GLY A 53 1.071 -8.978 4.431 1.00 0.50 H new ATOM 0 HA3 GLY A 53 2.488 -7.972 4.208 1.00 0.50 H new ATOM 664 N TYR A 54 3.215 -10.132 2.251 1.00 0.37 N ATOM 665 CA TYR A 54 3.347 -10.543 0.859 1.00 0.36 C ATOM 666 C TYR A 54 2.261 -11.550 0.490 1.00 0.26 C ATOM 667 O TYR A 54 1.502 -11.331 -0.454 1.00 0.25 O ATOM 668 CB TYR A 54 4.729 -11.139 0.620 1.00 0.45 C ATOM 669 CG TYR A 54 5.224 -11.046 -0.806 1.00 0.41 C ATOM 670 CD1 TYR A 54 4.363 -10.809 -1.878 1.00 0.45 C ATOM 671 CD2 TYR A 54 6.574 -11.190 -1.074 1.00 0.53 C ATOM 672 CE1 TYR A 54 4.844 -10.723 -3.174 1.00 0.46 C ATOM 673 CE2 TYR A 54 7.061 -11.110 -2.356 1.00 0.65 C ATOM 674 CZ TYR A 54 6.196 -10.877 -3.406 1.00 0.56 C ATOM 675 OH TYR A 54 6.689 -10.809 -4.691 1.00 0.70 O ATOM 0 H TYR A 54 3.970 -10.445 2.861 1.00 0.37 H new ATOM 0 HA TYR A 54 3.227 -9.665 0.224 1.00 0.36 H new ATOM 0 HB2 TYR A 54 5.444 -10.635 1.271 1.00 0.45 H new ATOM 0 HB3 TYR A 54 4.713 -12.188 0.916 1.00 0.45 H new ATOM 0 HD1 TYR A 54 3.305 -10.691 -1.694 1.00 0.45 H new ATOM 0 HD2 TYR A 54 7.259 -11.369 -0.258 1.00 0.53 H new ATOM 0 HE1 TYR A 54 4.168 -10.537 -3.995 1.00 0.46 H new ATOM 0 HE2 TYR A 54 8.118 -11.229 -2.542 1.00 0.65 H new ATOM 0 HH TYR A 54 6.651 -9.882 -5.007 1.00 0.70 H new ATOM 685 N GLU A 55 2.179 -12.642 1.244 1.00 0.25 N ATOM 686 CA GLU A 55 1.165 -13.662 0.996 1.00 0.27 C ATOM 687 C GLU A 55 -0.214 -13.082 1.280 1.00 0.22 C ATOM 688 O GLU A 55 -1.207 -13.440 0.644 1.00 0.25 O ATOM 689 CB GLU A 55 1.448 -14.920 1.843 1.00 0.36 C ATOM 690 CG GLU A 55 1.387 -14.720 3.356 1.00 1.14 C ATOM 691 CD GLU A 55 -0.025 -14.698 3.915 1.00 1.92 C ATOM 692 OE1 GLU A 55 -0.864 -15.504 3.462 1.00 2.39 O ATOM 693 OE2 GLU A 55 -0.299 -13.866 4.809 1.00 2.61 O ATOM 0 H GLU A 55 2.799 -12.843 2.028 1.00 0.25 H new ATOM 0 HA GLU A 55 1.197 -13.967 -0.050 1.00 0.27 H new ATOM 0 HB2 GLU A 55 0.730 -15.692 1.567 1.00 0.36 H new ATOM 0 HB3 GLU A 55 2.437 -15.297 1.583 1.00 0.36 H new ATOM 0 HG2 GLU A 55 1.948 -15.519 3.842 1.00 1.14 H new ATOM 0 HG3 GLU A 55 1.883 -13.783 3.610 1.00 1.14 H new ATOM 700 N THR A 56 -0.239 -12.160 2.229 1.00 0.25 N ATOM 701 CA THR A 56 -1.430 -11.422 2.577 1.00 0.24 C ATOM 702 C THR A 56 -1.949 -10.649 1.382 1.00 0.21 C ATOM 703 O THR A 56 -3.052 -10.887 0.899 1.00 0.22 O ATOM 704 CB THR A 56 -1.099 -10.458 3.730 1.00 0.26 C ATOM 705 OG1 THR A 56 -0.760 -11.212 4.896 1.00 0.33 O ATOM 706 CG2 THR A 56 -2.254 -9.528 4.032 1.00 0.25 C ATOM 0 H THR A 56 0.579 -11.904 2.782 1.00 0.25 H new ATOM 0 HA THR A 56 -2.207 -12.119 2.890 1.00 0.24 H new ATOM 0 HB THR A 56 -0.253 -9.842 3.426 1.00 0.26 H new ATOM 0 HG1 THR A 56 -0.869 -12.168 4.710 1.00 0.33 H new ATOM 0 HG21 THR A 56 -1.981 -8.863 4.852 1.00 0.25 H new ATOM 0 HG22 THR A 56 -2.486 -8.936 3.146 1.00 0.25 H new ATOM 0 HG23 THR A 56 -3.128 -10.114 4.316 1.00 0.25 H new ATOM 714 N ALA A 57 -1.113 -9.767 0.887 1.00 0.19 N ATOM 715 CA ALA A 57 -1.454 -8.910 -0.217 1.00 0.20 C ATOM 716 C ALA A 57 -1.774 -9.718 -1.465 1.00 0.19 C ATOM 717 O ALA A 57 -2.762 -9.446 -2.147 1.00 0.22 O ATOM 718 CB ALA A 57 -0.305 -7.958 -0.472 1.00 0.22 C ATOM 0 H ALA A 57 -0.168 -9.625 1.245 1.00 0.19 H new ATOM 0 HA ALA A 57 -2.349 -8.342 0.036 1.00 0.20 H new ATOM 0 HB1 ALA A 57 -0.553 -7.304 -1.307 1.00 0.22 H new ATOM 0 HB2 ALA A 57 -0.126 -7.357 0.419 1.00 0.22 H new ATOM 0 HB3 ALA A 57 0.593 -8.527 -0.712 1.00 0.22 H new ATOM 724 N THR A 58 -0.937 -10.718 -1.750 1.00 0.17 N ATOM 725 CA THR A 58 -1.093 -11.541 -2.942 1.00 0.17 C ATOM 726 C THR A 58 -2.494 -12.153 -2.986 1.00 0.17 C ATOM 727 O THR A 58 -3.235 -12.007 -3.968 1.00 0.19 O ATOM 728 CB THR A 58 -0.052 -12.676 -2.970 1.00 0.20 C ATOM 729 OG1 THR A 58 1.272 -12.126 -2.977 1.00 0.24 O ATOM 730 CG2 THR A 58 -0.236 -13.562 -4.193 1.00 0.26 C ATOM 0 H THR A 58 -0.142 -10.975 -1.165 1.00 0.17 H new ATOM 0 HA THR A 58 -0.943 -10.898 -3.809 1.00 0.17 H new ATOM 0 HB THR A 58 -0.195 -13.284 -2.077 1.00 0.20 H new ATOM 0 HG1 THR A 58 1.594 -12.037 -2.056 1.00 0.24 H new ATOM 0 HG21 THR A 58 0.513 -14.354 -4.185 1.00 0.26 H new ATOM 0 HG22 THR A 58 -1.232 -14.005 -4.175 1.00 0.26 H new ATOM 0 HG23 THR A 58 -0.121 -12.963 -5.097 1.00 0.26 H new ATOM 738 N THR A 59 -2.856 -12.800 -1.886 1.00 0.16 N ATOM 739 CA THR A 59 -4.118 -13.509 -1.783 1.00 0.17 C ATOM 740 C THR A 59 -5.293 -12.538 -1.670 1.00 0.16 C ATOM 741 O THR A 59 -6.358 -12.781 -2.227 1.00 0.19 O ATOM 742 CB THR A 59 -4.107 -14.448 -0.561 1.00 0.20 C ATOM 743 OG1 THR A 59 -2.895 -15.215 -0.554 1.00 0.48 O ATOM 744 CG2 THR A 59 -5.304 -15.388 -0.583 1.00 0.46 C ATOM 0 H THR A 59 -2.283 -12.846 -1.044 1.00 0.16 H new ATOM 0 HA THR A 59 -4.241 -14.097 -2.692 1.00 0.17 H new ATOM 0 HB THR A 59 -4.165 -13.838 0.340 1.00 0.20 H new ATOM 0 HG1 THR A 59 -2.203 -14.729 -0.058 1.00 0.48 H new ATOM 0 HG21 THR A 59 -5.271 -16.039 0.290 1.00 0.46 H new ATOM 0 HG22 THR A 59 -6.225 -14.805 -0.567 1.00 0.46 H new ATOM 0 HG23 THR A 59 -5.274 -15.994 -1.489 1.00 0.46 H new ATOM 752 N LEU A 60 -5.083 -11.425 -0.975 1.00 0.13 N ATOM 753 CA LEU A 60 -6.134 -10.452 -0.753 1.00 0.13 C ATOM 754 C LEU A 60 -6.542 -9.819 -2.050 1.00 0.13 C ATOM 755 O LEU A 60 -7.724 -9.760 -2.389 1.00 0.15 O ATOM 756 CB LEU A 60 -5.653 -9.380 0.200 1.00 0.13 C ATOM 757 CG LEU A 60 -5.784 -9.750 1.659 1.00 0.14 C ATOM 758 CD1 LEU A 60 -5.131 -8.700 2.531 1.00 0.43 C ATOM 759 CD2 LEU A 60 -7.250 -9.893 2.009 1.00 0.35 C ATOM 0 H LEU A 60 -4.187 -11.178 -0.555 1.00 0.13 H new ATOM 0 HA LEU A 60 -6.994 -10.964 -0.320 1.00 0.13 H new ATOM 0 HB2 LEU A 60 -4.608 -9.159 -0.016 1.00 0.13 H new ATOM 0 HB3 LEU A 60 -6.216 -8.465 0.016 1.00 0.13 H new ATOM 0 HG LEU A 60 -5.278 -10.699 1.837 1.00 0.14 H new ATOM 0 HD11 LEU A 60 -5.234 -8.982 3.579 1.00 0.43 H new ATOM 0 HD12 LEU A 60 -4.073 -8.624 2.278 1.00 0.43 H new ATOM 0 HD13 LEU A 60 -5.614 -7.737 2.365 1.00 0.43 H new ATOM 0 HD21 LEU A 60 -7.348 -10.160 3.061 1.00 0.35 H new ATOM 0 HD22 LEU A 60 -7.762 -8.948 1.825 1.00 0.35 H new ATOM 0 HD23 LEU A 60 -7.697 -10.674 1.393 1.00 0.35 H new ATOM 771 N TYR A 61 -5.543 -9.362 -2.775 1.00 0.14 N ATOM 772 CA TYR A 61 -5.762 -8.727 -4.042 1.00 0.15 C ATOM 773 C TYR A 61 -6.545 -9.642 -4.965 1.00 0.17 C ATOM 774 O TYR A 61 -7.576 -9.263 -5.444 1.00 0.22 O ATOM 775 CB TYR A 61 -4.441 -8.328 -4.682 1.00 0.17 C ATOM 776 CG TYR A 61 -4.648 -7.681 -6.015 1.00 0.18 C ATOM 777 CD1 TYR A 61 -5.780 -6.922 -6.256 1.00 0.16 C ATOM 778 CD2 TYR A 61 -3.718 -7.816 -7.019 1.00 0.28 C ATOM 779 CE1 TYR A 61 -5.981 -6.314 -7.475 1.00 0.18 C ATOM 780 CE2 TYR A 61 -3.908 -7.213 -8.247 1.00 0.31 C ATOM 781 CZ TYR A 61 -5.040 -6.462 -8.470 1.00 0.23 C ATOM 782 OH TYR A 61 -5.238 -5.875 -9.696 1.00 0.28 O ATOM 0 H TYR A 61 -4.563 -9.423 -2.498 1.00 0.14 H new ATOM 0 HA TYR A 61 -6.346 -7.822 -3.874 1.00 0.15 H new ATOM 0 HB2 TYR A 61 -3.909 -7.642 -4.023 1.00 0.17 H new ATOM 0 HB3 TYR A 61 -3.812 -9.210 -4.799 1.00 0.17 H new ATOM 0 HD1 TYR A 61 -6.517 -6.805 -5.476 1.00 0.16 H new ATOM 0 HD2 TYR A 61 -2.827 -8.401 -6.845 1.00 0.28 H new ATOM 0 HE1 TYR A 61 -6.870 -5.726 -7.650 1.00 0.18 H new ATOM 0 HE2 TYR A 61 -3.172 -7.330 -9.029 1.00 0.31 H new ATOM 0 HH TYR A 61 -4.479 -6.077 -10.282 1.00 0.28 H new ATOM 792 N ASN A 62 -6.082 -10.854 -5.163 1.00 0.18 N ATOM 793 CA ASN A 62 -6.682 -11.752 -6.139 1.00 0.22 C ATOM 794 C ASN A 62 -8.018 -12.288 -5.676 1.00 0.20 C ATOM 795 O ASN A 62 -8.855 -12.657 -6.499 1.00 0.24 O ATOM 796 CB ASN A 62 -5.731 -12.891 -6.481 1.00 0.27 C ATOM 797 CG ASN A 62 -4.755 -12.474 -7.555 1.00 0.75 C ATOM 798 OD1 ASN A 62 -4.939 -12.773 -8.734 1.00 1.21 O ATOM 799 ND2 ASN A 62 -3.735 -11.740 -7.160 1.00 1.12 N ATOM 0 H ASN A 62 -5.287 -11.249 -4.661 1.00 0.18 H new ATOM 0 HA ASN A 62 -6.866 -11.169 -7.042 1.00 0.22 H new ATOM 0 HB2 ASN A 62 -5.186 -13.196 -5.587 1.00 0.27 H new ATOM 0 HB3 ASN A 62 -6.301 -13.757 -6.818 1.00 0.27 H new ATOM 0 HD21 ASN A 62 -3.060 -11.396 -7.843 1.00 1.12 H new ATOM 0 HD22 ASN A 62 -3.621 -11.516 -6.172 1.00 1.12 H new ATOM 806 N LYS A 63 -8.241 -12.328 -4.370 1.00 0.18 N ATOM 807 CA LYS A 63 -9.489 -12.854 -3.873 1.00 0.20 C ATOM 808 C LYS A 63 -10.535 -11.767 -3.939 1.00 0.18 C ATOM 809 O LYS A 63 -11.736 -12.040 -3.987 1.00 0.22 O ATOM 810 CB LYS A 63 -9.343 -13.383 -2.437 1.00 0.26 C ATOM 811 CG LYS A 63 -10.649 -13.887 -1.826 1.00 0.29 C ATOM 812 CD LYS A 63 -10.409 -14.878 -0.695 1.00 0.64 C ATOM 813 CE LYS A 63 -9.786 -14.210 0.517 1.00 0.91 C ATOM 814 NZ LYS A 63 -9.721 -15.124 1.688 1.00 1.54 N ATOM 0 H LYS A 63 -7.587 -12.009 -3.656 1.00 0.18 H new ATOM 0 HA LYS A 63 -9.793 -13.696 -4.494 1.00 0.20 H new ATOM 0 HB2 LYS A 63 -8.614 -14.194 -2.431 1.00 0.26 H new ATOM 0 HB3 LYS A 63 -8.941 -12.589 -1.807 1.00 0.26 H new ATOM 0 HG2 LYS A 63 -11.223 -13.040 -1.449 1.00 0.29 H new ATOM 0 HG3 LYS A 63 -11.252 -14.361 -2.601 1.00 0.29 H new ATOM 0 HD2 LYS A 63 -11.354 -15.340 -0.410 1.00 0.64 H new ATOM 0 HD3 LYS A 63 -9.756 -15.678 -1.045 1.00 0.64 H new ATOM 0 HE2 LYS A 63 -8.781 -13.870 0.267 1.00 0.91 H new ATOM 0 HE3 LYS A 63 -10.365 -13.325 0.780 1.00 0.91 H new ATOM 0 HZ1 LYS A 63 -9.890 -14.583 2.560 1.00 1.54 H new ATOM 0 HZ2 LYS A 63 -10.447 -15.862 1.593 1.00 1.54 H new ATOM 0 HZ3 LYS A 63 -8.781 -15.567 1.731 1.00 1.54 H new ATOM 828 N TYR A 64 -10.083 -10.517 -3.963 1.00 0.16 N ATOM 829 CA TYR A 64 -11.020 -9.431 -3.857 1.00 0.16 C ATOM 830 C TYR A 64 -10.967 -8.432 -4.998 1.00 0.17 C ATOM 831 O TYR A 64 -11.831 -7.558 -5.081 1.00 0.17 O ATOM 832 CB TYR A 64 -10.878 -8.780 -2.497 1.00 0.15 C ATOM 833 CG TYR A 64 -11.276 -9.732 -1.401 1.00 0.17 C ATOM 834 CD1 TYR A 64 -12.526 -10.328 -1.428 1.00 0.19 C ATOM 835 CD2 TYR A 64 -10.414 -10.051 -0.364 1.00 0.19 C ATOM 836 CE1 TYR A 64 -12.912 -11.216 -0.455 1.00 0.23 C ATOM 837 CE2 TYR A 64 -10.794 -10.937 0.623 1.00 0.23 C ATOM 838 CZ TYR A 64 -12.044 -11.519 0.574 1.00 0.24 C ATOM 839 OH TYR A 64 -12.415 -12.420 1.546 1.00 0.31 O ATOM 0 H TYR A 64 -9.103 -10.247 -4.052 1.00 0.16 H new ATOM 0 HA TYR A 64 -12.019 -9.857 -3.950 1.00 0.16 H new ATOM 0 HB2 TYR A 64 -9.847 -8.459 -2.349 1.00 0.15 H new ATOM 0 HB3 TYR A 64 -11.500 -7.886 -2.451 1.00 0.15 H new ATOM 0 HD1 TYR A 64 -13.210 -10.090 -2.229 1.00 0.19 H new ATOM 0 HD2 TYR A 64 -9.433 -9.601 -0.328 1.00 0.19 H new ATOM 0 HE1 TYR A 64 -13.889 -11.675 -0.495 1.00 0.23 H new ATOM 0 HE2 TYR A 64 -10.116 -11.174 1.430 1.00 0.23 H new ATOM 0 HH TYR A 64 -11.737 -12.436 2.253 1.00 0.31 H new ATOM 849 N LYS A 65 -10.012 -8.573 -5.907 1.00 0.20 N ATOM 850 CA LYS A 65 -10.032 -7.773 -7.119 1.00 0.23 C ATOM 851 C LYS A 65 -11.248 -8.158 -7.906 1.00 0.20 C ATOM 852 O LYS A 65 -11.802 -7.355 -8.653 1.00 0.22 O ATOM 853 CB LYS A 65 -8.760 -7.908 -7.972 1.00 0.34 C ATOM 854 CG LYS A 65 -8.230 -9.322 -8.178 1.00 0.29 C ATOM 855 CD LYS A 65 -6.907 -9.278 -8.927 1.00 0.38 C ATOM 856 CE LYS A 65 -7.116 -9.018 -10.408 1.00 0.80 C ATOM 857 NZ LYS A 65 -5.865 -8.582 -11.088 1.00 1.35 N ATOM 0 H LYS A 65 -9.228 -9.222 -5.830 1.00 0.20 H new ATOM 0 HA LYS A 65 -10.067 -6.722 -6.831 1.00 0.23 H new ATOM 0 HB2 LYS A 65 -8.957 -7.471 -8.951 1.00 0.34 H new ATOM 0 HB3 LYS A 65 -7.973 -7.312 -7.509 1.00 0.34 H new ATOM 0 HG2 LYS A 65 -8.095 -9.813 -7.214 1.00 0.29 H new ATOM 0 HG3 LYS A 65 -8.955 -9.913 -8.738 1.00 0.29 H new ATOM 0 HD2 LYS A 65 -6.274 -8.497 -8.505 1.00 0.38 H new ATOM 0 HD3 LYS A 65 -6.380 -10.223 -8.793 1.00 0.38 H new ATOM 0 HE2 LYS A 65 -7.489 -9.925 -10.885 1.00 0.80 H new ATOM 0 HE3 LYS A 65 -7.882 -8.253 -10.536 1.00 0.80 H new ATOM 0 HZ1 LYS A 65 -6.054 -8.433 -12.100 1.00 1.35 H new ATOM 0 HZ2 LYS A 65 -5.531 -7.693 -10.664 1.00 1.35 H new ATOM 0 HZ3 LYS A 65 -5.136 -9.315 -10.976 1.00 1.35 H new ATOM 871 N SER A 66 -11.680 -9.390 -7.668 1.00 0.23 N ATOM 872 CA SER A 66 -12.933 -9.891 -8.207 1.00 0.26 C ATOM 873 C SER A 66 -14.067 -8.884 -7.968 1.00 0.25 C ATOM 874 O SER A 66 -14.883 -8.635 -8.858 1.00 0.31 O ATOM 875 CB SER A 66 -13.263 -11.226 -7.546 1.00 0.32 C ATOM 876 OG SER A 66 -12.094 -12.014 -7.407 1.00 1.28 O ATOM 0 H SER A 66 -11.172 -10.066 -7.098 1.00 0.23 H new ATOM 0 HA SER A 66 -12.829 -10.032 -9.283 1.00 0.26 H new ATOM 0 HB2 SER A 66 -13.710 -11.053 -6.567 1.00 0.32 H new ATOM 0 HB3 SER A 66 -14.001 -11.762 -8.143 1.00 0.32 H new ATOM 0 HG SER A 66 -12.323 -12.866 -6.980 1.00 1.28 H new ATOM 882 N GLN A 67 -14.103 -8.288 -6.773 1.00 0.21 N ATOM 883 CA GLN A 67 -15.073 -7.235 -6.475 1.00 0.20 C ATOM 884 C GLN A 67 -14.599 -5.861 -6.986 1.00 0.20 C ATOM 885 O GLN A 67 -15.398 -5.075 -7.497 1.00 0.27 O ATOM 886 CB GLN A 67 -15.347 -7.176 -4.969 1.00 0.21 C ATOM 887 CG GLN A 67 -16.080 -8.404 -4.447 1.00 0.38 C ATOM 888 CD GLN A 67 -16.312 -8.372 -2.948 1.00 0.52 C ATOM 889 OE1 GLN A 67 -15.392 -8.952 -2.193 1.00 1.11 O flip ATOM 890 NE2 GLN A 67 -17.319 -7.848 -2.470 1.00 0.46 N flip ATOM 0 H GLN A 67 -13.475 -8.516 -6.002 1.00 0.21 H new ATOM 0 HA GLN A 67 -15.998 -7.480 -6.998 1.00 0.20 H new ATOM 0 HB2 GLN A 67 -14.401 -7.072 -4.437 1.00 0.21 H new ATOM 0 HB3 GLN A 67 -15.937 -6.287 -4.748 1.00 0.21 H new ATOM 0 HG2 GLN A 67 -17.041 -8.488 -4.955 1.00 0.38 H new ATOM 0 HG3 GLN A 67 -15.507 -9.296 -4.700 1.00 0.38 H new ATOM 0 HE21 GLN A 67 -18.006 -7.410 -3.084 1.00 0.46 H new ATOM 0 HE22 GLN A 67 -17.466 -7.852 -1.461 1.00 0.46 H new ATOM 899 N GLY A 68 -13.299 -5.598 -6.874 1.00 0.17 N ATOM 900 CA GLY A 68 -12.742 -4.308 -7.240 1.00 0.18 C ATOM 901 C GLY A 68 -11.522 -3.980 -6.396 1.00 0.15 C ATOM 902 O GLY A 68 -10.802 -3.012 -6.662 1.00 0.17 O ATOM 0 H GLY A 68 -12.612 -6.269 -6.530 1.00 0.17 H new ATOM 0 HA2 GLY A 68 -12.468 -4.313 -8.295 1.00 0.18 H new ATOM 0 HA3 GLY A 68 -13.497 -3.532 -7.111 1.00 0.18 H new ATOM 906 N PHE A 69 -11.296 -4.816 -5.383 1.00 0.14 N ATOM 907 CA PHE A 69 -10.203 -4.637 -4.430 1.00 0.13 C ATOM 908 C PHE A 69 -8.859 -4.739 -5.113 1.00 0.14 C ATOM 909 O PHE A 69 -8.691 -5.496 -6.060 1.00 0.18 O ATOM 910 CB PHE A 69 -10.297 -5.703 -3.333 1.00 0.14 C ATOM 911 CG PHE A 69 -9.266 -5.570 -2.259 1.00 0.12 C ATOM 912 CD1 PHE A 69 -9.022 -4.341 -1.723 1.00 0.14 C ATOM 913 CD2 PHE A 69 -8.554 -6.662 -1.782 1.00 0.14 C ATOM 914 CE1 PHE A 69 -8.099 -4.168 -0.747 1.00 0.16 C ATOM 915 CE2 PHE A 69 -7.614 -6.504 -0.781 1.00 0.16 C ATOM 916 CZ PHE A 69 -7.383 -5.249 -0.265 1.00 0.14 C ATOM 0 H PHE A 69 -11.869 -5.640 -5.200 1.00 0.14 H new ATOM 0 HA PHE A 69 -10.293 -3.642 -3.994 1.00 0.13 H new ATOM 0 HB2 PHE A 69 -11.287 -5.655 -2.879 1.00 0.14 H new ATOM 0 HB3 PHE A 69 -10.204 -6.688 -3.790 1.00 0.14 H new ATOM 0 HD1 PHE A 69 -9.576 -3.487 -2.084 1.00 0.14 H new ATOM 0 HD2 PHE A 69 -8.736 -7.643 -2.196 1.00 0.14 H new ATOM 0 HE1 PHE A 69 -7.921 -3.182 -0.343 1.00 0.16 H new ATOM 0 HE2 PHE A 69 -7.066 -7.357 -0.408 1.00 0.16 H new ATOM 0 HZ PHE A 69 -6.646 -5.109 0.512 1.00 0.14 H new ATOM 926 N THR A 70 -7.900 -3.963 -4.656 1.00 0.13 N ATOM 927 CA THR A 70 -6.574 -4.112 -5.115 1.00 0.12 C ATOM 928 C THR A 70 -5.656 -4.112 -3.937 1.00 0.12 C ATOM 929 O THR A 70 -5.974 -3.569 -2.899 1.00 0.19 O ATOM 930 CB THR A 70 -6.170 -2.978 -6.053 1.00 0.15 C ATOM 931 OG1 THR A 70 -5.066 -3.374 -6.858 1.00 0.20 O ATOM 932 CG2 THR A 70 -5.797 -1.728 -5.284 1.00 0.19 C ATOM 0 H THR A 70 -8.035 -3.225 -3.964 1.00 0.13 H new ATOM 0 HA THR A 70 -6.507 -5.050 -5.667 1.00 0.12 H new ATOM 0 HB THR A 70 -7.030 -2.756 -6.685 1.00 0.15 H new ATOM 0 HG1 THR A 70 -5.197 -4.297 -7.161 1.00 0.20 H new ATOM 0 HG21 THR A 70 -5.515 -0.941 -5.983 1.00 0.19 H new ATOM 0 HG22 THR A 70 -6.650 -1.398 -4.691 1.00 0.19 H new ATOM 0 HG23 THR A 70 -4.958 -1.944 -4.623 1.00 0.19 H new ATOM 940 N VAL A 71 -4.559 -4.759 -4.081 1.00 0.13 N ATOM 941 CA VAL A 71 -3.440 -4.475 -3.255 1.00 0.13 C ATOM 942 C VAL A 71 -2.433 -3.743 -4.090 1.00 0.13 C ATOM 943 O VAL A 71 -1.752 -4.335 -4.912 1.00 0.15 O ATOM 944 CB VAL A 71 -2.834 -5.746 -2.673 1.00 0.15 C ATOM 945 CG1 VAL A 71 -1.456 -5.468 -2.095 1.00 0.16 C ATOM 946 CG2 VAL A 71 -3.751 -6.309 -1.607 1.00 0.17 C ATOM 0 H VAL A 71 -4.409 -5.496 -4.770 1.00 0.13 H new ATOM 0 HA VAL A 71 -3.754 -3.864 -2.409 1.00 0.13 H new ATOM 0 HB VAL A 71 -2.724 -6.480 -3.471 1.00 0.15 H new ATOM 0 HG11 VAL A 71 -1.041 -6.389 -1.685 1.00 0.16 H new ATOM 0 HG12 VAL A 71 -0.800 -5.093 -2.881 1.00 0.16 H new ATOM 0 HG13 VAL A 71 -1.537 -4.722 -1.304 1.00 0.16 H new ATOM 0 HG21 VAL A 71 -3.314 -7.218 -1.194 1.00 0.17 H new ATOM 0 HG22 VAL A 71 -3.879 -5.574 -0.812 1.00 0.17 H new ATOM 0 HG23 VAL A 71 -4.721 -6.541 -2.047 1.00 0.17 H new ATOM 956 N LEU A 72 -2.368 -2.448 -3.918 1.00 0.17 N ATOM 957 CA LEU A 72 -1.411 -1.679 -4.674 1.00 0.22 C ATOM 958 C LEU A 72 -0.088 -1.740 -3.941 1.00 0.19 C ATOM 959 O LEU A 72 0.009 -1.302 -2.808 1.00 0.28 O ATOM 960 CB LEU A 72 -1.847 -0.218 -4.811 1.00 0.43 C ATOM 961 CG LEU A 72 -3.140 0.059 -5.560 1.00 0.34 C ATOM 962 CD1 LEU A 72 -3.524 1.517 -5.418 1.00 1.04 C ATOM 963 CD2 LEU A 72 -3.007 -0.293 -7.017 1.00 1.00 C ATOM 0 H LEU A 72 -2.952 -1.912 -3.276 1.00 0.17 H new ATOM 0 HA LEU A 72 -1.330 -2.095 -5.678 1.00 0.22 H new ATOM 0 HB2 LEU A 72 -1.942 0.200 -3.809 1.00 0.43 H new ATOM 0 HB3 LEU A 72 -1.046 0.327 -5.310 1.00 0.43 H new ATOM 0 HG LEU A 72 -3.922 -0.564 -5.125 1.00 0.34 H new ATOM 0 HD11 LEU A 72 -4.452 1.703 -5.959 1.00 1.04 H new ATOM 0 HD12 LEU A 72 -3.664 1.755 -4.364 1.00 1.04 H new ATOM 0 HD13 LEU A 72 -2.732 2.143 -5.829 1.00 1.04 H new ATOM 0 HD21 LEU A 72 -3.947 -0.085 -7.529 1.00 1.00 H new ATOM 0 HD22 LEU A 72 -2.211 0.302 -7.464 1.00 1.00 H new ATOM 0 HD23 LEU A 72 -2.767 -1.352 -7.115 1.00 1.00 H new ATOM 975 N ALA A 73 0.923 -2.280 -4.576 1.00 0.22 N ATOM 976 CA ALA A 73 2.223 -2.374 -3.940 1.00 0.30 C ATOM 977 C ALA A 73 3.120 -1.232 -4.386 1.00 0.23 C ATOM 978 O ALA A 73 3.486 -1.138 -5.549 1.00 0.32 O ATOM 979 CB ALA A 73 2.874 -3.708 -4.234 1.00 0.51 C ATOM 0 H ALA A 73 0.877 -2.658 -5.522 1.00 0.22 H new ATOM 0 HA ALA A 73 2.078 -2.298 -2.862 1.00 0.30 H new ATOM 0 HB1 ALA A 73 3.848 -3.753 -3.746 1.00 0.51 H new ATOM 0 HB2 ALA A 73 2.242 -4.512 -3.858 1.00 0.51 H new ATOM 0 HB3 ALA A 73 3.002 -3.821 -5.311 1.00 0.51 H new ATOM 985 N PHE A 74 3.445 -0.353 -3.472 1.00 0.29 N ATOM 986 CA PHE A 74 4.353 0.741 -3.752 1.00 0.33 C ATOM 987 C PHE A 74 5.702 0.467 -3.084 1.00 0.35 C ATOM 988 O PHE A 74 5.887 0.739 -1.902 1.00 0.37 O ATOM 989 CB PHE A 74 3.741 2.053 -3.264 1.00 0.44 C ATOM 990 CG PHE A 74 2.689 2.636 -4.182 1.00 0.36 C ATOM 991 CD1 PHE A 74 1.399 2.107 -4.273 1.00 0.43 C ATOM 992 CD2 PHE A 74 2.992 3.749 -4.939 1.00 0.41 C ATOM 993 CE1 PHE A 74 0.458 2.687 -5.095 1.00 0.41 C ATOM 994 CE2 PHE A 74 2.050 4.331 -5.760 1.00 0.43 C ATOM 995 CZ PHE A 74 0.782 3.799 -5.834 1.00 0.35 C ATOM 0 H PHE A 74 3.092 -0.371 -2.515 1.00 0.29 H new ATOM 0 HA PHE A 74 4.518 0.826 -4.826 1.00 0.33 H new ATOM 0 HB2 PHE A 74 3.297 1.889 -2.282 1.00 0.44 H new ATOM 0 HB3 PHE A 74 4.538 2.785 -3.135 1.00 0.44 H new ATOM 0 HD1 PHE A 74 1.137 1.234 -3.693 1.00 0.43 H new ATOM 0 HD2 PHE A 74 3.985 4.172 -4.887 1.00 0.41 H new ATOM 0 HE1 PHE A 74 -0.535 2.267 -5.159 1.00 0.41 H new ATOM 0 HE2 PHE A 74 2.306 5.203 -6.344 1.00 0.43 H new ATOM 0 HZ PHE A 74 0.042 4.256 -6.474 1.00 0.35 H new ATOM 1005 N PRO A 75 6.660 -0.082 -3.851 1.00 0.37 N ATOM 1006 CA PRO A 75 7.897 -0.659 -3.312 1.00 0.46 C ATOM 1007 C PRO A 75 8.982 0.360 -2.968 1.00 0.61 C ATOM 1008 O PRO A 75 9.996 0.430 -3.652 1.00 1.30 O ATOM 1009 CB PRO A 75 8.360 -1.584 -4.432 1.00 0.54 C ATOM 1010 CG PRO A 75 7.837 -0.972 -5.687 1.00 0.44 C ATOM 1011 CD PRO A 75 6.604 -0.174 -5.317 1.00 0.38 C ATOM 0 HA PRO A 75 7.711 -1.152 -2.358 1.00 0.46 H new ATOM 0 HB2 PRO A 75 9.447 -1.661 -4.455 1.00 0.54 H new ATOM 0 HB3 PRO A 75 7.972 -2.593 -4.295 1.00 0.54 H new ATOM 0 HG2 PRO A 75 8.589 -0.328 -6.143 1.00 0.44 H new ATOM 0 HG3 PRO A 75 7.591 -1.743 -6.417 1.00 0.44 H new ATOM 0 HD2 PRO A 75 6.615 0.813 -5.779 1.00 0.38 H new ATOM 0 HD3 PRO A 75 5.693 -0.671 -5.650 1.00 0.38 H new ATOM 1019 N SER A 76 8.764 1.055 -1.854 1.00 0.41 N ATOM 1020 CA SER A 76 9.622 2.131 -1.320 1.00 0.37 C ATOM 1021 C SER A 76 11.041 2.162 -1.869 1.00 0.50 C ATOM 1022 O SER A 76 11.760 1.156 -1.881 1.00 0.74 O ATOM 1023 CB SER A 76 9.675 1.982 0.207 1.00 0.53 C ATOM 1024 OG SER A 76 10.428 0.834 0.578 1.00 1.44 O ATOM 0 H SER A 76 7.949 0.882 -1.266 1.00 0.41 H new ATOM 0 HA SER A 76 9.172 3.071 -1.638 1.00 0.37 H new ATOM 0 HB2 SER A 76 10.121 2.873 0.648 1.00 0.53 H new ATOM 0 HB3 SER A 76 8.663 1.902 0.604 1.00 0.53 H new ATOM 0 HG SER A 76 10.993 0.556 -0.173 1.00 1.44 H new ATOM 1030 N ASN A 77 11.464 3.356 -2.251 1.00 0.52 N ATOM 1031 CA ASN A 77 12.786 3.529 -2.809 1.00 0.72 C ATOM 1032 C ASN A 77 13.758 3.849 -1.697 1.00 0.70 C ATOM 1033 O ASN A 77 14.059 5.016 -1.426 1.00 0.75 O ATOM 1034 CB ASN A 77 12.841 4.601 -3.916 1.00 0.93 C ATOM 1035 CG ASN A 77 12.006 5.840 -3.641 1.00 0.96 C ATOM 1036 OD1 ASN A 77 10.885 5.957 -4.123 1.00 1.81 O ATOM 1037 ND2 ASN A 77 12.544 6.773 -2.870 1.00 1.46 N ATOM 0 H ASN A 77 10.912 4.211 -2.184 1.00 0.52 H new ATOM 0 HA ASN A 77 13.067 2.592 -3.290 1.00 0.72 H new ATOM 0 HB2 ASN A 77 13.878 4.903 -4.059 1.00 0.93 H new ATOM 0 HB3 ASN A 77 12.507 4.154 -4.852 1.00 0.93 H new ATOM 0 HD21 ASN A 77 12.022 7.624 -2.660 1.00 1.46 H new ATOM 0 HD22 ASN A 77 13.480 6.641 -2.487 1.00 1.46 H new ATOM 1044 N GLN A 78 14.254 2.786 -1.059 1.00 0.85 N ATOM 1045 CA GLN A 78 15.195 2.881 0.063 1.00 0.98 C ATOM 1046 C GLN A 78 16.398 3.751 -0.282 1.00 0.98 C ATOM 1047 O GLN A 78 17.182 4.118 0.592 1.00 1.12 O ATOM 1048 CB GLN A 78 15.660 1.501 0.518 1.00 1.35 C ATOM 1049 CG GLN A 78 14.528 0.561 0.903 1.00 2.07 C ATOM 1050 CD GLN A 78 15.033 -0.687 1.602 1.00 2.74 C ATOM 1051 OE1 GLN A 78 16.169 -1.107 1.400 1.00 3.34 O ATOM 1052 NE2 GLN A 78 14.187 -1.299 2.415 1.00 3.30 N ATOM 0 H GLN A 78 14.013 1.827 -1.308 1.00 0.85 H new ATOM 0 HA GLN A 78 14.658 3.354 0.885 1.00 0.98 H new ATOM 0 HB2 GLN A 78 16.242 1.043 -0.282 1.00 1.35 H new ATOM 0 HB3 GLN A 78 16.328 1.617 1.372 1.00 1.35 H new ATOM 0 HG2 GLN A 78 13.830 1.084 1.556 1.00 2.07 H new ATOM 0 HG3 GLN A 78 13.975 0.276 0.008 1.00 2.07 H new ATOM 0 HE21 GLN A 78 13.251 -0.919 2.557 1.00 3.30 H new ATOM 0 HE22 GLN A 78 14.471 -2.151 2.899 1.00 3.30 H new ATOM 1061 N PHE A 79 16.522 4.081 -1.558 1.00 0.98 N ATOM 1062 CA PHE A 79 17.623 4.900 -2.049 1.00 1.19 C ATOM 1063 C PHE A 79 17.561 6.290 -1.431 1.00 1.20 C ATOM 1064 O PHE A 79 18.556 7.012 -1.390 1.00 1.54 O ATOM 1065 CB PHE A 79 17.543 5.025 -3.569 1.00 1.32 C ATOM 1066 CG PHE A 79 17.476 3.711 -4.286 1.00 1.57 C ATOM 1067 CD1 PHE A 79 18.621 2.968 -4.502 1.00 1.82 C ATOM 1068 CD2 PHE A 79 16.265 3.222 -4.745 1.00 2.02 C ATOM 1069 CE1 PHE A 79 18.563 1.759 -5.163 1.00 2.25 C ATOM 1070 CE2 PHE A 79 16.198 2.013 -5.407 1.00 2.64 C ATOM 1071 CZ PHE A 79 17.350 1.282 -5.617 1.00 2.68 C ATOM 0 H PHE A 79 15.865 3.790 -2.282 1.00 0.98 H new ATOM 0 HA PHE A 79 18.562 4.421 -1.770 1.00 1.19 H new ATOM 0 HB2 PHE A 79 16.664 5.614 -3.829 1.00 1.32 H new ATOM 0 HB3 PHE A 79 18.413 5.577 -3.924 1.00 1.32 H new ATOM 0 HD1 PHE A 79 19.572 3.338 -4.149 1.00 1.82 H new ATOM 0 HD2 PHE A 79 15.363 3.793 -4.583 1.00 2.02 H new ATOM 0 HE1 PHE A 79 19.465 1.187 -5.325 1.00 2.25 H new ATOM 0 HE2 PHE A 79 15.248 1.640 -5.760 1.00 2.64 H new ATOM 0 HZ PHE A 79 17.302 0.336 -6.137 1.00 2.68 H new ATOM 1081 N GLY A 80 16.383 6.650 -0.948 1.00 1.10 N ATOM 1082 CA GLY A 80 16.210 7.917 -0.272 1.00 1.22 C ATOM 1083 C GLY A 80 16.933 7.945 1.059 1.00 1.24 C ATOM 1084 O GLY A 80 17.650 8.896 1.357 1.00 1.98 O ATOM 0 H GLY A 80 15.538 6.083 -1.013 1.00 1.10 H new ATOM 0 HA2 GLY A 80 16.583 8.722 -0.906 1.00 1.22 H new ATOM 0 HA3 GLY A 80 15.148 8.103 -0.113 1.00 1.22 H new ATOM 1088 N GLY A 81 16.758 6.892 1.852 1.00 1.18 N ATOM 1089 CA GLY A 81 17.425 6.815 3.138 1.00 1.21 C ATOM 1090 C GLY A 81 16.455 6.717 4.296 1.00 1.14 C ATOM 1091 O GLY A 81 16.712 6.023 5.277 1.00 1.49 O ATOM 0 H GLY A 81 16.167 6.092 1.627 1.00 1.18 H new ATOM 0 HA2 GLY A 81 18.085 5.948 3.149 1.00 1.21 H new ATOM 0 HA3 GLY A 81 18.053 7.696 3.270 1.00 1.21 H new ATOM 1095 N GLN A 82 15.328 7.398 4.170 1.00 0.86 N ATOM 1096 CA GLN A 82 14.351 7.474 5.251 1.00 0.82 C ATOM 1097 C GLN A 82 13.403 6.284 5.245 1.00 0.77 C ATOM 1098 O GLN A 82 12.664 6.088 6.198 1.00 0.91 O ATOM 1099 CB GLN A 82 13.533 8.785 5.184 1.00 0.80 C ATOM 1100 CG GLN A 82 12.745 9.045 3.887 1.00 0.75 C ATOM 1101 CD GLN A 82 13.594 9.066 2.629 1.00 1.09 C ATOM 1102 OE1 GLN A 82 13.584 7.970 1.895 1.00 1.74 O flip ATOM 1103 NE2 GLN A 82 14.195 10.076 2.285 1.00 1.14 N flip ATOM 0 H GLN A 82 15.064 7.909 3.328 1.00 0.86 H new ATOM 0 HA GLN A 82 14.920 7.458 6.181 1.00 0.82 H new ATOM 0 HB2 GLN A 82 12.829 8.789 6.016 1.00 0.80 H new ATOM 0 HB3 GLN A 82 14.216 9.620 5.340 1.00 0.80 H new ATOM 0 HG2 GLN A 82 11.980 8.276 3.781 1.00 0.75 H new ATOM 0 HG3 GLN A 82 12.227 10.000 3.977 1.00 0.75 H new ATOM 0 HE21 GLN A 82 14.180 10.905 2.879 1.00 1.14 H new ATOM 0 HE22 GLN A 82 14.710 10.088 1.405 1.00 1.14 H new ATOM 1112 N GLU A 83 13.524 5.440 4.232 1.00 0.75 N ATOM 1113 CA GLU A 83 12.470 4.493 3.872 1.00 0.74 C ATOM 1114 C GLU A 83 12.117 3.527 5.000 1.00 0.72 C ATOM 1115 O GLU A 83 12.949 3.172 5.836 1.00 0.88 O ATOM 1116 CB GLU A 83 12.901 3.729 2.623 1.00 0.87 C ATOM 1117 CG GLU A 83 12.989 4.613 1.395 1.00 1.16 C ATOM 1118 CD GLU A 83 11.708 5.370 1.120 1.00 2.33 C ATOM 1119 OE1 GLU A 83 11.430 6.336 1.855 1.00 2.83 O ATOM 1120 OE2 GLU A 83 10.993 5.006 0.168 1.00 3.07 O ATOM 0 H GLU A 83 14.350 5.389 3.636 1.00 0.75 H new ATOM 0 HA GLU A 83 11.562 5.064 3.676 1.00 0.74 H new ATOM 0 HB2 GLU A 83 13.872 3.266 2.802 1.00 0.87 H new ATOM 0 HB3 GLU A 83 12.193 2.922 2.434 1.00 0.87 H new ATOM 0 HG2 GLU A 83 13.805 5.324 1.524 1.00 1.16 H new ATOM 0 HG3 GLU A 83 13.235 3.999 0.529 1.00 1.16 H new ATOM 1127 N PRO A 84 10.844 3.085 5.002 1.00 0.63 N ATOM 1128 CA PRO A 84 10.228 2.365 6.124 1.00 0.75 C ATOM 1129 C PRO A 84 10.788 0.956 6.267 1.00 1.00 C ATOM 1130 O PRO A 84 10.885 0.423 7.373 1.00 1.75 O ATOM 1131 CB PRO A 84 8.754 2.338 5.719 1.00 1.02 C ATOM 1132 CG PRO A 84 8.770 2.309 4.249 1.00 0.72 C ATOM 1133 CD PRO A 84 9.896 3.224 3.869 1.00 0.61 C ATOM 0 HA PRO A 84 10.411 2.833 7.091 1.00 0.75 H new ATOM 0 HB2 PRO A 84 8.248 1.463 6.127 1.00 1.02 H new ATOM 0 HB3 PRO A 84 8.225 3.215 6.092 1.00 1.02 H new ATOM 0 HG2 PRO A 84 8.935 1.299 3.873 1.00 0.72 H new ATOM 0 HG3 PRO A 84 7.822 2.652 3.835 1.00 0.72 H new ATOM 0 HD2 PRO A 84 10.352 2.930 2.924 1.00 0.61 H new ATOM 0 HD3 PRO A 84 9.556 4.253 3.752 1.00 0.61 H new ATOM 1141 N GLY A 85 11.161 0.361 5.139 1.00 1.45 N ATOM 1142 CA GLY A 85 11.739 -0.966 5.155 1.00 1.82 C ATOM 1143 C GLY A 85 13.134 -0.968 5.742 1.00 1.61 C ATOM 1144 O GLY A 85 13.459 -1.817 6.570 1.00 2.20 O ATOM 0 H GLY A 85 11.072 0.777 4.212 1.00 1.45 H new ATOM 0 HA2 GLY A 85 11.101 -1.633 5.734 1.00 1.82 H new ATOM 0 HA3 GLY A 85 11.772 -1.360 4.139 1.00 1.82 H new ATOM 1148 N ASN A 86 13.956 -0.016 5.304 1.00 1.49 N ATOM 1149 CA ASN A 86 15.309 0.146 5.830 1.00 2.04 C ATOM 1150 C ASN A 86 15.994 1.351 5.184 1.00 1.94 C ATOM 1151 O ASN A 86 15.639 2.491 5.478 1.00 2.70 O ATOM 1152 CB ASN A 86 16.157 -1.121 5.632 1.00 2.78 C ATOM 1153 CG ASN A 86 17.480 -1.054 6.379 1.00 3.58 C ATOM 1154 OD1 ASN A 86 18.494 -1.734 5.866 1.00 4.07 O flip ATOM 1155 ND2 ASN A 86 17.588 -0.398 7.412 1.00 4.20 N flip ATOM 0 H ASN A 86 13.706 0.659 4.581 1.00 1.49 H new ATOM 0 HA ASN A 86 15.223 0.319 6.903 1.00 2.04 H new ATOM 0 HB2 ASN A 86 15.593 -1.989 5.973 1.00 2.78 H new ATOM 0 HB3 ASN A 86 16.350 -1.264 4.569 1.00 2.78 H new ATOM 0 HD21 ASN A 86 16.785 0.113 7.778 1.00 4.20 H new ATOM 0 HD22 ASN A 86 18.481 -0.365 7.904 1.00 4.20 H new ATOM 1162 N GLU A 87 16.935 1.099 4.267 1.00 1.52 N ATOM 1163 CA GLU A 87 17.728 2.167 3.656 1.00 1.46 C ATOM 1164 C GLU A 87 18.788 1.593 2.711 1.00 1.60 C ATOM 1165 O GLU A 87 18.657 1.682 1.492 1.00 2.15 O ATOM 1166 CB GLU A 87 18.387 3.049 4.737 1.00 1.61 C ATOM 1167 CG GLU A 87 19.061 2.273 5.863 1.00 2.19 C ATOM 1168 CD GLU A 87 19.548 3.168 6.981 1.00 2.58 C ATOM 1169 OE1 GLU A 87 20.705 3.628 6.914 1.00 3.02 O ATOM 1170 OE2 GLU A 87 18.781 3.411 7.936 1.00 2.84 O ATOM 0 H GLU A 87 17.165 0.163 3.933 1.00 1.52 H new ATOM 0 HA GLU A 87 17.053 2.790 3.070 1.00 1.46 H new ATOM 0 HB2 GLU A 87 19.128 3.691 4.261 1.00 1.61 H new ATOM 0 HB3 GLU A 87 17.628 3.702 5.167 1.00 1.61 H new ATOM 0 HG2 GLU A 87 18.359 1.544 6.267 1.00 2.19 H new ATOM 0 HG3 GLU A 87 19.904 1.713 5.458 1.00 2.19 H new ATOM 1177 N GLU A 88 19.817 0.977 3.278 1.00 1.57 N ATOM 1178 CA GLU A 88 20.941 0.457 2.501 1.00 1.77 C ATOM 1179 C GLU A 88 20.627 -0.917 1.921 1.00 1.62 C ATOM 1180 O GLU A 88 21.338 -1.410 1.050 1.00 1.62 O ATOM 1181 CB GLU A 88 22.179 0.347 3.392 1.00 2.18 C ATOM 1182 CG GLU A 88 22.613 1.663 4.021 1.00 2.68 C ATOM 1183 CD GLU A 88 23.039 2.691 2.996 1.00 3.33 C ATOM 1184 OE1 GLU A 88 23.985 2.420 2.228 1.00 3.92 O ATOM 1185 OE2 GLU A 88 22.429 3.775 2.944 1.00 3.66 O ATOM 0 H GLU A 88 19.899 0.823 4.283 1.00 1.57 H new ATOM 0 HA GLU A 88 21.126 1.149 1.679 1.00 1.77 H new ATOM 0 HB2 GLU A 88 21.979 -0.374 4.185 1.00 2.18 H new ATOM 0 HB3 GLU A 88 23.004 -0.050 2.801 1.00 2.18 H new ATOM 0 HG2 GLU A 88 21.791 2.066 4.613 1.00 2.68 H new ATOM 0 HG3 GLU A 88 23.439 1.477 4.707 1.00 2.68 H new ATOM 1192 N GLU A 89 19.539 -1.503 2.393 1.00 1.62 N ATOM 1193 CA GLU A 89 19.216 -2.900 2.124 1.00 1.59 C ATOM 1194 C GLU A 89 19.148 -3.204 0.626 1.00 1.49 C ATOM 1195 O GLU A 89 19.931 -4.001 0.117 1.00 1.59 O ATOM 1196 CB GLU A 89 17.893 -3.230 2.809 1.00 1.70 C ATOM 1197 CG GLU A 89 17.632 -4.710 3.011 1.00 1.75 C ATOM 1198 CD GLU A 89 16.617 -4.941 4.108 1.00 2.11 C ATOM 1199 OE1 GLU A 89 15.582 -4.243 4.121 1.00 2.65 O ATOM 1200 OE2 GLU A 89 16.867 -5.790 4.987 1.00 2.45 O ATOM 0 H GLU A 89 18.851 -1.025 2.975 1.00 1.62 H new ATOM 0 HA GLU A 89 20.013 -3.527 2.523 1.00 1.59 H new ATOM 0 HB2 GLU A 89 17.870 -2.736 3.780 1.00 1.70 H new ATOM 0 HB3 GLU A 89 17.079 -2.810 2.218 1.00 1.70 H new ATOM 0 HG2 GLU A 89 17.272 -5.149 2.080 1.00 1.75 H new ATOM 0 HG3 GLU A 89 18.564 -5.216 3.262 1.00 1.75 H new ATOM 1207 N ILE A 90 18.244 -2.547 -0.088 1.00 1.43 N ATOM 1208 CA ILE A 90 18.078 -2.798 -1.521 1.00 1.39 C ATOM 1209 C ILE A 90 19.172 -2.128 -2.349 1.00 1.49 C ATOM 1210 O ILE A 90 19.141 -2.168 -3.579 1.00 1.57 O ATOM 1211 CB ILE A 90 16.711 -2.313 -2.035 1.00 1.45 C ATOM 1212 CG1 ILE A 90 16.550 -0.814 -1.795 1.00 1.74 C ATOM 1213 CG2 ILE A 90 15.596 -3.088 -1.356 1.00 1.76 C ATOM 1214 CD1 ILE A 90 15.427 -0.188 -2.595 1.00 2.15 C ATOM 0 H ILE A 90 17.616 -1.840 0.294 1.00 1.43 H new ATOM 0 HA ILE A 90 18.146 -3.879 -1.641 1.00 1.39 H new ATOM 0 HB ILE A 90 16.656 -2.492 -3.109 1.00 1.45 H new ATOM 0 HG12 ILE A 90 16.368 -0.642 -0.734 1.00 1.74 H new ATOM 0 HG13 ILE A 90 17.485 -0.312 -2.044 1.00 1.74 H new ATOM 0 HG21 ILE A 90 14.632 -2.738 -1.726 1.00 1.76 H new ATOM 0 HG22 ILE A 90 15.705 -4.150 -1.576 1.00 1.76 H new ATOM 0 HG23 ILE A 90 15.649 -2.933 -0.278 1.00 1.76 H new ATOM 0 HD11 ILE A 90 15.372 0.878 -2.373 1.00 2.15 H new ATOM 0 HD12 ILE A 90 15.617 -0.328 -3.659 1.00 2.15 H new ATOM 0 HD13 ILE A 90 14.482 -0.663 -2.329 1.00 2.15 H new ATOM 1226 N LYS A 91 20.128 -1.502 -1.677 1.00 1.71 N ATOM 1227 CA LYS A 91 21.230 -0.850 -2.363 1.00 1.89 C ATOM 1228 C LYS A 91 22.474 -1.726 -2.319 1.00 1.98 C ATOM 1229 O LYS A 91 23.217 -1.812 -3.299 1.00 2.17 O ATOM 1230 CB LYS A 91 21.527 0.518 -1.744 1.00 2.00 C ATOM 1231 CG LYS A 91 20.381 1.514 -1.863 1.00 2.10 C ATOM 1232 CD LYS A 91 20.808 2.908 -1.430 1.00 2.33 C ATOM 1233 CE LYS A 91 21.246 2.933 0.023 1.00 2.39 C ATOM 1234 NZ LYS A 91 21.828 4.244 0.411 1.00 2.79 N ATOM 0 H LYS A 91 20.161 -1.433 -0.660 1.00 1.71 H new ATOM 0 HA LYS A 91 20.940 -0.700 -3.403 1.00 1.89 H new ATOM 0 HB2 LYS A 91 21.770 0.383 -0.690 1.00 2.00 H new ATOM 0 HB3 LYS A 91 22.411 0.938 -2.224 1.00 2.00 H new ATOM 0 HG2 LYS A 91 20.029 1.544 -2.894 1.00 2.10 H new ATOM 0 HG3 LYS A 91 19.543 1.182 -1.250 1.00 2.10 H new ATOM 0 HD2 LYS A 91 21.626 3.251 -2.063 1.00 2.33 H new ATOM 0 HD3 LYS A 91 19.981 3.603 -1.573 1.00 2.33 H new ATOM 0 HE2 LYS A 91 20.391 2.713 0.662 1.00 2.39 H new ATOM 0 HE3 LYS A 91 21.981 2.146 0.193 1.00 2.39 H new ATOM 0 HZ1 LYS A 91 21.909 4.295 1.447 1.00 2.79 H new ATOM 0 HZ2 LYS A 91 22.771 4.345 -0.015 1.00 2.79 H new ATOM 0 HZ3 LYS A 91 21.212 5.011 0.074 1.00 2.79 H new ATOM 1248 N GLU A 92 22.700 -2.377 -1.184 1.00 2.07 N ATOM 1249 CA GLU A 92 23.835 -3.276 -1.042 1.00 2.27 C ATOM 1250 C GLU A 92 23.469 -4.677 -1.519 1.00 2.10 C ATOM 1251 O GLU A 92 24.277 -5.355 -2.154 1.00 2.26 O ATOM 1252 CB GLU A 92 24.327 -3.317 0.410 1.00 2.54 C ATOM 1253 CG GLU A 92 23.299 -3.837 1.401 1.00 2.47 C ATOM 1254 CD GLU A 92 23.849 -3.939 2.805 1.00 2.96 C ATOM 1255 OE1 GLU A 92 24.453 -4.981 3.136 1.00 3.29 O ATOM 1256 OE2 GLU A 92 23.676 -2.980 3.585 1.00 3.20 O ATOM 0 H GLU A 92 22.114 -2.299 -0.353 1.00 2.07 H new ATOM 0 HA GLU A 92 24.646 -2.896 -1.664 1.00 2.27 H new ATOM 0 HB2 GLU A 92 25.216 -3.945 0.463 1.00 2.54 H new ATOM 0 HB3 GLU A 92 24.628 -2.313 0.709 1.00 2.54 H new ATOM 0 HG2 GLU A 92 22.432 -3.176 1.401 1.00 2.47 H new ATOM 0 HG3 GLU A 92 22.952 -4.818 1.078 1.00 2.47 H new ATOM 1263 N PHE A 93 22.244 -5.103 -1.227 1.00 1.86 N ATOM 1264 CA PHE A 93 21.781 -6.416 -1.647 1.00 1.75 C ATOM 1265 C PHE A 93 21.103 -6.317 -2.998 1.00 1.59 C ATOM 1266 O PHE A 93 20.704 -5.235 -3.430 1.00 1.69 O ATOM 1267 CB PHE A 93 20.784 -7.013 -0.649 1.00 1.73 C ATOM 1268 CG PHE A 93 21.299 -7.155 0.757 1.00 2.09 C ATOM 1269 CD1 PHE A 93 22.330 -8.032 1.046 1.00 2.34 C ATOM 1270 CD2 PHE A 93 20.742 -6.421 1.792 1.00 2.65 C ATOM 1271 CE1 PHE A 93 22.796 -8.173 2.338 1.00 2.87 C ATOM 1272 CE2 PHE A 93 21.203 -6.559 3.087 1.00 3.40 C ATOM 1273 CZ PHE A 93 22.233 -7.436 3.360 1.00 3.42 C ATOM 0 H PHE A 93 21.558 -4.559 -0.703 1.00 1.86 H new ATOM 0 HA PHE A 93 22.655 -7.064 -1.701 1.00 1.75 H new ATOM 0 HB2 PHE A 93 19.892 -6.387 -0.631 1.00 1.73 H new ATOM 0 HB3 PHE A 93 20.477 -7.995 -1.008 1.00 1.73 H new ATOM 0 HD1 PHE A 93 22.775 -8.613 0.252 1.00 2.34 H new ATOM 0 HD2 PHE A 93 19.937 -5.732 1.584 1.00 2.65 H new ATOM 0 HE1 PHE A 93 23.602 -8.861 2.549 1.00 2.87 H new ATOM 0 HE2 PHE A 93 20.758 -5.982 3.884 1.00 3.40 H new ATOM 0 HZ PHE A 93 22.598 -7.545 4.371 1.00 3.42 H new ATOM 1283 N VAL A 94 20.982 -7.449 -3.660 1.00 1.62 N ATOM 1284 CA VAL A 94 20.251 -7.527 -4.907 1.00 1.68 C ATOM 1285 C VAL A 94 18.756 -7.605 -4.639 1.00 1.54 C ATOM 1286 O VAL A 94 18.261 -8.580 -4.079 1.00 1.74 O ATOM 1287 CB VAL A 94 20.712 -8.740 -5.747 1.00 2.11 C ATOM 1288 CG1 VAL A 94 20.721 -10.020 -4.922 1.00 2.63 C ATOM 1289 CG2 VAL A 94 19.840 -8.909 -6.983 1.00 2.56 C ATOM 0 H VAL A 94 21.384 -8.334 -3.352 1.00 1.62 H new ATOM 0 HA VAL A 94 20.459 -6.622 -5.479 1.00 1.68 H new ATOM 0 HB VAL A 94 21.734 -8.543 -6.070 1.00 2.11 H new ATOM 0 HG11 VAL A 94 21.050 -10.852 -5.545 1.00 2.63 H new ATOM 0 HG12 VAL A 94 21.403 -9.905 -4.080 1.00 2.63 H new ATOM 0 HG13 VAL A 94 19.716 -10.220 -4.550 1.00 2.63 H new ATOM 0 HG21 VAL A 94 20.185 -9.769 -7.557 1.00 2.56 H new ATOM 0 HG22 VAL A 94 18.805 -9.067 -6.679 1.00 2.56 H new ATOM 0 HG23 VAL A 94 19.904 -8.012 -7.599 1.00 2.56 H new ATOM 1299 N CYS A 95 18.041 -6.559 -5.010 1.00 1.47 N ATOM 1300 CA CYS A 95 16.604 -6.533 -4.824 1.00 1.46 C ATOM 1301 C CYS A 95 15.932 -5.887 -6.008 1.00 1.37 C ATOM 1302 O CYS A 95 16.215 -4.743 -6.360 1.00 1.52 O ATOM 1303 CB CYS A 95 16.220 -5.783 -3.546 1.00 1.77 C ATOM 1304 SG CYS A 95 17.326 -6.090 -2.146 1.00 2.83 S ATOM 0 H CYS A 95 18.431 -5.720 -5.440 1.00 1.47 H new ATOM 0 HA CYS A 95 16.266 -7.565 -4.733 1.00 1.46 H new ATOM 0 HB2 CYS A 95 16.206 -4.713 -3.756 1.00 1.77 H new ATOM 0 HB3 CYS A 95 15.206 -6.066 -3.263 1.00 1.77 H new ATOM 0 HG CYS A 95 16.785 -6.963 -1.349 1.00 2.83 H new ATOM 1310 N THR A 96 15.051 -6.643 -6.619 1.00 1.52 N ATOM 1311 CA THR A 96 14.166 -6.127 -7.624 1.00 1.59 C ATOM 1312 C THR A 96 13.160 -5.200 -6.962 1.00 1.08 C ATOM 1313 O THR A 96 13.052 -5.174 -5.734 1.00 1.31 O ATOM 1314 CB THR A 96 13.450 -7.276 -8.350 1.00 2.27 C ATOM 1315 OG1 THR A 96 13.106 -8.303 -7.408 1.00 2.76 O ATOM 1316 CG2 THR A 96 14.340 -7.855 -9.441 1.00 2.98 C ATOM 0 H THR A 96 14.931 -7.638 -6.429 1.00 1.52 H new ATOM 0 HA THR A 96 14.738 -5.570 -8.366 1.00 1.59 H new ATOM 0 HB THR A 96 12.542 -6.887 -8.811 1.00 2.27 H new ATOM 0 HG1 THR A 96 13.833 -8.958 -7.358 1.00 2.76 H new ATOM 0 HG21 THR A 96 13.816 -8.668 -9.945 1.00 2.98 H new ATOM 0 HG22 THR A 96 14.582 -7.076 -10.164 1.00 2.98 H new ATOM 0 HG23 THR A 96 15.259 -8.236 -8.996 1.00 2.98 H new ATOM 1324 N LYS A 97 12.496 -4.384 -7.762 1.00 1.14 N ATOM 1325 CA LYS A 97 11.455 -3.476 -7.266 1.00 1.11 C ATOM 1326 C LYS A 97 10.239 -4.244 -6.736 1.00 1.04 C ATOM 1327 O LYS A 97 9.098 -3.948 -7.099 1.00 1.76 O ATOM 1328 CB LYS A 97 11.009 -2.502 -8.365 1.00 1.47 C ATOM 1329 CG LYS A 97 10.509 -3.184 -9.636 1.00 1.47 C ATOM 1330 CD LYS A 97 9.952 -2.188 -10.649 1.00 1.89 C ATOM 1331 CE LYS A 97 11.009 -1.201 -11.123 1.00 2.34 C ATOM 1332 NZ LYS A 97 10.528 -0.364 -12.254 1.00 2.72 N ATOM 0 H LYS A 97 12.655 -4.326 -8.768 1.00 1.14 H new ATOM 0 HA LYS A 97 11.891 -2.912 -6.442 1.00 1.11 H new ATOM 0 HB2 LYS A 97 10.217 -1.865 -7.972 1.00 1.47 H new ATOM 0 HB3 LYS A 97 11.845 -1.851 -8.620 1.00 1.47 H new ATOM 0 HG2 LYS A 97 11.327 -3.742 -10.091 1.00 1.47 H new ATOM 0 HG3 LYS A 97 9.735 -3.906 -9.377 1.00 1.47 H new ATOM 0 HD2 LYS A 97 9.552 -2.729 -11.506 1.00 1.89 H new ATOM 0 HD3 LYS A 97 9.122 -1.642 -10.201 1.00 1.89 H new ATOM 0 HE2 LYS A 97 11.300 -0.556 -10.294 1.00 2.34 H new ATOM 0 HE3 LYS A 97 11.901 -1.746 -11.430 1.00 2.34 H new ATOM 0 HZ1 LYS A 97 10.996 0.564 -12.223 1.00 2.72 H new ATOM 0 HZ2 LYS A 97 10.752 -0.834 -13.154 1.00 2.72 H new ATOM 0 HZ3 LYS A 97 9.499 -0.235 -12.178 1.00 2.72 H new ATOM 1346 N PHE A 98 10.503 -5.212 -5.863 1.00 0.89 N ATOM 1347 CA PHE A 98 9.483 -6.066 -5.282 1.00 0.92 C ATOM 1348 C PHE A 98 8.828 -6.931 -6.363 1.00 1.11 C ATOM 1349 O PHE A 98 9.299 -8.033 -6.652 1.00 2.12 O ATOM 1350 CB PHE A 98 8.447 -5.223 -4.527 1.00 1.15 C ATOM 1351 CG PHE A 98 7.285 -6.013 -4.023 1.00 0.75 C ATOM 1352 CD1 PHE A 98 7.447 -6.940 -3.014 1.00 1.02 C ATOM 1353 CD2 PHE A 98 6.030 -5.840 -4.578 1.00 0.96 C ATOM 1354 CE1 PHE A 98 6.375 -7.673 -2.568 1.00 0.94 C ATOM 1355 CE2 PHE A 98 4.959 -6.574 -4.134 1.00 0.87 C ATOM 1356 CZ PHE A 98 5.133 -7.484 -3.134 1.00 0.45 C ATOM 0 H PHE A 98 11.446 -5.425 -5.538 1.00 0.89 H new ATOM 0 HA PHE A 98 9.952 -6.737 -4.563 1.00 0.92 H new ATOM 0 HB2 PHE A 98 8.935 -4.732 -3.685 1.00 1.15 H new ATOM 0 HB3 PHE A 98 8.082 -4.436 -5.186 1.00 1.15 H new ATOM 0 HD1 PHE A 98 8.421 -7.090 -2.573 1.00 1.02 H new ATOM 0 HD2 PHE A 98 5.891 -5.119 -5.370 1.00 0.96 H new ATOM 0 HE1 PHE A 98 6.505 -8.396 -1.776 1.00 0.94 H new ATOM 0 HE2 PHE A 98 3.983 -6.431 -4.575 1.00 0.87 H new ATOM 0 HZ PHE A 98 4.291 -8.061 -2.783 1.00 0.45 H new ATOM 1366 N LYS A 99 7.769 -6.398 -6.974 1.00 0.80 N ATOM 1367 CA LYS A 99 7.013 -7.074 -8.027 1.00 0.78 C ATOM 1368 C LYS A 99 6.307 -8.319 -7.504 1.00 0.79 C ATOM 1369 O LYS A 99 6.842 -9.067 -6.691 1.00 1.43 O ATOM 1370 CB LYS A 99 7.917 -7.403 -9.222 1.00 1.02 C ATOM 1371 CG LYS A 99 7.180 -7.996 -10.409 1.00 1.34 C ATOM 1372 CD LYS A 99 8.096 -8.138 -11.612 1.00 1.63 C ATOM 1373 CE LYS A 99 8.590 -6.785 -12.108 1.00 2.05 C ATOM 1374 NZ LYS A 99 7.469 -5.921 -12.567 1.00 2.69 N ATOM 0 H LYS A 99 7.408 -5.471 -6.747 1.00 0.80 H new ATOM 0 HA LYS A 99 6.238 -6.388 -8.370 1.00 0.78 H new ATOM 0 HB2 LYS A 99 8.426 -6.493 -9.541 1.00 1.02 H new ATOM 0 HB3 LYS A 99 8.688 -8.103 -8.899 1.00 1.02 H new ATOM 0 HG2 LYS A 99 6.777 -8.972 -10.139 1.00 1.34 H new ATOM 0 HG3 LYS A 99 6.332 -7.361 -10.668 1.00 1.34 H new ATOM 0 HD2 LYS A 99 8.950 -8.762 -11.348 1.00 1.63 H new ATOM 0 HD3 LYS A 99 7.565 -8.648 -12.416 1.00 1.63 H new ATOM 0 HE2 LYS A 99 9.133 -6.281 -11.309 1.00 2.05 H new ATOM 0 HE3 LYS A 99 9.294 -6.933 -12.927 1.00 2.05 H new ATOM 0 HZ1 LYS A 99 7.850 -5.110 -13.095 1.00 2.69 H new ATOM 0 HZ2 LYS A 99 6.838 -6.470 -13.184 1.00 2.69 H new ATOM 0 HZ3 LYS A 99 6.935 -5.578 -11.743 1.00 2.69 H new ATOM 1388 N ALA A 100 5.088 -8.527 -7.977 1.00 0.51 N ATOM 1389 CA ALA A 100 4.238 -9.583 -7.460 1.00 0.43 C ATOM 1390 C ALA A 100 3.001 -9.753 -8.314 1.00 0.40 C ATOM 1391 O ALA A 100 3.010 -9.447 -9.506 1.00 0.55 O ATOM 1392 CB ALA A 100 3.808 -9.255 -6.050 1.00 0.43 C ATOM 0 H ALA A 100 4.665 -7.974 -8.722 1.00 0.51 H new ATOM 0 HA ALA A 100 4.813 -10.509 -7.474 1.00 0.43 H new ATOM 0 HB1 ALA A 100 3.170 -10.053 -5.669 1.00 0.43 H new ATOM 0 HB2 ALA A 100 4.688 -9.159 -5.414 1.00 0.43 H new ATOM 0 HB3 ALA A 100 3.255 -8.316 -6.047 1.00 0.43 H new ATOM 1398 N GLU A 101 1.929 -10.208 -7.681 1.00 0.34 N ATOM 1399 CA GLU A 101 0.676 -10.420 -8.370 1.00 0.40 C ATOM 1400 C GLU A 101 -0.267 -9.228 -8.190 1.00 0.43 C ATOM 1401 O GLU A 101 -1.483 -9.369 -8.321 1.00 0.67 O ATOM 1402 CB GLU A 101 0.000 -11.698 -7.867 1.00 0.50 C ATOM 1403 CG GLU A 101 0.867 -12.940 -7.995 1.00 0.67 C ATOM 1404 CD GLU A 101 1.391 -13.139 -9.402 1.00 1.24 C ATOM 1405 OE1 GLU A 101 0.586 -13.456 -10.301 1.00 1.57 O ATOM 1406 OE2 GLU A 101 2.608 -12.974 -9.616 1.00 1.99 O ATOM 0 H GLU A 101 1.908 -10.437 -6.687 1.00 0.34 H new ATOM 0 HA GLU A 101 0.896 -10.524 -9.432 1.00 0.40 H new ATOM 0 HB2 GLU A 101 -0.276 -11.565 -6.821 1.00 0.50 H new ATOM 0 HB3 GLU A 101 -0.925 -11.852 -8.423 1.00 0.50 H new ATOM 0 HG2 GLU A 101 1.707 -12.865 -7.305 1.00 0.67 H new ATOM 0 HG3 GLU A 101 0.288 -13.815 -7.699 1.00 0.67 H new ATOM 1413 N PHE A 102 0.295 -8.058 -7.890 1.00 0.38 N ATOM 1414 CA PHE A 102 -0.497 -6.866 -7.649 1.00 0.40 C ATOM 1415 C PHE A 102 -0.293 -5.853 -8.756 1.00 0.45 C ATOM 1416 O PHE A 102 0.417 -6.098 -9.730 1.00 0.80 O ATOM 1417 CB PHE A 102 -0.078 -6.156 -6.378 1.00 0.84 C ATOM 1418 CG PHE A 102 0.388 -7.026 -5.313 1.00 0.45 C ATOM 1419 CD1 PHE A 102 -0.445 -7.945 -4.740 1.00 0.52 C ATOM 1420 CD2 PHE A 102 1.674 -6.911 -4.879 1.00 0.62 C ATOM 1421 CE1 PHE A 102 0.015 -8.745 -3.744 1.00 0.59 C ATOM 1422 CE2 PHE A 102 2.140 -7.703 -3.885 1.00 0.58 C ATOM 1423 CZ PHE A 102 1.309 -8.631 -3.313 1.00 0.44 C ATOM 0 H PHE A 102 1.302 -7.916 -7.809 1.00 0.38 H new ATOM 0 HA PHE A 102 -1.530 -7.207 -7.586 1.00 0.40 H new ATOM 0 HB2 PHE A 102 0.714 -5.447 -6.620 1.00 0.84 H new ATOM 0 HB3 PHE A 102 -0.923 -5.576 -6.009 1.00 0.84 H new ATOM 0 HD1 PHE A 102 -1.467 -8.035 -5.078 1.00 0.52 H new ATOM 0 HD2 PHE A 102 2.328 -6.181 -5.332 1.00 0.62 H new ATOM 0 HE1 PHE A 102 -0.642 -9.473 -3.291 1.00 0.59 H new ATOM 0 HE2 PHE A 102 3.160 -7.604 -3.545 1.00 0.58 H new ATOM 0 HZ PHE A 102 1.675 -9.271 -2.524 1.00 0.44 H new ATOM 1433 N PRO A 103 -0.921 -4.694 -8.596 1.00 0.33 N ATOM 1434 CA PRO A 103 -0.515 -3.459 -9.236 1.00 0.39 C ATOM 1435 C PRO A 103 0.621 -2.830 -8.447 1.00 0.41 C ATOM 1436 O PRO A 103 0.411 -1.919 -7.643 1.00 0.62 O ATOM 1437 CB PRO A 103 -1.792 -2.603 -9.188 1.00 0.42 C ATOM 1438 CG PRO A 103 -2.854 -3.549 -8.733 1.00 0.58 C ATOM 1439 CD PRO A 103 -2.142 -4.489 -7.832 1.00 0.27 C ATOM 0 HA PRO A 103 -0.143 -3.580 -10.253 1.00 0.39 H new ATOM 0 HB2 PRO A 103 -1.684 -1.765 -8.499 1.00 0.42 H new ATOM 0 HB3 PRO A 103 -2.026 -2.183 -10.166 1.00 0.42 H new ATOM 0 HG2 PRO A 103 -3.656 -3.027 -8.211 1.00 0.58 H new ATOM 0 HG3 PRO A 103 -3.309 -4.071 -9.574 1.00 0.58 H new ATOM 0 HD2 PRO A 103 -1.951 -4.060 -6.848 1.00 0.27 H new ATOM 0 HD3 PRO A 103 -2.695 -5.415 -7.674 1.00 0.27 H new ATOM 1447 N ILE A 104 1.823 -3.368 -8.637 1.00 0.35 N ATOM 1448 CA ILE A 104 2.994 -2.845 -7.962 1.00 0.35 C ATOM 1449 C ILE A 104 3.521 -1.682 -8.770 1.00 0.33 C ATOM 1450 O ILE A 104 3.734 -1.797 -9.975 1.00 0.44 O ATOM 1451 CB ILE A 104 4.133 -3.874 -7.759 1.00 0.41 C ATOM 1452 CG1 ILE A 104 3.606 -5.176 -7.128 1.00 0.52 C ATOM 1453 CG2 ILE A 104 5.250 -3.250 -6.916 1.00 0.45 C ATOM 1454 CD1 ILE A 104 3.063 -6.147 -8.148 1.00 1.34 C ATOM 0 H ILE A 104 2.005 -4.162 -9.251 1.00 0.35 H new ATOM 0 HA ILE A 104 2.676 -2.551 -6.962 1.00 0.35 H new ATOM 0 HB ILE A 104 4.543 -4.140 -8.733 1.00 0.41 H new ATOM 0 HG12 ILE A 104 4.411 -5.655 -6.571 1.00 0.52 H new ATOM 0 HG13 ILE A 104 2.822 -4.934 -6.411 1.00 0.52 H new ATOM 0 HG21 ILE A 104 6.049 -3.977 -6.776 1.00 0.45 H new ATOM 0 HG22 ILE A 104 5.644 -2.372 -7.427 1.00 0.45 H new ATOM 0 HG23 ILE A 104 4.852 -2.956 -5.945 1.00 0.45 H new ATOM 0 HD11 ILE A 104 2.707 -7.045 -7.642 1.00 1.34 H new ATOM 0 HD12 ILE A 104 2.238 -5.683 -8.688 1.00 1.34 H new ATOM 0 HD13 ILE A 104 3.852 -6.415 -8.851 1.00 1.34 H new ATOM 1466 N MET A 105 3.710 -0.571 -8.104 1.00 0.29 N ATOM 1467 CA MET A 105 3.996 0.681 -8.763 1.00 0.30 C ATOM 1468 C MET A 105 5.492 0.939 -8.783 1.00 0.27 C ATOM 1469 O MET A 105 6.282 0.103 -8.347 1.00 0.35 O ATOM 1470 CB MET A 105 3.247 1.783 -8.031 1.00 0.43 C ATOM 1471 CG MET A 105 1.832 1.383 -7.670 1.00 1.50 C ATOM 1472 SD MET A 105 0.647 1.567 -9.024 1.00 2.49 S ATOM 1473 CE MET A 105 1.027 0.166 -10.070 1.00 3.03 C ATOM 0 H MET A 105 3.670 -0.508 -7.087 1.00 0.29 H new ATOM 0 HA MET A 105 3.665 0.650 -9.801 1.00 0.30 H new ATOM 0 HB2 MET A 105 3.790 2.045 -7.123 1.00 0.43 H new ATOM 0 HB3 MET A 105 3.220 2.676 -8.655 1.00 0.43 H new ATOM 0 HG2 MET A 105 1.832 0.344 -7.340 1.00 1.50 H new ATOM 0 HG3 MET A 105 1.499 1.986 -6.825 1.00 1.50 H new ATOM 0 HE1 MET A 105 0.199 -0.011 -10.756 1.00 3.03 H new ATOM 0 HE2 MET A 105 1.933 0.372 -10.640 1.00 3.03 H new ATOM 0 HE3 MET A 105 1.181 -0.718 -9.452 1.00 3.03 H new ATOM 1483 N ALA A 106 5.882 2.099 -9.278 1.00 0.33 N ATOM 1484 CA ALA A 106 7.285 2.357 -9.592 1.00 0.52 C ATOM 1485 C ALA A 106 8.080 2.830 -8.398 1.00 0.66 C ATOM 1486 O ALA A 106 9.019 3.597 -8.574 1.00 1.46 O ATOM 1487 CB ALA A 106 7.397 3.379 -10.693 1.00 0.70 C ATOM 0 H ALA A 106 5.254 2.878 -9.473 1.00 0.33 H new ATOM 0 HA ALA A 106 7.706 1.404 -9.913 1.00 0.52 H new ATOM 0 HB1 ALA A 106 8.449 3.560 -10.915 1.00 0.70 H new ATOM 0 HB2 ALA A 106 6.896 3.007 -11.587 1.00 0.70 H new ATOM 0 HB3 ALA A 106 6.928 4.310 -10.375 1.00 0.70 H new ATOM 1493 N LYS A 107 7.710 2.337 -7.217 1.00 0.40 N ATOM 1494 CA LYS A 107 8.316 2.720 -5.934 1.00 0.36 C ATOM 1495 C LYS A 107 8.309 4.215 -5.710 1.00 0.38 C ATOM 1496 O LYS A 107 8.732 5.025 -6.531 1.00 0.59 O ATOM 1497 CB LYS A 107 9.738 2.163 -5.754 1.00 0.49 C ATOM 1498 CG LYS A 107 10.816 2.834 -6.575 1.00 0.84 C ATOM 1499 CD LYS A 107 12.158 2.121 -6.458 1.00 0.83 C ATOM 1500 CE LYS A 107 12.063 0.651 -6.852 1.00 0.95 C ATOM 1501 NZ LYS A 107 13.405 0.008 -6.939 1.00 1.76 N ATOM 0 H LYS A 107 6.966 1.646 -7.119 1.00 0.40 H new ATOM 0 HA LYS A 107 7.682 2.263 -5.175 1.00 0.36 H new ATOM 0 HB2 LYS A 107 10.008 2.241 -4.701 1.00 0.49 H new ATOM 0 HB3 LYS A 107 9.726 1.102 -6.002 1.00 0.49 H new ATOM 0 HG2 LYS A 107 10.510 2.860 -7.621 1.00 0.84 H new ATOM 0 HG3 LYS A 107 10.927 3.868 -6.250 1.00 0.84 H new ATOM 0 HD2 LYS A 107 12.890 2.620 -7.094 1.00 0.83 H new ATOM 0 HD3 LYS A 107 12.521 2.198 -5.433 1.00 0.83 H new ATOM 0 HE2 LYS A 107 11.453 0.119 -6.122 1.00 0.95 H new ATOM 0 HE3 LYS A 107 11.557 0.565 -7.814 1.00 0.95 H new ATOM 0 HZ1 LYS A 107 13.295 -0.990 -7.209 1.00 1.76 H new ATOM 0 HZ2 LYS A 107 13.979 0.499 -7.654 1.00 1.76 H new ATOM 0 HZ3 LYS A 107 13.878 0.066 -6.015 1.00 1.76 H new ATOM 1515 N ILE A 108 7.792 4.565 -4.578 1.00 0.31 N ATOM 1516 CA ILE A 108 7.747 5.927 -4.155 1.00 0.35 C ATOM 1517 C ILE A 108 8.328 6.021 -2.756 1.00 0.36 C ATOM 1518 O ILE A 108 8.435 5.017 -2.050 1.00 0.42 O ATOM 1519 CB ILE A 108 6.304 6.449 -4.177 1.00 0.48 C ATOM 1520 CG1 ILE A 108 5.469 5.676 -3.164 1.00 0.82 C ATOM 1521 CG2 ILE A 108 5.712 6.313 -5.583 1.00 0.68 C ATOM 1522 CD1 ILE A 108 4.021 6.065 -3.164 1.00 0.64 C ATOM 0 H ILE A 108 7.385 3.907 -3.914 1.00 0.31 H new ATOM 0 HA ILE A 108 8.334 6.543 -4.836 1.00 0.35 H new ATOM 0 HB ILE A 108 6.298 7.505 -3.908 1.00 0.48 H new ATOM 0 HG12 ILE A 108 5.551 4.610 -3.375 1.00 0.82 H new ATOM 0 HG13 ILE A 108 5.880 5.836 -2.167 1.00 0.82 H new ATOM 0 HG21 ILE A 108 4.688 6.687 -5.584 1.00 0.68 H new ATOM 0 HG22 ILE A 108 6.310 6.891 -6.287 1.00 0.68 H new ATOM 0 HG23 ILE A 108 5.716 5.264 -5.879 1.00 0.68 H new ATOM 0 HD11 ILE A 108 3.486 5.476 -2.419 1.00 0.64 H new ATOM 0 HD12 ILE A 108 3.929 7.124 -2.923 1.00 0.64 H new ATOM 0 HD13 ILE A 108 3.594 5.878 -4.149 1.00 0.64 H new ATOM 1534 N ASN A 109 8.717 7.221 -2.393 1.00 0.38 N ATOM 1535 CA ASN A 109 9.336 7.524 -1.101 1.00 0.44 C ATOM 1536 C ASN A 109 8.321 7.439 0.020 1.00 0.47 C ATOM 1537 O ASN A 109 8.191 8.372 0.803 1.00 0.76 O ATOM 1538 CB ASN A 109 9.928 8.928 -1.198 1.00 0.53 C ATOM 1539 CG ASN A 109 10.946 9.294 -0.121 1.00 0.98 C ATOM 1540 OD1 ASN A 109 10.770 8.802 1.088 1.00 1.73 O flip ATOM 1541 ND2 ASN A 109 11.883 10.045 -0.381 1.00 1.16 N flip ATOM 0 H ASN A 109 8.615 8.039 -2.993 1.00 0.38 H new ATOM 0 HA ASN A 109 10.116 6.798 -0.873 1.00 0.44 H new ATOM 0 HB2 ASN A 109 10.404 9.035 -2.173 1.00 0.53 H new ATOM 0 HB3 ASN A 109 9.112 9.650 -1.161 1.00 0.53 H new ATOM 0 HD21 ASN A 109 11.996 10.412 -1.326 1.00 1.16 H new ATOM 0 HD22 ASN A 109 12.548 10.302 0.348 1.00 1.16 H new ATOM 1548 N VAL A 110 7.607 6.321 0.102 1.00 0.41 N ATOM 1549 CA VAL A 110 6.619 6.145 1.145 1.00 0.42 C ATOM 1550 C VAL A 110 7.301 6.178 2.492 1.00 0.44 C ATOM 1551 O VAL A 110 7.792 5.171 2.986 1.00 0.48 O ATOM 1552 CB VAL A 110 5.872 4.810 0.981 1.00 0.43 C ATOM 1553 CG1 VAL A 110 4.722 4.965 0.012 1.00 0.60 C ATOM 1554 CG2 VAL A 110 6.818 3.719 0.500 1.00 0.77 C ATOM 0 H VAL A 110 7.697 5.532 -0.539 1.00 0.41 H new ATOM 0 HA VAL A 110 5.893 6.955 1.073 1.00 0.42 H new ATOM 0 HB VAL A 110 5.476 4.520 1.954 1.00 0.43 H new ATOM 0 HG11 VAL A 110 4.204 4.012 -0.093 1.00 0.60 H new ATOM 0 HG12 VAL A 110 4.028 5.716 0.389 1.00 0.60 H new ATOM 0 HG13 VAL A 110 5.104 5.279 -0.959 1.00 0.60 H new ATOM 0 HG21 VAL A 110 6.269 2.784 0.391 1.00 0.77 H new ATOM 0 HG22 VAL A 110 7.243 4.005 -0.462 1.00 0.77 H new ATOM 0 HG23 VAL A 110 7.620 3.586 1.226 1.00 0.77 H new ATOM 1564 N ASN A 111 7.290 7.353 3.085 1.00 0.48 N ATOM 1565 CA ASN A 111 7.949 7.591 4.342 1.00 0.56 C ATOM 1566 C ASN A 111 7.785 9.054 4.698 1.00 0.62 C ATOM 1567 O ASN A 111 7.170 9.816 3.949 1.00 0.67 O ATOM 1568 CB ASN A 111 9.433 7.217 4.286 1.00 0.65 C ATOM 1569 CG ASN A 111 9.931 6.783 5.653 1.00 1.20 C ATOM 1570 OD1 ASN A 111 10.502 7.712 6.408 1.00 1.90 O flip ATOM 1571 ND2 ASN A 111 9.812 5.621 6.030 1.00 1.72 N flip ATOM 0 H ASN A 111 6.819 8.173 2.702 1.00 0.48 H new ATOM 0 HA ASN A 111 7.493 6.961 5.106 1.00 0.56 H new ATOM 0 HB2 ASN A 111 9.583 6.412 3.567 1.00 0.65 H new ATOM 0 HB3 ASN A 111 10.015 8.070 3.936 1.00 0.65 H new ATOM 0 HD21 ASN A 111 9.368 4.931 5.424 1.00 1.72 H new ATOM 0 HD22 ASN A 111 10.157 5.345 6.949 1.00 1.72 H new ATOM 1578 N GLY A 112 8.353 9.439 5.823 1.00 0.73 N ATOM 1579 CA GLY A 112 8.205 10.781 6.325 1.00 0.85 C ATOM 1580 C GLY A 112 8.981 11.846 5.599 1.00 0.93 C ATOM 1581 O GLY A 112 9.093 12.954 6.122 1.00 1.47 O ATOM 0 H GLY A 112 8.926 8.831 6.408 1.00 0.73 H new ATOM 0 HA2 GLY A 112 7.148 11.045 6.294 1.00 0.85 H new ATOM 0 HA3 GLY A 112 8.505 10.791 7.373 1.00 0.85 H new ATOM 1585 N GLU A 113 9.540 11.576 4.424 1.00 0.88 N ATOM 1586 CA GLU A 113 10.234 12.657 3.763 1.00 1.23 C ATOM 1587 C GLU A 113 9.487 13.193 2.553 1.00 1.10 C ATOM 1588 O GLU A 113 9.320 14.403 2.407 1.00 1.39 O ATOM 1589 CB GLU A 113 11.637 12.264 3.378 1.00 1.61 C ATOM 1590 CG GLU A 113 12.490 13.489 3.241 1.00 1.83 C ATOM 1591 CD GLU A 113 13.971 13.202 3.210 1.00 2.29 C ATOM 1592 OE1 GLU A 113 14.562 12.986 4.288 1.00 2.81 O ATOM 1593 OE2 GLU A 113 14.557 13.209 2.112 1.00 2.65 O ATOM 0 H GLU A 113 9.528 10.678 3.941 1.00 0.88 H new ATOM 0 HA GLU A 113 10.284 13.464 4.494 1.00 1.23 H new ATOM 0 HB2 GLU A 113 12.058 11.600 4.133 1.00 1.61 H new ATOM 0 HB3 GLU A 113 11.625 11.712 2.438 1.00 1.61 H new ATOM 0 HG2 GLU A 113 12.212 14.013 2.326 1.00 1.83 H new ATOM 0 HG3 GLU A 113 12.278 14.162 4.071 1.00 1.83 H new ATOM 1600 N ASN A 114 9.021 12.301 1.701 1.00 0.79 N ATOM 1601 CA ASN A 114 8.322 12.717 0.495 1.00 0.79 C ATOM 1602 C ASN A 114 7.000 11.992 0.351 1.00 0.79 C ATOM 1603 O ASN A 114 6.018 12.561 -0.123 1.00 1.22 O ATOM 1604 CB ASN A 114 9.206 12.466 -0.732 1.00 0.87 C ATOM 1605 CG ASN A 114 8.472 12.640 -2.053 1.00 1.45 C ATOM 1606 OD1 ASN A 114 7.937 11.682 -2.613 1.00 2.06 O ATOM 1607 ND2 ASN A 114 8.446 13.862 -2.558 1.00 2.16 N ATOM 0 H ASN A 114 9.111 11.292 1.817 1.00 0.79 H new ATOM 0 HA ASN A 114 8.110 13.784 0.571 1.00 0.79 H new ATOM 0 HB2 ASN A 114 10.055 13.149 -0.704 1.00 0.87 H new ATOM 0 HB3 ASN A 114 9.609 11.454 -0.679 1.00 0.87 H new ATOM 0 HD21 ASN A 114 7.970 14.038 -3.443 1.00 2.16 H new ATOM 0 HD22 ASN A 114 8.902 14.628 -2.063 1.00 2.16 H new ATOM 1614 N ALA A 115 6.980 10.747 0.822 1.00 0.59 N ATOM 1615 CA ALA A 115 5.859 9.849 0.619 1.00 0.61 C ATOM 1616 C ALA A 115 5.405 9.898 -0.831 1.00 0.68 C ATOM 1617 O ALA A 115 6.098 9.415 -1.727 1.00 1.26 O ATOM 1618 CB ALA A 115 4.721 10.166 1.576 1.00 0.86 C ATOM 0 H ALA A 115 7.746 10.337 1.356 1.00 0.59 H new ATOM 0 HA ALA A 115 6.184 8.832 0.837 1.00 0.61 H new ATOM 0 HB1 ALA A 115 3.895 9.477 1.400 1.00 0.86 H new ATOM 0 HB2 ALA A 115 5.069 10.060 2.603 1.00 0.86 H new ATOM 0 HB3 ALA A 115 4.381 11.189 1.411 1.00 0.86 H new ATOM 1624 N HIS A 116 4.240 10.481 -1.036 1.00 0.42 N ATOM 1625 CA HIS A 116 3.712 10.795 -2.322 1.00 0.35 C ATOM 1626 C HIS A 116 2.357 11.380 -2.048 1.00 0.29 C ATOM 1627 O HIS A 116 1.684 10.860 -1.188 1.00 0.29 O ATOM 1628 CB HIS A 116 3.624 9.532 -3.194 1.00 0.35 C ATOM 1629 CG HIS A 116 2.750 9.704 -4.375 1.00 0.31 C ATOM 1630 ND1 HIS A 116 1.409 9.773 -4.216 1.00 0.33 N ATOM 1631 CD2 HIS A 116 2.994 9.955 -5.682 1.00 0.31 C ATOM 1632 CE1 HIS A 116 0.843 10.081 -5.337 1.00 0.32 C ATOM 1633 NE2 HIS A 116 1.774 10.193 -6.264 1.00 0.32 N ATOM 0 H HIS A 116 3.622 10.754 -0.272 1.00 0.42 H new ATOM 0 HA HIS A 116 4.342 11.492 -2.875 1.00 0.35 H new ATOM 0 HB2 HIS A 116 4.625 9.257 -3.527 1.00 0.35 H new ATOM 0 HB3 HIS A 116 3.250 8.705 -2.590 1.00 0.35 H new ATOM 0 HD2 HIS A 116 3.957 9.966 -6.170 1.00 0.31 H new ATOM 0 HE1 HIS A 116 -0.217 10.223 -5.489 1.00 0.32 H new ATOM 0 HE2 HIS A 116 1.615 10.418 -7.246 1.00 0.32 H new ATOM 1642 N PRO A 117 1.958 12.471 -2.727 1.00 0.31 N ATOM 1643 CA PRO A 117 0.662 13.127 -2.545 1.00 0.31 C ATOM 1644 C PRO A 117 -0.450 12.185 -2.055 1.00 0.26 C ATOM 1645 O PRO A 117 -1.173 12.502 -1.123 1.00 0.27 O ATOM 1646 CB PRO A 117 0.376 13.630 -3.958 1.00 0.37 C ATOM 1647 CG PRO A 117 1.717 13.872 -4.587 1.00 0.40 C ATOM 1648 CD PRO A 117 2.757 13.202 -3.719 1.00 0.38 C ATOM 0 HA PRO A 117 0.689 13.898 -1.775 1.00 0.31 H new ATOM 0 HB2 PRO A 117 -0.195 12.896 -4.526 1.00 0.37 H new ATOM 0 HB3 PRO A 117 -0.216 14.545 -3.935 1.00 0.37 H new ATOM 0 HG2 PRO A 117 1.744 13.467 -5.599 1.00 0.40 H new ATOM 0 HG3 PRO A 117 1.915 14.941 -4.666 1.00 0.40 H new ATOM 0 HD2 PRO A 117 3.390 12.530 -4.298 1.00 0.38 H new ATOM 0 HD3 PRO A 117 3.415 13.931 -3.246 1.00 0.38 H new ATOM 1656 N LEU A 118 -0.539 11.014 -2.673 1.00 0.24 N ATOM 1657 CA LEU A 118 -1.509 9.984 -2.316 1.00 0.23 C ATOM 1658 C LEU A 118 -1.264 9.433 -0.904 1.00 0.27 C ATOM 1659 O LEU A 118 -2.173 9.369 -0.087 1.00 0.28 O ATOM 1660 CB LEU A 118 -1.404 8.878 -3.353 1.00 0.24 C ATOM 1661 CG LEU A 118 -2.198 7.614 -3.088 1.00 0.25 C ATOM 1662 CD1 LEU A 118 -3.664 7.873 -3.331 1.00 0.39 C ATOM 1663 CD2 LEU A 118 -1.698 6.480 -3.967 1.00 0.27 C ATOM 0 H LEU A 118 0.069 10.748 -3.448 1.00 0.24 H new ATOM 0 HA LEU A 118 -2.512 10.411 -2.308 1.00 0.23 H new ATOM 0 HB2 LEU A 118 -1.721 9.283 -4.314 1.00 0.24 H new ATOM 0 HB3 LEU A 118 -0.354 8.605 -3.453 1.00 0.24 H new ATOM 0 HG LEU A 118 -2.062 7.319 -2.047 1.00 0.25 H new ATOM 0 HD11 LEU A 118 -4.231 6.962 -3.139 1.00 0.39 H new ATOM 0 HD12 LEU A 118 -4.009 8.663 -2.664 1.00 0.39 H new ATOM 0 HD13 LEU A 118 -3.812 8.182 -4.366 1.00 0.39 H new ATOM 0 HD21 LEU A 118 -2.278 5.580 -3.765 1.00 0.27 H new ATOM 0 HD22 LEU A 118 -1.810 6.756 -5.016 1.00 0.27 H new ATOM 0 HD23 LEU A 118 -0.646 6.290 -3.752 1.00 0.27 H new ATOM 1675 N TYR A 119 -0.029 9.036 -0.621 1.00 0.32 N ATOM 1676 CA TYR A 119 0.326 8.531 0.701 1.00 0.42 C ATOM 1677 C TYR A 119 0.453 9.647 1.702 1.00 0.40 C ATOM 1678 O TYR A 119 0.163 9.455 2.877 1.00 0.41 O ATOM 1679 CB TYR A 119 1.625 7.755 0.668 1.00 0.57 C ATOM 1680 CG TYR A 119 1.462 6.352 0.181 1.00 0.54 C ATOM 1681 CD1 TYR A 119 1.350 6.087 -1.167 1.00 0.92 C ATOM 1682 CD2 TYR A 119 1.447 5.290 1.071 1.00 1.09 C ATOM 1683 CE1 TYR A 119 1.235 4.800 -1.627 1.00 1.74 C ATOM 1684 CE2 TYR A 119 1.325 3.995 0.625 1.00 1.88 C ATOM 1685 CZ TYR A 119 1.225 3.752 -0.724 1.00 2.20 C ATOM 1686 OH TYR A 119 1.137 2.461 -1.168 1.00 3.04 O ATOM 0 H TYR A 119 0.743 9.054 -1.288 1.00 0.32 H new ATOM 0 HA TYR A 119 -0.483 7.866 1.005 1.00 0.42 H new ATOM 0 HB2 TYR A 119 2.335 8.275 0.025 1.00 0.57 H new ATOM 0 HB3 TYR A 119 2.055 7.737 1.669 1.00 0.57 H new ATOM 0 HD1 TYR A 119 1.353 6.905 -1.872 1.00 0.92 H new ATOM 0 HD2 TYR A 119 1.532 5.482 2.130 1.00 1.09 H new ATOM 0 HE1 TYR A 119 1.153 4.606 -2.686 1.00 1.74 H new ATOM 0 HE2 TYR A 119 1.308 3.176 1.329 1.00 1.88 H new ATOM 0 HH TYR A 119 1.180 2.448 -2.147 1.00 3.04 H new ATOM 1696 N GLU A 120 0.901 10.805 1.248 1.00 0.40 N ATOM 1697 CA GLU A 120 0.858 11.983 2.078 1.00 0.42 C ATOM 1698 C GLU A 120 -0.564 12.172 2.491 1.00 0.37 C ATOM 1699 O GLU A 120 -0.841 12.485 3.639 1.00 0.43 O ATOM 1700 CB GLU A 120 1.344 13.232 1.344 1.00 0.50 C ATOM 1701 CG GLU A 120 2.804 13.200 0.934 1.00 0.76 C ATOM 1702 CD GLU A 120 3.264 14.536 0.390 1.00 1.58 C ATOM 1703 OE1 GLU A 120 3.659 15.402 1.197 1.00 1.93 O ATOM 1704 OE2 GLU A 120 3.212 14.736 -0.841 1.00 2.44 O ATOM 0 H GLU A 120 1.294 10.948 0.318 1.00 0.40 H new ATOM 0 HA GLU A 120 1.521 11.844 2.932 1.00 0.42 H new ATOM 0 HB2 GLU A 120 0.734 13.373 0.452 1.00 0.50 H new ATOM 0 HB3 GLU A 120 1.179 14.099 1.983 1.00 0.50 H new ATOM 0 HG2 GLU A 120 3.417 12.927 1.793 1.00 0.76 H new ATOM 0 HG3 GLU A 120 2.953 12.429 0.178 1.00 0.76 H new ATOM 1711 N TYR A 121 -1.466 11.906 1.553 1.00 0.29 N ATOM 1712 CA TYR A 121 -2.885 11.962 1.867 1.00 0.28 C ATOM 1713 C TYR A 121 -3.266 10.848 2.837 1.00 0.27 C ATOM 1714 O TYR A 121 -4.133 11.020 3.688 1.00 0.29 O ATOM 1715 CB TYR A 121 -3.740 11.866 0.604 1.00 0.28 C ATOM 1716 CG TYR A 121 -5.205 11.655 0.889 1.00 0.30 C ATOM 1717 CD1 TYR A 121 -6.040 12.726 1.162 1.00 0.39 C ATOM 1718 CD2 TYR A 121 -5.743 10.382 0.912 1.00 0.33 C ATOM 1719 CE1 TYR A 121 -7.374 12.529 1.448 1.00 0.46 C ATOM 1720 CE2 TYR A 121 -7.070 10.177 1.200 1.00 0.41 C ATOM 1721 CZ TYR A 121 -7.885 11.251 1.469 1.00 0.46 C ATOM 1722 OH TYR A 121 -9.210 11.042 1.767 1.00 0.56 O ATOM 0 H TYR A 121 -1.245 11.655 0.589 1.00 0.29 H new ATOM 0 HA TYR A 121 -3.078 12.926 2.338 1.00 0.28 H new ATOM 0 HB2 TYR A 121 -3.618 12.779 0.021 1.00 0.28 H new ATOM 0 HB3 TYR A 121 -3.375 11.044 -0.012 1.00 0.28 H new ATOM 0 HD1 TYR A 121 -5.640 13.729 1.151 1.00 0.39 H new ATOM 0 HD2 TYR A 121 -5.109 9.534 0.700 1.00 0.33 H new ATOM 0 HE1 TYR A 121 -8.015 13.373 1.655 1.00 0.46 H new ATOM 0 HE2 TYR A 121 -7.472 9.175 1.215 1.00 0.41 H new ATOM 0 HH TYR A 121 -9.697 11.890 1.704 1.00 0.56 H new ATOM 1732 N MET A 122 -2.586 9.726 2.731 1.00 0.27 N ATOM 1733 CA MET A 122 -2.978 8.533 3.461 1.00 0.29 C ATOM 1734 C MET A 122 -2.615 8.674 4.923 1.00 0.33 C ATOM 1735 O MET A 122 -3.470 8.551 5.797 1.00 0.35 O ATOM 1736 CB MET A 122 -2.356 7.275 2.861 1.00 0.33 C ATOM 1737 CG MET A 122 -3.397 6.230 2.526 1.00 0.71 C ATOM 1738 SD MET A 122 -2.929 5.205 1.129 1.00 0.56 S ATOM 1739 CE MET A 122 -3.225 6.367 -0.191 1.00 0.55 C ATOM 0 H MET A 122 -1.758 9.612 2.146 1.00 0.27 H new ATOM 0 HA MET A 122 -4.060 8.427 3.378 1.00 0.29 H new ATOM 0 HB2 MET A 122 -1.804 7.539 1.959 1.00 0.33 H new ATOM 0 HB3 MET A 122 -1.636 6.856 3.564 1.00 0.33 H new ATOM 0 HG2 MET A 122 -3.562 5.596 3.397 1.00 0.71 H new ATOM 0 HG3 MET A 122 -4.344 6.724 2.307 1.00 0.71 H new ATOM 0 HE1 MET A 122 -4.000 5.978 -0.852 1.00 0.55 H new ATOM 0 HE2 MET A 122 -3.550 7.319 0.228 1.00 0.55 H new ATOM 0 HE3 MET A 122 -2.306 6.516 -0.758 1.00 0.55 H new ATOM 1749 N LYS A 123 -1.344 8.964 5.187 1.00 0.37 N ATOM 1750 CA LYS A 123 -0.898 9.189 6.551 1.00 0.45 C ATOM 1751 C LYS A 123 -1.444 10.502 7.106 1.00 0.47 C ATOM 1752 O LYS A 123 -1.552 10.656 8.319 1.00 0.54 O ATOM 1753 CB LYS A 123 0.634 9.110 6.706 1.00 0.53 C ATOM 1754 CG LYS A 123 1.435 9.499 5.480 1.00 0.48 C ATOM 1755 CD LYS A 123 2.841 9.953 5.846 1.00 1.00 C ATOM 1756 CE LYS A 123 2.834 11.249 6.647 1.00 1.05 C ATOM 1757 NZ LYS A 123 2.346 12.403 5.846 1.00 1.46 N ATOM 0 H LYS A 123 -0.614 9.047 4.480 1.00 0.37 H new ATOM 0 HA LYS A 123 -1.309 8.372 7.144 1.00 0.45 H new ATOM 0 HB2 LYS A 123 0.932 9.755 7.533 1.00 0.53 H new ATOM 0 HB3 LYS A 123 0.901 8.091 6.985 1.00 0.53 H new ATOM 0 HG2 LYS A 123 1.493 8.650 4.799 1.00 0.48 H new ATOM 0 HG3 LYS A 123 0.921 10.300 4.949 1.00 0.48 H new ATOM 0 HD2 LYS A 123 3.335 9.172 6.425 1.00 1.00 H new ATOM 0 HD3 LYS A 123 3.425 10.093 4.936 1.00 1.00 H new ATOM 0 HE2 LYS A 123 2.202 11.127 7.527 1.00 1.05 H new ATOM 0 HE3 LYS A 123 3.842 11.458 7.005 1.00 1.05 H new ATOM 0 HZ1 LYS A 123 2.532 13.287 6.362 1.00 1.46 H new ATOM 0 HZ2 LYS A 123 2.841 12.425 4.932 1.00 1.46 H new ATOM 0 HZ3 LYS A 123 1.323 12.305 5.684 1.00 1.46 H new ATOM 1771 N LYS A 124 -1.780 11.468 6.242 1.00 0.43 N ATOM 1772 CA LYS A 124 -2.381 12.698 6.749 1.00 0.50 C ATOM 1773 C LYS A 124 -3.828 12.446 7.154 1.00 0.49 C ATOM 1774 O LYS A 124 -4.364 13.112 8.042 1.00 0.57 O ATOM 1775 CB LYS A 124 -2.271 13.883 5.766 1.00 0.56 C ATOM 1776 CG LYS A 124 -3.259 13.885 4.602 1.00 0.59 C ATOM 1777 CD LYS A 124 -4.523 14.679 4.904 1.00 0.97 C ATOM 1778 CE LYS A 124 -5.298 14.983 3.629 1.00 1.41 C ATOM 1779 NZ LYS A 124 -6.558 15.730 3.888 1.00 1.99 N ATOM 0 H LYS A 124 -1.652 11.424 5.231 1.00 0.43 H new ATOM 0 HA LYS A 124 -1.809 12.992 7.629 1.00 0.50 H new ATOM 0 HB2 LYS A 124 -2.401 14.808 6.328 1.00 0.56 H new ATOM 0 HB3 LYS A 124 -1.260 13.897 5.358 1.00 0.56 H new ATOM 0 HG2 LYS A 124 -2.774 14.304 3.720 1.00 0.59 H new ATOM 0 HG3 LYS A 124 -3.530 12.857 4.359 1.00 0.59 H new ATOM 0 HD2 LYS A 124 -5.154 14.116 5.591 1.00 0.97 H new ATOM 0 HD3 LYS A 124 -4.260 15.611 5.404 1.00 0.97 H new ATOM 0 HE2 LYS A 124 -4.668 15.564 2.955 1.00 1.41 H new ATOM 0 HE3 LYS A 124 -5.533 14.048 3.120 1.00 1.41 H new ATOM 0 HZ1 LYS A 124 -6.851 16.228 3.023 1.00 1.99 H new ATOM 0 HZ2 LYS A 124 -7.304 15.064 4.173 1.00 1.99 H new ATOM 0 HZ3 LYS A 124 -6.402 16.421 4.649 1.00 1.99 H new ATOM 1793 N THR A 125 -4.450 11.471 6.504 1.00 0.42 N ATOM 1794 CA THR A 125 -5.801 11.056 6.862 1.00 0.44 C ATOM 1795 C THR A 125 -5.770 10.168 8.106 1.00 0.44 C ATOM 1796 O THR A 125 -6.582 10.323 9.022 1.00 0.56 O ATOM 1797 CB THR A 125 -6.489 10.309 5.700 1.00 0.49 C ATOM 1798 OG1 THR A 125 -6.555 11.161 4.551 1.00 0.57 O ATOM 1799 CG2 THR A 125 -7.895 9.866 6.079 1.00 0.59 C ATOM 0 H THR A 125 -4.041 10.953 5.726 1.00 0.42 H new ATOM 0 HA THR A 125 -6.379 11.955 7.075 1.00 0.44 H new ATOM 0 HB THR A 125 -5.898 9.421 5.475 1.00 0.49 H new ATOM 0 HG1 THR A 125 -5.654 11.468 4.319 1.00 0.57 H new ATOM 0 HG21 THR A 125 -8.351 9.343 5.238 1.00 0.59 H new ATOM 0 HG22 THR A 125 -7.847 9.198 6.939 1.00 0.59 H new ATOM 0 HG23 THR A 125 -8.496 10.740 6.332 1.00 0.59 H new ATOM 1807 N LYS A 126 -4.813 9.252 8.136 1.00 0.44 N ATOM 1808 CA LYS A 126 -4.638 8.349 9.260 1.00 0.54 C ATOM 1809 C LYS A 126 -3.153 8.010 9.396 1.00 0.57 C ATOM 1810 O LYS A 126 -2.611 7.197 8.646 1.00 0.68 O ATOM 1811 CB LYS A 126 -5.467 7.086 9.035 1.00 0.78 C ATOM 1812 CG LYS A 126 -5.913 6.419 10.322 1.00 1.26 C ATOM 1813 CD LYS A 126 -6.826 5.244 10.041 1.00 0.92 C ATOM 1814 CE LYS A 126 -7.408 4.661 11.319 1.00 1.27 C ATOM 1815 NZ LYS A 126 -6.363 4.139 12.240 1.00 1.85 N ATOM 0 H LYS A 126 -4.139 9.115 7.383 1.00 0.44 H new ATOM 0 HA LYS A 126 -4.979 8.821 10.181 1.00 0.54 H new ATOM 0 HB2 LYS A 126 -6.346 7.339 8.442 1.00 0.78 H new ATOM 0 HB3 LYS A 126 -4.882 6.376 8.451 1.00 0.78 H new ATOM 0 HG2 LYS A 126 -5.040 6.080 10.880 1.00 1.26 H new ATOM 0 HG3 LYS A 126 -6.431 7.144 10.950 1.00 1.26 H new ATOM 0 HD2 LYS A 126 -7.636 5.562 9.385 1.00 0.92 H new ATOM 0 HD3 LYS A 126 -6.271 4.471 9.509 1.00 0.92 H new ATOM 0 HE2 LYS A 126 -7.988 5.428 11.832 1.00 1.27 H new ATOM 0 HE3 LYS A 126 -8.098 3.856 11.065 1.00 1.27 H new ATOM 0 HZ1 LYS A 126 -6.817 3.693 13.063 1.00 1.85 H new ATOM 0 HZ2 LYS A 126 -5.781 3.436 11.742 1.00 1.85 H new ATOM 0 HZ3 LYS A 126 -5.760 4.923 12.560 1.00 1.85 H new ATOM 1829 N PRO A 127 -2.498 8.615 10.408 1.00 0.77 N ATOM 1830 CA PRO A 127 -1.032 8.634 10.545 1.00 1.04 C ATOM 1831 C PRO A 127 -0.404 7.262 10.774 1.00 1.27 C ATOM 1832 O PRO A 127 0.219 6.704 9.876 1.00 1.69 O ATOM 1833 CB PRO A 127 -0.790 9.539 11.763 1.00 1.28 C ATOM 1834 CG PRO A 127 -2.070 10.273 11.965 1.00 1.22 C ATOM 1835 CD PRO A 127 -3.144 9.334 11.512 1.00 0.95 C ATOM 0 HA PRO A 127 -0.569 8.985 9.623 1.00 1.04 H new ATOM 0 HB2 PRO A 127 -0.529 8.952 12.644 1.00 1.28 H new ATOM 0 HB3 PRO A 127 0.035 10.228 11.584 1.00 1.28 H new ATOM 0 HG2 PRO A 127 -2.204 10.548 13.011 1.00 1.22 H new ATOM 0 HG3 PRO A 127 -2.088 11.198 11.388 1.00 1.22 H new ATOM 0 HD2 PRO A 127 -3.454 8.658 12.309 1.00 0.95 H new ATOM 0 HD3 PRO A 127 -4.035 9.867 11.182 1.00 0.95 H new ATOM 1843 N GLY A 128 -0.560 6.714 11.969 1.00 1.55 N ATOM 1844 CA GLY A 128 0.112 5.472 12.279 1.00 1.96 C ATOM 1845 C GLY A 128 -0.614 4.652 13.314 1.00 2.13 C ATOM 1846 O GLY A 128 -1.702 5.019 13.757 1.00 2.59 O ATOM 0 H GLY A 128 -1.132 7.101 12.720 1.00 1.55 H new ATOM 0 HA2 GLY A 128 0.217 4.885 11.367 1.00 1.96 H new ATOM 0 HA3 GLY A 128 1.119 5.689 12.636 1.00 1.96 H new ATOM 1850 N ILE A 129 -0.007 3.534 13.689 1.00 2.17 N ATOM 1851 CA ILE A 129 -0.562 2.656 14.707 1.00 2.46 C ATOM 1852 C ILE A 129 -0.361 3.308 16.067 1.00 2.36 C ATOM 1853 O ILE A 129 -1.030 2.982 17.048 1.00 2.70 O ATOM 1854 CB ILE A 129 0.097 1.249 14.687 1.00 2.91 C ATOM 1855 CG1 ILE A 129 0.012 0.615 13.290 1.00 3.06 C ATOM 1856 CG2 ILE A 129 -0.563 0.328 15.705 1.00 3.44 C ATOM 1857 CD1 ILE A 129 1.078 1.087 12.319 1.00 3.58 C ATOM 0 H ILE A 129 0.879 3.213 13.298 1.00 2.17 H new ATOM 0 HA ILE A 129 -1.623 2.513 14.502 1.00 2.46 H new ATOM 0 HB ILE A 129 1.147 1.378 14.949 1.00 2.91 H new ATOM 0 HG12 ILE A 129 0.085 -0.468 13.391 1.00 3.06 H new ATOM 0 HG13 ILE A 129 -0.969 0.831 12.866 1.00 3.06 H new ATOM 0 HG21 ILE A 129 -0.085 -0.651 15.673 1.00 3.44 H new ATOM 0 HG22 ILE A 129 -0.455 0.752 16.703 1.00 3.44 H new ATOM 0 HG23 ILE A 129 -1.622 0.223 15.468 1.00 3.44 H new ATOM 0 HD11 ILE A 129 0.942 0.589 11.359 1.00 3.58 H new ATOM 0 HD12 ILE A 129 0.995 2.165 12.183 1.00 3.58 H new ATOM 0 HD13 ILE A 129 2.064 0.847 12.716 1.00 3.58 H new ATOM 1869 N LEU A 130 0.578 4.244 16.102 1.00 2.12 N ATOM 1870 CA LEU A 130 0.808 5.063 17.284 1.00 2.29 C ATOM 1871 C LEU A 130 -0.263 6.143 17.368 1.00 2.20 C ATOM 1872 O LEU A 130 -1.260 6.105 16.639 1.00 2.44 O ATOM 1873 CB LEU A 130 2.180 5.744 17.205 1.00 2.58 C ATOM 1874 CG LEU A 130 2.864 6.002 18.551 1.00 2.89 C ATOM 1875 CD1 LEU A 130 3.125 4.696 19.282 1.00 3.36 C ATOM 1876 CD2 LEU A 130 4.160 6.769 18.347 1.00 3.47 C ATOM 0 H LEU A 130 1.197 4.456 15.319 1.00 2.12 H new ATOM 0 HA LEU A 130 0.771 4.420 18.163 1.00 2.29 H new ATOM 0 HB2 LEU A 130 2.839 5.126 16.594 1.00 2.58 H new ATOM 0 HB3 LEU A 130 2.065 6.696 16.687 1.00 2.58 H new ATOM 0 HG LEU A 130 2.196 6.606 19.165 1.00 2.89 H new ATOM 0 HD11 LEU A 130 3.611 4.903 20.235 1.00 3.36 H new ATOM 0 HD12 LEU A 130 2.180 4.184 19.461 1.00 3.36 H new ATOM 0 HD13 LEU A 130 3.772 4.062 18.675 1.00 3.36 H new ATOM 0 HD21 LEU A 130 4.635 6.945 19.312 1.00 3.47 H new ATOM 0 HD22 LEU A 130 4.831 6.188 17.713 1.00 3.47 H new ATOM 0 HD23 LEU A 130 3.946 7.725 17.869 1.00 3.47 H new ATOM 1888 N ALA A 131 -0.061 7.110 18.252 1.00 2.45 N ATOM 1889 CA ALA A 131 -0.836 8.334 18.201 1.00 2.67 C ATOM 1890 C ALA A 131 -0.575 9.004 16.861 1.00 2.55 C ATOM 1891 O ALA A 131 -1.479 9.555 16.226 1.00 3.21 O ATOM 1892 CB ALA A 131 -0.459 9.258 19.348 1.00 3.28 C ATOM 0 H ALA A 131 0.626 7.069 19.004 1.00 2.45 H new ATOM 0 HA ALA A 131 -1.897 8.107 18.303 1.00 2.67 H new ATOM 0 HB1 ALA A 131 -1.053 10.170 19.290 1.00 3.28 H new ATOM 0 HB2 ALA A 131 -0.653 8.758 20.297 1.00 3.28 H new ATOM 0 HB3 ALA A 131 0.600 9.509 19.280 1.00 3.28 H new ATOM 1898 N THR A 132 0.678 8.907 16.432 1.00 2.02 N ATOM 1899 CA THR A 132 1.114 9.419 15.152 1.00 2.10 C ATOM 1900 C THR A 132 2.270 8.589 14.599 1.00 1.56 C ATOM 1901 O THR A 132 3.083 8.065 15.356 1.00 2.12 O ATOM 1902 CB THR A 132 1.579 10.870 15.272 1.00 2.73 C ATOM 1903 OG1 THR A 132 2.058 11.120 16.601 1.00 3.34 O ATOM 1904 CG2 THR A 132 0.463 11.843 14.921 1.00 3.56 C ATOM 0 H THR A 132 1.422 8.465 16.973 1.00 2.02 H new ATOM 0 HA THR A 132 0.261 9.361 14.476 1.00 2.10 H new ATOM 0 HB THR A 132 2.390 11.026 14.561 1.00 2.73 H new ATOM 0 HG1 THR A 132 2.356 12.051 16.672 1.00 3.34 H new ATOM 0 HG21 THR A 132 0.828 12.866 15.017 1.00 3.56 H new ATOM 0 HG22 THR A 132 0.137 11.669 13.895 1.00 3.56 H new ATOM 0 HG23 THR A 132 -0.377 11.693 15.599 1.00 3.56 H new ATOM 1912 N LYS A 133 2.328 8.475 13.284 1.00 1.29 N ATOM 1913 CA LYS A 133 3.420 7.799 12.603 1.00 1.47 C ATOM 1914 C LYS A 133 3.337 8.163 11.131 1.00 1.14 C ATOM 1915 O LYS A 133 2.303 8.653 10.681 1.00 1.58 O ATOM 1916 CB LYS A 133 3.331 6.276 12.790 1.00 2.24 C ATOM 1917 CG LYS A 133 4.626 5.530 12.495 1.00 3.04 C ATOM 1918 CD LYS A 133 5.731 5.912 13.470 1.00 3.81 C ATOM 1919 CE LYS A 133 6.983 5.079 13.241 1.00 4.63 C ATOM 1920 NZ LYS A 133 8.093 5.454 14.155 1.00 5.17 N ATOM 0 H LYS A 133 1.617 8.850 12.656 1.00 1.29 H new ATOM 0 HA LYS A 133 4.375 8.115 13.022 1.00 1.47 H new ATOM 0 HB2 LYS A 133 3.030 6.065 13.816 1.00 2.24 H new ATOM 0 HB3 LYS A 133 2.546 5.888 12.141 1.00 2.24 H new ATOM 0 HG2 LYS A 133 4.448 4.456 12.550 1.00 3.04 H new ATOM 0 HG3 LYS A 133 4.948 5.748 11.477 1.00 3.04 H new ATOM 0 HD2 LYS A 133 5.969 6.970 13.356 1.00 3.81 H new ATOM 0 HD3 LYS A 133 5.381 5.772 14.493 1.00 3.81 H new ATOM 0 HE2 LYS A 133 6.744 4.025 13.379 1.00 4.63 H new ATOM 0 HE3 LYS A 133 7.311 5.199 12.208 1.00 4.63 H new ATOM 0 HZ1 LYS A 133 8.922 4.857 13.958 1.00 5.17 H new ATOM 0 HZ2 LYS A 133 8.342 6.453 14.007 1.00 5.17 H new ATOM 0 HZ3 LYS A 133 7.793 5.315 15.141 1.00 5.17 H new ATOM 1934 N ALA A 134 4.404 7.953 10.384 1.00 0.92 N ATOM 1935 CA ALA A 134 4.396 8.304 8.979 1.00 0.77 C ATOM 1936 C ALA A 134 5.104 7.262 8.137 1.00 0.81 C ATOM 1937 O ALA A 134 6.033 7.588 7.400 1.00 1.59 O ATOM 1938 CB ALA A 134 5.028 9.671 8.783 1.00 1.02 C ATOM 0 H ALA A 134 5.276 7.546 10.722 1.00 0.92 H new ATOM 0 HA ALA A 134 3.359 8.339 8.646 1.00 0.77 H new ATOM 0 HB1 ALA A 134 5.018 9.928 7.724 1.00 1.02 H new ATOM 0 HB2 ALA A 134 4.463 10.417 9.342 1.00 1.02 H new ATOM 0 HB3 ALA A 134 6.057 9.651 9.142 1.00 1.02 H new ATOM 1944 N ILE A 135 4.645 6.014 8.249 1.00 0.69 N ATOM 1945 CA ILE A 135 5.199 4.900 7.479 1.00 0.74 C ATOM 1946 C ILE A 135 6.640 4.587 7.927 1.00 1.09 C ATOM 1947 O ILE A 135 7.510 5.451 7.869 1.00 2.00 O ATOM 1948 CB ILE A 135 5.188 5.209 5.965 1.00 0.86 C ATOM 1949 CG1 ILE A 135 3.759 5.496 5.488 1.00 0.88 C ATOM 1950 CG2 ILE A 135 5.789 4.053 5.183 1.00 1.54 C ATOM 1951 CD1 ILE A 135 3.672 5.914 4.035 1.00 0.89 C ATOM 0 H ILE A 135 3.883 5.748 8.873 1.00 0.69 H new ATOM 0 HA ILE A 135 4.569 4.030 7.666 1.00 0.74 H new ATOM 0 HB ILE A 135 5.795 6.097 5.788 1.00 0.86 H new ATOM 0 HG12 ILE A 135 3.150 4.604 5.637 1.00 0.88 H new ATOM 0 HG13 ILE A 135 3.330 6.282 6.109 1.00 0.88 H new ATOM 0 HG21 ILE A 135 5.774 4.287 4.118 1.00 1.54 H new ATOM 0 HG22 ILE A 135 6.818 3.892 5.504 1.00 1.54 H new ATOM 0 HG23 ILE A 135 5.207 3.149 5.364 1.00 1.54 H new ATOM 0 HD11 ILE A 135 2.631 6.099 3.771 1.00 0.89 H new ATOM 0 HD12 ILE A 135 4.252 6.824 3.883 1.00 0.89 H new ATOM 0 HD13 ILE A 135 4.070 5.120 3.403 1.00 0.89 H new ATOM 1963 N LYS A 136 6.895 3.367 8.397 1.00 0.85 N ATOM 1964 CA LYS A 136 8.250 3.010 8.835 1.00 1.14 C ATOM 1965 C LYS A 136 8.454 1.486 8.883 1.00 0.75 C ATOM 1966 O LYS A 136 9.178 0.965 9.734 1.00 0.78 O ATOM 1967 CB LYS A 136 8.534 3.626 10.210 1.00 1.71 C ATOM 1968 CG LYS A 136 9.925 4.218 10.346 1.00 2.72 C ATOM 1969 CD LYS A 136 11.008 3.171 10.156 1.00 3.21 C ATOM 1970 CE LYS A 136 12.393 3.796 10.222 1.00 4.09 C ATOM 1971 NZ LYS A 136 12.599 4.801 9.140 1.00 4.81 N ATOM 0 H LYS A 136 6.203 2.623 8.485 1.00 0.85 H new ATOM 0 HA LYS A 136 8.952 3.411 8.104 1.00 1.14 H new ATOM 0 HB2 LYS A 136 7.798 4.405 10.407 1.00 1.71 H new ATOM 0 HB3 LYS A 136 8.400 2.861 10.974 1.00 1.71 H new ATOM 0 HG2 LYS A 136 10.055 5.012 9.611 1.00 2.72 H new ATOM 0 HG3 LYS A 136 10.030 4.675 11.330 1.00 2.72 H new ATOM 0 HD2 LYS A 136 10.915 2.404 10.925 1.00 3.21 H new ATOM 0 HD3 LYS A 136 10.875 2.676 9.194 1.00 3.21 H new ATOM 0 HE2 LYS A 136 12.531 4.273 11.192 1.00 4.09 H new ATOM 0 HE3 LYS A 136 13.149 3.015 10.141 1.00 4.09 H new ATOM 0 HZ1 LYS A 136 13.614 5.004 9.043 1.00 4.81 H new ATOM 0 HZ2 LYS A 136 12.234 4.424 8.242 1.00 4.81 H new ATOM 0 HZ3 LYS A 136 12.092 5.677 9.379 1.00 4.81 H new ATOM 1985 N TRP A 137 7.799 0.774 7.978 1.00 0.69 N ATOM 1986 CA TRP A 137 7.902 -0.678 7.913 1.00 0.45 C ATOM 1987 C TRP A 137 7.887 -1.160 6.474 1.00 0.43 C ATOM 1988 O TRP A 137 7.771 -0.375 5.542 1.00 0.55 O ATOM 1989 CB TRP A 137 6.750 -1.374 8.652 1.00 0.42 C ATOM 1990 CG TRP A 137 6.809 -1.273 10.140 1.00 0.62 C ATOM 1991 CD1 TRP A 137 7.155 -2.246 11.033 1.00 0.93 C ATOM 1992 CD2 TRP A 137 6.491 -0.117 10.906 1.00 1.00 C ATOM 1993 NE1 TRP A 137 7.123 -1.731 12.308 1.00 1.11 N ATOM 1994 CE2 TRP A 137 6.708 -0.429 12.251 1.00 1.16 C ATOM 1995 CE3 TRP A 137 6.065 1.161 10.569 1.00 1.47 C ATOM 1996 CZ2 TRP A 137 6.511 0.501 13.264 1.00 1.59 C ATOM 1997 CZ3 TRP A 137 5.870 2.082 11.560 1.00 1.97 C ATOM 1998 CH2 TRP A 137 6.093 1.754 12.902 1.00 1.97 C ATOM 0 H TRP A 137 7.185 1.182 7.273 1.00 0.69 H new ATOM 0 HA TRP A 137 8.846 -0.934 8.393 1.00 0.45 H new ATOM 0 HB2 TRP A 137 5.807 -0.947 8.310 1.00 0.42 H new ATOM 0 HB3 TRP A 137 6.742 -2.428 8.373 1.00 0.42 H new ATOM 0 HD1 TRP A 137 7.414 -3.263 10.778 1.00 0.93 H new ATOM 0 HE1 TRP A 137 7.369 -2.238 13.158 1.00 1.11 H new ATOM 0 HE3 TRP A 137 5.890 1.424 9.536 1.00 1.47 H new ATOM 0 HZ2 TRP A 137 6.681 0.245 14.299 1.00 1.59 H new ATOM 0 HZ3 TRP A 137 5.539 3.078 11.304 1.00 1.97 H new ATOM 0 HH2 TRP A 137 5.933 2.501 13.665 1.00 1.97 H new ATOM 2009 N ASN A 138 8.100 -2.453 6.323 1.00 0.37 N ATOM 2010 CA ASN A 138 7.681 -3.215 5.141 1.00 0.38 C ATOM 2011 C ASN A 138 6.259 -2.840 4.682 1.00 0.31 C ATOM 2012 O ASN A 138 5.746 -1.773 4.971 1.00 0.30 O ATOM 2013 CB ASN A 138 7.724 -4.719 5.426 1.00 0.41 C ATOM 2014 CG ASN A 138 9.132 -5.291 5.491 1.00 1.06 C ATOM 2015 OD1 ASN A 138 10.093 -4.597 5.813 1.00 2.04 O ATOM 2016 ND2 ASN A 138 9.258 -6.576 5.185 1.00 1.40 N ATOM 0 H ASN A 138 8.576 -3.021 7.024 1.00 0.37 H new ATOM 0 HA ASN A 138 8.381 -2.963 4.344 1.00 0.38 H new ATOM 0 HB2 ASN A 138 7.218 -4.915 6.371 1.00 0.41 H new ATOM 0 HB3 ASN A 138 7.165 -5.242 4.651 1.00 0.41 H new ATOM 0 HD21 ASN A 138 10.176 -7.019 5.213 1.00 1.40 H new ATOM 0 HD22 ASN A 138 8.437 -7.121 4.922 1.00 1.40 H new ATOM 2023 N PHE A 139 5.644 -3.781 3.981 1.00 0.34 N ATOM 2024 CA PHE A 139 4.393 -3.604 3.233 1.00 0.36 C ATOM 2025 C PHE A 139 3.418 -2.535 3.772 1.00 0.32 C ATOM 2026 O PHE A 139 2.922 -1.765 2.969 1.00 0.57 O ATOM 2027 CB PHE A 139 3.697 -4.956 3.263 1.00 0.55 C ATOM 2028 CG PHE A 139 3.959 -5.810 2.069 1.00 0.55 C ATOM 2029 CD1 PHE A 139 5.251 -6.045 1.614 1.00 0.61 C ATOM 2030 CD2 PHE A 139 2.899 -6.389 1.403 1.00 1.23 C ATOM 2031 CE1 PHE A 139 5.464 -6.849 0.517 1.00 1.22 C ATOM 2032 CE2 PHE A 139 3.108 -7.192 0.311 1.00 1.93 C ATOM 2033 CZ PHE A 139 4.389 -7.425 -0.132 1.00 1.89 C ATOM 0 H PHE A 139 6.012 -4.730 3.910 1.00 0.34 H new ATOM 0 HA PHE A 139 4.661 -3.245 2.239 1.00 0.36 H new ATOM 0 HB2 PHE A 139 4.014 -5.494 4.156 1.00 0.55 H new ATOM 0 HB3 PHE A 139 2.622 -4.796 3.351 1.00 0.55 H new ATOM 0 HD1 PHE A 139 6.091 -5.595 2.123 1.00 0.61 H new ATOM 0 HD2 PHE A 139 1.891 -6.208 1.746 1.00 1.23 H new ATOM 0 HE1 PHE A 139 6.469 -7.029 0.165 1.00 1.22 H new ATOM 0 HE2 PHE A 139 2.269 -7.640 -0.200 1.00 1.93 H new ATOM 0 HZ PHE A 139 4.555 -8.060 -0.990 1.00 1.89 H new ATOM 2043 N THR A 140 3.130 -2.507 5.084 1.00 0.25 N ATOM 2044 CA THR A 140 2.278 -1.476 5.700 1.00 0.25 C ATOM 2045 C THR A 140 1.122 -1.033 4.801 1.00 0.22 C ATOM 2046 O THR A 140 1.235 -0.093 4.014 1.00 0.29 O ATOM 2047 CB THR A 140 3.099 -0.242 6.115 1.00 0.37 C ATOM 2048 OG1 THR A 140 4.281 -0.655 6.808 1.00 0.48 O ATOM 2049 CG2 THR A 140 2.287 0.682 7.012 1.00 0.60 C ATOM 0 H THR A 140 3.481 -3.198 5.747 1.00 0.25 H new ATOM 0 HA THR A 140 1.850 -1.946 6.585 1.00 0.25 H new ATOM 0 HB THR A 140 3.370 0.302 5.210 1.00 0.37 H new ATOM 0 HG1 THR A 140 5.027 -0.716 6.175 1.00 0.48 H new ATOM 0 HG21 THR A 140 2.893 1.545 7.289 1.00 0.60 H new ATOM 0 HG22 THR A 140 1.398 1.019 6.478 1.00 0.60 H new ATOM 0 HG23 THR A 140 1.988 0.145 7.912 1.00 0.60 H new ATOM 2057 N SER A 141 0.002 -1.689 4.961 1.00 0.19 N ATOM 2058 CA SER A 141 -1.142 -1.446 4.102 1.00 0.20 C ATOM 2059 C SER A 141 -1.939 -0.243 4.594 1.00 0.22 C ATOM 2060 O SER A 141 -1.754 0.178 5.717 1.00 0.39 O ATOM 2061 CB SER A 141 -2.016 -2.676 4.138 1.00 0.26 C ATOM 2062 OG SER A 141 -1.245 -3.823 4.445 1.00 0.62 O ATOM 0 H SER A 141 -0.149 -2.398 5.678 1.00 0.19 H new ATOM 0 HA SER A 141 -0.803 -1.237 3.087 1.00 0.20 H new ATOM 0 HB2 SER A 141 -2.802 -2.549 4.882 1.00 0.26 H new ATOM 0 HB3 SER A 141 -2.508 -2.808 3.174 1.00 0.26 H new ATOM 0 HG SER A 141 -0.753 -4.110 3.647 1.00 0.62 H new ATOM 2068 N PHE A 142 -2.800 0.314 3.749 1.00 0.19 N ATOM 2069 CA PHE A 142 -3.790 1.296 4.168 1.00 0.18 C ATOM 2070 C PHE A 142 -5.091 0.812 3.617 1.00 0.18 C ATOM 2071 O PHE A 142 -5.210 0.607 2.421 1.00 0.21 O ATOM 2072 CB PHE A 142 -3.503 2.683 3.585 1.00 0.22 C ATOM 2073 CG PHE A 142 -2.341 3.417 4.184 1.00 0.26 C ATOM 2074 CD1 PHE A 142 -1.060 3.245 3.687 1.00 0.42 C ATOM 2075 CD2 PHE A 142 -2.538 4.317 5.220 1.00 0.35 C ATOM 2076 CE1 PHE A 142 0.002 3.950 4.216 1.00 0.55 C ATOM 2077 CE2 PHE A 142 -1.480 5.031 5.747 1.00 0.50 C ATOM 2078 CZ PHE A 142 -0.210 4.846 5.245 1.00 0.57 C ATOM 0 H PHE A 142 -2.830 0.096 2.753 1.00 0.19 H new ATOM 0 HA PHE A 142 -3.786 1.393 5.254 1.00 0.18 H new ATOM 0 HB2 PHE A 142 -3.328 2.577 2.514 1.00 0.22 H new ATOM 0 HB3 PHE A 142 -4.396 3.297 3.703 1.00 0.22 H new ATOM 0 HD1 PHE A 142 -0.890 2.552 2.877 1.00 0.42 H new ATOM 0 HD2 PHE A 142 -3.531 4.461 5.620 1.00 0.35 H new ATOM 0 HE1 PHE A 142 0.998 3.801 3.826 1.00 0.55 H new ATOM 0 HE2 PHE A 142 -1.647 5.733 6.551 1.00 0.50 H new ATOM 0 HZ PHE A 142 0.620 5.402 5.656 1.00 0.57 H new ATOM 2088 N LEU A 143 -6.059 0.594 4.448 1.00 0.17 N ATOM 2089 CA LEU A 143 -7.297 0.116 3.938 1.00 0.16 C ATOM 2090 C LEU A 143 -8.056 1.277 3.378 1.00 0.15 C ATOM 2091 O LEU A 143 -8.595 2.112 4.095 1.00 0.18 O ATOM 2092 CB LEU A 143 -8.075 -0.625 5.000 1.00 0.21 C ATOM 2093 CG LEU A 143 -9.588 -0.660 4.803 1.00 0.23 C ATOM 2094 CD1 LEU A 143 -9.979 -1.547 3.633 1.00 0.41 C ATOM 2095 CD2 LEU A 143 -10.280 -1.111 6.075 1.00 0.43 C ATOM 0 H LEU A 143 -6.018 0.736 5.457 1.00 0.17 H new ATOM 0 HA LEU A 143 -7.121 -0.606 3.140 1.00 0.16 H new ATOM 0 HB2 LEU A 143 -7.708 -1.650 5.045 1.00 0.21 H new ATOM 0 HB3 LEU A 143 -7.863 -0.168 5.966 1.00 0.21 H new ATOM 0 HG LEU A 143 -9.916 0.353 4.570 1.00 0.23 H new ATOM 0 HD11 LEU A 143 -11.063 -1.547 3.523 1.00 0.41 H new ATOM 0 HD12 LEU A 143 -9.522 -1.167 2.719 1.00 0.41 H new ATOM 0 HD13 LEU A 143 -9.632 -2.564 3.816 1.00 0.41 H new ATOM 0 HD21 LEU A 143 -11.358 -1.130 5.916 1.00 0.43 H new ATOM 0 HD22 LEU A 143 -9.935 -2.110 6.342 1.00 0.43 H new ATOM 0 HD23 LEU A 143 -10.045 -0.418 6.883 1.00 0.43 H new ATOM 2107 N ILE A 144 -8.027 1.323 2.078 1.00 0.14 N ATOM 2108 CA ILE A 144 -8.663 2.349 1.322 1.00 0.14 C ATOM 2109 C ILE A 144 -10.068 1.886 1.022 1.00 0.15 C ATOM 2110 O ILE A 144 -10.276 0.717 0.716 1.00 0.19 O ATOM 2111 CB ILE A 144 -7.901 2.577 0.013 1.00 0.15 C ATOM 2112 CG1 ILE A 144 -6.416 2.816 0.261 1.00 0.17 C ATOM 2113 CG2 ILE A 144 -8.515 3.722 -0.755 1.00 0.17 C ATOM 2114 CD1 ILE A 144 -6.122 3.975 1.155 1.00 0.19 C ATOM 0 H ILE A 144 -7.547 0.629 1.505 1.00 0.14 H new ATOM 0 HA ILE A 144 -8.677 3.286 1.879 1.00 0.14 H new ATOM 0 HB ILE A 144 -7.984 1.671 -0.588 1.00 0.15 H new ATOM 0 HG12 ILE A 144 -5.983 1.916 0.698 1.00 0.17 H new ATOM 0 HG13 ILE A 144 -5.921 2.976 -0.697 1.00 0.17 H new ATOM 0 HG21 ILE A 144 -7.964 3.874 -1.683 1.00 0.17 H new ATOM 0 HG22 ILE A 144 -9.555 3.490 -0.984 1.00 0.17 H new ATOM 0 HG23 ILE A 144 -8.469 4.630 -0.153 1.00 0.17 H new ATOM 0 HD11 ILE A 144 -5.044 4.075 1.279 1.00 0.19 H new ATOM 0 HD12 ILE A 144 -6.522 4.887 0.712 1.00 0.19 H new ATOM 0 HD13 ILE A 144 -6.585 3.811 2.128 1.00 0.19 H new ATOM 2126 N ASP A 145 -11.023 2.778 1.105 1.00 0.14 N ATOM 2127 CA ASP A 145 -12.423 2.349 1.061 1.00 0.15 C ATOM 2128 C ASP A 145 -12.978 2.414 -0.360 1.00 0.14 C ATOM 2129 O ASP A 145 -12.239 2.714 -1.294 1.00 0.15 O ATOM 2130 CB ASP A 145 -13.278 3.158 2.052 1.00 0.19 C ATOM 2131 CG ASP A 145 -14.211 4.153 1.394 1.00 0.58 C ATOM 2132 OD1 ASP A 145 -13.731 5.136 0.806 1.00 0.98 O ATOM 2133 OD2 ASP A 145 -15.438 3.933 1.448 1.00 0.75 O ATOM 0 H ASP A 145 -10.877 3.783 1.201 1.00 0.14 H new ATOM 0 HA ASP A 145 -12.467 1.305 1.372 1.00 0.15 H new ATOM 0 HB2 ASP A 145 -13.867 2.467 2.655 1.00 0.19 H new ATOM 0 HB3 ASP A 145 -12.617 3.692 2.734 1.00 0.19 H new ATOM 2138 N ARG A 146 -14.267 2.106 -0.518 1.00 0.17 N ATOM 2139 CA ARG A 146 -14.908 2.071 -1.832 1.00 0.17 C ATOM 2140 C ARG A 146 -14.662 3.364 -2.599 1.00 0.18 C ATOM 2141 O ARG A 146 -14.390 3.347 -3.797 1.00 0.22 O ATOM 2142 CB ARG A 146 -16.419 1.875 -1.700 1.00 0.19 C ATOM 2143 CG ARG A 146 -16.839 0.727 -0.800 1.00 0.24 C ATOM 2144 CD ARG A 146 -18.340 0.496 -0.882 1.00 0.29 C ATOM 2145 NE ARG A 146 -19.095 1.745 -0.743 1.00 1.00 N ATOM 2146 CZ ARG A 146 -20.311 1.945 -1.252 1.00 1.46 C ATOM 2147 NH1 ARG A 146 -20.945 0.962 -1.882 1.00 1.63 N ATOM 2148 NH2 ARG A 146 -20.900 3.127 -1.119 1.00 2.22 N ATOM 0 H ARG A 146 -14.891 1.876 0.255 1.00 0.17 H new ATOM 0 HA ARG A 146 -14.471 1.232 -2.374 1.00 0.17 H new ATOM 0 HB2 ARG A 146 -16.858 2.796 -1.318 1.00 0.19 H new ATOM 0 HB3 ARG A 146 -16.837 1.711 -2.693 1.00 0.19 H new ATOM 0 HG2 ARG A 146 -16.311 -0.181 -1.091 1.00 0.24 H new ATOM 0 HG3 ARG A 146 -16.556 0.944 0.230 1.00 0.24 H new ATOM 0 HD2 ARG A 146 -18.584 0.029 -1.836 1.00 0.29 H new ATOM 0 HD3 ARG A 146 -18.643 -0.200 -0.100 1.00 0.29 H new ATOM 0 HE ARG A 146 -18.663 2.509 -0.224 1.00 1.00 H new ATOM 0 HH11 ARG A 146 -20.502 0.048 -1.978 1.00 1.63 H new ATOM 0 HH12 ARG A 146 -21.875 1.121 -2.269 1.00 1.63 H new ATOM 0 HH21 ARG A 146 -20.422 3.882 -0.627 1.00 2.22 H new ATOM 0 HH22 ARG A 146 -21.830 3.280 -1.508 1.00 2.22 H new ATOM 2162 N ASP A 147 -14.747 4.484 -1.897 1.00 0.18 N ATOM 2163 CA ASP A 147 -14.630 5.785 -2.529 1.00 0.21 C ATOM 2164 C ASP A 147 -13.206 6.278 -2.417 1.00 0.18 C ATOM 2165 O ASP A 147 -12.933 7.445 -2.658 1.00 0.24 O ATOM 2166 CB ASP A 147 -15.578 6.798 -1.878 1.00 0.28 C ATOM 2167 CG ASP A 147 -17.025 6.350 -1.887 1.00 1.09 C ATOM 2168 OD1 ASP A 147 -17.748 6.664 -2.856 1.00 1.19 O ATOM 2169 OD2 ASP A 147 -17.455 5.697 -0.911 1.00 2.00 O ATOM 0 H ASP A 147 -14.897 4.516 -0.889 1.00 0.18 H new ATOM 0 HA ASP A 147 -14.903 5.683 -3.579 1.00 0.21 H new ATOM 0 HB2 ASP A 147 -15.264 6.971 -0.849 1.00 0.28 H new ATOM 0 HB3 ASP A 147 -15.496 7.751 -2.401 1.00 0.28 H new ATOM 2174 N GLY A 148 -12.300 5.373 -2.073 1.00 0.16 N ATOM 2175 CA GLY A 148 -10.907 5.720 -1.950 1.00 0.16 C ATOM 2176 C GLY A 148 -10.565 6.435 -0.663 1.00 0.15 C ATOM 2177 O GLY A 148 -9.656 7.253 -0.641 1.00 0.17 O ATOM 0 H GLY A 148 -12.513 4.395 -1.876 1.00 0.16 H new ATOM 0 HA2 GLY A 148 -10.309 4.811 -2.019 1.00 0.16 H new ATOM 0 HA3 GLY A 148 -10.625 6.352 -2.792 1.00 0.16 H new ATOM 2181 N VAL A 149 -11.271 6.153 0.413 1.00 0.17 N ATOM 2182 CA VAL A 149 -10.932 6.772 1.683 1.00 0.18 C ATOM 2183 C VAL A 149 -10.204 5.791 2.607 1.00 0.17 C ATOM 2184 O VAL A 149 -10.759 4.779 3.024 1.00 0.24 O ATOM 2185 CB VAL A 149 -12.177 7.338 2.401 1.00 0.28 C ATOM 2186 CG1 VAL A 149 -11.784 8.032 3.696 1.00 0.97 C ATOM 2187 CG2 VAL A 149 -12.931 8.296 1.489 1.00 1.12 C ATOM 0 H VAL A 149 -12.066 5.514 0.438 1.00 0.17 H new ATOM 0 HA VAL A 149 -10.264 7.602 1.453 1.00 0.18 H new ATOM 0 HB VAL A 149 -12.836 6.505 2.647 1.00 0.28 H new ATOM 0 HG11 VAL A 149 -12.676 8.423 4.185 1.00 0.97 H new ATOM 0 HG12 VAL A 149 -11.292 7.318 4.356 1.00 0.97 H new ATOM 0 HG13 VAL A 149 -11.102 8.853 3.476 1.00 0.97 H new ATOM 0 HG21 VAL A 149 -13.805 8.684 2.012 1.00 1.12 H new ATOM 0 HG22 VAL A 149 -12.278 9.123 1.210 1.00 1.12 H new ATOM 0 HG23 VAL A 149 -13.251 7.768 0.591 1.00 1.12 H new ATOM 2197 N PRO A 150 -8.935 6.088 2.920 1.00 0.21 N ATOM 2198 CA PRO A 150 -8.116 5.279 3.830 1.00 0.20 C ATOM 2199 C PRO A 150 -8.665 5.339 5.255 1.00 0.23 C ATOM 2200 O PRO A 150 -8.715 6.408 5.868 1.00 0.34 O ATOM 2201 CB PRO A 150 -6.743 5.952 3.780 1.00 0.26 C ATOM 2202 CG PRO A 150 -7.004 7.333 3.296 1.00 0.29 C ATOM 2203 CD PRO A 150 -8.214 7.259 2.421 1.00 0.41 C ATOM 0 HA PRO A 150 -8.096 4.227 3.545 1.00 0.20 H new ATOM 0 HB2 PRO A 150 -6.273 5.962 4.763 1.00 0.26 H new ATOM 0 HB3 PRO A 150 -6.068 5.420 3.109 1.00 0.26 H new ATOM 0 HG2 PRO A 150 -7.172 8.011 4.133 1.00 0.29 H new ATOM 0 HG3 PRO A 150 -6.148 7.717 2.741 1.00 0.29 H new ATOM 0 HD2 PRO A 150 -8.818 8.163 2.497 1.00 0.41 H new ATOM 0 HD3 PRO A 150 -7.942 7.144 1.372 1.00 0.41 H new ATOM 2211 N VAL A 151 -9.072 4.205 5.782 1.00 0.22 N ATOM 2212 CA VAL A 151 -9.686 4.160 7.095 1.00 0.29 C ATOM 2213 C VAL A 151 -8.867 3.292 8.027 1.00 0.32 C ATOM 2214 O VAL A 151 -9.102 3.270 9.230 1.00 0.61 O ATOM 2215 CB VAL A 151 -11.141 3.645 7.031 1.00 0.42 C ATOM 2216 CG1 VAL A 151 -12.041 4.672 6.356 1.00 1.45 C ATOM 2217 CG2 VAL A 151 -11.209 2.312 6.299 1.00 1.13 C ATOM 0 H VAL A 151 -8.989 3.299 5.322 1.00 0.22 H new ATOM 0 HA VAL A 151 -9.712 5.179 7.481 1.00 0.29 H new ATOM 0 HB VAL A 151 -11.495 3.493 8.051 1.00 0.42 H new ATOM 0 HG11 VAL A 151 -13.062 4.293 6.319 1.00 1.45 H new ATOM 0 HG12 VAL A 151 -12.020 5.603 6.923 1.00 1.45 H new ATOM 0 HG13 VAL A 151 -11.686 4.856 5.342 1.00 1.45 H new ATOM 0 HG21 VAL A 151 -12.243 1.968 6.266 1.00 1.13 H new ATOM 0 HG22 VAL A 151 -10.835 2.435 5.283 1.00 1.13 H new ATOM 0 HG23 VAL A 151 -10.599 1.577 6.824 1.00 1.13 H new ATOM 2227 N GLU A 152 -7.897 2.588 7.456 1.00 0.19 N ATOM 2228 CA GLU A 152 -6.965 1.775 8.237 1.00 0.20 C ATOM 2229 C GLU A 152 -5.598 1.790 7.614 1.00 0.20 C ATOM 2230 O GLU A 152 -5.415 2.254 6.495 1.00 0.19 O ATOM 2231 CB GLU A 152 -7.397 0.309 8.343 1.00 0.21 C ATOM 2232 CG GLU A 152 -8.764 0.131 8.925 1.00 0.57 C ATOM 2233 CD GLU A 152 -8.800 0.363 10.426 1.00 0.63 C ATOM 2234 OE1 GLU A 152 -7.874 1.012 10.959 1.00 1.17 O ATOM 2235 OE2 GLU A 152 -9.745 -0.108 11.086 1.00 1.17 O ATOM 0 H GLU A 152 -7.733 2.562 6.450 1.00 0.19 H new ATOM 0 HA GLU A 152 -6.955 2.218 9.233 1.00 0.20 H new ATOM 0 HB2 GLU A 152 -7.371 -0.142 7.351 1.00 0.21 H new ATOM 0 HB3 GLU A 152 -6.676 -0.231 8.957 1.00 0.21 H new ATOM 0 HG2 GLU A 152 -9.454 0.821 8.439 1.00 0.57 H new ATOM 0 HG3 GLU A 152 -9.117 -0.877 8.709 1.00 0.57 H new ATOM 2242 N ARG A 153 -4.645 1.327 8.376 1.00 0.23 N ATOM 2243 CA ARG A 153 -3.372 0.911 7.840 1.00 0.24 C ATOM 2244 C ARG A 153 -2.828 -0.233 8.674 1.00 0.25 C ATOM 2245 O ARG A 153 -2.743 -0.148 9.902 1.00 0.39 O ATOM 2246 CB ARG A 153 -2.389 2.074 7.739 1.00 0.36 C ATOM 2247 CG ARG A 153 -1.048 1.848 8.422 1.00 0.40 C ATOM 2248 CD ARG A 153 -0.367 3.180 8.686 1.00 0.47 C ATOM 2249 NE ARG A 153 -1.299 4.190 9.211 1.00 0.65 N ATOM 2250 CZ ARG A 153 -2.072 4.041 10.298 1.00 1.51 C ATOM 2251 NH1 ARG A 153 -2.064 2.912 11.001 1.00 2.16 N ATOM 2252 NH2 ARG A 153 -2.855 5.039 10.682 1.00 1.85 N ATOM 0 H ARG A 153 -4.727 1.226 9.388 1.00 0.23 H new ATOM 0 HA ARG A 153 -3.516 0.557 6.819 1.00 0.24 H new ATOM 0 HB2 ARG A 153 -2.211 2.288 6.685 1.00 0.36 H new ATOM 0 HB3 ARG A 153 -2.854 2.961 8.170 1.00 0.36 H new ATOM 0 HG2 ARG A 153 -1.194 1.313 9.360 1.00 0.40 H new ATOM 0 HG3 ARG A 153 -0.412 1.223 7.795 1.00 0.40 H new ATOM 0 HD2 ARG A 153 0.446 3.035 9.397 1.00 0.47 H new ATOM 0 HD3 ARG A 153 0.079 3.547 7.762 1.00 0.47 H new ATOM 0 HE ARG A 153 -1.363 5.075 8.708 1.00 0.65 H new ATOM 0 HH11 ARG A 153 -1.463 2.139 10.717 1.00 2.16 H new ATOM 0 HH12 ARG A 153 -2.659 2.820 11.824 1.00 2.16 H new ATOM 0 HH21 ARG A 153 -2.867 5.911 10.153 1.00 1.85 H new ATOM 0 HH22 ARG A 153 -3.446 4.935 11.507 1.00 1.85 H new ATOM 2266 N PHE A 154 -2.497 -1.309 7.994 1.00 0.24 N ATOM 2267 CA PHE A 154 -2.070 -2.529 8.639 1.00 0.22 C ATOM 2268 C PHE A 154 -0.561 -2.615 8.611 1.00 0.24 C ATOM 2269 O PHE A 154 0.078 -2.130 7.685 1.00 0.32 O ATOM 2270 CB PHE A 154 -2.680 -3.734 7.924 1.00 0.22 C ATOM 2271 CG PHE A 154 -4.183 -3.744 7.952 1.00 0.20 C ATOM 2272 CD1 PHE A 154 -4.911 -3.077 6.979 1.00 0.22 C ATOM 2273 CD2 PHE A 154 -4.868 -4.421 8.948 1.00 0.21 C ATOM 2274 CE1 PHE A 154 -6.291 -3.084 6.999 1.00 0.24 C ATOM 2275 CE2 PHE A 154 -6.250 -4.429 8.973 1.00 0.22 C ATOM 2276 CZ PHE A 154 -6.960 -3.760 7.997 1.00 0.22 C ATOM 0 H PHE A 154 -2.517 -1.361 6.976 1.00 0.24 H new ATOM 0 HA PHE A 154 -2.407 -2.528 9.676 1.00 0.22 H new ATOM 0 HB2 PHE A 154 -2.343 -3.742 6.887 1.00 0.22 H new ATOM 0 HB3 PHE A 154 -2.309 -4.648 8.387 1.00 0.22 H new ATOM 0 HD1 PHE A 154 -4.392 -2.545 6.195 1.00 0.22 H new ATOM 0 HD2 PHE A 154 -4.317 -4.948 9.713 1.00 0.21 H new ATOM 0 HE1 PHE A 154 -6.846 -2.561 6.234 1.00 0.24 H new ATOM 0 HE2 PHE A 154 -6.774 -4.958 9.755 1.00 0.22 H new ATOM 0 HZ PHE A 154 -8.040 -3.766 8.015 1.00 0.22 H new ATOM 2286 N SER A 155 0.008 -3.229 9.620 1.00 0.22 N ATOM 2287 CA SER A 155 1.448 -3.354 9.698 1.00 0.25 C ATOM 2288 C SER A 155 1.881 -4.615 8.970 1.00 0.22 C ATOM 2289 O SER A 155 1.118 -5.576 8.902 1.00 0.26 O ATOM 2290 CB SER A 155 1.887 -3.411 11.162 1.00 0.35 C ATOM 2291 OG SER A 155 1.346 -2.323 11.896 1.00 1.11 O ATOM 0 H SER A 155 -0.500 -3.650 10.398 1.00 0.22 H new ATOM 0 HA SER A 155 1.916 -2.489 9.228 1.00 0.25 H new ATOM 0 HB2 SER A 155 1.563 -4.352 11.607 1.00 0.35 H new ATOM 0 HB3 SER A 155 2.975 -3.389 11.221 1.00 0.35 H new ATOM 0 HG SER A 155 1.638 -2.381 12.830 1.00 1.11 H new ATOM 2297 N PRO A 156 3.087 -4.626 8.384 1.00 0.25 N ATOM 2298 CA PRO A 156 3.665 -5.846 7.839 1.00 0.29 C ATOM 2299 C PRO A 156 3.902 -6.813 8.977 1.00 0.39 C ATOM 2300 O PRO A 156 4.902 -6.736 9.688 1.00 0.78 O ATOM 2301 CB PRO A 156 4.980 -5.391 7.215 1.00 0.34 C ATOM 2302 CG PRO A 156 5.302 -4.115 7.907 1.00 0.36 C ATOM 2303 CD PRO A 156 3.982 -3.472 8.229 1.00 0.33 C ATOM 0 HA PRO A 156 3.032 -6.351 7.109 1.00 0.29 H new ATOM 0 HB2 PRO A 156 5.766 -6.131 7.363 1.00 0.34 H new ATOM 0 HB3 PRO A 156 4.879 -5.244 6.140 1.00 0.34 H new ATOM 0 HG2 PRO A 156 5.878 -4.298 8.814 1.00 0.36 H new ATOM 0 HG3 PRO A 156 5.906 -3.468 7.271 1.00 0.36 H new ATOM 0 HD2 PRO A 156 4.034 -2.875 9.140 1.00 0.33 H new ATOM 0 HD3 PRO A 156 3.651 -2.807 7.431 1.00 0.33 H new ATOM 2311 N GLY A 157 2.951 -7.689 9.154 1.00 0.36 N ATOM 2312 CA GLY A 157 2.859 -8.452 10.363 1.00 0.46 C ATOM 2313 C GLY A 157 1.414 -8.801 10.615 1.00 0.41 C ATOM 2314 O GLY A 157 1.099 -9.695 11.399 1.00 0.50 O ATOM 0 H GLY A 157 2.224 -7.891 8.468 1.00 0.36 H new ATOM 0 HA2 GLY A 157 3.457 -9.360 10.282 1.00 0.46 H new ATOM 0 HA3 GLY A 157 3.260 -7.880 11.200 1.00 0.46 H new ATOM 2318 N ALA A 158 0.530 -8.070 9.934 1.00 0.34 N ATOM 2319 CA ALA A 158 -0.861 -8.457 9.832 1.00 0.31 C ATOM 2320 C ALA A 158 -1.023 -9.292 8.572 1.00 0.34 C ATOM 2321 O ALA A 158 -0.328 -9.061 7.582 1.00 0.50 O ATOM 2322 CB ALA A 158 -1.761 -7.227 9.793 1.00 0.37 C ATOM 0 H ALA A 158 0.763 -7.205 9.446 1.00 0.34 H new ATOM 0 HA ALA A 158 -1.155 -9.041 10.704 1.00 0.31 H new ATOM 0 HB1 ALA A 158 -2.802 -7.540 9.716 1.00 0.37 H new ATOM 0 HB2 ALA A 158 -1.623 -6.646 10.705 1.00 0.37 H new ATOM 0 HB3 ALA A 158 -1.502 -6.614 8.930 1.00 0.37 H new ATOM 2328 N SER A 159 -1.908 -10.266 8.610 1.00 0.26 N ATOM 2329 CA SER A 159 -2.061 -11.183 7.507 1.00 0.30 C ATOM 2330 C SER A 159 -3.388 -10.932 6.805 1.00 0.23 C ATOM 2331 O SER A 159 -4.132 -10.019 7.180 1.00 0.22 O ATOM 2332 CB SER A 159 -1.968 -12.628 8.021 1.00 0.41 C ATOM 2333 OG SER A 159 -2.005 -13.577 6.963 1.00 1.42 O ATOM 0 H SER A 159 -2.533 -10.441 9.397 1.00 0.26 H new ATOM 0 HA SER A 159 -1.261 -11.024 6.784 1.00 0.30 H new ATOM 0 HB2 SER A 159 -1.044 -12.752 8.586 1.00 0.41 H new ATOM 0 HB3 SER A 159 -2.791 -12.821 8.709 1.00 0.41 H new ATOM 0 HG SER A 159 -1.257 -13.414 6.351 1.00 1.42 H new ATOM 2339 N VAL A 160 -3.660 -11.745 5.788 1.00 0.22 N ATOM 2340 CA VAL A 160 -4.898 -11.689 5.016 1.00 0.20 C ATOM 2341 C VAL A 160 -6.094 -11.469 5.931 1.00 0.21 C ATOM 2342 O VAL A 160 -6.869 -10.541 5.745 1.00 0.20 O ATOM 2343 CB VAL A 160 -5.104 -13.023 4.273 1.00 0.24 C ATOM 2344 CG1 VAL A 160 -6.375 -13.005 3.443 1.00 0.28 C ATOM 2345 CG2 VAL A 160 -3.910 -13.357 3.400 1.00 0.26 C ATOM 0 H VAL A 160 -3.018 -12.472 5.472 1.00 0.22 H new ATOM 0 HA VAL A 160 -4.820 -10.862 4.311 1.00 0.20 H new ATOM 0 HB VAL A 160 -5.203 -13.801 5.030 1.00 0.24 H new ATOM 0 HG11 VAL A 160 -6.490 -13.961 2.932 1.00 0.28 H new ATOM 0 HG12 VAL A 160 -7.233 -12.836 4.094 1.00 0.28 H new ATOM 0 HG13 VAL A 160 -6.317 -12.204 2.706 1.00 0.28 H new ATOM 0 HG21 VAL A 160 -4.086 -14.304 2.889 1.00 0.26 H new ATOM 0 HG22 VAL A 160 -3.767 -12.568 2.662 1.00 0.26 H new ATOM 0 HG23 VAL A 160 -3.018 -13.440 4.020 1.00 0.26 H new ATOM 2355 N LYS A 161 -6.176 -12.302 6.959 1.00 0.26 N ATOM 2356 CA LYS A 161 -7.302 -12.316 7.878 1.00 0.31 C ATOM 2357 C LYS A 161 -7.450 -10.980 8.581 1.00 0.26 C ATOM 2358 O LYS A 161 -8.548 -10.427 8.675 1.00 0.27 O ATOM 2359 CB LYS A 161 -7.079 -13.417 8.918 1.00 0.45 C ATOM 2360 CG LYS A 161 -7.799 -13.176 10.236 1.00 1.12 C ATOM 2361 CD LYS A 161 -7.058 -13.821 11.395 1.00 1.80 C ATOM 2362 CE LYS A 161 -7.544 -13.291 12.736 1.00 2.67 C ATOM 2363 NZ LYS A 161 -7.351 -11.818 12.869 1.00 3.46 N ATOM 0 H LYS A 161 -5.457 -12.991 7.179 1.00 0.26 H new ATOM 0 HA LYS A 161 -8.214 -12.506 7.312 1.00 0.31 H new ATOM 0 HB2 LYS A 161 -7.412 -14.368 8.502 1.00 0.45 H new ATOM 0 HB3 LYS A 161 -6.010 -13.510 9.111 1.00 0.45 H new ATOM 0 HG2 LYS A 161 -7.891 -12.104 10.412 1.00 1.12 H new ATOM 0 HG3 LYS A 161 -8.811 -13.578 10.179 1.00 1.12 H new ATOM 0 HD2 LYS A 161 -7.195 -14.902 11.359 1.00 1.80 H new ATOM 0 HD3 LYS A 161 -5.989 -13.632 11.294 1.00 1.80 H new ATOM 0 HE2 LYS A 161 -8.601 -13.528 12.856 1.00 2.67 H new ATOM 0 HE3 LYS A 161 -7.010 -13.799 13.539 1.00 2.67 H new ATOM 0 HZ1 LYS A 161 -7.284 -11.566 13.876 1.00 3.46 H new ATOM 0 HZ2 LYS A 161 -6.475 -11.537 12.383 1.00 3.46 H new ATOM 0 HZ3 LYS A 161 -8.159 -11.322 12.441 1.00 3.46 H new ATOM 2377 N ASP A 162 -6.326 -10.474 9.057 1.00 0.26 N ATOM 2378 CA ASP A 162 -6.294 -9.276 9.869 1.00 0.27 C ATOM 2379 C ASP A 162 -6.717 -8.072 9.049 1.00 0.22 C ATOM 2380 O ASP A 162 -7.282 -7.115 9.575 1.00 0.26 O ATOM 2381 CB ASP A 162 -4.894 -9.068 10.440 1.00 0.33 C ATOM 2382 CG ASP A 162 -4.404 -10.266 11.225 1.00 0.78 C ATOM 2383 OD1 ASP A 162 -5.029 -10.614 12.250 1.00 0.86 O ATOM 2384 OD2 ASP A 162 -3.391 -10.869 10.819 1.00 1.40 O ATOM 0 H ASP A 162 -5.408 -10.886 8.889 1.00 0.26 H new ATOM 0 HA ASP A 162 -6.995 -9.392 10.696 1.00 0.27 H new ATOM 0 HB2 ASP A 162 -4.200 -8.863 9.625 1.00 0.33 H new ATOM 0 HB3 ASP A 162 -4.895 -8.190 11.086 1.00 0.33 H new ATOM 2389 N ILE A 163 -6.429 -8.127 7.761 1.00 0.18 N ATOM 2390 CA ILE A 163 -6.827 -7.081 6.841 1.00 0.15 C ATOM 2391 C ILE A 163 -8.279 -7.256 6.398 1.00 0.14 C ATOM 2392 O ILE A 163 -9.049 -6.295 6.397 1.00 0.15 O ATOM 2393 CB ILE A 163 -5.898 -7.056 5.609 1.00 0.14 C ATOM 2394 CG1 ILE A 163 -4.504 -6.535 5.996 1.00 0.15 C ATOM 2395 CG2 ILE A 163 -6.504 -6.217 4.491 1.00 0.15 C ATOM 2396 CD1 ILE A 163 -3.518 -6.540 4.847 1.00 0.21 C ATOM 0 H ILE A 163 -5.916 -8.894 7.327 1.00 0.18 H new ATOM 0 HA ILE A 163 -6.742 -6.130 7.366 1.00 0.15 H new ATOM 0 HB ILE A 163 -5.789 -8.076 5.240 1.00 0.14 H new ATOM 0 HG12 ILE A 163 -4.598 -5.519 6.380 1.00 0.15 H new ATOM 0 HG13 ILE A 163 -4.108 -7.147 6.807 1.00 0.15 H new ATOM 0 HG21 ILE A 163 -5.832 -6.214 3.633 1.00 0.15 H new ATOM 0 HG22 ILE A 163 -7.464 -6.641 4.198 1.00 0.15 H new ATOM 0 HG23 ILE A 163 -6.650 -5.195 4.841 1.00 0.15 H new ATOM 0 HD11 ILE A 163 -2.556 -6.160 5.191 1.00 0.21 H new ATOM 0 HD12 ILE A 163 -3.395 -7.558 4.478 1.00 0.21 H new ATOM 0 HD13 ILE A 163 -3.892 -5.905 4.044 1.00 0.21 H new ATOM 2408 N GLU A 164 -8.653 -8.487 6.051 1.00 0.13 N ATOM 2409 CA GLU A 164 -9.998 -8.778 5.555 1.00 0.13 C ATOM 2410 C GLU A 164 -11.064 -8.279 6.518 1.00 0.15 C ATOM 2411 O GLU A 164 -12.062 -7.720 6.109 1.00 0.15 O ATOM 2412 CB GLU A 164 -10.221 -10.277 5.370 1.00 0.14 C ATOM 2413 CG GLU A 164 -9.398 -10.921 4.281 1.00 0.20 C ATOM 2414 CD GLU A 164 -9.643 -12.412 4.200 1.00 0.30 C ATOM 2415 OE1 GLU A 164 -9.193 -13.143 5.108 1.00 0.67 O ATOM 2416 OE2 GLU A 164 -10.292 -12.860 3.235 1.00 0.60 O ATOM 0 H GLU A 164 -8.041 -9.301 6.104 1.00 0.13 H new ATOM 0 HA GLU A 164 -10.080 -8.266 4.596 1.00 0.13 H new ATOM 0 HB2 GLU A 164 -10.003 -10.779 6.313 1.00 0.14 H new ATOM 0 HB3 GLU A 164 -11.276 -10.447 5.154 1.00 0.14 H new ATOM 0 HG2 GLU A 164 -9.639 -10.460 3.323 1.00 0.20 H new ATOM 0 HG3 GLU A 164 -8.340 -10.736 4.467 1.00 0.20 H new ATOM 2423 N GLU A 165 -10.848 -8.503 7.799 1.00 0.18 N ATOM 2424 CA GLU A 165 -11.828 -8.137 8.821 1.00 0.21 C ATOM 2425 C GLU A 165 -12.141 -6.637 8.815 1.00 0.21 C ATOM 2426 O GLU A 165 -13.172 -6.211 9.337 1.00 0.27 O ATOM 2427 CB GLU A 165 -11.356 -8.589 10.212 1.00 0.27 C ATOM 2428 CG GLU A 165 -9.909 -8.242 10.516 1.00 0.47 C ATOM 2429 CD GLU A 165 -9.429 -8.801 11.842 1.00 0.66 C ATOM 2430 OE1 GLU A 165 -9.229 -10.033 11.943 1.00 0.83 O ATOM 2431 OE2 GLU A 165 -9.241 -8.012 12.788 1.00 0.87 O ATOM 0 H GLU A 165 -10.001 -8.938 8.165 1.00 0.18 H new ATOM 0 HA GLU A 165 -12.754 -8.658 8.578 1.00 0.21 H new ATOM 0 HB2 GLU A 165 -11.995 -8.132 10.968 1.00 0.27 H new ATOM 0 HB3 GLU A 165 -11.485 -9.668 10.295 1.00 0.27 H new ATOM 0 HG2 GLU A 165 -9.274 -8.624 9.716 1.00 0.47 H new ATOM 0 HG3 GLU A 165 -9.795 -7.158 10.523 1.00 0.47 H new ATOM 2438 N LYS A 166 -11.262 -5.841 8.222 1.00 0.19 N ATOM 2439 CA LYS A 166 -11.540 -4.425 8.032 1.00 0.20 C ATOM 2440 C LYS A 166 -11.931 -4.161 6.579 1.00 0.19 C ATOM 2441 O LYS A 166 -12.683 -3.238 6.273 1.00 0.25 O ATOM 2442 CB LYS A 166 -10.331 -3.570 8.422 1.00 0.25 C ATOM 2443 CG LYS A 166 -9.908 -3.723 9.876 1.00 0.38 C ATOM 2444 CD LYS A 166 -11.018 -3.315 10.829 1.00 0.58 C ATOM 2445 CE LYS A 166 -10.564 -3.400 12.276 1.00 1.09 C ATOM 2446 NZ LYS A 166 -11.665 -3.088 13.225 1.00 1.71 N ATOM 0 H LYS A 166 -10.357 -6.149 7.867 1.00 0.19 H new ATOM 0 HA LYS A 166 -12.371 -4.148 8.681 1.00 0.20 H new ATOM 0 HB2 LYS A 166 -9.490 -3.833 7.780 1.00 0.25 H new ATOM 0 HB3 LYS A 166 -10.563 -2.522 8.230 1.00 0.25 H new ATOM 0 HG2 LYS A 166 -9.627 -4.759 10.066 1.00 0.38 H new ATOM 0 HG3 LYS A 166 -9.024 -3.113 10.064 1.00 0.38 H new ATOM 0 HD2 LYS A 166 -11.336 -2.297 10.605 1.00 0.58 H new ATOM 0 HD3 LYS A 166 -11.884 -3.960 10.679 1.00 0.58 H new ATOM 0 HE2 LYS A 166 -10.184 -4.401 12.478 1.00 1.09 H new ATOM 0 HE3 LYS A 166 -9.738 -2.707 12.438 1.00 1.09 H new ATOM 0 HZ1 LYS A 166 -11.312 -3.158 14.201 1.00 1.71 H new ATOM 0 HZ2 LYS A 166 -12.011 -2.123 13.050 1.00 1.71 H new ATOM 0 HZ3 LYS A 166 -12.443 -3.765 13.089 1.00 1.71 H new ATOM 2460 N LEU A 167 -11.428 -5.014 5.702 1.00 0.15 N ATOM 2461 CA LEU A 167 -11.635 -4.899 4.268 1.00 0.15 C ATOM 2462 C LEU A 167 -13.025 -5.371 3.840 1.00 0.15 C ATOM 2463 O LEU A 167 -13.734 -4.675 3.112 1.00 0.16 O ATOM 2464 CB LEU A 167 -10.585 -5.741 3.552 1.00 0.13 C ATOM 2465 CG LEU A 167 -10.920 -6.068 2.110 1.00 0.14 C ATOM 2466 CD1 LEU A 167 -10.774 -4.833 1.241 1.00 0.16 C ATOM 2467 CD2 LEU A 167 -10.054 -7.203 1.603 1.00 0.16 C ATOM 0 H LEU A 167 -10.857 -5.816 5.969 1.00 0.15 H new ATOM 0 HA LEU A 167 -11.548 -3.845 4.002 1.00 0.15 H new ATOM 0 HB2 LEU A 167 -9.632 -5.212 3.580 1.00 0.13 H new ATOM 0 HB3 LEU A 167 -10.448 -6.673 4.101 1.00 0.13 H new ATOM 0 HG LEU A 167 -11.958 -6.396 2.059 1.00 0.14 H new ATOM 0 HD11 LEU A 167 -11.018 -5.084 0.209 1.00 0.16 H new ATOM 0 HD12 LEU A 167 -11.452 -4.056 1.596 1.00 0.16 H new ATOM 0 HD13 LEU A 167 -9.747 -4.470 1.294 1.00 0.16 H new ATOM 0 HD21 LEU A 167 -10.311 -7.422 0.566 1.00 0.16 H new ATOM 0 HD22 LEU A 167 -9.004 -6.915 1.664 1.00 0.16 H new ATOM 0 HD23 LEU A 167 -10.223 -8.090 2.213 1.00 0.16 H new ATOM 2479 N ILE A 168 -13.388 -6.570 4.281 1.00 0.16 N ATOM 2480 CA ILE A 168 -14.630 -7.220 3.883 1.00 0.19 C ATOM 2481 C ILE A 168 -15.857 -6.334 4.141 1.00 0.22 C ATOM 2482 O ILE A 168 -16.714 -6.220 3.271 1.00 0.25 O ATOM 2483 CB ILE A 168 -14.804 -8.593 4.575 1.00 0.20 C ATOM 2484 CG1 ILE A 168 -13.630 -9.521 4.221 1.00 0.19 C ATOM 2485 CG2 ILE A 168 -16.133 -9.230 4.181 1.00 0.26 C ATOM 2486 CD1 ILE A 168 -13.683 -10.859 4.932 1.00 0.24 C ATOM 0 H ILE A 168 -12.825 -7.121 4.929 1.00 0.16 H new ATOM 0 HA ILE A 168 -14.558 -7.384 2.808 1.00 0.19 H new ATOM 0 HB ILE A 168 -14.809 -8.439 5.654 1.00 0.20 H new ATOM 0 HG12 ILE A 168 -13.623 -9.690 3.144 1.00 0.19 H new ATOM 0 HG13 ILE A 168 -12.694 -9.022 4.472 1.00 0.19 H new ATOM 0 HG21 ILE A 168 -16.236 -10.195 4.678 1.00 0.26 H new ATOM 0 HG22 ILE A 168 -16.953 -8.577 4.482 1.00 0.26 H new ATOM 0 HG23 ILE A 168 -16.162 -9.374 3.101 1.00 0.26 H new ATOM 0 HD11 ILE A 168 -12.825 -11.463 4.636 1.00 0.24 H new ATOM 0 HD12 ILE A 168 -13.660 -10.699 6.010 1.00 0.24 H new ATOM 0 HD13 ILE A 168 -14.603 -11.378 4.662 1.00 0.24 H new ATOM 2498 N PRO A 169 -15.971 -5.693 5.327 1.00 0.24 N ATOM 2499 CA PRO A 169 -17.043 -4.721 5.597 1.00 0.29 C ATOM 2500 C PRO A 169 -17.155 -3.639 4.520 1.00 0.29 C ATOM 2501 O PRO A 169 -18.240 -3.107 4.272 1.00 0.41 O ATOM 2502 CB PRO A 169 -16.625 -4.097 6.927 1.00 0.34 C ATOM 2503 CG PRO A 169 -15.840 -5.160 7.606 1.00 0.40 C ATOM 2504 CD PRO A 169 -15.114 -5.896 6.516 1.00 0.24 C ATOM 0 HA PRO A 169 -18.022 -5.201 5.614 1.00 0.29 H new ATOM 0 HB2 PRO A 169 -16.027 -3.199 6.773 1.00 0.34 H new ATOM 0 HB3 PRO A 169 -17.493 -3.805 7.519 1.00 0.34 H new ATOM 0 HG2 PRO A 169 -15.139 -4.731 8.322 1.00 0.40 H new ATOM 0 HG3 PRO A 169 -16.493 -5.832 8.163 1.00 0.40 H new ATOM 0 HD2 PRO A 169 -14.112 -5.496 6.361 1.00 0.24 H new ATOM 0 HD3 PRO A 169 -15.001 -6.954 6.753 1.00 0.24 H new ATOM 2512 N LEU A 170 -16.036 -3.315 3.882 1.00 0.22 N ATOM 2513 CA LEU A 170 -16.026 -2.317 2.822 1.00 0.22 C ATOM 2514 C LEU A 170 -16.305 -2.953 1.459 1.00 0.20 C ATOM 2515 O LEU A 170 -17.045 -2.384 0.657 1.00 0.23 O ATOM 2516 CB LEU A 170 -14.700 -1.555 2.798 1.00 0.24 C ATOM 2517 CG LEU A 170 -14.475 -0.585 3.951 1.00 0.33 C ATOM 2518 CD1 LEU A 170 -13.094 0.035 3.842 1.00 0.71 C ATOM 2519 CD2 LEU A 170 -15.547 0.493 3.949 1.00 0.69 C ATOM 0 H LEU A 170 -15.125 -3.729 4.081 1.00 0.22 H new ATOM 0 HA LEU A 170 -16.825 -1.606 3.033 1.00 0.22 H new ATOM 0 HB2 LEU A 170 -13.886 -2.280 2.793 1.00 0.24 H new ATOM 0 HB3 LEU A 170 -14.638 -0.999 1.862 1.00 0.24 H new ATOM 0 HG LEU A 170 -14.540 -1.130 4.892 1.00 0.33 H new ATOM 0 HD11 LEU A 170 -12.940 0.728 4.669 1.00 0.71 H new ATOM 0 HD12 LEU A 170 -12.339 -0.750 3.880 1.00 0.71 H new ATOM 0 HD13 LEU A 170 -13.010 0.573 2.898 1.00 0.71 H new ATOM 0 HD21 LEU A 170 -15.374 1.179 4.778 1.00 0.69 H new ATOM 0 HD22 LEU A 170 -15.508 1.043 3.009 1.00 0.69 H new ATOM 0 HD23 LEU A 170 -16.528 0.031 4.059 1.00 0.69 H new ATOM 2531 N LEU A 171 -15.704 -4.119 1.191 1.00 0.18 N ATOM 2532 CA LEU A 171 -15.978 -4.852 -0.055 1.00 0.20 C ATOM 2533 C LEU A 171 -17.439 -5.204 -0.124 1.00 0.27 C ATOM 2534 O LEU A 171 -18.148 -4.868 -1.073 1.00 0.34 O ATOM 2535 CB LEU A 171 -15.191 -6.157 -0.126 1.00 0.26 C ATOM 2536 CG LEU A 171 -13.691 -6.003 -0.219 1.00 0.17 C ATOM 2537 CD1 LEU A 171 -13.016 -7.362 -0.223 1.00 0.26 C ATOM 2538 CD2 LEU A 171 -13.319 -5.223 -1.467 1.00 0.31 C ATOM 0 H LEU A 171 -15.032 -4.572 1.811 1.00 0.18 H new ATOM 0 HA LEU A 171 -15.683 -4.205 -0.881 1.00 0.20 H new ATOM 0 HB2 LEU A 171 -15.424 -6.751 0.757 1.00 0.26 H new ATOM 0 HB3 LEU A 171 -15.536 -6.723 -0.991 1.00 0.26 H new ATOM 0 HG LEU A 171 -13.344 -5.450 0.654 1.00 0.17 H new ATOM 0 HD11 LEU A 171 -11.936 -7.232 -0.291 1.00 0.26 H new ATOM 0 HD12 LEU A 171 -13.261 -7.892 0.697 1.00 0.26 H new ATOM 0 HD13 LEU A 171 -13.366 -7.940 -1.079 1.00 0.26 H new ATOM 0 HD21 LEU A 171 -12.235 -5.119 -1.522 1.00 0.31 H new ATOM 0 HD22 LEU A 171 -13.678 -5.754 -2.349 1.00 0.31 H new ATOM 0 HD23 LEU A 171 -13.777 -4.234 -1.428 1.00 0.31 H new ATOM 2550 N GLY A 172 -17.858 -5.897 0.911 1.00 0.29 N ATOM 2551 CA GLY A 172 -19.230 -6.297 1.053 1.00 0.39 C ATOM 2552 C GLY A 172 -20.158 -5.108 1.206 1.00 0.66 C ATOM 2553 O GLY A 172 -21.368 -5.223 1.015 1.00 1.12 O ATOM 0 H GLY A 172 -17.253 -6.197 1.675 1.00 0.29 H new ATOM 0 HA2 GLY A 172 -19.529 -6.880 0.182 1.00 0.39 H new ATOM 0 HA3 GLY A 172 -19.329 -6.948 1.922 1.00 0.39 H new ATOM 2557 N SER A 173 -19.568 -3.970 1.558 1.00 0.85 N ATOM 2558 CA SER A 173 -20.274 -2.699 1.638 1.00 1.33 C ATOM 2559 C SER A 173 -21.368 -2.736 2.704 1.00 1.84 C ATOM 2560 O SER A 173 -22.560 -2.808 2.398 1.00 2.43 O ATOM 2561 CB SER A 173 -20.853 -2.322 0.266 1.00 2.03 C ATOM 2562 OG SER A 173 -21.384 -1.007 0.273 1.00 2.64 O ATOM 0 H SER A 173 -18.579 -3.905 1.797 1.00 0.85 H new ATOM 0 HA SER A 173 -19.558 -1.932 1.933 1.00 1.33 H new ATOM 0 HB2 SER A 173 -20.074 -2.398 -0.493 1.00 2.03 H new ATOM 0 HB3 SER A 173 -21.635 -3.030 -0.008 1.00 2.03 H new ATOM 0 HG SER A 173 -22.011 -0.903 -0.473 1.00 2.64 H new ATOM 2568 N ALA A 174 -20.947 -2.696 3.960 1.00 2.40 N ATOM 2569 CA ALA A 174 -21.877 -2.611 5.073 1.00 3.35 C ATOM 2570 C ALA A 174 -22.304 -1.165 5.290 1.00 3.69 C ATOM 2571 O ALA A 174 -23.347 -0.901 5.891 1.00 4.35 O ATOM 2572 CB ALA A 174 -21.242 -3.177 6.333 1.00 4.30 C ATOM 0 H ALA A 174 -19.964 -2.721 4.233 1.00 2.40 H new ATOM 0 HA ALA A 174 -22.763 -3.202 4.839 1.00 3.35 H new ATOM 0 HB1 ALA A 174 -21.949 -3.107 7.160 1.00 4.30 H new ATOM 0 HB2 ALA A 174 -20.977 -4.222 6.169 1.00 4.30 H new ATOM 0 HB3 ALA A 174 -20.344 -2.608 6.575 1.00 4.30 H new ATOM 2578 N ARG A 175 -21.476 -0.241 4.785 1.00 3.66 N ATOM 2579 CA ARG A 175 -21.721 1.201 4.887 1.00 4.44 C ATOM 2580 C ARG A 175 -21.642 1.680 6.335 1.00 4.81 C ATOM 2581 O ARG A 175 -20.624 2.230 6.758 1.00 5.15 O ATOM 2582 CB ARG A 175 -23.072 1.573 4.263 1.00 5.16 C ATOM 2583 CG ARG A 175 -23.096 1.502 2.741 1.00 5.82 C ATOM 2584 CD ARG A 175 -22.601 2.792 2.098 1.00 6.62 C ATOM 2585 NE ARG A 175 -21.176 3.046 2.330 1.00 7.03 N ATOM 2586 CZ ARG A 175 -20.713 4.062 3.061 1.00 7.84 C ATOM 2587 NH1 ARG A 175 -21.560 4.872 3.683 1.00 8.30 N ATOM 2588 NH2 ARG A 175 -19.406 4.273 3.158 1.00 8.45 N ATOM 0 H ARG A 175 -20.614 -0.475 4.292 1.00 3.66 H new ATOM 0 HA ARG A 175 -20.935 1.708 4.327 1.00 4.44 H new ATOM 0 HB2 ARG A 175 -23.839 0.907 4.659 1.00 5.16 H new ATOM 0 HB3 ARG A 175 -23.337 2.584 4.573 1.00 5.16 H new ATOM 0 HG2 ARG A 175 -22.475 0.670 2.408 1.00 5.82 H new ATOM 0 HG3 ARG A 175 -24.112 1.297 2.404 1.00 5.82 H new ATOM 0 HD2 ARG A 175 -22.785 2.749 1.025 1.00 6.62 H new ATOM 0 HD3 ARG A 175 -23.180 3.629 2.487 1.00 6.62 H new ATOM 0 HE ARG A 175 -20.499 2.410 1.908 1.00 7.03 H new ATOM 0 HH11 ARG A 175 -22.565 4.718 3.602 1.00 8.30 H new ATOM 0 HH12 ARG A 175 -21.206 5.648 4.242 1.00 8.30 H new ATOM 0 HH21 ARG A 175 -18.753 3.658 2.673 1.00 8.45 H new ATOM 0 HH22 ARG A 175 -19.055 5.050 3.717 1.00 8.45 H new ATOM 2602 N LEU A 176 -22.711 1.473 7.086 1.00 5.22 N ATOM 2603 CA LEU A 176 -22.749 1.853 8.487 1.00 6.05 C ATOM 2604 C LEU A 176 -22.962 0.612 9.338 1.00 6.72 C ATOM 2605 O LEU A 176 -21.974 0.084 9.882 1.00 7.14 O ATOM 2606 CB LEU A 176 -23.859 2.881 8.766 1.00 6.60 C ATOM 2607 CG LEU A 176 -23.652 4.280 8.168 1.00 7.19 C ATOM 2608 CD1 LEU A 176 -23.910 4.286 6.670 1.00 7.69 C ATOM 2609 CD2 LEU A 176 -24.551 5.292 8.863 1.00 7.60 C ATOM 2610 OXT LEU A 176 -24.120 0.149 9.435 1.00 7.13 O ATOM 0 H LEU A 176 -23.570 1.041 6.745 1.00 5.22 H new ATOM 0 HA LEU A 176 -21.798 2.320 8.741 1.00 6.05 H new ATOM 0 HB2 LEU A 176 -24.799 2.482 8.386 1.00 6.60 H new ATOM 0 HB3 LEU A 176 -23.969 2.983 9.846 1.00 6.60 H new ATOM 0 HG LEU A 176 -22.611 4.561 8.330 1.00 7.19 H new ATOM 0 HD11 LEU A 176 -23.755 5.291 6.278 1.00 7.69 H new ATOM 0 HD12 LEU A 176 -23.224 3.595 6.180 1.00 7.69 H new ATOM 0 HD13 LEU A 176 -24.937 3.976 6.476 1.00 7.69 H new ATOM 0 HD21 LEU A 176 -24.393 6.279 8.428 1.00 7.60 H new ATOM 0 HD22 LEU A 176 -25.594 5.002 8.734 1.00 7.60 H new ATOM 0 HD23 LEU A 176 -24.312 5.322 9.926 1.00 7.60 H new TER 2622 LEU A 176