USER MOD reduce.3.24.130724 H: found=0, std=0, add=1822, rem=0, adj=62 USER MOD reduce.3.24.130724 removed 1828 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 81 CYS SG : rot 73:sc= -0.554! USER MOD Set 1.2: B 110 THR OG1 : rot 78:sc= 0.833 USER MOD Set 2.1: B 28 LYS NZ :NH3+ -122:sc= 1.39 (180deg=0.054) USER MOD Set 2.2: B 29 ASN : amide:sc= 0.258 K(o=1.6,f=-5.4) USER MOD Set 3.1: A 108 CYS SG : rot 71:sc= -0.723! USER MOD Set 3.2: B 96 ASN : amide:sc= -1.63 K(o=-2.4,f=-2.9) USER MOD Set 4.1: A 96 ASN : amide:sc= -0.413 K(o=0.57,f=-0.95) USER MOD Set 4.2: B 108 CYS SG : rot 75:sc= 0.985 USER MOD Set 5.1: A 81 CYS SG : rot 81:sc= -0.62! USER MOD Set 5.2: A 110 THR OG1 : rot 76:sc= 0.864 USER MOD Set 6.1: A 28 LYS NZ :NH3+ -124:sc= 1.47 (180deg=-0.00516) USER MOD Set 6.2: A 29 ASN : amide:sc= 0.235 K(o=1.7,f=-4.9) USER MOD Single : A 2 SER OG : rot 23:sc= 0.159 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 SER OG : rot -130:sc= 0.00593 USER MOD Single : A 9 SER OG : rot -60:sc= 0.411 USER MOD Single : A 12 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00341) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 CYS SG : rot 54:sc= 1.2 USER MOD Single : A 23 MET CE :methyl 148:sc= -0.0482 (180deg=-0.666) USER MOD Single : A 24 SER OG : rot 11:sc= -0.721 USER MOD Single : A 26 THR OG1 : rot 172:sc= -0.199 USER MOD Single : A 30 MET CE :methyl -128:sc= 0 (180deg=-1.77!) USER MOD Single : A 37 SER OG : rot -50:sc= -0.745 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 45 ASN : amide:sc=-0.00218 X(o=-0.0022,f=-0.32) USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 SER OG : rot -145:sc= 0.383 USER MOD Single : A 49 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 LYS NZ :NH3+ 151:sc= 0 (180deg=-0.939) USER MOD Single : A 57 TYR OH : rot 180:sc= -0.201 USER MOD Single : A 58 CYS SG : rot 79:sc= -0.122 USER MOD Single : A 60 HIS : no HD1:sc= -0.111 X(o=-0.11,f=-0.38) USER MOD Single : A 61 HIS : no HD1:sc= 0.0161 K(o=0.038,f=-1.8) USER MOD Single : A 62 HIS : +bothHN:sc= 0.119 K(o=0.12,f=-2.8) USER MOD Single : A 63 GLN : amide:sc= -0.0561 X(o=-0.056,f=-0.24) USER MOD Single : A 64 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 76 TYR OH : rot 0:sc= 0 USER MOD Single : A 82 LYS NZ :NH3+ -163:sc= 0.463 (180deg=0.207) USER MOD Single : A 85 GLN : amide:sc= -0.425 X(o=-0.42,f=-0.015) USER MOD Single : A 87 THR OG1 : rot 180:sc= 0 USER MOD Single : A 97 TYR OH : rot 171:sc= -1.21 USER MOD Single : A 101 LYS NZ :NH3+ 168:sc= 0.308 (180deg=0.274) USER MOD Single : A 107 THR OG1 : rot 78:sc= 0.699 USER MOD Single : A 109 LYS NZ :NH3+ -107:sc= 0.283 (180deg=-0.515) USER MOD Single : A 113 ASN : amide:sc= 0.453 K(o=0.45,f=-3.9!) USER MOD Single : A 114 MET CE :methyl -178:sc= -2.34! (180deg=-2.44!) USER MOD Single : B 2 SER OG : rot 36:sc= 0.156 USER MOD Single : B 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 8 SER OG : rot -130:sc= 0.00688 USER MOD Single : B 9 SER OG : rot -53:sc= 0.462 USER MOD Single : B 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 22 CYS SG : rot 61:sc= 1.2 USER MOD Single : B 23 MET CE :methyl 148:sc= -0.0507 (180deg=-0.645) USER MOD Single : B 24 SER OG : rot 20:sc= -0.664 USER MOD Single : B 26 THR OG1 : rot 170:sc= -0.0845 USER MOD Single : B 30 MET CE :methyl -130:sc= 0 (180deg=-1.39) USER MOD Single : B 37 SER OG : rot -50:sc= -0.682 USER MOD Single : B 39 SER OG : rot 180:sc= 0 USER MOD Single : B 45 ASN : amide:sc= 0 X(o=0,f=-0.46) USER MOD Single : B 47 THR OG1 : rot 180:sc= 0 USER MOD Single : B 48 SER OG : rot -145:sc= 0.394 USER MOD Single : B 49 THR OG1 : rot 180:sc= 0 USER MOD Single : B 53 LYS NZ :NH3+ 148:sc= 0 (180deg=-1.03) USER MOD Single : B 57 TYR OH : rot 180:sc= -0.173 USER MOD Single : B 58 CYS SG : rot 78:sc= -0.107 USER MOD Single : B 60 HIS : no HD1:sc= -0.0835 X(o=-0.084,f=-0.33) USER MOD Single : B 61 HIS : +bothHN:sc= 0.0587 K(o=0.059,f=-1.9) USER MOD Single : B 62 HIS : +bothHN:sc= 0.113 K(o=0.11,f=-2.6) USER MOD Single : B 63 GLN : amide:sc= -0.0825 X(o=-0.083,f=-0.25) USER MOD Single : B 64 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 68 SER OG : rot 180:sc= 0 USER MOD Single : B 76 TYR OH : rot 0:sc= 0 USER MOD Single : B 82 LYS NZ :NH3+ -160:sc= 0.49 (180deg=0.0747) USER MOD Single : B 85 GLN : amide:sc= 0.0665 X(o=0.066,f=-0.0036) USER MOD Single : B 87 THR OG1 : rot 180:sc= 0.00152 USER MOD Single : B 97 TYR OH : rot -167:sc= -1.3 USER MOD Single : B 101 LYS NZ :NH3+ 172:sc= 0.301 (180deg=0.289) USER MOD Single : B 107 THR OG1 : rot 77:sc= 0.706 USER MOD Single : B 109 LYS NZ :NH3+ -111:sc= 0.269 (180deg=-0.209) USER MOD Single : B 113 ASN : amide:sc= 0.315 K(o=0.32,f=-3.6!) USER MOD Single : B 114 MET CE :methyl -176:sc= -2.21! (180deg=-2.36) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 2 -16.755 -14.270 -17.215 1.00 32.25 N ATOM 2 CA SER A 2 -18.041 -13.556 -17.097 1.00 3.23 C ATOM 3 C SER A 2 -17.847 -12.225 -16.352 1.00 71.52 C ATOM 4 O SER A 2 -16.833 -12.030 -15.666 1.00 50.44 O ATOM 5 CB SER A 2 -19.060 -14.468 -16.382 1.00 24.33 C ATOM 6 OG SER A 2 -19.149 -15.726 -17.033 1.00 30.54 O ATOM 0 HA SER A 2 -18.426 -13.317 -18.088 1.00 3.23 H new ATOM 0 HB2 SER A 2 -18.762 -14.611 -15.343 1.00 24.33 H new ATOM 0 HB3 SER A 2 -20.039 -13.989 -16.370 1.00 24.33 H new ATOM 0 HG SER A 2 -18.326 -15.891 -17.539 1.00 30.54 H new ATOM 14 N LEU A 3 -18.819 -11.303 -16.500 1.00 32.30 N ATOM 15 CA LEU A 3 -18.756 -9.971 -15.871 1.00 24.21 C ATOM 16 C LEU A 3 -19.234 -10.038 -14.407 1.00 53.41 C ATOM 17 O LEU A 3 -20.391 -10.388 -14.151 1.00 24.42 O ATOM 18 CB LEU A 3 -19.625 -8.953 -16.663 1.00 33.40 C ATOM 19 CG LEU A 3 -19.296 -8.799 -18.180 1.00 64.25 C ATOM 20 CD1 LEU A 3 -20.228 -7.770 -18.855 1.00 73.33 C ATOM 21 CD2 LEU A 3 -17.822 -8.428 -18.399 1.00 34.45 C ATOM 0 H LEU A 3 -19.661 -11.459 -17.053 1.00 32.30 H new ATOM 0 HA LEU A 3 -17.718 -9.638 -15.887 1.00 24.21 H new ATOM 0 HB2 LEU A 3 -20.670 -9.248 -16.567 1.00 33.40 H new ATOM 0 HB3 LEU A 3 -19.525 -7.976 -16.190 1.00 33.40 H new ATOM 0 HG LEU A 3 -19.470 -9.767 -18.650 1.00 64.25 H new ATOM 0 HD11 LEU A 3 -19.973 -7.686 -19.911 1.00 73.33 H new ATOM 0 HD12 LEU A 3 -21.263 -8.097 -18.757 1.00 73.33 H new ATOM 0 HD13 LEU A 3 -20.107 -6.799 -18.374 1.00 73.33 H new ATOM 0 HD21 LEU A 3 -17.627 -8.328 -19.467 1.00 34.45 H new ATOM 0 HD22 LEU A 3 -17.607 -7.483 -17.901 1.00 34.45 H new ATOM 0 HD23 LEU A 3 -17.185 -9.209 -17.985 1.00 34.45 H new ATOM 33 N VAL A 4 -18.342 -9.720 -13.458 1.00 22.42 N ATOM 34 CA VAL A 4 -18.719 -9.511 -12.047 1.00 41.41 C ATOM 35 C VAL A 4 -19.168 -8.058 -11.849 1.00 23.05 C ATOM 36 O VAL A 4 -18.494 -7.110 -12.283 1.00 72.33 O ATOM 37 CB VAL A 4 -17.568 -9.873 -11.033 1.00 22.24 C ATOM 38 CG1 VAL A 4 -17.396 -11.404 -10.924 1.00 72.51 C ATOM 39 CG2 VAL A 4 -16.238 -9.185 -11.422 1.00 10.11 C ATOM 0 H VAL A 4 -17.346 -9.600 -13.641 1.00 22.42 H new ATOM 0 HA VAL A 4 -19.540 -10.194 -11.829 1.00 41.41 H new ATOM 0 HB VAL A 4 -17.855 -9.496 -10.051 1.00 22.24 H new ATOM 0 HG11 VAL A 4 -16.596 -11.631 -10.219 1.00 72.51 H new ATOM 0 HG12 VAL A 4 -18.326 -11.851 -10.574 1.00 72.51 H new ATOM 0 HG13 VAL A 4 -17.144 -11.812 -11.903 1.00 72.51 H new ATOM 0 HG21 VAL A 4 -15.465 -9.455 -10.703 1.00 10.11 H new ATOM 0 HG22 VAL A 4 -15.937 -9.511 -12.418 1.00 10.11 H new ATOM 0 HG23 VAL A 4 -16.374 -8.103 -11.420 1.00 10.11 H new ATOM 49 N LYS A 5 -20.324 -7.907 -11.206 1.00 1.44 N ATOM 50 CA LYS A 5 -20.976 -6.619 -11.013 1.00 22.25 C ATOM 51 C LYS A 5 -20.423 -5.936 -9.746 1.00 2.33 C ATOM 52 O LYS A 5 -20.985 -6.068 -8.656 1.00 21.25 O ATOM 53 CB LYS A 5 -22.508 -6.839 -10.939 1.00 41.43 C ATOM 54 CG LYS A 5 -23.118 -7.530 -12.180 1.00 70.22 C ATOM 55 CD LYS A 5 -24.662 -7.536 -12.154 1.00 13.05 C ATOM 56 CE LYS A 5 -25.264 -8.223 -13.390 1.00 11.53 C ATOM 57 NZ LYS A 5 -26.738 -8.061 -13.454 1.00 73.11 N ATOM 0 H LYS A 5 -20.839 -8.688 -10.800 1.00 1.44 H new ATOM 0 HA LYS A 5 -20.768 -5.955 -11.852 1.00 22.25 H new ATOM 0 HB2 LYS A 5 -22.734 -7.439 -10.057 1.00 41.43 H new ATOM 0 HB3 LYS A 5 -22.995 -5.873 -10.801 1.00 41.43 H new ATOM 0 HG2 LYS A 5 -22.775 -7.021 -13.081 1.00 70.22 H new ATOM 0 HG3 LYS A 5 -22.755 -8.556 -12.236 1.00 70.22 H new ATOM 0 HD2 LYS A 5 -25.006 -8.046 -11.254 1.00 13.05 H new ATOM 0 HD3 LYS A 5 -25.026 -6.510 -12.098 1.00 13.05 H new ATOM 0 HE2 LYS A 5 -24.814 -7.807 -14.291 1.00 11.53 H new ATOM 0 HE3 LYS A 5 -25.016 -9.284 -13.371 1.00 11.53 H new ATOM 0 HZ1 LYS A 5 -27.103 -8.539 -14.302 1.00 73.11 H new ATOM 0 HZ2 LYS A 5 -27.171 -8.481 -12.607 1.00 73.11 H new ATOM 0 HZ3 LYS A 5 -26.974 -7.049 -13.498 1.00 73.11 H new ATOM 71 N LEU A 6 -19.276 -5.261 -9.900 1.00 70.24 N ATOM 72 CA LEU A 6 -18.577 -4.592 -8.791 1.00 21.41 C ATOM 73 C LEU A 6 -19.220 -3.230 -8.505 1.00 0.32 C ATOM 74 O LEU A 6 -18.859 -2.217 -9.120 1.00 73.22 O ATOM 75 CB LEU A 6 -17.070 -4.444 -9.126 1.00 71.12 C ATOM 76 CG LEU A 6 -16.312 -5.777 -9.403 1.00 52.41 C ATOM 77 CD1 LEU A 6 -14.825 -5.520 -9.707 1.00 10.42 C ATOM 78 CD2 LEU A 6 -16.481 -6.786 -8.242 1.00 30.50 C ATOM 0 H LEU A 6 -18.804 -5.162 -10.799 1.00 70.24 H new ATOM 0 HA LEU A 6 -18.666 -5.200 -7.891 1.00 21.41 H new ATOM 0 HB2 LEU A 6 -16.971 -3.801 -10.001 1.00 71.12 H new ATOM 0 HB3 LEU A 6 -16.580 -3.933 -8.298 1.00 71.12 H new ATOM 0 HG LEU A 6 -16.761 -6.226 -10.289 1.00 52.41 H new ATOM 0 HD11 LEU A 6 -14.323 -6.469 -9.896 1.00 10.42 H new ATOM 0 HD12 LEU A 6 -14.738 -4.882 -10.587 1.00 10.42 H new ATOM 0 HD13 LEU A 6 -14.359 -5.027 -8.854 1.00 10.42 H new ATOM 0 HD21 LEU A 6 -15.938 -7.702 -8.474 1.00 30.50 H new ATOM 0 HD22 LEU A 6 -16.086 -6.353 -7.323 1.00 30.50 H new ATOM 0 HD23 LEU A 6 -17.538 -7.015 -8.110 1.00 30.50 H new ATOM 90 N GLU A 7 -20.212 -3.235 -7.608 1.00 72.14 N ATOM 91 CA GLU A 7 -20.914 -2.020 -7.194 1.00 43.30 C ATOM 92 C GLU A 7 -20.065 -1.244 -6.168 1.00 21.24 C ATOM 93 O GLU A 7 -19.511 -1.831 -5.239 1.00 32.15 O ATOM 94 CB GLU A 7 -22.307 -2.372 -6.606 1.00 52.31 C ATOM 95 CG GLU A 7 -23.137 -1.139 -6.181 1.00 42.42 C ATOM 96 CD GLU A 7 -24.521 -1.497 -5.630 1.00 14.33 C ATOM 97 OE1 GLU A 7 -25.506 -1.504 -6.408 1.00 31.12 O ATOM 98 OE2 GLU A 7 -24.633 -1.791 -4.418 1.00 63.14 O ATOM 0 H GLU A 7 -20.549 -4.082 -7.150 1.00 72.14 H new ATOM 0 HA GLU A 7 -21.067 -1.385 -8.067 1.00 43.30 H new ATOM 0 HB2 GLU A 7 -22.870 -2.939 -7.347 1.00 52.31 H new ATOM 0 HB3 GLU A 7 -22.172 -3.022 -5.742 1.00 52.31 H new ATOM 0 HG2 GLU A 7 -22.585 -0.583 -5.423 1.00 42.42 H new ATOM 0 HG3 GLU A 7 -23.256 -0.477 -7.039 1.00 42.42 H new ATOM 105 N SER A 8 -19.965 0.072 -6.371 1.00 53.12 N ATOM 106 CA SER A 8 -19.247 0.990 -5.477 1.00 73.23 C ATOM 107 C SER A 8 -20.168 1.480 -4.347 1.00 70.43 C ATOM 108 O SER A 8 -21.375 1.189 -4.344 1.00 55.20 O ATOM 109 CB SER A 8 -18.749 2.182 -6.321 1.00 25.04 C ATOM 110 OG SER A 8 -19.825 2.808 -7.016 1.00 2.22 O ATOM 0 H SER A 8 -20.387 0.539 -7.174 1.00 53.12 H new ATOM 0 HA SER A 8 -18.405 0.477 -5.014 1.00 73.23 H new ATOM 0 HB2 SER A 8 -18.259 2.909 -5.674 1.00 25.04 H new ATOM 0 HB3 SER A 8 -18.002 1.837 -7.036 1.00 25.04 H new ATOM 0 HG SER A 8 -19.588 2.911 -7.961 1.00 2.22 H new ATOM 116 N SER A 9 -19.600 2.248 -3.404 1.00 43.23 N ATOM 117 CA SER A 9 -20.368 2.921 -2.334 1.00 41.20 C ATOM 118 C SER A 9 -21.234 4.078 -2.900 1.00 55.01 C ATOM 119 O SER A 9 -22.120 4.595 -2.215 1.00 74.44 O ATOM 120 CB SER A 9 -19.401 3.447 -1.251 1.00 0.21 C ATOM 121 OG SER A 9 -18.479 4.379 -1.790 1.00 12.03 O ATOM 0 H SER A 9 -18.596 2.423 -3.358 1.00 43.23 H new ATOM 0 HA SER A 9 -21.046 2.193 -1.888 1.00 41.20 H new ATOM 0 HB2 SER A 9 -19.971 3.918 -0.450 1.00 0.21 H new ATOM 0 HB3 SER A 9 -18.859 2.611 -0.808 1.00 0.21 H new ATOM 0 HG SER A 9 -17.951 3.947 -2.494 1.00 12.03 H new ATOM 127 N ASP A 10 -20.947 4.473 -4.161 1.00 31.14 N ATOM 128 CA ASP A 10 -21.720 5.484 -4.914 1.00 31.02 C ATOM 129 C ASP A 10 -22.839 4.796 -5.751 1.00 0.41 C ATOM 130 O ASP A 10 -23.536 5.443 -6.533 1.00 74.20 O ATOM 131 CB ASP A 10 -20.730 6.288 -5.805 1.00 72.12 C ATOM 132 CG ASP A 10 -21.382 7.430 -6.621 1.00 41.41 C ATOM 133 OD1 ASP A 10 -21.653 7.237 -7.828 1.00 43.45 O ATOM 134 OD2 ASP A 10 -21.628 8.517 -6.060 1.00 13.43 O ATOM 0 H ASP A 10 -20.162 4.093 -4.690 1.00 31.14 H new ATOM 0 HA ASP A 10 -22.219 6.174 -4.233 1.00 31.02 H new ATOM 0 HB2 ASP A 10 -19.951 6.711 -5.170 1.00 72.12 H new ATOM 0 HB3 ASP A 10 -20.241 5.600 -6.494 1.00 72.12 H new ATOM 139 N GLU A 11 -22.980 3.458 -5.562 1.00 23.41 N ATOM 140 CA GLU A 11 -24.065 2.623 -6.135 1.00 71.32 C ATOM 141 C GLU A 11 -23.834 2.281 -7.641 1.00 5.10 C ATOM 142 O GLU A 11 -24.593 1.491 -8.220 1.00 5.12 O ATOM 143 CB GLU A 11 -25.469 3.283 -5.888 1.00 53.42 C ATOM 144 CG GLU A 11 -26.700 2.426 -6.251 1.00 21.15 C ATOM 145 CD GLU A 11 -28.032 3.200 -6.174 1.00 55.35 C ATOM 146 OE1 GLU A 11 -28.310 4.015 -7.080 1.00 52.40 O ATOM 147 OE2 GLU A 11 -28.805 3.004 -5.207 1.00 23.51 O ATOM 0 H GLU A 11 -22.327 2.919 -4.994 1.00 23.41 H new ATOM 0 HA GLU A 11 -24.047 1.669 -5.609 1.00 71.32 H new ATOM 0 HB2 GLU A 11 -25.539 3.554 -4.835 1.00 53.42 H new ATOM 0 HB3 GLU A 11 -25.517 4.210 -6.459 1.00 53.42 H new ATOM 0 HG2 GLU A 11 -26.575 2.033 -7.260 1.00 21.15 H new ATOM 0 HG3 GLU A 11 -26.747 1.569 -5.579 1.00 21.15 H new ATOM 154 N LYS A 12 -22.753 2.804 -8.270 1.00 74.30 N ATOM 155 CA LYS A 12 -22.465 2.507 -9.691 1.00 11.12 C ATOM 156 C LYS A 12 -21.859 1.098 -9.832 1.00 22.13 C ATOM 157 O LYS A 12 -20.855 0.777 -9.188 1.00 63.41 O ATOM 158 CB LYS A 12 -21.532 3.560 -10.336 1.00 35.00 C ATOM 159 CG LYS A 12 -22.113 4.991 -10.383 1.00 44.33 C ATOM 160 CD LYS A 12 -21.296 5.932 -11.304 1.00 75.24 C ATOM 161 CE LYS A 12 -21.671 7.416 -11.139 1.00 62.15 C ATOM 162 NZ LYS A 12 -23.105 7.670 -11.417 1.00 12.21 N ATOM 0 H LYS A 12 -22.077 3.423 -7.823 1.00 74.30 H new ATOM 0 HA LYS A 12 -23.414 2.547 -10.226 1.00 11.12 H new ATOM 0 HB2 LYS A 12 -20.593 3.581 -9.783 1.00 35.00 H new ATOM 0 HB3 LYS A 12 -21.297 3.244 -11.352 1.00 35.00 H new ATOM 0 HG2 LYS A 12 -23.144 4.950 -10.734 1.00 44.33 H new ATOM 0 HG3 LYS A 12 -22.135 5.404 -9.375 1.00 44.33 H new ATOM 0 HD2 LYS A 12 -20.234 5.806 -11.092 1.00 75.24 H new ATOM 0 HD3 LYS A 12 -21.450 5.638 -12.342 1.00 75.24 H new ATOM 0 HE2 LYS A 12 -21.438 7.736 -10.123 1.00 62.15 H new ATOM 0 HE3 LYS A 12 -21.061 8.019 -11.811 1.00 62.15 H new ATOM 0 HZ1 LYS A 12 -23.301 8.687 -11.326 1.00 12.21 H new ATOM 0 HZ2 LYS A 12 -23.332 7.359 -12.383 1.00 12.21 H new ATOM 0 HZ3 LYS A 12 -23.689 7.142 -10.737 1.00 12.21 H new ATOM 176 N VAL A 13 -22.500 0.287 -10.686 1.00 70.33 N ATOM 177 CA VAL A 13 -22.176 -1.130 -10.891 1.00 73.14 C ATOM 178 C VAL A 13 -21.227 -1.291 -12.098 1.00 42.31 C ATOM 179 O VAL A 13 -21.627 -1.068 -13.241 1.00 41.35 O ATOM 180 CB VAL A 13 -23.509 -1.942 -11.115 1.00 31.01 C ATOM 181 CG1 VAL A 13 -23.234 -3.429 -11.387 1.00 23.24 C ATOM 182 CG2 VAL A 13 -24.458 -1.766 -9.905 1.00 52.21 C ATOM 0 H VAL A 13 -23.276 0.607 -11.266 1.00 70.33 H new ATOM 0 HA VAL A 13 -21.668 -1.519 -10.009 1.00 73.14 H new ATOM 0 HB VAL A 13 -23.998 -1.539 -12.002 1.00 31.01 H new ATOM 0 HG11 VAL A 13 -24.178 -3.952 -11.536 1.00 23.24 H new ATOM 0 HG12 VAL A 13 -22.620 -3.528 -12.282 1.00 23.24 H new ATOM 0 HG13 VAL A 13 -22.709 -3.863 -10.537 1.00 23.24 H new ATOM 0 HG21 VAL A 13 -25.373 -2.333 -10.075 1.00 52.21 H new ATOM 0 HG22 VAL A 13 -23.968 -2.131 -9.002 1.00 52.21 H new ATOM 0 HG23 VAL A 13 -24.702 -0.710 -9.784 1.00 52.21 H new ATOM 192 N PHE A 14 -19.971 -1.657 -11.826 1.00 11.20 N ATOM 193 CA PHE A 14 -18.941 -1.856 -12.859 1.00 60.03 C ATOM 194 C PHE A 14 -18.835 -3.349 -13.193 1.00 32.30 C ATOM 195 O PHE A 14 -18.167 -4.117 -12.487 1.00 35.23 O ATOM 196 CB PHE A 14 -17.588 -1.277 -12.373 1.00 13.11 C ATOM 197 CG PHE A 14 -17.675 0.217 -12.050 1.00 51.04 C ATOM 198 CD1 PHE A 14 -17.833 0.669 -10.739 1.00 61.04 C ATOM 199 CD2 PHE A 14 -17.631 1.169 -13.069 1.00 21.52 C ATOM 200 CE1 PHE A 14 -17.946 2.017 -10.460 1.00 23.22 C ATOM 201 CE2 PHE A 14 -17.739 2.515 -12.787 1.00 64.31 C ATOM 202 CZ PHE A 14 -17.895 2.940 -11.485 1.00 3.42 C ATOM 0 H PHE A 14 -19.635 -1.826 -10.878 1.00 11.20 H new ATOM 0 HA PHE A 14 -19.218 -1.325 -13.770 1.00 60.03 H new ATOM 0 HB2 PHE A 14 -17.262 -1.819 -11.486 1.00 13.11 H new ATOM 0 HB3 PHE A 14 -16.831 -1.437 -13.141 1.00 13.11 H new ATOM 0 HD1 PHE A 14 -17.867 -0.046 -9.930 1.00 61.04 H new ATOM 0 HD2 PHE A 14 -17.511 0.848 -14.093 1.00 21.52 H new ATOM 0 HE1 PHE A 14 -18.074 2.349 -9.440 1.00 23.22 H new ATOM 0 HE2 PHE A 14 -17.701 3.238 -13.589 1.00 64.31 H new ATOM 0 HZ PHE A 14 -17.977 3.995 -11.267 1.00 3.42 H new ATOM 212 N GLU A 15 -19.554 -3.746 -14.251 1.00 53.12 N ATOM 213 CA GLU A 15 -19.603 -5.133 -14.731 1.00 20.44 C ATOM 214 C GLU A 15 -18.347 -5.436 -15.565 1.00 15.45 C ATOM 215 O GLU A 15 -18.369 -5.374 -16.803 1.00 34.20 O ATOM 216 CB GLU A 15 -20.897 -5.357 -15.552 1.00 3.45 C ATOM 217 CG GLU A 15 -22.183 -4.939 -14.823 1.00 4.23 C ATOM 218 CD GLU A 15 -23.450 -5.169 -15.657 1.00 24.30 C ATOM 219 OE1 GLU A 15 -23.961 -6.303 -15.681 1.00 33.41 O ATOM 220 OE2 GLU A 15 -23.933 -4.220 -16.309 1.00 62.45 O ATOM 0 H GLU A 15 -20.124 -3.106 -14.804 1.00 53.12 H new ATOM 0 HA GLU A 15 -19.620 -5.818 -13.883 1.00 20.44 H new ATOM 0 HB2 GLU A 15 -20.823 -4.799 -16.485 1.00 3.45 H new ATOM 0 HB3 GLU A 15 -20.969 -6.412 -15.816 1.00 3.45 H new ATOM 0 HG2 GLU A 15 -22.263 -5.498 -13.890 1.00 4.23 H new ATOM 0 HG3 GLU A 15 -22.116 -3.884 -14.558 1.00 4.23 H new ATOM 227 N ILE A 16 -17.232 -5.689 -14.867 1.00 20.43 N ATOM 228 CA ILE A 16 -15.929 -5.957 -15.493 1.00 31.55 C ATOM 229 C ILE A 16 -15.647 -7.466 -15.428 1.00 33.23 C ATOM 230 O ILE A 16 -16.232 -8.162 -14.595 1.00 2.15 O ATOM 231 CB ILE A 16 -14.787 -5.115 -14.788 1.00 25.11 C ATOM 232 CG1 ILE A 16 -13.447 -5.181 -15.588 1.00 14.02 C ATOM 233 CG2 ILE A 16 -14.577 -5.566 -13.321 1.00 45.35 C ATOM 234 CD1 ILE A 16 -12.383 -4.201 -15.132 1.00 53.10 C ATOM 0 H ILE A 16 -17.208 -5.714 -13.848 1.00 20.43 H new ATOM 0 HA ILE A 16 -15.950 -5.650 -16.539 1.00 31.55 H new ATOM 0 HB ILE A 16 -15.115 -4.075 -14.776 1.00 25.11 H new ATOM 0 HG12 ILE A 16 -13.046 -6.192 -15.514 1.00 14.02 H new ATOM 0 HG13 ILE A 16 -13.660 -5.000 -16.641 1.00 14.02 H new ATOM 0 HG21 ILE A 16 -13.787 -4.969 -12.866 1.00 45.35 H new ATOM 0 HG22 ILE A 16 -15.503 -5.429 -12.762 1.00 45.35 H new ATOM 0 HG23 ILE A 16 -14.293 -6.618 -13.301 1.00 45.35 H new ATOM 0 HD11 ILE A 16 -11.490 -4.321 -15.746 1.00 53.10 H new ATOM 0 HD12 ILE A 16 -12.759 -3.183 -15.234 1.00 53.10 H new ATOM 0 HD13 ILE A 16 -12.134 -4.393 -14.088 1.00 53.10 H new ATOM 246 N GLU A 17 -14.769 -7.960 -16.321 1.00 13.34 N ATOM 247 CA GLU A 17 -14.375 -9.379 -16.370 1.00 43.30 C ATOM 248 C GLU A 17 -13.789 -9.815 -15.012 1.00 51.45 C ATOM 249 O GLU A 17 -12.956 -9.098 -14.438 1.00 24.33 O ATOM 250 CB GLU A 17 -13.345 -9.636 -17.510 1.00 2.11 C ATOM 251 CG GLU A 17 -13.835 -9.327 -18.951 1.00 72.44 C ATOM 252 CD GLU A 17 -13.887 -7.825 -19.305 1.00 42.14 C ATOM 253 OE1 GLU A 17 -14.972 -7.212 -19.238 1.00 12.23 O ATOM 254 OE2 GLU A 17 -12.844 -7.241 -19.644 1.00 71.25 O ATOM 0 H GLU A 17 -14.313 -7.385 -17.029 1.00 13.34 H new ATOM 0 HA GLU A 17 -15.265 -9.972 -16.580 1.00 43.30 H new ATOM 0 HB2 GLU A 17 -12.457 -9.036 -17.313 1.00 2.11 H new ATOM 0 HB3 GLU A 17 -13.039 -10.681 -17.468 1.00 2.11 H new ATOM 0 HG2 GLU A 17 -13.178 -9.831 -19.660 1.00 72.44 H new ATOM 0 HG3 GLU A 17 -14.830 -9.752 -19.081 1.00 72.44 H new ATOM 261 N LYS A 18 -14.245 -10.983 -14.522 1.00 10.11 N ATOM 262 CA LYS A 18 -13.868 -11.524 -13.203 1.00 10.53 C ATOM 263 C LYS A 18 -12.352 -11.723 -13.092 1.00 51.23 C ATOM 264 O LYS A 18 -11.769 -11.492 -12.038 1.00 61.14 O ATOM 265 CB LYS A 18 -14.584 -12.872 -12.958 1.00 60.44 C ATOM 266 CG LYS A 18 -14.339 -13.488 -11.552 1.00 71.13 C ATOM 267 CD LYS A 18 -14.767 -14.974 -11.466 1.00 73.11 C ATOM 268 CE LYS A 18 -13.912 -15.876 -12.382 1.00 2.33 C ATOM 269 NZ LYS A 18 -14.334 -17.298 -12.315 1.00 11.13 N ATOM 0 H LYS A 18 -14.891 -11.583 -15.035 1.00 10.11 H new ATOM 0 HA LYS A 18 -14.176 -10.801 -12.447 1.00 10.53 H new ATOM 0 HB2 LYS A 18 -15.656 -12.730 -13.096 1.00 60.44 H new ATOM 0 HB3 LYS A 18 -14.257 -13.585 -13.715 1.00 60.44 H new ATOM 0 HG2 LYS A 18 -13.281 -13.404 -11.303 1.00 71.13 H new ATOM 0 HG3 LYS A 18 -14.889 -12.912 -10.807 1.00 71.13 H new ATOM 0 HD2 LYS A 18 -14.680 -15.317 -10.435 1.00 73.11 H new ATOM 0 HD3 LYS A 18 -15.817 -15.066 -11.745 1.00 73.11 H new ATOM 0 HE2 LYS A 18 -13.988 -15.524 -13.411 1.00 2.33 H new ATOM 0 HE3 LYS A 18 -12.864 -15.795 -12.094 1.00 2.33 H new ATOM 0 HZ1 LYS A 18 -13.734 -17.868 -12.945 1.00 11.13 H new ATOM 0 HZ2 LYS A 18 -14.237 -17.643 -11.339 1.00 11.13 H new ATOM 0 HZ3 LYS A 18 -15.327 -17.380 -12.615 1.00 11.13 H new ATOM 283 N GLU A 19 -11.744 -12.140 -14.208 1.00 73.34 N ATOM 284 CA GLU A 19 -10.287 -12.360 -14.322 1.00 72.20 C ATOM 285 C GLU A 19 -9.475 -11.074 -14.024 1.00 14.13 C ATOM 286 O GLU A 19 -8.350 -11.142 -13.516 1.00 73.25 O ATOM 287 CB GLU A 19 -9.966 -12.926 -15.731 1.00 64.20 C ATOM 288 CG GLU A 19 -10.531 -12.092 -16.905 1.00 23.53 C ATOM 289 CD GLU A 19 -10.440 -12.812 -18.262 1.00 75.44 C ATOM 290 OE1 GLU A 19 -9.536 -12.493 -19.065 1.00 25.44 O ATOM 291 OE2 GLU A 19 -11.262 -13.724 -18.516 1.00 40.33 O ATOM 0 H GLU A 19 -12.250 -12.338 -15.071 1.00 73.34 H new ATOM 0 HA GLU A 19 -9.985 -13.086 -13.567 1.00 72.20 H new ATOM 0 HB2 GLU A 19 -8.884 -12.998 -15.841 1.00 64.20 H new ATOM 0 HB3 GLU A 19 -10.361 -13.940 -15.800 1.00 64.20 H new ATOM 0 HG2 GLU A 19 -11.573 -11.848 -16.700 1.00 23.53 H new ATOM 0 HG3 GLU A 19 -9.989 -11.148 -16.965 1.00 23.53 H new ATOM 298 N ILE A 20 -10.062 -9.912 -14.331 1.00 73.31 N ATOM 299 CA ILE A 20 -9.459 -8.598 -14.033 1.00 11.11 C ATOM 300 C ILE A 20 -9.713 -8.226 -12.556 1.00 31.23 C ATOM 301 O ILE A 20 -8.857 -7.631 -11.894 1.00 71.10 O ATOM 302 CB ILE A 20 -10.031 -7.493 -14.985 1.00 73.34 C ATOM 303 CG1 ILE A 20 -9.889 -7.934 -16.478 1.00 51.42 C ATOM 304 CG2 ILE A 20 -9.340 -6.132 -14.736 1.00 73.54 C ATOM 305 CD1 ILE A 20 -10.395 -6.930 -17.493 1.00 74.22 C ATOM 0 H ILE A 20 -10.969 -9.851 -14.793 1.00 73.31 H new ATOM 0 HA ILE A 20 -8.384 -8.662 -14.201 1.00 11.11 H new ATOM 0 HB ILE A 20 -11.091 -7.367 -14.766 1.00 73.34 H new ATOM 0 HG12 ILE A 20 -8.838 -8.137 -16.683 1.00 51.42 H new ATOM 0 HG13 ILE A 20 -10.427 -8.871 -16.617 1.00 51.42 H new ATOM 0 HG21 ILE A 20 -9.756 -5.384 -15.410 1.00 73.54 H new ATOM 0 HG22 ILE A 20 -9.506 -5.823 -13.704 1.00 73.54 H new ATOM 0 HG23 ILE A 20 -8.270 -6.229 -14.918 1.00 73.54 H new ATOM 0 HD11 ILE A 20 -10.253 -7.326 -18.499 1.00 74.22 H new ATOM 0 HD12 ILE A 20 -11.455 -6.743 -17.323 1.00 74.22 H new ATOM 0 HD13 ILE A 20 -9.841 -5.997 -17.389 1.00 74.22 H new ATOM 317 N ALA A 21 -10.902 -8.592 -12.058 1.00 32.04 N ATOM 318 CA ALA A 21 -11.267 -8.424 -10.633 1.00 31.34 C ATOM 319 C ALA A 21 -10.484 -9.394 -9.716 1.00 13.44 C ATOM 320 O ALA A 21 -10.471 -9.218 -8.498 1.00 1.00 O ATOM 321 CB ALA A 21 -12.777 -8.619 -10.460 1.00 71.41 C ATOM 0 H ALA A 21 -11.639 -9.012 -12.624 1.00 32.04 H new ATOM 0 HA ALA A 21 -10.995 -7.412 -10.333 1.00 31.34 H new ATOM 0 HB1 ALA A 21 -13.042 -8.495 -9.410 1.00 71.41 H new ATOM 0 HB2 ALA A 21 -13.310 -7.881 -11.059 1.00 71.41 H new ATOM 0 HB3 ALA A 21 -13.054 -9.621 -10.788 1.00 71.41 H new ATOM 327 N CYS A 22 -9.874 -10.440 -10.314 1.00 25.42 N ATOM 328 CA CYS A 22 -8.976 -11.373 -9.606 1.00 62.34 C ATOM 329 C CYS A 22 -7.602 -10.721 -9.335 1.00 43.32 C ATOM 330 O CYS A 22 -6.908 -11.099 -8.382 1.00 51.42 O ATOM 331 CB CYS A 22 -8.806 -12.675 -10.418 1.00 52.31 C ATOM 332 SG CYS A 22 -10.335 -13.616 -10.655 1.00 62.31 S ATOM 0 H CYS A 22 -9.992 -10.660 -11.303 1.00 25.42 H new ATOM 0 HA CYS A 22 -9.429 -11.617 -8.645 1.00 62.34 H new ATOM 0 HB2 CYS A 22 -8.391 -12.428 -11.395 1.00 52.31 H new ATOM 0 HB3 CYS A 22 -8.078 -13.310 -9.914 1.00 52.31 H new ATOM 0 HG CYS A 22 -11.240 -12.847 -11.183 1.00 62.31 H new ATOM 338 N MET A 23 -7.219 -9.744 -10.192 1.00 74.42 N ATOM 339 CA MET A 23 -5.999 -8.916 -9.995 1.00 15.31 C ATOM 340 C MET A 23 -6.138 -8.089 -8.704 1.00 13.41 C ATOM 341 O MET A 23 -5.150 -7.797 -8.019 1.00 71.03 O ATOM 342 CB MET A 23 -5.772 -7.980 -11.214 1.00 74.43 C ATOM 343 CG MET A 23 -5.643 -8.705 -12.563 1.00 23.32 C ATOM 344 SD MET A 23 -5.459 -7.568 -13.956 1.00 32.23 S ATOM 345 CE MET A 23 -3.914 -6.735 -13.565 1.00 70.54 C ATOM 0 H MET A 23 -7.742 -9.507 -11.035 1.00 74.42 H new ATOM 0 HA MET A 23 -5.135 -9.575 -9.906 1.00 15.31 H new ATOM 0 HB2 MET A 23 -6.601 -7.275 -11.273 1.00 74.43 H new ATOM 0 HB3 MET A 23 -4.868 -7.395 -11.043 1.00 74.43 H new ATOM 0 HG2 MET A 23 -4.783 -9.374 -12.530 1.00 23.32 H new ATOM 0 HG3 MET A 23 -6.524 -9.327 -12.722 1.00 23.32 H new ATOM 0 HE1 MET A 23 -3.397 -6.474 -14.489 1.00 70.54 H new ATOM 0 HE2 MET A 23 -4.123 -5.828 -12.998 1.00 70.54 H new ATOM 0 HE3 MET A 23 -3.284 -7.397 -12.971 1.00 70.54 H new ATOM 355 N SER A 24 -7.390 -7.707 -8.411 1.00 52.13 N ATOM 356 CA SER A 24 -7.787 -7.203 -7.102 1.00 13.13 C ATOM 357 C SER A 24 -7.842 -8.389 -6.126 1.00 3.00 C ATOM 358 O SER A 24 -8.763 -9.206 -6.200 1.00 50.03 O ATOM 359 CB SER A 24 -9.155 -6.491 -7.198 1.00 25.42 C ATOM 360 OG SER A 24 -9.579 -6.022 -5.933 1.00 31.43 O ATOM 0 H SER A 24 -8.155 -7.742 -9.085 1.00 52.13 H new ATOM 0 HA SER A 24 -7.064 -6.472 -6.740 1.00 13.13 H new ATOM 0 HB2 SER A 24 -9.084 -5.655 -7.893 1.00 25.42 H new ATOM 0 HB3 SER A 24 -9.898 -7.179 -7.601 1.00 25.42 H new ATOM 0 HG SER A 24 -8.841 -6.096 -5.292 1.00 31.43 H new ATOM 366 N VAL A 25 -6.835 -8.492 -5.236 1.00 65.25 N ATOM 367 CA VAL A 25 -6.674 -9.658 -4.351 1.00 30.11 C ATOM 368 C VAL A 25 -7.819 -9.747 -3.314 1.00 12.33 C ATOM 369 O VAL A 25 -8.272 -10.846 -3.014 1.00 41.31 O ATOM 370 CB VAL A 25 -5.262 -9.670 -3.652 1.00 51.53 C ATOM 371 CG1 VAL A 25 -5.084 -10.885 -2.708 1.00 33.20 C ATOM 372 CG2 VAL A 25 -4.122 -9.614 -4.709 1.00 23.43 C ATOM 0 H VAL A 25 -6.119 -7.777 -5.112 1.00 65.25 H new ATOM 0 HA VAL A 25 -6.731 -10.547 -4.979 1.00 30.11 H new ATOM 0 HB VAL A 25 -5.204 -8.776 -3.032 1.00 51.53 H new ATOM 0 HG11 VAL A 25 -4.095 -10.848 -2.250 1.00 33.20 H new ATOM 0 HG12 VAL A 25 -5.846 -10.855 -1.929 1.00 33.20 H new ATOM 0 HG13 VAL A 25 -5.185 -11.808 -3.279 1.00 33.20 H new ATOM 0 HG21 VAL A 25 -3.156 -9.623 -4.203 1.00 23.43 H new ATOM 0 HG22 VAL A 25 -4.195 -10.479 -5.369 1.00 23.43 H new ATOM 0 HG23 VAL A 25 -4.215 -8.701 -5.297 1.00 23.43 H new ATOM 382 N THR A 26 -8.298 -8.593 -2.808 1.00 65.43 N ATOM 383 CA THR A 26 -9.432 -8.549 -1.850 1.00 64.31 C ATOM 384 C THR A 26 -10.739 -9.061 -2.493 1.00 52.11 C ATOM 385 O THR A 26 -11.422 -9.905 -1.904 1.00 71.41 O ATOM 386 CB THR A 26 -9.657 -7.113 -1.264 1.00 4.52 C ATOM 387 OG1 THR A 26 -8.482 -6.687 -0.568 1.00 65.13 O ATOM 388 CG2 THR A 26 -10.853 -7.034 -0.292 1.00 64.12 C ATOM 0 H THR A 26 -7.920 -7.676 -3.044 1.00 65.43 H new ATOM 0 HA THR A 26 -9.161 -9.212 -1.028 1.00 64.31 H new ATOM 0 HB THR A 26 -9.874 -6.464 -2.113 1.00 4.52 H new ATOM 0 HG1 THR A 26 -8.572 -5.743 -0.322 1.00 65.13 H new ATOM 0 HG21 THR A 26 -10.954 -6.014 0.078 1.00 64.12 H new ATOM 0 HG22 THR A 26 -11.765 -7.323 -0.813 1.00 64.12 H new ATOM 0 HG23 THR A 26 -10.685 -7.709 0.547 1.00 64.12 H new ATOM 396 N ILE A 27 -11.074 -8.553 -3.701 1.00 73.32 N ATOM 397 CA ILE A 27 -12.297 -8.962 -4.434 1.00 1.42 C ATOM 398 C ILE A 27 -12.226 -10.464 -4.784 1.00 64.31 C ATOM 399 O ILE A 27 -13.214 -11.191 -4.633 1.00 33.33 O ATOM 400 CB ILE A 27 -12.513 -8.099 -5.734 1.00 72.42 C ATOM 401 CG1 ILE A 27 -12.750 -6.599 -5.355 1.00 51.23 C ATOM 402 CG2 ILE A 27 -13.679 -8.643 -6.607 1.00 13.41 C ATOM 403 CD1 ILE A 27 -12.913 -5.663 -6.542 1.00 21.24 C ATOM 0 H ILE A 27 -10.513 -7.856 -4.191 1.00 73.32 H new ATOM 0 HA ILE A 27 -13.153 -8.788 -3.783 1.00 1.42 H new ATOM 0 HB ILE A 27 -11.606 -8.171 -6.334 1.00 72.42 H new ATOM 0 HG12 ILE A 27 -13.642 -6.532 -4.732 1.00 51.23 H new ATOM 0 HG13 ILE A 27 -11.911 -6.254 -4.750 1.00 51.23 H new ATOM 0 HG21 ILE A 27 -13.793 -8.018 -7.493 1.00 13.41 H new ATOM 0 HG22 ILE A 27 -13.459 -9.666 -6.911 1.00 13.41 H new ATOM 0 HG23 ILE A 27 -14.604 -8.626 -6.030 1.00 13.41 H new ATOM 0 HD11 ILE A 27 -13.073 -4.646 -6.184 1.00 21.24 H new ATOM 0 HD12 ILE A 27 -12.013 -5.694 -7.156 1.00 21.24 H new ATOM 0 HD13 ILE A 27 -13.770 -5.977 -7.138 1.00 21.24 H new ATOM 415 N LYS A 28 -11.031 -10.899 -5.225 1.00 22.45 N ATOM 416 CA LYS A 28 -10.712 -12.317 -5.488 1.00 14.30 C ATOM 417 C LYS A 28 -10.988 -13.168 -4.229 1.00 34.43 C ATOM 418 O LYS A 28 -11.718 -14.159 -4.286 1.00 31.41 O ATOM 419 CB LYS A 28 -9.222 -12.446 -5.901 1.00 54.44 C ATOM 420 CG LYS A 28 -8.756 -13.878 -6.256 1.00 72.13 C ATOM 421 CD LYS A 28 -7.219 -13.988 -6.417 1.00 1.40 C ATOM 422 CE LYS A 28 -6.455 -13.621 -5.132 1.00 43.54 C ATOM 423 NZ LYS A 28 -6.834 -14.478 -3.977 1.00 5.15 N ATOM 0 H LYS A 28 -10.250 -10.270 -5.411 1.00 22.45 H new ATOM 0 HA LYS A 28 -11.343 -12.681 -6.299 1.00 14.30 H new ATOM 0 HB2 LYS A 28 -9.043 -11.800 -6.760 1.00 54.44 H new ATOM 0 HB3 LYS A 28 -8.602 -12.072 -5.086 1.00 54.44 H new ATOM 0 HG2 LYS A 28 -9.085 -14.566 -5.477 1.00 72.13 H new ATOM 0 HG3 LYS A 28 -9.237 -14.192 -7.182 1.00 72.13 H new ATOM 0 HD2 LYS A 28 -6.961 -15.006 -6.709 1.00 1.40 H new ATOM 0 HD3 LYS A 28 -6.896 -13.333 -7.226 1.00 1.40 H new ATOM 0 HE2 LYS A 28 -5.384 -13.713 -5.312 1.00 43.54 H new ATOM 0 HE3 LYS A 28 -6.648 -12.577 -4.884 1.00 43.54 H new ATOM 0 HZ1 LYS A 28 -7.156 -13.878 -3.191 1.00 5.15 H new ATOM 0 HZ2 LYS A 28 -7.601 -15.121 -4.259 1.00 5.15 H new ATOM 0 HZ3 LYS A 28 -6.010 -15.035 -3.673 1.00 5.15 H new ATOM 437 N ASN A 29 -10.442 -12.702 -3.085 1.00 51.34 N ATOM 438 CA ASN A 29 -10.567 -13.386 -1.780 1.00 51.12 C ATOM 439 C ASN A 29 -12.032 -13.432 -1.318 1.00 22.33 C ATOM 440 O ASN A 29 -12.421 -14.384 -0.656 1.00 64.15 O ATOM 441 CB ASN A 29 -9.683 -12.704 -0.681 1.00 71.45 C ATOM 442 CG ASN A 29 -8.168 -12.932 -0.845 1.00 44.10 C ATOM 443 OD1 ASN A 29 -7.733 -13.927 -1.423 1.00 50.44 O ATOM 444 ND2 ASN A 29 -7.355 -12.023 -0.316 1.00 13.03 N ATOM 0 H ASN A 29 -9.901 -11.839 -3.041 1.00 51.34 H new ATOM 0 HA ASN A 29 -10.209 -14.406 -1.921 1.00 51.12 H new ATOM 0 HB2 ASN A 29 -9.879 -11.632 -0.689 1.00 71.45 H new ATOM 0 HB3 ASN A 29 -9.990 -13.077 0.296 1.00 71.45 H new ATOM 0 HD21 ASN A 29 -6.344 -12.142 -0.384 1.00 13.03 H new ATOM 0 HD22 ASN A 29 -7.742 -11.207 0.158 1.00 13.03 H new ATOM 451 N MET A 30 -12.824 -12.395 -1.671 1.00 64.31 N ATOM 452 CA MET A 30 -14.270 -12.332 -1.345 1.00 1.51 C ATOM 453 C MET A 30 -15.035 -13.449 -2.079 1.00 72.34 C ATOM 454 O MET A 30 -15.800 -14.196 -1.459 1.00 3.42 O ATOM 455 CB MET A 30 -14.885 -10.943 -1.714 1.00 52.52 C ATOM 456 CG MET A 30 -14.453 -9.775 -0.817 1.00 35.43 C ATOM 457 SD MET A 30 -15.208 -8.208 -1.321 1.00 52.32 S ATOM 458 CE MET A 30 -14.579 -7.087 -0.069 1.00 63.13 C ATOM 0 H MET A 30 -12.484 -11.583 -2.186 1.00 64.31 H new ATOM 0 HA MET A 30 -14.368 -12.471 -0.268 1.00 1.51 H new ATOM 0 HB2 MET A 30 -14.616 -10.707 -2.744 1.00 52.52 H new ATOM 0 HB3 MET A 30 -15.971 -11.024 -1.679 1.00 52.52 H new ATOM 0 HG2 MET A 30 -14.726 -9.992 0.216 1.00 35.43 H new ATOM 0 HG3 MET A 30 -13.368 -9.679 -0.846 1.00 35.43 H new ATOM 0 HE1 MET A 30 -15.409 -6.542 0.381 1.00 63.13 H new ATOM 0 HE2 MET A 30 -14.059 -7.657 0.701 1.00 63.13 H new ATOM 0 HE3 MET A 30 -13.887 -6.381 -0.528 1.00 63.13 H new ATOM 468 N ILE A 31 -14.787 -13.557 -3.396 1.00 45.52 N ATOM 469 CA ILE A 31 -15.445 -14.546 -4.274 1.00 24.31 C ATOM 470 C ILE A 31 -15.111 -15.986 -3.814 1.00 11.52 C ATOM 471 O ILE A 31 -15.986 -16.861 -3.800 1.00 62.55 O ATOM 472 CB ILE A 31 -15.033 -14.328 -5.785 1.00 54.13 C ATOM 473 CG1 ILE A 31 -15.420 -12.881 -6.257 1.00 3.15 C ATOM 474 CG2 ILE A 31 -15.672 -15.397 -6.712 1.00 41.11 C ATOM 475 CD1 ILE A 31 -14.973 -12.525 -7.666 1.00 54.41 C ATOM 0 H ILE A 31 -14.122 -12.959 -3.886 1.00 45.52 H new ATOM 0 HA ILE A 31 -16.523 -14.402 -4.199 1.00 24.31 H new ATOM 0 HB ILE A 31 -13.951 -14.440 -5.853 1.00 54.13 H new ATOM 0 HG12 ILE A 31 -16.503 -12.773 -6.197 1.00 3.15 H new ATOM 0 HG13 ILE A 31 -14.989 -12.161 -5.562 1.00 3.15 H new ATOM 0 HG21 ILE A 31 -15.366 -15.215 -7.742 1.00 41.11 H new ATOM 0 HG22 ILE A 31 -15.341 -16.389 -6.405 1.00 41.11 H new ATOM 0 HG23 ILE A 31 -16.758 -15.339 -6.640 1.00 41.11 H new ATOM 0 HD11 ILE A 31 -15.286 -11.508 -7.901 1.00 54.41 H new ATOM 0 HD12 ILE A 31 -13.887 -12.595 -7.732 1.00 54.41 H new ATOM 0 HD13 ILE A 31 -15.425 -13.217 -8.377 1.00 54.41 H new ATOM 487 N GLU A 32 -13.846 -16.191 -3.405 1.00 4.55 N ATOM 488 CA GLU A 32 -13.342 -17.501 -2.938 1.00 4.42 C ATOM 489 C GLU A 32 -13.853 -17.837 -1.519 1.00 32.41 C ATOM 490 O GLU A 32 -14.110 -19.005 -1.210 1.00 13.34 O ATOM 491 CB GLU A 32 -11.795 -17.508 -2.959 1.00 24.53 C ATOM 492 CG GLU A 32 -11.175 -17.255 -4.346 1.00 1.32 C ATOM 493 CD GLU A 32 -9.637 -17.174 -4.312 1.00 72.42 C ATOM 494 OE1 GLU A 32 -9.097 -16.212 -3.713 1.00 11.31 O ATOM 495 OE2 GLU A 32 -8.962 -18.070 -4.879 1.00 54.52 O ATOM 0 H GLU A 32 -13.141 -15.454 -3.388 1.00 4.55 H new ATOM 0 HA GLU A 32 -13.720 -18.265 -3.617 1.00 4.42 H new ATOM 0 HB2 GLU A 32 -11.431 -16.748 -2.268 1.00 24.53 H new ATOM 0 HB3 GLU A 32 -11.443 -18.471 -2.588 1.00 24.53 H new ATOM 0 HG2 GLU A 32 -11.476 -18.054 -5.024 1.00 1.32 H new ATOM 0 HG3 GLU A 32 -11.573 -16.325 -4.752 1.00 1.32 H new ATOM 502 N ASP A 33 -14.005 -16.799 -0.673 1.00 53.20 N ATOM 503 CA ASP A 33 -14.441 -16.947 0.740 1.00 30.02 C ATOM 504 C ASP A 33 -15.928 -17.333 0.814 1.00 71.43 C ATOM 505 O ASP A 33 -16.343 -18.136 1.658 1.00 73.05 O ATOM 506 CB ASP A 33 -14.179 -15.632 1.521 1.00 14.33 C ATOM 507 CG ASP A 33 -14.535 -15.713 3.013 1.00 25.42 C ATOM 508 OD1 ASP A 33 -13.828 -16.425 3.763 1.00 11.41 O ATOM 509 OD2 ASP A 33 -15.518 -15.071 3.450 1.00 14.31 O ATOM 0 H ASP A 33 -13.830 -15.832 -0.945 1.00 53.20 H new ATOM 0 HA ASP A 33 -13.861 -17.747 1.199 1.00 30.02 H new ATOM 0 HB2 ASP A 33 -13.127 -15.366 1.423 1.00 14.33 H new ATOM 0 HB3 ASP A 33 -14.755 -14.828 1.063 1.00 14.33 H new ATOM 514 N ILE A 34 -16.718 -16.729 -0.081 1.00 52.23 N ATOM 515 CA ILE A 34 -18.132 -17.083 -0.288 1.00 64.22 C ATOM 516 C ILE A 34 -18.221 -18.426 -1.047 1.00 14.13 C ATOM 517 O ILE A 34 -19.166 -19.200 -0.861 1.00 71.02 O ATOM 518 CB ILE A 34 -18.886 -15.943 -1.076 1.00 54.23 C ATOM 519 CG1 ILE A 34 -18.808 -14.590 -0.287 1.00 4.41 C ATOM 520 CG2 ILE A 34 -20.360 -16.326 -1.369 1.00 11.23 C ATOM 521 CD1 ILE A 34 -19.431 -13.392 -0.992 1.00 40.13 C ATOM 0 H ILE A 34 -16.394 -15.975 -0.687 1.00 52.23 H new ATOM 0 HA ILE A 34 -18.617 -17.190 0.682 1.00 64.22 H new ATOM 0 HB ILE A 34 -18.387 -15.817 -2.037 1.00 54.23 H new ATOM 0 HG12 ILE A 34 -19.300 -14.721 0.677 1.00 4.41 H new ATOM 0 HG13 ILE A 34 -17.761 -14.367 -0.082 1.00 4.41 H new ATOM 0 HG21 ILE A 34 -20.845 -15.516 -1.913 1.00 11.23 H new ATOM 0 HG22 ILE A 34 -20.387 -17.234 -1.971 1.00 11.23 H new ATOM 0 HG23 ILE A 34 -20.885 -16.498 -0.429 1.00 11.23 H new ATOM 0 HD11 ILE A 34 -19.326 -12.506 -0.366 1.00 40.13 H new ATOM 0 HD12 ILE A 34 -18.925 -13.226 -1.943 1.00 40.13 H new ATOM 0 HD13 ILE A 34 -20.488 -13.585 -1.172 1.00 40.13 H new ATOM 533 N GLY A 35 -17.203 -18.692 -1.884 1.00 51.25 N ATOM 534 CA GLY A 35 -17.135 -19.907 -2.696 1.00 74.24 C ATOM 535 C GLY A 35 -17.545 -19.630 -4.125 1.00 55.10 C ATOM 536 O GLY A 35 -16.787 -19.891 -5.064 1.00 64.41 O ATOM 0 H GLY A 35 -16.407 -18.067 -2.012 1.00 51.25 H new ATOM 0 HA2 GLY A 35 -16.121 -20.305 -2.676 1.00 74.24 H new ATOM 0 HA3 GLY A 35 -17.786 -20.670 -2.269 1.00 74.24 H new ATOM 540 N GLU A 36 -18.767 -19.085 -4.273 1.00 70.10 N ATOM 541 CA GLU A 36 -19.346 -18.667 -5.562 1.00 74.44 C ATOM 542 C GLU A 36 -20.069 -17.320 -5.358 1.00 54.32 C ATOM 543 O GLU A 36 -20.948 -17.221 -4.496 1.00 12.05 O ATOM 544 CB GLU A 36 -20.348 -19.744 -6.085 1.00 71.42 C ATOM 545 CG GLU A 36 -19.737 -21.133 -6.365 1.00 1.02 C ATOM 546 CD GLU A 36 -20.768 -22.185 -6.811 1.00 61.21 C ATOM 547 OE1 GLU A 36 -20.838 -22.501 -8.024 1.00 14.21 O ATOM 548 OE2 GLU A 36 -21.515 -22.706 -5.950 1.00 72.43 O ATOM 0 H GLU A 36 -19.391 -18.920 -3.483 1.00 70.10 H new ATOM 0 HA GLU A 36 -18.554 -18.557 -6.303 1.00 74.44 H new ATOM 0 HB2 GLU A 36 -21.148 -19.858 -5.353 1.00 71.42 H new ATOM 0 HB3 GLU A 36 -20.806 -19.375 -7.003 1.00 71.42 H new ATOM 0 HG2 GLU A 36 -18.974 -21.035 -7.137 1.00 1.02 H new ATOM 0 HG3 GLU A 36 -19.236 -21.488 -5.464 1.00 1.02 H new ATOM 555 N SER A 37 -19.698 -16.281 -6.139 1.00 70.02 N ATOM 556 CA SER A 37 -20.308 -14.940 -6.030 1.00 33.32 C ATOM 557 C SER A 37 -20.825 -14.458 -7.402 1.00 43.35 C ATOM 558 O SER A 37 -20.107 -13.781 -8.155 1.00 20.34 O ATOM 559 CB SER A 37 -19.301 -13.932 -5.424 1.00 4.52 C ATOM 560 OG SER A 37 -18.809 -14.392 -4.175 1.00 55.14 O ATOM 0 H SER A 37 -18.975 -16.348 -6.855 1.00 70.02 H new ATOM 0 HA SER A 37 -21.164 -15.005 -5.358 1.00 33.32 H new ATOM 0 HB2 SER A 37 -18.470 -13.784 -6.114 1.00 4.52 H new ATOM 0 HB3 SER A 37 -19.784 -12.964 -5.294 1.00 4.52 H new ATOM 0 HG SER A 37 -19.561 -14.653 -3.603 1.00 55.14 H new ATOM 566 N ASP A 38 -22.065 -14.868 -7.736 1.00 52.34 N ATOM 567 CA ASP A 38 -22.776 -14.403 -8.946 1.00 4.14 C ATOM 568 C ASP A 38 -23.446 -13.049 -8.673 1.00 10.23 C ATOM 569 O ASP A 38 -23.524 -12.196 -9.561 1.00 3.54 O ATOM 570 CB ASP A 38 -23.841 -15.444 -9.394 1.00 31.24 C ATOM 571 CG ASP A 38 -24.565 -15.063 -10.702 1.00 23.42 C ATOM 572 OD1 ASP A 38 -25.761 -14.697 -10.663 1.00 24.24 O ATOM 573 OD2 ASP A 38 -23.930 -15.122 -11.782 1.00 64.51 O ATOM 0 H ASP A 38 -22.602 -15.530 -7.176 1.00 52.34 H new ATOM 0 HA ASP A 38 -22.049 -14.287 -9.750 1.00 4.14 H new ATOM 0 HB2 ASP A 38 -23.358 -16.412 -9.525 1.00 31.24 H new ATOM 0 HB3 ASP A 38 -24.579 -15.561 -8.601 1.00 31.24 H new ATOM 578 N SER A 39 -23.919 -12.876 -7.426 1.00 65.34 N ATOM 579 CA SER A 39 -24.596 -11.651 -6.973 1.00 61.04 C ATOM 580 C SER A 39 -23.633 -10.437 -7.036 1.00 2.43 C ATOM 581 O SER A 39 -22.428 -10.607 -6.801 1.00 31.10 O ATOM 582 CB SER A 39 -25.124 -11.852 -5.533 1.00 32.52 C ATOM 583 OG SER A 39 -26.015 -12.958 -5.458 1.00 23.52 O ATOM 0 H SER A 39 -23.841 -13.588 -6.700 1.00 65.34 H new ATOM 0 HA SER A 39 -25.437 -11.446 -7.635 1.00 61.04 H new ATOM 0 HB2 SER A 39 -24.285 -12.011 -4.855 1.00 32.52 H new ATOM 0 HB3 SER A 39 -25.635 -10.948 -5.201 1.00 32.52 H new ATOM 0 HG SER A 39 -26.331 -13.062 -4.536 1.00 23.52 H new ATOM 589 N PRO A 40 -24.147 -9.204 -7.383 1.00 61.45 N ATOM 590 CA PRO A 40 -23.320 -7.970 -7.441 1.00 75.44 C ATOM 591 C PRO A 40 -22.532 -7.717 -6.140 1.00 50.11 C ATOM 592 O PRO A 40 -23.137 -7.572 -5.077 1.00 44.54 O ATOM 593 CB PRO A 40 -24.372 -6.850 -7.691 1.00 21.14 C ATOM 594 CG PRO A 40 -25.505 -7.547 -8.383 1.00 23.21 C ATOM 595 CD PRO A 40 -25.563 -8.926 -7.766 1.00 34.13 C ATOM 0 HA PRO A 40 -22.551 -8.027 -8.211 1.00 75.44 H new ATOM 0 HB2 PRO A 40 -24.698 -6.395 -6.755 1.00 21.14 H new ATOM 0 HB3 PRO A 40 -23.962 -6.051 -8.308 1.00 21.14 H new ATOM 0 HG2 PRO A 40 -26.443 -7.012 -8.238 1.00 23.21 H new ATOM 0 HG3 PRO A 40 -25.334 -7.604 -9.458 1.00 23.21 H new ATOM 0 HD2 PRO A 40 -26.224 -8.949 -6.899 1.00 34.13 H new ATOM 0 HD3 PRO A 40 -25.939 -9.665 -8.473 1.00 34.13 H new ATOM 603 N ILE A 41 -21.188 -7.698 -6.248 1.00 55.04 N ATOM 604 CA ILE A 41 -20.285 -7.511 -5.099 1.00 43.12 C ATOM 605 C ILE A 41 -20.354 -6.029 -4.648 1.00 73.14 C ATOM 606 O ILE A 41 -19.932 -5.143 -5.397 1.00 12.14 O ATOM 607 CB ILE A 41 -18.781 -7.912 -5.431 1.00 71.24 C ATOM 608 CG1 ILE A 41 -18.635 -9.441 -5.808 1.00 45.41 C ATOM 609 CG2 ILE A 41 -17.823 -7.550 -4.255 1.00 32.51 C ATOM 610 CD1 ILE A 41 -19.123 -9.836 -7.200 1.00 11.40 C ATOM 0 H ILE A 41 -20.700 -7.812 -7.136 1.00 55.04 H new ATOM 0 HA ILE A 41 -20.615 -8.173 -4.298 1.00 43.12 H new ATOM 0 HB ILE A 41 -18.493 -7.329 -6.306 1.00 71.24 H new ATOM 0 HG12 ILE A 41 -17.584 -9.718 -5.721 1.00 45.41 H new ATOM 0 HG13 ILE A 41 -19.182 -10.030 -5.072 1.00 45.41 H new ATOM 0 HG21 ILE A 41 -16.804 -7.837 -4.514 1.00 32.51 H new ATOM 0 HG22 ILE A 41 -17.862 -6.476 -4.071 1.00 32.51 H new ATOM 0 HG23 ILE A 41 -18.133 -8.083 -3.356 1.00 32.51 H new ATOM 0 HD11 ILE A 41 -18.974 -10.906 -7.348 1.00 11.40 H new ATOM 0 HD12 ILE A 41 -20.183 -9.601 -7.294 1.00 11.40 H new ATOM 0 HD13 ILE A 41 -18.561 -9.284 -7.953 1.00 11.40 H new ATOM 622 N PRO A 42 -20.934 -5.735 -3.436 1.00 13.22 N ATOM 623 CA PRO A 42 -21.009 -4.366 -2.909 1.00 21.01 C ATOM 624 C PRO A 42 -19.718 -3.993 -2.141 1.00 13.44 C ATOM 625 O PRO A 42 -19.296 -4.699 -1.208 1.00 54.34 O ATOM 626 CB PRO A 42 -22.250 -4.430 -1.987 1.00 32.11 C ATOM 627 CG PRO A 42 -22.300 -5.846 -1.479 1.00 63.30 C ATOM 628 CD PRO A 42 -21.548 -6.709 -2.485 1.00 43.01 C ATOM 0 HA PRO A 42 -21.096 -3.598 -3.678 1.00 21.01 H new ATOM 0 HB2 PRO A 42 -22.165 -3.720 -1.164 1.00 32.11 H new ATOM 0 HB3 PRO A 42 -23.159 -4.177 -2.533 1.00 32.11 H new ATOM 0 HG2 PRO A 42 -21.843 -5.918 -0.492 1.00 63.30 H new ATOM 0 HG3 PRO A 42 -23.332 -6.183 -1.378 1.00 63.30 H new ATOM 0 HD2 PRO A 42 -20.788 -7.317 -1.995 1.00 43.01 H new ATOM 0 HD3 PRO A 42 -22.221 -7.395 -3.000 1.00 43.01 H new ATOM 636 N LEU A 43 -19.078 -2.906 -2.576 1.00 32.21 N ATOM 637 CA LEU A 43 -17.865 -2.367 -1.950 1.00 63.32 C ATOM 638 C LEU A 43 -18.250 -1.072 -1.202 1.00 33.30 C ATOM 639 O LEU A 43 -18.319 0.002 -1.812 1.00 71.32 O ATOM 640 CB LEU A 43 -16.780 -2.122 -3.036 1.00 35.43 C ATOM 641 CG LEU A 43 -16.307 -3.391 -3.824 1.00 21.43 C ATOM 642 CD1 LEU A 43 -15.367 -3.015 -4.993 1.00 4.34 C ATOM 643 CD2 LEU A 43 -15.651 -4.432 -2.881 1.00 61.15 C ATOM 0 H LEU A 43 -19.390 -2.367 -3.384 1.00 32.21 H new ATOM 0 HA LEU A 43 -17.442 -3.071 -1.233 1.00 63.32 H new ATOM 0 HB2 LEU A 43 -17.166 -1.396 -3.751 1.00 35.43 H new ATOM 0 HB3 LEU A 43 -15.911 -1.669 -2.559 1.00 35.43 H new ATOM 0 HG LEU A 43 -17.194 -3.855 -4.256 1.00 21.43 H new ATOM 0 HD11 LEU A 43 -15.059 -3.920 -5.517 1.00 4.34 H new ATOM 0 HD12 LEU A 43 -15.892 -2.356 -5.684 1.00 4.34 H new ATOM 0 HD13 LEU A 43 -14.487 -2.504 -4.602 1.00 4.34 H new ATOM 0 HD21 LEU A 43 -15.335 -5.299 -3.460 1.00 61.15 H new ATOM 0 HD22 LEU A 43 -14.784 -3.986 -2.393 1.00 61.15 H new ATOM 0 HD23 LEU A 43 -16.372 -4.744 -2.125 1.00 61.15 H new ATOM 655 N PRO A 44 -18.555 -1.167 0.141 1.00 51.44 N ATOM 656 CA PRO A 44 -19.098 -0.036 0.940 1.00 61.43 C ATOM 657 C PRO A 44 -18.073 1.084 1.245 1.00 71.32 C ATOM 658 O PRO A 44 -18.433 2.087 1.873 1.00 33.54 O ATOM 659 CB PRO A 44 -19.572 -0.733 2.238 1.00 23.12 C ATOM 660 CG PRO A 44 -18.645 -1.895 2.390 1.00 45.51 C ATOM 661 CD PRO A 44 -18.414 -2.393 0.985 1.00 42.03 C ATOM 0 HA PRO A 44 -19.881 0.494 0.398 1.00 61.43 H new ATOM 0 HB2 PRO A 44 -19.513 -0.062 3.095 1.00 23.12 H new ATOM 0 HB3 PRO A 44 -20.609 -1.059 2.159 1.00 23.12 H new ATOM 0 HG2 PRO A 44 -17.709 -1.595 2.862 1.00 45.51 H new ATOM 0 HG3 PRO A 44 -19.084 -2.671 3.017 1.00 45.51 H new ATOM 0 HD2 PRO A 44 -17.426 -2.841 0.877 1.00 42.03 H new ATOM 0 HD3 PRO A 44 -19.142 -3.155 0.707 1.00 42.03 H new ATOM 669 N ASN A 45 -16.807 0.920 0.803 1.00 51.14 N ATOM 670 CA ASN A 45 -15.765 1.947 0.987 1.00 41.05 C ATOM 671 C ASN A 45 -14.879 2.060 -0.268 1.00 13.34 C ATOM 672 O ASN A 45 -13.732 1.587 -0.290 1.00 52.43 O ATOM 673 CB ASN A 45 -14.911 1.658 2.257 1.00 10.24 C ATOM 674 CG ASN A 45 -13.885 2.767 2.563 1.00 74.35 C ATOM 675 OD1 ASN A 45 -14.136 3.954 2.333 1.00 74.11 O ATOM 676 ND2 ASN A 45 -12.723 2.393 3.072 1.00 52.53 N ATOM 0 H ASN A 45 -16.484 0.084 0.316 1.00 51.14 H new ATOM 0 HA ASN A 45 -16.260 2.907 1.134 1.00 41.05 H new ATOM 0 HB2 ASN A 45 -15.574 1.539 3.114 1.00 10.24 H new ATOM 0 HB3 ASN A 45 -14.386 0.712 2.126 1.00 10.24 H new ATOM 0 HD21 ASN A 45 -12.010 3.091 3.283 1.00 52.53 H new ATOM 0 HD22 ASN A 45 -12.539 1.406 3.253 1.00 52.53 H new ATOM 683 N VAL A 46 -15.470 2.642 -1.321 1.00 55.31 N ATOM 684 CA VAL A 46 -14.752 3.125 -2.513 1.00 73.01 C ATOM 685 C VAL A 46 -15.757 3.855 -3.422 1.00 12.54 C ATOM 686 O VAL A 46 -16.800 3.292 -3.783 1.00 2.11 O ATOM 687 CB VAL A 46 -13.971 1.997 -3.320 1.00 32.40 C ATOM 688 CG1 VAL A 46 -14.909 0.897 -3.878 1.00 74.10 C ATOM 689 CG2 VAL A 46 -13.083 2.620 -4.429 1.00 62.13 C ATOM 0 H VAL A 46 -16.477 2.794 -1.371 1.00 55.31 H new ATOM 0 HA VAL A 46 -13.971 3.801 -2.166 1.00 73.01 H new ATOM 0 HB VAL A 46 -13.315 1.495 -2.608 1.00 32.40 H new ATOM 0 HG11 VAL A 46 -14.320 0.156 -4.418 1.00 74.10 H new ATOM 0 HG12 VAL A 46 -15.433 0.413 -3.054 1.00 74.10 H new ATOM 0 HG13 VAL A 46 -15.635 1.347 -4.555 1.00 74.10 H new ATOM 0 HG21 VAL A 46 -12.561 1.827 -4.965 1.00 62.13 H new ATOM 0 HG22 VAL A 46 -13.709 3.178 -5.126 1.00 62.13 H new ATOM 0 HG23 VAL A 46 -12.355 3.293 -3.977 1.00 62.13 H new ATOM 699 N THR A 47 -15.458 5.122 -3.745 1.00 13.43 N ATOM 700 CA THR A 47 -16.288 5.933 -4.644 1.00 2.35 C ATOM 701 C THR A 47 -16.196 5.392 -6.085 1.00 64.21 C ATOM 702 O THR A 47 -15.188 4.773 -6.456 1.00 2.11 O ATOM 703 CB THR A 47 -15.853 7.426 -4.599 1.00 63.33 C ATOM 704 OG1 THR A 47 -14.451 7.526 -4.901 1.00 64.24 O ATOM 705 CG2 THR A 47 -16.137 8.062 -3.224 1.00 50.14 C ATOM 0 H THR A 47 -14.636 5.611 -3.391 1.00 13.43 H new ATOM 0 HA THR A 47 -17.323 5.869 -4.309 1.00 2.35 H new ATOM 0 HB THR A 47 -16.435 7.970 -5.343 1.00 63.33 H new ATOM 0 HG1 THR A 47 -14.177 8.467 -4.874 1.00 64.24 H new ATOM 0 HG21 THR A 47 -15.819 9.105 -3.233 1.00 50.14 H new ATOM 0 HG22 THR A 47 -17.205 8.010 -3.013 1.00 50.14 H new ATOM 0 HG23 THR A 47 -15.588 7.522 -2.453 1.00 50.14 H new ATOM 713 N SER A 48 -17.248 5.648 -6.876 1.00 64.04 N ATOM 714 CA SER A 48 -17.421 5.073 -8.221 1.00 63.14 C ATOM 715 C SER A 48 -16.295 5.459 -9.183 1.00 52.04 C ATOM 716 O SER A 48 -15.741 4.599 -9.870 1.00 42.42 O ATOM 717 CB SER A 48 -18.763 5.535 -8.793 1.00 34.13 C ATOM 718 OG SER A 48 -18.858 6.956 -8.794 1.00 52.22 O ATOM 0 H SER A 48 -18.011 6.266 -6.599 1.00 64.04 H new ATOM 0 HA SER A 48 -17.394 3.988 -8.119 1.00 63.14 H new ATOM 0 HB2 SER A 48 -18.877 5.159 -9.810 1.00 34.13 H new ATOM 0 HB3 SER A 48 -19.577 5.113 -8.204 1.00 34.13 H new ATOM 0 HG SER A 48 -19.784 7.222 -8.616 1.00 52.22 H new ATOM 724 N THR A 49 -15.977 6.757 -9.209 1.00 22.22 N ATOM 725 CA THR A 49 -14.962 7.330 -10.097 1.00 51.53 C ATOM 726 C THR A 49 -13.587 6.681 -9.862 1.00 34.34 C ATOM 727 O THR A 49 -12.926 6.252 -10.811 1.00 73.42 O ATOM 728 CB THR A 49 -14.878 8.871 -9.873 1.00 44.21 C ATOM 729 OG1 THR A 49 -14.669 9.128 -8.470 1.00 53.13 O ATOM 730 CG2 THR A 49 -16.164 9.590 -10.343 1.00 31.24 C ATOM 0 H THR A 49 -16.423 7.448 -8.606 1.00 22.22 H new ATOM 0 HA THR A 49 -15.253 7.130 -11.128 1.00 51.53 H new ATOM 0 HB THR A 49 -14.047 9.258 -10.463 1.00 44.21 H new ATOM 0 HG1 THR A 49 -14.613 10.095 -8.319 1.00 53.13 H new ATOM 0 HG21 THR A 49 -16.066 10.662 -10.170 1.00 31.24 H new ATOM 0 HG22 THR A 49 -16.315 9.407 -11.407 1.00 31.24 H new ATOM 0 HG23 THR A 49 -17.019 9.209 -9.784 1.00 31.24 H new ATOM 738 N ILE A 50 -13.205 6.564 -8.580 1.00 44.51 N ATOM 739 CA ILE A 50 -11.906 6.006 -8.172 1.00 3.13 C ATOM 740 C ILE A 50 -11.851 4.493 -8.461 1.00 11.12 C ATOM 741 O ILE A 50 -10.839 3.993 -8.965 1.00 40.24 O ATOM 742 CB ILE A 50 -11.637 6.289 -6.648 1.00 74.12 C ATOM 743 CG1 ILE A 50 -11.642 7.823 -6.373 1.00 22.32 C ATOM 744 CG2 ILE A 50 -10.315 5.654 -6.164 1.00 31.30 C ATOM 745 CD1 ILE A 50 -10.576 8.615 -7.111 1.00 64.40 C ATOM 0 H ILE A 50 -13.789 6.854 -7.796 1.00 44.51 H new ATOM 0 HA ILE A 50 -11.125 6.494 -8.754 1.00 3.13 H new ATOM 0 HB ILE A 50 -12.444 5.824 -6.081 1.00 74.12 H new ATOM 0 HG12 ILE A 50 -12.620 8.221 -6.643 1.00 22.32 H new ATOM 0 HG13 ILE A 50 -11.516 7.985 -5.302 1.00 22.32 H new ATOM 0 HG21 ILE A 50 -10.171 5.875 -5.106 1.00 31.30 H new ATOM 0 HG22 ILE A 50 -10.357 4.574 -6.306 1.00 31.30 H new ATOM 0 HG23 ILE A 50 -9.483 6.064 -6.737 1.00 31.30 H new ATOM 0 HD11 ILE A 50 -10.663 9.670 -6.853 1.00 64.40 H new ATOM 0 HD12 ILE A 50 -9.589 8.252 -6.825 1.00 64.40 H new ATOM 0 HD13 ILE A 50 -10.710 8.492 -8.186 1.00 64.40 H new ATOM 757 N LEU A 51 -12.961 3.790 -8.155 1.00 30.25 N ATOM 758 CA LEU A 51 -13.102 2.343 -8.422 1.00 25.42 C ATOM 759 C LEU A 51 -12.936 2.059 -9.928 1.00 20.53 C ATOM 760 O LEU A 51 -12.240 1.118 -10.312 1.00 63.22 O ATOM 761 CB LEU A 51 -14.475 1.806 -7.913 1.00 13.12 C ATOM 762 CG LEU A 51 -14.714 0.263 -8.075 1.00 41.14 C ATOM 763 CD1 LEU A 51 -13.636 -0.564 -7.335 1.00 65.40 C ATOM 764 CD2 LEU A 51 -16.135 -0.145 -7.618 1.00 4.11 C ATOM 0 H LEU A 51 -13.782 4.207 -7.717 1.00 30.25 H new ATOM 0 HA LEU A 51 -12.316 1.820 -7.877 1.00 25.42 H new ATOM 0 HB2 LEU A 51 -14.573 2.060 -6.857 1.00 13.12 H new ATOM 0 HB3 LEU A 51 -15.268 2.334 -8.443 1.00 13.12 H new ATOM 0 HG LEU A 51 -14.630 0.039 -9.138 1.00 41.14 H new ATOM 0 HD11 LEU A 51 -13.836 -1.627 -7.471 1.00 65.40 H new ATOM 0 HD12 LEU A 51 -12.653 -0.325 -7.740 1.00 65.40 H new ATOM 0 HD13 LEU A 51 -13.659 -0.323 -6.272 1.00 65.40 H new ATOM 0 HD21 LEU A 51 -16.263 -1.220 -7.745 1.00 4.11 H new ATOM 0 HD22 LEU A 51 -16.268 0.115 -6.568 1.00 4.11 H new ATOM 0 HD23 LEU A 51 -16.876 0.382 -8.219 1.00 4.11 H new ATOM 776 N GLU A 52 -13.542 2.927 -10.756 1.00 33.43 N ATOM 777 CA GLU A 52 -13.474 2.843 -12.223 1.00 53.02 C ATOM 778 C GLU A 52 -12.025 2.974 -12.713 1.00 42.24 C ATOM 779 O GLU A 52 -11.578 2.187 -13.547 1.00 72.25 O ATOM 780 CB GLU A 52 -14.342 3.957 -12.860 1.00 63.42 C ATOM 781 CG GLU A 52 -14.234 4.042 -14.396 1.00 51.41 C ATOM 782 CD GLU A 52 -15.044 5.187 -15.018 1.00 54.23 C ATOM 783 OE1 GLU A 52 -14.934 6.333 -14.533 1.00 35.51 O ATOM 784 OE2 GLU A 52 -15.758 4.953 -16.019 1.00 52.14 O ATOM 0 H GLU A 52 -14.098 3.714 -10.421 1.00 33.43 H new ATOM 0 HA GLU A 52 -13.856 1.868 -12.525 1.00 53.02 H new ATOM 0 HB2 GLU A 52 -15.384 3.789 -12.589 1.00 63.42 H new ATOM 0 HB3 GLU A 52 -14.052 4.917 -12.433 1.00 63.42 H new ATOM 0 HG2 GLU A 52 -13.186 4.162 -14.670 1.00 51.41 H new ATOM 0 HG3 GLU A 52 -14.570 3.098 -14.826 1.00 51.41 H new ATOM 791 N LYS A 53 -11.316 3.984 -12.174 1.00 41.23 N ATOM 792 CA LYS A 53 -9.916 4.285 -12.537 1.00 2.30 C ATOM 793 C LYS A 53 -8.996 3.081 -12.256 1.00 2.33 C ATOM 794 O LYS A 53 -8.139 2.731 -13.078 1.00 70.55 O ATOM 795 CB LYS A 53 -9.403 5.521 -11.749 1.00 13.25 C ATOM 796 CG LYS A 53 -10.115 6.855 -12.064 1.00 62.21 C ATOM 797 CD LYS A 53 -9.538 8.038 -11.243 1.00 34.23 C ATOM 798 CE LYS A 53 -8.089 8.383 -11.627 1.00 12.21 C ATOM 799 NZ LYS A 53 -7.988 8.894 -13.022 1.00 20.52 N ATOM 0 H LYS A 53 -11.699 4.617 -11.472 1.00 41.23 H new ATOM 0 HA LYS A 53 -9.893 4.501 -13.605 1.00 2.30 H new ATOM 0 HB2 LYS A 53 -9.505 5.318 -10.683 1.00 13.25 H new ATOM 0 HB3 LYS A 53 -8.338 5.642 -11.950 1.00 13.25 H new ATOM 0 HG2 LYS A 53 -10.019 7.073 -13.128 1.00 62.21 H new ATOM 0 HG3 LYS A 53 -11.180 6.755 -11.854 1.00 62.21 H new ATOM 0 HD2 LYS A 53 -10.166 8.916 -11.390 1.00 34.23 H new ATOM 0 HD3 LYS A 53 -9.578 7.791 -10.182 1.00 34.23 H new ATOM 0 HE2 LYS A 53 -7.700 9.132 -10.937 1.00 12.21 H new ATOM 0 HE3 LYS A 53 -7.465 7.496 -11.520 1.00 12.21 H new ATOM 0 HZ1 LYS A 53 -7.181 9.545 -13.096 1.00 20.52 H new ATOM 0 HZ2 LYS A 53 -7.850 8.096 -13.675 1.00 20.52 H new ATOM 0 HZ3 LYS A 53 -8.863 9.398 -13.271 1.00 20.52 H new ATOM 813 N VAL A 54 -9.195 2.463 -11.082 1.00 1.22 N ATOM 814 CA VAL A 54 -8.386 1.324 -10.618 1.00 25.31 C ATOM 815 C VAL A 54 -8.679 0.066 -11.475 1.00 21.40 C ATOM 816 O VAL A 54 -7.750 -0.631 -11.891 1.00 51.40 O ATOM 817 CB VAL A 54 -8.638 1.053 -9.084 1.00 62.33 C ATOM 818 CG1 VAL A 54 -7.876 -0.189 -8.579 1.00 15.34 C ATOM 819 CG2 VAL A 54 -8.262 2.298 -8.234 1.00 51.12 C ATOM 0 H VAL A 54 -9.924 2.740 -10.425 1.00 1.22 H new ATOM 0 HA VAL A 54 -7.331 1.570 -10.740 1.00 25.31 H new ATOM 0 HB VAL A 54 -9.703 0.854 -8.968 1.00 62.33 H new ATOM 0 HG11 VAL A 54 -8.081 -0.335 -7.518 1.00 15.34 H new ATOM 0 HG12 VAL A 54 -8.202 -1.067 -9.136 1.00 15.34 H new ATOM 0 HG13 VAL A 54 -6.806 -0.044 -8.725 1.00 15.34 H new ATOM 0 HG21 VAL A 54 -8.444 2.088 -7.180 1.00 51.12 H new ATOM 0 HG22 VAL A 54 -7.208 2.533 -8.380 1.00 51.12 H new ATOM 0 HG23 VAL A 54 -8.870 3.148 -8.545 1.00 51.12 H new ATOM 829 N LEU A 55 -9.974 -0.184 -11.756 1.00 2.02 N ATOM 830 CA LEU A 55 -10.421 -1.340 -12.575 1.00 42.31 C ATOM 831 C LEU A 55 -9.990 -1.192 -14.054 1.00 71.10 C ATOM 832 O LEU A 55 -9.707 -2.193 -14.723 1.00 41.32 O ATOM 833 CB LEU A 55 -11.967 -1.523 -12.482 1.00 2.34 C ATOM 834 CG LEU A 55 -12.540 -1.939 -11.084 1.00 70.04 C ATOM 835 CD1 LEU A 55 -14.084 -2.048 -11.129 1.00 72.43 C ATOM 836 CD2 LEU A 55 -11.894 -3.249 -10.566 1.00 31.52 C ATOM 0 H LEU A 55 -10.739 0.404 -11.426 1.00 2.02 H new ATOM 0 HA LEU A 55 -9.937 -2.229 -12.170 1.00 42.31 H new ATOM 0 HB2 LEU A 55 -12.440 -0.587 -12.779 1.00 2.34 H new ATOM 0 HB3 LEU A 55 -12.266 -2.276 -13.211 1.00 2.34 H new ATOM 0 HG LEU A 55 -12.281 -1.153 -10.375 1.00 70.04 H new ATOM 0 HD11 LEU A 55 -14.457 -2.338 -10.147 1.00 72.43 H new ATOM 0 HD12 LEU A 55 -14.509 -1.084 -11.408 1.00 72.43 H new ATOM 0 HD13 LEU A 55 -14.374 -2.799 -11.864 1.00 72.43 H new ATOM 0 HD21 LEU A 55 -12.317 -3.504 -9.595 1.00 31.52 H new ATOM 0 HD22 LEU A 55 -12.092 -4.056 -11.271 1.00 31.52 H new ATOM 0 HD23 LEU A 55 -10.817 -3.110 -10.467 1.00 31.52 H new ATOM 848 N ASP A 56 -9.947 0.064 -14.542 1.00 53.14 N ATOM 849 CA ASP A 56 -9.545 0.388 -15.928 1.00 45.34 C ATOM 850 C ASP A 56 -8.038 0.139 -16.100 1.00 75.35 C ATOM 851 O ASP A 56 -7.614 -0.459 -17.091 1.00 15.42 O ATOM 852 CB ASP A 56 -9.902 1.863 -16.282 1.00 0.25 C ATOM 853 CG ASP A 56 -9.647 2.224 -17.767 1.00 44.33 C ATOM 854 OD1 ASP A 56 -10.575 2.079 -18.599 1.00 32.40 O ATOM 855 OD2 ASP A 56 -8.526 2.637 -18.112 1.00 40.41 O ATOM 0 H ASP A 56 -10.190 0.884 -13.986 1.00 53.14 H new ATOM 0 HA ASP A 56 -10.094 -0.259 -16.612 1.00 45.34 H new ATOM 0 HB2 ASP A 56 -10.952 2.040 -16.049 1.00 0.25 H new ATOM 0 HB3 ASP A 56 -9.318 2.531 -15.649 1.00 0.25 H new ATOM 860 N TYR A 57 -7.242 0.592 -15.109 1.00 11.22 N ATOM 861 CA TYR A 57 -5.787 0.349 -15.078 1.00 53.44 C ATOM 862 C TYR A 57 -5.492 -1.162 -15.036 1.00 4.12 C ATOM 863 O TYR A 57 -4.619 -1.651 -15.763 1.00 3.34 O ATOM 864 CB TYR A 57 -5.115 1.048 -13.864 1.00 45.22 C ATOM 865 CG TYR A 57 -3.605 0.739 -13.742 1.00 43.24 C ATOM 866 CD1 TYR A 57 -2.665 1.414 -14.526 1.00 42.51 C ATOM 867 CD2 TYR A 57 -3.125 -0.252 -12.868 1.00 23.13 C ATOM 868 CE1 TYR A 57 -1.318 1.112 -14.444 1.00 4.12 C ATOM 869 CE2 TYR A 57 -1.777 -0.545 -12.781 1.00 21.34 C ATOM 870 CZ TYR A 57 -0.878 0.138 -13.571 1.00 75.21 C ATOM 871 OH TYR A 57 0.466 -0.165 -13.495 1.00 74.11 O ATOM 0 H TYR A 57 -7.587 1.132 -14.315 1.00 11.22 H new ATOM 0 HA TYR A 57 -5.368 0.773 -15.990 1.00 53.44 H new ATOM 0 HB2 TYR A 57 -5.253 2.126 -13.952 1.00 45.22 H new ATOM 0 HB3 TYR A 57 -5.618 0.736 -12.949 1.00 45.22 H new ATOM 0 HD1 TYR A 57 -2.996 2.184 -15.207 1.00 42.51 H new ATOM 0 HD2 TYR A 57 -3.825 -0.796 -12.251 1.00 23.13 H new ATOM 0 HE1 TYR A 57 -0.609 1.640 -15.065 1.00 4.12 H new ATOM 0 HE2 TYR A 57 -1.430 -1.306 -12.097 1.00 21.34 H new ATOM 0 HH TYR A 57 0.605 -0.872 -12.831 1.00 74.11 H new ATOM 881 N CYS A 58 -6.222 -1.878 -14.159 1.00 14.31 N ATOM 882 CA CYS A 58 -6.110 -3.337 -14.025 1.00 60.35 C ATOM 883 C CYS A 58 -6.454 -4.035 -15.360 1.00 12.24 C ATOM 884 O CYS A 58 -5.828 -5.028 -15.710 1.00 33.42 O ATOM 885 CB CYS A 58 -7.008 -3.856 -12.879 1.00 11.33 C ATOM 886 SG CYS A 58 -6.525 -3.263 -11.241 1.00 74.54 S ATOM 0 H CYS A 58 -6.904 -1.459 -13.526 1.00 14.31 H new ATOM 0 HA CYS A 58 -5.077 -3.578 -13.774 1.00 60.35 H new ATOM 0 HB2 CYS A 58 -8.038 -3.556 -13.074 1.00 11.33 H new ATOM 0 HB3 CYS A 58 -6.988 -4.946 -12.880 1.00 11.33 H new ATOM 0 HG CYS A 58 -6.943 -2.042 -11.081 1.00 74.54 H new ATOM 892 N ARG A 59 -7.438 -3.480 -16.105 1.00 75.23 N ATOM 893 CA ARG A 59 -7.813 -3.986 -17.445 1.00 25.31 C ATOM 894 C ARG A 59 -6.662 -3.784 -18.452 1.00 74.34 C ATOM 895 O ARG A 59 -6.361 -4.687 -19.230 1.00 71.10 O ATOM 896 CB ARG A 59 -9.129 -3.319 -17.961 1.00 24.34 C ATOM 897 CG ARG A 59 -9.481 -3.650 -19.435 1.00 5.30 C ATOM 898 CD ARG A 59 -10.871 -3.143 -19.873 1.00 12.35 C ATOM 899 NE ARG A 59 -11.970 -4.015 -19.399 1.00 34.32 N ATOM 900 CZ ARG A 59 -13.246 -3.632 -19.208 1.00 33.13 C ATOM 901 NH1 ARG A 59 -13.618 -2.380 -19.433 1.00 41.24 N ATOM 902 NH2 ARG A 59 -14.146 -4.520 -18.825 1.00 23.12 N ATOM 0 H ARG A 59 -7.989 -2.678 -15.798 1.00 75.23 H new ATOM 0 HA ARG A 59 -8.000 -5.056 -17.352 1.00 25.31 H new ATOM 0 HB2 ARG A 59 -9.955 -3.634 -17.324 1.00 24.34 H new ATOM 0 HB3 ARG A 59 -9.039 -2.238 -17.856 1.00 24.34 H new ATOM 0 HG2 ARG A 59 -8.724 -3.214 -20.086 1.00 5.30 H new ATOM 0 HG3 ARG A 59 -9.438 -4.730 -19.575 1.00 5.30 H new ATOM 0 HD2 ARG A 59 -11.023 -2.133 -19.491 1.00 12.35 H new ATOM 0 HD3 ARG A 59 -10.905 -3.081 -20.961 1.00 12.35 H new ATOM 0 HE ARG A 59 -11.740 -4.989 -19.200 1.00 34.32 H new ATOM 0 HH11 ARG A 59 -12.934 -1.695 -19.755 1.00 41.24 H new ATOM 0 HH12 ARG A 59 -14.588 -2.102 -19.285 1.00 41.24 H new ATOM 0 HH21 ARG A 59 -13.873 -5.491 -18.675 1.00 23.12 H new ATOM 0 HH22 ARG A 59 -15.114 -4.234 -18.679 1.00 23.12 H new ATOM 916 N HIS A 60 -6.011 -2.608 -18.393 1.00 61.13 N ATOM 917 CA HIS A 60 -4.873 -2.262 -19.283 1.00 32.11 C ATOM 918 C HIS A 60 -3.682 -3.216 -19.055 1.00 11.22 C ATOM 919 O HIS A 60 -3.081 -3.724 -20.013 1.00 74.24 O ATOM 920 CB HIS A 60 -4.429 -0.789 -19.062 1.00 20.13 C ATOM 921 CG HIS A 60 -5.362 0.271 -19.611 1.00 11.24 C ATOM 922 ND1 HIS A 60 -4.934 1.534 -19.956 1.00 63.44 N ATOM 923 CD2 HIS A 60 -6.696 0.258 -19.861 1.00 13.44 C ATOM 924 CE1 HIS A 60 -5.960 2.241 -20.388 1.00 60.50 C ATOM 925 NE2 HIS A 60 -7.040 1.494 -20.343 1.00 14.44 N ATOM 0 H HIS A 60 -6.253 -1.870 -17.732 1.00 61.13 H new ATOM 0 HA HIS A 60 -5.211 -2.374 -20.313 1.00 32.11 H new ATOM 0 HB2 HIS A 60 -4.310 -0.622 -17.991 1.00 20.13 H new ATOM 0 HB3 HIS A 60 -3.448 -0.653 -19.517 1.00 20.13 H new ATOM 0 HD2 HIS A 60 -7.365 -0.576 -19.708 1.00 13.44 H new ATOM 0 HE1 HIS A 60 -5.919 3.267 -20.724 1.00 60.50 H new ATOM 0 HE2 HIS A 60 -7.977 1.785 -20.620 1.00 14.44 H new ATOM 934 N HIS A 61 -3.370 -3.461 -17.771 1.00 51.32 N ATOM 935 CA HIS A 61 -2.257 -4.343 -17.367 1.00 41.34 C ATOM 936 C HIS A 61 -2.664 -5.829 -17.496 1.00 72.00 C ATOM 937 O HIS A 61 -1.817 -6.714 -17.420 1.00 73.14 O ATOM 938 CB HIS A 61 -1.795 -4.013 -15.918 1.00 64.40 C ATOM 939 CG HIS A 61 -0.407 -4.518 -15.585 1.00 14.34 C ATOM 940 ND1 HIS A 61 -0.122 -5.849 -15.348 1.00 71.44 N ATOM 941 CD2 HIS A 61 0.783 -3.866 -15.495 1.00 10.21 C ATOM 942 CE1 HIS A 61 1.169 -5.993 -15.129 1.00 53.04 C ATOM 943 NE2 HIS A 61 1.741 -4.808 -15.213 1.00 24.02 N ATOM 0 H HIS A 61 -3.879 -3.056 -16.985 1.00 51.32 H new ATOM 0 HA HIS A 61 -1.416 -4.166 -18.037 1.00 41.34 H new ATOM 0 HB2 HIS A 61 -1.821 -2.933 -15.776 1.00 64.40 H new ATOM 0 HB3 HIS A 61 -2.506 -4.444 -15.214 1.00 64.40 H new ATOM 0 HD2 HIS A 61 0.944 -2.806 -15.622 1.00 10.21 H new ATOM 0 HE1 HIS A 61 1.673 -6.924 -14.917 1.00 53.04 H new ATOM 0 HE2 HIS A 61 2.736 -4.621 -15.088 1.00 24.02 H new ATOM 952 N HIS A 62 -3.974 -6.095 -17.642 1.00 41.24 N ATOM 953 CA HIS A 62 -4.482 -7.451 -17.929 1.00 74.54 C ATOM 954 C HIS A 62 -4.306 -7.764 -19.428 1.00 12.14 C ATOM 955 O HIS A 62 -3.998 -8.899 -19.796 1.00 64.34 O ATOM 956 CB HIS A 62 -5.968 -7.578 -17.517 1.00 64.34 C ATOM 957 CG HIS A 62 -6.481 -8.991 -17.497 1.00 30.45 C ATOM 958 ND1 HIS A 62 -6.407 -9.787 -16.377 1.00 53.14 N ATOM 959 CD2 HIS A 62 -7.056 -9.759 -18.458 1.00 51.11 C ATOM 960 CE1 HIS A 62 -6.904 -10.970 -16.645 1.00 23.03 C ATOM 961 NE2 HIS A 62 -7.305 -10.981 -17.897 1.00 24.13 N ATOM 0 H HIS A 62 -4.704 -5.387 -17.566 1.00 41.24 H new ATOM 0 HA HIS A 62 -3.910 -8.173 -17.346 1.00 74.54 H new ATOM 0 HB2 HIS A 62 -6.098 -7.142 -16.527 1.00 64.34 H new ATOM 0 HB3 HIS A 62 -6.576 -6.992 -18.206 1.00 64.34 H new ATOM 0 HD1 HIS A 62 -6.024 -9.500 -15.476 1.00 53.14 H new ATOM 0 HD2 HIS A 62 -7.275 -9.461 -19.473 1.00 51.11 H new ATOM 0 HE1 HIS A 62 -6.973 -11.797 -15.953 1.00 23.03 H new ATOM 0 HE2 HIS A 62 -7.733 -11.774 -18.374 1.00 24.13 H new ATOM 970 N GLN A 63 -4.517 -6.734 -20.276 1.00 63.12 N ATOM 971 CA GLN A 63 -4.321 -6.828 -21.742 1.00 54.01 C ATOM 972 C GLN A 63 -2.827 -6.877 -22.092 1.00 60.21 C ATOM 973 O GLN A 63 -2.443 -7.374 -23.158 1.00 72.31 O ATOM 974 CB GLN A 63 -5.003 -5.631 -22.471 1.00 25.54 C ATOM 975 CG GLN A 63 -6.534 -5.557 -22.287 1.00 52.31 C ATOM 976 CD GLN A 63 -7.279 -6.814 -22.756 1.00 2.45 C ATOM 977 OE1 GLN A 63 -6.878 -7.487 -23.705 1.00 25.10 O ATOM 978 NE2 GLN A 63 -8.361 -7.148 -22.085 1.00 30.52 N ATOM 0 H GLN A 63 -4.828 -5.814 -19.965 1.00 63.12 H new ATOM 0 HA GLN A 63 -4.788 -7.753 -22.081 1.00 54.01 H new ATOM 0 HB2 GLN A 63 -4.561 -4.702 -22.109 1.00 25.54 H new ATOM 0 HB3 GLN A 63 -4.781 -5.696 -23.536 1.00 25.54 H new ATOM 0 HG2 GLN A 63 -6.756 -5.387 -21.233 1.00 52.31 H new ATOM 0 HG3 GLN A 63 -6.915 -4.695 -22.835 1.00 52.31 H new ATOM 0 HE21 GLN A 63 -8.673 -6.574 -21.302 1.00 30.52 H new ATOM 0 HE22 GLN A 63 -8.887 -7.981 -22.348 1.00 30.52 H new ATOM 987 N HIS A 64 -1.990 -6.335 -21.184 1.00 62.44 N ATOM 988 CA HIS A 64 -0.521 -6.384 -21.285 1.00 11.41 C ATOM 989 C HIS A 64 0.047 -6.964 -19.967 1.00 22.12 C ATOM 990 O HIS A 64 0.590 -6.224 -19.130 1.00 74.32 O ATOM 991 CB HIS A 64 0.050 -4.965 -21.601 1.00 30.11 C ATOM 992 CG HIS A 64 -0.430 -4.393 -22.919 1.00 13.13 C ATOM 993 ND1 HIS A 64 0.242 -4.569 -24.106 1.00 2.22 N ATOM 994 CD2 HIS A 64 -1.542 -3.677 -23.231 1.00 50.13 C ATOM 995 CE1 HIS A 64 -0.426 -3.997 -25.080 1.00 21.23 C ATOM 996 NE2 HIS A 64 -1.512 -3.448 -24.583 1.00 12.04 N ATOM 0 H HIS A 64 -2.321 -5.846 -20.352 1.00 62.44 H new ATOM 0 HA HIS A 64 -0.218 -7.033 -22.107 1.00 11.41 H new ATOM 0 HB2 HIS A 64 -0.229 -4.284 -20.797 1.00 30.11 H new ATOM 0 HB3 HIS A 64 1.139 -5.016 -21.613 1.00 30.11 H new ATOM 0 HD2 HIS A 64 -2.307 -3.349 -22.543 1.00 50.13 H new ATOM 0 HE1 HIS A 64 -0.132 -3.980 -26.119 1.00 21.23 H new ATOM 0 HE2 HIS A 64 -2.216 -2.936 -25.115 1.00 12.04 H new ATOM 1005 N PRO A 65 -0.102 -8.321 -19.735 1.00 73.25 N ATOM 1006 CA PRO A 65 0.255 -8.973 -18.454 1.00 73.15 C ATOM 1007 C PRO A 65 1.720 -9.461 -18.402 1.00 54.11 C ATOM 1008 O PRO A 65 2.053 -10.343 -17.599 1.00 21.55 O ATOM 1009 CB PRO A 65 -0.743 -10.151 -18.424 1.00 24.23 C ATOM 1010 CG PRO A 65 -0.858 -10.587 -19.858 1.00 13.21 C ATOM 1011 CD PRO A 65 -0.626 -9.338 -20.706 1.00 30.54 C ATOM 0 HA PRO A 65 0.191 -8.300 -17.599 1.00 73.15 H new ATOM 0 HB2 PRO A 65 -0.381 -10.961 -17.791 1.00 24.23 H new ATOM 0 HB3 PRO A 65 -1.709 -9.842 -18.025 1.00 24.23 H new ATOM 0 HG2 PRO A 65 -0.122 -11.357 -20.090 1.00 13.21 H new ATOM 0 HG3 PRO A 65 -1.841 -11.015 -20.057 1.00 13.21 H new ATOM 0 HD2 PRO A 65 0.089 -9.528 -21.507 1.00 30.54 H new ATOM 0 HD3 PRO A 65 -1.549 -9.000 -21.176 1.00 30.54 H new ATOM 1019 N GLY A 66 2.591 -8.855 -19.233 1.00 50.25 N ATOM 1020 CA GLY A 66 4.008 -9.224 -19.301 1.00 31.03 C ATOM 1021 C GLY A 66 4.876 -8.505 -18.273 1.00 13.20 C ATOM 1022 O GLY A 66 6.034 -8.180 -18.560 1.00 72.51 O ATOM 0 H GLY A 66 2.329 -8.102 -19.869 1.00 50.25 H new ATOM 0 HA2 GLY A 66 4.102 -10.300 -19.155 1.00 31.03 H new ATOM 0 HA3 GLY A 66 4.385 -9.004 -20.300 1.00 31.03 H new ATOM 1026 N GLY A 67 4.320 -8.302 -17.056 1.00 14.22 N ATOM 1027 CA GLY A 67 5.000 -7.596 -15.970 1.00 72.52 C ATOM 1028 C GLY A 67 5.330 -6.144 -16.318 1.00 21.54 C ATOM 1029 O GLY A 67 4.481 -5.254 -16.179 1.00 42.44 O ATOM 0 H GLY A 67 3.385 -8.628 -16.809 1.00 14.22 H new ATOM 0 HA2 GLY A 67 4.371 -7.617 -15.080 1.00 72.52 H new ATOM 0 HA3 GLY A 67 5.921 -8.123 -15.722 1.00 72.52 H new ATOM 1033 N SER A 68 6.561 -5.923 -16.798 1.00 31.20 N ATOM 1034 CA SER A 68 7.061 -4.608 -17.237 1.00 73.23 C ATOM 1035 C SER A 68 7.826 -4.781 -18.561 1.00 21.43 C ATOM 1036 O SER A 68 8.646 -5.701 -18.692 1.00 3.54 O ATOM 1037 CB SER A 68 7.980 -3.988 -16.150 1.00 63.22 C ATOM 1038 OG SER A 68 7.281 -3.793 -14.926 1.00 64.30 O ATOM 0 H SER A 68 7.253 -6.666 -16.895 1.00 31.20 H new ATOM 0 HA SER A 68 6.221 -3.930 -17.391 1.00 73.23 H new ATOM 0 HB2 SER A 68 8.837 -4.640 -15.981 1.00 63.22 H new ATOM 0 HB3 SER A 68 8.371 -3.034 -16.503 1.00 63.22 H new ATOM 0 HG SER A 68 7.887 -3.403 -14.262 1.00 64.30 H new ATOM 1044 N GLY A 69 7.533 -3.919 -19.541 1.00 53.42 N ATOM 1045 CA GLY A 69 8.260 -3.890 -20.816 1.00 32.42 C ATOM 1046 C GLY A 69 8.976 -2.567 -20.997 1.00 52.13 C ATOM 1047 O GLY A 69 8.605 -1.578 -20.352 1.00 11.53 O ATOM 0 H GLY A 69 6.789 -3.225 -19.474 1.00 53.42 H new ATOM 0 HA2 GLY A 69 8.982 -4.706 -20.847 1.00 32.42 H new ATOM 0 HA3 GLY A 69 7.564 -4.048 -21.640 1.00 32.42 H new ATOM 1051 N LEU A 70 9.982 -2.529 -21.891 1.00 65.32 N ATOM 1052 CA LEU A 70 10.787 -1.322 -22.162 1.00 22.44 C ATOM 1053 C LEU A 70 10.064 -0.458 -23.240 1.00 73.03 C ATOM 1054 O LEU A 70 10.624 -0.082 -24.269 1.00 44.15 O ATOM 1055 CB LEU A 70 12.219 -1.772 -22.597 1.00 61.54 C ATOM 1056 CG LEU A 70 13.256 -0.644 -22.884 1.00 71.11 C ATOM 1057 CD1 LEU A 70 13.458 0.272 -21.656 1.00 52.21 C ATOM 1058 CD2 LEU A 70 14.597 -1.234 -23.385 1.00 40.41 C ATOM 0 H LEU A 70 10.261 -3.337 -22.448 1.00 65.32 H new ATOM 0 HA LEU A 70 10.892 -0.699 -21.274 1.00 22.44 H new ATOM 0 HB2 LEU A 70 12.625 -2.415 -21.816 1.00 61.54 H new ATOM 0 HB3 LEU A 70 12.125 -2.383 -23.495 1.00 61.54 H new ATOM 0 HG LEU A 70 12.852 -0.021 -23.682 1.00 71.11 H new ATOM 0 HD11 LEU A 70 14.188 1.046 -21.895 1.00 52.21 H new ATOM 0 HD12 LEU A 70 12.509 0.738 -21.390 1.00 52.21 H new ATOM 0 HD13 LEU A 70 13.820 -0.321 -20.816 1.00 52.21 H new ATOM 0 HD21 LEU A 70 15.301 -0.425 -23.577 1.00 40.41 H new ATOM 0 HD22 LEU A 70 15.008 -1.900 -22.626 1.00 40.41 H new ATOM 0 HD23 LEU A 70 14.427 -1.793 -24.305 1.00 40.41 H new ATOM 1070 N ASP A 71 8.783 -0.165 -22.970 1.00 34.34 N ATOM 1071 CA ASP A 71 7.901 0.609 -23.869 1.00 51.11 C ATOM 1072 C ASP A 71 6.691 1.134 -23.057 1.00 32.41 C ATOM 1073 O ASP A 71 5.656 1.533 -23.610 1.00 31.35 O ATOM 1074 CB ASP A 71 7.461 -0.297 -25.063 1.00 72.20 C ATOM 1075 CG ASP A 71 6.748 0.451 -26.202 1.00 14.23 C ATOM 1076 OD1 ASP A 71 7.380 1.335 -26.820 1.00 50.54 O ATOM 1077 OD2 ASP A 71 5.565 0.149 -26.493 1.00 44.24 O ATOM 0 H ASP A 71 8.320 -0.461 -22.111 1.00 34.34 H new ATOM 0 HA ASP A 71 8.426 1.470 -24.283 1.00 51.11 H new ATOM 0 HB2 ASP A 71 8.342 -0.796 -25.468 1.00 72.20 H new ATOM 0 HB3 ASP A 71 6.798 -1.076 -24.686 1.00 72.20 H new ATOM 1082 N ASP A 72 6.871 1.180 -21.719 1.00 71.34 N ATOM 1083 CA ASP A 72 5.812 1.523 -20.757 1.00 72.43 C ATOM 1084 C ASP A 72 5.719 3.058 -20.599 1.00 63.14 C ATOM 1085 O ASP A 72 6.172 3.795 -21.482 1.00 4.22 O ATOM 1086 CB ASP A 72 6.076 0.787 -19.406 1.00 3.33 C ATOM 1087 CG ASP A 72 7.324 1.291 -18.657 1.00 24.30 C ATOM 1088 OD1 ASP A 72 8.453 0.948 -19.066 1.00 21.34 O ATOM 1089 OD2 ASP A 72 7.179 2.040 -17.665 1.00 22.05 O ATOM 0 H ASP A 72 7.767 0.977 -21.276 1.00 71.34 H new ATOM 0 HA ASP A 72 4.843 1.186 -21.124 1.00 72.43 H new ATOM 0 HB2 ASP A 72 5.205 0.906 -18.762 1.00 3.33 H new ATOM 0 HB3 ASP A 72 6.186 -0.280 -19.600 1.00 3.33 H new ATOM 1094 N ILE A 73 5.131 3.521 -19.473 1.00 31.22 N ATOM 1095 CA ILE A 73 4.701 4.920 -19.266 1.00 14.14 C ATOM 1096 C ILE A 73 3.680 5.323 -20.372 1.00 15.14 C ATOM 1097 O ILE A 73 4.009 6.089 -21.295 1.00 12.03 O ATOM 1098 CB ILE A 73 5.915 5.945 -19.166 1.00 62.31 C ATOM 1099 CG1 ILE A 73 6.973 5.460 -18.113 1.00 11.12 C ATOM 1100 CG2 ILE A 73 5.421 7.382 -18.833 1.00 42.34 C ATOM 1101 CD1 ILE A 73 6.470 5.382 -16.675 1.00 14.24 C ATOM 0 H ILE A 73 4.939 2.922 -18.670 1.00 31.22 H new ATOM 0 HA ILE A 73 4.209 4.974 -18.295 1.00 14.14 H new ATOM 0 HB ILE A 73 6.397 5.980 -20.143 1.00 62.31 H new ATOM 0 HG12 ILE A 73 7.331 4.474 -18.410 1.00 11.12 H new ATOM 0 HG13 ILE A 73 7.829 6.134 -18.145 1.00 11.12 H new ATOM 0 HG21 ILE A 73 6.276 8.056 -18.772 1.00 42.34 H new ATOM 0 HG22 ILE A 73 4.744 7.724 -19.616 1.00 42.34 H new ATOM 0 HG23 ILE A 73 4.897 7.374 -17.877 1.00 42.34 H new ATOM 0 HD11 ILE A 73 7.275 5.037 -16.026 1.00 14.24 H new ATOM 0 HD12 ILE A 73 6.140 6.369 -16.351 1.00 14.24 H new ATOM 0 HD13 ILE A 73 5.635 4.684 -16.619 1.00 14.24 H new ATOM 1113 N PRO A 74 2.447 4.709 -20.360 1.00 41.24 N ATOM 1114 CA PRO A 74 1.351 5.117 -21.264 1.00 51.44 C ATOM 1115 C PRO A 74 0.842 6.543 -20.948 1.00 73.31 C ATOM 1116 O PRO A 74 0.933 6.990 -19.792 1.00 25.52 O ATOM 1117 CB PRO A 74 0.238 4.050 -21.005 1.00 43.45 C ATOM 1118 CG PRO A 74 0.952 2.906 -20.351 1.00 73.35 C ATOM 1119 CD PRO A 74 2.035 3.548 -19.517 1.00 21.14 C ATOM 0 HA PRO A 74 1.669 5.156 -22.306 1.00 51.44 H new ATOM 0 HB2 PRO A 74 -0.548 4.446 -20.362 1.00 43.45 H new ATOM 0 HB3 PRO A 74 -0.238 3.740 -21.936 1.00 43.45 H new ATOM 0 HG2 PRO A 74 0.273 2.319 -19.733 1.00 73.35 H new ATOM 0 HG3 PRO A 74 1.374 2.228 -21.093 1.00 73.35 H new ATOM 0 HD2 PRO A 74 1.662 3.866 -18.543 1.00 21.14 H new ATOM 0 HD3 PRO A 74 2.864 2.865 -19.334 1.00 21.14 H new ATOM 1127 N PRO A 75 0.286 7.274 -21.976 1.00 4.42 N ATOM 1128 CA PRO A 75 -0.377 8.588 -21.765 1.00 41.33 C ATOM 1129 C PRO A 75 -1.503 8.503 -20.713 1.00 42.11 C ATOM 1130 O PRO A 75 -1.747 9.463 -19.976 1.00 64.10 O ATOM 1131 CB PRO A 75 -0.930 8.941 -23.172 1.00 70.14 C ATOM 1132 CG PRO A 75 -0.051 8.186 -24.128 1.00 23.24 C ATOM 1133 CD PRO A 75 0.291 6.894 -23.422 1.00 2.32 C ATOM 0 HA PRO A 75 0.304 9.345 -21.375 1.00 41.33 H new ATOM 0 HB2 PRO A 75 -1.973 8.643 -23.274 1.00 70.14 H new ATOM 0 HB3 PRO A 75 -0.886 10.014 -23.357 1.00 70.14 H new ATOM 0 HG2 PRO A 75 -0.567 7.995 -25.069 1.00 23.24 H new ATOM 0 HG3 PRO A 75 0.848 8.753 -24.367 1.00 23.24 H new ATOM 0 HD2 PRO A 75 -0.441 6.115 -23.635 1.00 2.32 H new ATOM 0 HD3 PRO A 75 1.263 6.512 -23.733 1.00 2.32 H new ATOM 1141 N TYR A 76 -2.144 7.313 -20.642 1.00 33.11 N ATOM 1142 CA TYR A 76 -3.176 6.997 -19.639 1.00 1.12 C ATOM 1143 C TYR A 76 -2.658 7.184 -18.199 1.00 65.43 C ATOM 1144 O TYR A 76 -3.325 7.822 -17.390 1.00 15.21 O ATOM 1145 CB TYR A 76 -3.696 5.545 -19.815 1.00 34.31 C ATOM 1146 CG TYR A 76 -4.604 5.076 -18.659 1.00 10.01 C ATOM 1147 CD1 TYR A 76 -5.885 5.603 -18.492 1.00 72.53 C ATOM 1148 CD2 TYR A 76 -4.164 4.136 -17.718 1.00 3.02 C ATOM 1149 CE1 TYR A 76 -6.683 5.213 -17.437 1.00 31.40 C ATOM 1150 CE2 TYR A 76 -4.963 3.742 -16.667 1.00 23.01 C ATOM 1151 CZ TYR A 76 -6.224 4.284 -16.531 1.00 20.12 C ATOM 1152 OH TYR A 76 -7.026 3.903 -15.480 1.00 60.44 O ATOM 0 H TYR A 76 -1.955 6.544 -21.285 1.00 33.11 H new ATOM 0 HA TYR A 76 -3.995 7.697 -19.802 1.00 1.12 H new ATOM 0 HB2 TYR A 76 -4.248 5.476 -20.752 1.00 34.31 H new ATOM 0 HB3 TYR A 76 -2.845 4.869 -19.896 1.00 34.31 H new ATOM 0 HD1 TYR A 76 -6.258 6.328 -19.200 1.00 72.53 H new ATOM 0 HD2 TYR A 76 -3.176 3.711 -17.819 1.00 3.02 H new ATOM 0 HE1 TYR A 76 -7.670 5.637 -17.322 1.00 31.40 H new ATOM 0 HE2 TYR A 76 -4.604 3.014 -15.955 1.00 23.01 H new ATOM 0 HH TYR A 76 -7.878 4.385 -15.527 1.00 60.44 H new ATOM 1162 N ASP A 77 -1.495 6.581 -17.893 1.00 71.35 N ATOM 1163 CA ASP A 77 -0.893 6.594 -16.539 1.00 45.20 C ATOM 1164 C ASP A 77 -0.554 8.019 -16.096 1.00 2.14 C ATOM 1165 O ASP A 77 -0.648 8.346 -14.907 1.00 24.42 O ATOM 1166 CB ASP A 77 0.368 5.691 -16.498 1.00 40.32 C ATOM 1167 CG ASP A 77 0.051 4.185 -16.632 1.00 41.14 C ATOM 1168 OD1 ASP A 77 0.639 3.367 -15.887 1.00 12.33 O ATOM 1169 OD2 ASP A 77 -0.778 3.813 -17.494 1.00 14.12 O ATOM 0 H ASP A 77 -0.941 6.068 -18.578 1.00 71.35 H new ATOM 0 HA ASP A 77 -1.628 6.196 -15.839 1.00 45.20 H new ATOM 0 HB2 ASP A 77 1.042 5.985 -17.302 1.00 40.32 H new ATOM 0 HB3 ASP A 77 0.897 5.861 -15.560 1.00 40.32 H new ATOM 1174 N ARG A 78 -0.180 8.866 -17.071 1.00 63.24 N ATOM 1175 CA ARG A 78 0.054 10.304 -16.836 1.00 2.51 C ATOM 1176 C ARG A 78 -1.263 10.992 -16.440 1.00 1.11 C ATOM 1177 O ARG A 78 -1.307 11.751 -15.464 1.00 62.11 O ATOM 1178 CB ARG A 78 0.651 10.968 -18.100 1.00 73.54 C ATOM 1179 CG ARG A 78 1.976 10.345 -18.591 1.00 14.12 C ATOM 1180 CD ARG A 78 3.106 10.406 -17.543 1.00 22.01 C ATOM 1181 NE ARG A 78 3.354 11.784 -17.081 1.00 34.21 N ATOM 1182 CZ ARG A 78 4.136 12.132 -16.037 1.00 61.54 C ATOM 1183 NH1 ARG A 78 4.775 11.220 -15.318 1.00 45.24 N ATOM 1184 NH2 ARG A 78 4.259 13.405 -15.706 1.00 11.41 N ATOM 0 H ARG A 78 -0.032 8.577 -18.038 1.00 63.24 H new ATOM 0 HA ARG A 78 0.768 10.415 -16.020 1.00 2.51 H new ATOM 0 HB2 ARG A 78 -0.082 10.911 -18.905 1.00 73.54 H new ATOM 0 HB3 ARG A 78 0.817 12.026 -17.895 1.00 73.54 H new ATOM 0 HG2 ARG A 78 1.800 9.305 -18.865 1.00 14.12 H new ATOM 0 HG3 ARG A 78 2.300 10.862 -19.494 1.00 14.12 H new ATOM 0 HD2 ARG A 78 2.845 9.779 -16.691 1.00 22.01 H new ATOM 0 HD3 ARG A 78 4.021 9.997 -17.971 1.00 22.01 H new ATOM 0 HE ARG A 78 2.896 12.538 -17.593 1.00 34.21 H new ATOM 0 HH11 ARG A 78 4.681 10.231 -15.549 1.00 45.24 H new ATOM 0 HH12 ARG A 78 5.360 11.507 -14.534 1.00 45.24 H new ATOM 0 HH21 ARG A 78 3.764 14.121 -16.238 1.00 11.41 H new ATOM 0 HH22 ARG A 78 4.849 13.672 -14.918 1.00 11.41 H new ATOM 1198 N ASP A 79 -2.332 10.688 -17.198 1.00 12.23 N ATOM 1199 CA ASP A 79 -3.685 11.219 -16.934 1.00 44.01 C ATOM 1200 C ASP A 79 -4.295 10.634 -15.645 1.00 72.42 C ATOM 1201 O ASP A 79 -5.158 11.263 -15.031 1.00 32.41 O ATOM 1202 CB ASP A 79 -4.624 10.983 -18.148 1.00 20.31 C ATOM 1203 CG ASP A 79 -4.330 11.943 -19.320 1.00 1.01 C ATOM 1204 OD1 ASP A 79 -3.594 11.570 -20.255 1.00 52.41 O ATOM 1205 OD2 ASP A 79 -4.814 13.098 -19.293 1.00 71.14 O ATOM 0 H ASP A 79 -2.285 10.070 -18.008 1.00 12.23 H new ATOM 0 HA ASP A 79 -3.583 12.294 -16.784 1.00 44.01 H new ATOM 0 HB2 ASP A 79 -4.517 9.954 -18.491 1.00 20.31 H new ATOM 0 HB3 ASP A 79 -5.660 11.108 -17.832 1.00 20.31 H new ATOM 1210 N PHE A 80 -3.832 9.440 -15.244 1.00 65.43 N ATOM 1211 CA PHE A 80 -4.242 8.783 -13.986 1.00 22.34 C ATOM 1212 C PHE A 80 -3.661 9.568 -12.796 1.00 31.20 C ATOM 1213 O PHE A 80 -4.321 9.749 -11.764 1.00 32.42 O ATOM 1214 CB PHE A 80 -3.761 7.299 -13.975 1.00 44.40 C ATOM 1215 CG PHE A 80 -4.231 6.472 -12.772 1.00 35.34 C ATOM 1216 CD1 PHE A 80 -5.429 5.761 -12.820 1.00 41.42 C ATOM 1217 CD2 PHE A 80 -3.479 6.411 -11.594 1.00 2.44 C ATOM 1218 CE1 PHE A 80 -5.857 5.023 -11.734 1.00 44.52 C ATOM 1219 CE2 PHE A 80 -3.912 5.672 -10.512 1.00 51.13 C ATOM 1220 CZ PHE A 80 -5.104 4.980 -10.582 1.00 20.43 C ATOM 0 H PHE A 80 -3.158 8.897 -15.784 1.00 65.43 H new ATOM 0 HA PHE A 80 -5.329 8.779 -13.905 1.00 22.34 H new ATOM 0 HB2 PHE A 80 -4.108 6.814 -14.887 1.00 44.40 H new ATOM 0 HB3 PHE A 80 -2.671 7.286 -14.002 1.00 44.40 H new ATOM 0 HD1 PHE A 80 -6.030 5.788 -13.717 1.00 41.42 H new ATOM 0 HD2 PHE A 80 -2.546 6.950 -11.530 1.00 2.44 H new ATOM 0 HE1 PHE A 80 -6.787 4.477 -11.789 1.00 44.52 H new ATOM 0 HE2 PHE A 80 -3.318 5.635 -9.611 1.00 51.13 H new ATOM 0 HZ PHE A 80 -5.446 4.405 -9.734 1.00 20.43 H new ATOM 1230 N CYS A 81 -2.411 10.044 -12.987 1.00 34.11 N ATOM 1231 CA CYS A 81 -1.692 10.870 -12.010 1.00 24.05 C ATOM 1232 C CYS A 81 -2.286 12.294 -11.932 1.00 33.43 C ATOM 1233 O CYS A 81 -2.131 12.965 -10.908 1.00 71.24 O ATOM 1234 CB CYS A 81 -0.199 10.923 -12.391 1.00 25.32 C ATOM 1235 SG CYS A 81 0.584 9.297 -12.490 1.00 3.44 S ATOM 0 H CYS A 81 -1.873 9.860 -13.834 1.00 34.11 H new ATOM 0 HA CYS A 81 -1.800 10.420 -11.023 1.00 24.05 H new ATOM 0 HB2 CYS A 81 -0.096 11.425 -13.353 1.00 25.32 H new ATOM 0 HB3 CYS A 81 0.333 11.528 -11.657 1.00 25.32 H new ATOM 0 HG CYS A 81 0.304 8.750 -13.636 1.00 3.44 H new ATOM 1241 N LYS A 82 -2.956 12.744 -13.024 1.00 34.23 N ATOM 1242 CA LYS A 82 -3.651 14.048 -13.064 1.00 44.20 C ATOM 1243 C LYS A 82 -4.964 13.974 -12.257 1.00 63.12 C ATOM 1244 O LYS A 82 -6.055 13.828 -12.826 1.00 33.21 O ATOM 1245 CB LYS A 82 -3.953 14.481 -14.527 1.00 71.35 C ATOM 1246 CG LYS A 82 -2.717 14.661 -15.426 1.00 71.01 C ATOM 1247 CD LYS A 82 -3.099 14.925 -16.902 1.00 44.41 C ATOM 1248 CE LYS A 82 -1.907 14.780 -17.867 1.00 12.22 C ATOM 1249 NZ LYS A 82 -2.337 14.880 -19.288 1.00 35.30 N ATOM 0 H LYS A 82 -3.027 12.215 -13.893 1.00 34.23 H new ATOM 0 HA LYS A 82 -2.993 14.794 -12.617 1.00 44.20 H new ATOM 0 HB2 LYS A 82 -4.607 13.737 -14.981 1.00 71.35 H new ATOM 0 HB3 LYS A 82 -4.506 15.420 -14.504 1.00 71.35 H new ATOM 0 HG2 LYS A 82 -2.117 15.492 -15.054 1.00 71.01 H new ATOM 0 HG3 LYS A 82 -2.095 13.768 -15.368 1.00 71.01 H new ATOM 0 HD2 LYS A 82 -3.885 14.231 -17.198 1.00 44.41 H new ATOM 0 HD3 LYS A 82 -3.511 15.930 -16.991 1.00 44.41 H new ATOM 0 HE2 LYS A 82 -1.170 15.554 -17.654 1.00 12.22 H new ATOM 0 HE3 LYS A 82 -1.418 13.820 -17.701 1.00 12.22 H new ATOM 0 HZ1 LYS A 82 -1.590 14.500 -19.904 1.00 35.30 H new ATOM 0 HZ2 LYS A 82 -3.211 14.334 -19.425 1.00 35.30 H new ATOM 0 HZ3 LYS A 82 -2.510 15.877 -19.529 1.00 35.30 H new ATOM 1263 N VAL A 83 -4.829 14.016 -10.929 1.00 54.35 N ATOM 1264 CA VAL A 83 -5.945 14.050 -9.971 1.00 22.21 C ATOM 1265 C VAL A 83 -5.552 14.975 -8.809 1.00 41.05 C ATOM 1266 O VAL A 83 -4.357 15.181 -8.548 1.00 72.32 O ATOM 1267 CB VAL A 83 -6.315 12.613 -9.423 1.00 2.40 C ATOM 1268 CG1 VAL A 83 -6.958 11.715 -10.509 1.00 42.33 C ATOM 1269 CG2 VAL A 83 -5.093 11.915 -8.789 1.00 33.43 C ATOM 0 H VAL A 83 -3.916 14.028 -10.474 1.00 54.35 H new ATOM 0 HA VAL A 83 -6.831 14.424 -10.484 1.00 22.21 H new ATOM 0 HB VAL A 83 -7.062 12.764 -8.644 1.00 2.40 H new ATOM 0 HG11 VAL A 83 -7.193 10.740 -10.082 1.00 42.33 H new ATOM 0 HG12 VAL A 83 -7.873 12.182 -10.873 1.00 42.33 H new ATOM 0 HG13 VAL A 83 -6.261 11.590 -11.337 1.00 42.33 H new ATOM 0 HG21 VAL A 83 -5.385 10.931 -8.424 1.00 33.43 H new ATOM 0 HG22 VAL A 83 -4.308 11.806 -9.537 1.00 33.43 H new ATOM 0 HG23 VAL A 83 -4.722 12.515 -7.958 1.00 33.43 H new ATOM 1279 N ASP A 84 -6.552 15.516 -8.107 1.00 55.13 N ATOM 1280 CA ASP A 84 -6.340 16.493 -7.017 1.00 40.43 C ATOM 1281 C ASP A 84 -5.676 15.792 -5.802 1.00 20.20 C ATOM 1282 O ASP A 84 -5.676 14.560 -5.730 1.00 70.31 O ATOM 1283 CB ASP A 84 -7.702 17.151 -6.642 1.00 1.52 C ATOM 1284 CG ASP A 84 -7.558 18.577 -6.083 1.00 63.31 C ATOM 1285 OD1 ASP A 84 -7.915 18.831 -4.921 1.00 42.43 O ATOM 1286 OD2 ASP A 84 -7.074 19.455 -6.825 1.00 40.21 O ATOM 0 H ASP A 84 -7.534 15.294 -8.273 1.00 55.13 H new ATOM 0 HA ASP A 84 -5.665 17.283 -7.345 1.00 40.43 H new ATOM 0 HB2 ASP A 84 -8.340 17.178 -7.526 1.00 1.52 H new ATOM 0 HB3 ASP A 84 -8.207 16.528 -5.903 1.00 1.52 H new ATOM 1291 N GLN A 85 -5.118 16.582 -4.860 1.00 71.34 N ATOM 1292 CA GLN A 85 -4.380 16.048 -3.677 1.00 42.13 C ATOM 1293 C GLN A 85 -5.240 15.063 -2.816 1.00 42.14 C ATOM 1294 O GLN A 85 -4.755 13.967 -2.507 1.00 65.22 O ATOM 1295 CB GLN A 85 -3.783 17.202 -2.809 1.00 53.12 C ATOM 1296 CG GLN A 85 -2.958 16.746 -1.580 1.00 42.53 C ATOM 1297 CD GLN A 85 -1.752 15.857 -1.926 1.00 64.52 C ATOM 1298 OE1 GLN A 85 -0.663 16.353 -2.190 1.00 42.24 O ATOM 1299 NE2 GLN A 85 -1.940 14.543 -1.914 1.00 43.53 N ATOM 0 H GLN A 85 -5.161 17.601 -4.890 1.00 71.34 H new ATOM 0 HA GLN A 85 -3.549 15.462 -4.070 1.00 42.13 H new ATOM 0 HB2 GLN A 85 -3.148 17.820 -3.443 1.00 53.12 H new ATOM 0 HB3 GLN A 85 -4.600 17.835 -2.463 1.00 53.12 H new ATOM 0 HG2 GLN A 85 -2.604 17.628 -1.046 1.00 42.53 H new ATOM 0 HG3 GLN A 85 -3.612 16.202 -0.898 1.00 42.53 H new ATOM 0 HE21 GLN A 85 -2.859 14.161 -1.690 1.00 43.53 H new ATOM 0 HE22 GLN A 85 -1.165 13.915 -2.129 1.00 43.53 H new ATOM 1308 N PRO A 86 -6.526 15.395 -2.425 1.00 44.23 N ATOM 1309 CA PRO A 86 -7.421 14.413 -1.740 1.00 61.23 C ATOM 1310 C PRO A 86 -7.683 13.147 -2.594 1.00 42.30 C ATOM 1311 O PRO A 86 -7.762 12.034 -2.059 1.00 2.51 O ATOM 1312 CB PRO A 86 -8.736 15.213 -1.506 1.00 61.42 C ATOM 1313 CG PRO A 86 -8.666 16.363 -2.466 1.00 32.53 C ATOM 1314 CD PRO A 86 -7.205 16.717 -2.554 1.00 62.24 C ATOM 0 HA PRO A 86 -6.976 14.034 -0.820 1.00 61.23 H new ATOM 0 HB2 PRO A 86 -9.613 14.594 -1.694 1.00 61.42 H new ATOM 0 HB3 PRO A 86 -8.808 15.562 -0.476 1.00 61.42 H new ATOM 0 HG2 PRO A 86 -9.063 16.085 -3.442 1.00 32.53 H new ATOM 0 HG3 PRO A 86 -9.255 17.209 -2.111 1.00 32.53 H new ATOM 0 HD2 PRO A 86 -6.965 17.203 -3.500 1.00 62.24 H new ATOM 0 HD3 PRO A 86 -6.908 17.402 -1.760 1.00 62.24 H new ATOM 1322 N THR A 87 -7.772 13.339 -3.921 1.00 74.10 N ATOM 1323 CA THR A 87 -8.066 12.265 -4.885 1.00 60.04 C ATOM 1324 C THR A 87 -6.878 11.269 -5.001 1.00 13.13 C ATOM 1325 O THR A 87 -7.086 10.079 -5.263 1.00 64.02 O ATOM 1326 CB THR A 87 -8.423 12.887 -6.274 1.00 54.04 C ATOM 1327 OG1 THR A 87 -9.286 14.024 -6.086 1.00 54.30 O ATOM 1328 CG2 THR A 87 -9.122 11.896 -7.216 1.00 73.31 C ATOM 0 H THR A 87 -7.641 14.251 -4.358 1.00 74.10 H new ATOM 0 HA THR A 87 -8.924 11.697 -4.525 1.00 60.04 H new ATOM 0 HB THR A 87 -7.480 13.176 -6.737 1.00 54.04 H new ATOM 0 HG1 THR A 87 -9.508 14.414 -6.957 1.00 54.30 H new ATOM 0 HG21 THR A 87 -9.343 12.388 -8.163 1.00 73.31 H new ATOM 0 HG22 THR A 87 -8.469 11.042 -7.395 1.00 73.31 H new ATOM 0 HG23 THR A 87 -10.051 11.553 -6.760 1.00 73.31 H new ATOM 1336 N LEU A 88 -5.643 11.779 -4.784 1.00 52.41 N ATOM 1337 CA LEU A 88 -4.415 10.949 -4.674 1.00 70.31 C ATOM 1338 C LEU A 88 -4.550 9.950 -3.504 1.00 3.44 C ATOM 1339 O LEU A 88 -4.280 8.756 -3.663 1.00 11.23 O ATOM 1340 CB LEU A 88 -3.167 11.861 -4.463 1.00 73.43 C ATOM 1341 CG LEU A 88 -2.717 12.712 -5.692 1.00 31.35 C ATOM 1342 CD1 LEU A 88 -1.679 13.783 -5.281 1.00 10.40 C ATOM 1343 CD2 LEU A 88 -2.160 11.804 -6.818 1.00 24.14 C ATOM 0 H LEU A 88 -5.467 12.778 -4.680 1.00 52.41 H new ATOM 0 HA LEU A 88 -4.286 10.388 -5.600 1.00 70.31 H new ATOM 0 HB2 LEU A 88 -3.375 12.539 -3.635 1.00 73.43 H new ATOM 0 HB3 LEU A 88 -2.331 11.232 -4.158 1.00 73.43 H new ATOM 0 HG LEU A 88 -3.594 13.231 -6.078 1.00 31.35 H new ATOM 0 HD11 LEU A 88 -1.385 14.360 -6.158 1.00 10.40 H new ATOM 0 HD12 LEU A 88 -2.118 14.450 -4.539 1.00 10.40 H new ATOM 0 HD13 LEU A 88 -0.802 13.295 -4.856 1.00 10.40 H new ATOM 0 HD21 LEU A 88 -1.853 12.420 -7.663 1.00 24.14 H new ATOM 0 HD22 LEU A 88 -1.301 11.246 -6.444 1.00 24.14 H new ATOM 0 HD23 LEU A 88 -2.934 11.106 -7.139 1.00 24.14 H new ATOM 1355 N PHE A 89 -5.000 10.468 -2.344 1.00 41.54 N ATOM 1356 CA PHE A 89 -5.232 9.661 -1.124 1.00 2.45 C ATOM 1357 C PHE A 89 -6.381 8.648 -1.323 1.00 74.32 C ATOM 1358 O PHE A 89 -6.383 7.586 -0.698 1.00 52.40 O ATOM 1359 CB PHE A 89 -5.515 10.578 0.096 1.00 64.32 C ATOM 1360 CG PHE A 89 -4.322 11.444 0.540 1.00 15.23 C ATOM 1361 CD1 PHE A 89 -3.147 10.854 1.019 1.00 63.31 C ATOM 1362 CD2 PHE A 89 -4.385 12.840 0.514 1.00 70.30 C ATOM 1363 CE1 PHE A 89 -2.083 11.631 1.454 1.00 50.22 C ATOM 1364 CE2 PHE A 89 -3.318 13.612 0.944 1.00 70.45 C ATOM 1365 CZ PHE A 89 -2.170 13.008 1.416 1.00 62.50 C ATOM 0 H PHE A 89 -5.214 11.458 -2.224 1.00 41.54 H new ATOM 0 HA PHE A 89 -4.322 9.094 -0.927 1.00 2.45 H new ATOM 0 HB2 PHE A 89 -6.352 11.233 -0.145 1.00 64.32 H new ATOM 0 HB3 PHE A 89 -5.828 9.957 0.935 1.00 64.32 H new ATOM 0 HD1 PHE A 89 -3.067 9.777 1.051 1.00 63.31 H new ATOM 0 HD2 PHE A 89 -5.280 13.325 0.153 1.00 70.30 H new ATOM 0 HE1 PHE A 89 -1.185 11.158 1.823 1.00 50.22 H new ATOM 0 HE2 PHE A 89 -3.385 14.689 0.910 1.00 70.45 H new ATOM 0 HZ PHE A 89 -1.341 13.612 1.755 1.00 62.50 H new ATOM 1375 N GLU A 90 -7.355 9.004 -2.180 1.00 11.22 N ATOM 1376 CA GLU A 90 -8.463 8.104 -2.579 1.00 11.13 C ATOM 1377 C GLU A 90 -7.952 6.905 -3.398 1.00 12.54 C ATOM 1378 O GLU A 90 -8.477 5.796 -3.269 1.00 61.14 O ATOM 1379 CB GLU A 90 -9.531 8.883 -3.387 1.00 4.04 C ATOM 1380 CG GLU A 90 -10.301 9.935 -2.573 1.00 32.11 C ATOM 1381 CD GLU A 90 -11.151 9.316 -1.452 1.00 64.13 C ATOM 1382 OE1 GLU A 90 -12.249 8.786 -1.758 1.00 12.30 O ATOM 1383 OE2 GLU A 90 -10.736 9.353 -0.268 1.00 34.32 O ATOM 0 H GLU A 90 -7.400 9.924 -2.618 1.00 11.22 H new ATOM 0 HA GLU A 90 -8.917 7.719 -1.666 1.00 11.13 H new ATOM 0 HB2 GLU A 90 -9.044 9.377 -4.228 1.00 4.04 H new ATOM 0 HB3 GLU A 90 -10.243 8.172 -3.805 1.00 4.04 H new ATOM 0 HG2 GLU A 90 -9.593 10.641 -2.138 1.00 32.11 H new ATOM 0 HG3 GLU A 90 -10.948 10.503 -3.242 1.00 32.11 H new ATOM 1390 N LEU A 91 -6.941 7.154 -4.256 1.00 65.34 N ATOM 1391 CA LEU A 91 -6.277 6.096 -5.050 1.00 3.30 C ATOM 1392 C LEU A 91 -5.476 5.150 -4.128 1.00 54.20 C ATOM 1393 O LEU A 91 -5.426 3.938 -4.365 1.00 64.14 O ATOM 1394 CB LEU A 91 -5.343 6.720 -6.127 1.00 70.24 C ATOM 1395 CG LEU A 91 -6.029 7.631 -7.197 1.00 64.25 C ATOM 1396 CD1 LEU A 91 -4.978 8.270 -8.137 1.00 35.52 C ATOM 1397 CD2 LEU A 91 -7.103 6.850 -7.996 1.00 44.22 C ATOM 0 H LEU A 91 -6.563 8.087 -4.418 1.00 65.34 H new ATOM 0 HA LEU A 91 -7.048 5.517 -5.558 1.00 3.30 H new ATOM 0 HB2 LEU A 91 -4.578 7.307 -5.618 1.00 70.24 H new ATOM 0 HB3 LEU A 91 -4.830 5.910 -6.646 1.00 70.24 H new ATOM 0 HG LEU A 91 -6.538 8.439 -6.671 1.00 64.25 H new ATOM 0 HD11 LEU A 91 -5.481 8.899 -8.872 1.00 35.52 H new ATOM 0 HD12 LEU A 91 -4.288 8.878 -7.552 1.00 35.52 H new ATOM 0 HD13 LEU A 91 -4.424 7.484 -8.651 1.00 35.52 H new ATOM 0 HD21 LEU A 91 -7.561 7.511 -8.732 1.00 44.22 H new ATOM 0 HD22 LEU A 91 -6.636 6.008 -8.506 1.00 44.22 H new ATOM 0 HD23 LEU A 91 -7.868 6.481 -7.313 1.00 44.22 H new ATOM 1409 N ILE A 92 -4.867 5.733 -3.075 1.00 2.12 N ATOM 1410 CA ILE A 92 -4.132 4.982 -2.034 1.00 2.54 C ATOM 1411 C ILE A 92 -5.118 4.117 -1.211 1.00 52.40 C ATOM 1412 O ILE A 92 -4.834 2.946 -0.922 1.00 73.41 O ATOM 1413 CB ILE A 92 -3.311 5.959 -1.093 1.00 0.50 C ATOM 1414 CG1 ILE A 92 -2.301 6.806 -1.942 1.00 70.32 C ATOM 1415 CG2 ILE A 92 -2.575 5.187 0.039 1.00 33.05 C ATOM 1416 CD1 ILE A 92 -1.560 7.887 -1.171 1.00 60.24 C ATOM 0 H ILE A 92 -4.871 6.741 -2.921 1.00 2.12 H new ATOM 0 HA ILE A 92 -3.415 4.324 -2.524 1.00 2.54 H new ATOM 0 HB ILE A 92 -4.019 6.635 -0.612 1.00 0.50 H new ATOM 0 HG12 ILE A 92 -1.569 6.132 -2.387 1.00 70.32 H new ATOM 0 HG13 ILE A 92 -2.844 7.274 -2.763 1.00 70.32 H new ATOM 0 HG21 ILE A 92 -2.024 5.892 0.662 1.00 33.05 H new ATOM 0 HG22 ILE A 92 -3.304 4.656 0.651 1.00 33.05 H new ATOM 0 HG23 ILE A 92 -1.880 4.472 -0.401 1.00 33.05 H new ATOM 0 HD11 ILE A 92 -0.886 8.417 -1.844 1.00 60.24 H new ATOM 0 HD12 ILE A 92 -2.278 8.590 -0.749 1.00 60.24 H new ATOM 0 HD13 ILE A 92 -0.984 7.430 -0.366 1.00 60.24 H new ATOM 1428 N LEU A 93 -6.295 4.703 -0.877 1.00 54.31 N ATOM 1429 CA LEU A 93 -7.372 4.003 -0.137 1.00 62.32 C ATOM 1430 C LEU A 93 -7.909 2.816 -0.952 1.00 34.11 C ATOM 1431 O LEU A 93 -8.010 1.713 -0.432 1.00 72.04 O ATOM 1432 CB LEU A 93 -8.557 4.969 0.244 1.00 54.44 C ATOM 1433 CG LEU A 93 -8.461 5.689 1.636 1.00 61.03 C ATOM 1434 CD1 LEU A 93 -9.713 6.573 1.890 1.00 73.34 C ATOM 1435 CD2 LEU A 93 -8.267 4.662 2.786 1.00 52.54 C ATOM 0 H LEU A 93 -6.522 5.669 -1.112 1.00 54.31 H new ATOM 0 HA LEU A 93 -6.931 3.635 0.789 1.00 62.32 H new ATOM 0 HB2 LEU A 93 -8.635 5.733 -0.529 1.00 54.44 H new ATOM 0 HB3 LEU A 93 -9.484 4.396 0.221 1.00 54.44 H new ATOM 0 HG LEU A 93 -7.586 6.338 1.616 1.00 61.03 H new ATOM 0 HD11 LEU A 93 -9.623 7.061 2.860 1.00 73.34 H new ATOM 0 HD12 LEU A 93 -9.789 7.329 1.109 1.00 73.34 H new ATOM 0 HD13 LEU A 93 -10.607 5.949 1.879 1.00 73.34 H new ATOM 0 HD21 LEU A 93 -8.204 5.189 3.738 1.00 52.54 H new ATOM 0 HD22 LEU A 93 -9.113 3.975 2.807 1.00 52.54 H new ATOM 0 HD23 LEU A 93 -7.348 4.100 2.621 1.00 52.54 H new ATOM 1447 N ALA A 94 -8.214 3.065 -2.237 1.00 64.34 N ATOM 1448 CA ALA A 94 -8.832 2.069 -3.133 1.00 71.24 C ATOM 1449 C ALA A 94 -7.883 0.899 -3.399 1.00 3.53 C ATOM 1450 O ALA A 94 -8.294 -0.249 -3.376 1.00 72.11 O ATOM 1451 CB ALA A 94 -9.249 2.726 -4.452 1.00 12.24 C ATOM 0 H ALA A 94 -8.039 3.964 -2.686 1.00 64.34 H new ATOM 0 HA ALA A 94 -9.720 1.676 -2.638 1.00 71.24 H new ATOM 0 HB1 ALA A 94 -9.703 1.979 -5.103 1.00 12.24 H new ATOM 0 HB2 ALA A 94 -9.969 3.519 -4.252 1.00 12.24 H new ATOM 0 HB3 ALA A 94 -8.371 3.148 -4.942 1.00 12.24 H new ATOM 1457 N ALA A 95 -6.608 1.218 -3.635 1.00 62.10 N ATOM 1458 CA ALA A 95 -5.568 0.216 -3.911 1.00 55.53 C ATOM 1459 C ALA A 95 -5.313 -0.690 -2.689 1.00 41.12 C ATOM 1460 O ALA A 95 -5.159 -1.896 -2.837 1.00 75.13 O ATOM 1461 CB ALA A 95 -4.283 0.911 -4.347 1.00 54.14 C ATOM 0 H ALA A 95 -6.264 2.178 -3.641 1.00 62.10 H new ATOM 0 HA ALA A 95 -5.919 -0.425 -4.720 1.00 55.53 H new ATOM 0 HB1 ALA A 95 -3.516 0.164 -4.550 1.00 54.14 H new ATOM 0 HB2 ALA A 95 -4.472 1.492 -5.250 1.00 54.14 H new ATOM 0 HB3 ALA A 95 -3.941 1.575 -3.553 1.00 54.14 H new ATOM 1467 N ASN A 96 -5.280 -0.088 -1.486 1.00 22.34 N ATOM 1468 CA ASN A 96 -5.062 -0.827 -0.212 1.00 1.52 C ATOM 1469 C ASN A 96 -6.335 -1.627 0.186 1.00 2.11 C ATOM 1470 O ASN A 96 -6.246 -2.719 0.764 1.00 53.03 O ATOM 1471 CB ASN A 96 -4.648 0.178 0.907 1.00 74.32 C ATOM 1472 CG ASN A 96 -4.259 -0.471 2.249 1.00 35.53 C ATOM 1473 OD1 ASN A 96 -3.810 -1.617 2.304 1.00 34.25 O ATOM 1474 ND2 ASN A 96 -4.382 0.280 3.341 1.00 24.34 N ATOM 0 H ASN A 96 -5.402 0.917 -1.361 1.00 22.34 H new ATOM 0 HA ASN A 96 -4.256 -1.548 -0.347 1.00 1.52 H new ATOM 0 HB2 ASN A 96 -3.806 0.771 0.549 1.00 74.32 H new ATOM 0 HB3 ASN A 96 -5.474 0.868 1.079 1.00 74.32 H new ATOM 0 HD21 ASN A 96 -4.102 -0.091 4.249 1.00 24.34 H new ATOM 0 HD22 ASN A 96 -4.757 1.226 3.270 1.00 24.34 H new ATOM 1481 N TYR A 97 -7.511 -1.072 -0.162 1.00 52.31 N ATOM 1482 CA TYR A 97 -8.835 -1.678 0.124 1.00 11.01 C ATOM 1483 C TYR A 97 -9.079 -2.905 -0.773 1.00 42.23 C ATOM 1484 O TYR A 97 -9.650 -3.907 -0.332 1.00 23.12 O ATOM 1485 CB TYR A 97 -9.958 -0.617 -0.081 1.00 60.44 C ATOM 1486 CG TYR A 97 -11.400 -1.137 0.085 1.00 35.12 C ATOM 1487 CD1 TYR A 97 -12.252 -1.296 -1.018 1.00 70.52 C ATOM 1488 CD2 TYR A 97 -11.902 -1.479 1.343 1.00 63.35 C ATOM 1489 CE1 TYR A 97 -13.537 -1.777 -0.869 1.00 11.21 C ATOM 1490 CE2 TYR A 97 -13.188 -1.959 1.492 1.00 22.11 C ATOM 1491 CZ TYR A 97 -13.999 -2.105 0.385 1.00 60.24 C ATOM 1492 OH TYR A 97 -15.274 -2.585 0.531 1.00 2.41 O ATOM 0 H TYR A 97 -7.575 -0.181 -0.655 1.00 52.31 H new ATOM 0 HA TYR A 97 -8.850 -2.012 1.161 1.00 11.01 H new ATOM 0 HB2 TYR A 97 -9.800 0.196 0.628 1.00 60.44 H new ATOM 0 HB3 TYR A 97 -9.856 -0.193 -1.080 1.00 60.44 H new ATOM 0 HD1 TYR A 97 -11.895 -1.037 -2.004 1.00 70.52 H new ATOM 0 HD2 TYR A 97 -11.273 -1.366 2.214 1.00 63.35 H new ATOM 0 HE1 TYR A 97 -14.176 -1.895 -1.731 1.00 11.21 H new ATOM 0 HE2 TYR A 97 -13.558 -2.220 2.472 1.00 22.11 H new ATOM 0 HH TYR A 97 -15.400 -2.904 1.449 1.00 2.41 H new ATOM 1502 N LEU A 98 -8.650 -2.795 -2.037 1.00 0.41 N ATOM 1503 CA LEU A 98 -8.805 -3.853 -3.049 1.00 51.23 C ATOM 1504 C LEU A 98 -7.575 -4.786 -3.069 1.00 42.11 C ATOM 1505 O LEU A 98 -7.593 -5.807 -3.761 1.00 23.44 O ATOM 1506 CB LEU A 98 -9.031 -3.216 -4.446 1.00 31.45 C ATOM 1507 CG LEU A 98 -10.291 -2.304 -4.597 1.00 74.53 C ATOM 1508 CD1 LEU A 98 -10.392 -1.716 -6.022 1.00 24.42 C ATOM 1509 CD2 LEU A 98 -11.585 -3.047 -4.191 1.00 52.35 C ATOM 0 H LEU A 98 -8.181 -1.962 -2.391 1.00 0.41 H new ATOM 0 HA LEU A 98 -9.675 -4.457 -2.789 1.00 51.23 H new ATOM 0 HB2 LEU A 98 -8.150 -2.626 -4.699 1.00 31.45 H new ATOM 0 HB3 LEU A 98 -9.100 -4.018 -5.181 1.00 31.45 H new ATOM 0 HG LEU A 98 -10.174 -1.468 -3.908 1.00 74.53 H new ATOM 0 HD11 LEU A 98 -11.279 -1.087 -6.094 1.00 24.42 H new ATOM 0 HD12 LEU A 98 -9.505 -1.119 -6.233 1.00 24.42 H new ATOM 0 HD13 LEU A 98 -10.463 -2.527 -6.746 1.00 24.42 H new ATOM 0 HD21 LEU A 98 -12.440 -2.381 -4.309 1.00 52.35 H new ATOM 0 HD22 LEU A 98 -11.717 -3.922 -4.827 1.00 52.35 H new ATOM 0 HD23 LEU A 98 -11.512 -3.362 -3.150 1.00 52.35 H new ATOM 1521 N ASP A 99 -6.533 -4.410 -2.290 1.00 71.32 N ATOM 1522 CA ASP A 99 -5.267 -5.158 -2.156 1.00 54.44 C ATOM 1523 C ASP A 99 -4.645 -5.407 -3.547 1.00 42.41 C ATOM 1524 O ASP A 99 -4.617 -6.528 -4.053 1.00 43.41 O ATOM 1525 CB ASP A 99 -5.484 -6.480 -1.352 1.00 43.44 C ATOM 1526 CG ASP A 99 -4.187 -7.104 -0.782 1.00 20.51 C ATOM 1527 OD1 ASP A 99 -3.461 -7.787 -1.528 1.00 71.11 O ATOM 1528 OD2 ASP A 99 -3.902 -6.934 0.427 1.00 11.11 O ATOM 0 H ASP A 99 -6.553 -3.560 -1.727 1.00 71.32 H new ATOM 0 HA ASP A 99 -4.557 -4.559 -1.585 1.00 54.44 H new ATOM 0 HB2 ASP A 99 -6.169 -6.281 -0.528 1.00 43.44 H new ATOM 0 HB3 ASP A 99 -5.969 -7.210 -2.001 1.00 43.44 H new ATOM 1533 N ILE A 100 -4.254 -4.312 -4.206 1.00 73.43 N ATOM 1534 CA ILE A 100 -3.614 -4.339 -5.525 1.00 34.44 C ATOM 1535 C ILE A 100 -2.249 -3.685 -5.371 1.00 35.23 C ATOM 1536 O ILE A 100 -2.133 -2.457 -5.460 1.00 54.32 O ATOM 1537 CB ILE A 100 -4.461 -3.588 -6.630 1.00 20.41 C ATOM 1538 CG1 ILE A 100 -5.929 -4.103 -6.628 1.00 22.42 C ATOM 1539 CG2 ILE A 100 -3.815 -3.767 -8.031 1.00 13.44 C ATOM 1540 CD1 ILE A 100 -6.850 -3.466 -7.650 1.00 1.21 C ATOM 0 H ILE A 100 -4.375 -3.370 -3.834 1.00 73.43 H new ATOM 0 HA ILE A 100 -3.530 -5.372 -5.863 1.00 34.44 H new ATOM 0 HB ILE A 100 -4.470 -2.523 -6.396 1.00 20.41 H new ATOM 0 HG12 ILE A 100 -5.917 -5.180 -6.798 1.00 22.42 H new ATOM 0 HG13 ILE A 100 -6.350 -3.941 -5.636 1.00 22.42 H new ATOM 0 HG21 ILE A 100 -4.413 -3.243 -8.777 1.00 13.44 H new ATOM 0 HG22 ILE A 100 -2.805 -3.356 -8.021 1.00 13.44 H new ATOM 0 HG23 ILE A 100 -3.773 -4.827 -8.279 1.00 13.44 H new ATOM 0 HD11 ILE A 100 -7.847 -3.898 -7.561 1.00 1.21 H new ATOM 0 HD12 ILE A 100 -6.903 -2.392 -7.473 1.00 1.21 H new ATOM 0 HD13 ILE A 100 -6.463 -3.649 -8.652 1.00 1.21 H new ATOM 1552 N LYS A 101 -1.237 -4.513 -5.074 1.00 53.12 N ATOM 1553 CA LYS A 101 0.150 -4.065 -4.867 1.00 40.24 C ATOM 1554 C LYS A 101 0.692 -3.297 -6.117 1.00 51.11 C ATOM 1555 O LYS A 101 1.293 -2.245 -5.933 1.00 11.35 O ATOM 1556 CB LYS A 101 1.061 -5.278 -4.473 1.00 31.43 C ATOM 1557 CG LYS A 101 2.212 -4.973 -3.477 1.00 12.21 C ATOM 1558 CD LYS A 101 3.308 -4.037 -4.036 1.00 12.05 C ATOM 1559 CE LYS A 101 4.458 -3.816 -3.042 1.00 75.43 C ATOM 1560 NZ LYS A 101 5.477 -2.868 -3.568 1.00 2.33 N ATOM 0 H LYS A 101 -1.358 -5.520 -4.970 1.00 53.12 H new ATOM 0 HA LYS A 101 0.167 -3.358 -4.038 1.00 40.24 H new ATOM 0 HB2 LYS A 101 0.430 -6.055 -4.041 1.00 31.43 H new ATOM 0 HB3 LYS A 101 1.496 -5.691 -5.384 1.00 31.43 H new ATOM 0 HG2 LYS A 101 1.789 -4.522 -2.579 1.00 12.21 H new ATOM 0 HG3 LYS A 101 2.673 -5.913 -3.175 1.00 12.21 H new ATOM 0 HD2 LYS A 101 3.706 -4.460 -4.959 1.00 12.05 H new ATOM 0 HD3 LYS A 101 2.864 -3.075 -4.292 1.00 12.05 H new ATOM 0 HE2 LYS A 101 4.057 -3.433 -2.104 1.00 75.43 H new ATOM 0 HE3 LYS A 101 4.933 -4.771 -2.819 1.00 75.43 H new ATOM 0 HZ1 LYS A 101 6.121 -2.590 -2.800 1.00 2.33 H new ATOM 0 HZ2 LYS A 101 6.020 -3.328 -4.327 1.00 2.33 H new ATOM 0 HZ3 LYS A 101 5.003 -2.023 -3.945 1.00 2.33 H new ATOM 1574 N PRO A 102 0.492 -3.791 -7.407 1.00 31.33 N ATOM 1575 CA PRO A 102 0.885 -3.020 -8.624 1.00 52.33 C ATOM 1576 C PRO A 102 0.391 -1.552 -8.633 1.00 40.12 C ATOM 1577 O PRO A 102 1.202 -0.626 -8.700 1.00 44.14 O ATOM 1578 CB PRO A 102 0.236 -3.823 -9.779 1.00 52.53 C ATOM 1579 CG PRO A 102 0.240 -5.231 -9.284 1.00 72.13 C ATOM 1580 CD PRO A 102 -0.048 -5.138 -7.797 1.00 53.22 C ATOM 0 HA PRO A 102 1.969 -2.926 -8.693 1.00 52.33 H new ATOM 0 HB2 PRO A 102 -0.776 -3.476 -9.988 1.00 52.53 H new ATOM 0 HB3 PRO A 102 0.804 -3.723 -10.704 1.00 52.53 H new ATOM 0 HG2 PRO A 102 -0.516 -5.828 -9.794 1.00 72.13 H new ATOM 0 HG3 PRO A 102 1.202 -5.709 -9.468 1.00 72.13 H new ATOM 0 HD2 PRO A 102 -1.116 -5.215 -7.591 1.00 53.22 H new ATOM 0 HD3 PRO A 102 0.442 -5.940 -7.244 1.00 53.22 H new ATOM 1588 N LEU A 103 -0.942 -1.357 -8.510 1.00 51.20 N ATOM 1589 CA LEU A 103 -1.568 -0.018 -8.589 1.00 34.50 C ATOM 1590 C LEU A 103 -1.152 0.844 -7.385 1.00 65.53 C ATOM 1591 O LEU A 103 -0.889 2.040 -7.535 1.00 21.41 O ATOM 1592 CB LEU A 103 -3.124 -0.149 -8.697 1.00 13.33 C ATOM 1593 CG LEU A 103 -3.953 1.152 -9.068 1.00 33.21 C ATOM 1594 CD1 LEU A 103 -4.305 2.028 -7.835 1.00 64.11 C ATOM 1595 CD2 LEU A 103 -3.218 1.989 -10.146 1.00 41.45 C ATOM 0 H LEU A 103 -1.607 -2.115 -8.355 1.00 51.20 H new ATOM 0 HA LEU A 103 -1.215 0.484 -9.490 1.00 34.50 H new ATOM 0 HB2 LEU A 103 -3.345 -0.911 -9.445 1.00 13.33 H new ATOM 0 HB3 LEU A 103 -3.496 -0.522 -7.743 1.00 13.33 H new ATOM 0 HG LEU A 103 -4.901 0.802 -9.477 1.00 33.21 H new ATOM 0 HD11 LEU A 103 -4.872 2.901 -8.159 1.00 64.11 H new ATOM 0 HD12 LEU A 103 -4.904 1.446 -7.134 1.00 64.11 H new ATOM 0 HD13 LEU A 103 -3.387 2.353 -7.345 1.00 64.11 H new ATOM 0 HD21 LEU A 103 -3.807 2.875 -10.383 1.00 41.45 H new ATOM 0 HD22 LEU A 103 -2.242 2.292 -9.768 1.00 41.45 H new ATOM 0 HD23 LEU A 103 -3.088 1.389 -11.046 1.00 41.45 H new ATOM 1607 N LEU A 104 -1.078 0.205 -6.211 1.00 2.02 N ATOM 1608 CA LEU A 104 -0.682 0.860 -4.953 1.00 64.44 C ATOM 1609 C LEU A 104 0.753 1.393 -5.061 1.00 44.14 C ATOM 1610 O LEU A 104 1.035 2.510 -4.646 1.00 32.23 O ATOM 1611 CB LEU A 104 -0.814 -0.136 -3.767 1.00 55.25 C ATOM 1612 CG LEU A 104 -0.496 0.411 -2.338 1.00 60.25 C ATOM 1613 CD1 LEU A 104 -1.398 1.613 -1.958 1.00 42.30 C ATOM 1614 CD2 LEU A 104 -0.604 -0.728 -1.295 1.00 73.32 C ATOM 0 H LEU A 104 -1.292 -0.787 -6.104 1.00 2.02 H new ATOM 0 HA LEU A 104 -1.347 1.704 -4.768 1.00 64.44 H new ATOM 0 HB2 LEU A 104 -1.833 -0.523 -3.762 1.00 55.25 H new ATOM 0 HB3 LEU A 104 -0.153 -0.981 -3.960 1.00 55.25 H new ATOM 0 HG LEU A 104 0.529 0.783 -2.343 1.00 60.25 H new ATOM 0 HD11 LEU A 104 -1.141 1.959 -0.957 1.00 42.30 H new ATOM 0 HD12 LEU A 104 -1.246 2.422 -2.672 1.00 42.30 H new ATOM 0 HD13 LEU A 104 -2.443 1.304 -1.977 1.00 42.30 H new ATOM 0 HD21 LEU A 104 -0.380 -0.335 -0.303 1.00 73.32 H new ATOM 0 HD22 LEU A 104 -1.615 -1.135 -1.305 1.00 73.32 H new ATOM 0 HD23 LEU A 104 0.107 -1.516 -1.542 1.00 73.32 H new ATOM 1626 N ASP A 105 1.626 0.587 -5.686 1.00 65.40 N ATOM 1627 CA ASP A 105 3.061 0.888 -5.811 1.00 13.22 C ATOM 1628 C ASP A 105 3.290 2.003 -6.836 1.00 34.13 C ATOM 1629 O ASP A 105 4.128 2.875 -6.618 1.00 3.33 O ATOM 1630 CB ASP A 105 3.855 -0.393 -6.177 1.00 74.02 C ATOM 1631 CG ASP A 105 5.367 -0.239 -5.950 1.00 2.11 C ATOM 1632 OD1 ASP A 105 5.809 -0.294 -4.793 1.00 60.33 O ATOM 1633 OD2 ASP A 105 6.119 -0.035 -6.902 1.00 24.14 O ATOM 0 H ASP A 105 1.355 -0.295 -6.121 1.00 65.40 H new ATOM 0 HA ASP A 105 3.429 1.243 -4.848 1.00 13.22 H new ATOM 0 HB2 ASP A 105 3.485 -1.227 -5.581 1.00 74.02 H new ATOM 0 HB3 ASP A 105 3.672 -0.643 -7.222 1.00 74.02 H new ATOM 1638 N VAL A 106 2.518 1.978 -7.940 1.00 25.11 N ATOM 1639 CA VAL A 106 2.546 3.040 -8.964 1.00 1.14 C ATOM 1640 C VAL A 106 2.121 4.387 -8.341 1.00 31.12 C ATOM 1641 O VAL A 106 2.785 5.408 -8.543 1.00 3.23 O ATOM 1642 CB VAL A 106 1.621 2.694 -10.198 1.00 4.52 C ATOM 1643 CG1 VAL A 106 1.509 3.880 -11.196 1.00 5.41 C ATOM 1644 CG2 VAL A 106 2.118 1.422 -10.927 1.00 23.22 C ATOM 0 H VAL A 106 1.861 1.225 -8.146 1.00 25.11 H new ATOM 0 HA VAL A 106 3.569 3.117 -9.332 1.00 1.14 H new ATOM 0 HB VAL A 106 0.624 2.502 -9.801 1.00 4.52 H new ATOM 0 HG11 VAL A 106 0.864 3.596 -12.027 1.00 5.41 H new ATOM 0 HG12 VAL A 106 1.085 4.745 -10.687 1.00 5.41 H new ATOM 0 HG13 VAL A 106 2.500 4.131 -11.575 1.00 5.41 H new ATOM 0 HG21 VAL A 106 1.463 1.207 -11.772 1.00 23.22 H new ATOM 0 HG22 VAL A 106 3.134 1.583 -11.287 1.00 23.22 H new ATOM 0 HG23 VAL A 106 2.107 0.579 -10.236 1.00 23.22 H new ATOM 1654 N THR A 107 1.026 4.361 -7.559 1.00 20.24 N ATOM 1655 CA THR A 107 0.495 5.556 -6.881 1.00 63.45 C ATOM 1656 C THR A 107 1.492 6.076 -5.818 1.00 55.41 C ATOM 1657 O THR A 107 1.717 7.284 -5.724 1.00 32.14 O ATOM 1658 CB THR A 107 -0.907 5.263 -6.239 1.00 12.23 C ATOM 1659 OG1 THR A 107 -1.803 4.782 -7.257 1.00 14.04 O ATOM 1660 CG2 THR A 107 -1.530 6.513 -5.579 1.00 11.33 C ATOM 0 H THR A 107 0.487 3.514 -7.380 1.00 20.24 H new ATOM 0 HA THR A 107 0.363 6.336 -7.631 1.00 63.45 H new ATOM 0 HB THR A 107 -0.757 4.515 -5.460 1.00 12.23 H new ATOM 0 HG1 THR A 107 -1.610 3.839 -7.444 1.00 14.04 H new ATOM 0 HG21 THR A 107 -2.498 6.254 -5.151 1.00 11.33 H new ATOM 0 HG22 THR A 107 -0.870 6.875 -4.791 1.00 11.33 H new ATOM 0 HG23 THR A 107 -1.662 7.293 -6.329 1.00 11.33 H new ATOM 1668 N CYS A 108 2.112 5.141 -5.069 1.00 71.14 N ATOM 1669 CA CYS A 108 3.085 5.462 -4.002 1.00 35.05 C ATOM 1670 C CYS A 108 4.356 6.111 -4.597 1.00 44.13 C ATOM 1671 O CYS A 108 4.913 7.047 -4.011 1.00 64.10 O ATOM 1672 CB CYS A 108 3.453 4.194 -3.187 1.00 60.13 C ATOM 1673 SG CYS A 108 2.085 3.497 -2.232 1.00 50.21 S ATOM 0 H CYS A 108 1.952 4.140 -5.186 1.00 71.14 H new ATOM 0 HA CYS A 108 2.618 6.178 -3.326 1.00 35.05 H new ATOM 0 HB2 CYS A 108 3.827 3.433 -3.872 1.00 60.13 H new ATOM 0 HB3 CYS A 108 4.268 4.439 -2.506 1.00 60.13 H new ATOM 0 HG CYS A 108 1.222 2.958 -3.041 1.00 50.21 H new ATOM 1679 N LYS A 109 4.804 5.602 -5.764 1.00 75.01 N ATOM 1680 CA LYS A 109 5.955 6.172 -6.499 1.00 45.25 C ATOM 1681 C LYS A 109 5.617 7.595 -6.979 1.00 55.20 C ATOM 1682 O LYS A 109 6.365 8.526 -6.707 1.00 32.52 O ATOM 1683 CB LYS A 109 6.378 5.263 -7.713 1.00 35.33 C ATOM 1684 CG LYS A 109 7.578 4.312 -7.453 1.00 31.34 C ATOM 1685 CD LYS A 109 7.301 3.253 -6.365 1.00 32.25 C ATOM 1686 CE LYS A 109 8.510 2.328 -6.111 1.00 51.00 C ATOM 1687 NZ LYS A 109 8.201 1.282 -5.099 1.00 10.43 N ATOM 0 H LYS A 109 4.384 4.792 -6.220 1.00 75.01 H new ATOM 0 HA LYS A 109 6.804 6.216 -5.816 1.00 45.25 H new ATOM 0 HB2 LYS A 109 5.519 4.662 -8.010 1.00 35.33 H new ATOM 0 HB3 LYS A 109 6.624 5.907 -8.557 1.00 35.33 H new ATOM 0 HG2 LYS A 109 7.838 3.806 -8.383 1.00 31.34 H new ATOM 0 HG3 LYS A 109 8.444 4.905 -7.159 1.00 31.34 H new ATOM 0 HD2 LYS A 109 7.032 3.755 -5.436 1.00 32.25 H new ATOM 0 HD3 LYS A 109 6.443 2.649 -6.662 1.00 32.25 H new ATOM 0 HE2 LYS A 109 8.807 1.853 -7.046 1.00 51.00 H new ATOM 0 HE3 LYS A 109 9.358 2.923 -5.772 1.00 51.00 H new ATOM 0 HZ1 LYS A 109 8.689 1.506 -4.208 1.00 10.43 H new ATOM 0 HZ2 LYS A 109 7.175 1.252 -4.933 1.00 10.43 H new ATOM 0 HZ3 LYS A 109 8.523 0.356 -5.447 1.00 10.43 H new ATOM 1701 N THR A 110 4.461 7.731 -7.655 1.00 34.14 N ATOM 1702 CA THR A 110 4.017 8.992 -8.274 1.00 1.22 C ATOM 1703 C THR A 110 3.906 10.132 -7.246 1.00 24.03 C ATOM 1704 O THR A 110 4.471 11.208 -7.452 1.00 20.44 O ATOM 1705 CB THR A 110 2.649 8.805 -9.006 1.00 44.20 C ATOM 1706 OG1 THR A 110 2.796 7.828 -10.049 1.00 34.31 O ATOM 1707 CG2 THR A 110 2.111 10.121 -9.609 1.00 70.11 C ATOM 0 H THR A 110 3.804 6.962 -7.787 1.00 34.14 H new ATOM 0 HA THR A 110 4.778 9.269 -9.004 1.00 1.22 H new ATOM 0 HB THR A 110 1.926 8.470 -8.262 1.00 44.20 H new ATOM 0 HG1 THR A 110 2.825 6.931 -9.655 1.00 34.31 H new ATOM 0 HG21 THR A 110 1.159 9.932 -10.105 1.00 70.11 H new ATOM 0 HG22 THR A 110 1.967 10.853 -8.814 1.00 70.11 H new ATOM 0 HG23 THR A 110 2.827 10.509 -10.334 1.00 70.11 H new ATOM 1715 N VAL A 111 3.191 9.876 -6.130 1.00 5.31 N ATOM 1716 CA VAL A 111 2.977 10.884 -5.071 1.00 23.44 C ATOM 1717 C VAL A 111 4.320 11.326 -4.452 1.00 23.54 C ATOM 1718 O VAL A 111 4.498 12.501 -4.125 1.00 35.21 O ATOM 1719 CB VAL A 111 1.978 10.391 -3.959 1.00 51.14 C ATOM 1720 CG1 VAL A 111 0.563 10.149 -4.543 1.00 12.31 C ATOM 1721 CG2 VAL A 111 2.502 9.129 -3.228 1.00 54.25 C ATOM 0 H VAL A 111 2.751 8.976 -5.939 1.00 5.31 H new ATOM 0 HA VAL A 111 2.514 11.748 -5.547 1.00 23.44 H new ATOM 0 HB VAL A 111 1.906 11.187 -3.218 1.00 51.14 H new ATOM 0 HG11 VAL A 111 -0.104 9.809 -3.751 1.00 12.31 H new ATOM 0 HG12 VAL A 111 0.180 11.078 -4.966 1.00 12.31 H new ATOM 0 HG13 VAL A 111 0.616 9.390 -5.323 1.00 12.31 H new ATOM 0 HG21 VAL A 111 1.782 8.823 -2.469 1.00 54.25 H new ATOM 0 HG22 VAL A 111 2.636 8.321 -3.947 1.00 54.25 H new ATOM 0 HG23 VAL A 111 3.457 9.354 -2.753 1.00 54.25 H new ATOM 1731 N ALA A 112 5.269 10.376 -4.364 1.00 72.41 N ATOM 1732 CA ALA A 112 6.623 10.624 -3.848 1.00 42.22 C ATOM 1733 C ALA A 112 7.482 11.414 -4.847 1.00 35.50 C ATOM 1734 O ALA A 112 8.327 12.217 -4.452 1.00 3.20 O ATOM 1735 CB ALA A 112 7.298 9.311 -3.503 1.00 35.41 C ATOM 0 H ALA A 112 5.114 9.410 -4.651 1.00 72.41 H new ATOM 0 HA ALA A 112 6.526 11.230 -2.947 1.00 42.22 H new ATOM 0 HB1 ALA A 112 8.300 9.506 -3.122 1.00 35.41 H new ATOM 0 HB2 ALA A 112 6.715 8.791 -2.742 1.00 35.41 H new ATOM 0 HB3 ALA A 112 7.364 8.690 -4.396 1.00 35.41 H new ATOM 1741 N ASN A 113 7.262 11.166 -6.137 1.00 31.33 N ATOM 1742 CA ASN A 113 8.020 11.818 -7.219 1.00 13.21 C ATOM 1743 C ASN A 113 7.594 13.288 -7.388 1.00 11.41 C ATOM 1744 O ASN A 113 8.440 14.154 -7.597 1.00 33.05 O ATOM 1745 CB ASN A 113 7.845 11.043 -8.552 1.00 74.11 C ATOM 1746 CG ASN A 113 8.516 9.666 -8.565 1.00 53.44 C ATOM 1747 OD1 ASN A 113 9.529 9.443 -7.902 1.00 74.43 O ATOM 1748 ND2 ASN A 113 7.958 8.730 -9.324 1.00 21.05 N ATOM 0 H ASN A 113 6.555 10.509 -6.468 1.00 31.33 H new ATOM 0 HA ASN A 113 9.075 11.803 -6.946 1.00 13.21 H new ATOM 0 HB2 ASN A 113 6.781 10.919 -8.751 1.00 74.11 H new ATOM 0 HB3 ASN A 113 8.254 11.643 -9.365 1.00 74.11 H new ATOM 0 HD21 ASN A 113 8.369 7.797 -9.368 1.00 21.05 H new ATOM 0 HD22 ASN A 113 7.119 8.944 -9.863 1.00 21.05 H new ATOM 1755 N MET A 114 6.282 13.551 -7.264 1.00 11.43 N ATOM 1756 CA MET A 114 5.704 14.895 -7.487 1.00 75.21 C ATOM 1757 C MET A 114 6.105 15.877 -6.366 1.00 42.10 C ATOM 1758 O MET A 114 6.421 17.037 -6.640 1.00 43.31 O ATOM 1759 CB MET A 114 4.155 14.808 -7.614 1.00 13.34 C ATOM 1760 CG MET A 114 3.659 13.982 -8.809 1.00 10.23 C ATOM 1761 SD MET A 114 1.857 13.936 -8.948 1.00 43.04 S ATOM 1762 CE MET A 114 1.356 13.281 -7.352 1.00 40.02 C ATOM 0 H MET A 114 5.592 12.845 -7.008 1.00 11.43 H new ATOM 0 HA MET A 114 6.109 15.280 -8.423 1.00 75.21 H new ATOM 0 HB2 MET A 114 3.752 14.376 -6.698 1.00 13.34 H new ATOM 0 HB3 MET A 114 3.753 15.818 -7.695 1.00 13.34 H new ATOM 0 HG2 MET A 114 4.077 14.396 -9.727 1.00 10.23 H new ATOM 0 HG3 MET A 114 4.036 12.963 -8.719 1.00 10.23 H new ATOM 0 HE1 MET A 114 0.272 13.172 -7.327 1.00 40.02 H new ATOM 0 HE2 MET A 114 1.822 12.308 -7.195 1.00 40.02 H new ATOM 0 HE3 MET A 114 1.670 13.965 -6.563 1.00 40.02 H new ATOM 1772 N ILE A 115 6.108 15.395 -5.110 1.00 54.14 N ATOM 1773 CA ILE A 115 6.489 16.217 -3.923 1.00 72.43 C ATOM 1774 C ILE A 115 8.006 16.545 -3.909 1.00 72.25 C ATOM 1775 O ILE A 115 8.430 17.528 -3.290 1.00 43.25 O ATOM 1776 CB ILE A 115 6.088 15.497 -2.586 1.00 41.42 C ATOM 1777 CG1 ILE A 115 6.797 14.107 -2.520 1.00 61.34 C ATOM 1778 CG2 ILE A 115 4.548 15.377 -2.476 1.00 44.04 C ATOM 1779 CD1 ILE A 115 6.462 13.229 -1.350 1.00 31.04 C ATOM 0 H ILE A 115 5.851 14.435 -4.879 1.00 54.14 H new ATOM 0 HA ILE A 115 5.940 17.155 -4.000 1.00 72.43 H new ATOM 0 HB ILE A 115 6.418 16.087 -1.731 1.00 41.42 H new ATOM 0 HG12 ILE A 115 6.559 13.561 -3.433 1.00 61.34 H new ATOM 0 HG13 ILE A 115 7.874 14.275 -2.521 1.00 61.34 H new ATOM 0 HG21 ILE A 115 4.288 14.876 -1.544 1.00 44.04 H new ATOM 0 HG22 ILE A 115 4.104 16.372 -2.489 1.00 44.04 H new ATOM 0 HG23 ILE A 115 4.167 14.798 -3.318 1.00 44.04 H new ATOM 0 HD11 ILE A 115 7.020 12.296 -1.424 1.00 31.04 H new ATOM 0 HD12 ILE A 115 6.729 13.739 -0.424 1.00 31.04 H new ATOM 0 HD13 ILE A 115 5.393 13.014 -1.351 1.00 31.04 H new ATOM 1791 N ARG A 116 8.804 15.694 -4.578 1.00 44.10 N ATOM 1792 CA ARG A 116 10.256 15.914 -4.767 1.00 0.42 C ATOM 1793 C ARG A 116 10.521 16.704 -6.064 1.00 13.44 C ATOM 1794 O ARG A 116 11.591 17.307 -6.223 1.00 73.41 O ATOM 1795 CB ARG A 116 10.996 14.549 -4.793 1.00 31.11 C ATOM 1796 CG ARG A 116 10.965 13.796 -3.443 1.00 2.32 C ATOM 1797 CD ARG A 116 11.700 12.442 -3.493 1.00 4.44 C ATOM 1798 NE ARG A 116 11.074 11.485 -4.430 1.00 51.33 N ATOM 1799 CZ ARG A 116 11.320 10.162 -4.465 1.00 3.24 C ATOM 1800 NH1 ARG A 116 12.187 9.607 -3.624 1.00 14.12 N ATOM 1801 NH2 ARG A 116 10.699 9.398 -5.354 1.00 74.41 N ATOM 0 H ARG A 116 8.464 14.832 -5.005 1.00 44.10 H new ATOM 0 HA ARG A 116 10.636 16.503 -3.932 1.00 0.42 H new ATOM 0 HB2 ARG A 116 10.548 13.918 -5.561 1.00 31.11 H new ATOM 0 HB3 ARG A 116 12.034 14.714 -5.082 1.00 31.11 H new ATOM 0 HG2 ARG A 116 11.418 14.421 -2.674 1.00 2.32 H new ATOM 0 HG3 ARG A 116 9.929 13.630 -3.149 1.00 2.32 H new ATOM 0 HD2 ARG A 116 12.736 12.607 -3.788 1.00 4.44 H new ATOM 0 HD3 ARG A 116 11.718 12.006 -2.494 1.00 4.44 H new ATOM 0 HE ARG A 116 10.403 11.856 -5.103 1.00 51.33 H new ATOM 0 HH11 ARG A 116 12.676 10.185 -2.940 1.00 14.12 H new ATOM 0 HH12 ARG A 116 12.363 8.603 -3.662 1.00 14.12 H new ATOM 0 HH21 ARG A 116 10.037 9.813 -6.009 1.00 74.41 H new ATOM 0 HH22 ARG A 116 10.884 8.395 -5.382 1.00 74.41 H new ATOM 1815 N GLY A 117 9.527 16.697 -6.973 1.00 31.15 N ATOM 1816 CA GLY A 117 9.635 17.363 -8.276 1.00 45.24 C ATOM 1817 C GLY A 117 10.096 16.409 -9.386 1.00 10.42 C ATOM 1818 O GLY A 117 10.856 15.457 -9.092 1.00 43.34 O ATOM 1819 OXT GLY A 117 9.711 16.608 -10.557 1.00 38.24 O ATOM 0 H GLY A 117 8.633 16.231 -6.822 1.00 31.15 H new ATOM 0 HA2 GLY A 117 8.668 17.788 -8.545 1.00 45.24 H new ATOM 0 HA3 GLY A 117 10.338 18.193 -8.199 1.00 45.24 H new TER 1823 GLY A 117 ATOM 1824 N SER B 2 17.878 -13.792 16.449 1.00 33.04 N ATOM 1825 CA SER B 2 19.126 -13.054 16.165 1.00 23.25 C ATOM 1826 C SER B 2 18.825 -11.751 15.413 1.00 43.02 C ATOM 1827 O SER B 2 17.743 -11.596 14.825 1.00 0.14 O ATOM 1828 CB SER B 2 20.084 -13.963 15.372 1.00 74.00 C ATOM 1829 OG SER B 2 20.302 -15.183 16.067 1.00 21.21 O ATOM 0 HA SER B 2 19.609 -12.777 17.102 1.00 23.25 H new ATOM 0 HB2 SER B 2 19.667 -14.169 14.386 1.00 74.00 H new ATOM 0 HB3 SER B 2 21.034 -13.452 15.216 1.00 74.00 H new ATOM 0 HG SER B 2 19.477 -15.451 16.524 1.00 21.21 H new ATOM 1837 N LEU B 3 19.787 -10.812 15.447 1.00 22.44 N ATOM 1838 CA LEU B 3 19.642 -9.492 14.814 1.00 44.11 C ATOM 1839 C LEU B 3 19.949 -9.576 13.305 1.00 34.44 C ATOM 1840 O LEU B 3 21.075 -9.921 12.918 1.00 53.30 O ATOM 1841 CB LEU B 3 20.592 -8.460 15.490 1.00 11.11 C ATOM 1842 CG LEU B 3 20.444 -8.297 17.035 1.00 1.05 C ATOM 1843 CD1 LEU B 3 21.462 -7.280 17.593 1.00 12.22 C ATOM 1844 CD2 LEU B 3 19.009 -7.907 17.423 1.00 1.45 C ATOM 0 H LEU B 3 20.684 -10.948 15.913 1.00 22.44 H new ATOM 0 HA LEU B 3 18.611 -9.164 14.944 1.00 44.11 H new ATOM 0 HB2 LEU B 3 21.621 -8.748 15.273 1.00 11.11 H new ATOM 0 HB3 LEU B 3 20.428 -7.488 15.026 1.00 11.11 H new ATOM 0 HG LEU B 3 20.659 -9.266 17.486 1.00 1.05 H new ATOM 0 HD11 LEU B 3 21.332 -7.190 18.671 1.00 12.22 H new ATOM 0 HD12 LEU B 3 22.474 -7.622 17.377 1.00 12.22 H new ATOM 0 HD13 LEU B 3 21.300 -6.309 17.126 1.00 12.22 H new ATOM 0 HD21 LEU B 3 18.941 -7.802 18.506 1.00 1.45 H new ATOM 0 HD22 LEU B 3 18.748 -6.961 16.949 1.00 1.45 H new ATOM 0 HD23 LEU B 3 18.319 -8.682 17.090 1.00 1.45 H new ATOM 1856 N VAL B 4 18.944 -9.275 12.466 1.00 74.10 N ATOM 1857 CA VAL B 4 19.139 -9.093 11.014 1.00 21.31 C ATOM 1858 C VAL B 4 19.550 -7.641 10.730 1.00 31.03 C ATOM 1859 O VAL B 4 18.917 -6.689 11.210 1.00 24.14 O ATOM 1860 CB VAL B 4 17.876 -9.489 10.157 1.00 62.54 C ATOM 1861 CG1 VAL B 4 17.708 -11.025 10.112 1.00 71.02 C ATOM 1862 CG2 VAL B 4 16.599 -8.798 10.687 1.00 4.43 C ATOM 0 H VAL B 4 17.978 -9.151 12.771 1.00 74.10 H new ATOM 0 HA VAL B 4 19.933 -9.775 10.710 1.00 21.31 H new ATOM 0 HB VAL B 4 18.035 -9.138 9.138 1.00 62.54 H new ATOM 0 HG11 VAL B 4 16.831 -11.278 9.516 1.00 71.02 H new ATOM 0 HG12 VAL B 4 18.594 -11.475 9.663 1.00 71.02 H new ATOM 0 HG13 VAL B 4 17.581 -11.407 11.125 1.00 71.02 H new ATOM 0 HG21 VAL B 4 15.746 -9.091 10.075 1.00 4.43 H new ATOM 0 HG22 VAL B 4 16.425 -9.098 11.720 1.00 4.43 H new ATOM 0 HG23 VAL B 4 16.724 -7.716 10.640 1.00 4.43 H new ATOM 1872 N LYS B 5 20.631 -7.499 9.962 1.00 70.35 N ATOM 1873 CA LYS B 5 21.246 -6.212 9.667 1.00 10.12 C ATOM 1874 C LYS B 5 20.541 -5.558 8.459 1.00 60.11 C ATOM 1875 O LYS B 5 20.969 -5.712 7.315 1.00 42.22 O ATOM 1876 CB LYS B 5 22.764 -6.422 9.421 1.00 33.32 C ATOM 1877 CG LYS B 5 23.515 -7.083 10.599 1.00 35.01 C ATOM 1878 CD LYS B 5 25.047 -7.097 10.406 1.00 51.33 C ATOM 1879 CE LYS B 5 25.774 -7.768 11.586 1.00 21.32 C ATOM 1880 NZ LYS B 5 27.245 -7.579 11.510 1.00 63.24 N ATOM 0 H LYS B 5 21.107 -8.287 9.523 1.00 70.35 H new ATOM 0 HA LYS B 5 21.133 -5.532 10.511 1.00 10.12 H new ATOM 0 HB2 LYS B 5 22.894 -7.038 8.531 1.00 33.32 H new ATOM 0 HB3 LYS B 5 23.223 -5.456 9.209 1.00 33.32 H new ATOM 0 HG2 LYS B 5 23.275 -6.551 11.520 1.00 35.01 H new ATOM 0 HG3 LYS B 5 23.160 -8.106 10.720 1.00 35.01 H new ATOM 0 HD2 LYS B 5 25.291 -7.624 9.484 1.00 51.33 H new ATOM 0 HD3 LYS B 5 25.407 -6.074 10.293 1.00 51.33 H new ATOM 0 HE2 LYS B 5 25.403 -7.354 12.524 1.00 21.32 H new ATOM 0 HE3 LYS B 5 25.545 -8.834 11.595 1.00 21.32 H new ATOM 0 HZ1 LYS B 5 27.697 -8.045 12.322 1.00 63.24 H new ATOM 0 HZ2 LYS B 5 27.603 -7.996 10.627 1.00 63.24 H new ATOM 0 HZ3 LYS B 5 27.466 -6.563 11.527 1.00 63.24 H new ATOM 1894 N LEU B 6 19.416 -4.880 8.737 1.00 23.33 N ATOM 1895 CA LEU B 6 18.584 -4.239 7.706 1.00 74.45 C ATOM 1896 C LEU B 6 19.174 -2.879 7.320 1.00 43.35 C ATOM 1897 O LEU B 6 18.872 -1.856 7.950 1.00 24.35 O ATOM 1898 CB LEU B 6 17.122 -4.093 8.211 1.00 12.31 C ATOM 1899 CG LEU B 6 16.414 -5.424 8.607 1.00 51.14 C ATOM 1900 CD1 LEU B 6 14.973 -5.172 9.083 1.00 72.24 C ATOM 1901 CD2 LEU B 6 16.450 -6.456 7.455 1.00 74.04 C ATOM 0 H LEU B 6 19.057 -4.761 9.684 1.00 23.33 H new ATOM 0 HA LEU B 6 18.573 -4.868 6.816 1.00 74.45 H new ATOM 0 HB2 LEU B 6 17.119 -3.429 9.075 1.00 12.31 H new ATOM 0 HB3 LEU B 6 16.534 -3.606 7.433 1.00 12.31 H new ATOM 0 HG LEU B 6 16.971 -5.849 9.442 1.00 51.14 H new ATOM 0 HD11 LEU B 6 14.507 -6.120 9.352 1.00 72.24 H new ATOM 0 HD12 LEU B 6 14.987 -4.515 9.953 1.00 72.24 H new ATOM 0 HD13 LEU B 6 14.402 -4.702 8.282 1.00 72.24 H new ATOM 0 HD21 LEU B 6 15.947 -7.370 7.770 1.00 74.04 H new ATOM 0 HD22 LEU B 6 15.943 -6.045 6.582 1.00 74.04 H new ATOM 0 HD23 LEU B 6 17.486 -6.681 7.201 1.00 74.04 H new ATOM 1913 N GLU B 7 20.058 -2.894 6.319 1.00 54.24 N ATOM 1914 CA GLU B 7 20.699 -1.682 5.800 1.00 23.14 C ATOM 1915 C GLU B 7 19.729 -0.933 4.865 1.00 41.04 C ATOM 1916 O GLU B 7 19.074 -1.547 4.021 1.00 44.22 O ATOM 1917 CB GLU B 7 22.011 -2.047 5.058 1.00 31.00 C ATOM 1918 CG GLU B 7 22.780 -0.840 4.479 1.00 55.10 C ATOM 1919 CD GLU B 7 24.092 -1.235 3.778 1.00 14.12 C ATOM 1920 OE1 GLU B 7 25.174 -1.149 4.413 1.00 53.12 O ATOM 1921 OE2 GLU B 7 24.052 -1.655 2.598 1.00 23.04 O ATOM 0 H GLU B 7 20.350 -3.748 5.844 1.00 54.24 H new ATOM 0 HA GLU B 7 20.950 -1.025 6.633 1.00 23.14 H new ATOM 0 HB2 GLU B 7 22.666 -2.581 5.747 1.00 31.00 H new ATOM 0 HB3 GLU B 7 21.774 -2.734 4.245 1.00 31.00 H new ATOM 0 HG2 GLU B 7 22.140 -0.317 3.769 1.00 55.10 H new ATOM 0 HG3 GLU B 7 23.003 -0.140 5.284 1.00 55.10 H new ATOM 1928 N SER B 8 19.644 0.386 5.048 1.00 44.40 N ATOM 1929 CA SER B 8 18.808 1.277 4.230 1.00 32.30 C ATOM 1930 C SER B 8 19.570 1.737 2.977 1.00 15.33 C ATOM 1931 O SER B 8 20.759 1.427 2.805 1.00 14.01 O ATOM 1932 CB SER B 8 18.405 2.488 5.098 1.00 25.34 C ATOM 1933 OG SER B 8 19.550 3.136 5.644 1.00 43.23 O ATOM 0 H SER B 8 20.160 0.876 5.779 1.00 44.40 H new ATOM 0 HA SER B 8 17.917 0.747 3.893 1.00 32.30 H new ATOM 0 HB2 SER B 8 17.836 3.196 4.496 1.00 25.34 H new ATOM 0 HB3 SER B 8 17.751 2.158 5.905 1.00 25.34 H new ATOM 0 HG SER B 8 19.426 3.262 6.608 1.00 43.23 H new ATOM 1939 N SER B 9 18.879 2.500 2.112 1.00 54.31 N ATOM 1940 CA SER B 9 19.498 3.159 0.944 1.00 4.25 C ATOM 1941 C SER B 9 20.418 4.326 1.379 1.00 20.22 C ATOM 1942 O SER B 9 21.209 4.828 0.578 1.00 63.32 O ATOM 1943 CB SER B 9 18.400 3.658 -0.023 1.00 70.03 C ATOM 1944 OG SER B 9 17.533 4.591 0.595 1.00 5.20 O ATOM 0 H SER B 9 17.879 2.678 2.201 1.00 54.31 H new ATOM 0 HA SER B 9 20.119 2.428 0.426 1.00 4.25 H new ATOM 0 HB2 SER B 9 18.866 4.118 -0.894 1.00 70.03 H new ATOM 0 HB3 SER B 9 17.820 2.808 -0.383 1.00 70.03 H new ATOM 0 HG SER B 9 17.177 4.208 1.424 1.00 5.20 H new ATOM 1950 N ASP B 10 20.289 4.742 2.661 1.00 14.11 N ATOM 1951 CA ASP B 10 21.141 5.765 3.299 1.00 41.02 C ATOM 1952 C ASP B 10 22.355 5.098 4.010 1.00 32.13 C ATOM 1953 O ASP B 10 23.137 5.769 4.687 1.00 5.11 O ATOM 1954 CB ASP B 10 20.257 6.588 4.282 1.00 14.11 C ATOM 1955 CG ASP B 10 20.987 7.754 4.991 1.00 61.11 C ATOM 1956 OD1 ASP B 10 21.388 7.594 6.160 1.00 35.33 O ATOM 1957 OD2 ASP B 10 21.163 8.828 4.385 1.00 24.34 O ATOM 0 H ASP B 10 19.577 4.368 3.289 1.00 14.11 H new ATOM 0 HA ASP B 10 21.557 6.441 2.552 1.00 41.02 H new ATOM 0 HB2 ASP B 10 19.406 6.991 3.733 1.00 14.11 H new ATOM 0 HB3 ASP B 10 19.857 5.914 5.040 1.00 14.11 H new ATOM 1962 N GLU B 11 22.481 3.754 3.842 1.00 72.14 N ATOM 1963 CA GLU B 11 23.639 2.937 4.296 1.00 72.15 C ATOM 1964 C GLU B 11 23.604 2.638 5.828 1.00 11.11 C ATOM 1965 O GLU B 11 24.454 1.892 6.338 1.00 73.04 O ATOM 1966 CB GLU B 11 24.992 3.603 3.861 1.00 2.12 C ATOM 1967 CG GLU B 11 26.269 2.761 4.063 1.00 42.42 C ATOM 1968 CD GLU B 11 27.561 3.539 3.755 1.00 21.44 C ATOM 1969 OE1 GLU B 11 27.973 4.378 4.596 1.00 2.43 O ATOM 1970 OE2 GLU B 11 28.160 3.340 2.669 1.00 41.31 O ATOM 0 H GLU B 11 21.764 3.197 3.377 1.00 72.14 H new ATOM 0 HA GLU B 11 23.563 1.968 3.802 1.00 72.15 H new ATOM 0 HB2 GLU B 11 24.919 3.865 2.806 1.00 2.12 H new ATOM 0 HB3 GLU B 11 25.107 4.535 4.414 1.00 2.12 H new ATOM 0 HG2 GLU B 11 26.303 2.405 5.093 1.00 42.42 H new ATOM 0 HG3 GLU B 11 26.221 1.880 3.423 1.00 42.42 H new ATOM 1977 N LYS B 12 22.600 3.172 6.565 1.00 54.34 N ATOM 1978 CA LYS B 12 22.477 2.901 8.017 1.00 42.25 C ATOM 1979 C LYS B 12 21.905 1.492 8.244 1.00 61.31 C ATOM 1980 O LYS B 12 20.841 1.152 7.718 1.00 34.32 O ATOM 1981 CB LYS B 12 21.613 3.955 8.749 1.00 24.04 C ATOM 1982 CG LYS B 12 22.186 5.389 8.716 1.00 71.43 C ATOM 1983 CD LYS B 12 21.483 6.342 9.720 1.00 31.12 C ATOM 1984 CE LYS B 12 21.822 7.823 9.472 1.00 30.12 C ATOM 1985 NZ LYS B 12 23.274 8.102 9.578 1.00 44.32 N ATOM 0 H LYS B 12 21.876 3.782 6.186 1.00 54.34 H new ATOM 0 HA LYS B 12 23.479 2.963 8.441 1.00 42.25 H new ATOM 0 HB2 LYS B 12 20.619 3.964 8.303 1.00 24.04 H new ATOM 0 HB3 LYS B 12 21.493 3.649 9.788 1.00 24.04 H new ATOM 0 HG2 LYS B 12 23.252 5.354 8.941 1.00 71.43 H new ATOM 0 HG3 LYS B 12 22.086 5.792 7.708 1.00 71.43 H new ATOM 0 HD2 LYS B 12 20.404 6.204 9.650 1.00 31.12 H new ATOM 0 HD3 LYS B 12 21.774 6.072 10.735 1.00 31.12 H new ATOM 0 HE2 LYS B 12 21.472 8.111 8.481 1.00 30.12 H new ATOM 0 HE3 LYS B 12 21.284 8.440 10.191 1.00 30.12 H new ATOM 0 HZ1 LYS B 12 23.447 9.112 9.402 1.00 44.32 H new ATOM 0 HZ2 LYS B 12 23.606 7.854 10.532 1.00 44.32 H new ATOM 0 HZ3 LYS B 12 23.789 7.535 8.874 1.00 44.32 H new ATOM 1999 N VAL B 13 22.641 0.704 9.034 1.00 22.50 N ATOM 2000 CA VAL B 13 22.352 -0.706 9.303 1.00 33.10 C ATOM 2001 C VAL B 13 21.556 -0.839 10.613 1.00 41.41 C ATOM 2002 O VAL B 13 22.081 -0.558 11.695 1.00 65.54 O ATOM 2003 CB VAL B 13 23.705 -1.501 9.387 1.00 45.53 C ATOM 2004 CG1 VAL B 13 23.470 -2.985 9.720 1.00 43.20 C ATOM 2005 CG2 VAL B 13 24.515 -1.335 8.077 1.00 21.12 C ATOM 0 H VAL B 13 23.475 1.039 9.516 1.00 22.50 H new ATOM 0 HA VAL B 13 21.747 -1.120 8.497 1.00 33.10 H new ATOM 0 HB VAL B 13 24.292 -1.081 10.204 1.00 45.53 H new ATOM 0 HG11 VAL B 13 24.428 -3.503 9.770 1.00 43.20 H new ATOM 0 HG12 VAL B 13 22.963 -3.066 10.682 1.00 43.20 H new ATOM 0 HG13 VAL B 13 22.852 -3.438 8.945 1.00 43.20 H new ATOM 0 HG21 VAL B 13 25.449 -1.892 8.153 1.00 21.12 H new ATOM 0 HG22 VAL B 13 23.932 -1.716 7.238 1.00 21.12 H new ATOM 0 HG23 VAL B 13 24.735 -0.280 7.916 1.00 21.12 H new ATOM 2015 N PHE B 14 20.287 -1.245 10.498 1.00 10.20 N ATOM 2016 CA PHE B 14 19.381 -1.432 11.640 1.00 74.24 C ATOM 2017 C PHE B 14 19.330 -2.915 12.015 1.00 21.14 C ATOM 2018 O PHE B 14 18.597 -3.705 11.404 1.00 62.53 O ATOM 2019 CB PHE B 14 17.977 -0.871 11.294 1.00 54.01 C ATOM 2020 CG PHE B 14 18.015 0.619 10.948 1.00 40.14 C ATOM 2021 CD1 PHE B 14 18.021 1.054 9.622 1.00 41.13 C ATOM 2022 CD2 PHE B 14 18.085 1.581 11.954 1.00 22.43 C ATOM 2023 CE1 PHE B 14 18.092 2.398 9.318 1.00 12.21 C ATOM 2024 CE2 PHE B 14 18.152 2.925 11.648 1.00 55.22 C ATOM 2025 CZ PHE B 14 18.157 3.333 10.331 1.00 43.33 C ATOM 0 H PHE B 14 19.854 -1.456 9.599 1.00 10.20 H new ATOM 0 HA PHE B 14 19.750 -0.882 12.506 1.00 74.24 H new ATOM 0 HB2 PHE B 14 17.564 -1.427 10.452 1.00 54.01 H new ATOM 0 HB3 PHE B 14 17.307 -1.028 12.139 1.00 54.01 H new ATOM 0 HD1 PHE B 14 17.969 0.329 8.823 1.00 41.13 H new ATOM 0 HD2 PHE B 14 18.087 1.270 12.988 1.00 22.43 H new ATOM 0 HE1 PHE B 14 18.097 2.718 8.287 1.00 12.21 H new ATOM 0 HE2 PHE B 14 18.201 3.657 12.440 1.00 55.22 H new ATOM 0 HZ PHE B 14 18.212 4.385 10.092 1.00 43.33 H new ATOM 2035 N GLU B 15 20.163 -3.283 12.998 1.00 35.22 N ATOM 2036 CA GLU B 15 20.290 -4.663 13.478 1.00 64.12 C ATOM 2037 C GLU B 15 19.151 -4.972 14.457 1.00 45.34 C ATOM 2038 O GLU B 15 19.327 -4.911 15.679 1.00 42.30 O ATOM 2039 CB GLU B 15 21.679 -4.866 14.138 1.00 31.03 C ATOM 2040 CG GLU B 15 22.860 -4.432 13.251 1.00 33.24 C ATOM 2041 CD GLU B 15 24.225 -4.619 13.920 1.00 74.52 C ATOM 2042 OE1 GLU B 15 24.711 -5.760 13.990 1.00 3.10 O ATOM 2043 OE2 GLU B 15 24.825 -3.624 14.381 1.00 32.21 O ATOM 0 H GLU B 15 20.772 -2.625 13.485 1.00 35.22 H new ATOM 0 HA GLU B 15 20.215 -5.356 12.640 1.00 64.12 H new ATOM 0 HB2 GLU B 15 21.713 -4.304 15.071 1.00 31.03 H new ATOM 0 HB3 GLU B 15 21.798 -5.919 14.395 1.00 31.03 H new ATOM 0 HG2 GLU B 15 22.837 -5.004 12.323 1.00 33.24 H new ATOM 0 HG3 GLU B 15 22.736 -3.383 12.982 1.00 33.24 H new ATOM 2050 N ILE B 16 17.960 -5.235 13.905 1.00 41.13 N ATOM 2051 CA ILE B 16 16.747 -5.505 14.693 1.00 71.03 C ATOM 2052 C ILE B 16 16.474 -7.016 14.692 1.00 22.11 C ATOM 2053 O ILE B 16 16.964 -7.725 13.812 1.00 63.54 O ATOM 2054 CB ILE B 16 15.521 -4.683 14.117 1.00 1.32 C ATOM 2055 CG1 ILE B 16 14.291 -4.741 15.077 1.00 43.34 C ATOM 2056 CG2 ILE B 16 15.139 -5.162 12.696 1.00 34.03 C ATOM 2057 CD1 ILE B 16 13.171 -3.774 14.741 1.00 14.01 C ATOM 0 H ILE B 16 17.808 -5.267 12.897 1.00 41.13 H new ATOM 0 HA ILE B 16 16.893 -5.182 15.724 1.00 71.03 H new ATOM 0 HB ILE B 16 15.835 -3.642 14.045 1.00 1.32 H new ATOM 0 HG12 ILE B 16 13.890 -5.755 15.069 1.00 43.34 H new ATOM 0 HG13 ILE B 16 14.632 -4.540 16.093 1.00 43.34 H new ATOM 0 HG21 ILE B 16 14.295 -4.578 12.330 1.00 34.03 H new ATOM 0 HG22 ILE B 16 15.989 -5.030 12.027 1.00 34.03 H new ATOM 0 HG23 ILE B 16 14.864 -6.216 12.729 1.00 34.03 H new ATOM 0 HD11 ILE B 16 12.362 -3.889 15.463 1.00 14.01 H new ATOM 0 HD12 ILE B 16 13.549 -2.752 14.779 1.00 14.01 H new ATOM 0 HD13 ILE B 16 12.796 -3.985 13.740 1.00 14.01 H new ATOM 2069 N GLU B 17 15.713 -7.496 15.693 1.00 24.30 N ATOM 2070 CA GLU B 17 15.336 -8.913 15.815 1.00 12.15 C ATOM 2071 C GLU B 17 14.600 -9.377 14.541 1.00 12.41 C ATOM 2072 O GLU B 17 13.702 -8.677 14.053 1.00 53.22 O ATOM 2073 CB GLU B 17 14.448 -9.154 17.070 1.00 21.13 C ATOM 2074 CG GLU B 17 15.100 -8.810 18.439 1.00 43.43 C ATOM 2075 CD GLU B 17 15.192 -7.301 18.752 1.00 13.30 C ATOM 2076 OE1 GLU B 17 16.259 -6.694 18.547 1.00 4.12 O ATOM 2077 OE2 GLU B 17 14.198 -6.713 19.206 1.00 2.21 O ATOM 0 H GLU B 17 15.342 -6.909 16.441 1.00 24.30 H new ATOM 0 HA GLU B 17 16.248 -9.498 15.933 1.00 12.15 H new ATOM 0 HB2 GLU B 17 13.537 -8.565 16.965 1.00 21.13 H new ATOM 0 HB3 GLU B 17 14.150 -10.202 17.085 1.00 21.13 H new ATOM 0 HG2 GLU B 17 14.529 -9.296 19.230 1.00 43.43 H new ATOM 0 HG3 GLU B 17 16.104 -9.234 18.464 1.00 43.43 H new ATOM 2084 N LYS B 18 15.014 -10.546 14.022 1.00 63.20 N ATOM 2085 CA LYS B 18 14.488 -11.121 12.773 1.00 62.41 C ATOM 2086 C LYS B 18 12.970 -11.336 12.847 1.00 22.45 C ATOM 2087 O LYS B 18 12.265 -11.130 11.868 1.00 2.32 O ATOM 2088 CB LYS B 18 15.189 -12.468 12.475 1.00 12.44 C ATOM 2089 CG LYS B 18 14.790 -13.104 11.119 1.00 61.25 C ATOM 2090 CD LYS B 18 15.218 -14.583 11.002 1.00 24.45 C ATOM 2091 CE LYS B 18 14.491 -15.482 12.022 1.00 54.40 C ATOM 2092 NZ LYS B 18 14.900 -16.903 11.901 1.00 22.02 N ATOM 0 H LYS B 18 15.730 -11.123 14.463 1.00 63.20 H new ATOM 0 HA LYS B 18 14.692 -10.413 11.969 1.00 62.41 H new ATOM 0 HB2 LYS B 18 16.268 -12.314 12.488 1.00 12.44 H new ATOM 0 HB3 LYS B 18 14.957 -13.171 13.276 1.00 12.44 H new ATOM 0 HG2 LYS B 18 13.710 -13.032 10.993 1.00 61.25 H new ATOM 0 HG3 LYS B 18 15.244 -12.534 10.308 1.00 61.25 H new ATOM 0 HD2 LYS B 18 15.012 -14.940 9.993 1.00 24.45 H new ATOM 0 HD3 LYS B 18 16.295 -14.661 11.154 1.00 24.45 H new ATOM 0 HE2 LYS B 18 14.702 -15.129 13.031 1.00 54.40 H new ATOM 0 HE3 LYS B 18 13.414 -15.401 11.874 1.00 54.40 H new ATOM 0 HZ1 LYS B 18 14.388 -17.473 12.604 1.00 22.02 H new ATOM 0 HZ2 LYS B 18 14.676 -17.249 10.946 1.00 22.02 H new ATOM 0 HZ3 LYS B 18 15.923 -16.985 12.068 1.00 22.02 H new ATOM 2106 N GLU B 19 12.499 -11.731 14.038 1.00 4.12 N ATOM 2107 CA GLU B 19 11.067 -11.965 14.324 1.00 54.13 C ATOM 2108 C GLU B 19 10.211 -10.693 14.113 1.00 22.10 C ATOM 2109 O GLU B 19 9.028 -10.781 13.763 1.00 62.52 O ATOM 2110 CB GLU B 19 10.919 -12.517 15.765 1.00 1.02 C ATOM 2111 CG GLU B 19 11.616 -11.669 16.852 1.00 53.12 C ATOM 2112 CD GLU B 19 11.698 -12.380 18.212 1.00 3.41 C ATOM 2113 OE1 GLU B 19 10.852 -12.108 19.093 1.00 65.52 O ATOM 2114 OE2 GLU B 19 12.596 -13.240 18.391 1.00 11.23 O ATOM 0 H GLU B 19 13.104 -11.900 14.842 1.00 4.12 H new ATOM 0 HA GLU B 19 10.689 -12.702 13.615 1.00 54.13 H new ATOM 0 HB2 GLU B 19 9.858 -12.591 16.005 1.00 1.02 H new ATOM 0 HB3 GLU B 19 11.324 -13.528 15.796 1.00 1.02 H new ATOM 0 HG2 GLU B 19 12.623 -11.419 16.519 1.00 53.12 H new ATOM 0 HG3 GLU B 19 11.077 -10.729 16.972 1.00 53.12 H new ATOM 2121 N ILE B 20 10.826 -9.522 14.325 1.00 51.43 N ATOM 2122 CA ILE B 20 10.187 -8.216 14.081 1.00 34.31 C ATOM 2123 C ILE B 20 10.264 -7.868 12.576 1.00 52.20 C ATOM 2124 O ILE B 20 9.334 -7.288 12.010 1.00 54.31 O ATOM 2125 CB ILE B 20 10.857 -7.089 14.946 1.00 23.02 C ATOM 2126 CG1 ILE B 20 10.890 -7.507 16.454 1.00 52.45 C ATOM 2127 CG2 ILE B 20 10.130 -5.738 14.754 1.00 11.41 C ATOM 2128 CD1 ILE B 20 11.504 -6.484 17.391 1.00 14.10 C ATOM 0 H ILE B 20 11.783 -9.450 14.671 1.00 51.43 H new ATOM 0 HA ILE B 20 9.140 -8.281 14.377 1.00 34.31 H new ATOM 0 HB ILE B 20 11.885 -6.959 14.607 1.00 23.02 H new ATOM 0 HG12 ILE B 20 9.870 -7.711 16.781 1.00 52.45 H new ATOM 0 HG13 ILE B 20 11.446 -8.440 16.545 1.00 52.45 H new ATOM 0 HG21 ILE B 20 10.614 -4.975 15.364 1.00 11.41 H new ATOM 0 HG22 ILE B 20 10.175 -5.446 13.705 1.00 11.41 H new ATOM 0 HG23 ILE B 20 9.088 -5.839 15.058 1.00 11.41 H new ATOM 0 HD11 ILE B 20 11.481 -6.865 18.412 1.00 14.10 H new ATOM 0 HD12 ILE B 20 12.537 -6.295 17.098 1.00 14.10 H new ATOM 0 HD13 ILE B 20 10.936 -5.555 17.338 1.00 14.10 H new ATOM 2140 N ALA B 21 11.389 -8.235 11.947 1.00 5.22 N ATOM 2141 CA ALA B 21 11.582 -8.086 10.486 1.00 10.34 C ATOM 2142 C ALA B 21 10.706 -9.075 9.680 1.00 74.43 C ATOM 2143 O ALA B 21 10.538 -8.912 8.473 1.00 34.55 O ATOM 2144 CB ALA B 21 13.061 -8.273 10.133 1.00 62.10 C ATOM 0 H ALA B 21 12.191 -8.642 12.428 1.00 5.22 H new ATOM 0 HA ALA B 21 11.268 -7.079 10.211 1.00 10.34 H new ATOM 0 HB1 ALA B 21 13.195 -8.162 9.057 1.00 62.10 H new ATOM 0 HB2 ALA B 21 13.657 -7.522 10.652 1.00 62.10 H new ATOM 0 HB3 ALA B 21 13.385 -9.268 10.438 1.00 62.10 H new ATOM 2150 N CYS B 22 10.182 -10.114 10.363 1.00 25.21 N ATOM 2151 CA CYS B 22 9.220 -11.062 9.780 1.00 3.12 C ATOM 2152 C CYS B 22 7.831 -10.408 9.644 1.00 41.20 C ATOM 2153 O CYS B 22 7.066 -10.767 8.742 1.00 30.12 O ATOM 2154 CB CYS B 22 9.139 -12.345 10.635 1.00 20.14 C ATOM 2155 SG CYS B 22 10.683 -13.290 10.706 1.00 3.53 S ATOM 0 H CYS B 22 10.417 -10.316 11.335 1.00 25.21 H new ATOM 0 HA CYS B 22 9.566 -11.337 8.784 1.00 3.12 H new ATOM 0 HB2 CYS B 22 8.845 -12.074 11.649 1.00 20.14 H new ATOM 0 HB3 CYS B 22 8.353 -12.985 10.235 1.00 20.14 H new ATOM 0 HG CYS B 22 11.619 -12.553 11.226 1.00 3.53 H new ATOM 2161 N MET B 23 7.528 -9.437 10.546 1.00 62.04 N ATOM 2162 CA MET B 23 6.287 -8.612 10.481 1.00 52.45 C ATOM 2163 C MET B 23 6.255 -7.815 9.165 1.00 24.50 C ATOM 2164 O MET B 23 5.189 -7.546 8.600 1.00 61.45 O ATOM 2165 CB MET B 23 6.202 -7.645 11.695 1.00 53.21 C ATOM 2166 CG MET B 23 6.253 -8.329 13.067 1.00 23.53 C ATOM 2167 SD MET B 23 6.206 -7.161 14.447 1.00 74.10 S ATOM 2168 CE MET B 23 4.598 -6.388 14.238 1.00 13.41 C ATOM 0 H MET B 23 8.131 -9.203 11.335 1.00 62.04 H new ATOM 0 HA MET B 23 5.426 -9.280 10.516 1.00 52.45 H new ATOM 0 HB2 MET B 23 7.022 -6.930 11.630 1.00 53.21 H new ATOM 0 HB3 MET B 23 5.276 -7.075 11.623 1.00 53.21 H new ATOM 0 HG2 MET B 23 5.413 -9.018 13.154 1.00 23.53 H new ATOM 0 HG3 MET B 23 7.163 -8.925 13.135 1.00 23.53 H new ATOM 0 HE1 MET B 23 4.194 -6.119 15.214 1.00 13.41 H new ATOM 0 HE2 MET B 23 4.702 -5.490 13.629 1.00 13.41 H new ATOM 0 HE3 MET B 23 3.921 -7.085 13.744 1.00 13.41 H new ATOM 2178 N SER B 24 7.456 -7.429 8.715 1.00 10.11 N ATOM 2179 CA SER B 24 7.686 -6.950 7.358 1.00 21.13 C ATOM 2180 C SER B 24 7.630 -8.158 6.405 1.00 30.23 C ATOM 2181 O SER B 24 8.555 -8.972 6.388 1.00 23.10 O ATOM 2182 CB SER B 24 9.052 -6.233 7.275 1.00 62.24 C ATOM 2183 OG SER B 24 9.316 -5.789 5.959 1.00 75.13 O ATOM 0 H SER B 24 8.297 -7.443 9.291 1.00 10.11 H new ATOM 0 HA SER B 24 6.920 -6.229 7.071 1.00 21.13 H new ATOM 0 HB2 SER B 24 9.062 -5.383 7.957 1.00 62.24 H new ATOM 0 HB3 SER B 24 9.842 -6.911 7.599 1.00 62.24 H new ATOM 0 HG SER B 24 8.477 -5.742 5.455 1.00 75.13 H new ATOM 2189 N VAL B 25 6.528 -8.278 5.638 1.00 63.23 N ATOM 2190 CA VAL B 25 6.271 -9.461 4.798 1.00 1.03 C ATOM 2191 C VAL B 25 7.285 -9.566 3.637 1.00 72.01 C ATOM 2192 O VAL B 25 7.711 -10.667 3.307 1.00 54.31 O ATOM 2193 CB VAL B 25 4.788 -9.488 4.266 1.00 0.01 C ATOM 2194 CG1 VAL B 25 4.497 -10.726 3.380 1.00 1.24 C ATOM 2195 CG2 VAL B 25 3.782 -9.401 5.448 1.00 53.31 C ATOM 0 H VAL B 25 5.800 -7.566 5.584 1.00 63.23 H new ATOM 0 HA VAL B 25 6.406 -10.338 5.432 1.00 1.03 H new ATOM 0 HB VAL B 25 4.660 -8.612 3.630 1.00 0.01 H new ATOM 0 HG11 VAL B 25 3.462 -10.695 3.040 1.00 1.24 H new ATOM 0 HG12 VAL B 25 5.163 -10.720 2.517 1.00 1.24 H new ATOM 0 HG13 VAL B 25 4.662 -11.635 3.959 1.00 1.24 H new ATOM 0 HG21 VAL B 25 2.763 -9.421 5.061 1.00 53.31 H new ATOM 0 HG22 VAL B 25 3.933 -10.248 6.117 1.00 53.31 H new ATOM 0 HG23 VAL B 25 3.944 -8.473 5.996 1.00 53.31 H new ATOM 2205 N THR B 26 7.690 -8.418 3.054 1.00 32.54 N ATOM 2206 CA THR B 26 8.705 -8.382 1.972 1.00 73.41 C ATOM 2207 C THR B 26 10.083 -8.879 2.467 1.00 74.54 C ATOM 2208 O THR B 26 10.692 -9.739 1.821 1.00 11.41 O ATOM 2209 CB THR B 26 8.855 -6.952 1.350 1.00 34.23 C ATOM 2210 OG1 THR B 26 7.605 -6.534 0.791 1.00 23.02 O ATOM 2211 CG2 THR B 26 9.930 -6.883 0.248 1.00 11.43 C ATOM 0 H THR B 26 7.330 -7.500 3.313 1.00 32.54 H new ATOM 0 HA THR B 26 8.344 -9.057 1.196 1.00 73.41 H new ATOM 0 HB THR B 26 9.165 -6.293 2.161 1.00 34.23 H new ATOM 0 HG1 THR B 26 7.654 -5.584 0.555 1.00 23.02 H new ATOM 0 HG21 THR B 26 9.986 -5.867 -0.143 1.00 11.43 H new ATOM 0 HG22 THR B 26 10.897 -7.165 0.665 1.00 11.43 H new ATOM 0 HG23 THR B 26 9.669 -7.568 -0.558 1.00 11.43 H new ATOM 2219 N ILE B 27 10.556 -8.344 3.615 1.00 35.21 N ATOM 2220 CA ILE B 27 11.862 -8.732 4.205 1.00 3.21 C ATOM 2221 C ILE B 27 11.844 -10.226 4.589 1.00 31.02 C ATOM 2222 O ILE B 27 12.813 -10.951 4.336 1.00 25.40 O ATOM 2223 CB ILE B 27 12.224 -7.842 5.457 1.00 14.33 C ATOM 2224 CG1 ILE B 27 12.405 -6.348 5.031 1.00 23.31 C ATOM 2225 CG2 ILE B 27 13.488 -8.367 6.195 1.00 32.41 C ATOM 2226 CD1 ILE B 27 12.699 -5.394 6.176 1.00 30.31 C ATOM 0 H ILE B 27 10.053 -7.640 4.155 1.00 35.21 H new ATOM 0 HA ILE B 27 12.634 -8.565 3.453 1.00 3.21 H new ATOM 0 HB ILE B 27 11.393 -7.906 6.159 1.00 14.33 H new ATOM 0 HG12 ILE B 27 13.217 -6.286 4.307 1.00 23.31 H new ATOM 0 HG13 ILE B 27 11.499 -6.017 4.523 1.00 23.31 H new ATOM 0 HG21 ILE B 27 13.702 -7.726 7.050 1.00 32.41 H new ATOM 0 HG22 ILE B 27 13.311 -9.386 6.540 1.00 32.41 H new ATOM 0 HG23 ILE B 27 14.338 -8.358 5.513 1.00 32.41 H new ATOM 0 HD11 ILE B 27 12.809 -4.382 5.787 1.00 30.31 H new ATOM 0 HD12 ILE B 27 11.877 -5.420 6.892 1.00 30.31 H new ATOM 0 HD13 ILE B 27 13.622 -5.694 6.672 1.00 30.31 H new ATOM 2238 N LYS B 28 10.714 -10.657 5.175 1.00 74.03 N ATOM 2239 CA LYS B 28 10.437 -12.071 5.499 1.00 65.24 C ATOM 2240 C LYS B 28 10.573 -12.945 4.233 1.00 70.35 C ATOM 2241 O LYS B 28 11.312 -13.932 4.226 1.00 51.41 O ATOM 2242 CB LYS B 28 9.003 -12.196 6.086 1.00 34.11 C ATOM 2243 CG LYS B 28 8.585 -13.622 6.515 1.00 10.44 C ATOM 2244 CD LYS B 28 7.080 -13.738 6.858 1.00 4.04 C ATOM 2245 CE LYS B 28 6.162 -13.406 5.665 1.00 42.13 C ATOM 2246 NZ LYS B 28 6.420 -14.275 4.482 1.00 63.45 N ATOM 0 H LYS B 28 9.957 -10.027 5.441 1.00 74.03 H new ATOM 0 HA LYS B 28 11.159 -12.418 6.238 1.00 65.24 H new ATOM 0 HB2 LYS B 28 8.924 -11.537 6.950 1.00 34.11 H new ATOM 0 HB3 LYS B 28 8.292 -11.835 5.343 1.00 34.11 H new ATOM 0 HG2 LYS B 28 8.823 -14.320 5.713 1.00 10.44 H new ATOM 0 HG3 LYS B 28 9.173 -13.921 7.383 1.00 10.44 H new ATOM 0 HD2 LYS B 28 6.868 -14.751 7.201 1.00 4.04 H new ATOM 0 HD3 LYS B 28 6.849 -13.066 7.685 1.00 4.04 H new ATOM 0 HE2 LYS B 28 5.122 -13.515 5.971 1.00 42.13 H new ATOM 0 HE3 LYS B 28 6.303 -12.363 5.382 1.00 42.13 H new ATOM 0 HZ1 LYS B 28 6.668 -13.683 3.664 1.00 63.45 H new ATOM 0 HZ2 LYS B 28 7.206 -14.923 4.692 1.00 63.45 H new ATOM 0 HZ3 LYS B 28 5.566 -14.827 4.264 1.00 63.45 H new ATOM 2260 N ASN B 29 9.894 -12.505 3.147 1.00 31.04 N ATOM 2261 CA ASN B 29 9.873 -13.217 1.849 1.00 14.32 C ATOM 2262 C ASN B 29 11.273 -13.259 1.219 1.00 50.41 C ATOM 2263 O ASN B 29 11.594 -14.215 0.531 1.00 31.20 O ATOM 2264 CB ASN B 29 8.863 -12.568 0.844 1.00 61.22 C ATOM 2265 CG ASN B 29 7.382 -12.785 1.200 1.00 10.52 C ATOM 2266 OD1 ASN B 29 7.021 -13.765 1.851 1.00 65.44 O ATOM 2267 ND2 ASN B 29 6.513 -11.877 0.758 1.00 64.23 N ATOM 0 H ASN B 29 9.345 -11.645 3.147 1.00 31.04 H new ATOM 0 HA ASN B 29 9.544 -14.235 2.055 1.00 14.32 H new ATOM 0 HB2 ASN B 29 9.058 -11.497 0.793 1.00 61.22 H new ATOM 0 HB3 ASN B 29 9.048 -12.974 -0.151 1.00 61.22 H new ATOM 0 HD21 ASN B 29 5.518 -11.984 0.957 1.00 64.23 H new ATOM 0 HD22 ASN B 29 6.842 -11.075 0.221 1.00 64.23 H new ATOM 2274 N MET B 30 12.090 -12.210 1.460 1.00 70.00 N ATOM 2275 CA MET B 30 13.487 -12.140 0.967 1.00 12.51 C ATOM 2276 C MET B 30 14.343 -13.238 1.623 1.00 34.44 C ATOM 2277 O MET B 30 15.042 -13.985 0.931 1.00 74.02 O ATOM 2278 CB MET B 30 14.126 -10.740 1.239 1.00 44.24 C ATOM 2279 CG MET B 30 13.586 -9.592 0.374 1.00 33.20 C ATOM 2280 SD MET B 30 14.385 -8.012 0.755 1.00 35.12 S ATOM 2281 CE MET B 30 13.630 -6.918 -0.450 1.00 51.14 C ATOM 0 H MET B 30 11.804 -11.392 1.998 1.00 70.00 H new ATOM 0 HA MET B 30 13.460 -12.296 -0.111 1.00 12.51 H new ATOM 0 HB2 MET B 30 13.972 -10.486 2.288 1.00 44.24 H new ATOM 0 HB3 MET B 30 15.202 -10.814 1.084 1.00 44.24 H new ATOM 0 HG2 MET B 30 13.739 -9.830 -0.679 1.00 33.20 H new ATOM 0 HG3 MET B 30 12.511 -9.499 0.527 1.00 33.20 H new ATOM 0 HE1 MET B 30 14.407 -6.359 -0.971 1.00 51.14 H new ATOM 0 HE2 MET B 30 13.062 -7.507 -1.170 1.00 51.14 H new ATOM 0 HE3 MET B 30 12.962 -6.223 0.058 1.00 51.14 H new ATOM 2291 N ILE B 31 14.249 -13.330 2.963 1.00 32.22 N ATOM 2292 CA ILE B 31 15.012 -14.302 3.772 1.00 53.54 C ATOM 2293 C ILE B 31 14.638 -15.752 3.376 1.00 54.02 C ATOM 2294 O ILE B 31 15.510 -16.618 3.276 1.00 44.41 O ATOM 2295 CB ILE B 31 14.781 -14.062 5.319 1.00 13.41 C ATOM 2296 CG1 ILE B 31 15.211 -12.606 5.719 1.00 15.31 C ATOM 2297 CG2 ILE B 31 15.537 -15.114 6.176 1.00 52.54 C ATOM 2298 CD1 ILE B 31 14.933 -12.228 7.165 1.00 52.43 C ATOM 0 H ILE B 31 13.639 -12.730 3.518 1.00 32.22 H new ATOM 0 HA ILE B 31 16.072 -14.154 3.568 1.00 53.54 H new ATOM 0 HB ILE B 31 13.716 -14.178 5.520 1.00 13.41 H new ATOM 0 HG12 ILE B 31 16.278 -12.493 5.529 1.00 15.31 H new ATOM 0 HG13 ILE B 31 14.695 -11.899 5.069 1.00 15.31 H new ATOM 0 HG21 ILE B 31 15.357 -14.920 7.233 1.00 52.54 H new ATOM 0 HG22 ILE B 31 15.180 -16.113 5.925 1.00 52.54 H new ATOM 0 HG23 ILE B 31 16.606 -15.049 5.972 1.00 52.54 H new ATOM 0 HD11 ILE B 31 15.265 -11.205 7.344 1.00 52.43 H new ATOM 0 HD12 ILE B 31 13.863 -12.302 7.361 1.00 52.43 H new ATOM 0 HD13 ILE B 31 15.471 -12.905 7.828 1.00 52.43 H new ATOM 2310 N GLU B 32 13.334 -15.974 3.119 1.00 2.53 N ATOM 2311 CA GLU B 32 12.791 -17.298 2.731 1.00 12.45 C ATOM 2312 C GLU B 32 13.149 -17.657 1.277 1.00 31.30 C ATOM 2313 O GLU B 32 13.370 -18.834 0.959 1.00 22.43 O ATOM 2314 CB GLU B 32 11.251 -17.312 2.911 1.00 14.05 C ATOM 2315 CG GLU B 32 10.788 -17.038 4.349 1.00 12.33 C ATOM 2316 CD GLU B 32 9.264 -16.876 4.477 1.00 71.44 C ATOM 2317 OE1 GLU B 32 8.716 -15.901 3.917 1.00 3.30 O ATOM 2318 OE2 GLU B 32 8.611 -17.701 5.154 1.00 54.15 O ATOM 0 H GLU B 32 12.625 -15.243 3.174 1.00 2.53 H new ATOM 0 HA GLU B 32 13.244 -18.046 3.382 1.00 12.45 H new ATOM 0 HB2 GLU B 32 10.811 -16.565 2.250 1.00 14.05 H new ATOM 0 HB3 GLU B 32 10.867 -18.282 2.595 1.00 14.05 H new ATOM 0 HG2 GLU B 32 11.115 -17.856 4.991 1.00 12.33 H new ATOM 0 HG3 GLU B 32 11.274 -16.133 4.714 1.00 12.33 H new ATOM 2325 N ASP B 33 13.179 -16.633 0.401 1.00 23.12 N ATOM 2326 CA ASP B 33 13.451 -16.798 -1.051 1.00 13.53 C ATOM 2327 C ASP B 33 14.920 -17.180 -1.286 1.00 24.42 C ATOM 2328 O ASP B 33 15.233 -18.010 -2.146 1.00 14.22 O ATOM 2329 CB ASP B 33 13.082 -15.496 -1.814 1.00 74.32 C ATOM 2330 CG ASP B 33 13.260 -15.590 -3.340 1.00 20.50 C ATOM 2331 OD1 ASP B 33 12.476 -16.314 -3.996 1.00 33.34 O ATOM 2332 OD2 ASP B 33 14.173 -14.933 -3.892 1.00 63.35 O ATOM 0 H ASP B 33 13.016 -15.664 0.676 1.00 23.12 H new ATOM 0 HA ASP B 33 12.831 -17.608 -1.436 1.00 13.53 H new ATOM 0 HB2 ASP B 33 12.045 -15.241 -1.595 1.00 74.32 H new ATOM 0 HB3 ASP B 33 13.698 -14.680 -1.437 1.00 74.32 H new ATOM 2337 N ILE B 34 15.808 -16.552 -0.506 1.00 10.03 N ATOM 2338 CA ILE B 34 17.241 -16.900 -0.457 1.00 60.21 C ATOM 2339 C ILE B 34 17.432 -18.217 0.333 1.00 51.43 C ATOM 2340 O ILE B 34 18.377 -18.975 0.090 1.00 52.44 O ATOM 2341 CB ILE B 34 18.077 -15.734 0.206 1.00 13.53 C ATOM 2342 CG1 ILE B 34 17.883 -14.399 -0.591 1.00 54.32 C ATOM 2343 CG2 ILE B 34 19.582 -16.097 0.319 1.00 1.33 C ATOM 2344 CD1 ILE B 34 18.576 -13.183 0.010 1.00 61.40 C ATOM 0 H ILE B 34 15.555 -15.783 0.114 1.00 10.03 H new ATOM 0 HA ILE B 34 17.603 -17.039 -1.476 1.00 60.21 H new ATOM 0 HB ILE B 34 17.702 -15.592 1.219 1.00 13.53 H new ATOM 0 HG12 ILE B 34 18.251 -14.543 -1.607 1.00 54.32 H new ATOM 0 HG13 ILE B 34 16.816 -14.190 -0.666 1.00 54.32 H new ATOM 0 HG21 ILE B 34 20.122 -15.270 0.780 1.00 1.33 H new ATOM 0 HG22 ILE B 34 19.696 -16.991 0.932 1.00 1.33 H new ATOM 0 HG23 ILE B 34 19.987 -16.285 -0.675 1.00 1.33 H new ATOM 0 HD11 ILE B 34 18.383 -12.309 -0.613 1.00 61.40 H new ATOM 0 HD12 ILE B 34 18.192 -13.005 1.014 1.00 61.40 H new ATOM 0 HD13 ILE B 34 19.650 -13.363 0.059 1.00 61.40 H new ATOM 2356 N GLY B 35 16.508 -18.473 1.276 1.00 3.22 N ATOM 2357 CA GLY B 35 16.548 -19.658 2.135 1.00 74.10 C ATOM 2358 C GLY B 35 17.112 -19.318 3.499 1.00 63.03 C ATOM 2359 O GLY B 35 16.451 -19.505 4.529 1.00 11.23 O ATOM 0 H GLY B 35 15.714 -17.860 1.460 1.00 3.22 H new ATOM 0 HA2 GLY B 35 15.544 -20.067 2.244 1.00 74.10 H new ATOM 0 HA3 GLY B 35 17.158 -20.431 1.667 1.00 74.10 H new ATOM 2363 N GLU B 36 18.347 -18.795 3.490 1.00 43.14 N ATOM 2364 CA GLU B 36 19.070 -18.337 4.689 1.00 21.50 C ATOM 2365 C GLU B 36 19.751 -16.999 4.351 1.00 54.11 C ATOM 2366 O GLU B 36 20.500 -16.926 3.366 1.00 43.32 O ATOM 2367 CB GLU B 36 20.148 -19.381 5.105 1.00 51.42 C ATOM 2368 CG GLU B 36 19.615 -20.789 5.437 1.00 62.31 C ATOM 2369 CD GLU B 36 20.728 -21.790 5.786 1.00 21.03 C ATOM 2370 OE1 GLU B 36 20.981 -22.026 6.990 1.00 34.01 O ATOM 2371 OE2 GLU B 36 21.366 -22.335 4.857 1.00 73.02 O ATOM 0 H GLU B 36 18.884 -18.675 2.631 1.00 43.14 H new ATOM 0 HA GLU B 36 18.373 -18.216 5.518 1.00 21.50 H new ATOM 0 HB2 GLU B 36 20.875 -19.468 4.298 1.00 51.42 H new ATOM 0 HB3 GLU B 36 20.682 -18.999 5.975 1.00 51.42 H new ATOM 0 HG2 GLU B 36 18.921 -20.720 6.275 1.00 62.31 H new ATOM 0 HG3 GLU B 36 19.049 -21.167 4.585 1.00 62.31 H new ATOM 2378 N SER B 37 19.490 -15.939 5.145 1.00 62.31 N ATOM 2379 CA SER B 37 20.072 -14.598 4.910 1.00 11.52 C ATOM 2380 C SER B 37 20.749 -14.062 6.186 1.00 50.14 C ATOM 2381 O SER B 37 20.147 -13.294 6.951 1.00 23.43 O ATOM 2382 CB SER B 37 18.980 -13.622 4.406 1.00 74.25 C ATOM 2383 OG SER B 37 18.352 -14.124 3.241 1.00 30.41 O ATOM 0 H SER B 37 18.877 -15.986 5.959 1.00 62.31 H new ATOM 0 HA SER B 37 20.839 -14.682 4.140 1.00 11.52 H new ATOM 0 HB2 SER B 37 18.236 -13.468 5.187 1.00 74.25 H new ATOM 0 HB3 SER B 37 19.425 -12.650 4.194 1.00 74.25 H new ATOM 0 HG SER B 37 19.035 -14.389 2.590 1.00 30.41 H new ATOM 2389 N ASP B 38 21.992 -14.522 6.427 1.00 51.34 N ATOM 2390 CA ASP B 38 22.832 -14.041 7.545 1.00 23.54 C ATOM 2391 C ASP B 38 23.484 -12.695 7.177 1.00 1.41 C ATOM 2392 O ASP B 38 23.698 -11.840 8.040 1.00 31.24 O ATOM 2393 CB ASP B 38 23.918 -15.091 7.896 1.00 51.50 C ATOM 2394 CG ASP B 38 24.780 -14.707 9.118 1.00 12.44 C ATOM 2395 OD1 ASP B 38 25.969 -14.352 8.950 1.00 0.24 O ATOM 2396 OD2 ASP B 38 24.264 -14.763 10.257 1.00 72.14 O ATOM 0 H ASP B 38 22.443 -15.236 5.855 1.00 51.34 H new ATOM 0 HA ASP B 38 22.199 -13.895 8.420 1.00 23.54 H new ATOM 0 HB2 ASP B 38 23.436 -16.049 8.089 1.00 51.50 H new ATOM 0 HB3 ASP B 38 24.569 -15.230 7.033 1.00 51.50 H new ATOM 2401 N SER B 39 23.788 -12.535 5.879 1.00 44.24 N ATOM 2402 CA SER B 39 24.398 -11.314 5.326 1.00 53.52 C ATOM 2403 C SER B 39 23.444 -10.104 5.478 1.00 14.23 C ATOM 2404 O SER B 39 22.221 -10.285 5.376 1.00 15.11 O ATOM 2405 CB SER B 39 24.749 -11.549 3.840 1.00 33.52 C ATOM 2406 OG SER B 39 25.578 -12.691 3.682 1.00 63.15 O ATOM 0 H SER B 39 23.616 -13.255 5.178 1.00 44.24 H new ATOM 0 HA SER B 39 25.309 -11.087 5.880 1.00 53.52 H new ATOM 0 HB2 SER B 39 23.833 -11.679 3.264 1.00 33.52 H new ATOM 0 HB3 SER B 39 25.256 -10.671 3.440 1.00 33.52 H new ATOM 0 HG SER B 39 25.783 -12.817 2.732 1.00 63.15 H new ATOM 2412 N PRO B 40 23.986 -8.857 5.736 1.00 50.21 N ATOM 2413 CA PRO B 40 23.157 -7.629 5.862 1.00 12.14 C ATOM 2414 C PRO B 40 22.214 -7.430 4.655 1.00 52.32 C ATOM 2415 O PRO B 40 22.680 -7.372 3.517 1.00 61.51 O ATOM 2416 CB PRO B 40 24.218 -6.492 5.958 1.00 3.32 C ATOM 2417 CG PRO B 40 25.434 -7.158 6.526 1.00 52.51 C ATOM 2418 CD PRO B 40 25.435 -8.557 5.943 1.00 35.25 C ATOM 0 HA PRO B 40 22.487 -7.664 6.721 1.00 12.14 H new ATOM 0 HB2 PRO B 40 24.424 -6.058 4.979 1.00 3.32 H new ATOM 0 HB3 PRO B 40 23.874 -5.681 6.600 1.00 3.32 H new ATOM 0 HG2 PRO B 40 26.341 -6.618 6.254 1.00 52.51 H new ATOM 0 HG3 PRO B 40 25.394 -7.186 7.615 1.00 52.51 H new ATOM 0 HD2 PRO B 40 25.990 -8.600 5.006 1.00 35.25 H new ATOM 0 HD3 PRO B 40 25.899 -9.273 6.621 1.00 35.25 H new ATOM 2426 N ILE B 41 20.895 -7.380 4.926 1.00 51.52 N ATOM 2427 CA ILE B 41 19.861 -7.217 3.889 1.00 52.51 C ATOM 2428 C ILE B 41 19.864 -5.742 3.409 1.00 33.32 C ATOM 2429 O ILE B 41 19.532 -4.846 4.193 1.00 74.41 O ATOM 2430 CB ILE B 41 18.413 -7.622 4.409 1.00 75.15 C ATOM 2431 CG1 ILE B 41 18.325 -9.145 4.834 1.00 43.11 C ATOM 2432 CG2 ILE B 41 17.315 -7.292 3.350 1.00 54.23 C ATOM 2433 CD1 ILE B 41 18.978 -9.511 6.165 1.00 4.12 C ATOM 0 H ILE B 41 20.518 -7.452 5.871 1.00 51.52 H new ATOM 0 HA ILE B 41 20.097 -7.888 3.063 1.00 52.51 H new ATOM 0 HB ILE B 41 18.230 -7.022 5.301 1.00 75.15 H new ATOM 0 HG12 ILE B 41 17.273 -9.428 4.879 1.00 43.11 H new ATOM 0 HG13 ILE B 41 18.784 -9.747 4.050 1.00 43.11 H new ATOM 0 HG21 ILE B 41 16.338 -7.581 3.737 1.00 54.23 H new ATOM 0 HG22 ILE B 41 17.321 -6.222 3.141 1.00 54.23 H new ATOM 0 HG23 ILE B 41 17.519 -7.842 2.431 1.00 54.23 H new ATOM 0 HD11 ILE B 41 18.854 -10.578 6.350 1.00 4.12 H new ATOM 0 HD12 ILE B 41 20.040 -9.270 6.128 1.00 4.12 H new ATOM 0 HD13 ILE B 41 18.506 -8.947 6.969 1.00 4.12 H new ATOM 2445 N PRO B 42 20.279 -5.460 2.129 1.00 42.14 N ATOM 2446 CA PRO B 42 20.267 -4.098 1.572 1.00 4.32 C ATOM 2447 C PRO B 42 18.885 -3.751 0.978 1.00 2.40 C ATOM 2448 O PRO B 42 18.344 -4.484 0.133 1.00 31.44 O ATOM 2449 CB PRO B 42 21.369 -4.165 0.490 1.00 24.43 C ATOM 2450 CG PRO B 42 21.355 -5.588 -0.001 1.00 40.40 C ATOM 2451 CD PRO B 42 20.780 -6.444 1.125 1.00 51.41 C ATOM 0 HA PRO B 42 20.449 -3.319 2.312 1.00 4.32 H new ATOM 0 HB2 PRO B 42 21.167 -3.466 -0.322 1.00 24.43 H new ATOM 0 HB3 PRO B 42 22.343 -3.901 0.903 1.00 24.43 H new ATOM 0 HG2 PRO B 42 20.749 -5.679 -0.902 1.00 40.40 H new ATOM 0 HG3 PRO B 42 22.362 -5.917 -0.259 1.00 40.40 H new ATOM 0 HD2 PRO B 42 19.976 -7.086 0.764 1.00 51.41 H new ATOM 0 HD3 PRO B 42 21.540 -7.096 1.555 1.00 51.41 H new ATOM 2459 N LEU B 43 18.306 -2.652 1.452 1.00 74.41 N ATOM 2460 CA LEU B 43 17.020 -2.137 0.970 1.00 75.23 C ATOM 2461 C LEU B 43 17.295 -0.855 0.154 1.00 75.12 C ATOM 2462 O LEU B 43 17.419 0.230 0.731 1.00 15.51 O ATOM 2463 CB LEU B 43 16.074 -1.883 2.178 1.00 3.24 C ATOM 2464 CG LEU B 43 15.715 -3.144 3.039 1.00 44.23 C ATOM 2465 CD1 LEU B 43 14.918 -2.755 4.305 1.00 23.41 C ATOM 2466 CD2 LEU B 43 14.962 -4.207 2.199 1.00 61.24 C ATOM 0 H LEU B 43 18.719 -2.084 2.191 1.00 74.41 H new ATOM 0 HA LEU B 43 16.519 -2.857 0.323 1.00 75.23 H new ATOM 0 HB2 LEU B 43 16.537 -1.142 2.829 1.00 3.24 H new ATOM 0 HB3 LEU B 43 15.148 -1.445 1.805 1.00 3.24 H new ATOM 0 HG LEU B 43 16.652 -3.593 3.369 1.00 44.23 H new ATOM 0 HD11 LEU B 43 14.686 -3.652 4.879 1.00 23.41 H new ATOM 0 HD12 LEU B 43 15.514 -2.078 4.916 1.00 23.41 H new ATOM 0 HD13 LEU B 43 13.991 -2.260 4.014 1.00 23.41 H new ATOM 0 HD21 LEU B 43 14.728 -5.067 2.826 1.00 61.24 H new ATOM 0 HD22 LEU B 43 14.037 -3.778 1.813 1.00 61.24 H new ATOM 0 HD23 LEU B 43 15.590 -4.524 1.366 1.00 61.24 H new ATOM 2478 N PRO B 44 17.443 -0.973 -1.216 1.00 34.53 N ATOM 2479 CA PRO B 44 17.879 0.149 -2.093 1.00 34.31 C ATOM 2480 C PRO B 44 16.817 1.260 -2.282 1.00 5.14 C ATOM 2481 O PRO B 44 17.097 2.266 -2.942 1.00 62.41 O ATOM 2482 CB PRO B 44 18.191 -0.564 -3.434 1.00 11.44 C ATOM 2483 CG PRO B 44 17.253 -1.727 -3.451 1.00 74.34 C ATOM 2484 CD PRO B 44 17.208 -2.211 -2.020 1.00 44.11 C ATOM 0 HA PRO B 44 18.723 0.687 -1.661 1.00 34.31 H new ATOM 0 HB2 PRO B 44 18.024 0.096 -4.285 1.00 11.44 H new ATOM 0 HB3 PRO B 44 19.230 -0.889 -3.481 1.00 11.44 H new ATOM 0 HG2 PRO B 44 16.263 -1.431 -3.799 1.00 74.34 H new ATOM 0 HG3 PRO B 44 17.606 -2.510 -4.122 1.00 74.34 H new ATOM 0 HD2 PRO B 44 16.247 -2.666 -1.782 1.00 44.11 H new ATOM 0 HD3 PRO B 44 17.973 -2.964 -1.828 1.00 44.11 H new ATOM 2492 N ASN B 45 15.611 1.085 -1.699 1.00 64.42 N ATOM 2493 CA ASN B 45 14.544 2.098 -1.774 1.00 73.23 C ATOM 2494 C ASN B 45 13.818 2.229 -0.422 1.00 35.43 C ATOM 2495 O ASN B 45 12.689 1.745 -0.248 1.00 40.34 O ATOM 2496 CB ASN B 45 13.542 1.772 -2.920 1.00 60.11 C ATOM 2497 CG ASN B 45 12.488 2.876 -3.132 1.00 74.00 C ATOM 2498 OD1 ASN B 45 12.770 4.061 -2.959 1.00 3.23 O ATOM 2499 ND2 ASN B 45 11.273 2.502 -3.493 1.00 61.32 N ATOM 0 H ASN B 45 15.355 0.250 -1.172 1.00 64.42 H new ATOM 0 HA ASN B 45 15.006 3.059 -2.002 1.00 73.23 H new ATOM 0 HB2 ASN B 45 14.095 1.623 -3.847 1.00 60.11 H new ATOM 0 HB3 ASN B 45 13.036 0.833 -2.696 1.00 60.11 H new ATOM 0 HD21 ASN B 45 10.545 3.202 -3.634 1.00 61.32 H new ATOM 0 HD22 ASN B 45 11.063 1.513 -3.630 1.00 61.32 H new ATOM 2506 N VAL B 46 14.526 2.839 0.538 1.00 12.41 N ATOM 2507 CA VAL B 46 13.952 3.343 1.800 1.00 33.44 C ATOM 2508 C VAL B 46 15.053 4.099 2.565 1.00 11.32 C ATOM 2509 O VAL B 46 16.141 3.553 2.795 1.00 72.22 O ATOM 2510 CB VAL B 46 13.289 2.222 2.717 1.00 73.22 C ATOM 2511 CG1 VAL B 46 14.304 1.146 3.178 1.00 51.52 C ATOM 2512 CG2 VAL B 46 12.537 2.859 3.915 1.00 3.11 C ATOM 0 H VAL B 46 15.530 3.000 0.462 1.00 12.41 H new ATOM 0 HA VAL B 46 13.128 4.007 1.540 1.00 33.44 H new ATOM 0 HB VAL B 46 12.558 1.699 2.101 1.00 73.22 H new ATOM 0 HG11 VAL B 46 13.796 0.409 3.799 1.00 51.52 H new ATOM 0 HG12 VAL B 46 14.732 0.652 2.306 1.00 51.52 H new ATOM 0 HG13 VAL B 46 15.099 1.619 3.754 1.00 51.52 H new ATOM 0 HG21 VAL B 46 12.093 2.073 4.526 1.00 3.11 H new ATOM 0 HG22 VAL B 46 13.237 3.436 4.519 1.00 3.11 H new ATOM 0 HG23 VAL B 46 11.751 3.517 3.543 1.00 3.11 H new ATOM 2522 N THR B 47 14.777 5.364 2.917 1.00 41.43 N ATOM 2523 CA THR B 47 15.706 6.198 3.693 1.00 45.33 C ATOM 2524 C THR B 47 15.798 5.680 5.143 1.00 12.23 C ATOM 2525 O THR B 47 14.853 5.053 5.643 1.00 33.25 O ATOM 2526 CB THR B 47 15.259 7.691 3.677 1.00 32.43 C ATOM 2527 OG1 THR B 47 13.899 7.796 4.133 1.00 4.31 O ATOM 2528 CG2 THR B 47 15.384 8.307 2.269 1.00 43.43 C ATOM 0 H THR B 47 13.906 5.836 2.672 1.00 41.43 H new ATOM 0 HA THR B 47 16.692 6.135 3.232 1.00 45.33 H new ATOM 0 HB THR B 47 15.918 8.245 4.345 1.00 32.43 H new ATOM 0 HG1 THR B 47 13.622 8.736 4.123 1.00 4.31 H new ATOM 0 HG21 THR B 47 15.063 9.348 2.298 1.00 43.43 H new ATOM 0 HG22 THR B 47 16.422 8.256 1.940 1.00 43.43 H new ATOM 0 HG23 THR B 47 14.755 7.753 1.572 1.00 43.43 H new ATOM 2536 N SER B 48 16.935 5.955 5.798 1.00 15.35 N ATOM 2537 CA SER B 48 17.275 5.408 7.122 1.00 11.31 C ATOM 2538 C SER B 48 16.268 5.804 8.205 1.00 63.31 C ATOM 2539 O SER B 48 15.805 4.953 8.966 1.00 71.55 O ATOM 2540 CB SER B 48 18.673 5.889 7.523 1.00 54.13 C ATOM 2541 OG SER B 48 18.750 7.309 7.521 1.00 12.12 O ATOM 0 H SER B 48 17.654 6.571 5.419 1.00 15.35 H new ATOM 0 HA SER B 48 17.247 4.321 7.042 1.00 11.31 H new ATOM 0 HB2 SER B 48 18.920 5.510 8.515 1.00 54.13 H new ATOM 0 HB3 SER B 48 19.412 5.481 6.833 1.00 54.13 H new ATOM 0 HG SER B 48 19.643 7.588 7.230 1.00 12.12 H new ATOM 2547 N THR B 49 15.945 7.102 8.247 1.00 30.22 N ATOM 2548 CA THR B 49 15.039 7.685 9.242 1.00 62.52 C ATOM 2549 C THR B 49 13.652 7.020 9.178 1.00 24.24 C ATOM 2550 O THR B 49 13.118 6.594 10.203 1.00 41.42 O ATOM 2551 CB THR B 49 14.916 9.223 9.012 1.00 30.21 C ATOM 2552 OG1 THR B 49 14.561 9.467 7.639 1.00 75.31 O ATOM 2553 CG2 THR B 49 16.233 9.962 9.333 1.00 52.15 C ATOM 0 H THR B 49 16.310 7.785 7.583 1.00 30.22 H new ATOM 0 HA THR B 49 15.453 7.506 10.234 1.00 62.52 H new ATOM 0 HB THR B 49 14.147 9.602 9.684 1.00 30.21 H new ATOM 0 HG1 THR B 49 14.480 10.432 7.488 1.00 75.31 H new ATOM 0 HG21 THR B 49 16.103 11.030 9.159 1.00 52.15 H new ATOM 0 HG22 THR B 49 16.499 9.794 10.377 1.00 52.15 H new ATOM 0 HG23 THR B 49 17.028 9.584 8.690 1.00 52.15 H new ATOM 2561 N ILE B 50 13.123 6.882 7.952 1.00 71.45 N ATOM 2562 CA ILE B 50 11.791 6.305 7.708 1.00 24.44 C ATOM 2563 C ILE B 50 11.778 4.798 8.025 1.00 35.12 C ATOM 2564 O ILE B 50 10.835 4.303 8.651 1.00 31.04 O ATOM 2565 CB ILE B 50 11.338 6.563 6.223 1.00 63.22 C ATOM 2566 CG1 ILE B 50 11.296 8.095 5.924 1.00 23.32 C ATOM 2567 CG2 ILE B 50 9.971 5.912 5.912 1.00 33.00 C ATOM 2568 CD1 ILE B 50 10.325 8.892 6.784 1.00 13.25 C ATOM 0 H ILE B 50 13.607 7.168 7.101 1.00 71.45 H new ATOM 0 HA ILE B 50 11.082 6.797 8.374 1.00 24.44 H new ATOM 0 HB ILE B 50 12.076 6.095 5.571 1.00 63.22 H new ATOM 0 HG12 ILE B 50 12.297 8.504 6.059 1.00 23.32 H new ATOM 0 HG13 ILE B 50 11.032 8.238 4.876 1.00 23.32 H new ATOM 0 HG21 ILE B 50 9.698 6.116 4.877 1.00 33.00 H new ATOM 0 HG22 ILE B 50 10.038 4.835 6.064 1.00 33.00 H new ATOM 0 HG23 ILE B 50 9.212 6.326 6.575 1.00 33.00 H new ATOM 0 HD11 ILE B 50 10.368 9.944 6.502 1.00 13.25 H new ATOM 0 HD12 ILE B 50 9.313 8.517 6.633 1.00 13.25 H new ATOM 0 HD13 ILE B 50 10.598 8.787 7.834 1.00 13.25 H new ATOM 2580 N LEU B 51 12.850 4.095 7.607 1.00 54.22 N ATOM 2581 CA LEU B 51 13.032 2.652 7.875 1.00 20.43 C ATOM 2582 C LEU B 51 13.042 2.389 9.395 1.00 51.20 C ATOM 2583 O LEU B 51 12.399 1.454 9.871 1.00 14.23 O ATOM 2584 CB LEU B 51 14.342 2.115 7.219 1.00 54.02 C ATOM 2585 CG LEU B 51 14.612 0.576 7.377 1.00 42.21 C ATOM 2586 CD1 LEU B 51 13.463 -0.272 6.784 1.00 32.33 C ATOM 2587 CD2 LEU B 51 15.972 0.172 6.760 1.00 13.44 C ATOM 0 H LEU B 51 13.614 4.510 7.074 1.00 54.22 H new ATOM 0 HA LEU B 51 12.193 2.117 7.430 1.00 20.43 H new ATOM 0 HB2 LEU B 51 14.315 2.351 6.155 1.00 54.02 H new ATOM 0 HB3 LEU B 51 15.186 2.657 7.645 1.00 54.02 H new ATOM 0 HG LEU B 51 14.656 0.370 8.446 1.00 42.21 H new ATOM 0 HD11 LEU B 51 13.688 -1.331 6.913 1.00 32.33 H new ATOM 0 HD12 LEU B 51 12.532 -0.033 7.298 1.00 32.33 H new ATOM 0 HD13 LEU B 51 13.358 -0.050 5.722 1.00 32.33 H new ATOM 0 HD21 LEU B 51 16.125 -0.900 6.888 1.00 13.44 H new ATOM 0 HD22 LEU B 51 15.976 0.415 5.697 1.00 13.44 H new ATOM 0 HD23 LEU B 51 16.774 0.715 7.260 1.00 13.44 H new ATOM 2599 N GLU B 52 13.740 3.270 10.134 1.00 63.04 N ATOM 2600 CA GLU B 52 13.848 3.208 11.600 1.00 62.44 C ATOM 2601 C GLU B 52 12.466 3.354 12.253 1.00 3.43 C ATOM 2602 O GLU B 52 12.122 2.591 13.152 1.00 62.21 O ATOM 2603 CB GLU B 52 14.788 4.325 12.115 1.00 13.31 C ATOM 2604 CG GLU B 52 14.897 4.406 13.651 1.00 12.22 C ATOM 2605 CD GLU B 52 15.814 5.534 14.135 1.00 71.32 C ATOM 2606 OE1 GLU B 52 15.541 6.709 13.807 1.00 44.31 O ATOM 2607 OE2 GLU B 52 16.795 5.259 14.869 1.00 24.13 O ATOM 0 H GLU B 52 14.250 4.053 9.724 1.00 63.04 H new ATOM 0 HA GLU B 52 14.262 2.237 11.870 1.00 62.44 H new ATOM 0 HB2 GLU B 52 15.783 4.166 11.700 1.00 13.31 H new ATOM 0 HB3 GLU B 52 14.434 5.284 11.737 1.00 13.31 H new ATOM 0 HG2 GLU B 52 13.902 4.550 14.072 1.00 12.22 H new ATOM 0 HG3 GLU B 52 15.270 3.455 14.032 1.00 12.22 H new ATOM 2614 N LYS B 53 11.695 4.349 11.776 1.00 54.31 N ATOM 2615 CA LYS B 53 10.343 4.651 12.289 1.00 72.32 C ATOM 2616 C LYS B 53 9.406 3.434 12.148 1.00 4.11 C ATOM 2617 O LYS B 53 8.661 3.097 13.076 1.00 60.55 O ATOM 2618 CB LYS B 53 9.732 5.867 11.538 1.00 53.53 C ATOM 2619 CG LYS B 53 10.464 7.212 11.741 1.00 50.25 C ATOM 2620 CD LYS B 53 9.772 8.385 10.998 1.00 62.51 C ATOM 2621 CE LYS B 53 8.382 8.719 11.575 1.00 20.13 C ATOM 2622 NZ LYS B 53 8.457 9.228 12.976 1.00 2.23 N ATOM 0 H LYS B 53 11.992 4.968 11.022 1.00 54.31 H new ATOM 0 HA LYS B 53 10.441 4.893 13.347 1.00 72.32 H new ATOM 0 HB2 LYS B 53 9.713 5.641 10.472 1.00 53.53 H new ATOM 0 HB3 LYS B 53 8.696 5.985 11.857 1.00 53.53 H new ATOM 0 HG2 LYS B 53 10.511 7.439 12.806 1.00 50.25 H new ATOM 0 HG3 LYS B 53 11.491 7.119 11.389 1.00 50.25 H new ATOM 0 HD2 LYS B 53 10.406 9.270 11.054 1.00 62.51 H new ATOM 0 HD3 LYS B 53 9.671 8.132 9.943 1.00 62.51 H new ATOM 0 HE2 LYS B 53 7.900 9.466 10.945 1.00 20.13 H new ATOM 0 HE3 LYS B 53 7.756 7.827 11.548 1.00 20.13 H new ATOM 0 HZ1 LYS B 53 7.689 9.911 13.139 1.00 2.23 H new ATOM 0 HZ2 LYS B 53 8.360 8.433 13.640 1.00 2.23 H new ATOM 0 HZ3 LYS B 53 9.374 9.695 13.127 1.00 2.23 H new ATOM 2636 N VAL B 54 9.471 2.789 10.974 1.00 64.50 N ATOM 2637 CA VAL B 54 8.619 1.639 10.634 1.00 43.21 C ATOM 2638 C VAL B 54 9.022 0.395 11.468 1.00 64.55 C ATOM 2639 O VAL B 54 8.153 -0.303 12.000 1.00 62.44 O ATOM 2640 CB VAL B 54 8.686 1.341 9.086 1.00 14.11 C ATOM 2641 CG1 VAL B 54 7.878 0.085 8.699 1.00 1.22 C ATOM 2642 CG2 VAL B 54 8.203 2.567 8.265 1.00 73.21 C ATOM 0 H VAL B 54 10.118 3.051 10.231 1.00 64.50 H new ATOM 0 HA VAL B 54 7.586 1.884 10.883 1.00 43.21 H new ATOM 0 HB VAL B 54 9.731 1.145 8.846 1.00 14.11 H new ATOM 0 HG11 VAL B 54 7.954 -0.080 7.624 1.00 1.22 H new ATOM 0 HG12 VAL B 54 8.276 -0.781 9.228 1.00 1.22 H new ATOM 0 HG13 VAL B 54 6.832 0.227 8.971 1.00 1.22 H new ATOM 0 HG21 VAL B 54 8.258 2.337 7.201 1.00 73.21 H new ATOM 0 HG22 VAL B 54 7.173 2.801 8.532 1.00 73.21 H new ATOM 0 HG23 VAL B 54 8.838 3.425 8.484 1.00 73.21 H new ATOM 2652 N LEU B 55 10.344 0.156 11.600 1.00 50.13 N ATOM 2653 CA LEU B 55 10.892 -0.985 12.375 1.00 22.13 C ATOM 2654 C LEU B 55 10.635 -0.815 13.888 1.00 61.13 C ATOM 2655 O LEU B 55 10.431 -1.803 14.605 1.00 40.03 O ATOM 2656 CB LEU B 55 12.416 -1.156 12.107 1.00 2.31 C ATOM 2657 CG LEU B 55 12.826 -1.588 10.662 1.00 1.54 C ATOM 2658 CD1 LEU B 55 14.365 -1.683 10.526 1.00 30.20 C ATOM 2659 CD2 LEU B 55 12.134 -2.912 10.243 1.00 2.33 C ATOM 0 H LEU B 55 11.061 0.744 11.176 1.00 50.13 H new ATOM 0 HA LEU B 55 10.374 -1.884 12.041 1.00 22.13 H new ATOM 0 HB2 LEU B 55 12.910 -0.211 12.334 1.00 2.31 H new ATOM 0 HB3 LEU B 55 12.805 -1.895 12.807 1.00 2.31 H new ATOM 0 HG LEU B 55 12.480 -0.815 9.976 1.00 1.54 H new ATOM 0 HD11 LEU B 55 14.623 -1.985 9.511 1.00 30.20 H new ATOM 0 HD12 LEU B 55 14.810 -0.711 10.739 1.00 30.20 H new ATOM 0 HD13 LEU B 55 14.748 -2.420 11.232 1.00 30.20 H new ATOM 0 HD21 LEU B 55 12.443 -3.180 9.233 1.00 2.33 H new ATOM 0 HD22 LEU B 55 12.420 -3.706 10.933 1.00 2.33 H new ATOM 0 HD23 LEU B 55 11.052 -2.781 10.268 1.00 2.33 H new ATOM 2671 N ASP B 56 10.648 0.448 14.351 1.00 65.33 N ATOM 2672 CA ASP B 56 10.418 0.799 15.766 1.00 71.42 C ATOM 2673 C ASP B 56 8.944 0.554 16.128 1.00 34.42 C ATOM 2674 O ASP B 56 8.647 -0.017 17.180 1.00 43.23 O ATOM 2675 CB ASP B 56 10.811 2.276 16.043 1.00 73.45 C ATOM 2676 CG ASP B 56 10.735 2.653 17.536 1.00 72.52 C ATOM 2677 OD1 ASP B 56 11.754 2.517 18.253 1.00 71.01 O ATOM 2678 OD2 ASP B 56 9.663 3.071 18.004 1.00 61.24 O ATOM 0 H ASP B 56 10.819 1.257 13.753 1.00 65.33 H new ATOM 0 HA ASP B 56 11.048 0.165 16.390 1.00 71.42 H new ATOM 0 HB2 ASP B 56 11.825 2.450 15.682 1.00 73.45 H new ATOM 0 HB3 ASP B 56 10.153 2.933 15.475 1.00 73.45 H new ATOM 2683 N TYR B 57 8.030 0.983 15.233 1.00 11.32 N ATOM 2684 CA TYR B 57 6.582 0.734 15.387 1.00 24.43 C ATOM 2685 C TYR B 57 6.296 -0.779 15.412 1.00 20.11 C ATOM 2686 O TYR B 57 5.520 -1.256 16.250 1.00 52.12 O ATOM 2687 CB TYR B 57 5.758 1.402 14.253 1.00 65.01 C ATOM 2688 CG TYR B 57 4.246 1.082 14.320 1.00 35.34 C ATOM 2689 CD1 TYR B 57 3.400 1.763 15.199 1.00 61.12 C ATOM 2690 CD2 TYR B 57 3.674 0.072 13.526 1.00 21.21 C ATOM 2691 CE1 TYR B 57 2.054 1.449 15.283 1.00 65.45 C ATOM 2692 CE2 TYR B 57 2.329 -0.233 13.606 1.00 2.32 C ATOM 2693 CZ TYR B 57 1.524 0.455 14.485 1.00 63.34 C ATOM 2694 OH TYR B 57 0.186 0.136 14.578 1.00 41.23 O ATOM 0 H TYR B 57 8.272 1.506 14.392 1.00 11.32 H new ATOM 0 HA TYR B 57 6.277 1.178 16.334 1.00 24.43 H new ATOM 0 HB2 TYR B 57 5.895 2.482 14.302 1.00 65.01 H new ATOM 0 HB3 TYR B 57 6.148 1.075 13.289 1.00 65.01 H new ATOM 0 HD1 TYR B 57 3.802 2.547 15.823 1.00 61.12 H new ATOM 0 HD2 TYR B 57 4.300 -0.477 12.838 1.00 21.21 H new ATOM 0 HE1 TYR B 57 1.418 1.982 15.974 1.00 65.45 H new ATOM 0 HE2 TYR B 57 1.911 -1.008 12.981 1.00 2.32 H new ATOM 0 HH TYR B 57 -0.023 -0.584 13.947 1.00 41.23 H new ATOM 2704 N CYS B 58 6.921 -1.509 14.468 1.00 0.40 N ATOM 2705 CA CYS B 58 6.803 -2.971 14.376 1.00 71.03 C ATOM 2706 C CYS B 58 7.302 -3.641 15.674 1.00 33.32 C ATOM 2707 O CYS B 58 6.719 -4.622 16.121 1.00 15.14 O ATOM 2708 CB CYS B 58 7.566 -3.509 13.143 1.00 62.22 C ATOM 2709 SG CYS B 58 6.890 -2.958 11.560 1.00 34.52 S ATOM 0 H CYS B 58 7.520 -1.100 13.751 1.00 0.40 H new ATOM 0 HA CYS B 58 5.749 -3.221 14.251 1.00 71.03 H new ATOM 0 HB2 CYS B 58 8.608 -3.197 13.209 1.00 62.22 H new ATOM 0 HB3 CYS B 58 7.557 -4.599 13.170 1.00 62.22 H new ATOM 0 HG CYS B 58 7.257 -1.731 11.335 1.00 34.52 H new ATOM 2715 N ARG B 59 8.365 -3.071 16.281 1.00 24.40 N ATOM 2716 CA ARG B 59 8.901 -3.542 17.577 1.00 22.10 C ATOM 2717 C ARG B 59 7.876 -3.329 18.709 1.00 3.14 C ATOM 2718 O ARG B 59 7.680 -4.217 19.535 1.00 32.25 O ATOM 2719 CB ARG B 59 10.258 -2.849 17.915 1.00 12.33 C ATOM 2720 CG ARG B 59 10.783 -3.131 19.346 1.00 51.24 C ATOM 2721 CD ARG B 59 12.210 -2.609 19.597 1.00 65.54 C ATOM 2722 NE ARG B 59 13.245 -3.493 19.012 1.00 43.54 N ATOM 2723 CZ ARG B 59 14.483 -3.111 18.655 1.00 73.44 C ATOM 2724 NH1 ARG B 59 14.883 -1.850 18.789 1.00 51.51 N ATOM 2725 NH2 ARG B 59 15.331 -4.019 18.207 1.00 62.30 N ATOM 0 H ARG B 59 8.873 -2.277 15.890 1.00 24.40 H new ATOM 0 HA ARG B 59 9.088 -4.612 17.488 1.00 22.10 H new ATOM 0 HB2 ARG B 59 11.008 -3.176 17.195 1.00 12.33 H new ATOM 0 HB3 ARG B 59 10.143 -1.772 17.789 1.00 12.33 H new ATOM 0 HG2 ARG B 59 10.106 -2.674 20.068 1.00 51.24 H new ATOM 0 HG3 ARG B 59 10.762 -4.206 19.526 1.00 51.24 H new ATOM 0 HD2 ARG B 59 12.308 -1.609 19.174 1.00 65.54 H new ATOM 0 HD3 ARG B 59 12.377 -2.519 20.670 1.00 65.54 H new ATOM 0 HE ARG B 59 12.998 -4.472 18.868 1.00 43.54 H new ATOM 0 HH11 ARG B 59 14.246 -1.150 19.169 1.00 51.51 H new ATOM 0 HH12 ARG B 59 15.827 -1.582 18.512 1.00 51.51 H new ATOM 0 HH21 ARG B 59 15.043 -4.995 18.136 1.00 62.30 H new ATOM 0 HH22 ARG B 59 16.274 -3.744 17.932 1.00 62.30 H new ATOM 2739 N HIS B 60 7.215 -2.160 18.709 1.00 71.24 N ATOM 2740 CA HIS B 60 6.191 -1.805 19.725 1.00 3.44 C ATOM 2741 C HIS B 60 4.993 -2.775 19.660 1.00 15.20 C ATOM 2742 O HIS B 60 4.523 -3.276 20.692 1.00 30.14 O ATOM 2743 CB HIS B 60 5.700 -0.344 19.527 1.00 73.34 C ATOM 2744 CG HIS B 60 6.679 0.735 19.924 1.00 62.43 C ATOM 2745 ND1 HIS B 60 6.285 2.013 20.253 1.00 62.10 N ATOM 2746 CD2 HIS B 60 8.031 0.728 20.036 1.00 42.15 C ATOM 2747 CE1 HIS B 60 7.346 2.736 20.546 1.00 65.42 C ATOM 2748 NE2 HIS B 60 8.419 1.985 20.423 1.00 44.11 N ATOM 0 H HIS B 60 7.369 -1.432 18.011 1.00 71.24 H new ATOM 0 HA HIS B 60 6.655 -1.888 20.708 1.00 3.44 H new ATOM 0 HB2 HIS B 60 5.442 -0.206 18.477 1.00 73.34 H new ATOM 0 HB3 HIS B 60 4.784 -0.207 20.101 1.00 73.34 H new ATOM 0 HD2 HIS B 60 8.683 -0.114 19.854 1.00 42.15 H new ATOM 0 HE1 HIS B 60 7.337 3.775 20.839 1.00 65.42 H new ATOM 0 HE2 HIS B 60 9.379 2.287 20.588 1.00 44.11 H new ATOM 2757 N HIS B 61 4.528 -3.041 18.428 1.00 3.11 N ATOM 2758 CA HIS B 61 3.387 -3.941 18.175 1.00 32.54 C ATOM 2759 C HIS B 61 3.819 -5.422 18.286 1.00 3.53 C ATOM 2760 O HIS B 61 2.978 -6.314 18.323 1.00 2.32 O ATOM 2761 CB HIS B 61 2.750 -3.645 16.787 1.00 72.41 C ATOM 2762 CG HIS B 61 1.335 -4.169 16.636 1.00 13.22 C ATOM 2763 ND1 HIS B 61 1.036 -5.509 16.478 1.00 50.43 N ATOM 2764 CD2 HIS B 61 0.140 -3.525 16.673 1.00 31.11 C ATOM 2765 CE1 HIS B 61 -0.273 -5.664 16.418 1.00 74.31 C ATOM 2766 NE2 HIS B 61 -0.836 -4.479 16.537 1.00 63.25 N ATOM 0 H HIS B 61 4.930 -2.640 17.581 1.00 3.11 H new ATOM 0 HA HIS B 61 2.631 -3.756 18.938 1.00 32.54 H new ATOM 0 HB2 HIS B 61 2.748 -2.568 16.622 1.00 72.41 H new ATOM 0 HB3 HIS B 61 3.375 -4.085 16.010 1.00 72.41 H new ATOM 0 HD1 HIS B 61 1.721 -6.262 16.417 1.00 50.43 H new ATOM 0 HD2 HIS B 61 -0.013 -2.462 16.788 1.00 31.11 H new ATOM 0 HE1 HIS B 61 -0.794 -6.602 16.293 1.00 74.31 H new ATOM 0 HE2 HIS B 61 -1.840 -4.299 16.529 1.00 63.25 H new ATOM 2775 N HIS B 62 5.139 -5.678 18.288 1.00 41.32 N ATOM 2776 CA HIS B 62 5.686 -7.029 18.533 1.00 44.21 C ATOM 2777 C HIS B 62 5.704 -7.314 20.048 1.00 55.12 C ATOM 2778 O HIS B 62 5.470 -8.449 20.480 1.00 22.01 O ATOM 2779 CB HIS B 62 7.105 -7.154 17.931 1.00 60.13 C ATOM 2780 CG HIS B 62 7.613 -8.566 17.853 1.00 5.34 C ATOM 2781 ND1 HIS B 62 7.399 -9.371 16.756 1.00 61.32 N ATOM 2782 CD2 HIS B 62 8.313 -9.323 18.737 1.00 74.34 C ATOM 2783 CE1 HIS B 62 7.941 -10.549 16.965 1.00 2.20 C ATOM 2784 NE2 HIS B 62 8.499 -10.545 18.155 1.00 63.42 N ATOM 0 H HIS B 62 5.851 -4.966 18.122 1.00 41.32 H new ATOM 0 HA HIS B 62 5.049 -7.767 18.046 1.00 44.21 H new ATOM 0 HB2 HIS B 62 7.103 -6.724 16.930 1.00 60.13 H new ATOM 0 HB3 HIS B 62 7.797 -6.562 18.531 1.00 60.13 H new ATOM 0 HD1 HIS B 62 6.897 -9.095 15.912 1.00 61.32 H new ATOM 0 HD2 HIS B 62 8.657 -9.017 19.714 1.00 74.34 H new ATOM 0 HE1 HIS B 62 7.930 -11.380 16.276 1.00 2.20 H new ATOM 0 HE2 HIS B 62 8.993 -11.331 18.578 1.00 63.42 H new ATOM 2793 N GLN B 63 5.989 -6.260 20.841 1.00 11.35 N ATOM 2794 CA GLN B 63 5.966 -6.326 22.318 1.00 61.31 C ATOM 2795 C GLN B 63 4.521 -6.380 22.837 1.00 53.23 C ATOM 2796 O GLN B 63 4.265 -6.865 23.945 1.00 13.05 O ATOM 2797 CB GLN B 63 6.723 -5.112 22.933 1.00 33.35 C ATOM 2798 CG GLN B 63 8.221 -5.044 22.562 1.00 34.32 C ATOM 2799 CD GLN B 63 9.004 -6.299 22.956 1.00 61.12 C ATOM 2800 OE1 GLN B 63 8.728 -6.935 23.976 1.00 60.41 O ATOM 2801 NE2 GLN B 63 9.973 -6.675 22.143 1.00 13.30 N ATOM 0 H GLN B 63 6.241 -5.341 20.477 1.00 11.35 H new ATOM 0 HA GLN B 63 6.474 -7.240 22.626 1.00 61.31 H new ATOM 0 HB2 GLN B 63 6.238 -4.192 22.606 1.00 33.35 H new ATOM 0 HB3 GLN B 63 6.631 -5.153 24.018 1.00 33.35 H new ATOM 0 HG2 GLN B 63 8.315 -4.889 21.487 1.00 34.32 H new ATOM 0 HG3 GLN B 63 8.669 -4.178 23.049 1.00 34.32 H new ATOM 0 HE21 GLN B 63 10.178 -6.128 21.307 1.00 13.30 H new ATOM 0 HE22 GLN B 63 10.517 -7.512 22.351 1.00 13.30 H new ATOM 2810 N HIS B 64 3.581 -5.862 22.024 1.00 4.13 N ATOM 2811 CA HIS B 64 2.134 -5.920 22.292 1.00 11.24 C ATOM 2812 C HIS B 64 1.428 -6.532 21.054 1.00 61.34 C ATOM 2813 O HIS B 64 0.800 -5.811 20.260 1.00 23.43 O ATOM 2814 CB HIS B 64 1.591 -4.500 22.645 1.00 22.15 C ATOM 2815 CG HIS B 64 2.200 -3.904 23.898 1.00 64.13 C ATOM 2816 ND1 HIS B 64 1.637 -4.034 25.146 1.00 2.40 N ATOM 2817 CD2 HIS B 64 3.353 -3.200 24.087 1.00 41.24 C ATOM 2818 CE1 HIS B 64 2.405 -3.450 26.042 1.00 52.32 C ATOM 2819 NE2 HIS B 64 3.449 -2.932 25.431 1.00 1.01 N ATOM 0 H HIS B 64 3.810 -5.386 21.152 1.00 4.13 H new ATOM 0 HA HIS B 64 1.929 -6.554 23.154 1.00 11.24 H new ATOM 0 HB2 HIS B 64 1.781 -3.830 21.806 1.00 22.15 H new ATOM 0 HB3 HIS B 64 0.510 -4.556 22.770 1.00 22.15 H new ATOM 0 HD2 HIS B 64 4.058 -2.908 23.323 1.00 41.24 H new ATOM 0 HE1 HIS B 64 2.210 -3.404 27.103 1.00 52.32 H new ATOM 0 HE2 HIS B 64 4.205 -2.416 25.881 1.00 1.01 H new ATOM 2828 N PRO B 65 1.559 -7.894 20.840 1.00 63.23 N ATOM 2829 CA PRO B 65 1.061 -8.578 19.627 1.00 50.21 C ATOM 2830 C PRO B 65 -0.386 -9.084 19.764 1.00 24.20 C ATOM 2831 O PRO B 65 -0.791 -10.002 19.037 1.00 34.11 O ATOM 2832 CB PRO B 65 2.066 -9.744 19.504 1.00 53.41 C ATOM 2833 CG PRO B 65 2.347 -10.148 20.924 1.00 0.43 C ATOM 2834 CD PRO B 65 2.203 -8.883 21.766 1.00 2.51 C ATOM 0 HA PRO B 65 1.011 -7.925 18.755 1.00 50.21 H new ATOM 0 HB2 PRO B 65 1.647 -10.571 18.931 1.00 53.41 H new ATOM 0 HB3 PRO B 65 2.976 -9.431 18.992 1.00 53.41 H new ATOM 0 HG2 PRO B 65 1.649 -10.917 21.255 1.00 0.43 H new ATOM 0 HG3 PRO B 65 3.349 -10.566 21.018 1.00 0.43 H new ATOM 0 HD2 PRO B 65 1.589 -9.060 22.649 1.00 2.51 H new ATOM 0 HD3 PRO B 65 3.171 -8.527 22.118 1.00 2.51 H new ATOM 2842 N GLY B 66 -1.166 -8.452 20.665 1.00 51.30 N ATOM 2843 CA GLY B 66 -2.556 -8.830 20.915 1.00 44.10 C ATOM 2844 C GLY B 66 -3.541 -8.113 19.999 1.00 54.03 C ATOM 2845 O GLY B 66 -4.635 -7.742 20.439 1.00 71.23 O ATOM 0 H GLY B 66 -0.843 -7.669 21.234 1.00 51.30 H new ATOM 0 HA2 GLY B 66 -2.663 -9.907 20.784 1.00 44.10 H new ATOM 0 HA3 GLY B 66 -2.806 -8.609 21.953 1.00 44.10 H new ATOM 2849 N GLY B 67 -3.153 -7.955 18.712 1.00 14.55 N ATOM 2850 CA GLY B 67 -3.970 -7.280 17.702 1.00 32.30 C ATOM 2851 C GLY B 67 -4.260 -5.821 18.048 1.00 73.32 C ATOM 2852 O GLY B 67 -3.442 -4.933 17.779 1.00 20.31 O ATOM 0 H GLY B 67 -2.261 -8.296 18.354 1.00 14.55 H new ATOM 0 HA2 GLY B 67 -3.460 -7.325 16.740 1.00 32.30 H new ATOM 0 HA3 GLY B 67 -4.913 -7.815 17.588 1.00 32.30 H new ATOM 2856 N SER B 68 -5.426 -5.590 18.665 1.00 62.14 N ATOM 2857 CA SER B 68 -5.871 -4.268 19.139 1.00 61.20 C ATOM 2858 C SER B 68 -6.490 -4.415 20.538 1.00 34.03 C ATOM 2859 O SER B 68 -7.303 -5.319 20.774 1.00 1.22 O ATOM 2860 CB SER B 68 -6.904 -3.664 18.157 1.00 65.42 C ATOM 2861 OG SER B 68 -6.341 -3.453 16.872 1.00 13.43 O ATOM 0 H SER B 68 -6.102 -6.330 18.854 1.00 62.14 H new ATOM 0 HA SER B 68 -5.015 -3.596 19.190 1.00 61.20 H new ATOM 0 HB2 SER B 68 -7.762 -4.332 18.074 1.00 65.42 H new ATOM 0 HB3 SER B 68 -7.273 -2.718 18.553 1.00 65.42 H new ATOM 0 HG SER B 68 -7.020 -3.073 16.276 1.00 13.43 H new ATOM 2867 N GLY B 69 -6.081 -3.537 21.462 1.00 51.53 N ATOM 2868 CA GLY B 69 -6.647 -3.481 22.813 1.00 61.52 C ATOM 2869 C GLY B 69 -7.354 -2.159 23.055 1.00 30.53 C ATOM 2870 O GLY B 69 -7.084 -1.179 22.350 1.00 53.34 O ATOM 0 H GLY B 69 -5.349 -2.847 21.293 1.00 51.53 H new ATOM 0 HA2 GLY B 69 -7.349 -4.303 22.951 1.00 61.52 H new ATOM 0 HA3 GLY B 69 -5.854 -3.613 23.549 1.00 61.52 H new ATOM 2874 N LEU B 70 -8.243 -2.109 24.066 1.00 11.21 N ATOM 2875 CA LEU B 70 -9.017 -0.899 24.418 1.00 51.12 C ATOM 2876 C LEU B 70 -8.179 0.017 25.368 1.00 4.00 C ATOM 2877 O LEU B 70 -8.648 0.510 26.393 1.00 34.23 O ATOM 2878 CB LEU B 70 -10.376 -1.357 25.040 1.00 71.31 C ATOM 2879 CG LEU B 70 -11.397 -0.242 25.426 1.00 65.35 C ATOM 2880 CD1 LEU B 70 -11.777 0.640 24.209 1.00 0.24 C ATOM 2881 CD2 LEU B 70 -12.652 -0.846 26.104 1.00 54.41 C ATOM 0 H LEU B 70 -8.446 -2.909 24.665 1.00 11.21 H new ATOM 0 HA LEU B 70 -9.235 -0.296 23.537 1.00 51.12 H new ATOM 0 HB2 LEU B 70 -10.862 -2.029 24.332 1.00 71.31 H new ATOM 0 HB3 LEU B 70 -10.158 -1.940 25.935 1.00 71.31 H new ATOM 0 HG LEU B 70 -10.909 0.410 26.150 1.00 65.35 H new ATOM 0 HD11 LEU B 70 -12.490 1.403 24.521 1.00 0.24 H new ATOM 0 HD12 LEU B 70 -10.882 1.119 23.813 1.00 0.24 H new ATOM 0 HD13 LEU B 70 -12.227 0.018 23.435 1.00 0.24 H new ATOM 0 HD21 LEU B 70 -13.346 -0.046 26.362 1.00 54.41 H new ATOM 0 HD22 LEU B 70 -13.137 -1.541 25.418 1.00 54.41 H new ATOM 0 HD23 LEU B 70 -12.357 -1.377 27.009 1.00 54.41 H new ATOM 2893 N ASP B 71 -6.920 0.256 24.975 1.00 24.10 N ATOM 2894 CA ASP B 71 -5.945 1.058 25.747 1.00 61.01 C ATOM 2895 C ASP B 71 -4.837 1.548 24.780 1.00 64.32 C ATOM 2896 O ASP B 71 -3.723 1.907 25.188 1.00 22.44 O ATOM 2897 CB ASP B 71 -5.381 0.185 26.917 1.00 23.14 C ATOM 2898 CG ASP B 71 -4.537 0.956 27.954 1.00 0.12 C ATOM 2899 OD1 ASP B 71 -5.105 1.812 28.670 1.00 11.32 O ATOM 2900 OD2 ASP B 71 -3.314 0.699 28.071 1.00 51.33 O ATOM 0 H ASP B 71 -6.539 -0.105 24.100 1.00 24.10 H new ATOM 0 HA ASP B 71 -6.412 1.936 26.193 1.00 61.01 H new ATOM 0 HB2 ASP B 71 -6.216 -0.291 27.431 1.00 23.14 H new ATOM 0 HB3 ASP B 71 -4.771 -0.613 26.494 1.00 23.14 H new ATOM 2905 N ASP B 72 -5.192 1.591 23.475 1.00 71.03 N ATOM 2906 CA ASP B 72 -4.271 1.917 22.372 1.00 54.21 C ATOM 2907 C ASP B 72 -4.191 3.449 22.187 1.00 1.22 C ATOM 2908 O ASP B 72 -4.505 4.198 23.120 1.00 22.35 O ATOM 2909 CB ASP B 72 -4.725 1.178 21.076 1.00 3.13 C ATOM 2910 CG ASP B 72 -6.056 1.701 20.499 1.00 25.15 C ATOM 2911 OD1 ASP B 72 -7.111 1.485 21.130 1.00 34.35 O ATOM 2912 OD2 ASP B 72 -6.044 2.334 19.418 1.00 5.11 O ATOM 0 H ASP B 72 -6.142 1.396 23.159 1.00 71.03 H new ATOM 0 HA ASP B 72 -3.264 1.572 22.608 1.00 54.21 H new ATOM 0 HB2 ASP B 72 -3.947 1.278 20.319 1.00 3.13 H new ATOM 0 HB3 ASP B 72 -4.825 0.114 21.291 1.00 3.13 H new ATOM 2917 N ILE B 73 -3.755 3.899 20.990 1.00 22.34 N ATOM 2918 CA ILE B 73 -3.368 5.296 20.712 1.00 20.35 C ATOM 2919 C ILE B 73 -2.232 5.731 21.680 1.00 30.11 C ATOM 2920 O ILE B 73 -2.459 6.510 22.621 1.00 73.44 O ATOM 2921 CB ILE B 73 -4.594 6.307 20.740 1.00 43.25 C ATOM 2922 CG1 ILE B 73 -5.755 5.805 19.819 1.00 52.12 C ATOM 2923 CG2 ILE B 73 -4.157 7.745 20.343 1.00 1.14 C ATOM 2924 CD1 ILE B 73 -5.418 5.721 18.334 1.00 62.20 C ATOM 0 H ILE B 73 -3.661 3.290 20.177 1.00 22.34 H new ATOM 0 HA ILE B 73 -2.994 5.334 19.689 1.00 20.35 H new ATOM 0 HB ILE B 73 -4.963 6.345 21.765 1.00 43.25 H new ATOM 0 HG12 ILE B 73 -6.067 4.818 20.160 1.00 52.12 H new ATOM 0 HG13 ILE B 73 -6.609 6.470 19.944 1.00 52.12 H new ATOM 0 HG21 ILE B 73 -5.021 8.409 20.373 1.00 1.14 H new ATOM 0 HG22 ILE B 73 -3.401 8.102 21.042 1.00 1.14 H new ATOM 0 HG23 ILE B 73 -3.743 7.734 19.335 1.00 1.14 H new ATOM 0 HD11 ILE B 73 -6.288 5.363 17.783 1.00 62.20 H new ATOM 0 HD12 ILE B 73 -5.138 6.709 17.968 1.00 62.20 H new ATOM 0 HD13 ILE B 73 -4.587 5.031 18.188 1.00 62.20 H new ATOM 2936 N PRO B 74 -1.006 5.125 21.536 1.00 65.10 N ATOM 2937 CA PRO B 74 0.189 5.557 22.295 1.00 31.34 C ATOM 2938 C PRO B 74 0.640 6.982 21.895 1.00 4.43 C ATOM 2939 O PRO B 74 0.395 7.412 20.757 1.00 60.11 O ATOM 2940 CB PRO B 74 1.269 4.492 21.915 1.00 75.44 C ATOM 2941 CG PRO B 74 0.492 3.332 21.375 1.00 33.33 C ATOM 2942 CD PRO B 74 -0.690 3.952 20.671 1.00 10.20 C ATOM 0 HA PRO B 74 0.004 5.612 23.368 1.00 31.34 H new ATOM 0 HB2 PRO B 74 1.964 4.882 21.172 1.00 75.44 H new ATOM 0 HB3 PRO B 74 1.860 4.202 22.783 1.00 75.44 H new ATOM 0 HG2 PRO B 74 1.095 2.738 20.688 1.00 33.33 H new ATOM 0 HG3 PRO B 74 0.170 2.665 22.175 1.00 33.33 H new ATOM 0 HD2 PRO B 74 -0.443 4.254 19.653 1.00 10.20 H new ATOM 0 HD3 PRO B 74 -1.530 3.260 20.603 1.00 10.20 H new ATOM 2950 N PRO B 75 1.311 7.737 22.836 1.00 63.33 N ATOM 2951 CA PRO B 75 1.937 9.048 22.525 1.00 51.04 C ATOM 2952 C PRO B 75 2.926 8.950 21.345 1.00 43.40 C ATOM 2953 O PRO B 75 3.077 9.897 20.570 1.00 14.31 O ATOM 2954 CB PRO B 75 2.662 9.422 23.846 1.00 74.21 C ATOM 2955 CG PRO B 75 1.904 8.690 24.913 1.00 64.44 C ATOM 2956 CD PRO B 75 1.488 7.384 24.277 1.00 32.23 C ATOM 0 HA PRO B 75 1.209 9.796 22.212 1.00 51.04 H new ATOM 0 HB2 PRO B 75 3.709 9.118 23.824 1.00 74.21 H new ATOM 0 HB3 PRO B 75 2.646 10.499 24.016 1.00 74.21 H new ATOM 0 HG2 PRO B 75 2.526 8.520 25.792 1.00 64.44 H new ATOM 0 HG3 PRO B 75 1.036 9.262 25.243 1.00 64.44 H new ATOM 0 HD2 PRO B 75 2.247 6.613 24.411 1.00 32.23 H new ATOM 0 HD3 PRO B 75 0.565 7.002 24.713 1.00 32.23 H new ATOM 2964 N TYR B 76 3.566 7.763 21.218 1.00 3.54 N ATOM 2965 CA TYR B 76 4.475 7.441 20.105 1.00 12.13 C ATOM 2966 C TYR B 76 3.793 7.606 18.733 1.00 71.14 C ATOM 2967 O TYR B 76 4.358 8.232 17.844 1.00 22.33 O ATOM 2968 CB TYR B 76 5.025 5.995 20.243 1.00 21.32 C ATOM 2969 CG TYR B 76 5.791 5.508 19.001 1.00 5.24 C ATOM 2970 CD1 TYR B 76 7.041 6.034 18.673 1.00 62.32 C ATOM 2971 CD2 TYR B 76 5.247 4.546 18.141 1.00 23.13 C ATOM 2972 CE1 TYR B 76 7.711 5.620 17.542 1.00 61.10 C ATOM 2973 CE2 TYR B 76 5.919 4.128 17.013 1.00 53.42 C ATOM 2974 CZ TYR B 76 7.150 4.668 16.717 1.00 60.32 C ATOM 2975 OH TYR B 76 7.824 4.259 15.591 1.00 63.23 O ATOM 0 H TYR B 76 3.462 7.003 21.890 1.00 3.54 H new ATOM 0 HA TYR B 76 5.301 8.150 20.159 1.00 12.13 H new ATOM 0 HB2 TYR B 76 5.685 5.947 21.109 1.00 21.32 H new ATOM 0 HB3 TYR B 76 4.195 5.316 20.437 1.00 21.32 H new ATOM 0 HD1 TYR B 76 7.490 6.777 19.315 1.00 62.32 H new ATOM 0 HD2 TYR B 76 4.280 4.122 18.367 1.00 23.13 H new ATOM 0 HE1 TYR B 76 8.676 6.041 17.302 1.00 61.10 H new ATOM 0 HE2 TYR B 76 5.483 3.382 16.366 1.00 53.42 H new ATOM 0 HH TYR B 76 8.676 4.739 15.527 1.00 63.23 H new ATOM 2985 N ASP B 77 2.603 7.002 18.580 1.00 63.34 N ATOM 2986 CA ASP B 77 1.843 6.990 17.307 1.00 45.22 C ATOM 2987 C ASP B 77 1.436 8.405 16.888 1.00 15.25 C ATOM 2988 O ASP B 77 1.373 8.708 15.690 1.00 21.43 O ATOM 2989 CB ASP B 77 0.594 6.079 17.435 1.00 4.22 C ATOM 2990 CG ASP B 77 0.948 4.585 17.569 1.00 72.45 C ATOM 2991 OD1 ASP B 77 0.315 3.741 16.896 1.00 64.31 O ATOM 2992 OD2 ASP B 77 1.859 4.251 18.361 1.00 65.44 O ATOM 0 H ASP B 77 2.134 6.504 19.337 1.00 63.34 H new ATOM 0 HA ASP B 77 2.493 6.588 16.530 1.00 45.22 H new ATOM 0 HB2 ASP B 77 0.013 6.388 18.304 1.00 4.22 H new ATOM 0 HB3 ASP B 77 -0.042 6.219 16.561 1.00 4.22 H new ATOM 2997 N ARG B 78 1.183 9.261 17.889 1.00 53.53 N ATOM 2998 CA ARG B 78 0.907 10.690 17.666 1.00 1.43 C ATOM 2999 C ARG B 78 2.155 11.380 17.096 1.00 71.44 C ATOM 3000 O ARG B 78 2.071 12.113 16.105 1.00 22.04 O ATOM 3001 CB ARG B 78 0.463 11.370 18.987 1.00 54.15 C ATOM 3002 CG ARG B 78 -0.787 10.741 19.640 1.00 72.34 C ATOM 3003 CD ARG B 78 -2.037 10.773 18.730 1.00 24.35 C ATOM 3004 NE ARG B 78 -2.337 12.137 18.249 1.00 22.42 N ATOM 3005 CZ ARG B 78 -3.245 12.460 17.306 1.00 4.33 C ATOM 3006 NH1 ARG B 78 -3.982 11.533 16.709 1.00 73.41 N ATOM 3007 NH2 ARG B 78 -3.397 13.726 16.951 1.00 34.31 N ATOM 0 H ARG B 78 1.164 8.985 18.871 1.00 53.53 H new ATOM 0 HA ARG B 78 0.094 10.784 16.946 1.00 1.43 H new ATOM 0 HB2 ARG B 78 1.289 11.329 19.698 1.00 54.15 H new ATOM 0 HB3 ARG B 78 0.264 12.423 18.790 1.00 54.15 H new ATOM 0 HG2 ARG B 78 -0.567 9.707 19.907 1.00 72.34 H new ATOM 0 HG3 ARG B 78 -1.008 11.269 20.567 1.00 72.34 H new ATOM 0 HD2 ARG B 78 -1.881 10.114 17.876 1.00 24.35 H new ATOM 0 HD3 ARG B 78 -2.895 10.385 19.279 1.00 24.35 H new ATOM 0 HE ARG B 78 -1.810 12.903 18.668 1.00 22.42 H new ATOM 0 HH11 ARG B 78 -3.868 10.551 16.960 1.00 73.41 H new ATOM 0 HH12 ARG B 78 -4.663 11.802 15.998 1.00 73.41 H new ATOM 0 HH21 ARG B 78 -2.829 14.451 17.390 1.00 34.31 H new ATOM 0 HH22 ARG B 78 -4.082 13.977 16.238 1.00 34.31 H new ATOM 3021 N ASP B 79 3.316 11.100 17.719 1.00 62.10 N ATOM 3022 CA ASP B 79 4.621 11.639 17.284 1.00 60.23 C ATOM 3023 C ASP B 79 5.080 11.033 15.943 1.00 63.22 C ATOM 3024 O ASP B 79 5.883 11.644 15.225 1.00 13.43 O ATOM 3025 CB ASP B 79 5.701 11.443 18.382 1.00 20.40 C ATOM 3026 CG ASP B 79 5.537 12.424 19.561 1.00 11.31 C ATOM 3027 OD1 ASP B 79 4.901 12.072 20.575 1.00 2.04 O ATOM 3028 OD2 ASP B 79 6.037 13.569 19.473 1.00 25.44 O ATOM 0 H ASP B 79 3.377 10.494 18.537 1.00 62.10 H new ATOM 0 HA ASP B 79 4.488 12.709 17.125 1.00 60.23 H new ATOM 0 HB2 ASP B 79 5.651 10.420 18.756 1.00 20.40 H new ATOM 0 HB3 ASP B 79 6.689 11.573 17.941 1.00 20.40 H new ATOM 3033 N PHE B 80 4.577 9.828 15.626 1.00 54.30 N ATOM 3034 CA PHE B 80 4.839 9.144 14.341 1.00 22.33 C ATOM 3035 C PHE B 80 4.110 9.893 13.212 1.00 71.23 C ATOM 3036 O PHE B 80 4.639 10.048 12.103 1.00 40.33 O ATOM 3037 CB PHE B 80 4.378 7.655 14.419 1.00 23.14 C ATOM 3038 CG PHE B 80 4.707 6.805 13.186 1.00 2.05 C ATOM 3039 CD1 PHE B 80 5.909 6.102 13.101 1.00 73.33 C ATOM 3040 CD2 PHE B 80 3.819 6.715 12.108 1.00 31.23 C ATOM 3041 CE1 PHE B 80 6.209 5.342 11.987 1.00 13.13 C ATOM 3042 CE2 PHE B 80 4.123 5.956 10.996 1.00 53.44 C ATOM 3043 CZ PHE B 80 5.320 5.272 10.935 1.00 40.11 C ATOM 0 H PHE B 80 3.974 9.296 16.254 1.00 54.30 H new ATOM 0 HA PHE B 80 5.909 9.149 14.132 1.00 22.33 H new ATOM 0 HB2 PHE B 80 4.839 7.194 15.292 1.00 23.14 H new ATOM 0 HB3 PHE B 80 3.300 7.633 14.579 1.00 23.14 H new ATOM 0 HD1 PHE B 80 6.615 6.153 13.917 1.00 73.33 H new ATOM 0 HD2 PHE B 80 2.881 7.248 12.147 1.00 31.23 H new ATOM 0 HE1 PHE B 80 7.143 4.801 11.940 1.00 13.13 H new ATOM 0 HE2 PHE B 80 3.425 5.897 10.174 1.00 53.44 H new ATOM 0 HZ PHE B 80 5.561 4.682 10.063 1.00 40.11 H new ATOM 3053 N CYS B 81 2.891 10.363 13.540 1.00 64.02 N ATOM 3054 CA CYS B 81 2.047 11.162 12.642 1.00 34.22 C ATOM 3055 C CYS B 81 2.605 12.589 12.465 1.00 72.13 C ATOM 3056 O CYS B 81 2.324 13.239 11.451 1.00 2.21 O ATOM 3057 CB CYS B 81 0.612 11.206 13.203 1.00 51.25 C ATOM 3058 SG CYS B 81 -0.136 9.576 13.399 1.00 0.11 S ATOM 0 H CYS B 81 2.462 10.194 14.450 1.00 64.02 H new ATOM 0 HA CYS B 81 2.041 10.693 11.658 1.00 34.22 H new ATOM 0 HB2 CYS B 81 0.624 11.710 14.169 1.00 51.25 H new ATOM 0 HB3 CYS B 81 -0.011 11.805 12.539 1.00 51.25 H new ATOM 0 HG CYS B 81 0.407 8.968 14.412 1.00 0.11 H new ATOM 3064 N LYS B 82 3.384 13.071 13.463 1.00 21.25 N ATOM 3065 CA LYS B 82 4.072 14.376 13.386 1.00 61.42 C ATOM 3066 C LYS B 82 5.282 14.271 12.440 1.00 73.11 C ATOM 3067 O LYS B 82 6.425 14.077 12.881 1.00 54.04 O ATOM 3068 CB LYS B 82 4.539 14.844 14.790 1.00 74.20 C ATOM 3069 CG LYS B 82 3.416 15.029 15.828 1.00 31.25 C ATOM 3070 CD LYS B 82 3.978 15.316 17.239 1.00 1.24 C ATOM 3071 CE LYS B 82 2.924 15.197 18.351 1.00 11.44 C ATOM 3072 NZ LYS B 82 3.548 15.305 19.702 1.00 51.45 N ATOM 0 H LYS B 82 3.550 12.569 14.335 1.00 21.25 H new ATOM 0 HA LYS B 82 3.368 15.112 12.998 1.00 61.42 H new ATOM 0 HB2 LYS B 82 5.254 14.118 15.178 1.00 74.20 H new ATOM 0 HB3 LYS B 82 5.071 15.789 14.682 1.00 74.20 H new ATOM 0 HG2 LYS B 82 2.769 15.851 15.521 1.00 31.25 H new ATOM 0 HG3 LYS B 82 2.798 14.131 15.859 1.00 31.25 H new ATOM 0 HD2 LYS B 82 4.793 14.622 17.445 1.00 1.24 H new ATOM 0 HD3 LYS B 82 4.402 16.320 17.256 1.00 1.24 H new ATOM 0 HE2 LYS B 82 2.175 15.979 18.230 1.00 11.44 H new ATOM 0 HE3 LYS B 82 2.405 14.243 18.263 1.00 11.44 H new ATOM 0 HZ1 LYS B 82 2.909 14.895 20.413 1.00 51.45 H new ATOM 0 HZ2 LYS B 82 4.451 14.789 19.710 1.00 51.45 H new ATOM 0 HZ3 LYS B 82 3.719 16.306 19.926 1.00 51.45 H new ATOM 3086 N VAL B 83 4.996 14.307 11.139 1.00 0.41 N ATOM 3087 CA VAL B 83 5.989 14.318 10.058 1.00 53.35 C ATOM 3088 C VAL B 83 5.453 15.216 8.936 1.00 62.01 C ATOM 3089 O VAL B 83 4.231 15.394 8.809 1.00 21.03 O ATOM 3090 CB VAL B 83 6.299 12.872 9.490 1.00 44.03 C ATOM 3091 CG1 VAL B 83 7.066 11.989 10.504 1.00 35.33 C ATOM 3092 CG2 VAL B 83 5.016 12.166 9.010 1.00 21.03 C ATOM 0 H VAL B 83 4.036 14.330 10.794 1.00 0.41 H new ATOM 0 HA VAL B 83 6.929 14.697 10.458 1.00 53.35 H new ATOM 0 HB VAL B 83 6.952 13.014 8.629 1.00 44.03 H new ATOM 0 HG11 VAL B 83 7.253 11.009 10.065 1.00 35.33 H new ATOM 0 HG12 VAL B 83 8.016 12.462 10.753 1.00 35.33 H new ATOM 0 HG13 VAL B 83 6.470 11.873 11.409 1.00 35.33 H new ATOM 0 HG21 VAL B 83 5.267 11.177 8.627 1.00 21.03 H new ATOM 0 HG22 VAL B 83 4.321 12.067 9.844 1.00 21.03 H new ATOM 0 HG23 VAL B 83 4.551 12.754 8.219 1.00 21.03 H new ATOM 3102 N ASP B 84 6.364 15.774 8.131 1.00 53.24 N ATOM 3103 CA ASP B 84 6.023 16.735 7.066 1.00 42.24 C ATOM 3104 C ASP B 84 5.225 16.013 5.947 1.00 3.22 C ATOM 3105 O ASP B 84 5.242 14.778 5.882 1.00 54.11 O ATOM 3106 CB ASP B 84 7.334 17.387 6.527 1.00 2.01 C ATOM 3107 CG ASP B 84 7.134 18.802 5.956 1.00 11.15 C ATOM 3108 OD1 ASP B 84 7.487 19.055 4.785 1.00 0.41 O ATOM 3109 OD2 ASP B 84 6.638 19.678 6.702 1.00 33.41 O ATOM 0 H ASP B 84 7.362 15.574 8.197 1.00 53.24 H new ATOM 0 HA ASP B 84 5.389 17.530 7.457 1.00 42.24 H new ATOM 0 HB2 ASP B 84 8.065 17.431 7.334 1.00 2.01 H new ATOM 0 HB3 ASP B 84 7.754 16.748 5.750 1.00 2.01 H new ATOM 3114 N GLN B 85 4.544 16.784 5.073 1.00 51.13 N ATOM 3115 CA GLN B 85 3.676 16.225 4.001 1.00 10.33 C ATOM 3116 C GLN B 85 4.442 15.239 3.065 1.00 71.30 C ATOM 3117 O GLN B 85 3.932 14.139 2.810 1.00 40.24 O ATOM 3118 CB GLN B 85 2.963 17.347 3.180 1.00 54.13 C ATOM 3119 CG GLN B 85 2.000 16.843 2.076 1.00 62.40 C ATOM 3120 CD GLN B 85 0.833 15.984 2.595 1.00 52.41 C ATOM 3121 OE1 GLN B 85 -0.219 16.503 2.962 1.00 21.13 O ATOM 3122 NE2 GLN B 85 1.004 14.666 2.609 1.00 41.35 N ATOM 0 H GLN B 85 4.576 17.803 5.085 1.00 51.13 H new ATOM 0 HA GLN B 85 2.903 15.647 4.508 1.00 10.33 H new ATOM 0 HB2 GLN B 85 2.402 17.979 3.869 1.00 54.13 H new ATOM 0 HB3 GLN B 85 3.723 17.976 2.717 1.00 54.13 H new ATOM 0 HG2 GLN B 85 1.594 17.704 1.545 1.00 62.40 H new ATOM 0 HG3 GLN B 85 2.570 16.261 1.352 1.00 62.40 H new ATOM 0 HE21 GLN B 85 1.888 14.263 2.299 1.00 41.35 H new ATOM 0 HE22 GLN B 85 0.251 14.057 2.930 1.00 41.35 H new ATOM 3131 N PRO B 86 5.679 15.578 2.547 1.00 34.04 N ATOM 3132 CA PRO B 86 6.491 14.605 1.784 1.00 64.43 C ATOM 3133 C PRO B 86 6.870 13.344 2.594 1.00 64.31 C ATOM 3134 O PRO B 86 6.902 12.228 2.047 1.00 33.23 O ATOM 3135 CB PRO B 86 7.755 15.409 1.361 1.00 12.24 C ATOM 3136 CG PRO B 86 7.800 16.565 2.303 1.00 63.12 C ATOM 3137 CD PRO B 86 6.357 16.905 2.580 1.00 72.54 C ATOM 0 HA PRO B 86 5.930 14.210 0.937 1.00 64.43 H new ATOM 0 HB2 PRO B 86 8.656 14.800 1.438 1.00 12.24 H new ATOM 0 HB3 PRO B 86 7.684 15.744 0.326 1.00 12.24 H new ATOM 0 HG2 PRO B 86 8.327 16.305 3.221 1.00 63.12 H new ATOM 0 HG3 PRO B 86 8.327 17.412 1.863 1.00 63.12 H new ATOM 0 HD2 PRO B 86 6.237 17.394 3.547 1.00 72.54 H new ATOM 0 HD3 PRO B 86 5.952 17.582 1.828 1.00 72.54 H new ATOM 3145 N THR B 87 7.112 13.543 3.894 1.00 52.51 N ATOM 3146 CA THR B 87 7.534 12.485 4.822 1.00 21.22 C ATOM 3147 C THR B 87 6.378 11.475 5.090 1.00 2.24 C ATOM 3148 O THR B 87 6.631 10.294 5.348 1.00 23.24 O ATOM 3149 CB THR B 87 8.053 13.130 6.147 1.00 21.24 C ATOM 3150 OG1 THR B 87 8.865 14.280 5.836 1.00 20.13 O ATOM 3151 CG2 THR B 87 8.886 12.158 6.996 1.00 72.13 C ATOM 0 H THR B 87 7.019 14.456 4.339 1.00 52.51 H new ATOM 0 HA THR B 87 8.348 11.919 4.368 1.00 21.22 H new ATOM 0 HB THR B 87 7.175 13.412 6.728 1.00 21.24 H new ATOM 0 HG1 THR B 87 9.189 14.686 6.667 1.00 20.13 H new ATOM 0 HG21 THR B 87 9.219 12.661 7.904 1.00 72.13 H new ATOM 0 HG22 THR B 87 8.277 11.294 7.263 1.00 72.13 H new ATOM 0 HG23 THR B 87 9.754 11.828 6.425 1.00 72.13 H new ATOM 3159 N LEU B 88 5.118 11.969 5.012 1.00 74.12 N ATOM 3160 CA LEU B 88 3.894 11.126 5.056 1.00 3.44 C ATOM 3161 C LEU B 88 3.898 10.100 3.904 1.00 13.15 C ATOM 3162 O LEU B 88 3.661 8.909 4.119 1.00 50.34 O ATOM 3163 CB LEU B 88 2.619 12.025 4.968 1.00 11.54 C ATOM 3164 CG LEU B 88 2.300 12.894 6.227 1.00 34.44 C ATOM 3165 CD1 LEU B 88 1.212 13.947 5.917 1.00 60.31 C ATOM 3166 CD2 LEU B 88 1.883 12.001 7.423 1.00 12.12 C ATOM 0 H LEU B 88 4.920 12.965 4.917 1.00 74.12 H new ATOM 0 HA LEU B 88 3.883 10.584 6.002 1.00 3.44 H new ATOM 0 HB2 LEU B 88 2.727 12.690 4.111 1.00 11.54 H new ATOM 0 HB3 LEU B 88 1.761 11.384 4.768 1.00 11.54 H new ATOM 0 HG LEU B 88 3.209 13.427 6.504 1.00 34.44 H new ATOM 0 HD11 LEU B 88 1.011 14.537 6.811 1.00 60.31 H new ATOM 0 HD12 LEU B 88 1.558 14.604 5.119 1.00 60.31 H new ATOM 0 HD13 LEU B 88 0.298 13.444 5.601 1.00 60.31 H new ATOM 0 HD21 LEU B 88 1.666 12.629 8.287 1.00 12.12 H new ATOM 0 HD22 LEU B 88 0.994 11.429 7.157 1.00 12.12 H new ATOM 0 HD23 LEU B 88 2.695 11.316 7.667 1.00 12.12 H new ATOM 3178 N PHE B 89 4.200 10.595 2.690 1.00 62.45 N ATOM 3179 CA PHE B 89 4.277 9.766 1.466 1.00 51.22 C ATOM 3180 C PHE B 89 5.452 8.768 1.526 1.00 52.11 C ATOM 3181 O PHE B 89 5.389 7.702 0.912 1.00 2.12 O ATOM 3182 CB PHE B 89 4.379 10.665 0.213 1.00 30.13 C ATOM 3183 CG PHE B 89 3.129 11.518 -0.065 1.00 4.52 C ATOM 3184 CD1 PHE B 89 1.905 10.914 -0.353 1.00 22.13 C ATOM 3185 CD2 PHE B 89 3.184 12.911 -0.087 1.00 11.53 C ATOM 3186 CE1 PHE B 89 0.786 11.673 -0.655 1.00 54.14 C ATOM 3187 CE2 PHE B 89 2.064 13.668 -0.384 1.00 24.53 C ATOM 3188 CZ PHE B 89 0.868 13.049 -0.673 1.00 63.43 C ATOM 0 H PHE B 89 4.398 11.582 2.526 1.00 62.45 H new ATOM 0 HA PHE B 89 3.360 9.181 1.401 1.00 51.22 H new ATOM 0 HB2 PHE B 89 5.237 11.327 0.326 1.00 30.13 H new ATOM 0 HB3 PHE B 89 4.574 10.035 -0.655 1.00 30.13 H new ATOM 0 HD1 PHE B 89 1.828 9.837 -0.340 1.00 22.13 H new ATOM 0 HD2 PHE B 89 4.117 13.408 0.132 1.00 11.53 H new ATOM 0 HE1 PHE B 89 -0.152 11.186 -0.877 1.00 54.14 H new ATOM 0 HE2 PHE B 89 2.128 14.746 -0.389 1.00 24.53 H new ATOM 0 HZ PHE B 89 -0.003 13.640 -0.913 1.00 63.43 H new ATOM 3198 N GLU B 90 6.522 9.145 2.250 1.00 43.14 N ATOM 3199 CA GLU B 90 7.676 8.260 2.529 1.00 24.10 C ATOM 3200 C GLU B 90 7.280 7.075 3.430 1.00 35.43 C ATOM 3201 O GLU B 90 7.802 5.968 3.260 1.00 60.31 O ATOM 3202 CB GLU B 90 8.819 9.066 3.188 1.00 54.33 C ATOM 3203 CG GLU B 90 9.478 10.105 2.275 1.00 54.24 C ATOM 3204 CD GLU B 90 10.212 9.475 1.080 1.00 31.31 C ATOM 3205 OE1 GLU B 90 11.330 8.941 1.279 1.00 3.31 O ATOM 3206 OE2 GLU B 90 9.691 9.518 -0.062 1.00 54.20 O ATOM 0 H GLU B 90 6.614 10.074 2.661 1.00 43.14 H new ATOM 0 HA GLU B 90 8.020 7.855 1.577 1.00 24.10 H new ATOM 0 HB2 GLU B 90 8.426 9.573 4.069 1.00 54.33 H new ATOM 0 HB3 GLU B 90 9.583 8.370 3.535 1.00 54.33 H new ATOM 0 HG2 GLU B 90 8.716 10.791 1.906 1.00 54.24 H new ATOM 0 HG3 GLU B 90 10.184 10.697 2.857 1.00 54.24 H new ATOM 3213 N LEU B 91 6.377 7.332 4.395 1.00 52.31 N ATOM 3214 CA LEU B 91 5.820 6.287 5.281 1.00 71.00 C ATOM 3215 C LEU B 91 4.924 5.319 4.476 1.00 41.30 C ATOM 3216 O LEU B 91 4.910 4.113 4.742 1.00 72.55 O ATOM 3217 CB LEU B 91 5.014 6.930 6.446 1.00 74.52 C ATOM 3218 CG LEU B 91 5.816 7.865 7.413 1.00 71.03 C ATOM 3219 CD1 LEU B 91 4.882 8.518 8.459 1.00 43.12 C ATOM 3220 CD2 LEU B 91 6.986 7.108 8.090 1.00 42.23 C ATOM 0 H LEU B 91 6.013 8.266 4.584 1.00 52.31 H new ATOM 0 HA LEU B 91 6.648 5.721 5.707 1.00 71.00 H new ATOM 0 HB2 LEU B 91 4.193 7.505 6.017 1.00 74.52 H new ATOM 0 HB3 LEU B 91 4.568 6.129 7.036 1.00 74.52 H new ATOM 0 HG LEU B 91 6.251 8.666 6.815 1.00 71.03 H new ATOM 0 HD11 LEU B 91 5.466 9.162 9.117 1.00 43.12 H new ATOM 0 HD12 LEU B 91 4.124 9.112 7.949 1.00 43.12 H new ATOM 0 HD13 LEU B 91 4.397 7.741 9.049 1.00 43.12 H new ATOM 0 HD21 LEU B 91 7.522 7.786 8.754 1.00 42.23 H new ATOM 0 HD22 LEU B 91 6.593 6.271 8.666 1.00 42.23 H new ATOM 0 HD23 LEU B 91 7.668 6.734 7.326 1.00 42.23 H new ATOM 3232 N ILE B 92 4.189 5.880 3.494 1.00 11.32 N ATOM 3233 CA ILE B 92 3.342 5.107 2.560 1.00 32.45 C ATOM 3234 C ILE B 92 4.232 4.233 1.640 1.00 54.42 C ATOM 3235 O ILE B 92 3.923 3.055 1.406 1.00 31.24 O ATOM 3236 CB ILE B 92 2.408 6.063 1.707 1.00 15.22 C ATOM 3237 CG1 ILE B 92 1.500 6.921 2.654 1.00 0.21 C ATOM 3238 CG2 ILE B 92 1.547 5.268 0.686 1.00 12.22 C ATOM 3239 CD1 ILE B 92 0.663 7.982 1.959 1.00 34.13 C ATOM 0 H ILE B 92 4.166 6.886 3.325 1.00 11.32 H new ATOM 0 HA ILE B 92 2.693 4.453 3.142 1.00 32.45 H new ATOM 0 HB ILE B 92 3.050 6.732 1.134 1.00 15.22 H new ATOM 0 HG12 ILE B 92 0.832 6.251 3.196 1.00 0.21 H new ATOM 0 HG13 ILE B 92 2.133 7.408 3.395 1.00 0.21 H new ATOM 0 HG21 ILE B 92 0.921 5.959 0.122 1.00 12.22 H new ATOM 0 HG22 ILE B 92 2.201 4.728 0.001 1.00 12.22 H new ATOM 0 HG23 ILE B 92 0.914 4.558 1.219 1.00 12.22 H new ATOM 0 HD11 ILE B 92 0.071 8.521 2.699 1.00 34.13 H new ATOM 0 HD12 ILE B 92 1.319 8.681 1.441 1.00 34.13 H new ATOM 0 HD13 ILE B 92 -0.002 7.506 1.238 1.00 34.13 H new ATOM 3251 N LEU B 93 5.358 4.819 1.160 1.00 11.12 N ATOM 3252 CA LEU B 93 6.355 4.105 0.325 1.00 32.33 C ATOM 3253 C LEU B 93 6.977 2.933 1.092 1.00 44.21 C ATOM 3254 O LEU B 93 7.018 1.821 0.584 1.00 33.34 O ATOM 3255 CB LEU B 93 7.503 5.055 -0.177 1.00 0.02 C ATOM 3256 CG LEU B 93 7.299 5.746 -1.559 1.00 20.24 C ATOM 3257 CD1 LEU B 93 8.539 6.595 -1.917 1.00 31.02 C ATOM 3258 CD2 LEU B 93 7.012 4.703 -2.668 1.00 44.23 C ATOM 0 H LEU B 93 5.599 5.794 1.340 1.00 11.12 H new ATOM 0 HA LEU B 93 5.813 3.731 -0.544 1.00 32.33 H new ATOM 0 HB2 LEU B 93 7.650 5.833 0.572 1.00 0.02 H new ATOM 0 HB3 LEU B 93 8.426 4.477 -0.221 1.00 0.02 H new ATOM 0 HG LEU B 93 6.432 6.403 -1.489 1.00 20.24 H new ATOM 0 HD11 LEU B 93 8.386 7.073 -2.884 1.00 31.02 H new ATOM 0 HD12 LEU B 93 8.689 7.359 -1.154 1.00 31.02 H new ATOM 0 HD13 LEU B 93 9.418 5.953 -1.965 1.00 31.02 H new ATOM 0 HD21 LEU B 93 6.874 5.214 -3.621 1.00 44.23 H new ATOM 0 HD22 LEU B 93 7.852 4.013 -2.745 1.00 44.23 H new ATOM 0 HD23 LEU B 93 6.108 4.147 -2.420 1.00 44.23 H new ATOM 3270 N ALA B 94 7.434 3.211 2.322 1.00 73.12 N ATOM 3271 CA ALA B 94 8.166 2.242 3.154 1.00 42.32 C ATOM 3272 C ALA B 94 7.268 1.075 3.557 1.00 10.15 C ATOM 3273 O ALA B 94 7.683 -0.072 3.506 1.00 43.13 O ATOM 3274 CB ALA B 94 8.734 2.932 4.395 1.00 52.13 C ATOM 0 H ALA B 94 7.306 4.118 2.770 1.00 73.12 H new ATOM 0 HA ALA B 94 8.991 1.843 2.564 1.00 42.32 H new ATOM 0 HB1 ALA B 94 9.273 2.204 5.001 1.00 52.13 H new ATOM 0 HB2 ALA B 94 9.416 3.726 4.090 1.00 52.13 H new ATOM 0 HB3 ALA B 94 7.919 3.359 4.979 1.00 52.13 H new ATOM 3280 N ALA B 95 6.026 1.393 3.931 1.00 4.00 N ATOM 3281 CA ALA B 95 5.036 0.393 4.353 1.00 40.33 C ATOM 3282 C ALA B 95 4.654 -0.539 3.190 1.00 70.01 C ATOM 3283 O ALA B 95 4.537 -1.744 3.375 1.00 75.32 O ATOM 3284 CB ALA B 95 3.802 1.089 4.914 1.00 24.03 C ATOM 0 H ALA B 95 5.676 2.351 3.951 1.00 4.00 H new ATOM 0 HA ALA B 95 5.481 -0.223 5.135 1.00 40.33 H new ATOM 0 HB1 ALA B 95 3.072 0.341 5.225 1.00 24.03 H new ATOM 0 HB2 ALA B 95 4.086 1.698 5.772 1.00 24.03 H new ATOM 0 HB3 ALA B 95 3.364 1.727 4.146 1.00 24.03 H new ATOM 3290 N ASN B 96 4.480 0.040 1.991 1.00 64.43 N ATOM 3291 CA ASN B 96 4.126 -0.721 0.772 1.00 41.42 C ATOM 3292 C ASN B 96 5.348 -1.525 0.253 1.00 65.30 C ATOM 3293 O ASN B 96 5.206 -2.647 -0.238 1.00 65.00 O ATOM 3294 CB ASN B 96 3.580 0.255 -0.308 1.00 33.02 C ATOM 3295 CG ASN B 96 3.057 -0.430 -1.573 1.00 32.22 C ATOM 3296 OD1 ASN B 96 2.623 -1.579 -1.551 1.00 3.03 O ATOM 3297 ND2 ASN B 96 3.042 0.289 -2.676 1.00 13.42 N ATOM 0 H ASN B 96 4.579 1.043 1.835 1.00 64.43 H new ATOM 0 HA ASN B 96 3.345 -1.443 1.010 1.00 41.42 H new ATOM 0 HB2 ASN B 96 2.776 0.848 0.128 1.00 33.02 H new ATOM 0 HB3 ASN B 96 4.373 0.949 -0.587 1.00 33.02 H new ATOM 0 HD21 ASN B 96 2.664 -0.106 -3.537 1.00 13.42 H new ATOM 0 HD22 ASN B 96 3.408 1.241 -2.669 1.00 13.42 H new ATOM 3304 N TYR B 97 6.546 -0.944 0.420 1.00 45.13 N ATOM 3305 CA TYR B 97 7.824 -1.549 -0.017 1.00 71.51 C ATOM 3306 C TYR B 97 8.188 -2.757 0.868 1.00 72.32 C ATOM 3307 O TYR B 97 8.704 -3.764 0.381 1.00 63.34 O ATOM 3308 CB TYR B 97 8.956 -0.481 0.025 1.00 11.21 C ATOM 3309 CG TYR B 97 10.370 -1.004 -0.295 1.00 45.52 C ATOM 3310 CD1 TYR B 97 11.349 -1.124 0.702 1.00 75.34 C ATOM 3311 CD2 TYR B 97 10.718 -1.389 -1.589 1.00 62.42 C ATOM 3312 CE1 TYR B 97 12.608 -1.607 0.414 1.00 4.12 C ATOM 3313 CE2 TYR B 97 11.979 -1.869 -1.876 1.00 14.41 C ATOM 3314 CZ TYR B 97 12.918 -1.975 -0.874 1.00 23.22 C ATOM 3315 OH TYR B 97 14.168 -2.458 -1.157 1.00 60.30 O ATOM 0 H TYR B 97 6.661 -0.034 0.865 1.00 45.13 H new ATOM 0 HA TYR B 97 7.710 -1.904 -1.041 1.00 71.51 H new ATOM 0 HB2 TYR B 97 8.711 0.311 -0.682 1.00 11.21 H new ATOM 0 HB3 TYR B 97 8.970 -0.030 1.017 1.00 11.21 H new ATOM 0 HD1 TYR B 97 11.112 -0.833 1.715 1.00 75.34 H new ATOM 0 HD2 TYR B 97 9.988 -1.310 -2.381 1.00 62.42 H new ATOM 0 HE1 TYR B 97 13.347 -1.696 1.196 1.00 4.12 H new ATOM 0 HE2 TYR B 97 12.230 -2.161 -2.885 1.00 14.41 H new ATOM 0 HH TYR B 97 14.299 -2.478 -2.128 1.00 60.30 H new ATOM 3325 N LEU B 98 7.909 -2.630 2.169 1.00 42.52 N ATOM 3326 CA LEU B 98 8.194 -3.668 3.171 1.00 63.34 C ATOM 3327 C LEU B 98 6.987 -4.609 3.349 1.00 3.32 C ATOM 3328 O LEU B 98 7.096 -5.621 4.045 1.00 3.52 O ATOM 3329 CB LEU B 98 8.579 -3.005 4.521 1.00 70.12 C ATOM 3330 CG LEU B 98 9.839 -2.079 4.504 1.00 1.05 C ATOM 3331 CD1 LEU B 98 10.100 -1.464 5.900 1.00 40.31 C ATOM 3332 CD2 LEU B 98 11.082 -2.818 3.960 1.00 24.33 C ATOM 0 H LEU B 98 7.474 -1.796 2.563 1.00 42.52 H new ATOM 0 HA LEU B 98 9.033 -4.269 2.821 1.00 63.34 H new ATOM 0 HB2 LEU B 98 7.728 -2.419 4.869 1.00 70.12 H new ATOM 0 HB3 LEU B 98 8.744 -3.794 5.255 1.00 70.12 H new ATOM 0 HG LEU B 98 9.634 -1.256 3.819 1.00 1.05 H new ATOM 0 HD11 LEU B 98 10.982 -0.825 5.857 1.00 40.31 H new ATOM 0 HD12 LEU B 98 9.237 -0.871 6.204 1.00 40.31 H new ATOM 0 HD13 LEU B 98 10.265 -2.262 6.624 1.00 40.31 H new ATOM 0 HD21 LEU B 98 11.937 -2.142 3.963 1.00 24.33 H new ATOM 0 HD22 LEU B 98 11.298 -3.680 4.591 1.00 24.33 H new ATOM 0 HD23 LEU B 98 10.889 -3.154 2.941 1.00 24.33 H new ATOM 3344 N ASP B 99 5.855 -4.253 2.694 1.00 51.03 N ATOM 3345 CA ASP B 99 4.585 -5.010 2.724 1.00 55.02 C ATOM 3346 C ASP B 99 4.138 -5.237 4.183 1.00 3.11 C ATOM 3347 O ASP B 99 4.188 -6.346 4.712 1.00 3.41 O ATOM 3348 CB ASP B 99 4.702 -6.349 1.921 1.00 40.01 C ATOM 3349 CG ASP B 99 3.343 -6.972 1.527 1.00 42.02 C ATOM 3350 OD1 ASP B 99 2.696 -7.622 2.378 1.00 21.03 O ATOM 3351 OD2 ASP B 99 2.922 -6.827 0.354 1.00 73.13 O ATOM 0 H ASP B 99 5.801 -3.413 2.118 1.00 51.03 H new ATOM 0 HA ASP B 99 3.813 -4.422 2.229 1.00 55.02 H new ATOM 0 HB2 ASP B 99 5.282 -6.167 1.016 1.00 40.01 H new ATOM 0 HB3 ASP B 99 5.260 -7.070 2.518 1.00 40.01 H new ATOM 3356 N ILE B 100 3.813 -4.133 4.864 1.00 12.21 N ATOM 3357 CA ILE B 100 3.331 -4.143 6.249 1.00 23.12 C ATOM 3358 C ILE B 100 1.950 -3.503 6.245 1.00 21.14 C ATOM 3359 O ILE B 100 1.833 -2.274 6.319 1.00 33.12 O ATOM 3360 CB ILE B 100 4.296 -3.366 7.237 1.00 72.21 C ATOM 3361 CG1 ILE B 100 5.758 -3.872 7.070 1.00 15.52 C ATOM 3362 CG2 ILE B 100 3.819 -3.528 8.708 1.00 63.53 C ATOM 3363 CD1 ILE B 100 6.789 -3.212 7.963 1.00 42.32 C ATOM 0 H ILE B 100 3.878 -3.197 4.464 1.00 12.21 H new ATOM 0 HA ILE B 100 3.297 -5.170 6.611 1.00 23.12 H new ATOM 0 HB ILE B 100 4.269 -2.305 6.989 1.00 72.21 H new ATOM 0 HG12 ILE B 100 5.775 -4.945 7.259 1.00 15.52 H new ATOM 0 HG13 ILE B 100 6.057 -3.726 6.032 1.00 15.52 H new ATOM 0 HG21 ILE B 100 4.494 -2.987 9.371 1.00 63.53 H new ATOM 0 HG22 ILE B 100 2.811 -3.126 8.810 1.00 63.53 H new ATOM 0 HG23 ILE B 100 3.817 -4.585 8.975 1.00 63.53 H new ATOM 0 HD11 ILE B 100 7.771 -3.640 7.763 1.00 42.32 H new ATOM 0 HD12 ILE B 100 6.812 -2.141 7.762 1.00 42.32 H new ATOM 0 HD13 ILE B 100 6.526 -3.379 9.008 1.00 42.32 H new ATOM 3375 N LYS B 101 0.918 -4.346 6.087 1.00 2.33 N ATOM 3376 CA LYS B 101 -0.489 -3.912 6.033 1.00 71.31 C ATOM 3377 C LYS B 101 -0.893 -3.130 7.329 1.00 14.41 C ATOM 3378 O LYS B 101 -1.530 -2.089 7.199 1.00 41.51 O ATOM 3379 CB LYS B 101 -1.427 -5.141 5.760 1.00 2.41 C ATOM 3380 CG LYS B 101 -2.691 -4.863 4.894 1.00 61.21 C ATOM 3381 CD LYS B 101 -3.716 -3.911 5.551 1.00 41.43 C ATOM 3382 CE LYS B 101 -4.968 -3.687 4.679 1.00 64.05 C ATOM 3383 NZ LYS B 101 -5.911 -2.734 5.325 1.00 3.13 N ATOM 0 H LYS B 101 1.036 -5.355 5.992 1.00 2.33 H new ATOM 0 HA LYS B 101 -0.609 -3.216 5.203 1.00 71.31 H new ATOM 0 HB2 LYS B 101 -0.840 -5.918 5.270 1.00 2.41 H new ATOM 0 HB3 LYS B 101 -1.751 -5.544 6.719 1.00 2.41 H new ATOM 0 HG2 LYS B 101 -2.377 -4.438 3.941 1.00 61.21 H new ATOM 0 HG3 LYS B 101 -3.182 -5.811 4.674 1.00 61.21 H new ATOM 0 HD2 LYS B 101 -4.019 -4.320 6.515 1.00 41.43 H new ATOM 0 HD3 LYS B 101 -3.239 -2.951 5.748 1.00 41.43 H new ATOM 0 HE2 LYS B 101 -4.671 -3.303 3.703 1.00 64.05 H new ATOM 0 HE3 LYS B 101 -5.470 -4.639 4.507 1.00 64.05 H new ATOM 0 HZ1 LYS B 101 -6.675 -2.498 4.661 1.00 3.13 H new ATOM 0 HZ2 LYS B 101 -6.316 -3.171 6.178 1.00 3.13 H new ATOM 0 HZ3 LYS B 101 -5.401 -1.867 5.589 1.00 3.13 H new ATOM 3397 N PRO B 102 -0.535 -3.596 8.595 1.00 35.12 N ATOM 3398 CA PRO B 102 -0.786 -2.802 9.835 1.00 41.52 C ATOM 3399 C PRO B 102 -0.307 -1.330 9.755 1.00 44.42 C ATOM 3400 O PRO B 102 -1.113 -0.407 9.898 1.00 31.40 O ATOM 3401 CB PRO B 102 0.001 -3.577 10.920 1.00 40.20 C ATOM 3402 CG PRO B 102 -0.051 -4.997 10.457 1.00 61.05 C ATOM 3403 CD PRO B 102 0.055 -4.932 8.945 1.00 4.44 C ATOM 0 HA PRO B 102 -1.854 -2.713 10.031 1.00 41.52 H new ATOM 0 HB2 PRO B 102 1.028 -3.220 11.000 1.00 40.20 H new ATOM 0 HB3 PRO B 102 -0.454 -3.461 11.903 1.00 40.20 H new ATOM 0 HG2 PRO B 102 0.766 -5.579 10.883 1.00 61.05 H new ATOM 0 HG3 PRO B 102 -0.980 -5.477 10.765 1.00 61.05 H new ATOM 0 HD2 PRO B 102 1.091 -5.010 8.614 1.00 4.44 H new ATOM 0 HD3 PRO B 102 -0.493 -5.747 8.471 1.00 4.44 H new ATOM 3411 N LEU B 103 1.000 -1.128 9.471 1.00 32.40 N ATOM 3412 CA LEU B 103 1.618 0.217 9.452 1.00 64.11 C ATOM 3413 C LEU B 103 1.054 1.054 8.289 1.00 75.41 C ATOM 3414 O LEU B 103 0.799 2.249 8.448 1.00 33.23 O ATOM 3415 CB LEU B 103 3.177 0.099 9.379 1.00 13.35 C ATOM 3416 CG LEU B 103 4.033 1.412 9.628 1.00 63.30 C ATOM 3417 CD1 LEU B 103 4.229 2.267 8.347 1.00 2.14 C ATOM 3418 CD2 LEU B 103 3.424 2.264 10.768 1.00 4.10 C ATOM 0 H LEU B 103 1.649 -1.883 9.251 1.00 32.40 H new ATOM 0 HA LEU B 103 1.369 0.734 10.379 1.00 64.11 H new ATOM 0 HB2 LEU B 103 3.490 -0.648 10.108 1.00 13.35 H new ATOM 0 HB3 LEU B 103 3.437 -0.288 8.394 1.00 13.35 H new ATOM 0 HG LEU B 103 5.025 1.075 9.930 1.00 63.30 H new ATOM 0 HD11 LEU B 103 4.822 3.150 8.586 1.00 2.14 H new ATOM 0 HD12 LEU B 103 4.746 1.676 7.591 1.00 2.14 H new ATOM 0 HD13 LEU B 103 3.257 2.576 7.964 1.00 2.14 H new ATOM 0 HD21 LEU B 103 4.030 3.158 10.918 1.00 4.10 H new ATOM 0 HD22 LEU B 103 2.408 2.555 10.502 1.00 4.10 H new ATOM 0 HD23 LEU B 103 3.405 1.680 11.688 1.00 4.10 H new ATOM 3430 N LEU B 104 0.844 0.390 7.143 1.00 11.34 N ATOM 3431 CA LEU B 104 0.298 1.020 5.926 1.00 63.14 C ATOM 3432 C LEU B 104 -1.114 1.557 6.190 1.00 13.44 C ATOM 3433 O LEU B 104 -1.436 2.675 5.805 1.00 75.04 O ATOM 3434 CB LEU B 104 0.286 -0.001 4.755 1.00 14.24 C ATOM 3435 CG LEU B 104 -0.225 0.512 3.368 1.00 24.35 C ATOM 3436 CD1 LEU B 104 0.616 1.704 2.845 1.00 30.15 C ATOM 3437 CD2 LEU B 104 -0.255 -0.651 2.344 1.00 51.15 C ATOM 0 H LEU B 104 1.048 -0.603 7.031 1.00 11.34 H new ATOM 0 HA LEU B 104 0.936 1.859 5.648 1.00 63.14 H new ATOM 0 HB2 LEU B 104 1.301 -0.377 4.624 1.00 14.24 H new ATOM 0 HB3 LEU B 104 -0.332 -0.848 5.051 1.00 14.24 H new ATOM 0 HG LEU B 104 -1.242 0.882 3.502 1.00 24.35 H new ATOM 0 HD11 LEU B 104 0.227 2.028 1.880 1.00 30.15 H new ATOM 0 HD12 LEU B 104 0.559 2.529 3.555 1.00 30.15 H new ATOM 0 HD13 LEU B 104 1.655 1.394 2.732 1.00 30.15 H new ATOM 0 HD21 LEU B 104 -0.612 -0.281 1.383 1.00 51.15 H new ATOM 0 HD22 LEU B 104 0.749 -1.057 2.225 1.00 51.15 H new ATOM 0 HD23 LEU B 104 -0.923 -1.434 2.702 1.00 51.15 H new ATOM 3449 N ASP B 105 -1.913 0.754 6.905 1.00 33.51 N ATOM 3450 CA ASP B 105 -3.324 1.056 7.183 1.00 10.21 C ATOM 3451 C ASP B 105 -3.431 2.178 8.229 1.00 52.31 C ATOM 3452 O ASP B 105 -4.304 3.037 8.121 1.00 63.22 O ATOM 3453 CB ASP B 105 -4.062 -0.227 7.660 1.00 34.01 C ATOM 3454 CG ASP B 105 -5.594 -0.099 7.595 1.00 14.25 C ATOM 3455 OD1 ASP B 105 -6.243 0.065 8.627 1.00 13.24 O ATOM 3456 OD2 ASP B 105 -6.151 -0.133 6.491 1.00 25.21 O ATOM 0 H ASP B 105 -1.597 -0.128 7.309 1.00 33.51 H new ATOM 0 HA ASP B 105 -3.802 1.402 6.266 1.00 10.21 H new ATOM 0 HB2 ASP B 105 -3.747 -1.070 7.045 1.00 34.01 H new ATOM 0 HB3 ASP B 105 -3.765 -0.451 8.685 1.00 34.01 H new ATOM 3461 N VAL B 106 -2.529 2.168 9.238 1.00 12.43 N ATOM 3462 CA VAL B 106 -2.440 3.247 10.251 1.00 74.11 C ATOM 3463 C VAL B 106 -2.108 4.589 9.565 1.00 70.31 C ATOM 3464 O VAL B 106 -2.758 5.603 9.829 1.00 42.41 O ATOM 3465 CB VAL B 106 -1.373 2.933 11.377 1.00 21.01 C ATOM 3466 CG1 VAL B 106 -1.155 4.138 12.337 1.00 15.21 C ATOM 3467 CG2 VAL B 106 -1.768 1.670 12.181 1.00 54.31 C ATOM 0 H VAL B 106 -1.849 1.420 9.373 1.00 12.43 H new ATOM 0 HA VAL B 106 -3.412 3.313 10.739 1.00 74.11 H new ATOM 0 HB VAL B 106 -0.428 2.745 10.868 1.00 21.01 H new ATOM 0 HG11 VAL B 106 -0.414 3.873 13.091 1.00 15.21 H new ATOM 0 HG12 VAL B 106 -0.801 4.997 11.768 1.00 15.21 H new ATOM 0 HG13 VAL B 106 -2.097 4.389 12.825 1.00 15.21 H new ATOM 0 HG21 VAL B 106 -1.018 1.477 12.948 1.00 54.31 H new ATOM 0 HG22 VAL B 106 -2.737 1.828 12.653 1.00 54.31 H new ATOM 0 HG23 VAL B 106 -1.827 0.814 11.508 1.00 54.31 H new ATOM 3477 N THR B 107 -1.115 4.563 8.663 1.00 44.23 N ATOM 3478 CA THR B 107 -0.686 5.748 7.902 1.00 51.05 C ATOM 3479 C THR B 107 -1.809 6.238 6.951 1.00 35.03 C ATOM 3480 O THR B 107 -2.057 7.440 6.854 1.00 53.13 O ATOM 3481 CB THR B 107 0.633 5.454 7.108 1.00 54.54 C ATOM 3482 OG1 THR B 107 1.644 4.994 8.023 1.00 63.30 O ATOM 3483 CG2 THR B 107 1.167 6.694 6.358 1.00 41.42 C ATOM 0 H THR B 107 -0.586 3.720 8.440 1.00 44.23 H new ATOM 0 HA THR B 107 -0.481 6.547 8.614 1.00 51.05 H new ATOM 0 HB THR B 107 0.399 4.693 6.363 1.00 54.54 H new ATOM 0 HG1 THR B 107 1.473 4.058 8.256 1.00 63.30 H new ATOM 0 HG21 THR B 107 2.081 6.432 5.826 1.00 41.42 H new ATOM 0 HG22 THR B 107 0.418 7.038 5.645 1.00 41.42 H new ATOM 0 HG23 THR B 107 1.379 7.489 7.073 1.00 41.42 H new ATOM 3491 N CYS B 108 -2.508 5.282 6.298 1.00 12.41 N ATOM 3492 CA CYS B 108 -3.606 5.576 5.344 1.00 31.02 C ATOM 3493 C CYS B 108 -4.809 6.216 6.070 1.00 70.24 C ATOM 3494 O CYS B 108 -5.462 7.114 5.523 1.00 50.00 O ATOM 3495 CB CYS B 108 -4.052 4.295 4.593 1.00 74.23 C ATOM 3496 SG CYS B 108 -2.797 3.612 3.483 1.00 44.55 S ATOM 0 H CYS B 108 -2.328 4.285 6.416 1.00 12.41 H new ATOM 0 HA CYS B 108 -3.225 6.287 4.611 1.00 31.02 H new ATOM 0 HB2 CYS B 108 -4.326 3.535 5.325 1.00 74.23 H new ATOM 0 HB3 CYS B 108 -4.949 4.519 4.015 1.00 74.23 H new ATOM 0 HG CYS B 108 -1.871 3.026 4.183 1.00 44.55 H new ATOM 3502 N LYS B 109 -5.086 5.748 7.303 1.00 34.33 N ATOM 3503 CA LYS B 109 -6.145 6.323 8.156 1.00 3.43 C ATOM 3504 C LYS B 109 -5.762 7.752 8.573 1.00 71.20 C ATOM 3505 O LYS B 109 -6.547 8.677 8.381 1.00 24.02 O ATOM 3506 CB LYS B 109 -6.421 5.428 9.417 1.00 11.32 C ATOM 3507 CG LYS B 109 -7.642 4.479 9.299 1.00 54.31 C ATOM 3508 CD LYS B 109 -7.483 3.399 8.216 1.00 34.05 C ATOM 3509 CE LYS B 109 -8.720 2.491 8.113 1.00 72.45 C ATOM 3510 NZ LYS B 109 -8.527 1.418 7.106 1.00 70.32 N ATOM 0 H LYS B 109 -4.588 4.969 7.732 1.00 34.33 H new ATOM 0 HA LYS B 109 -7.068 6.357 7.577 1.00 3.43 H new ATOM 0 HB2 LYS B 109 -5.533 4.828 9.618 1.00 11.32 H new ATOM 0 HB3 LYS B 109 -6.569 6.078 10.279 1.00 11.32 H new ATOM 0 HG2 LYS B 109 -7.809 3.994 10.261 1.00 54.31 H new ATOM 0 HG3 LYS B 109 -8.531 5.071 9.082 1.00 54.31 H new ATOM 0 HD2 LYS B 109 -7.304 3.877 7.253 1.00 34.05 H new ATOM 0 HD3 LYS B 109 -6.606 2.791 8.438 1.00 34.05 H new ATOM 0 HE2 LYS B 109 -8.927 2.045 9.086 1.00 72.45 H new ATOM 0 HE3 LYS B 109 -9.591 3.090 7.845 1.00 72.45 H new ATOM 0 HZ1 LYS B 109 -9.150 1.590 6.291 1.00 70.32 H new ATOM 0 HZ2 LYS B 109 -7.536 1.413 6.789 1.00 70.32 H new ATOM 0 HZ3 LYS B 109 -8.759 0.497 7.531 1.00 70.32 H new ATOM 3524 N THR B 110 -4.537 7.903 9.105 1.00 1.11 N ATOM 3525 CA THR B 110 -4.030 9.178 9.643 1.00 53.52 C ATOM 3526 C THR B 110 -4.060 10.302 8.587 1.00 1.03 C ATOM 3527 O THR B 110 -4.608 11.379 8.845 1.00 34.54 O ATOM 3528 CB THR B 110 -2.580 9.016 10.206 1.00 5.20 C ATOM 3529 OG1 THR B 110 -2.585 8.060 11.279 1.00 52.44 O ATOM 3530 CG2 THR B 110 -1.989 10.348 10.715 1.00 33.00 C ATOM 0 H THR B 110 -3.866 7.138 9.174 1.00 1.11 H new ATOM 0 HA THR B 110 -4.696 9.462 10.458 1.00 53.52 H new ATOM 0 HB THR B 110 -1.952 8.671 9.385 1.00 5.20 H new ATOM 0 HG1 THR B 110 -2.628 7.153 10.909 1.00 52.44 H new ATOM 0 HG21 THR B 110 -0.982 10.178 11.095 1.00 33.00 H new ATOM 0 HG22 THR B 110 -1.951 11.066 9.896 1.00 33.00 H new ATOM 0 HG23 THR B 110 -2.616 10.742 11.515 1.00 33.00 H new ATOM 3538 N VAL B 111 -3.485 10.033 7.391 1.00 24.11 N ATOM 3539 CA VAL B 111 -3.419 11.024 6.294 1.00 53.12 C ATOM 3540 C VAL B 111 -4.839 11.428 5.836 1.00 72.31 C ATOM 3541 O VAL B 111 -5.080 12.597 5.527 1.00 44.12 O ATOM 3542 CB VAL B 111 -2.546 10.532 5.072 1.00 12.51 C ATOM 3543 CG1 VAL B 111 -1.074 10.299 5.495 1.00 5.42 C ATOM 3544 CG2 VAL B 111 -3.143 9.268 4.404 1.00 43.34 C ATOM 0 H VAL B 111 -3.059 9.135 7.162 1.00 24.11 H new ATOM 0 HA VAL B 111 -2.917 11.904 6.695 1.00 53.12 H new ATOM 0 HB VAL B 111 -2.561 11.326 4.326 1.00 12.51 H new ATOM 0 HG11 VAL B 111 -0.497 9.961 4.634 1.00 5.42 H new ATOM 0 HG12 VAL B 111 -0.652 11.231 5.872 1.00 5.42 H new ATOM 0 HG13 VAL B 111 -1.036 9.541 6.277 1.00 5.42 H new ATOM 0 HG21 VAL B 111 -2.511 8.965 3.569 1.00 43.34 H new ATOM 0 HG22 VAL B 111 -3.193 8.460 5.134 1.00 43.34 H new ATOM 0 HG23 VAL B 111 -4.146 9.489 4.038 1.00 43.34 H new ATOM 3554 N ALA B 112 -5.780 10.459 5.874 1.00 54.11 N ATOM 3555 CA ALA B 112 -7.192 10.684 5.506 1.00 12.10 C ATOM 3556 C ALA B 112 -7.930 11.501 6.589 1.00 73.40 C ATOM 3557 O ALA B 112 -8.800 12.315 6.278 1.00 12.32 O ATOM 3558 CB ALA B 112 -7.901 9.344 5.260 1.00 53.12 C ATOM 0 H ALA B 112 -5.581 9.501 6.161 1.00 54.11 H new ATOM 0 HA ALA B 112 -7.212 11.263 4.583 1.00 12.10 H new ATOM 0 HB1 ALA B 112 -8.941 9.527 4.990 1.00 53.12 H new ATOM 0 HB2 ALA B 112 -7.403 8.813 4.449 1.00 53.12 H new ATOM 0 HB3 ALA B 112 -7.863 8.740 6.167 1.00 53.12 H new ATOM 3564 N ASN B 113 -7.562 11.276 7.857 1.00 63.01 N ATOM 3565 CA ASN B 113 -8.187 11.952 9.012 1.00 31.14 C ATOM 3566 C ASN B 113 -7.755 13.426 9.086 1.00 45.32 C ATOM 3567 O ASN B 113 -8.576 14.295 9.377 1.00 11.22 O ATOM 3568 CB ASN B 113 -7.840 11.222 10.346 1.00 41.02 C ATOM 3569 CG ASN B 113 -8.481 9.835 10.477 1.00 64.13 C ATOM 3570 OD1 ASN B 113 -9.569 9.591 9.959 1.00 55.32 O ATOM 3571 ND2 ASN B 113 -7.810 8.921 11.166 1.00 4.21 N ATOM 0 H ASN B 113 -6.824 10.622 8.116 1.00 63.01 H new ATOM 0 HA ASN B 113 -9.267 11.914 8.870 1.00 31.14 H new ATOM 0 HB2 ASN B 113 -6.757 11.120 10.423 1.00 41.02 H new ATOM 0 HB3 ASN B 113 -8.162 11.842 11.183 1.00 41.02 H new ATOM 0 HD21 ASN B 113 -8.195 7.983 11.278 1.00 4.21 H new ATOM 0 HD22 ASN B 113 -6.909 9.156 11.583 1.00 4.21 H new ATOM 3578 N MET B 114 -6.466 13.692 8.809 1.00 60.31 N ATOM 3579 CA MET B 114 -5.877 15.044 8.933 1.00 2.11 C ATOM 3580 C MET B 114 -6.409 15.993 7.843 1.00 35.21 C ATOM 3581 O MET B 114 -6.690 17.161 8.120 1.00 62.43 O ATOM 3582 CB MET B 114 -4.325 14.984 8.883 1.00 45.23 C ATOM 3583 CG MET B 114 -3.672 14.202 10.032 1.00 63.20 C ATOM 3584 SD MET B 114 -1.863 14.208 9.940 1.00 40.05 S ATOM 3585 CE MET B 114 -1.552 13.477 8.323 1.00 5.15 C ATOM 0 H MET B 114 -5.804 12.983 8.494 1.00 60.31 H new ATOM 0 HA MET B 114 -6.178 15.440 9.903 1.00 2.11 H new ATOM 0 HB2 MET B 114 -4.023 14.533 7.938 1.00 45.23 H new ATOM 0 HB3 MET B 114 -3.936 16.002 8.888 1.00 45.23 H new ATOM 0 HG2 MET B 114 -3.985 14.632 10.983 1.00 63.20 H new ATOM 0 HG3 MET B 114 -4.029 13.172 10.015 1.00 63.20 H new ATOM 0 HE1 MET B 114 -0.478 13.360 8.177 1.00 5.15 H new ATOM 0 HE2 MET B 114 -2.035 12.501 8.266 1.00 5.15 H new ATOM 0 HE3 MET B 114 -1.955 14.127 7.546 1.00 5.15 H new ATOM 3595 N ILE B 115 -6.558 15.477 6.607 1.00 14.53 N ATOM 3596 CA ILE B 115 -7.068 16.275 5.460 1.00 3.23 C ATOM 3597 C ILE B 115 -8.577 16.587 5.603 1.00 52.42 C ATOM 3598 O ILE B 115 -9.080 17.534 4.996 1.00 21.24 O ATOM 3599 CB ILE B 115 -6.784 15.564 4.084 1.00 32.32 C ATOM 3600 CG1 ILE B 115 -7.477 14.166 4.033 1.00 43.34 C ATOM 3601 CG2 ILE B 115 -5.258 15.456 3.833 1.00 3.44 C ATOM 3602 CD1 ILE B 115 -7.229 13.345 2.777 1.00 43.13 C ATOM 0 H ILE B 115 -6.334 14.510 6.371 1.00 14.53 H new ATOM 0 HA ILE B 115 -6.525 17.220 5.472 1.00 3.23 H new ATOM 0 HB ILE B 115 -7.209 16.170 3.283 1.00 32.32 H new ATOM 0 HG12 ILE B 115 -7.145 13.586 4.894 1.00 43.34 H new ATOM 0 HG13 ILE B 115 -8.552 14.311 4.142 1.00 43.34 H new ATOM 0 HG21 ILE B 115 -5.080 14.962 2.878 1.00 3.44 H new ATOM 0 HG22 ILE B 115 -4.821 16.454 3.812 1.00 3.44 H new ATOM 0 HG23 ILE B 115 -4.798 14.875 4.633 1.00 3.44 H new ATOM 0 HD11 ILE B 115 -7.759 12.395 2.853 1.00 43.13 H new ATOM 0 HD12 ILE B 115 -7.590 13.893 1.907 1.00 43.13 H new ATOM 0 HD13 ILE B 115 -6.161 13.157 2.670 1.00 43.13 H new ATOM 3614 N ARG B 116 -9.286 15.765 6.403 1.00 74.01 N ATOM 3615 CA ARG B 116 -10.706 15.988 6.757 1.00 4.43 C ATOM 3616 C ARG B 116 -10.822 16.809 8.052 1.00 64.24 C ATOM 3617 O ARG B 116 -11.879 17.388 8.327 1.00 11.12 O ATOM 3618 CB ARG B 116 -11.439 14.629 6.907 1.00 51.33 C ATOM 3619 CG ARG B 116 -11.569 13.844 5.583 1.00 52.04 C ATOM 3620 CD ARG B 116 -12.279 12.488 5.754 1.00 75.25 C ATOM 3621 NE ARG B 116 -11.524 11.565 6.624 1.00 3.40 N ATOM 3622 CZ ARG B 116 -11.736 10.241 6.723 1.00 23.15 C ATOM 3623 NH1 ARG B 116 -12.689 9.642 6.017 1.00 31.01 N ATOM 3624 NH2 ARG B 116 -10.987 9.519 7.537 1.00 60.51 N ATOM 0 H ARG B 116 -8.890 14.925 6.824 1.00 74.01 H new ATOM 0 HA ARG B 116 -11.178 16.554 5.954 1.00 4.43 H new ATOM 0 HB2 ARG B 116 -10.904 14.016 7.632 1.00 51.33 H new ATOM 0 HB3 ARG B 116 -12.435 14.806 7.313 1.00 51.33 H new ATOM 0 HG2 ARG B 116 -12.120 14.448 4.862 1.00 52.04 H new ATOM 0 HG3 ARG B 116 -10.575 13.678 5.167 1.00 52.04 H new ATOM 0 HD2 ARG B 116 -13.271 12.651 6.175 1.00 75.25 H new ATOM 0 HD3 ARG B 116 -12.419 12.028 4.776 1.00 75.25 H new ATOM 0 HE ARG B 116 -10.781 11.964 7.197 1.00 3.40 H new ATOM 0 HH11 ARG B 116 -13.276 10.188 5.386 1.00 31.01 H new ATOM 0 HH12 ARG B 116 -12.834 8.636 6.106 1.00 31.01 H new ATOM 0 HH21 ARG B 116 -10.253 9.966 8.086 1.00 60.51 H new ATOM 0 HH22 ARG B 116 -11.143 8.514 7.617 1.00 60.51 H new ATOM 3638 N GLY B 117 -9.729 16.843 8.834 1.00 24.05 N ATOM 3639 CA GLY B 117 -9.693 17.551 10.115 1.00 62.25 C ATOM 3640 C GLY B 117 -10.009 16.633 11.301 1.00 23.42 C ATOM 3641 O GLY B 117 -10.820 15.692 11.141 1.00 52.44 O ATOM 3642 OXT GLY B 117 -9.445 16.841 12.396 1.00 38.24 O ATOM 0 H GLY B 117 -8.852 16.381 8.593 1.00 24.05 H new ATOM 0 HA2 GLY B 117 -8.707 17.993 10.255 1.00 62.25 H new ATOM 0 HA3 GLY B 117 -10.410 18.372 10.093 1.00 62.25 H new TER 3646 GLY B 117