USER MOD reduce.3.24.130724 H: found=0, std=0, add=1978, rem=0, adj=52 USER MOD reduce.3.24.130724 removed 1974 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 20 ASN : amide:sc= 0.251 K(o=-4.4,f=-8.8!) USER MOD Set 1.2: A 125 ASN : amide:sc= -2.51 K(o=-4.4,f=-5.5!) USER MOD Set 1.3: B 20 ASN : amide:sc= 0.0921 K(o=-4.4,f=-7.8!) USER MOD Set 1.4: B 125 ASN : amide:sc= -2.19 K(o=-4.4,f=-5.4!) USER MOD Set 2.1: B 28 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: B 73 SER OG : rot 180:sc= 0 USER MOD Set 3.1: B 14 SER OG : rot 180:sc= -0.737 USER MOD Set 3.2: B 15 GLN : amide:sc=-0.000216 X(o=-0.74,f=-0.84) USER MOD Set 4.1: A 28 THR OG1 : rot 180:sc= 0 USER MOD Set 4.2: A 73 SER OG : rot 180:sc= 0 USER MOD Set 5.1: A 14 SER OG : rot 180:sc= -0.745 USER MOD Set 5.2: A 15 GLN : amide:sc= 0 X(o=-0.74,f=-0.87) USER MOD Single : A 1 ALA N :NH3+ -112:sc= 0.0412 (180deg=0) USER MOD Single : A 2 GLN : amide:sc= 0 X(o=0,f=-0.082) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 10 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 11 THR OG1 : rot 88:sc= 1.26 USER MOD Single : A 12 GLN : amide:sc= -1.47 K(o=-1.5,f=-9.1!) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 TYR OH : rot 87:sc= -1.41 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 HIS : no HD1:sc= -0.0607 X(o=-0.061,f=-0.25) USER MOD Single : A 29 TYR OH : rot 180:sc= -0.823 USER MOD Single : A 30 HIS : no HD1:sc= -1.29 K(o=-1.3,f=-0.71) USER MOD Single : A 32 LYS NZ :NH3+ 160:sc= -0.0228 (180deg=-0.167) USER MOD Single : A 34 THR OG1 : rot 180:sc= -0.933 USER MOD Single : A 35 ASN : amide:sc= -1.74 K(o=-1.7,f=-2.5!) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 THR OG1 : rot 180:sc= -0.576 USER MOD Single : A 48 THR OG1 : rot 137:sc= 0.26 USER MOD Single : A 49 ASN : amide:sc= -1.45 K(o=-1.4,f=-0.44) USER MOD Single : A 50 MET CE :methyl 164:sc= -0.0095 (180deg=-0.219) USER MOD Single : A 54 SER OG : rot 27:sc= -0.222 USER MOD Single : A 59 CYS SG : rot 180:sc= -0.295 USER MOD Single : A 65 LYS NZ :NH3+ 159:sc=-0.00547 (180deg=-0.191) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 MET CE :methyl -169:sc= -6.79! (180deg=-7.41!) USER MOD Single : A 74 CYS SG : rot -66:sc= -0.161 USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 ASN : amide:sc= 0 X(o=0,f=-0.0015) USER MOD Single : A 81 THR OG1 : rot 63:sc= 0.23 USER MOD Single : A 85 ASN : amide:sc= -1.06 K(o=-1.1,f=-2.6!) USER MOD Single : A 86 ASN : amide:sc= 0 X(o=0,f=-0.043) USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 94 THR OG1 : rot 180:sc= 0 USER MOD Single : A 95 ASN : amide:sc= -0.747 K(o=-0.75,f=-2!) USER MOD Single : A 96 THR OG1 : rot 81:sc= -2.42 USER MOD Single : A 102 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.0039) USER MOD Single : A 103 GLN : amide:sc= 0 X(o=0,f=-0.41) USER MOD Single : A 110 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 114 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 118 LYS NZ :NH3+ -139:sc= 0 (180deg=-1.24) USER MOD Single : A 119 ASN : amide:sc= 0 X(o=0,f=0.32) USER MOD Single : A 124 TYR OH : rot 43:sc= 0.905 USER MOD Single : B 1 ALA N :NH3+ 134:sc= 0.0559 (180deg=0) USER MOD Single : B 2 GLN : amide:sc= 0 X(o=0,f=-0.079) USER MOD Single : B 3 SER OG : rot 180:sc= 0 USER MOD Single : B 10 ASN : amide:sc= 0 X(o=0,f=-0.0073) USER MOD Single : B 11 THR OG1 : rot 111:sc= 1.08 USER MOD Single : B 12 GLN : amide:sc= -1.4 K(o=-1.4,f=-9.1!) USER MOD Single : B 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 23 TYR OH : rot 100:sc= -1.47 USER MOD Single : B 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 27 HIS : no HD1:sc= -0.0504 X(o=-0.05,f=-0.18) USER MOD Single : B 29 TYR OH : rot 180:sc= -0.803 USER MOD Single : B 30 HIS : no HD1:sc= -1.27 K(o=-1.3,f=-0.72) USER MOD Single : B 32 LYS NZ :NH3+ 159:sc= -0.0171 (180deg=-0.16) USER MOD Single : B 34 THR OG1 : rot 180:sc= -0.934 USER MOD Single : B 35 ASN : amide:sc= -1.68 K(o=-1.7,f=-2.3!) USER MOD Single : B 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 47 THR OG1 : rot 180:sc= -0.582 USER MOD Single : B 48 THR OG1 : rot 133:sc= 0.314 USER MOD Single : B 49 ASN : amide:sc= -1.48 K(o=-1.5,f=-0.46) USER MOD Single : B 50 MET CE :methyl 162:sc= -0.0134 (180deg=-0.23) USER MOD Single : B 54 SER OG : rot 32:sc= 0.00846 USER MOD Single : B 59 CYS SG : rot 180:sc= -0.262 USER MOD Single : B 65 LYS NZ :NH3+ 160:sc= -0.026 (180deg=-0.207) USER MOD Single : B 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 70 MET CE :methyl -171:sc= -6.92! (180deg=-7.5!) USER MOD Single : B 74 CYS SG : rot -71:sc= -0.18 USER MOD Single : B 76 THR OG1 : rot 180:sc= 0 USER MOD Single : B 78 ASN : amide:sc= 0 X(o=0,f=-0.0081) USER MOD Single : B 81 THR OG1 : rot 63:sc= 0.245 USER MOD Single : B 85 ASN : amide:sc= -1.01 K(o=-1,f=-2.7!) USER MOD Single : B 86 ASN : amide:sc= 0 X(o=0,f=-0.065) USER MOD Single : B 90 THR OG1 : rot 180:sc= 0 USER MOD Single : B 94 THR OG1 : rot 180:sc= 0 USER MOD Single : B 95 ASN : amide:sc= -0.768 K(o=-0.77,f=-2!) USER MOD Single : B 96 THR OG1 : rot 70:sc= -2.38 USER MOD Single : B 102 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.00785) USER MOD Single : B 103 GLN : amide:sc= 0 X(o=0,f=-0.42) USER MOD Single : B 110 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 114 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 118 LYS NZ :NH3+ -139:sc= 0 (180deg=-1.25) USER MOD Single : B 119 ASN : amide:sc=-0.00157 X(o=-0.0016,f=0.34) USER MOD Single : B 124 TYR OH : rot 42:sc= 0.929 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 -44.244 8.780 -12.133 1.00 0.00 N ATOM 2 CA ALA A 1 -43.569 10.070 -12.431 1.00 0.00 C ATOM 3 C ALA A 1 -42.470 10.359 -11.414 1.00 0.00 C ATOM 4 O ALA A 1 -42.539 9.917 -10.268 1.00 0.00 O ATOM 5 CB ALA A 1 -44.584 11.202 -12.448 1.00 0.00 C ATOM 0 H1 ALA A 1 -44.021 8.091 -12.879 1.00 0.00 H new ATOM 0 H2 ALA A 1 -43.912 8.418 -11.216 1.00 0.00 H new ATOM 0 H3 ALA A 1 -45.273 8.927 -12.095 1.00 0.00 H new ATOM 0 HA ALA A 1 -43.108 9.994 -13.416 1.00 0.00 H new ATOM 0 HB1 ALA A 1 -44.077 12.142 -12.667 1.00 0.00 H new ATOM 0 HB2 ALA A 1 -45.334 11.007 -13.214 1.00 0.00 H new ATOM 0 HB3 ALA A 1 -45.069 11.270 -11.474 1.00 0.00 H new ATOM 13 N GLN A 2 -41.456 11.105 -11.842 1.00 0.00 N ATOM 14 CA GLN A 2 -40.342 11.453 -10.968 1.00 0.00 C ATOM 15 C GLN A 2 -39.594 10.202 -10.518 1.00 0.00 C ATOM 16 O GLN A 2 -40.206 9.177 -10.215 1.00 0.00 O ATOM 17 CB GLN A 2 -40.847 12.226 -9.748 1.00 0.00 C ATOM 18 CG GLN A 2 -40.582 13.721 -9.824 1.00 0.00 C ATOM 19 CD GLN A 2 -39.364 14.139 -9.025 1.00 0.00 C ATOM 20 OE1 GLN A 2 -38.323 13.484 -9.071 1.00 0.00 O ATOM 21 NE2 GLN A 2 -39.488 15.235 -8.285 1.00 0.00 N ATOM 0 H GLN A 2 -41.383 11.480 -12.788 1.00 0.00 H new ATOM 0 HA GLN A 2 -39.654 12.084 -11.530 1.00 0.00 H new ATOM 0 HB2 GLN A 2 -41.919 12.060 -9.641 1.00 0.00 H new ATOM 0 HB3 GLN A 2 -40.372 11.826 -8.852 1.00 0.00 H new ATOM 0 HG2 GLN A 2 -40.445 14.009 -10.866 1.00 0.00 H new ATOM 0 HG3 GLN A 2 -41.455 14.260 -9.457 1.00 0.00 H new ATOM 0 HE21 GLN A 2 -40.370 15.748 -8.277 1.00 0.00 H new ATOM 0 HE22 GLN A 2 -38.701 15.564 -7.725 1.00 0.00 H new ATOM 30 N SER A 3 -38.270 10.294 -10.476 1.00 0.00 N ATOM 31 CA SER A 3 -37.438 9.169 -10.063 1.00 0.00 C ATOM 32 C SER A 3 -36.344 9.623 -9.105 1.00 0.00 C ATOM 33 O SER A 3 -36.114 10.819 -8.930 1.00 0.00 O ATOM 34 CB SER A 3 -36.813 8.494 -11.285 1.00 0.00 C ATOM 35 OG SER A 3 -36.638 9.418 -12.344 1.00 0.00 O ATOM 0 H SER A 3 -37.749 11.136 -10.723 1.00 0.00 H new ATOM 0 HA SER A 3 -38.074 8.451 -9.545 1.00 0.00 H new ATOM 0 HB2 SER A 3 -35.850 8.062 -11.013 1.00 0.00 H new ATOM 0 HB3 SER A 3 -37.449 7.673 -11.616 1.00 0.00 H new ATOM 0 HG SER A 3 -36.235 8.962 -13.113 1.00 0.00 H new ATOM 41 N VAL A 4 -35.670 8.659 -8.485 1.00 0.00 N ATOM 42 CA VAL A 4 -34.598 8.960 -7.545 1.00 0.00 C ATOM 43 C VAL A 4 -33.500 7.899 -7.607 1.00 0.00 C ATOM 44 O VAL A 4 -33.658 6.801 -7.073 1.00 0.00 O ATOM 45 CB VAL A 4 -35.126 9.048 -6.102 1.00 0.00 C ATOM 46 CG1 VAL A 4 -36.108 10.200 -5.960 1.00 0.00 C ATOM 47 CG2 VAL A 4 -35.769 7.734 -5.687 1.00 0.00 C ATOM 0 H VAL A 4 -35.848 7.663 -8.617 1.00 0.00 H new ATOM 0 HA VAL A 4 -34.185 9.927 -7.834 1.00 0.00 H new ATOM 0 HB VAL A 4 -34.283 9.238 -5.438 1.00 0.00 H new ATOM 0 HG11 VAL A 4 -36.470 10.245 -4.933 1.00 0.00 H new ATOM 0 HG12 VAL A 4 -35.609 11.136 -6.211 1.00 0.00 H new ATOM 0 HG13 VAL A 4 -36.950 10.046 -6.635 1.00 0.00 H new ATOM 0 HG21 VAL A 4 -36.136 7.816 -4.664 1.00 0.00 H new ATOM 0 HG22 VAL A 4 -36.601 7.509 -6.354 1.00 0.00 H new ATOM 0 HG23 VAL A 4 -35.031 6.934 -5.745 1.00 0.00 H new ATOM 57 N PRO A 5 -32.368 8.213 -8.261 1.00 0.00 N ATOM 58 CA PRO A 5 -31.247 7.279 -8.389 1.00 0.00 C ATOM 59 C PRO A 5 -30.419 7.186 -7.110 1.00 0.00 C ATOM 60 O PRO A 5 -30.471 8.076 -6.261 1.00 0.00 O ATOM 61 CB PRO A 5 -30.418 7.890 -9.517 1.00 0.00 C ATOM 62 CG PRO A 5 -30.673 9.353 -9.415 1.00 0.00 C ATOM 63 CD PRO A 5 -32.092 9.500 -8.930 1.00 0.00 C ATOM 0 HA PRO A 5 -31.581 6.260 -8.584 1.00 0.00 H new ATOM 0 HB2 PRO A 5 -29.359 7.662 -9.399 1.00 0.00 H new ATOM 0 HB3 PRO A 5 -30.722 7.501 -10.489 1.00 0.00 H new ATOM 0 HG2 PRO A 5 -29.974 9.822 -8.722 1.00 0.00 H new ATOM 0 HG3 PRO A 5 -30.540 9.840 -10.381 1.00 0.00 H new ATOM 0 HD2 PRO A 5 -32.195 10.339 -8.242 1.00 0.00 H new ATOM 0 HD3 PRO A 5 -32.781 9.678 -9.756 1.00 0.00 H new ATOM 71 N PRO A 6 -29.640 6.101 -6.955 1.00 0.00 N ATOM 72 CA PRO A 6 -28.799 5.898 -5.774 1.00 0.00 C ATOM 73 C PRO A 6 -27.571 6.802 -5.777 1.00 0.00 C ATOM 74 O PRO A 6 -26.661 6.624 -6.586 1.00 0.00 O ATOM 75 CB PRO A 6 -28.385 4.430 -5.887 1.00 0.00 C ATOM 76 CG PRO A 6 -28.413 4.144 -7.348 1.00 0.00 C ATOM 77 CD PRO A 6 -29.519 4.990 -7.920 1.00 0.00 C ATOM 0 HA PRO A 6 -29.324 6.137 -4.849 1.00 0.00 H new ATOM 0 HB2 PRO A 6 -27.392 4.265 -5.470 1.00 0.00 H new ATOM 0 HB3 PRO A 6 -29.071 3.781 -5.343 1.00 0.00 H new ATOM 0 HG2 PRO A 6 -27.457 4.388 -7.811 1.00 0.00 H new ATOM 0 HG3 PRO A 6 -28.596 3.086 -7.534 1.00 0.00 H new ATOM 0 HD2 PRO A 6 -29.272 5.351 -8.918 1.00 0.00 H new ATOM 0 HD3 PRO A 6 -30.450 4.429 -8.005 1.00 0.00 H new ATOM 85 N GLY A 7 -27.554 7.773 -4.870 1.00 0.00 N ATOM 86 CA GLY A 7 -26.434 8.691 -4.788 1.00 0.00 C ATOM 87 C GLY A 7 -25.098 7.975 -4.747 1.00 0.00 C ATOM 88 O GLY A 7 -24.921 7.019 -3.991 1.00 0.00 O ATOM 0 H GLY A 7 -28.296 7.940 -4.190 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -26.456 9.363 -5.646 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -26.539 9.309 -3.896 1.00 0.00 H new ATOM 92 N ASP A 8 -24.156 8.437 -5.563 1.00 0.00 N ATOM 93 CA ASP A 8 -22.830 7.834 -5.618 1.00 0.00 C ATOM 94 C ASP A 8 -22.183 7.813 -4.237 1.00 0.00 C ATOM 95 O ASP A 8 -22.309 8.766 -3.469 1.00 0.00 O ATOM 96 CB ASP A 8 -21.940 8.597 -6.601 1.00 0.00 C ATOM 97 CG ASP A 8 -22.592 8.769 -7.959 1.00 0.00 C ATOM 98 OD1 ASP A 8 -22.997 7.749 -8.556 1.00 0.00 O ATOM 99 OD2 ASP A 8 -22.698 9.923 -8.425 1.00 0.00 O ATOM 0 H ASP A 8 -24.287 9.227 -6.195 1.00 0.00 H new ATOM 0 HA ASP A 8 -22.940 6.806 -5.962 1.00 0.00 H new ATOM 0 HB2 ASP A 8 -21.704 9.578 -6.187 1.00 0.00 H new ATOM 0 HB3 ASP A 8 -20.996 8.066 -6.719 1.00 0.00 H new ATOM 104 N ILE A 9 -21.493 6.720 -3.927 1.00 0.00 N ATOM 105 CA ILE A 9 -20.828 6.576 -2.637 1.00 0.00 C ATOM 106 C ILE A 9 -19.328 6.811 -2.761 1.00 0.00 C ATOM 107 O ILE A 9 -18.719 6.478 -3.777 1.00 0.00 O ATOM 108 CB ILE A 9 -21.070 5.177 -2.033 1.00 0.00 C ATOM 109 CG1 ILE A 9 -20.453 4.094 -2.922 1.00 0.00 C ATOM 110 CG2 ILE A 9 -22.560 4.931 -1.849 1.00 0.00 C ATOM 111 CD1 ILE A 9 -20.069 2.840 -2.166 1.00 0.00 C ATOM 0 H ILE A 9 -21.380 5.921 -4.551 1.00 0.00 H new ATOM 0 HA ILE A 9 -21.256 7.329 -1.975 1.00 0.00 H new ATOM 0 HB ILE A 9 -20.588 5.134 -1.056 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -21.162 3.833 -3.708 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -19.568 4.498 -3.413 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -22.715 3.940 -1.422 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -22.973 5.684 -1.178 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -23.061 4.992 -2.815 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -19.638 2.116 -2.858 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -19.337 3.088 -1.398 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -20.955 2.412 -1.697 1.00 0.00 H new ATOM 123 N ASN A 10 -18.734 7.381 -1.717 1.00 0.00 N ATOM 124 CA ASN A 10 -17.301 7.653 -1.709 1.00 0.00 C ATOM 125 C ASN A 10 -16.536 6.489 -1.091 1.00 0.00 C ATOM 126 O ASN A 10 -17.003 5.864 -0.138 1.00 0.00 O ATOM 127 CB ASN A 10 -17.009 8.941 -0.938 1.00 0.00 C ATOM 128 CG ASN A 10 -16.600 10.080 -1.852 1.00 0.00 C ATOM 129 OD1 ASN A 10 -15.554 10.028 -2.497 1.00 0.00 O ATOM 130 ND2 ASN A 10 -17.427 11.118 -1.910 1.00 0.00 N ATOM 0 H ASN A 10 -19.222 7.663 -0.867 1.00 0.00 H new ATOM 0 HA ASN A 10 -16.971 7.776 -2.740 1.00 0.00 H new ATOM 0 HB2 ASN A 10 -17.894 9.232 -0.373 1.00 0.00 H new ATOM 0 HB3 ASN A 10 -16.215 8.756 -0.214 1.00 0.00 H new ATOM 0 HD21 ASN A 10 -17.205 11.914 -2.507 1.00 0.00 H new ATOM 0 HD22 ASN A 10 -18.284 11.119 -1.357 1.00 0.00 H new ATOM 137 N THR A 11 -15.362 6.197 -1.640 1.00 0.00 N ATOM 138 CA THR A 11 -14.539 5.102 -1.140 1.00 0.00 C ATOM 139 C THR A 11 -13.084 5.532 -0.988 1.00 0.00 C ATOM 140 O THR A 11 -12.604 6.411 -1.704 1.00 0.00 O ATOM 141 CB THR A 11 -14.632 3.899 -2.080 1.00 0.00 C ATOM 142 OG1 THR A 11 -14.947 4.314 -3.398 1.00 0.00 O ATOM 143 CG2 THR A 11 -15.675 2.887 -1.656 1.00 0.00 C ATOM 0 H THR A 11 -14.960 6.702 -2.430 1.00 0.00 H new ATOM 0 HA THR A 11 -14.916 4.820 -0.157 1.00 0.00 H new ATOM 0 HB THR A 11 -13.651 3.425 -2.039 1.00 0.00 H new ATOM 0 HG1 THR A 11 -14.120 4.518 -3.883 1.00 0.00 H new ATOM 0 HG21 THR A 11 -15.689 2.060 -2.366 1.00 0.00 H new ATOM 0 HG22 THR A 11 -15.433 2.509 -0.663 1.00 0.00 H new ATOM 0 HG23 THR A 11 -16.656 3.363 -1.634 1.00 0.00 H new ATOM 151 N GLN A 12 -12.387 4.900 -0.049 1.00 0.00 N ATOM 152 CA GLN A 12 -10.984 5.206 0.206 1.00 0.00 C ATOM 153 C GLN A 12 -10.175 3.917 0.372 1.00 0.00 C ATOM 154 O GLN A 12 -10.355 3.197 1.354 1.00 0.00 O ATOM 155 CB GLN A 12 -10.855 6.061 1.469 1.00 0.00 C ATOM 156 CG GLN A 12 -10.848 7.557 1.193 1.00 0.00 C ATOM 157 CD GLN A 12 -11.401 8.365 2.351 1.00 0.00 C ATOM 158 OE1 GLN A 12 -11.664 7.830 3.427 1.00 0.00 O ATOM 159 NE2 GLN A 12 -11.583 9.663 2.134 1.00 0.00 N ATOM 0 H GLN A 12 -12.773 4.170 0.550 1.00 0.00 H new ATOM 0 HA GLN A 12 -10.592 5.760 -0.647 1.00 0.00 H new ATOM 0 HB2 GLN A 12 -11.681 5.828 2.141 1.00 0.00 H new ATOM 0 HB3 GLN A 12 -9.935 5.791 1.988 1.00 0.00 H new ATOM 0 HG2 GLN A 12 -9.828 7.880 0.984 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -11.437 7.761 0.298 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -11.351 10.066 1.226 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -11.954 10.257 2.875 1.00 0.00 H new ATOM 168 N PRO A 13 -9.273 3.593 -0.579 1.00 0.00 N ATOM 169 CA PRO A 13 -9.011 4.409 -1.776 1.00 0.00 C ATOM 170 C PRO A 13 -10.229 4.526 -2.683 1.00 0.00 C ATOM 171 O PRO A 13 -11.196 3.777 -2.549 1.00 0.00 O ATOM 172 CB PRO A 13 -7.883 3.656 -2.491 1.00 0.00 C ATOM 173 CG PRO A 13 -7.955 2.264 -1.968 1.00 0.00 C ATOM 174 CD PRO A 13 -8.430 2.386 -0.549 1.00 0.00 C ATOM 0 HA PRO A 13 -8.755 5.435 -1.512 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -8.017 3.678 -3.572 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -6.913 4.107 -2.281 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -8.642 1.659 -2.560 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -6.981 1.778 -2.014 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -8.995 1.508 -0.237 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -7.598 2.493 0.146 1.00 0.00 H new ATOM 182 N SER A 14 -10.170 5.481 -3.606 1.00 0.00 N ATOM 183 CA SER A 14 -11.262 5.721 -4.544 1.00 0.00 C ATOM 184 C SER A 14 -11.782 4.415 -5.141 1.00 0.00 C ATOM 185 O SER A 14 -12.896 3.985 -4.838 1.00 0.00 O ATOM 186 CB SER A 14 -10.802 6.657 -5.663 1.00 0.00 C ATOM 187 OG SER A 14 -11.864 6.949 -6.554 1.00 0.00 O ATOM 0 H SER A 14 -9.372 6.105 -3.725 1.00 0.00 H new ATOM 0 HA SER A 14 -12.077 6.190 -3.992 1.00 0.00 H new ATOM 0 HB2 SER A 14 -10.420 7.583 -5.233 1.00 0.00 H new ATOM 0 HB3 SER A 14 -9.980 6.197 -6.211 1.00 0.00 H new ATOM 0 HG SER A 14 -11.544 7.550 -7.259 1.00 0.00 H new ATOM 193 N GLN A 15 -10.975 3.791 -5.994 1.00 0.00 N ATOM 194 CA GLN A 15 -11.365 2.538 -6.633 1.00 0.00 C ATOM 195 C GLN A 15 -10.139 1.725 -7.036 1.00 0.00 C ATOM 196 O GLN A 15 -10.118 1.107 -8.101 1.00 0.00 O ATOM 197 CB GLN A 15 -12.235 2.805 -7.869 1.00 0.00 C ATOM 198 CG GLN A 15 -12.999 4.120 -7.824 1.00 0.00 C ATOM 199 CD GLN A 15 -13.526 4.533 -9.184 1.00 0.00 C ATOM 200 OE1 GLN A 15 -13.964 3.697 -9.973 1.00 0.00 O ATOM 201 NE2 GLN A 15 -13.486 5.831 -9.465 1.00 0.00 N ATOM 0 H GLN A 15 -10.050 4.131 -6.258 1.00 0.00 H new ATOM 0 HA GLN A 15 -11.943 1.965 -5.908 1.00 0.00 H new ATOM 0 HB2 GLN A 15 -11.600 2.797 -8.755 1.00 0.00 H new ATOM 0 HB3 GLN A 15 -12.948 1.988 -7.981 1.00 0.00 H new ATOM 0 HG2 GLN A 15 -13.833 4.028 -7.128 1.00 0.00 H new ATOM 0 HG3 GLN A 15 -12.346 4.903 -7.438 1.00 0.00 H new ATOM 0 HE21 GLN A 15 -13.114 6.490 -8.781 1.00 0.00 H new ATOM 0 HE22 GLN A 15 -13.827 6.169 -10.365 1.00 0.00 H new ATOM 210 N LYS A 16 -9.120 1.728 -6.185 1.00 0.00 N ATOM 211 CA LYS A 16 -7.896 0.986 -6.464 1.00 0.00 C ATOM 212 C LYS A 16 -7.044 0.833 -5.208 1.00 0.00 C ATOM 213 O LYS A 16 -6.890 1.774 -4.430 1.00 0.00 O ATOM 214 CB LYS A 16 -7.090 1.688 -7.559 1.00 0.00 C ATOM 215 CG LYS A 16 -6.965 3.189 -7.357 1.00 0.00 C ATOM 216 CD LYS A 16 -7.362 3.953 -8.609 1.00 0.00 C ATOM 217 CE LYS A 16 -6.413 3.665 -9.761 1.00 0.00 C ATOM 218 NZ LYS A 16 -7.123 3.085 -10.934 1.00 0.00 N ATOM 0 H LYS A 16 -9.116 2.234 -5.299 1.00 0.00 H new ATOM 0 HA LYS A 16 -8.178 -0.009 -6.807 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -6.092 1.251 -7.600 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -7.561 1.498 -8.523 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -7.596 3.499 -6.524 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -5.938 3.437 -7.088 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -8.378 3.681 -8.896 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -7.366 5.022 -8.398 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -5.913 4.587 -10.059 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -5.637 2.975 -9.429 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -6.441 2.903 -11.698 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -7.579 2.192 -10.657 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -7.846 3.754 -11.268 1.00 0.00 H new ATOM 232 N ILE A 17 -6.490 -0.360 -5.023 1.00 0.00 N ATOM 233 CA ILE A 17 -5.647 -0.644 -3.868 1.00 0.00 C ATOM 234 C ILE A 17 -4.569 -1.662 -4.222 1.00 0.00 C ATOM 235 O ILE A 17 -4.831 -2.637 -4.926 1.00 0.00 O ATOM 236 CB ILE A 17 -6.474 -1.178 -2.683 1.00 0.00 C ATOM 237 CG1 ILE A 17 -5.567 -1.445 -1.480 1.00 0.00 C ATOM 238 CG2 ILE A 17 -7.217 -2.442 -3.084 1.00 0.00 C ATOM 239 CD1 ILE A 17 -6.308 -1.482 -0.162 1.00 0.00 C ATOM 0 H ILE A 17 -6.610 -1.148 -5.660 1.00 0.00 H new ATOM 0 HA ILE A 17 -5.179 0.296 -3.575 1.00 0.00 H new ATOM 0 HB ILE A 17 -7.208 -0.423 -2.400 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -5.054 -2.395 -1.626 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -4.800 -0.672 -1.435 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -7.797 -2.808 -2.237 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -7.888 -2.222 -3.915 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -6.500 -3.204 -3.389 1.00 0.00 H new ATOM 0 HD11 ILE A 17 -5.603 -1.676 0.646 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -6.799 -0.524 0.006 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -7.057 -2.274 -0.188 1.00 0.00 H new ATOM 251 N VAL A 18 -3.354 -1.428 -3.737 1.00 0.00 N ATOM 252 CA VAL A 18 -2.239 -2.327 -4.015 1.00 0.00 C ATOM 253 C VAL A 18 -1.673 -2.927 -2.733 1.00 0.00 C ATOM 254 O VAL A 18 -1.141 -2.214 -1.882 1.00 0.00 O ATOM 255 CB VAL A 18 -1.109 -1.600 -4.768 1.00 0.00 C ATOM 256 CG1 VAL A 18 0.016 -2.564 -5.112 1.00 0.00 C ATOM 257 CG2 VAL A 18 -1.649 -0.932 -6.022 1.00 0.00 C ATOM 0 H VAL A 18 -3.117 -0.627 -3.152 1.00 0.00 H new ATOM 0 HA VAL A 18 -2.632 -3.128 -4.641 1.00 0.00 H new ATOM 0 HB VAL A 18 -0.704 -0.827 -4.115 1.00 0.00 H new ATOM 0 HG11 VAL A 18 0.803 -2.030 -5.643 1.00 0.00 H new ATOM 0 HG12 VAL A 18 0.422 -2.991 -4.195 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -0.370 -3.363 -5.744 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -0.837 -0.423 -6.542 1.00 0.00 H new ATOM 0 HG22 VAL A 18 -2.083 -1.687 -6.678 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -2.415 -0.207 -5.747 1.00 0.00 H new ATOM 267 N PHE A 19 -1.782 -4.246 -2.606 1.00 0.00 N ATOM 268 CA PHE A 19 -1.270 -4.946 -1.434 1.00 0.00 C ATOM 269 C PHE A 19 0.253 -5.005 -1.475 1.00 0.00 C ATOM 270 O PHE A 19 0.835 -5.879 -2.117 1.00 0.00 O ATOM 271 CB PHE A 19 -1.848 -6.360 -1.364 1.00 0.00 C ATOM 272 CG PHE A 19 -3.220 -6.419 -0.754 1.00 0.00 C ATOM 273 CD1 PHE A 19 -4.160 -5.439 -1.035 1.00 0.00 C ATOM 274 CD2 PHE A 19 -3.569 -7.452 0.099 1.00 0.00 C ATOM 275 CE1 PHE A 19 -5.422 -5.490 -0.475 1.00 0.00 C ATOM 276 CE2 PHE A 19 -4.830 -7.509 0.661 1.00 0.00 C ATOM 277 CZ PHE A 19 -5.757 -6.527 0.374 1.00 0.00 C ATOM 0 H PHE A 19 -2.220 -4.851 -3.300 1.00 0.00 H new ATOM 0 HA PHE A 19 -1.576 -4.398 -0.543 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -1.888 -6.777 -2.370 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -1.174 -6.991 -0.784 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -3.903 -4.627 -1.699 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -2.847 -8.222 0.328 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -6.145 -4.720 -0.701 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -5.090 -8.321 1.324 1.00 0.00 H new ATOM 0 HZ PHE A 19 -6.743 -6.569 0.813 1.00 0.00 H new ATOM 287 N ASN A 20 0.893 -4.061 -0.795 1.00 0.00 N ATOM 288 CA ASN A 20 2.349 -3.994 -0.763 1.00 0.00 C ATOM 289 C ASN A 20 2.946 -5.137 0.053 1.00 0.00 C ATOM 290 O ASN A 20 2.473 -5.452 1.146 1.00 0.00 O ATOM 291 CB ASN A 20 2.805 -2.652 -0.191 1.00 0.00 C ATOM 292 CG ASN A 20 2.372 -1.481 -1.049 1.00 0.00 C ATOM 293 OD1 ASN A 20 2.971 -1.201 -2.088 1.00 0.00 O ATOM 294 ND2 ASN A 20 1.324 -0.788 -0.619 1.00 0.00 N ATOM 0 H ASN A 20 0.426 -3.331 -0.258 1.00 0.00 H new ATOM 0 HA ASN A 20 2.706 -4.090 -1.788 1.00 0.00 H new ATOM 0 HB2 ASN A 20 2.400 -2.532 0.814 1.00 0.00 H new ATOM 0 HB3 ASN A 20 3.891 -2.650 -0.099 1.00 0.00 H new ATOM 0 HD21 ASN A 20 0.986 0.011 -1.155 1.00 0.00 H new ATOM 0 HD22 ASN A 20 0.857 -1.055 0.248 1.00 0.00 H new ATOM 301 N ALA A 21 3.998 -5.744 -0.488 1.00 0.00 N ATOM 302 CA ALA A 21 4.685 -6.847 0.176 1.00 0.00 C ATOM 303 C ALA A 21 5.538 -6.324 1.333 1.00 0.00 C ATOM 304 O ALA A 21 5.674 -5.112 1.501 1.00 0.00 O ATOM 305 CB ALA A 21 5.543 -7.592 -0.837 1.00 0.00 C ATOM 0 H ALA A 21 4.396 -5.488 -1.392 1.00 0.00 H new ATOM 0 HA ALA A 21 3.948 -7.536 0.588 1.00 0.00 H new ATOM 0 HB1 ALA A 21 6.057 -8.416 -0.342 1.00 0.00 H new ATOM 0 HB2 ALA A 21 4.909 -7.984 -1.632 1.00 0.00 H new ATOM 0 HB3 ALA A 21 6.278 -6.909 -1.263 1.00 0.00 H new ATOM 311 N PRO A 22 6.129 -7.215 2.160 1.00 0.00 N ATOM 312 CA PRO A 22 6.013 -8.674 2.024 1.00 0.00 C ATOM 313 C PRO A 22 4.731 -9.230 2.631 1.00 0.00 C ATOM 314 O PRO A 22 4.060 -8.562 3.419 1.00 0.00 O ATOM 315 CB PRO A 22 7.223 -9.175 2.806 1.00 0.00 C ATOM 316 CG PRO A 22 7.406 -8.169 3.888 1.00 0.00 C ATOM 317 CD PRO A 22 6.976 -6.844 3.311 1.00 0.00 C ATOM 0 HA PRO A 22 5.981 -8.985 0.980 1.00 0.00 H new ATOM 0 HB2 PRO A 22 7.048 -10.170 3.214 1.00 0.00 H new ATOM 0 HB3 PRO A 22 8.107 -9.241 2.171 1.00 0.00 H new ATOM 0 HG2 PRO A 22 6.807 -8.425 4.762 1.00 0.00 H new ATOM 0 HG3 PRO A 22 8.446 -8.132 4.213 1.00 0.00 H new ATOM 0 HD2 PRO A 22 6.422 -6.252 4.040 1.00 0.00 H new ATOM 0 HD3 PRO A 22 7.833 -6.247 3.000 1.00 0.00 H new ATOM 325 N TYR A 23 4.403 -10.463 2.259 1.00 0.00 N ATOM 326 CA TYR A 23 3.208 -11.127 2.765 1.00 0.00 C ATOM 327 C TYR A 23 3.565 -12.131 3.853 1.00 0.00 C ATOM 328 O TYR A 23 3.073 -13.260 3.859 1.00 0.00 O ATOM 329 CB TYR A 23 2.473 -11.829 1.624 1.00 0.00 C ATOM 330 CG TYR A 23 1.856 -10.870 0.638 1.00 0.00 C ATOM 331 CD1 TYR A 23 0.993 -9.870 1.067 1.00 0.00 C ATOM 332 CD2 TYR A 23 2.139 -10.957 -0.718 1.00 0.00 C ATOM 333 CE1 TYR A 23 0.429 -8.985 0.173 1.00 0.00 C ATOM 334 CE2 TYR A 23 1.579 -10.074 -1.620 1.00 0.00 C ATOM 335 CZ TYR A 23 0.724 -9.090 -1.170 1.00 0.00 C ATOM 336 OH TYR A 23 0.162 -8.209 -2.065 1.00 0.00 O ATOM 0 H TYR A 23 4.951 -11.024 1.606 1.00 0.00 H new ATOM 0 HA TYR A 23 2.554 -10.370 3.198 1.00 0.00 H new ATOM 0 HB2 TYR A 23 3.170 -12.482 1.099 1.00 0.00 H new ATOM 0 HB3 TYR A 23 1.692 -12.465 2.040 1.00 0.00 H new ATOM 0 HD1 TYR A 23 0.760 -9.784 2.118 1.00 0.00 H new ATOM 0 HD2 TYR A 23 2.808 -11.727 -1.073 1.00 0.00 H new ATOM 0 HE1 TYR A 23 -0.241 -8.213 0.523 1.00 0.00 H new ATOM 0 HE2 TYR A 23 1.809 -10.154 -2.672 1.00 0.00 H new ATOM 0 HH TYR A 23 0.724 -7.409 -2.133 1.00 0.00 H new ATOM 346 N ASP A 24 4.423 -11.710 4.774 1.00 0.00 N ATOM 347 CA ASP A 24 4.851 -12.565 5.874 1.00 0.00 C ATOM 348 C ASP A 24 4.600 -11.902 7.228 1.00 0.00 C ATOM 349 O ASP A 24 5.036 -12.408 8.262 1.00 0.00 O ATOM 350 CB ASP A 24 6.335 -12.899 5.733 1.00 0.00 C ATOM 351 CG ASP A 24 6.632 -13.700 4.480 1.00 0.00 C ATOM 352 OD1 ASP A 24 5.948 -14.718 4.250 1.00 0.00 O ATOM 353 OD2 ASP A 24 7.549 -13.306 3.729 1.00 0.00 O ATOM 0 H ASP A 24 4.837 -10.778 4.781 1.00 0.00 H new ATOM 0 HA ASP A 24 4.264 -13.482 5.830 1.00 0.00 H new ATOM 0 HB2 ASP A 24 6.912 -11.975 5.715 1.00 0.00 H new ATOM 0 HB3 ASP A 24 6.662 -13.462 6.607 1.00 0.00 H new ATOM 358 N ASP A 25 3.901 -10.767 7.224 1.00 0.00 N ATOM 359 CA ASP A 25 3.610 -10.052 8.461 1.00 0.00 C ATOM 360 C ASP A 25 2.161 -9.561 8.505 1.00 0.00 C ATOM 361 O ASP A 25 1.784 -8.808 9.403 1.00 0.00 O ATOM 362 CB ASP A 25 4.558 -8.865 8.616 1.00 0.00 C ATOM 363 CG ASP A 25 4.736 -8.447 10.062 1.00 0.00 C ATOM 364 OD1 ASP A 25 5.574 -9.058 10.759 1.00 0.00 O ATOM 365 OD2 ASP A 25 4.035 -7.510 10.500 1.00 0.00 O ATOM 0 H ASP A 25 3.529 -10.327 6.382 1.00 0.00 H new ATOM 0 HA ASP A 25 3.755 -10.750 9.286 1.00 0.00 H new ATOM 0 HB2 ASP A 25 5.529 -9.123 8.194 1.00 0.00 H new ATOM 0 HB3 ASP A 25 4.175 -8.021 8.042 1.00 0.00 H new ATOM 370 N LYS A 26 1.352 -9.986 7.538 1.00 0.00 N ATOM 371 CA LYS A 26 -0.047 -9.578 7.486 1.00 0.00 C ATOM 372 C LYS A 26 -0.165 -8.069 7.307 1.00 0.00 C ATOM 373 O LYS A 26 0.568 -7.301 7.930 1.00 0.00 O ATOM 374 CB LYS A 26 -0.775 -10.008 8.761 1.00 0.00 C ATOM 375 CG LYS A 26 -0.822 -11.514 8.957 1.00 0.00 C ATOM 376 CD LYS A 26 -1.656 -11.890 10.170 1.00 0.00 C ATOM 377 CE LYS A 26 -2.682 -12.959 9.830 1.00 0.00 C ATOM 378 NZ LYS A 26 -3.060 -13.766 11.023 1.00 0.00 N ATOM 0 H LYS A 26 1.640 -10.610 6.784 1.00 0.00 H new ATOM 0 HA LYS A 26 -0.510 -10.067 6.629 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -0.283 -9.553 9.621 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -1.794 -9.621 8.735 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -1.239 -11.985 8.067 1.00 0.00 H new ATOM 0 HG3 LYS A 26 0.191 -11.899 9.077 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -1.003 -12.251 10.965 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -2.164 -11.005 10.552 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -3.572 -12.488 9.413 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -2.279 -13.617 9.060 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -3.761 -14.483 10.749 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -2.215 -14.236 11.406 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -3.468 -13.143 11.749 1.00 0.00 H new ATOM 392 N HIS A 27 -1.091 -7.648 6.452 1.00 0.00 N ATOM 393 CA HIS A 27 -1.301 -6.230 6.192 1.00 0.00 C ATOM 394 C HIS A 27 -2.788 -5.913 6.066 1.00 0.00 C ATOM 395 O HIS A 27 -3.376 -6.064 4.995 1.00 0.00 O ATOM 396 CB HIS A 27 -0.567 -5.812 4.917 1.00 0.00 C ATOM 397 CG HIS A 27 0.807 -5.273 5.168 1.00 0.00 C ATOM 398 ND1 HIS A 27 1.084 -4.267 6.066 1.00 0.00 N ATOM 399 CD2 HIS A 27 1.997 -5.624 4.618 1.00 0.00 C ATOM 400 CE1 HIS A 27 2.404 -4.040 6.034 1.00 0.00 C ATOM 401 NE2 HIS A 27 3.004 -4.839 5.172 1.00 0.00 N ATOM 0 H HIS A 27 -1.707 -8.269 5.928 1.00 0.00 H new ATOM 0 HA HIS A 27 -0.900 -5.667 7.035 1.00 0.00 H new ATOM 0 HB2 HIS A 27 -0.495 -6.671 4.250 1.00 0.00 H new ATOM 0 HB3 HIS A 27 -1.157 -5.055 4.399 1.00 0.00 H new ATOM 0 HD2 HIS A 27 2.140 -6.390 3.870 1.00 0.00 H new ATOM 0 HE1 HIS A 27 2.911 -3.300 6.635 1.00 0.00 H new ATOM 0 HE2 HIS A 27 4.000 -4.874 4.956 1.00 0.00 H new ATOM 409 N THR A 28 -3.389 -5.469 7.165 1.00 0.00 N ATOM 410 CA THR A 28 -4.807 -5.130 7.176 1.00 0.00 C ATOM 411 C THR A 28 -5.051 -3.788 6.494 1.00 0.00 C ATOM 412 O THR A 28 -4.551 -2.754 6.938 1.00 0.00 O ATOM 413 CB THR A 28 -5.331 -5.089 8.613 1.00 0.00 C ATOM 414 OG1 THR A 28 -4.898 -6.225 9.338 1.00 0.00 O ATOM 415 CG2 THR A 28 -6.841 -5.038 8.696 1.00 0.00 C ATOM 0 H THR A 28 -2.916 -5.336 8.059 1.00 0.00 H new ATOM 0 HA THR A 28 -5.344 -5.900 6.623 1.00 0.00 H new ATOM 0 HB THR A 28 -4.928 -4.172 9.042 1.00 0.00 H new ATOM 0 HG1 THR A 28 -5.242 -6.179 10.254 1.00 0.00 H new ATOM 0 HG21 THR A 28 -7.147 -5.011 9.742 1.00 0.00 H new ATOM 0 HG22 THR A 28 -7.203 -4.144 8.188 1.00 0.00 H new ATOM 0 HG23 THR A 28 -7.262 -5.923 8.218 1.00 0.00 H new ATOM 423 N TYR A 29 -5.822 -3.811 5.411 1.00 0.00 N ATOM 424 CA TYR A 29 -6.133 -2.595 4.668 1.00 0.00 C ATOM 425 C TYR A 29 -7.535 -2.101 5.004 1.00 0.00 C ATOM 426 O TYR A 29 -8.530 -2.741 4.662 1.00 0.00 O ATOM 427 CB TYR A 29 -6.009 -2.846 3.165 1.00 0.00 C ATOM 428 CG TYR A 29 -4.602 -3.178 2.721 1.00 0.00 C ATOM 429 CD1 TYR A 29 -3.657 -2.177 2.536 1.00 0.00 C ATOM 430 CD2 TYR A 29 -4.219 -4.493 2.488 1.00 0.00 C ATOM 431 CE1 TYR A 29 -2.369 -2.476 2.132 1.00 0.00 C ATOM 432 CE2 TYR A 29 -2.933 -4.801 2.085 1.00 0.00 C ATOM 433 CZ TYR A 29 -2.013 -3.789 1.908 1.00 0.00 C ATOM 434 OH TYR A 29 -0.732 -4.093 1.506 1.00 0.00 O ATOM 0 H TYR A 29 -6.243 -4.658 5.029 1.00 0.00 H new ATOM 0 HA TYR A 29 -5.418 -1.825 4.957 1.00 0.00 H new ATOM 0 HB2 TYR A 29 -6.672 -3.665 2.886 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -6.351 -1.962 2.628 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -3.933 -1.148 2.711 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -4.938 -5.288 2.624 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -1.646 -1.686 1.993 1.00 0.00 H new ATOM 0 HE2 TYR A 29 -2.650 -5.829 1.910 1.00 0.00 H new ATOM 0 HH TYR A 29 -0.646 -5.063 1.393 1.00 0.00 H new ATOM 444 N HIS A 30 -7.608 -0.961 5.683 1.00 0.00 N ATOM 445 CA HIS A 30 -8.888 -0.382 6.073 1.00 0.00 C ATOM 446 C HIS A 30 -9.486 0.449 4.943 1.00 0.00 C ATOM 447 O HIS A 30 -8.792 1.239 4.304 1.00 0.00 O ATOM 448 CB HIS A 30 -8.717 0.487 7.319 1.00 0.00 C ATOM 449 CG HIS A 30 -8.940 -0.254 8.602 1.00 0.00 C ATOM 450 ND1 HIS A 30 -7.926 -0.794 9.362 1.00 0.00 N ATOM 451 CD2 HIS A 30 -10.092 -0.537 9.260 1.00 0.00 C ATOM 452 CE1 HIS A 30 -8.481 -1.377 10.433 1.00 0.00 C ATOM 453 NE2 HIS A 30 -9.793 -1.249 10.418 1.00 0.00 N ATOM 0 H HIS A 30 -6.794 -0.419 5.975 1.00 0.00 H new ATOM 0 HA HIS A 30 -9.572 -1.202 6.294 1.00 0.00 H new ATOM 0 HB2 HIS A 30 -7.712 0.909 7.323 1.00 0.00 H new ATOM 0 HB3 HIS A 30 -9.413 1.324 7.267 1.00 0.00 H new ATOM 0 HD2 HIS A 30 -11.083 -0.255 8.937 1.00 0.00 H new ATOM 0 HE1 HIS A 30 -7.926 -1.885 11.208 1.00 0.00 H new ATOM 0 HE2 HIS A 30 -10.453 -1.600 11.112 1.00 0.00 H new ATOM 461 N ILE A 31 -10.782 0.269 4.709 1.00 0.00 N ATOM 462 CA ILE A 31 -11.483 1.005 3.664 1.00 0.00 C ATOM 463 C ILE A 31 -12.501 1.964 4.271 1.00 0.00 C ATOM 464 O ILE A 31 -13.206 1.617 5.219 1.00 0.00 O ATOM 465 CB ILE A 31 -12.204 0.051 2.691 1.00 0.00 C ATOM 466 CG1 ILE A 31 -11.205 -0.923 2.064 1.00 0.00 C ATOM 467 CG2 ILE A 31 -12.932 0.839 1.612 1.00 0.00 C ATOM 468 CD1 ILE A 31 -11.819 -1.830 1.020 1.00 0.00 C ATOM 0 H ILE A 31 -11.369 -0.382 5.231 1.00 0.00 H new ATOM 0 HA ILE A 31 -10.734 1.571 3.110 1.00 0.00 H new ATOM 0 HB ILE A 31 -12.942 -0.523 3.251 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -10.394 -0.355 1.609 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -10.764 -1.535 2.851 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -13.435 0.149 0.934 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -13.669 1.495 2.075 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -12.214 1.438 1.052 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -11.053 -2.493 0.618 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -12.611 -2.424 1.475 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -12.236 -1.227 0.213 1.00 0.00 H new ATOM 480 N LYS A 32 -12.572 3.173 3.725 1.00 0.00 N ATOM 481 CA LYS A 32 -13.503 4.178 4.223 1.00 0.00 C ATOM 482 C LYS A 32 -14.607 4.462 3.208 1.00 0.00 C ATOM 483 O LYS A 32 -14.333 4.792 2.053 1.00 0.00 O ATOM 484 CB LYS A 32 -12.757 5.471 4.555 1.00 0.00 C ATOM 485 CG LYS A 32 -12.638 5.737 6.047 1.00 0.00 C ATOM 486 CD LYS A 32 -12.969 7.181 6.383 1.00 0.00 C ATOM 487 CE LYS A 32 -11.977 7.761 7.378 1.00 0.00 C ATOM 488 NZ LYS A 32 -10.626 7.936 6.777 1.00 0.00 N ATOM 0 H LYS A 32 -11.998 3.480 2.940 1.00 0.00 H new ATOM 0 HA LYS A 32 -13.966 3.786 5.129 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -11.758 5.426 4.121 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -13.272 6.309 4.085 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -13.310 5.073 6.591 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -11.625 5.508 6.379 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -12.964 7.779 5.471 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -13.976 7.238 6.796 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -12.343 8.723 7.736 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -11.906 7.104 8.245 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -10.082 8.622 7.339 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -10.128 7.023 6.770 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -10.722 8.286 5.802 1.00 0.00 H new ATOM 502 N ILE A 33 -15.854 4.336 3.650 1.00 0.00 N ATOM 503 CA ILE A 33 -17.001 4.584 2.785 1.00 0.00 C ATOM 504 C ILE A 33 -17.876 5.698 3.349 1.00 0.00 C ATOM 505 O ILE A 33 -17.876 5.951 4.553 1.00 0.00 O ATOM 506 CB ILE A 33 -17.858 3.315 2.604 1.00 0.00 C ATOM 507 CG1 ILE A 33 -16.976 2.129 2.214 1.00 0.00 C ATOM 508 CG2 ILE A 33 -18.935 3.548 1.556 1.00 0.00 C ATOM 509 CD1 ILE A 33 -17.578 0.789 2.579 1.00 0.00 C ATOM 0 H ILE A 33 -16.096 4.063 4.603 1.00 0.00 H new ATOM 0 HA ILE A 33 -16.607 4.885 1.814 1.00 0.00 H new ATOM 0 HB ILE A 33 -18.345 3.085 3.552 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -16.795 2.158 1.139 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -16.007 2.229 2.703 1.00 0.00 H new ATOM 0 HG21 ILE A 33 -19.531 2.643 1.440 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -19.579 4.369 1.872 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -18.468 3.799 0.604 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -16.901 -0.009 2.274 1.00 0.00 H new ATOM 0 HD12 ILE A 33 -17.733 0.741 3.657 1.00 0.00 H new ATOM 0 HD13 ILE A 33 -18.534 0.668 2.069 1.00 0.00 H new ATOM 521 N THR A 34 -18.619 6.364 2.472 1.00 0.00 N ATOM 522 CA THR A 34 -19.494 7.455 2.888 1.00 0.00 C ATOM 523 C THR A 34 -20.702 7.575 1.967 1.00 0.00 C ATOM 524 O THR A 34 -20.677 7.120 0.824 1.00 0.00 O ATOM 525 CB THR A 34 -18.722 8.776 2.912 1.00 0.00 C ATOM 526 OG1 THR A 34 -17.717 8.751 3.910 1.00 0.00 O ATOM 527 CG2 THR A 34 -19.601 9.982 3.177 1.00 0.00 C ATOM 0 H THR A 34 -18.633 6.169 1.471 1.00 0.00 H new ATOM 0 HA THR A 34 -19.852 7.232 3.893 1.00 0.00 H new ATOM 0 HB THR A 34 -18.290 8.874 1.916 1.00 0.00 H new ATOM 0 HG1 THR A 34 -17.233 9.603 3.909 1.00 0.00 H new ATOM 0 HG21 THR A 34 -18.989 10.884 3.180 1.00 0.00 H new ATOM 0 HG22 THR A 34 -20.358 10.059 2.396 1.00 0.00 H new ATOM 0 HG23 THR A 34 -20.089 9.871 4.145 1.00 0.00 H new ATOM 535 N ASN A 35 -21.755 8.199 2.480 1.00 0.00 N ATOM 536 CA ASN A 35 -22.980 8.394 1.717 1.00 0.00 C ATOM 537 C ASN A 35 -23.001 9.777 1.073 1.00 0.00 C ATOM 538 O ASN A 35 -23.149 10.789 1.756 1.00 0.00 O ATOM 539 CB ASN A 35 -24.202 8.220 2.621 1.00 0.00 C ATOM 540 CG ASN A 35 -25.298 7.404 1.965 1.00 0.00 C ATOM 541 OD1 ASN A 35 -25.950 6.586 2.612 1.00 0.00 O ATOM 542 ND2 ASN A 35 -25.506 7.623 0.672 1.00 0.00 N ATOM 0 H ASN A 35 -21.784 8.580 3.426 1.00 0.00 H new ATOM 0 HA ASN A 35 -23.013 7.643 0.928 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -23.898 7.735 3.548 1.00 0.00 H new ATOM 0 HB3 ASN A 35 -24.595 9.201 2.889 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -26.230 7.103 0.177 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -24.942 8.311 0.174 1.00 0.00 H new ATOM 549 N ALA A 36 -22.851 9.811 -0.244 1.00 0.00 N ATOM 550 CA ALA A 36 -22.854 11.069 -0.982 1.00 0.00 C ATOM 551 C ALA A 36 -24.241 11.377 -1.536 1.00 0.00 C ATOM 552 O ALA A 36 -24.383 12.132 -2.498 1.00 0.00 O ATOM 553 CB ALA A 36 -21.839 11.018 -2.111 1.00 0.00 C ATOM 0 H ALA A 36 -22.726 8.982 -0.825 1.00 0.00 H new ATOM 0 HA ALA A 36 -22.579 11.867 -0.292 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -21.851 11.963 -2.654 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -20.844 10.849 -1.699 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -22.092 10.205 -2.792 1.00 0.00 H new ATOM 559 N GLY A 37 -25.260 10.786 -0.923 1.00 0.00 N ATOM 560 CA GLY A 37 -26.623 11.004 -1.367 1.00 0.00 C ATOM 561 C GLY A 37 -27.470 11.708 -0.325 1.00 0.00 C ATOM 562 O GLY A 37 -26.955 12.467 0.495 1.00 0.00 O ATOM 0 H GLY A 37 -25.166 10.158 -0.125 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -26.613 11.596 -2.282 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -27.079 10.045 -1.613 1.00 0.00 H new ATOM 566 N GLY A 38 -28.775 11.455 -0.358 1.00 0.00 N ATOM 567 CA GLY A 38 -29.675 12.078 0.595 1.00 0.00 C ATOM 568 C GLY A 38 -30.380 11.068 1.481 1.00 0.00 C ATOM 569 O GLY A 38 -30.886 11.416 2.548 1.00 0.00 O ATOM 0 H GLY A 38 -29.225 10.830 -1.027 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -29.113 12.773 1.219 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -30.419 12.664 0.056 1.00 0.00 H new ATOM 573 N ARG A 39 -30.415 9.814 1.041 1.00 0.00 N ATOM 574 CA ARG A 39 -31.065 8.754 1.804 1.00 0.00 C ATOM 575 C ARG A 39 -30.085 7.629 2.122 1.00 0.00 C ATOM 576 O ARG A 39 -29.123 7.406 1.388 1.00 0.00 O ATOM 577 CB ARG A 39 -32.261 8.199 1.030 1.00 0.00 C ATOM 578 CG ARG A 39 -33.105 9.270 0.360 1.00 0.00 C ATOM 579 CD ARG A 39 -34.541 9.241 0.857 1.00 0.00 C ATOM 580 NE ARG A 39 -35.437 8.595 -0.097 1.00 0.00 N ATOM 581 CZ ARG A 39 -36.710 8.313 0.165 1.00 0.00 C ATOM 582 NH1 ARG A 39 -37.230 8.622 1.345 1.00 0.00 N ATOM 583 NH2 ARG A 39 -37.463 7.724 -0.753 1.00 0.00 N ATOM 0 H ARG A 39 -30.001 9.507 0.161 1.00 0.00 H new ATOM 0 HA ARG A 39 -31.415 9.182 2.743 1.00 0.00 H new ATOM 0 HB2 ARG A 39 -31.901 7.505 0.271 1.00 0.00 H new ATOM 0 HB3 ARG A 39 -32.890 7.627 1.712 1.00 0.00 H new ATOM 0 HG2 ARG A 39 -32.671 10.251 0.555 1.00 0.00 H new ATOM 0 HG3 ARG A 39 -33.090 9.124 -0.720 1.00 0.00 H new ATOM 0 HD2 ARG A 39 -34.584 8.713 1.810 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -34.881 10.260 1.041 1.00 0.00 H new ATOM 0 HE ARG A 39 -35.067 8.346 -1.014 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -36.654 9.077 2.053 1.00 0.00 H new ATOM 0 HH12 ARG A 39 -38.206 8.405 1.545 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -37.066 7.486 -1.662 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -38.439 7.508 -0.550 1.00 0.00 H new ATOM 597 N ARG A 40 -30.338 6.922 3.219 1.00 0.00 N ATOM 598 CA ARG A 40 -29.478 5.817 3.631 1.00 0.00 C ATOM 599 C ARG A 40 -29.315 4.808 2.499 1.00 0.00 C ATOM 600 O ARG A 40 -30.022 4.872 1.493 1.00 0.00 O ATOM 601 CB ARG A 40 -30.056 5.129 4.869 1.00 0.00 C ATOM 602 CG ARG A 40 -31.570 4.986 4.837 1.00 0.00 C ATOM 603 CD ARG A 40 -32.234 5.855 5.894 1.00 0.00 C ATOM 604 NE ARG A 40 -31.895 5.427 7.249 1.00 0.00 N ATOM 605 CZ ARG A 40 -32.081 6.181 8.328 1.00 0.00 C ATOM 606 NH1 ARG A 40 -32.596 7.397 8.209 1.00 0.00 N ATOM 607 NH2 ARG A 40 -31.752 5.718 9.526 1.00 0.00 N ATOM 0 H ARG A 40 -31.130 7.094 3.838 1.00 0.00 H new ATOM 0 HA ARG A 40 -28.496 6.221 3.877 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -29.608 4.140 4.967 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -29.772 5.696 5.755 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -31.942 5.263 3.851 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -31.842 3.943 4.999 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -31.928 6.892 5.755 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -33.316 5.821 5.763 1.00 0.00 H new ATOM 0 HE ARG A 40 -31.493 4.498 7.374 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -32.850 7.755 7.288 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -32.738 7.974 9.038 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -31.356 4.783 9.620 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -31.895 6.297 10.353 1.00 0.00 H new ATOM 621 N ILE A 41 -28.379 3.879 2.665 1.00 0.00 N ATOM 622 CA ILE A 41 -28.128 2.864 1.649 1.00 0.00 C ATOM 623 C ILE A 41 -27.502 1.611 2.249 1.00 0.00 C ATOM 624 O ILE A 41 -26.755 1.683 3.226 1.00 0.00 O ATOM 625 CB ILE A 41 -27.196 3.396 0.543 1.00 0.00 C ATOM 626 CG1 ILE A 41 -25.829 3.758 1.128 1.00 0.00 C ATOM 627 CG2 ILE A 41 -27.817 4.600 -0.144 1.00 0.00 C ATOM 628 CD1 ILE A 41 -24.868 4.328 0.109 1.00 0.00 C ATOM 0 H ILE A 41 -27.784 3.808 3.490 1.00 0.00 H new ATOM 0 HA ILE A 41 -29.098 2.612 1.220 1.00 0.00 H new ATOM 0 HB ILE A 41 -27.058 2.611 -0.200 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -25.967 4.482 1.931 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -25.387 2.868 1.575 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -27.145 4.962 -0.922 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -28.769 4.313 -0.592 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -27.984 5.390 0.588 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -23.920 4.562 0.594 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -24.701 3.597 -0.682 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -25.290 5.237 -0.320 1.00 0.00 H new ATOM 640 N GLY A 42 -27.801 0.464 1.644 1.00 0.00 N ATOM 641 CA GLY A 42 -27.252 -0.795 2.112 1.00 0.00 C ATOM 642 C GLY A 42 -26.176 -1.315 1.179 1.00 0.00 C ATOM 643 O GLY A 42 -26.460 -1.673 0.036 1.00 0.00 O ATOM 0 H GLY A 42 -28.417 0.386 0.835 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -26.836 -0.662 3.111 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -28.050 -1.533 2.195 1.00 0.00 H new ATOM 647 N TRP A 43 -24.937 -1.338 1.658 1.00 0.00 N ATOM 648 CA TRP A 43 -23.813 -1.794 0.848 1.00 0.00 C ATOM 649 C TRP A 43 -23.390 -3.212 1.212 1.00 0.00 C ATOM 650 O TRP A 43 -23.709 -3.719 2.288 1.00 0.00 O ATOM 651 CB TRP A 43 -22.628 -0.844 1.016 1.00 0.00 C ATOM 652 CG TRP A 43 -22.233 -0.641 2.445 1.00 0.00 C ATOM 653 CD1 TRP A 43 -22.721 0.299 3.306 1.00 0.00 C ATOM 654 CD2 TRP A 43 -21.266 -1.398 3.183 1.00 0.00 C ATOM 655 NE1 TRP A 43 -22.118 0.173 4.534 1.00 0.00 N ATOM 656 CE2 TRP A 43 -21.221 -0.860 4.483 1.00 0.00 C ATOM 657 CE3 TRP A 43 -20.435 -2.477 2.870 1.00 0.00 C ATOM 658 CZ2 TRP A 43 -20.377 -1.366 5.469 1.00 0.00 C ATOM 659 CZ3 TRP A 43 -19.598 -2.978 3.849 1.00 0.00 C ATOM 660 CH2 TRP A 43 -19.574 -2.423 5.135 1.00 0.00 C ATOM 0 H TRP A 43 -24.686 -1.046 2.603 1.00 0.00 H new ATOM 0 HA TRP A 43 -24.138 -1.798 -0.192 1.00 0.00 H new ATOM 0 HB2 TRP A 43 -21.775 -1.236 0.462 1.00 0.00 H new ATOM 0 HB3 TRP A 43 -22.879 0.121 0.575 1.00 0.00 H new ATOM 0 HD1 TRP A 43 -23.472 1.035 3.058 1.00 0.00 H new ATOM 0 HE1 TRP A 43 -22.308 0.754 5.350 1.00 0.00 H new ATOM 0 HE3 TRP A 43 -20.447 -2.911 1.881 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 -20.357 -0.940 6.461 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 -18.951 -3.812 3.619 1.00 0.00 H new ATOM 0 HH2 TRP A 43 -18.909 -2.837 5.878 1.00 0.00 H new ATOM 671 N ALA A 44 -22.656 -3.837 0.298 1.00 0.00 N ATOM 672 CA ALA A 44 -22.160 -5.193 0.492 1.00 0.00 C ATOM 673 C ALA A 44 -20.795 -5.352 -0.170 1.00 0.00 C ATOM 674 O ALA A 44 -20.490 -4.669 -1.148 1.00 0.00 O ATOM 675 CB ALA A 44 -23.146 -6.207 -0.068 1.00 0.00 C ATOM 0 H ALA A 44 -22.390 -3.420 -0.594 1.00 0.00 H new ATOM 0 HA ALA A 44 -22.053 -5.376 1.561 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -22.759 -7.214 0.086 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -24.103 -6.104 0.443 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -23.283 -6.030 -1.135 1.00 0.00 H new ATOM 681 N ILE A 45 -19.972 -6.244 0.369 1.00 0.00 N ATOM 682 CA ILE A 45 -18.639 -6.467 -0.177 1.00 0.00 C ATOM 683 C ILE A 45 -18.486 -7.873 -0.747 1.00 0.00 C ATOM 684 O ILE A 45 -19.034 -8.836 -0.213 1.00 0.00 O ATOM 685 CB ILE A 45 -17.553 -6.240 0.891 1.00 0.00 C ATOM 686 CG1 ILE A 45 -17.825 -4.946 1.658 1.00 0.00 C ATOM 687 CG2 ILE A 45 -16.175 -6.201 0.247 1.00 0.00 C ATOM 688 CD1 ILE A 45 -17.739 -3.704 0.798 1.00 0.00 C ATOM 0 H ILE A 45 -20.202 -6.821 1.178 1.00 0.00 H new ATOM 0 HA ILE A 45 -18.512 -5.745 -0.984 1.00 0.00 H new ATOM 0 HB ILE A 45 -17.579 -7.071 1.596 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -18.817 -5.000 2.105 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -17.110 -4.861 2.477 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -15.419 -6.040 1.015 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -15.983 -7.147 -0.259 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -16.135 -5.388 -0.478 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -17.943 -2.824 1.408 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -16.739 -3.626 0.371 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -18.473 -3.766 -0.006 1.00 0.00 H new ATOM 700 N LYS A 46 -17.728 -7.976 -1.834 1.00 0.00 N ATOM 701 CA LYS A 46 -17.483 -9.256 -2.488 1.00 0.00 C ATOM 702 C LYS A 46 -16.006 -9.398 -2.837 1.00 0.00 C ATOM 703 O LYS A 46 -15.350 -8.422 -3.196 1.00 0.00 O ATOM 704 CB LYS A 46 -18.333 -9.376 -3.753 1.00 0.00 C ATOM 705 CG LYS A 46 -19.721 -9.942 -3.503 1.00 0.00 C ATOM 706 CD LYS A 46 -19.687 -11.454 -3.354 1.00 0.00 C ATOM 707 CE LYS A 46 -20.814 -12.115 -4.130 1.00 0.00 C ATOM 708 NZ LYS A 46 -22.149 -11.775 -3.569 1.00 0.00 N ATOM 0 H LYS A 46 -17.270 -7.183 -2.283 1.00 0.00 H new ATOM 0 HA LYS A 46 -17.760 -10.055 -1.800 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -18.428 -8.392 -4.211 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -17.814 -10.012 -4.470 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -20.140 -9.496 -2.601 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -20.380 -9.671 -4.328 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -18.729 -11.834 -3.707 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -19.766 -11.719 -2.300 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -20.768 -11.802 -5.173 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -20.679 -13.197 -4.115 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -22.890 -12.246 -4.127 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -22.203 -12.096 -2.581 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -22.289 -10.745 -3.606 1.00 0.00 H new ATOM 722 N THR A 47 -15.485 -10.614 -2.729 1.00 0.00 N ATOM 723 CA THR A 47 -14.081 -10.872 -3.033 1.00 0.00 C ATOM 724 C THR A 47 -13.918 -12.177 -3.803 1.00 0.00 C ATOM 725 O THR A 47 -14.712 -13.105 -3.650 1.00 0.00 O ATOM 726 CB THR A 47 -13.259 -10.919 -1.745 1.00 0.00 C ATOM 727 OG1 THR A 47 -13.751 -11.922 -0.873 1.00 0.00 O ATOM 728 CG2 THR A 47 -13.260 -9.609 -0.986 1.00 0.00 C ATOM 0 H THR A 47 -16.011 -11.436 -2.434 1.00 0.00 H new ATOM 0 HA THR A 47 -13.717 -10.057 -3.659 1.00 0.00 H new ATOM 0 HB THR A 47 -12.239 -11.136 -2.061 1.00 0.00 H new ATOM 0 HG1 THR A 47 -13.211 -11.938 -0.055 1.00 0.00 H new ATOM 0 HG21 THR A 47 -12.658 -9.711 -0.083 1.00 0.00 H new ATOM 0 HG22 THR A 47 -12.840 -8.824 -1.615 1.00 0.00 H new ATOM 0 HG23 THR A 47 -14.282 -9.347 -0.713 1.00 0.00 H new ATOM 736 N THR A 48 -12.882 -12.241 -4.633 1.00 0.00 N ATOM 737 CA THR A 48 -12.611 -13.432 -5.429 1.00 0.00 C ATOM 738 C THR A 48 -12.354 -14.639 -4.532 1.00 0.00 C ATOM 739 O THR A 48 -12.739 -15.761 -4.859 1.00 0.00 O ATOM 740 CB THR A 48 -11.407 -13.197 -6.342 1.00 0.00 C ATOM 741 OG1 THR A 48 -10.518 -12.256 -5.768 1.00 0.00 O ATOM 742 CG2 THR A 48 -11.788 -12.690 -7.716 1.00 0.00 C ATOM 0 H THR A 48 -12.216 -11.481 -4.772 1.00 0.00 H new ATOM 0 HA THR A 48 -13.489 -13.637 -6.041 1.00 0.00 H new ATOM 0 HB THR A 48 -10.933 -14.172 -6.451 1.00 0.00 H new ATOM 0 HG1 THR A 48 -9.595 -12.565 -5.883 1.00 0.00 H new ATOM 0 HG21 THR A 48 -10.888 -12.544 -8.313 1.00 0.00 H new ATOM 0 HG22 THR A 48 -12.434 -13.418 -8.206 1.00 0.00 H new ATOM 0 HG23 THR A 48 -12.317 -11.742 -7.620 1.00 0.00 H new ATOM 750 N ASN A 49 -11.701 -14.398 -3.401 1.00 0.00 N ATOM 751 CA ASN A 49 -11.391 -15.462 -2.455 1.00 0.00 C ATOM 752 C ASN A 49 -11.643 -15.005 -1.022 1.00 0.00 C ATOM 753 O ASN A 49 -10.968 -14.107 -0.520 1.00 0.00 O ATOM 754 CB ASN A 49 -9.936 -15.904 -2.613 1.00 0.00 C ATOM 755 CG ASN A 49 -9.706 -16.691 -3.889 1.00 0.00 C ATOM 756 OD1 ASN A 49 -8.928 -16.283 -4.752 1.00 0.00 O ATOM 757 ND2 ASN A 49 -10.385 -17.825 -4.015 1.00 0.00 N ATOM 0 H ASN A 49 -11.376 -13.474 -3.117 1.00 0.00 H new ATOM 0 HA ASN A 49 -12.046 -16.307 -2.668 1.00 0.00 H new ATOM 0 HB2 ASN A 49 -9.290 -15.026 -2.609 1.00 0.00 H new ATOM 0 HB3 ASN A 49 -9.649 -16.514 -1.756 1.00 0.00 H new ATOM 0 HD21 ASN A 49 -10.272 -18.396 -4.852 1.00 0.00 H new ATOM 0 HD22 ASN A 49 -11.019 -18.125 -3.274 1.00 0.00 H new ATOM 764 N MET A 50 -12.619 -15.628 -0.369 1.00 0.00 N ATOM 765 CA MET A 50 -12.957 -15.283 1.008 1.00 0.00 C ATOM 766 C MET A 50 -12.164 -16.124 2.009 1.00 0.00 C ATOM 767 O MET A 50 -12.453 -16.107 3.206 1.00 0.00 O ATOM 768 CB MET A 50 -14.456 -15.468 1.246 1.00 0.00 C ATOM 769 CG MET A 50 -15.329 -14.665 0.295 1.00 0.00 C ATOM 770 SD MET A 50 -16.998 -14.413 0.929 1.00 0.00 S ATOM 771 CE MET A 50 -16.698 -13.176 2.190 1.00 0.00 C ATOM 0 H MET A 50 -13.189 -16.373 -0.770 1.00 0.00 H new ATOM 0 HA MET A 50 -12.692 -14.237 1.162 1.00 0.00 H new ATOM 0 HB2 MET A 50 -14.703 -16.525 1.147 1.00 0.00 H new ATOM 0 HB3 MET A 50 -14.690 -15.180 2.271 1.00 0.00 H new ATOM 0 HG2 MET A 50 -14.864 -13.696 0.112 1.00 0.00 H new ATOM 0 HG3 MET A 50 -15.383 -15.179 -0.664 1.00 0.00 H new ATOM 0 HE1 MET A 50 -17.642 -12.711 2.475 1.00 0.00 H new ATOM 0 HE2 MET A 50 -16.248 -13.648 3.063 1.00 0.00 H new ATOM 0 HE3 MET A 50 -16.022 -12.415 1.800 1.00 0.00 H new ATOM 781 N ARG A 51 -11.163 -16.856 1.521 1.00 0.00 N ATOM 782 CA ARG A 51 -10.338 -17.690 2.387 1.00 0.00 C ATOM 783 C ARG A 51 -9.040 -16.975 2.743 1.00 0.00 C ATOM 784 O ARG A 51 -8.528 -17.109 3.855 1.00 0.00 O ATOM 785 CB ARG A 51 -10.031 -19.026 1.705 1.00 0.00 C ATOM 786 CG ARG A 51 -9.621 -18.886 0.249 1.00 0.00 C ATOM 787 CD ARG A 51 -8.484 -19.830 -0.103 1.00 0.00 C ATOM 788 NE ARG A 51 -7.638 -19.294 -1.167 1.00 0.00 N ATOM 789 CZ ARG A 51 -7.950 -19.360 -2.458 1.00 0.00 C ATOM 790 NH1 ARG A 51 -9.079 -19.937 -2.842 1.00 0.00 N ATOM 791 NH2 ARG A 51 -7.130 -18.847 -3.366 1.00 0.00 N ATOM 0 H ARG A 51 -10.906 -16.887 0.534 1.00 0.00 H new ATOM 0 HA ARG A 51 -10.892 -17.882 3.306 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -9.233 -19.528 2.252 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -10.911 -19.666 1.766 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -10.478 -19.092 -0.393 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -9.316 -17.858 0.053 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -7.878 -20.014 0.784 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -8.894 -20.791 -0.415 1.00 0.00 H new ATOM 0 HE ARG A 51 -6.760 -18.845 -0.905 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -9.712 -20.332 -2.147 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -9.315 -19.986 -3.833 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -6.260 -18.402 -3.074 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -7.370 -18.898 -4.356 1.00 0.00 H new ATOM 805 N ARG A 52 -8.514 -16.212 1.790 1.00 0.00 N ATOM 806 CA ARG A 52 -7.277 -15.470 2.000 1.00 0.00 C ATOM 807 C ARG A 52 -7.572 -14.042 2.450 1.00 0.00 C ATOM 808 O ARG A 52 -6.752 -13.406 3.111 1.00 0.00 O ATOM 809 CB ARG A 52 -6.445 -15.451 0.715 1.00 0.00 C ATOM 810 CG ARG A 52 -4.971 -15.161 0.948 1.00 0.00 C ATOM 811 CD ARG A 52 -4.086 -16.191 0.262 1.00 0.00 C ATOM 812 NE ARG A 52 -4.439 -17.556 0.640 1.00 0.00 N ATOM 813 CZ ARG A 52 -3.887 -18.637 0.099 1.00 0.00 C ATOM 814 NH1 ARG A 52 -2.956 -18.510 -0.838 1.00 0.00 N ATOM 815 NH2 ARG A 52 -4.264 -19.845 0.493 1.00 0.00 N ATOM 0 H ARG A 52 -8.926 -16.092 0.865 1.00 0.00 H new ATOM 0 HA ARG A 52 -6.709 -15.970 2.784 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -6.542 -16.415 0.215 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -6.852 -14.699 0.040 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -4.731 -14.166 0.573 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -4.764 -15.157 2.018 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -4.173 -16.081 -0.819 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -3.044 -16.002 0.519 1.00 0.00 H new ATOM 0 HE ARG A 52 -5.149 -17.688 1.360 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -2.663 -17.582 -1.144 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -2.533 -19.340 -1.253 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -4.979 -19.946 1.213 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -3.839 -20.673 0.076 1.00 0.00 H new ATOM 829 N LEU A 53 -8.752 -13.545 2.086 1.00 0.00 N ATOM 830 CA LEU A 53 -9.159 -12.192 2.453 1.00 0.00 C ATOM 831 C LEU A 53 -10.436 -12.218 3.287 1.00 0.00 C ATOM 832 O LEU A 53 -11.343 -13.007 3.027 1.00 0.00 O ATOM 833 CB LEU A 53 -9.374 -11.343 1.199 1.00 0.00 C ATOM 834 CG LEU A 53 -8.403 -11.627 0.051 1.00 0.00 C ATOM 835 CD1 LEU A 53 -9.042 -11.275 -1.285 1.00 0.00 C ATOM 836 CD2 LEU A 53 -7.108 -10.852 0.246 1.00 0.00 C ATOM 0 H LEU A 53 -9.442 -14.059 1.538 1.00 0.00 H new ATOM 0 HA LEU A 53 -8.363 -11.749 3.051 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -10.392 -11.501 0.842 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -9.292 -10.291 1.472 1.00 0.00 H new ATOM 0 HG LEU A 53 -8.169 -12.692 0.050 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -8.338 -11.483 -2.091 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -9.942 -11.873 -1.426 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -9.304 -10.217 -1.296 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -6.429 -11.065 -0.579 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -7.324 -9.784 0.272 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -6.643 -11.151 1.185 1.00 0.00 H new ATOM 848 N SER A 54 -10.499 -11.347 4.291 1.00 0.00 N ATOM 849 CA SER A 54 -11.666 -11.270 5.162 1.00 0.00 C ATOM 850 C SER A 54 -12.096 -9.822 5.370 1.00 0.00 C ATOM 851 O SER A 54 -11.401 -9.044 6.024 1.00 0.00 O ATOM 852 CB SER A 54 -11.365 -11.924 6.512 1.00 0.00 C ATOM 853 OG SER A 54 -10.386 -11.190 7.227 1.00 0.00 O ATOM 0 H SER A 54 -9.757 -10.686 4.520 1.00 0.00 H new ATOM 0 HA SER A 54 -12.483 -11.807 4.680 1.00 0.00 H new ATOM 0 HB2 SER A 54 -12.280 -11.986 7.101 1.00 0.00 H new ATOM 0 HB3 SER A 54 -11.016 -12.945 6.355 1.00 0.00 H new ATOM 0 HG SER A 54 -10.412 -10.251 6.947 1.00 0.00 H new ATOM 859 N VAL A 55 -13.250 -9.466 4.812 1.00 0.00 N ATOM 860 CA VAL A 55 -13.774 -8.114 4.938 1.00 0.00 C ATOM 861 C VAL A 55 -14.872 -8.049 5.994 1.00 0.00 C ATOM 862 O VAL A 55 -15.881 -8.748 5.897 1.00 0.00 O ATOM 863 CB VAL A 55 -14.335 -7.598 3.600 1.00 0.00 C ATOM 864 CG1 VAL A 55 -13.224 -6.998 2.751 1.00 0.00 C ATOM 865 CG2 VAL A 55 -15.054 -8.707 2.845 1.00 0.00 C ATOM 0 H VAL A 55 -13.839 -10.097 4.268 1.00 0.00 H new ATOM 0 HA VAL A 55 -12.941 -7.480 5.240 1.00 0.00 H new ATOM 0 HB VAL A 55 -15.062 -6.815 3.816 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -13.639 -6.639 1.809 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -12.766 -6.166 3.286 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -12.470 -7.759 2.548 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -15.440 -8.315 1.904 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -14.357 -9.520 2.641 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -15.881 -9.081 3.449 1.00 0.00 H new ATOM 875 N ASP A 56 -14.670 -7.207 7.001 1.00 0.00 N ATOM 876 CA ASP A 56 -15.645 -7.055 8.075 1.00 0.00 C ATOM 877 C ASP A 56 -15.745 -5.593 8.521 1.00 0.00 C ATOM 878 O ASP A 56 -14.726 -4.950 8.774 1.00 0.00 O ATOM 879 CB ASP A 56 -15.256 -7.932 9.267 1.00 0.00 C ATOM 880 CG ASP A 56 -16.398 -8.107 10.250 1.00 0.00 C ATOM 881 OD1 ASP A 56 -17.496 -8.514 9.818 1.00 0.00 O ATOM 882 OD2 ASP A 56 -16.192 -7.839 11.452 1.00 0.00 O ATOM 0 H ASP A 56 -13.841 -6.620 7.096 1.00 0.00 H new ATOM 0 HA ASP A 56 -16.618 -7.369 7.696 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -14.937 -8.910 8.907 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -14.403 -7.487 9.780 1.00 0.00 H new ATOM 887 N PRO A 57 -16.972 -5.037 8.630 1.00 0.00 N ATOM 888 CA PRO A 57 -18.221 -5.756 8.340 1.00 0.00 C ATOM 889 C PRO A 57 -18.411 -6.000 6.845 1.00 0.00 C ATOM 890 O PRO A 57 -18.098 -5.135 6.025 1.00 0.00 O ATOM 891 CB PRO A 57 -19.303 -4.815 8.870 1.00 0.00 C ATOM 892 CG PRO A 57 -18.695 -3.459 8.787 1.00 0.00 C ATOM 893 CD PRO A 57 -17.226 -3.646 9.047 1.00 0.00 C ATOM 0 HA PRO A 57 -18.239 -6.746 8.796 1.00 0.00 H new ATOM 0 HB2 PRO A 57 -20.212 -4.879 8.272 1.00 0.00 H new ATOM 0 HB3 PRO A 57 -19.578 -5.064 9.895 1.00 0.00 H new ATOM 0 HG2 PRO A 57 -18.864 -3.015 7.806 1.00 0.00 H new ATOM 0 HG3 PRO A 57 -19.139 -2.787 9.522 1.00 0.00 H new ATOM 0 HD2 PRO A 57 -16.625 -2.940 8.474 1.00 0.00 H new ATOM 0 HD3 PRO A 57 -16.983 -3.492 10.098 1.00 0.00 H new ATOM 901 N PRO A 58 -18.925 -7.183 6.465 1.00 0.00 N ATOM 902 CA PRO A 58 -19.152 -7.528 5.057 1.00 0.00 C ATOM 903 C PRO A 58 -20.247 -6.678 4.425 1.00 0.00 C ATOM 904 O PRO A 58 -20.137 -6.261 3.274 1.00 0.00 O ATOM 905 CB PRO A 58 -19.579 -8.998 5.112 1.00 0.00 C ATOM 906 CG PRO A 58 -20.124 -9.186 6.484 1.00 0.00 C ATOM 907 CD PRO A 58 -19.329 -8.272 7.373 1.00 0.00 C ATOM 0 HA PRO A 58 -18.266 -7.353 4.447 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -20.330 -9.220 4.354 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -18.735 -9.662 4.928 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -21.185 -8.939 6.520 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -20.027 -10.223 6.804 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -19.927 -7.901 8.206 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -18.465 -8.779 7.802 1.00 0.00 H new ATOM 915 N CYS A 59 -21.302 -6.425 5.190 1.00 0.00 N ATOM 916 CA CYS A 59 -22.422 -5.621 4.711 1.00 0.00 C ATOM 917 C CYS A 59 -22.898 -4.663 5.797 1.00 0.00 C ATOM 918 O CYS A 59 -22.523 -4.794 6.962 1.00 0.00 O ATOM 919 CB CYS A 59 -23.574 -6.525 4.272 1.00 0.00 C ATOM 920 SG CYS A 59 -23.076 -7.881 3.185 1.00 0.00 S ATOM 0 H CYS A 59 -21.406 -6.765 6.146 1.00 0.00 H new ATOM 0 HA CYS A 59 -22.083 -5.037 3.855 1.00 0.00 H new ATOM 0 HB2 CYS A 59 -24.053 -6.941 5.158 1.00 0.00 H new ATOM 0 HB3 CYS A 59 -24.322 -5.919 3.760 1.00 0.00 H new ATOM 0 HG CYS A 59 -24.119 -8.590 2.870 1.00 0.00 H new ATOM 926 N GLY A 60 -23.728 -3.699 5.412 1.00 0.00 N ATOM 927 CA GLY A 60 -24.238 -2.738 6.371 1.00 0.00 C ATOM 928 C GLY A 60 -25.055 -1.639 5.721 1.00 0.00 C ATOM 929 O GLY A 60 -25.403 -1.727 4.544 1.00 0.00 O ATOM 0 H GLY A 60 -24.056 -3.567 4.455 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -24.854 -3.256 7.106 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -23.403 -2.293 6.912 1.00 0.00 H new ATOM 933 N VAL A 61 -25.359 -0.602 6.493 1.00 0.00 N ATOM 934 CA VAL A 61 -26.138 0.524 5.993 1.00 0.00 C ATOM 935 C VAL A 61 -25.762 1.809 6.721 1.00 0.00 C ATOM 936 O VAL A 61 -25.565 1.807 7.936 1.00 0.00 O ATOM 937 CB VAL A 61 -27.650 0.274 6.155 1.00 0.00 C ATOM 938 CG1 VAL A 61 -28.011 0.117 7.624 1.00 0.00 C ATOM 939 CG2 VAL A 61 -28.449 1.402 5.520 1.00 0.00 C ATOM 0 H VAL A 61 -25.077 -0.518 7.470 1.00 0.00 H new ATOM 0 HA VAL A 61 -25.909 0.629 4.933 1.00 0.00 H new ATOM 0 HB VAL A 61 -27.903 -0.653 5.641 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -29.083 -0.059 7.719 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -27.466 -0.728 8.044 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -27.743 1.025 8.164 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -29.514 1.208 5.644 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -28.193 2.345 6.002 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -28.213 1.462 4.458 1.00 0.00 H new ATOM 949 N LEU A 62 -25.658 2.905 5.975 1.00 0.00 N ATOM 950 CA LEU A 62 -25.301 4.191 6.565 1.00 0.00 C ATOM 951 C LEU A 62 -26.210 5.303 6.052 1.00 0.00 C ATOM 952 O LEU A 62 -26.722 5.237 4.935 1.00 0.00 O ATOM 953 CB LEU A 62 -23.838 4.529 6.264 1.00 0.00 C ATOM 954 CG LEU A 62 -23.488 4.647 4.781 1.00 0.00 C ATOM 955 CD1 LEU A 62 -22.334 5.616 4.581 1.00 0.00 C ATOM 956 CD2 LEU A 62 -23.145 3.280 4.205 1.00 0.00 C ATOM 0 H LEU A 62 -25.815 2.929 4.967 1.00 0.00 H new ATOM 0 HA LEU A 62 -25.433 4.112 7.644 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -23.591 5.470 6.755 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -23.206 3.761 6.710 1.00 0.00 H new ATOM 0 HG LEU A 62 -24.358 5.036 4.251 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -22.099 5.687 3.519 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -22.615 6.600 4.957 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -21.459 5.257 5.123 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -22.898 3.382 3.148 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -22.290 2.864 4.739 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -24.001 2.614 4.315 1.00 0.00 H new ATOM 968 N ASP A 63 -26.403 6.326 6.881 1.00 0.00 N ATOM 969 CA ASP A 63 -27.250 7.456 6.518 1.00 0.00 C ATOM 970 C ASP A 63 -26.470 8.479 5.696 1.00 0.00 C ATOM 971 O ASP A 63 -25.276 8.308 5.450 1.00 0.00 O ATOM 972 CB ASP A 63 -27.814 8.121 7.775 1.00 0.00 C ATOM 973 CG ASP A 63 -29.291 7.834 7.968 1.00 0.00 C ATOM 974 OD1 ASP A 63 -29.988 7.600 6.958 1.00 0.00 O ATOM 975 OD2 ASP A 63 -29.751 7.845 9.130 1.00 0.00 O ATOM 0 H ASP A 63 -25.984 6.394 7.808 1.00 0.00 H new ATOM 0 HA ASP A 63 -28.074 7.080 5.912 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -27.262 7.771 8.647 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -27.661 9.198 7.712 1.00 0.00 H new ATOM 980 N PRO A 64 -27.137 9.558 5.255 1.00 0.00 N ATOM 981 CA PRO A 64 -26.503 10.609 4.453 1.00 0.00 C ATOM 982 C PRO A 64 -25.381 11.319 5.206 1.00 0.00 C ATOM 983 O PRO A 64 -25.577 11.799 6.323 1.00 0.00 O ATOM 984 CB PRO A 64 -27.647 11.589 4.159 1.00 0.00 C ATOM 985 CG PRO A 64 -28.898 10.817 4.410 1.00 0.00 C ATOM 986 CD PRO A 64 -28.563 9.836 5.496 1.00 0.00 C ATOM 0 HA PRO A 64 -26.036 10.201 3.557 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -27.590 12.466 4.804 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -27.605 11.946 3.130 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -29.710 11.477 4.716 1.00 0.00 H new ATOM 0 HG3 PRO A 64 -29.228 10.303 3.507 1.00 0.00 H new ATOM 0 HD2 PRO A 64 -28.731 10.257 6.487 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -29.169 8.933 5.426 1.00 0.00 H new ATOM 994 N LYS A 65 -24.205 11.384 4.580 1.00 0.00 N ATOM 995 CA LYS A 65 -23.034 12.039 5.173 1.00 0.00 C ATOM 996 C LYS A 65 -22.306 11.127 6.163 1.00 0.00 C ATOM 997 O LYS A 65 -21.221 11.463 6.636 1.00 0.00 O ATOM 998 CB LYS A 65 -23.431 13.346 5.871 1.00 0.00 C ATOM 999 CG LYS A 65 -22.253 14.267 6.150 1.00 0.00 C ATOM 1000 CD LYS A 65 -22.221 15.439 5.182 1.00 0.00 C ATOM 1001 CE LYS A 65 -20.801 15.760 4.745 1.00 0.00 C ATOM 1002 NZ LYS A 65 -20.233 14.694 3.874 1.00 0.00 N ATOM 0 H LYS A 65 -24.036 10.988 3.655 1.00 0.00 H new ATOM 0 HA LYS A 65 -22.351 12.263 4.353 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -24.156 13.874 5.251 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -23.928 13.110 6.812 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -22.315 14.640 7.172 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -21.323 13.704 6.072 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -22.829 15.207 4.307 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -22.665 16.315 5.655 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -20.792 16.709 4.209 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -20.170 15.884 5.625 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -19.444 15.083 3.319 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -19.888 13.911 4.464 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -20.970 14.343 3.229 1.00 0.00 H new ATOM 1016 N GLU A 66 -22.895 9.974 6.474 1.00 0.00 N ATOM 1017 CA GLU A 66 -22.281 9.035 7.405 1.00 0.00 C ATOM 1018 C GLU A 66 -21.222 8.190 6.706 1.00 0.00 C ATOM 1019 O GLU A 66 -21.251 8.024 5.487 1.00 0.00 O ATOM 1020 CB GLU A 66 -23.346 8.130 8.027 1.00 0.00 C ATOM 1021 CG GLU A 66 -23.801 8.585 9.404 1.00 0.00 C ATOM 1022 CD GLU A 66 -23.706 7.486 10.443 1.00 0.00 C ATOM 1023 OE1 GLU A 66 -22.578 7.024 10.719 1.00 0.00 O ATOM 1024 OE2 GLU A 66 -24.759 7.085 10.983 1.00 0.00 O ATOM 0 H GLU A 66 -23.792 9.670 6.096 1.00 0.00 H new ATOM 0 HA GLU A 66 -21.797 9.609 8.195 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -24.209 8.089 7.363 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -22.952 7.116 8.100 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -23.194 9.433 9.721 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -24.831 8.935 9.345 1.00 0.00 H new ATOM 1031 N LYS A 67 -20.286 7.664 7.487 1.00 0.00 N ATOM 1032 CA LYS A 67 -19.214 6.837 6.944 1.00 0.00 C ATOM 1033 C LYS A 67 -19.026 5.572 7.775 1.00 0.00 C ATOM 1034 O LYS A 67 -19.272 5.567 8.982 1.00 0.00 O ATOM 1035 CB LYS A 67 -17.906 7.629 6.898 1.00 0.00 C ATOM 1036 CG LYS A 67 -17.564 8.317 8.209 1.00 0.00 C ATOM 1037 CD LYS A 67 -18.090 9.742 8.245 1.00 0.00 C ATOM 1038 CE LYS A 67 -17.764 10.423 9.565 1.00 0.00 C ATOM 1039 NZ LYS A 67 -16.618 11.366 9.434 1.00 0.00 N ATOM 0 H LYS A 67 -20.247 7.795 8.498 1.00 0.00 H new ATOM 0 HA LYS A 67 -19.492 6.546 5.931 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -17.093 6.955 6.628 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -17.973 8.379 6.110 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -17.987 7.751 9.039 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -16.483 8.324 8.346 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -17.656 10.312 7.423 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -19.169 9.736 8.094 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -18.641 10.964 9.921 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -17.529 9.668 10.315 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -16.427 11.810 10.355 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -15.775 10.846 9.119 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -16.852 12.102 8.737 1.00 0.00 H new ATOM 1053 N VAL A 68 -18.589 4.500 7.121 1.00 0.00 N ATOM 1054 CA VAL A 68 -18.369 3.228 7.798 1.00 0.00 C ATOM 1055 C VAL A 68 -16.923 2.767 7.643 1.00 0.00 C ATOM 1056 O VAL A 68 -16.256 3.103 6.665 1.00 0.00 O ATOM 1057 CB VAL A 68 -19.306 2.134 7.253 1.00 0.00 C ATOM 1058 CG1 VAL A 68 -20.743 2.405 7.672 1.00 0.00 C ATOM 1059 CG2 VAL A 68 -19.191 2.040 5.740 1.00 0.00 C ATOM 0 H VAL A 68 -18.380 4.488 6.123 1.00 0.00 H new ATOM 0 HA VAL A 68 -18.585 3.389 8.854 1.00 0.00 H new ATOM 0 HB VAL A 68 -19.004 1.176 7.677 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -21.391 1.622 7.278 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -20.809 2.417 8.760 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -21.061 3.371 7.279 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -19.860 1.262 5.372 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -19.466 2.996 5.294 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -18.164 1.795 5.468 1.00 0.00 H new ATOM 1069 N LEU A 69 -16.447 1.994 8.614 1.00 0.00 N ATOM 1070 CA LEU A 69 -15.081 1.485 8.586 1.00 0.00 C ATOM 1071 C LEU A 69 -15.059 0.006 8.214 1.00 0.00 C ATOM 1072 O LEU A 69 -15.889 -0.774 8.680 1.00 0.00 O ATOM 1073 CB LEU A 69 -14.411 1.690 9.946 1.00 0.00 C ATOM 1074 CG LEU A 69 -13.681 3.023 10.115 1.00 0.00 C ATOM 1075 CD1 LEU A 69 -13.242 3.209 11.558 1.00 0.00 C ATOM 1076 CD2 LEU A 69 -12.485 3.098 9.178 1.00 0.00 C ATOM 0 H LEU A 69 -16.987 1.707 9.430 1.00 0.00 H new ATOM 0 HA LEU A 69 -14.528 2.040 7.828 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -15.170 1.608 10.724 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -13.699 0.881 10.109 1.00 0.00 H new ATOM 0 HG LEU A 69 -14.369 3.829 9.858 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -12.724 4.163 11.661 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -14.117 3.199 12.209 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -12.570 2.399 11.841 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -11.977 4.053 9.312 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -11.794 2.285 9.404 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -12.825 3.009 8.146 1.00 0.00 H new ATOM 1088 N MET A 70 -14.104 -0.372 7.372 1.00 0.00 N ATOM 1089 CA MET A 70 -13.973 -1.758 6.937 1.00 0.00 C ATOM 1090 C MET A 70 -12.543 -2.251 7.123 1.00 0.00 C ATOM 1091 O MET A 70 -11.598 -1.462 7.126 1.00 0.00 O ATOM 1092 CB MET A 70 -14.386 -1.893 5.469 1.00 0.00 C ATOM 1093 CG MET A 70 -15.773 -1.344 5.176 1.00 0.00 C ATOM 1094 SD MET A 70 -16.421 -1.906 3.590 1.00 0.00 S ATOM 1095 CE MET A 70 -15.146 -1.321 2.476 1.00 0.00 C ATOM 0 H MET A 70 -13.409 0.262 6.977 1.00 0.00 H new ATOM 0 HA MET A 70 -14.632 -2.372 7.551 1.00 0.00 H new ATOM 0 HB2 MET A 70 -13.659 -1.372 4.846 1.00 0.00 H new ATOM 0 HB3 MET A 70 -14.353 -2.945 5.186 1.00 0.00 H new ATOM 0 HG2 MET A 70 -16.455 -1.647 5.971 1.00 0.00 H new ATOM 0 HG3 MET A 70 -15.738 -0.255 5.184 1.00 0.00 H new ATOM 0 HE1 MET A 70 -15.491 -1.416 1.446 1.00 0.00 H new ATOM 0 HE2 MET A 70 -14.928 -0.275 2.690 1.00 0.00 H new ATOM 0 HE3 MET A 70 -14.243 -1.916 2.613 1.00 0.00 H new ATOM 1105 N ALA A 71 -12.388 -3.561 7.283 1.00 0.00 N ATOM 1106 CA ALA A 71 -11.071 -4.156 7.472 1.00 0.00 C ATOM 1107 C ALA A 71 -10.922 -5.440 6.664 1.00 0.00 C ATOM 1108 O ALA A 71 -11.639 -6.415 6.890 1.00 0.00 O ATOM 1109 CB ALA A 71 -10.823 -4.429 8.948 1.00 0.00 C ATOM 0 H ALA A 71 -13.158 -4.230 7.286 1.00 0.00 H new ATOM 0 HA ALA A 71 -10.327 -3.446 7.113 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -9.836 -4.873 9.075 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -10.874 -3.493 9.505 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -11.581 -5.116 9.323 1.00 0.00 H new ATOM 1115 N VAL A 72 -9.980 -5.435 5.727 1.00 0.00 N ATOM 1116 CA VAL A 72 -9.728 -6.601 4.889 1.00 0.00 C ATOM 1117 C VAL A 72 -8.434 -7.292 5.302 1.00 0.00 C ATOM 1118 O VAL A 72 -7.366 -7.010 4.758 1.00 0.00 O ATOM 1119 CB VAL A 72 -9.645 -6.218 3.400 1.00 0.00 C ATOM 1120 CG1 VAL A 72 -8.535 -5.203 3.169 1.00 0.00 C ATOM 1121 CG2 VAL A 72 -9.432 -7.456 2.542 1.00 0.00 C ATOM 0 H VAL A 72 -9.378 -4.636 5.529 1.00 0.00 H new ATOM 0 HA VAL A 72 -10.566 -7.284 5.028 1.00 0.00 H new ATOM 0 HB VAL A 72 -10.590 -5.760 3.109 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -8.492 -4.945 2.111 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -8.736 -4.305 3.754 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -7.581 -5.631 3.477 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -9.376 -7.166 1.493 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -8.503 -7.945 2.834 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -10.265 -8.145 2.684 1.00 0.00 H new ATOM 1131 N SER A 73 -8.535 -8.193 6.272 1.00 0.00 N ATOM 1132 CA SER A 73 -7.371 -8.920 6.766 1.00 0.00 C ATOM 1133 C SER A 73 -6.903 -9.962 5.755 1.00 0.00 C ATOM 1134 O SER A 73 -7.701 -10.747 5.242 1.00 0.00 O ATOM 1135 CB SER A 73 -7.695 -9.594 8.101 1.00 0.00 C ATOM 1136 OG SER A 73 -7.646 -8.663 9.167 1.00 0.00 O ATOM 0 H SER A 73 -9.411 -8.438 6.733 1.00 0.00 H new ATOM 0 HA SER A 73 -6.564 -8.202 6.914 1.00 0.00 H new ATOM 0 HB2 SER A 73 -8.686 -10.045 8.053 1.00 0.00 H new ATOM 0 HB3 SER A 73 -6.986 -10.401 8.286 1.00 0.00 H new ATOM 0 HG SER A 73 -7.858 -9.118 10.009 1.00 0.00 H new ATOM 1142 N CYS A 74 -5.603 -9.965 5.479 1.00 0.00 N ATOM 1143 CA CYS A 74 -5.022 -10.912 4.534 1.00 0.00 C ATOM 1144 C CYS A 74 -3.907 -11.717 5.193 1.00 0.00 C ATOM 1145 O CYS A 74 -2.771 -11.257 5.293 1.00 0.00 O ATOM 1146 CB CYS A 74 -4.480 -10.174 3.308 1.00 0.00 C ATOM 1147 SG CYS A 74 -3.403 -8.777 3.705 1.00 0.00 S ATOM 0 H CYS A 74 -4.931 -9.321 5.897 1.00 0.00 H new ATOM 0 HA CYS A 74 -5.805 -11.600 4.216 1.00 0.00 H new ATOM 0 HB2 CYS A 74 -3.928 -10.880 2.687 1.00 0.00 H new ATOM 0 HB3 CYS A 74 -5.319 -9.814 2.713 1.00 0.00 H new ATOM 0 HG CYS A 74 -4.096 -7.849 4.297 1.00 0.00 H new ATOM 1153 N ASP A 75 -4.245 -12.921 5.646 1.00 0.00 N ATOM 1154 CA ASP A 75 -3.274 -13.791 6.300 1.00 0.00 C ATOM 1155 C ASP A 75 -2.021 -13.957 5.447 1.00 0.00 C ATOM 1156 O ASP A 75 -2.084 -13.920 4.218 1.00 0.00 O ATOM 1157 CB ASP A 75 -3.895 -15.160 6.586 1.00 0.00 C ATOM 1158 CG ASP A 75 -4.495 -15.793 5.346 1.00 0.00 C ATOM 1159 OD1 ASP A 75 -3.824 -15.786 4.292 1.00 0.00 O ATOM 1160 OD2 ASP A 75 -5.635 -16.297 5.429 1.00 0.00 O ATOM 0 H ASP A 75 -5.183 -13.315 5.572 1.00 0.00 H new ATOM 0 HA ASP A 75 -2.987 -13.324 7.242 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -3.133 -15.823 6.997 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -4.668 -15.053 7.347 1.00 0.00 H new ATOM 1165 N THR A 76 -0.882 -14.142 6.108 1.00 0.00 N ATOM 1166 CA THR A 76 0.388 -14.317 5.417 1.00 0.00 C ATOM 1167 C THR A 76 0.387 -15.595 4.585 1.00 0.00 C ATOM 1168 O THR A 76 -0.101 -16.635 5.029 1.00 0.00 O ATOM 1169 CB THR A 76 1.532 -14.354 6.428 1.00 0.00 C ATOM 1170 OG1 THR A 76 1.671 -15.650 6.983 1.00 0.00 O ATOM 1171 CG2 THR A 76 1.354 -13.380 7.572 1.00 0.00 C ATOM 0 H THR A 76 -0.814 -14.174 7.125 1.00 0.00 H new ATOM 0 HA THR A 76 0.529 -13.471 4.744 1.00 0.00 H new ATOM 0 HB THR A 76 2.421 -14.068 5.866 1.00 0.00 H new ATOM 0 HG1 THR A 76 2.410 -15.653 7.627 1.00 0.00 H new ATOM 0 HG21 THR A 76 2.202 -13.459 8.252 1.00 0.00 H new ATOM 0 HG22 THR A 76 1.297 -12.365 7.180 1.00 0.00 H new ATOM 0 HG23 THR A 76 0.435 -13.614 8.109 1.00 0.00 H new ATOM 1179 N PHE A 77 0.937 -15.512 3.379 1.00 0.00 N ATOM 1180 CA PHE A 77 1.000 -16.663 2.486 1.00 0.00 C ATOM 1181 C PHE A 77 2.164 -16.529 1.509 1.00 0.00 C ATOM 1182 O PHE A 77 2.972 -15.606 1.615 1.00 0.00 O ATOM 1183 CB PHE A 77 -0.315 -16.814 1.717 1.00 0.00 C ATOM 1184 CG PHE A 77 -0.571 -15.704 0.737 1.00 0.00 C ATOM 1185 CD1 PHE A 77 -0.965 -14.451 1.177 1.00 0.00 C ATOM 1186 CD2 PHE A 77 -0.418 -15.916 -0.623 1.00 0.00 C ATOM 1187 CE1 PHE A 77 -1.202 -13.429 0.277 1.00 0.00 C ATOM 1188 CE2 PHE A 77 -0.654 -14.898 -1.528 1.00 0.00 C ATOM 1189 CZ PHE A 77 -1.046 -13.652 -1.077 1.00 0.00 C ATOM 0 H PHE A 77 1.346 -14.659 2.997 1.00 0.00 H new ATOM 0 HA PHE A 77 1.159 -17.554 3.093 1.00 0.00 H new ATOM 0 HB2 PHE A 77 -0.306 -17.764 1.183 1.00 0.00 H new ATOM 0 HB3 PHE A 77 -1.139 -16.856 2.429 1.00 0.00 H new ATOM 0 HD1 PHE A 77 -1.088 -14.271 2.235 1.00 0.00 H new ATOM 0 HD2 PHE A 77 -0.111 -16.888 -0.981 1.00 0.00 H new ATOM 0 HE1 PHE A 77 -1.509 -12.456 0.632 1.00 0.00 H new ATOM 0 HE2 PHE A 77 -0.532 -15.076 -2.586 1.00 0.00 H new ATOM 0 HZ PHE A 77 -1.230 -12.854 -1.782 1.00 0.00 H new ATOM 1199 N ASN A 78 2.245 -17.456 0.560 1.00 0.00 N ATOM 1200 CA ASN A 78 3.313 -17.439 -0.435 1.00 0.00 C ATOM 1201 C ASN A 78 2.790 -16.977 -1.791 1.00 0.00 C ATOM 1202 O ASN A 78 2.042 -17.693 -2.457 1.00 0.00 O ATOM 1203 CB ASN A 78 3.942 -18.828 -0.565 1.00 0.00 C ATOM 1204 CG ASN A 78 4.944 -19.113 0.536 1.00 0.00 C ATOM 1205 OD1 ASN A 78 5.979 -18.455 0.636 1.00 0.00 O ATOM 1206 ND2 ASN A 78 4.641 -20.101 1.371 1.00 0.00 N ATOM 0 H ASN A 78 1.585 -18.227 0.458 1.00 0.00 H new ATOM 0 HA ASN A 78 4.073 -16.733 -0.100 1.00 0.00 H new ATOM 0 HB2 ASN A 78 3.156 -19.583 -0.542 1.00 0.00 H new ATOM 0 HB3 ASN A 78 4.436 -18.911 -1.533 1.00 0.00 H new ATOM 0 HD21 ASN A 78 5.278 -20.339 2.131 1.00 0.00 H new ATOM 0 HD22 ASN A 78 3.772 -20.621 1.252 1.00 0.00 H new ATOM 1213 N ALA A 79 3.190 -15.775 -2.194 1.00 0.00 N ATOM 1214 CA ALA A 79 2.763 -15.216 -3.472 1.00 0.00 C ATOM 1215 C ALA A 79 3.795 -15.477 -4.567 1.00 0.00 C ATOM 1216 O ALA A 79 3.796 -14.810 -5.602 1.00 0.00 O ATOM 1217 CB ALA A 79 2.512 -13.724 -3.333 1.00 0.00 C ATOM 0 H ALA A 79 3.809 -15.170 -1.654 1.00 0.00 H new ATOM 0 HA ALA A 79 1.835 -15.710 -3.761 1.00 0.00 H new ATOM 0 HB1 ALA A 79 2.194 -13.318 -4.293 1.00 0.00 H new ATOM 0 HB2 ALA A 79 1.732 -13.554 -2.591 1.00 0.00 H new ATOM 0 HB3 ALA A 79 3.430 -13.229 -3.016 1.00 0.00 H new ATOM 1223 N ALA A 80 4.673 -16.450 -4.335 1.00 0.00 N ATOM 1224 CA ALA A 80 5.706 -16.792 -5.304 1.00 0.00 C ATOM 1225 C ALA A 80 5.208 -17.838 -6.295 1.00 0.00 C ATOM 1226 O ALA A 80 5.721 -17.946 -7.408 1.00 0.00 O ATOM 1227 CB ALA A 80 6.950 -17.300 -4.591 1.00 0.00 C ATOM 0 H ALA A 80 4.688 -17.014 -3.485 1.00 0.00 H new ATOM 0 HA ALA A 80 5.957 -15.889 -5.860 1.00 0.00 H new ATOM 0 HB1 ALA A 80 7.714 -17.552 -5.327 1.00 0.00 H new ATOM 0 HB2 ALA A 80 7.329 -16.525 -3.925 1.00 0.00 H new ATOM 0 HB3 ALA A 80 6.699 -18.187 -4.010 1.00 0.00 H new ATOM 1233 N THR A 81 4.210 -18.611 -5.880 1.00 0.00 N ATOM 1234 CA THR A 81 3.651 -19.651 -6.731 1.00 0.00 C ATOM 1235 C THR A 81 2.131 -19.699 -6.616 1.00 0.00 C ATOM 1236 O THR A 81 1.550 -20.756 -6.369 1.00 0.00 O ATOM 1237 CB THR A 81 4.251 -21.005 -6.357 1.00 0.00 C ATOM 1238 OG1 THR A 81 3.896 -21.365 -5.034 1.00 0.00 O ATOM 1239 CG2 THR A 81 5.760 -21.022 -6.451 1.00 0.00 C ATOM 0 H THR A 81 3.773 -18.536 -4.961 1.00 0.00 H new ATOM 0 HA THR A 81 3.902 -19.418 -7.766 1.00 0.00 H new ATOM 0 HB THR A 81 3.845 -21.717 -7.076 1.00 0.00 H new ATOM 0 HG1 THR A 81 2.923 -21.461 -4.971 1.00 0.00 H new ATOM 0 HG21 THR A 81 6.131 -22.009 -6.174 1.00 0.00 H new ATOM 0 HG22 THR A 81 6.063 -20.794 -7.473 1.00 0.00 H new ATOM 0 HG23 THR A 81 6.175 -20.275 -5.774 1.00 0.00 H new ATOM 1247 N GLU A 82 1.492 -18.548 -6.798 1.00 0.00 N ATOM 1248 CA GLU A 82 0.038 -18.458 -6.714 1.00 0.00 C ATOM 1249 C GLU A 82 -0.509 -17.501 -7.769 1.00 0.00 C ATOM 1250 O GLU A 82 0.253 -16.869 -8.502 1.00 0.00 O ATOM 1251 CB GLU A 82 -0.384 -17.996 -5.319 1.00 0.00 C ATOM 1252 CG GLU A 82 0.245 -18.802 -4.194 1.00 0.00 C ATOM 1253 CD GLU A 82 -0.342 -20.195 -4.077 1.00 0.00 C ATOM 1254 OE1 GLU A 82 -0.788 -20.741 -5.108 1.00 0.00 O ATOM 1255 OE2 GLU A 82 -0.355 -20.741 -2.954 1.00 0.00 O ATOM 0 H GLU A 82 1.958 -17.664 -7.005 1.00 0.00 H new ATOM 0 HA GLU A 82 -0.375 -19.449 -6.901 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -0.116 -16.947 -5.197 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -1.469 -18.059 -5.237 1.00 0.00 H new ATOM 0 HG2 GLU A 82 1.319 -18.877 -4.362 1.00 0.00 H new ATOM 0 HG3 GLU A 82 0.106 -18.273 -3.251 1.00 0.00 H new ATOM 1262 N ASP A 83 -1.833 -17.399 -7.840 1.00 0.00 N ATOM 1263 CA ASP A 83 -2.479 -16.517 -8.806 1.00 0.00 C ATOM 1264 C ASP A 83 -2.991 -15.250 -8.130 1.00 0.00 C ATOM 1265 O ASP A 83 -3.921 -15.295 -7.326 1.00 0.00 O ATOM 1266 CB ASP A 83 -3.637 -17.243 -9.496 1.00 0.00 C ATOM 1267 CG ASP A 83 -3.158 -18.234 -10.538 1.00 0.00 C ATOM 1268 OD1 ASP A 83 -2.447 -19.191 -10.164 1.00 0.00 O ATOM 1269 OD2 ASP A 83 -3.493 -18.053 -11.728 1.00 0.00 O ATOM 0 H ASP A 83 -2.478 -17.915 -7.242 1.00 0.00 H new ATOM 0 HA ASP A 83 -1.738 -16.234 -9.553 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -4.232 -17.766 -8.747 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -4.291 -16.511 -9.969 1.00 0.00 H new ATOM 1274 N LEU A 84 -2.376 -14.118 -8.462 1.00 0.00 N ATOM 1275 CA LEU A 84 -2.769 -12.838 -7.886 1.00 0.00 C ATOM 1276 C LEU A 84 -2.877 -11.765 -8.964 1.00 0.00 C ATOM 1277 O LEU A 84 -2.173 -10.756 -8.921 1.00 0.00 O ATOM 1278 CB LEU A 84 -1.763 -12.404 -6.818 1.00 0.00 C ATOM 1279 CG LEU A 84 -1.448 -13.458 -5.755 1.00 0.00 C ATOM 1280 CD1 LEU A 84 -0.234 -13.046 -4.936 1.00 0.00 C ATOM 1281 CD2 LEU A 84 -2.653 -13.679 -4.853 1.00 0.00 C ATOM 0 H LEU A 84 -1.604 -14.062 -9.127 1.00 0.00 H new ATOM 0 HA LEU A 84 -3.748 -12.963 -7.424 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -0.834 -12.119 -7.311 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -2.146 -11.513 -6.321 1.00 0.00 H new ATOM 0 HG LEU A 84 -1.217 -14.397 -6.258 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -0.026 -13.808 -4.185 1.00 0.00 H new ATOM 0 HD12 LEU A 84 0.629 -12.939 -5.593 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -0.434 -12.095 -4.442 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -2.412 -14.432 -4.102 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -2.914 -12.743 -4.358 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -3.498 -14.020 -5.451 1.00 0.00 H new ATOM 1293 N ASN A 85 -3.762 -11.988 -9.931 1.00 0.00 N ATOM 1294 CA ASN A 85 -3.958 -11.038 -11.019 1.00 0.00 C ATOM 1295 C ASN A 85 -5.432 -10.934 -11.408 1.00 0.00 C ATOM 1296 O ASN A 85 -5.762 -10.445 -12.489 1.00 0.00 O ATOM 1297 CB ASN A 85 -3.128 -11.448 -12.237 1.00 0.00 C ATOM 1298 CG ASN A 85 -1.644 -11.222 -12.030 1.00 0.00 C ATOM 1299 OD1 ASN A 85 -1.237 -10.418 -11.192 1.00 0.00 O ATOM 1300 ND2 ASN A 85 -0.824 -11.933 -12.797 1.00 0.00 N ATOM 0 H ASN A 85 -4.354 -12.817 -9.983 1.00 0.00 H new ATOM 0 HA ASN A 85 -3.628 -10.060 -10.670 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -3.305 -12.501 -12.456 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -3.461 -10.882 -13.107 1.00 0.00 H new ATOM 0 HD21 ASN A 85 0.186 -11.823 -12.703 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -1.204 -12.589 -13.479 1.00 0.00 H new ATOM 1307 N ASN A 86 -6.318 -11.397 -10.528 1.00 0.00 N ATOM 1308 CA ASN A 86 -7.752 -11.350 -10.797 1.00 0.00 C ATOM 1309 C ASN A 86 -8.553 -10.973 -9.550 1.00 0.00 C ATOM 1310 O ASN A 86 -9.781 -11.066 -9.545 1.00 0.00 O ATOM 1311 CB ASN A 86 -8.229 -12.702 -11.321 1.00 0.00 C ATOM 1312 CG ASN A 86 -8.477 -12.687 -12.817 1.00 0.00 C ATOM 1313 OD1 ASN A 86 -9.273 -11.893 -13.318 1.00 0.00 O ATOM 1314 ND2 ASN A 86 -7.796 -13.568 -13.540 1.00 0.00 N ATOM 0 H ASN A 86 -6.069 -11.807 -9.628 1.00 0.00 H new ATOM 0 HA ASN A 86 -7.920 -10.580 -11.550 1.00 0.00 H new ATOM 0 HB2 ASN A 86 -7.484 -13.463 -11.086 1.00 0.00 H new ATOM 0 HB3 ASN A 86 -9.147 -12.985 -10.806 1.00 0.00 H new ATOM 0 HD21 ASN A 86 -7.923 -13.605 -14.551 1.00 0.00 H new ATOM 0 HD22 ASN A 86 -7.146 -14.208 -13.084 1.00 0.00 H new ATOM 1321 N ASP A 87 -7.861 -10.550 -8.495 1.00 0.00 N ATOM 1322 CA ASP A 87 -8.525 -10.165 -7.255 1.00 0.00 C ATOM 1323 C ASP A 87 -9.162 -8.785 -7.382 1.00 0.00 C ATOM 1324 O ASP A 87 -8.562 -7.863 -7.935 1.00 0.00 O ATOM 1325 CB ASP A 87 -7.528 -10.176 -6.094 1.00 0.00 C ATOM 1326 CG ASP A 87 -7.063 -11.577 -5.746 1.00 0.00 C ATOM 1327 OD1 ASP A 87 -7.825 -12.534 -5.995 1.00 0.00 O ATOM 1328 OD2 ASP A 87 -5.937 -11.716 -5.226 1.00 0.00 O ATOM 0 H ASP A 87 -6.845 -10.466 -8.475 1.00 0.00 H new ATOM 0 HA ASP A 87 -9.314 -10.890 -7.055 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -6.665 -9.563 -6.354 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -7.990 -9.721 -5.218 1.00 0.00 H new ATOM 1333 N ARG A 88 -10.380 -8.651 -6.867 1.00 0.00 N ATOM 1334 CA ARG A 88 -11.096 -7.382 -6.924 1.00 0.00 C ATOM 1335 C ARG A 88 -12.259 -7.364 -5.935 1.00 0.00 C ATOM 1336 O ARG A 88 -13.032 -8.319 -5.853 1.00 0.00 O ATOM 1337 CB ARG A 88 -11.615 -7.128 -8.340 1.00 0.00 C ATOM 1338 CG ARG A 88 -12.108 -8.383 -9.043 1.00 0.00 C ATOM 1339 CD ARG A 88 -12.890 -8.045 -10.302 1.00 0.00 C ATOM 1340 NE ARG A 88 -13.085 -9.213 -11.155 1.00 0.00 N ATOM 1341 CZ ARG A 88 -13.984 -9.270 -12.132 1.00 0.00 C ATOM 1342 NH1 ARG A 88 -14.767 -8.228 -12.377 1.00 0.00 N ATOM 1343 NH2 ARG A 88 -14.103 -10.368 -12.865 1.00 0.00 N ATOM 0 H ARG A 88 -10.891 -9.404 -6.406 1.00 0.00 H new ATOM 0 HA ARG A 88 -10.398 -6.590 -6.651 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -12.428 -6.404 -8.295 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -10.820 -6.678 -8.934 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -11.258 -9.015 -9.300 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -12.739 -8.957 -8.365 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -13.860 -7.632 -10.026 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -12.362 -7.272 -10.861 1.00 0.00 H new ATOM 0 HE ARG A 88 -12.498 -10.031 -10.992 1.00 0.00 H new ATOM 0 HH11 ARG A 88 -14.680 -7.381 -11.815 1.00 0.00 H new ATOM 0 HH12 ARG A 88 -15.456 -8.273 -13.127 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -13.504 -11.172 -12.680 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -14.794 -10.409 -13.614 1.00 0.00 H new ATOM 1357 N ILE A 89 -12.378 -6.269 -5.190 1.00 0.00 N ATOM 1358 CA ILE A 89 -13.447 -6.123 -4.210 1.00 0.00 C ATOM 1359 C ILE A 89 -14.615 -5.334 -4.793 1.00 0.00 C ATOM 1360 O ILE A 89 -14.494 -4.139 -5.066 1.00 0.00 O ATOM 1361 CB ILE A 89 -12.950 -5.414 -2.935 1.00 0.00 C ATOM 1362 CG1 ILE A 89 -11.768 -6.173 -2.329 1.00 0.00 C ATOM 1363 CG2 ILE A 89 -14.079 -5.288 -1.923 1.00 0.00 C ATOM 1364 CD1 ILE A 89 -11.221 -5.535 -1.071 1.00 0.00 C ATOM 0 H ILE A 89 -11.747 -5.470 -5.247 1.00 0.00 H new ATOM 0 HA ILE A 89 -13.779 -7.128 -3.950 1.00 0.00 H new ATOM 0 HB ILE A 89 -12.615 -4.412 -3.203 1.00 0.00 H new ATOM 0 HG12 ILE A 89 -12.079 -7.193 -2.104 1.00 0.00 H new ATOM 0 HG13 ILE A 89 -10.971 -6.239 -3.069 1.00 0.00 H new ATOM 0 HG21 ILE A 89 -13.711 -4.785 -1.028 1.00 0.00 H new ATOM 0 HG22 ILE A 89 -14.893 -4.708 -2.357 1.00 0.00 H new ATOM 0 HG23 ILE A 89 -14.442 -6.281 -1.658 1.00 0.00 H new ATOM 0 HD11 ILE A 89 -10.385 -6.126 -0.697 1.00 0.00 H new ATOM 0 HD12 ILE A 89 -10.879 -4.525 -1.295 1.00 0.00 H new ATOM 0 HD13 ILE A 89 -12.004 -5.494 -0.314 1.00 0.00 H new ATOM 1376 N THR A 90 -15.744 -6.007 -4.989 1.00 0.00 N ATOM 1377 CA THR A 90 -16.929 -5.364 -5.547 1.00 0.00 C ATOM 1378 C THR A 90 -17.860 -4.863 -4.446 1.00 0.00 C ATOM 1379 O THR A 90 -18.315 -5.635 -3.602 1.00 0.00 O ATOM 1380 CB THR A 90 -17.679 -6.337 -6.459 1.00 0.00 C ATOM 1381 OG1 THR A 90 -16.844 -6.779 -7.515 1.00 0.00 O ATOM 1382 CG2 THR A 90 -18.924 -5.738 -7.077 1.00 0.00 C ATOM 0 H THR A 90 -15.864 -6.996 -4.770 1.00 0.00 H new ATOM 0 HA THR A 90 -16.598 -4.504 -6.130 1.00 0.00 H new ATOM 0 HB THR A 90 -17.975 -7.166 -5.817 1.00 0.00 H new ATOM 0 HG1 THR A 90 -17.341 -7.401 -8.086 1.00 0.00 H new ATOM 0 HG21 THR A 90 -19.408 -6.480 -7.712 1.00 0.00 H new ATOM 0 HG22 THR A 90 -19.611 -5.432 -6.288 1.00 0.00 H new ATOM 0 HG23 THR A 90 -18.651 -4.870 -7.677 1.00 0.00 H new ATOM 1390 N ILE A 91 -18.142 -3.564 -4.468 1.00 0.00 N ATOM 1391 CA ILE A 91 -19.022 -2.951 -3.482 1.00 0.00 C ATOM 1392 C ILE A 91 -20.328 -2.498 -4.126 1.00 0.00 C ATOM 1393 O ILE A 91 -20.348 -1.545 -4.905 1.00 0.00 O ATOM 1394 CB ILE A 91 -18.350 -1.741 -2.806 1.00 0.00 C ATOM 1395 CG1 ILE A 91 -16.979 -2.133 -2.253 1.00 0.00 C ATOM 1396 CG2 ILE A 91 -19.238 -1.190 -1.699 1.00 0.00 C ATOM 1397 CD1 ILE A 91 -15.868 -2.043 -3.276 1.00 0.00 C ATOM 0 H ILE A 91 -17.771 -2.914 -5.161 1.00 0.00 H new ATOM 0 HA ILE A 91 -19.232 -3.708 -2.727 1.00 0.00 H new ATOM 0 HB ILE A 91 -18.208 -0.960 -3.553 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -16.738 -1.487 -1.409 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -17.028 -3.152 -1.870 1.00 0.00 H new ATOM 0 HG21 ILE A 91 -18.749 -0.336 -1.231 1.00 0.00 H new ATOM 0 HG22 ILE A 91 -20.193 -0.875 -2.121 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -19.409 -1.964 -0.951 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -14.924 -2.335 -2.815 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -16.086 -2.710 -4.110 1.00 0.00 H new ATOM 0 HD13 ILE A 91 -15.792 -1.019 -3.641 1.00 0.00 H new ATOM 1409 N GLU A 92 -21.417 -3.186 -3.799 1.00 0.00 N ATOM 1410 CA GLU A 92 -22.726 -2.851 -4.351 1.00 0.00 C ATOM 1411 C GLU A 92 -23.651 -2.304 -3.269 1.00 0.00 C ATOM 1412 O GLU A 92 -23.775 -2.886 -2.192 1.00 0.00 O ATOM 1413 CB GLU A 92 -23.359 -4.082 -5.001 1.00 0.00 C ATOM 1414 CG GLU A 92 -23.288 -5.331 -4.138 1.00 0.00 C ATOM 1415 CD GLU A 92 -24.229 -6.422 -4.611 1.00 0.00 C ATOM 1416 OE1 GLU A 92 -25.300 -6.087 -5.158 1.00 0.00 O ATOM 1417 OE2 GLU A 92 -23.893 -7.612 -4.433 1.00 0.00 O ATOM 0 H GLU A 92 -21.420 -3.978 -3.156 1.00 0.00 H new ATOM 0 HA GLU A 92 -22.585 -2.079 -5.108 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -24.403 -3.866 -5.228 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -22.861 -4.278 -5.950 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -22.267 -5.712 -4.140 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -23.529 -5.070 -3.108 1.00 0.00 H new ATOM 1424 N TRP A 93 -24.301 -1.182 -3.563 1.00 0.00 N ATOM 1425 CA TRP A 93 -25.217 -0.562 -2.611 1.00 0.00 C ATOM 1426 C TRP A 93 -26.496 -0.102 -3.303 1.00 0.00 C ATOM 1427 O TRP A 93 -26.463 0.390 -4.431 1.00 0.00 O ATOM 1428 CB TRP A 93 -24.540 0.623 -1.916 1.00 0.00 C ATOM 1429 CG TRP A 93 -24.342 1.806 -2.813 1.00 0.00 C ATOM 1430 CD1 TRP A 93 -24.989 3.008 -2.741 1.00 0.00 C ATOM 1431 CD2 TRP A 93 -23.435 1.904 -3.916 1.00 0.00 C ATOM 1432 NE1 TRP A 93 -24.540 3.845 -3.734 1.00 0.00 N ATOM 1433 CE2 TRP A 93 -23.586 3.190 -4.469 1.00 0.00 C ATOM 1434 CE3 TRP A 93 -22.511 1.027 -4.492 1.00 0.00 C ATOM 1435 CZ2 TRP A 93 -22.846 3.620 -5.568 1.00 0.00 C ATOM 1436 CZ3 TRP A 93 -21.777 1.455 -5.582 1.00 0.00 C ATOM 1437 CH2 TRP A 93 -21.948 2.741 -6.110 1.00 0.00 C ATOM 0 H TRP A 93 -24.211 -0.685 -4.449 1.00 0.00 H new ATOM 0 HA TRP A 93 -25.482 -1.309 -1.862 1.00 0.00 H new ATOM 0 HB2 TRP A 93 -25.142 0.924 -1.058 1.00 0.00 H new ATOM 0 HB3 TRP A 93 -23.572 0.303 -1.530 1.00 0.00 H new ATOM 0 HD1 TRP A 93 -25.743 3.263 -2.011 1.00 0.00 H new ATOM 0 HE1 TRP A 93 -24.864 4.798 -3.898 1.00 0.00 H new ATOM 0 HE3 TRP A 93 -22.373 0.033 -4.092 1.00 0.00 H new ATOM 0 HZ2 TRP A 93 -22.976 4.611 -5.977 1.00 0.00 H new ATOM 0 HZ3 TRP A 93 -21.059 0.787 -6.034 1.00 0.00 H new ATOM 0 HH2 TRP A 93 -21.359 3.045 -6.963 1.00 0.00 H new ATOM 1448 N THR A 94 -27.623 -0.265 -2.617 1.00 0.00 N ATOM 1449 CA THR A 94 -28.916 0.135 -3.162 1.00 0.00 C ATOM 1450 C THR A 94 -29.705 0.951 -2.145 1.00 0.00 C ATOM 1451 O THR A 94 -29.637 0.697 -0.942 1.00 0.00 O ATOM 1452 CB THR A 94 -29.721 -1.097 -3.580 1.00 0.00 C ATOM 1453 OG1 THR A 94 -31.075 -0.753 -3.817 1.00 0.00 O ATOM 1454 CG2 THR A 94 -29.702 -2.203 -2.547 1.00 0.00 C ATOM 0 H THR A 94 -27.667 -0.671 -1.682 1.00 0.00 H new ATOM 0 HA THR A 94 -28.736 0.757 -4.039 1.00 0.00 H new ATOM 0 HB THR A 94 -29.241 -1.462 -4.488 1.00 0.00 H new ATOM 0 HG1 THR A 94 -31.574 -1.553 -4.085 1.00 0.00 H new ATOM 0 HG21 THR A 94 -30.292 -3.046 -2.906 1.00 0.00 H new ATOM 0 HG22 THR A 94 -28.674 -2.525 -2.377 1.00 0.00 H new ATOM 0 HG23 THR A 94 -30.126 -1.835 -1.613 1.00 0.00 H new ATOM 1462 N ASN A 95 -30.455 1.933 -2.636 1.00 0.00 N ATOM 1463 CA ASN A 95 -31.258 2.788 -1.768 1.00 0.00 C ATOM 1464 C ASN A 95 -32.186 1.954 -0.892 1.00 0.00 C ATOM 1465 O ASN A 95 -32.719 0.933 -1.328 1.00 0.00 O ATOM 1466 CB ASN A 95 -32.078 3.773 -2.604 1.00 0.00 C ATOM 1467 CG ASN A 95 -31.386 5.112 -2.762 1.00 0.00 C ATOM 1468 OD1 ASN A 95 -30.173 5.179 -2.964 1.00 0.00 O ATOM 1469 ND2 ASN A 95 -32.156 6.191 -2.671 1.00 0.00 N ATOM 0 H ASN A 95 -30.523 2.156 -3.629 1.00 0.00 H new ATOM 0 HA ASN A 95 -30.580 3.346 -1.122 1.00 0.00 H new ATOM 0 HB2 ASN A 95 -32.262 3.344 -3.589 1.00 0.00 H new ATOM 0 HB3 ASN A 95 -33.050 3.923 -2.134 1.00 0.00 H new ATOM 0 HD21 ASN A 95 -31.746 7.120 -2.769 1.00 0.00 H new ATOM 0 HD22 ASN A 95 -33.157 6.090 -2.503 1.00 0.00 H new ATOM 1476 N THR A 96 -32.375 2.395 0.348 1.00 0.00 N ATOM 1477 CA THR A 96 -33.239 1.689 1.287 1.00 0.00 C ATOM 1478 C THR A 96 -34.707 2.020 1.029 1.00 0.00 C ATOM 1479 O THR A 96 -35.044 3.149 0.672 1.00 0.00 O ATOM 1480 CB THR A 96 -32.866 2.051 2.725 1.00 0.00 C ATOM 1481 OG1 THR A 96 -32.462 3.405 2.815 1.00 0.00 O ATOM 1482 CG2 THR A 96 -31.747 1.199 3.284 1.00 0.00 C ATOM 0 H THR A 96 -31.941 3.238 0.725 1.00 0.00 H new ATOM 0 HA THR A 96 -33.096 0.618 1.141 1.00 0.00 H new ATOM 0 HB THR A 96 -33.767 1.870 3.311 1.00 0.00 H new ATOM 0 HG1 THR A 96 -33.254 3.981 2.854 1.00 0.00 H new ATOM 0 HG21 THR A 96 -31.531 1.507 4.307 1.00 0.00 H new ATOM 0 HG22 THR A 96 -32.049 0.152 3.276 1.00 0.00 H new ATOM 0 HG23 THR A 96 -30.854 1.324 2.672 1.00 0.00 H new ATOM 1490 N PRO A 97 -35.603 1.034 1.209 1.00 0.00 N ATOM 1491 CA PRO A 97 -37.042 1.226 0.996 1.00 0.00 C ATOM 1492 C PRO A 97 -37.656 2.166 2.028 1.00 0.00 C ATOM 1493 O PRO A 97 -37.098 2.372 3.105 1.00 0.00 O ATOM 1494 CB PRO A 97 -37.618 -0.184 1.148 1.00 0.00 C ATOM 1495 CG PRO A 97 -36.630 -0.909 1.994 1.00 0.00 C ATOM 1496 CD PRO A 97 -35.287 -0.340 1.636 1.00 0.00 C ATOM 0 HA PRO A 97 -37.254 1.683 0.029 1.00 0.00 H new ATOM 0 HB2 PRO A 97 -38.601 -0.161 1.619 1.00 0.00 H new ATOM 0 HB3 PRO A 97 -37.740 -0.668 0.179 1.00 0.00 H new ATOM 0 HG2 PRO A 97 -36.844 -0.768 3.053 1.00 0.00 H new ATOM 0 HG3 PRO A 97 -36.664 -1.981 1.802 1.00 0.00 H new ATOM 0 HD2 PRO A 97 -34.606 -0.350 2.487 1.00 0.00 H new ATOM 0 HD3 PRO A 97 -34.809 -0.909 0.839 1.00 0.00 H new ATOM 1504 N ASP A 98 -38.807 2.735 1.690 1.00 0.00 N ATOM 1505 CA ASP A 98 -39.496 3.654 2.589 1.00 0.00 C ATOM 1506 C ASP A 98 -39.664 3.041 3.976 1.00 0.00 C ATOM 1507 O ASP A 98 -40.229 1.957 4.122 1.00 0.00 O ATOM 1508 CB ASP A 98 -40.865 4.028 2.017 1.00 0.00 C ATOM 1509 CG ASP A 98 -41.708 2.811 1.692 1.00 0.00 C ATOM 1510 OD1 ASP A 98 -41.185 1.681 1.799 1.00 0.00 O ATOM 1511 OD2 ASP A 98 -42.890 2.987 1.330 1.00 0.00 O ATOM 0 H ASP A 98 -39.283 2.577 0.802 1.00 0.00 H new ATOM 0 HA ASP A 98 -38.888 4.554 2.682 1.00 0.00 H new ATOM 0 HB2 ASP A 98 -41.397 4.654 2.734 1.00 0.00 H new ATOM 0 HB3 ASP A 98 -40.728 4.623 1.114 1.00 0.00 H new ATOM 1516 N GLY A 99 -39.170 3.742 4.991 1.00 0.00 N ATOM 1517 CA GLY A 99 -39.275 3.251 6.353 1.00 0.00 C ATOM 1518 C GLY A 99 -38.559 1.930 6.552 1.00 0.00 C ATOM 1519 O GLY A 99 -39.020 1.075 7.308 1.00 0.00 O ATOM 0 H GLY A 99 -38.699 4.641 4.895 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -38.859 3.992 7.036 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -40.327 3.133 6.613 1.00 0.00 H new ATOM 1523 N ALA A 100 -37.431 1.763 5.872 1.00 0.00 N ATOM 1524 CA ALA A 100 -36.651 0.536 5.977 1.00 0.00 C ATOM 1525 C ALA A 100 -36.090 0.361 7.384 1.00 0.00 C ATOM 1526 O ALA A 100 -35.579 1.309 7.982 1.00 0.00 O ATOM 1527 CB ALA A 100 -35.524 0.535 4.956 1.00 0.00 C ATOM 0 H ALA A 100 -37.036 2.462 5.242 1.00 0.00 H new ATOM 0 HA ALA A 100 -37.314 -0.304 5.770 1.00 0.00 H new ATOM 0 HB1 ALA A 100 -34.951 -0.388 5.047 1.00 0.00 H new ATOM 0 HB2 ALA A 100 -35.943 0.604 3.952 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -34.869 1.388 5.136 1.00 0.00 H new ATOM 1533 N ALA A 101 -36.188 -0.856 7.906 1.00 0.00 N ATOM 1534 CA ALA A 101 -35.689 -1.158 9.243 1.00 0.00 C ATOM 1535 C ALA A 101 -34.232 -0.757 9.392 1.00 0.00 C ATOM 1536 O ALA A 101 -33.533 -0.520 8.407 1.00 0.00 O ATOM 1537 CB ALA A 101 -35.855 -2.637 9.550 1.00 0.00 C ATOM 0 H ALA A 101 -36.609 -1.650 7.424 1.00 0.00 H new ATOM 0 HA ALA A 101 -36.276 -0.578 9.955 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -35.478 -2.845 10.551 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -36.911 -2.903 9.497 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -35.296 -3.225 8.822 1.00 0.00 H new ATOM 1543 N LYS A 102 -33.781 -0.690 10.636 1.00 0.00 N ATOM 1544 CA LYS A 102 -32.401 -0.324 10.929 1.00 0.00 C ATOM 1545 C LYS A 102 -31.520 -1.562 10.983 1.00 0.00 C ATOM 1546 O LYS A 102 -31.050 -1.964 12.048 1.00 0.00 O ATOM 1547 CB LYS A 102 -32.316 0.444 12.249 1.00 0.00 C ATOM 1548 CG LYS A 102 -32.934 -0.295 13.426 1.00 0.00 C ATOM 1549 CD LYS A 102 -34.220 0.369 13.887 1.00 0.00 C ATOM 1550 CE LYS A 102 -34.554 0.000 15.323 1.00 0.00 C ATOM 1551 NZ LYS A 102 -34.818 -1.457 15.474 1.00 0.00 N ATOM 0 H LYS A 102 -34.350 -0.884 11.460 1.00 0.00 H new ATOM 0 HA LYS A 102 -32.043 0.323 10.128 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -31.269 0.653 12.471 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -32.815 1.406 12.132 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -33.138 -1.327 13.142 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -32.223 -0.326 14.252 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -34.123 1.451 13.802 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -35.040 0.070 13.233 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -33.728 0.289 15.974 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -35.429 0.563 15.649 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -35.075 -1.663 16.460 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -35.600 -1.735 14.847 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -33.964 -1.993 15.220 1.00 0.00 H new ATOM 1565 N GLN A 103 -31.303 -2.160 9.821 1.00 0.00 N ATOM 1566 CA GLN A 103 -30.478 -3.358 9.712 1.00 0.00 C ATOM 1567 C GLN A 103 -30.430 -3.856 8.272 1.00 0.00 C ATOM 1568 O GLN A 103 -31.442 -3.855 7.571 1.00 0.00 O ATOM 1569 CB GLN A 103 -31.018 -4.460 10.627 1.00 0.00 C ATOM 1570 CG GLN A 103 -30.090 -4.800 11.781 1.00 0.00 C ATOM 1571 CD GLN A 103 -28.988 -5.760 11.378 1.00 0.00 C ATOM 1572 OE1 GLN A 103 -28.078 -5.400 10.631 1.00 0.00 O ATOM 1573 NE2 GLN A 103 -29.064 -6.991 11.871 1.00 0.00 N ATOM 0 H GLN A 103 -31.688 -1.834 8.935 1.00 0.00 H new ATOM 0 HA GLN A 103 -29.465 -3.101 10.023 1.00 0.00 H new ATOM 0 HB2 GLN A 103 -31.983 -4.148 11.027 1.00 0.00 H new ATOM 0 HB3 GLN A 103 -31.193 -5.359 10.036 1.00 0.00 H new ATOM 0 HG2 GLN A 103 -29.645 -3.883 12.167 1.00 0.00 H new ATOM 0 HG3 GLN A 103 -30.671 -5.239 12.592 1.00 0.00 H new ATOM 0 HE21 GLN A 103 -29.836 -7.247 12.487 1.00 0.00 H new ATOM 0 HE22 GLN A 103 -28.351 -7.680 11.634 1.00 0.00 H new ATOM 1582 N PHE A 104 -29.249 -4.282 7.837 1.00 0.00 N ATOM 1583 CA PHE A 104 -29.070 -4.783 6.480 1.00 0.00 C ATOM 1584 C PHE A 104 -30.121 -5.837 6.146 1.00 0.00 C ATOM 1585 O PHE A 104 -30.450 -6.685 6.975 1.00 0.00 O ATOM 1586 CB PHE A 104 -27.667 -5.372 6.314 1.00 0.00 C ATOM 1587 CG PHE A 104 -27.407 -5.926 4.942 1.00 0.00 C ATOM 1588 CD1 PHE A 104 -26.955 -5.104 3.922 1.00 0.00 C ATOM 1589 CD2 PHE A 104 -27.614 -7.269 4.673 1.00 0.00 C ATOM 1590 CE1 PHE A 104 -26.713 -5.611 2.660 1.00 0.00 C ATOM 1591 CE2 PHE A 104 -27.374 -7.783 3.412 1.00 0.00 C ATOM 1592 CZ PHE A 104 -26.923 -6.953 2.404 1.00 0.00 C ATOM 0 H PHE A 104 -28.402 -4.290 8.405 1.00 0.00 H new ATOM 0 HA PHE A 104 -29.190 -3.947 5.791 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -26.929 -4.599 6.531 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -27.525 -6.164 7.050 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -26.790 -4.054 4.116 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -27.967 -7.922 5.457 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -26.360 -4.960 1.874 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -27.539 -8.832 3.215 1.00 0.00 H new ATOM 0 HZ PHE A 104 -26.735 -7.352 1.418 1.00 0.00 H new ATOM 1602 N ARG A 105 -30.642 -5.779 4.924 1.00 0.00 N ATOM 1603 CA ARG A 105 -31.655 -6.728 4.480 1.00 0.00 C ATOM 1604 C ARG A 105 -31.279 -7.335 3.132 1.00 0.00 C ATOM 1605 O ARG A 105 -30.634 -6.686 2.307 1.00 0.00 O ATOM 1606 CB ARG A 105 -33.019 -6.043 4.382 1.00 0.00 C ATOM 1607 CG ARG A 105 -33.696 -5.841 5.727 1.00 0.00 C ATOM 1608 CD ARG A 105 -34.364 -7.118 6.211 1.00 0.00 C ATOM 1609 NE ARG A 105 -33.785 -7.598 7.462 1.00 0.00 N ATOM 1610 CZ ARG A 105 -34.283 -8.611 8.162 1.00 0.00 C ATOM 1611 NH1 ARG A 105 -35.365 -9.245 7.735 1.00 0.00 N ATOM 1612 NH2 ARG A 105 -33.700 -8.990 9.291 1.00 0.00 N ATOM 0 H ARG A 105 -30.379 -5.085 4.225 1.00 0.00 H new ATOM 0 HA ARG A 105 -31.712 -7.530 5.216 1.00 0.00 H new ATOM 0 HB2 ARG A 105 -32.896 -5.074 3.897 1.00 0.00 H new ATOM 0 HB3 ARG A 105 -33.670 -6.639 3.743 1.00 0.00 H new ATOM 0 HG2 ARG A 105 -32.960 -5.514 6.461 1.00 0.00 H new ATOM 0 HG3 ARG A 105 -34.440 -5.048 5.646 1.00 0.00 H new ATOM 0 HD2 ARG A 105 -35.430 -6.939 6.350 1.00 0.00 H new ATOM 0 HD3 ARG A 105 -34.267 -7.890 5.447 1.00 0.00 H new ATOM 0 HE ARG A 105 -32.952 -7.130 7.818 1.00 0.00 H new ATOM 0 HH11 ARG A 105 -35.817 -8.955 6.868 1.00 0.00 H new ATOM 0 HH12 ARG A 105 -35.746 -10.023 8.274 1.00 0.00 H new ATOM 0 HH21 ARG A 105 -32.867 -8.503 9.623 1.00 0.00 H new ATOM 0 HH22 ARG A 105 -34.084 -9.768 9.827 1.00 0.00 H new ATOM 1626 N ARG A 106 -31.684 -8.581 2.915 1.00 0.00 N ATOM 1627 CA ARG A 106 -31.388 -9.276 1.667 1.00 0.00 C ATOM 1628 C ARG A 106 -32.353 -8.850 0.565 1.00 0.00 C ATOM 1629 O ARG A 106 -31.989 -8.805 -0.610 1.00 0.00 O ATOM 1630 CB ARG A 106 -31.464 -10.790 1.870 1.00 0.00 C ATOM 1631 CG ARG A 106 -31.146 -11.590 0.617 1.00 0.00 C ATOM 1632 CD ARG A 106 -32.284 -12.529 0.252 1.00 0.00 C ATOM 1633 NE ARG A 106 -31.814 -13.891 0.010 1.00 0.00 N ATOM 1634 CZ ARG A 106 -32.600 -14.876 -0.414 1.00 0.00 C ATOM 1635 NH1 ARG A 106 -33.888 -14.649 -0.639 1.00 0.00 N ATOM 1636 NH2 ARG A 106 -32.099 -16.087 -0.614 1.00 0.00 N ATOM 0 H ARG A 106 -32.219 -9.131 3.587 1.00 0.00 H new ATOM 0 HA ARG A 106 -30.376 -9.008 1.363 1.00 0.00 H new ATOM 0 HB2 ARG A 106 -30.770 -11.077 2.660 1.00 0.00 H new ATOM 0 HB3 ARG A 106 -32.465 -11.052 2.214 1.00 0.00 H new ATOM 0 HG2 ARG A 106 -30.955 -10.909 -0.212 1.00 0.00 H new ATOM 0 HG3 ARG A 106 -30.234 -12.166 0.773 1.00 0.00 H new ATOM 0 HD2 ARG A 106 -33.020 -12.537 1.056 1.00 0.00 H new ATOM 0 HD3 ARG A 106 -32.790 -12.156 -0.639 1.00 0.00 H new ATOM 0 HE ARG A 106 -30.829 -14.098 0.175 1.00 0.00 H new ATOM 0 HH11 ARG A 106 -34.276 -13.718 -0.487 1.00 0.00 H new ATOM 0 HH12 ARG A 106 -34.490 -15.405 -0.964 1.00 0.00 H new ATOM 0 HH21 ARG A 106 -31.109 -16.264 -0.443 1.00 0.00 H new ATOM 0 HH22 ARG A 106 -32.703 -16.842 -0.939 1.00 0.00 H new ATOM 1650 N GLU A 107 -33.586 -8.540 0.952 1.00 0.00 N ATOM 1651 CA GLU A 107 -34.604 -8.119 -0.004 1.00 0.00 C ATOM 1652 C GLU A 107 -34.379 -6.678 -0.466 1.00 0.00 C ATOM 1653 O GLU A 107 -35.037 -6.213 -1.397 1.00 0.00 O ATOM 1654 CB GLU A 107 -35.998 -8.256 0.612 1.00 0.00 C ATOM 1655 CG GLU A 107 -36.900 -9.223 -0.139 1.00 0.00 C ATOM 1656 CD GLU A 107 -38.371 -8.910 0.048 1.00 0.00 C ATOM 1657 OE1 GLU A 107 -38.890 -9.137 1.161 1.00 0.00 O ATOM 1658 OE2 GLU A 107 -39.005 -8.438 -0.919 1.00 0.00 O ATOM 0 H GLU A 107 -33.904 -8.572 1.920 1.00 0.00 H new ATOM 0 HA GLU A 107 -34.528 -8.769 -0.876 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -35.899 -8.591 1.645 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -36.473 -7.275 0.639 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -36.657 -9.191 -1.201 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -36.702 -10.239 0.202 1.00 0.00 H new ATOM 1665 N TRP A 108 -33.455 -5.972 0.184 1.00 0.00 N ATOM 1666 CA TRP A 108 -33.163 -4.589 -0.176 1.00 0.00 C ATOM 1667 C TRP A 108 -32.624 -4.490 -1.603 1.00 0.00 C ATOM 1668 O TRP A 108 -32.642 -3.417 -2.206 1.00 0.00 O ATOM 1669 CB TRP A 108 -32.157 -3.988 0.806 1.00 0.00 C ATOM 1670 CG TRP A 108 -32.796 -3.456 2.053 1.00 0.00 C ATOM 1671 CD1 TRP A 108 -34.128 -3.452 2.351 1.00 0.00 C ATOM 1672 CD2 TRP A 108 -32.132 -2.850 3.169 1.00 0.00 C ATOM 1673 NE1 TRP A 108 -34.334 -2.882 3.583 1.00 0.00 N ATOM 1674 CE2 TRP A 108 -33.125 -2.503 4.106 1.00 0.00 C ATOM 1675 CE3 TRP A 108 -30.796 -2.567 3.468 1.00 0.00 C ATOM 1676 CZ2 TRP A 108 -32.823 -1.889 5.318 1.00 0.00 C ATOM 1677 CZ3 TRP A 108 -30.498 -1.957 4.673 1.00 0.00 C ATOM 1678 CH2 TRP A 108 -31.508 -1.624 5.585 1.00 0.00 C ATOM 0 H TRP A 108 -32.899 -6.334 0.959 1.00 0.00 H new ATOM 0 HA TRP A 108 -34.095 -4.025 -0.125 1.00 0.00 H new ATOM 0 HB2 TRP A 108 -31.424 -4.748 1.077 1.00 0.00 H new ATOM 0 HB3 TRP A 108 -31.613 -3.183 0.312 1.00 0.00 H new ATOM 0 HD1 TRP A 108 -34.906 -3.841 1.711 1.00 0.00 H new ATOM 0 HE1 TRP A 108 -35.240 -2.760 4.036 1.00 0.00 H new ATOM 0 HE3 TRP A 108 -30.011 -2.820 2.771 1.00 0.00 H new ATOM 0 HZ2 TRP A 108 -33.600 -1.631 6.023 1.00 0.00 H new ATOM 0 HZ3 TRP A 108 -29.469 -1.734 4.915 1.00 0.00 H new ATOM 0 HH2 TRP A 108 -31.243 -1.148 6.518 1.00 0.00 H new ATOM 1689 N PHE A 109 -32.150 -5.612 -2.139 1.00 0.00 N ATOM 1690 CA PHE A 109 -31.611 -5.640 -3.495 1.00 0.00 C ATOM 1691 C PHE A 109 -32.594 -6.303 -4.455 1.00 0.00 C ATOM 1692 O PHE A 109 -32.193 -6.891 -5.460 1.00 0.00 O ATOM 1693 CB PHE A 109 -30.276 -6.386 -3.520 1.00 0.00 C ATOM 1694 CG PHE A 109 -29.136 -5.599 -2.943 1.00 0.00 C ATOM 1695 CD1 PHE A 109 -29.152 -5.205 -1.614 1.00 0.00 C ATOM 1696 CD2 PHE A 109 -28.047 -5.254 -3.727 1.00 0.00 C ATOM 1697 CE1 PHE A 109 -28.103 -4.481 -1.079 1.00 0.00 C ATOM 1698 CE2 PHE A 109 -26.996 -4.530 -3.198 1.00 0.00 C ATOM 1699 CZ PHE A 109 -27.023 -4.143 -1.872 1.00 0.00 C ATOM 0 H PHE A 109 -32.128 -6.510 -1.657 1.00 0.00 H new ATOM 0 HA PHE A 109 -31.451 -4.611 -3.818 1.00 0.00 H new ATOM 0 HB2 PHE A 109 -30.380 -7.318 -2.965 1.00 0.00 H new ATOM 0 HB3 PHE A 109 -30.038 -6.653 -4.550 1.00 0.00 H new ATOM 0 HD1 PHE A 109 -29.993 -5.467 -0.990 1.00 0.00 H new ATOM 0 HD2 PHE A 109 -28.019 -5.555 -4.764 1.00 0.00 H new ATOM 0 HE1 PHE A 109 -28.127 -4.180 -0.042 1.00 0.00 H new ATOM 0 HE2 PHE A 109 -26.154 -4.267 -3.821 1.00 0.00 H new ATOM 0 HZ PHE A 109 -26.202 -3.578 -1.456 1.00 0.00 H new ATOM 1709 N GLN A 110 -33.881 -6.203 -4.141 1.00 0.00 N ATOM 1710 CA GLN A 110 -34.920 -6.794 -4.976 1.00 0.00 C ATOM 1711 C GLN A 110 -36.219 -5.998 -4.877 1.00 0.00 C ATOM 1712 O GLN A 110 -37.310 -6.561 -4.961 1.00 0.00 O ATOM 1713 CB GLN A 110 -35.168 -8.247 -4.568 1.00 0.00 C ATOM 1714 CG GLN A 110 -34.041 -9.190 -4.958 1.00 0.00 C ATOM 1715 CD GLN A 110 -34.416 -10.649 -4.789 1.00 0.00 C ATOM 1716 OE1 GLN A 110 -34.719 -11.342 -5.760 1.00 0.00 O ATOM 1717 NE2 GLN A 110 -34.398 -11.126 -3.548 1.00 0.00 N ATOM 0 H GLN A 110 -34.230 -5.718 -3.314 1.00 0.00 H new ATOM 0 HA GLN A 110 -34.576 -6.767 -6.010 1.00 0.00 H new ATOM 0 HB2 GLN A 110 -35.312 -8.293 -3.488 1.00 0.00 H new ATOM 0 HB3 GLN A 110 -36.094 -8.592 -5.028 1.00 0.00 H new ATOM 0 HG2 GLN A 110 -33.763 -9.008 -5.996 1.00 0.00 H new ATOM 0 HG3 GLN A 110 -33.163 -8.972 -4.350 1.00 0.00 H new ATOM 0 HE21 GLN A 110 -34.141 -10.517 -2.771 1.00 0.00 H new ATOM 0 HE22 GLN A 110 -34.641 -12.101 -3.373 1.00 0.00 H new ATOM 1726 N GLY A 111 -36.091 -4.688 -4.697 1.00 0.00 N ATOM 1727 CA GLY A 111 -37.262 -3.838 -4.591 1.00 0.00 C ATOM 1728 C GLY A 111 -37.290 -2.757 -5.653 1.00 0.00 C ATOM 1729 O GLY A 111 -36.895 -2.989 -6.795 1.00 0.00 O ATOM 0 H GLY A 111 -35.198 -4.200 -4.623 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -38.160 -4.450 -4.675 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -37.283 -3.375 -3.605 1.00 0.00 H new ATOM 1733 N ASP A 112 -37.756 -1.570 -5.276 1.00 0.00 N ATOM 1734 CA ASP A 112 -37.833 -0.450 -6.206 1.00 0.00 C ATOM 1735 C ASP A 112 -36.514 0.317 -6.239 1.00 0.00 C ATOM 1736 O ASP A 112 -35.868 0.505 -5.210 1.00 0.00 O ATOM 1737 CB ASP A 112 -38.974 0.490 -5.814 1.00 0.00 C ATOM 1738 CG ASP A 112 -39.936 0.738 -6.958 1.00 0.00 C ATOM 1739 OD1 ASP A 112 -40.032 -0.128 -7.852 1.00 0.00 O ATOM 1740 OD2 ASP A 112 -40.595 1.800 -6.961 1.00 0.00 O ATOM 0 H ASP A 112 -38.085 -1.360 -4.334 1.00 0.00 H new ATOM 0 HA ASP A 112 -38.028 -0.848 -7.202 1.00 0.00 H new ATOM 0 HB2 ASP A 112 -39.518 0.065 -4.971 1.00 0.00 H new ATOM 0 HB3 ASP A 112 -38.559 1.441 -5.479 1.00 0.00 H new ATOM 1745 N GLY A 113 -36.122 0.758 -7.430 1.00 0.00 N ATOM 1746 CA GLY A 113 -34.884 1.500 -7.576 1.00 0.00 C ATOM 1747 C GLY A 113 -33.820 0.713 -8.315 1.00 0.00 C ATOM 1748 O GLY A 113 -34.051 -0.425 -8.722 1.00 0.00 O ATOM 0 H GLY A 113 -36.640 0.614 -8.297 1.00 0.00 H new ATOM 0 HA2 GLY A 113 -35.082 2.429 -8.111 1.00 0.00 H new ATOM 0 HA3 GLY A 113 -34.510 1.774 -6.590 1.00 0.00 H new ATOM 1752 N MET A 114 -32.651 1.322 -8.490 1.00 0.00 N ATOM 1753 CA MET A 114 -31.546 0.673 -9.185 1.00 0.00 C ATOM 1754 C MET A 114 -30.395 0.383 -8.228 1.00 0.00 C ATOM 1755 O MET A 114 -30.179 1.116 -7.262 1.00 0.00 O ATOM 1756 CB MET A 114 -31.057 1.552 -10.338 1.00 0.00 C ATOM 1757 CG MET A 114 -31.601 1.137 -11.695 1.00 0.00 C ATOM 1758 SD MET A 114 -33.339 1.569 -11.909 1.00 0.00 S ATOM 1759 CE MET A 114 -33.225 2.809 -13.196 1.00 0.00 C ATOM 0 H MET A 114 -32.445 2.265 -8.160 1.00 0.00 H new ATOM 0 HA MET A 114 -31.907 -0.274 -9.586 1.00 0.00 H new ATOM 0 HB2 MET A 114 -31.343 2.585 -10.142 1.00 0.00 H new ATOM 0 HB3 MET A 114 -29.968 1.523 -10.369 1.00 0.00 H new ATOM 0 HG2 MET A 114 -31.013 1.614 -12.479 1.00 0.00 H new ATOM 0 HG3 MET A 114 -31.481 0.061 -11.817 1.00 0.00 H new ATOM 0 HE1 MET A 114 -34.223 3.174 -13.439 1.00 0.00 H new ATOM 0 HE2 MET A 114 -32.610 3.639 -12.848 1.00 0.00 H new ATOM 0 HE3 MET A 114 -32.773 2.370 -14.085 1.00 0.00 H new ATOM 1769 N VAL A 115 -29.658 -0.687 -8.501 1.00 0.00 N ATOM 1770 CA VAL A 115 -28.527 -1.071 -7.664 1.00 0.00 C ATOM 1771 C VAL A 115 -27.205 -0.764 -8.358 1.00 0.00 C ATOM 1772 O VAL A 115 -27.004 -1.125 -9.518 1.00 0.00 O ATOM 1773 CB VAL A 115 -28.573 -2.568 -7.308 1.00 0.00 C ATOM 1774 CG1 VAL A 115 -27.574 -2.886 -6.207 1.00 0.00 C ATOM 1775 CG2 VAL A 115 -29.979 -2.977 -6.896 1.00 0.00 C ATOM 0 H VAL A 115 -29.823 -1.305 -9.296 1.00 0.00 H new ATOM 0 HA VAL A 115 -28.598 -0.487 -6.746 1.00 0.00 H new ATOM 0 HB VAL A 115 -28.298 -3.141 -8.193 1.00 0.00 H new ATOM 0 HG11 VAL A 115 -27.621 -3.949 -5.969 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -26.569 -2.634 -6.544 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -27.815 -2.304 -5.318 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -29.991 -4.038 -6.648 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -30.286 -2.398 -6.025 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -30.669 -2.789 -7.719 1.00 0.00 H new ATOM 1785 N ARG A 116 -26.309 -0.094 -7.643 1.00 0.00 N ATOM 1786 CA ARG A 116 -25.007 0.263 -8.194 1.00 0.00 C ATOM 1787 C ARG A 116 -23.956 -0.781 -7.833 1.00 0.00 C ATOM 1788 O ARG A 116 -23.877 -1.230 -6.688 1.00 0.00 O ATOM 1789 CB ARG A 116 -24.573 1.638 -7.683 1.00 0.00 C ATOM 1790 CG ARG A 116 -25.459 2.773 -8.170 1.00 0.00 C ATOM 1791 CD ARG A 116 -24.825 4.129 -7.906 1.00 0.00 C ATOM 1792 NE ARG A 116 -25.160 5.101 -8.941 1.00 0.00 N ATOM 1793 CZ ARG A 116 -24.682 5.052 -10.181 1.00 0.00 C ATOM 1794 NH1 ARG A 116 -23.846 4.085 -10.533 1.00 0.00 N ATOM 1795 NH2 ARG A 116 -25.039 5.971 -11.068 1.00 0.00 N ATOM 0 H ARG A 116 -26.460 0.213 -6.682 1.00 0.00 H new ATOM 0 HA ARG A 116 -25.099 0.298 -9.280 1.00 0.00 H new ATOM 0 HB2 ARG A 116 -24.574 1.629 -6.593 1.00 0.00 H new ATOM 0 HB3 ARG A 116 -23.547 1.827 -7.999 1.00 0.00 H new ATOM 0 HG2 ARG A 116 -25.644 2.659 -9.238 1.00 0.00 H new ATOM 0 HG3 ARG A 116 -26.427 2.720 -7.671 1.00 0.00 H new ATOM 0 HD2 ARG A 116 -25.158 4.502 -6.937 1.00 0.00 H new ATOM 0 HD3 ARG A 116 -23.742 4.018 -7.850 1.00 0.00 H new ATOM 0 HE ARG A 116 -25.797 5.861 -8.700 1.00 0.00 H new ATOM 0 HH11 ARG A 116 -23.569 3.378 -9.852 1.00 0.00 H new ATOM 0 HH12 ARG A 116 -23.480 4.048 -11.484 1.00 0.00 H new ATOM 0 HH21 ARG A 116 -25.681 6.717 -10.799 1.00 0.00 H new ATOM 0 HH22 ARG A 116 -24.672 5.932 -12.019 1.00 0.00 H new ATOM 1809 N ARG A 117 -23.149 -1.163 -8.818 1.00 0.00 N ATOM 1810 CA ARG A 117 -22.100 -2.154 -8.608 1.00 0.00 C ATOM 1811 C ARG A 117 -20.735 -1.597 -8.997 1.00 0.00 C ATOM 1812 O ARG A 117 -20.505 -1.239 -10.153 1.00 0.00 O ATOM 1813 CB ARG A 117 -22.398 -3.420 -9.416 1.00 0.00 C ATOM 1814 CG ARG A 117 -21.327 -4.491 -9.286 1.00 0.00 C ATOM 1815 CD ARG A 117 -21.792 -5.816 -9.867 1.00 0.00 C ATOM 1816 NE ARG A 117 -22.483 -6.637 -8.877 1.00 0.00 N ATOM 1817 CZ ARG A 117 -23.047 -7.808 -9.155 1.00 0.00 C ATOM 1818 NH1 ARG A 117 -23.002 -8.291 -10.389 1.00 0.00 N ATOM 1819 NH2 ARG A 117 -23.656 -8.497 -8.199 1.00 0.00 N ATOM 0 H ARG A 117 -23.202 -0.801 -9.770 1.00 0.00 H new ATOM 0 HA ARG A 117 -22.079 -2.404 -7.547 1.00 0.00 H new ATOM 0 HB2 ARG A 117 -23.353 -3.832 -9.091 1.00 0.00 H new ATOM 0 HB3 ARG A 117 -22.507 -3.153 -10.467 1.00 0.00 H new ATOM 0 HG2 ARG A 117 -20.421 -4.166 -9.798 1.00 0.00 H new ATOM 0 HG3 ARG A 117 -21.069 -4.624 -8.235 1.00 0.00 H new ATOM 0 HD2 ARG A 117 -22.457 -5.628 -10.710 1.00 0.00 H new ATOM 0 HD3 ARG A 117 -20.933 -6.363 -10.255 1.00 0.00 H new ATOM 0 HE ARG A 117 -22.536 -6.293 -7.918 1.00 0.00 H new ATOM 0 HH11 ARG A 117 -22.534 -7.764 -11.126 1.00 0.00 H new ATOM 0 HH12 ARG A 117 -23.435 -9.190 -10.601 1.00 0.00 H new ATOM 0 HH21 ARG A 117 -23.692 -8.128 -7.249 1.00 0.00 H new ATOM 0 HH22 ARG A 117 -24.088 -9.395 -8.414 1.00 0.00 H new ATOM 1833 N LYS A 118 -19.831 -1.530 -8.025 1.00 0.00 N ATOM 1834 CA LYS A 118 -18.485 -1.018 -8.261 1.00 0.00 C ATOM 1835 C LYS A 118 -17.444 -2.095 -7.992 1.00 0.00 C ATOM 1836 O LYS A 118 -17.728 -3.102 -7.346 1.00 0.00 O ATOM 1837 CB LYS A 118 -18.217 0.199 -7.377 1.00 0.00 C ATOM 1838 CG LYS A 118 -18.540 1.522 -8.051 1.00 0.00 C ATOM 1839 CD LYS A 118 -17.282 2.336 -8.312 1.00 0.00 C ATOM 1840 CE LYS A 118 -17.130 3.464 -7.304 1.00 0.00 C ATOM 1841 NZ LYS A 118 -16.643 4.717 -7.942 1.00 0.00 N ATOM 0 H LYS A 118 -20.006 -1.824 -7.064 1.00 0.00 H new ATOM 0 HA LYS A 118 -18.413 -0.719 -9.307 1.00 0.00 H new ATOM 0 HB2 LYS A 118 -18.807 0.112 -6.464 1.00 0.00 H new ATOM 0 HB3 LYS A 118 -17.168 0.198 -7.080 1.00 0.00 H new ATOM 0 HG2 LYS A 118 -19.056 1.335 -8.993 1.00 0.00 H new ATOM 0 HG3 LYS A 118 -19.222 2.095 -7.422 1.00 0.00 H new ATOM 0 HD2 LYS A 118 -16.409 1.684 -8.265 1.00 0.00 H new ATOM 0 HD3 LYS A 118 -17.317 2.749 -9.320 1.00 0.00 H new ATOM 0 HE2 LYS A 118 -18.089 3.651 -6.822 1.00 0.00 H new ATOM 0 HE3 LYS A 118 -16.434 3.161 -6.522 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 -15.939 5.170 -7.325 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 -16.206 4.493 -8.859 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 -17.443 5.365 -8.089 1.00 0.00 H new ATOM 1855 N ASN A 119 -16.238 -1.875 -8.496 1.00 0.00 N ATOM 1856 CA ASN A 119 -15.147 -2.828 -8.314 1.00 0.00 C ATOM 1857 C ASN A 119 -13.825 -2.108 -8.066 1.00 0.00 C ATOM 1858 O ASN A 119 -13.559 -1.056 -8.648 1.00 0.00 O ATOM 1859 CB ASN A 119 -15.024 -3.740 -9.535 1.00 0.00 C ATOM 1860 CG ASN A 119 -15.279 -3.007 -10.838 1.00 0.00 C ATOM 1861 OD1 ASN A 119 -14.636 -2.000 -11.134 1.00 0.00 O ATOM 1862 ND2 ASN A 119 -16.224 -3.511 -11.623 1.00 0.00 N ATOM 0 H ASN A 119 -15.988 -1.046 -9.035 1.00 0.00 H new ATOM 0 HA ASN A 119 -15.377 -3.436 -7.439 1.00 0.00 H new ATOM 0 HB2 ASN A 119 -14.026 -4.178 -9.558 1.00 0.00 H new ATOM 0 HB3 ASN A 119 -15.731 -4.564 -9.441 1.00 0.00 H new ATOM 0 HD21 ASN A 119 -16.442 -3.061 -12.512 1.00 0.00 H new ATOM 0 HD22 ASN A 119 -16.732 -4.348 -11.337 1.00 0.00 H new ATOM 1869 N LEU A 120 -12.998 -2.686 -7.199 1.00 0.00 N ATOM 1870 CA LEU A 120 -11.700 -2.105 -6.873 1.00 0.00 C ATOM 1871 C LEU A 120 -10.579 -3.115 -7.120 1.00 0.00 C ATOM 1872 O LEU A 120 -10.393 -4.048 -6.339 1.00 0.00 O ATOM 1873 CB LEU A 120 -11.676 -1.652 -5.411 1.00 0.00 C ATOM 1874 CG LEU A 120 -12.976 -1.023 -4.901 1.00 0.00 C ATOM 1875 CD1 LEU A 120 -12.740 -0.322 -3.573 1.00 0.00 C ATOM 1876 CD2 LEU A 120 -13.540 -0.051 -5.927 1.00 0.00 C ATOM 0 H LEU A 120 -13.204 -3.557 -6.710 1.00 0.00 H new ATOM 0 HA LEU A 120 -11.541 -1.241 -7.518 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -11.437 -2.512 -4.785 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -10.868 -0.931 -5.284 1.00 0.00 H new ATOM 0 HG LEU A 120 -13.706 -1.818 -4.747 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -13.673 0.120 -3.224 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -12.383 -1.044 -2.839 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -11.994 0.462 -3.703 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -14.463 0.385 -5.546 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -12.815 0.741 -6.115 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -13.746 -0.582 -6.856 1.00 0.00 H new ATOM 1888 N PRO A 121 -9.815 -2.946 -8.214 1.00 0.00 N ATOM 1889 CA PRO A 121 -8.713 -3.854 -8.554 1.00 0.00 C ATOM 1890 C PRO A 121 -7.681 -3.961 -7.437 1.00 0.00 C ATOM 1891 O PRO A 121 -7.322 -2.963 -6.812 1.00 0.00 O ATOM 1892 CB PRO A 121 -8.086 -3.217 -9.799 1.00 0.00 C ATOM 1893 CG PRO A 121 -9.159 -2.360 -10.374 1.00 0.00 C ATOM 1894 CD PRO A 121 -9.963 -1.865 -9.206 1.00 0.00 C ATOM 0 HA PRO A 121 -9.067 -4.872 -8.715 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -7.206 -2.628 -9.540 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -7.763 -3.976 -10.511 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -8.735 -1.528 -10.936 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -9.783 -2.927 -11.065 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -9.582 -0.916 -8.828 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -11.007 -1.705 -9.475 1.00 0.00 H new ATOM 1902 N ILE A 122 -7.207 -5.179 -7.192 1.00 0.00 N ATOM 1903 CA ILE A 122 -6.214 -5.419 -6.153 1.00 0.00 C ATOM 1904 C ILE A 122 -4.891 -5.875 -6.758 1.00 0.00 C ATOM 1905 O ILE A 122 -4.758 -7.018 -7.192 1.00 0.00 O ATOM 1906 CB ILE A 122 -6.695 -6.480 -5.146 1.00 0.00 C ATOM 1907 CG1 ILE A 122 -8.161 -6.239 -4.780 1.00 0.00 C ATOM 1908 CG2 ILE A 122 -5.824 -6.463 -3.900 1.00 0.00 C ATOM 1909 CD1 ILE A 122 -8.403 -4.910 -4.100 1.00 0.00 C ATOM 0 H ILE A 122 -7.496 -6.015 -7.700 1.00 0.00 H new ATOM 0 HA ILE A 122 -6.069 -4.474 -5.630 1.00 0.00 H new ATOM 0 HB ILE A 122 -6.612 -7.463 -5.610 1.00 0.00 H new ATOM 0 HG12 ILE A 122 -8.766 -6.290 -5.685 1.00 0.00 H new ATOM 0 HG13 ILE A 122 -8.500 -7.041 -4.124 1.00 0.00 H new ATOM 0 HG21 ILE A 122 -6.178 -7.219 -3.199 1.00 0.00 H new ATOM 0 HG22 ILE A 122 -4.791 -6.678 -4.175 1.00 0.00 H new ATOM 0 HG23 ILE A 122 -5.878 -5.480 -3.432 1.00 0.00 H new ATOM 0 HD11 ILE A 122 -9.463 -4.807 -3.870 1.00 0.00 H new ATOM 0 HD12 ILE A 122 -7.825 -4.863 -3.177 1.00 0.00 H new ATOM 0 HD13 ILE A 122 -8.095 -4.101 -4.763 1.00 0.00 H new ATOM 1921 N GLU A 123 -3.916 -4.972 -6.785 1.00 0.00 N ATOM 1922 CA GLU A 123 -2.603 -5.284 -7.339 1.00 0.00 C ATOM 1923 C GLU A 123 -1.623 -5.670 -6.237 1.00 0.00 C ATOM 1924 O GLU A 123 -1.322 -4.869 -5.352 1.00 0.00 O ATOM 1925 CB GLU A 123 -2.061 -4.089 -8.123 1.00 0.00 C ATOM 1926 CG GLU A 123 -2.808 -3.820 -9.419 1.00 0.00 C ATOM 1927 CD GLU A 123 -1.877 -3.500 -10.573 1.00 0.00 C ATOM 1928 OE1 GLU A 123 -1.395 -4.449 -11.228 1.00 0.00 O ATOM 1929 OE2 GLU A 123 -1.630 -2.302 -10.821 1.00 0.00 O ATOM 0 H GLU A 123 -4.010 -4.020 -6.431 1.00 0.00 H new ATOM 0 HA GLU A 123 -2.714 -6.133 -8.013 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -2.111 -3.200 -7.494 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -1.009 -4.261 -8.349 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -3.411 -4.692 -9.674 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -3.497 -2.988 -9.271 1.00 0.00 H new ATOM 1936 N TYR A 124 -1.128 -6.901 -6.296 1.00 0.00 N ATOM 1937 CA TYR A 124 -0.179 -7.392 -5.304 1.00 0.00 C ATOM 1938 C TYR A 124 1.235 -6.927 -5.632 1.00 0.00 C ATOM 1939 O TYR A 124 1.911 -7.509 -6.480 1.00 0.00 O ATOM 1940 CB TYR A 124 -0.225 -8.920 -5.238 1.00 0.00 C ATOM 1941 CG TYR A 124 -1.474 -9.460 -4.578 1.00 0.00 C ATOM 1942 CD1 TYR A 124 -2.727 -9.239 -5.135 1.00 0.00 C ATOM 1943 CD2 TYR A 124 -1.400 -10.191 -3.399 1.00 0.00 C ATOM 1944 CE1 TYR A 124 -3.871 -9.731 -4.535 1.00 0.00 C ATOM 1945 CE2 TYR A 124 -2.538 -10.686 -2.794 1.00 0.00 C ATOM 1946 CZ TYR A 124 -3.771 -10.453 -3.365 1.00 0.00 C ATOM 1947 OH TYR A 124 -4.907 -10.944 -2.765 1.00 0.00 O ATOM 0 H TYR A 124 -1.368 -7.577 -7.021 1.00 0.00 H new ATOM 0 HA TYR A 124 -0.460 -6.985 -4.333 1.00 0.00 H new ATOM 0 HB2 TYR A 124 -0.156 -9.321 -6.249 1.00 0.00 H new ATOM 0 HB3 TYR A 124 0.648 -9.278 -4.693 1.00 0.00 H new ATOM 0 HD1 TYR A 124 -2.809 -8.674 -6.052 1.00 0.00 H new ATOM 0 HD2 TYR A 124 -0.436 -10.375 -2.948 1.00 0.00 H new ATOM 0 HE1 TYR A 124 -4.838 -9.551 -4.981 1.00 0.00 H new ATOM 0 HE2 TYR A 124 -2.463 -11.253 -1.878 1.00 0.00 H new ATOM 0 HH TYR A 124 -5.499 -11.325 -3.447 1.00 0.00 H new ATOM 1957 N ASN A 125 1.675 -5.870 -4.957 1.00 0.00 N ATOM 1958 CA ASN A 125 3.007 -5.320 -5.178 1.00 0.00 C ATOM 1959 C ASN A 125 4.078 -6.219 -4.568 1.00 0.00 C ATOM 1960 O ASN A 125 4.536 -5.984 -3.451 1.00 0.00 O ATOM 1961 CB ASN A 125 3.106 -3.915 -4.584 1.00 0.00 C ATOM 1962 CG ASN A 125 3.318 -2.852 -5.645 1.00 0.00 C ATOM 1963 OD1 ASN A 125 3.191 -3.117 -6.840 1.00 0.00 O ATOM 1964 ND2 ASN A 125 3.641 -1.639 -5.211 1.00 0.00 N ATOM 0 H ASN A 125 1.128 -5.377 -4.252 1.00 0.00 H new ATOM 0 HA ASN A 125 3.175 -5.266 -6.254 1.00 0.00 H new ATOM 0 HB2 ASN A 125 2.195 -3.693 -4.029 1.00 0.00 H new ATOM 0 HB3 ASN A 125 3.930 -3.882 -3.871 1.00 0.00 H new ATOM 0 HD21 ASN A 125 3.794 -0.883 -5.878 1.00 0.00 H new ATOM 0 HD22 ASN A 125 3.736 -1.464 -4.211 1.00 0.00 H new ATOM 1971 N LEU A 126 4.476 -7.247 -5.309 1.00 0.00 N ATOM 1972 CA LEU A 126 5.495 -8.178 -4.839 1.00 0.00 C ATOM 1973 C LEU A 126 6.851 -7.489 -4.728 1.00 0.00 C ATOM 1974 O LEU A 126 7.099 -6.836 -3.693 1.00 0.00 O ATOM 1975 CB LEU A 126 5.595 -9.378 -5.782 1.00 0.00 C ATOM 1976 CG LEU A 126 4.477 -10.411 -5.637 1.00 0.00 C ATOM 1977 CD1 LEU A 126 4.688 -11.568 -6.602 1.00 0.00 C ATOM 1978 CD2 LEU A 126 4.404 -10.917 -4.204 1.00 0.00 C ATOM 1979 OXT LEU A 126 7.653 -7.609 -5.678 1.00 0.00 O ATOM 0 H LEU A 126 4.109 -7.457 -6.237 1.00 0.00 H new ATOM 0 HA LEU A 126 5.203 -8.528 -3.849 1.00 0.00 H new ATOM 0 HB2 LEU A 126 5.601 -9.014 -6.809 1.00 0.00 H new ATOM 0 HB3 LEU A 126 6.551 -9.874 -5.614 1.00 0.00 H new ATOM 0 HG LEU A 126 3.530 -9.930 -5.882 1.00 0.00 H new ATOM 0 HD11 LEU A 126 3.882 -12.292 -6.483 1.00 0.00 H new ATOM 0 HD12 LEU A 126 4.691 -11.192 -7.625 1.00 0.00 H new ATOM 0 HD13 LEU A 126 5.643 -12.049 -6.390 1.00 0.00 H new ATOM 0 HD21 LEU A 126 3.603 -11.651 -4.118 1.00 0.00 H new ATOM 0 HD22 LEU A 126 5.352 -11.381 -3.933 1.00 0.00 H new ATOM 0 HD23 LEU A 126 4.204 -10.082 -3.533 1.00 0.00 H new TER 1991 LEU A 126 ATOM 1992 N ALA B 1 44.099 -9.088 -12.127 1.00 0.00 N ATOM 1993 CA ALA B 1 43.414 -10.373 -12.415 1.00 0.00 C ATOM 1994 C ALA B 1 42.316 -10.647 -11.393 1.00 0.00 C ATOM 1995 O ALA B 1 42.392 -10.197 -10.250 1.00 0.00 O ATOM 1996 CB ALA B 1 44.420 -11.515 -12.429 1.00 0.00 C ATOM 0 H1 ALA B 1 45.128 -9.221 -12.191 1.00 0.00 H new ATOM 0 H2 ALA B 1 43.799 -8.372 -12.819 1.00 0.00 H new ATOM 0 H3 ALA B 1 43.850 -8.769 -11.169 1.00 0.00 H new ATOM 0 HA ALA B 1 42.951 -10.299 -13.399 1.00 0.00 H new ATOM 0 HB1 ALA B 1 43.904 -12.452 -12.641 1.00 0.00 H new ATOM 0 HB2 ALA B 1 45.169 -11.331 -13.199 1.00 0.00 H new ATOM 0 HB3 ALA B 1 44.908 -11.582 -11.457 1.00 0.00 H new ATOM 2004 N GLN B 2 41.295 -11.389 -11.813 1.00 0.00 N ATOM 2005 CA GLN B 2 40.181 -11.722 -10.933 1.00 0.00 C ATOM 2006 C GLN B 2 39.444 -10.462 -10.488 1.00 0.00 C ATOM 2007 O GLN B 2 40.063 -9.441 -10.191 1.00 0.00 O ATOM 2008 CB GLN B 2 40.681 -12.493 -9.710 1.00 0.00 C ATOM 2009 CG GLN B 2 40.404 -13.986 -9.777 1.00 0.00 C ATOM 2010 CD GLN B 2 39.186 -14.390 -8.968 1.00 0.00 C ATOM 2011 OE1 GLN B 2 38.150 -13.728 -9.013 1.00 0.00 O ATOM 2012 NE2 GLN B 2 39.307 -15.483 -8.224 1.00 0.00 N ATOM 0 H GLN B 2 41.217 -11.770 -12.756 1.00 0.00 H new ATOM 0 HA GLN B 2 39.486 -12.351 -11.490 1.00 0.00 H new ATOM 0 HB2 GLN B 2 41.754 -12.335 -9.605 1.00 0.00 H new ATOM 0 HB3 GLN B 2 40.210 -12.084 -8.816 1.00 0.00 H new ATOM 0 HG2 GLN B 2 40.258 -14.278 -10.817 1.00 0.00 H new ATOM 0 HG3 GLN B 2 41.275 -14.530 -9.412 1.00 0.00 H new ATOM 0 HE21 GLN B 2 40.186 -16.001 -8.218 1.00 0.00 H new ATOM 0 HE22 GLN B 2 38.521 -15.805 -7.659 1.00 0.00 H new ATOM 2021 N SER B 3 38.118 -10.543 -10.444 1.00 0.00 N ATOM 2022 CA SER B 3 37.297 -9.408 -10.036 1.00 0.00 C ATOM 2023 C SER B 3 36.201 -9.847 -9.070 1.00 0.00 C ATOM 2024 O SER B 3 35.961 -11.041 -8.889 1.00 0.00 O ATOM 2025 CB SER B 3 36.675 -8.736 -11.261 1.00 0.00 C ATOM 2026 OG SER B 3 36.499 -9.663 -12.318 1.00 0.00 O ATOM 0 H SER B 3 37.589 -11.381 -10.685 1.00 0.00 H new ATOM 0 HA SER B 3 37.940 -8.692 -9.524 1.00 0.00 H new ATOM 0 HB2 SER B 3 35.713 -8.301 -10.991 1.00 0.00 H new ATOM 0 HB3 SER B 3 37.313 -7.917 -11.594 1.00 0.00 H new ATOM 0 HG SER B 3 36.098 -9.209 -13.088 1.00 0.00 H new ATOM 2032 N VAL B 4 35.539 -8.874 -8.453 1.00 0.00 N ATOM 2033 CA VAL B 4 34.467 -9.160 -7.507 1.00 0.00 C ATOM 2034 C VAL B 4 33.378 -8.090 -7.569 1.00 0.00 C ATOM 2035 O VAL B 4 33.547 -6.992 -7.042 1.00 0.00 O ATOM 2036 CB VAL B 4 35.000 -9.246 -6.064 1.00 0.00 C ATOM 2037 CG1 VAL B 4 35.972 -10.405 -5.921 1.00 0.00 C ATOM 2038 CG2 VAL B 4 35.655 -7.934 -5.657 1.00 0.00 C ATOM 0 H VAL B 4 35.726 -7.881 -8.591 1.00 0.00 H new ATOM 0 HA VAL B 4 34.044 -10.124 -7.790 1.00 0.00 H new ATOM 0 HB VAL B 4 34.158 -9.426 -5.396 1.00 0.00 H new ATOM 0 HG11 VAL B 4 36.337 -10.449 -4.895 1.00 0.00 H new ATOM 0 HG12 VAL B 4 35.464 -11.338 -6.166 1.00 0.00 H new ATOM 0 HG13 VAL B 4 36.813 -10.261 -6.600 1.00 0.00 H new ATOM 0 HG21 VAL B 4 36.025 -8.014 -4.635 1.00 0.00 H new ATOM 0 HG22 VAL B 4 36.486 -7.719 -6.328 1.00 0.00 H new ATOM 0 HG23 VAL B 4 34.923 -7.128 -5.716 1.00 0.00 H new ATOM 2048 N PRO B 5 32.241 -8.397 -8.219 1.00 0.00 N ATOM 2049 CA PRO B 5 31.127 -7.454 -8.347 1.00 0.00 C ATOM 2050 C PRO B 5 30.306 -7.347 -7.065 1.00 0.00 C ATOM 2051 O PRO B 5 30.352 -8.234 -6.212 1.00 0.00 O ATOM 2052 CB PRO B 5 30.289 -8.064 -9.469 1.00 0.00 C ATOM 2053 CG PRO B 5 30.532 -9.529 -9.361 1.00 0.00 C ATOM 2054 CD PRO B 5 31.952 -9.684 -8.881 1.00 0.00 C ATOM 0 HA PRO B 5 31.468 -6.438 -8.548 1.00 0.00 H new ATOM 0 HB2 PRO B 5 29.232 -7.827 -9.349 1.00 0.00 H new ATOM 0 HB3 PRO B 5 30.592 -7.682 -10.444 1.00 0.00 H new ATOM 0 HG2 PRO B 5 29.833 -9.989 -8.663 1.00 0.00 H new ATOM 0 HG3 PRO B 5 30.391 -10.019 -10.324 1.00 0.00 H new ATOM 0 HD2 PRO B 5 32.052 -10.521 -8.190 1.00 0.00 H new ATOM 0 HD3 PRO B 5 32.636 -9.871 -9.709 1.00 0.00 H new ATOM 2062 N PRO B 6 29.536 -6.255 -6.914 1.00 0.00 N ATOM 2063 CA PRO B 6 28.700 -6.038 -5.731 1.00 0.00 C ATOM 2064 C PRO B 6 27.465 -6.932 -5.725 1.00 0.00 C ATOM 2065 O PRO B 6 26.553 -6.752 -6.531 1.00 0.00 O ATOM 2066 CB PRO B 6 28.296 -4.569 -5.852 1.00 0.00 C ATOM 2067 CG PRO B 6 28.319 -4.293 -7.315 1.00 0.00 C ATOM 2068 CD PRO B 6 29.419 -5.149 -7.885 1.00 0.00 C ATOM 0 HA PRO B 6 29.227 -6.275 -4.807 1.00 0.00 H new ATOM 0 HB2 PRO B 6 27.306 -4.394 -5.431 1.00 0.00 H new ATOM 0 HB3 PRO B 6 28.989 -3.922 -5.315 1.00 0.00 H new ATOM 0 HG2 PRO B 6 27.360 -4.536 -7.772 1.00 0.00 H new ATOM 0 HG3 PRO B 6 28.507 -3.237 -7.509 1.00 0.00 H new ATOM 0 HD2 PRO B 6 29.168 -5.514 -8.881 1.00 0.00 H new ATOM 0 HD3 PRO B 6 30.353 -4.594 -7.975 1.00 0.00 H new ATOM 2076 N GLY B 7 27.443 -7.899 -4.812 1.00 0.00 N ATOM 2077 CA GLY B 7 26.314 -8.806 -4.722 1.00 0.00 C ATOM 2078 C GLY B 7 24.984 -8.078 -4.682 1.00 0.00 C ATOM 2079 O GLY B 7 24.818 -7.116 -3.933 1.00 0.00 O ATOM 0 H GLY B 7 28.186 -8.070 -4.134 1.00 0.00 H new ATOM 0 HA2 GLY B 7 26.328 -9.484 -5.576 1.00 0.00 H new ATOM 0 HA3 GLY B 7 26.416 -9.419 -3.827 1.00 0.00 H new ATOM 2083 N ASP B 8 24.036 -8.538 -5.493 1.00 0.00 N ATOM 2084 CA ASP B 8 22.714 -7.924 -5.547 1.00 0.00 C ATOM 2085 C ASP B 8 22.073 -7.890 -4.165 1.00 0.00 C ATOM 2086 O ASP B 8 22.194 -8.839 -3.391 1.00 0.00 O ATOM 2087 CB ASP B 8 21.814 -8.687 -6.522 1.00 0.00 C ATOM 2088 CG ASP B 8 22.459 -8.869 -7.883 1.00 0.00 C ATOM 2089 OD1 ASP B 8 22.869 -7.856 -8.486 1.00 0.00 O ATOM 2090 OD2 ASP B 8 22.553 -10.026 -8.345 1.00 0.00 O ATOM 0 H ASP B 8 24.159 -9.333 -6.121 1.00 0.00 H new ATOM 0 HA ASP B 8 22.831 -6.899 -5.898 1.00 0.00 H new ATOM 0 HB2 ASP B 8 21.575 -9.664 -6.103 1.00 0.00 H new ATOM 0 HB3 ASP B 8 20.872 -8.151 -6.638 1.00 0.00 H new ATOM 2095 N ILE B 9 21.393 -6.790 -3.859 1.00 0.00 N ATOM 2096 CA ILE B 9 20.734 -6.633 -2.567 1.00 0.00 C ATOM 2097 C ILE B 9 19.231 -6.856 -2.684 1.00 0.00 C ATOM 2098 O ILE B 9 18.621 -6.524 -3.701 1.00 0.00 O ATOM 2099 CB ILE B 9 20.990 -5.234 -1.972 1.00 0.00 C ATOM 2100 CG1 ILE B 9 20.377 -4.149 -2.863 1.00 0.00 C ATOM 2101 CG2 ILE B 9 22.482 -4.999 -1.796 1.00 0.00 C ATOM 2102 CD1 ILE B 9 20.011 -2.887 -2.113 1.00 0.00 C ATOM 0 H ILE B 9 21.284 -5.994 -4.488 1.00 0.00 H new ATOM 0 HA ILE B 9 21.158 -7.386 -1.903 1.00 0.00 H new ATOM 0 HB ILE B 9 20.513 -5.183 -0.993 1.00 0.00 H new ATOM 0 HG12 ILE B 9 21.083 -3.899 -3.655 1.00 0.00 H new ATOM 0 HG13 ILE B 9 19.484 -4.547 -3.345 1.00 0.00 H new ATOM 0 HG21 ILE B 9 22.647 -4.007 -1.375 1.00 0.00 H new ATOM 0 HG22 ILE B 9 22.892 -5.752 -1.123 1.00 0.00 H new ATOM 0 HG23 ILE B 9 22.978 -5.069 -2.764 1.00 0.00 H new ATOM 0 HD11 ILE B 9 19.583 -2.163 -2.806 1.00 0.00 H new ATOM 0 HD12 ILE B 9 19.282 -3.123 -1.338 1.00 0.00 H new ATOM 0 HD13 ILE B 9 20.905 -2.465 -1.654 1.00 0.00 H new ATOM 2114 N ASN B 10 18.636 -7.414 -1.634 1.00 0.00 N ATOM 2115 CA ASN B 10 17.202 -7.675 -1.620 1.00 0.00 C ATOM 2116 C ASN B 10 16.449 -6.499 -1.006 1.00 0.00 C ATOM 2117 O ASN B 10 16.925 -5.871 -0.060 1.00 0.00 O ATOM 2118 CB ASN B 10 16.901 -8.955 -0.841 1.00 0.00 C ATOM 2119 CG ASN B 10 16.480 -10.096 -1.747 1.00 0.00 C ATOM 2120 OD1 ASN B 10 15.432 -10.038 -2.389 1.00 0.00 O ATOM 2121 ND2 ASN B 10 17.299 -11.139 -1.803 1.00 0.00 N ATOM 0 H ASN B 10 19.125 -7.693 -0.783 1.00 0.00 H new ATOM 0 HA ASN B 10 16.868 -7.803 -2.649 1.00 0.00 H new ATOM 0 HB2 ASN B 10 17.785 -9.250 -0.276 1.00 0.00 H new ATOM 0 HB3 ASN B 10 16.111 -8.759 -0.116 1.00 0.00 H new ATOM 0 HD21 ASN B 10 17.070 -11.936 -2.396 1.00 0.00 H new ATOM 0 HD22 ASN B 10 18.158 -11.143 -1.253 1.00 0.00 H new ATOM 2128 N THR B 11 15.275 -6.202 -1.551 1.00 0.00 N ATOM 2129 CA THR B 11 14.463 -5.095 -1.056 1.00 0.00 C ATOM 2130 C THR B 11 13.004 -5.511 -0.895 1.00 0.00 C ATOM 2131 O THR B 11 12.514 -6.389 -1.606 1.00 0.00 O ATOM 2132 CB THR B 11 14.563 -3.900 -2.006 1.00 0.00 C ATOM 2133 OG1 THR B 11 14.870 -4.329 -3.321 1.00 0.00 O ATOM 2134 CG2 THR B 11 15.615 -2.894 -1.593 1.00 0.00 C ATOM 0 H THR B 11 14.864 -6.710 -2.334 1.00 0.00 H new ATOM 0 HA THR B 11 14.846 -4.808 -0.077 1.00 0.00 H new ATOM 0 HB THR B 11 13.587 -3.417 -1.967 1.00 0.00 H new ATOM 0 HG1 THR B 11 14.097 -4.177 -3.904 1.00 0.00 H new ATOM 0 HG21 THR B 11 15.634 -2.072 -2.309 1.00 0.00 H new ATOM 0 HG22 THR B 11 15.379 -2.506 -0.602 1.00 0.00 H new ATOM 0 HG23 THR B 11 16.592 -3.377 -1.570 1.00 0.00 H new ATOM 2142 N GLN B 12 12.316 -4.869 0.043 1.00 0.00 N ATOM 2143 CA GLN B 12 10.913 -5.162 0.305 1.00 0.00 C ATOM 2144 C GLN B 12 10.114 -3.865 0.466 1.00 0.00 C ATOM 2145 O GLN B 12 10.303 -3.140 1.443 1.00 0.00 O ATOM 2146 CB GLN B 12 10.779 -6.010 1.571 1.00 0.00 C ATOM 2147 CG GLN B 12 10.761 -7.506 1.302 1.00 0.00 C ATOM 2148 CD GLN B 12 11.308 -8.314 2.462 1.00 0.00 C ATOM 2149 OE1 GLN B 12 11.578 -7.776 3.535 1.00 0.00 O ATOM 2150 NE2 GLN B 12 11.475 -9.615 2.251 1.00 0.00 N ATOM 0 H GLN B 12 12.710 -4.139 0.637 1.00 0.00 H new ATOM 0 HA GLN B 12 10.514 -5.718 -0.544 1.00 0.00 H new ATOM 0 HB2 GLN B 12 11.607 -5.780 2.242 1.00 0.00 H new ATOM 0 HB3 GLN B 12 9.862 -5.731 2.090 1.00 0.00 H new ATOM 0 HG2 GLN B 12 9.739 -7.822 1.094 1.00 0.00 H new ATOM 0 HG3 GLN B 12 11.348 -7.718 0.408 1.00 0.00 H new ATOM 0 HE21 GLN B 12 11.238 -10.019 1.345 1.00 0.00 H new ATOM 0 HE22 GLN B 12 11.840 -10.210 2.995 1.00 0.00 H new ATOM 2159 N PRO B 13 9.212 -3.539 -0.484 1.00 0.00 N ATOM 2160 CA PRO B 13 8.938 -4.361 -1.675 1.00 0.00 C ATOM 2161 C PRO B 13 10.152 -4.493 -2.588 1.00 0.00 C ATOM 2162 O PRO B 13 11.124 -3.748 -2.464 1.00 0.00 O ATOM 2163 CB PRO B 13 7.815 -3.604 -2.391 1.00 0.00 C ATOM 2164 CG PRO B 13 7.905 -2.209 -1.878 1.00 0.00 C ATOM 2165 CD PRO B 13 8.378 -2.327 -0.459 1.00 0.00 C ATOM 0 HA PRO B 13 8.674 -5.383 -1.402 1.00 0.00 H new ATOM 0 HB2 PRO B 13 7.944 -3.636 -3.473 1.00 0.00 H new ATOM 0 HB3 PRO B 13 6.841 -4.043 -2.173 1.00 0.00 H new ATOM 0 HG2 PRO B 13 8.599 -1.617 -2.474 1.00 0.00 H new ATOM 0 HG3 PRO B 13 6.937 -1.711 -1.928 1.00 0.00 H new ATOM 0 HD2 PRO B 13 8.949 -1.451 -0.150 1.00 0.00 H new ATOM 0 HD3 PRO B 13 7.545 -2.426 0.237 1.00 0.00 H new ATOM 2173 N SER B 14 10.083 -5.455 -3.503 1.00 0.00 N ATOM 2174 CA SER B 14 11.171 -5.708 -4.445 1.00 0.00 C ATOM 2175 C SER B 14 11.698 -4.410 -5.052 1.00 0.00 C ATOM 2176 O SER B 14 12.816 -3.986 -4.757 1.00 0.00 O ATOM 2177 CB SER B 14 10.698 -6.647 -5.557 1.00 0.00 C ATOM 2178 OG SER B 14 11.755 -6.955 -6.449 1.00 0.00 O ATOM 0 H SER B 14 9.281 -6.076 -3.613 1.00 0.00 H new ATOM 0 HA SER B 14 11.985 -6.179 -3.894 1.00 0.00 H new ATOM 0 HB2 SER B 14 10.308 -7.566 -5.120 1.00 0.00 H new ATOM 0 HB3 SER B 14 9.879 -6.182 -6.106 1.00 0.00 H new ATOM 0 HG SER B 14 11.427 -7.557 -7.149 1.00 0.00 H new ATOM 2184 N GLN B 15 10.892 -3.786 -5.906 1.00 0.00 N ATOM 2185 CA GLN B 15 11.290 -2.540 -6.555 1.00 0.00 C ATOM 2186 C GLN B 15 10.070 -1.719 -6.959 1.00 0.00 C ATOM 2187 O GLN B 15 10.049 -1.108 -8.027 1.00 0.00 O ATOM 2188 CB GLN B 15 12.153 -2.821 -7.792 1.00 0.00 C ATOM 2189 CG GLN B 15 12.909 -4.141 -7.740 1.00 0.00 C ATOM 2190 CD GLN B 15 13.429 -4.566 -9.100 1.00 0.00 C ATOM 2191 OE1 GLN B 15 13.872 -3.737 -9.895 1.00 0.00 O ATOM 2192 NE2 GLN B 15 13.377 -5.865 -9.373 1.00 0.00 N ATOM 0 H GLN B 15 9.964 -4.120 -6.164 1.00 0.00 H new ATOM 0 HA GLN B 15 11.876 -1.968 -5.835 1.00 0.00 H new ATOM 0 HB2 GLN B 15 11.514 -2.816 -8.675 1.00 0.00 H new ATOM 0 HB3 GLN B 15 12.870 -2.009 -7.913 1.00 0.00 H new ATOM 0 HG2 GLN B 15 13.745 -4.050 -7.047 1.00 0.00 H new ATOM 0 HG3 GLN B 15 12.252 -4.917 -7.347 1.00 0.00 H new ATOM 0 HE21 GLN B 15 13.002 -6.516 -8.684 1.00 0.00 H new ATOM 0 HE22 GLN B 15 13.713 -6.211 -10.272 1.00 0.00 H new ATOM 2201 N LYS B 16 9.054 -1.707 -6.102 1.00 0.00 N ATOM 2202 CA LYS B 16 7.835 -0.957 -6.382 1.00 0.00 C ATOM 2203 C LYS B 16 6.988 -0.788 -5.124 1.00 0.00 C ATOM 2204 O LYS B 16 6.828 -1.723 -4.339 1.00 0.00 O ATOM 2205 CB LYS B 16 7.019 -1.657 -7.470 1.00 0.00 C ATOM 2206 CG LYS B 16 6.882 -3.155 -7.258 1.00 0.00 C ATOM 2207 CD LYS B 16 7.268 -3.932 -8.507 1.00 0.00 C ATOM 2208 CE LYS B 16 6.318 -3.644 -9.657 1.00 0.00 C ATOM 2209 NZ LYS B 16 7.027 -3.077 -10.835 1.00 0.00 N ATOM 0 H LYS B 16 9.050 -2.206 -5.212 1.00 0.00 H new ATOM 0 HA LYS B 16 8.126 0.033 -6.733 1.00 0.00 H new ATOM 0 HB2 LYS B 16 6.025 -1.212 -7.510 1.00 0.00 H new ATOM 0 HB3 LYS B 16 7.488 -1.477 -8.437 1.00 0.00 H new ATOM 0 HG2 LYS B 16 7.514 -3.465 -6.426 1.00 0.00 H new ATOM 0 HG3 LYS B 16 5.854 -3.392 -6.984 1.00 0.00 H new ATOM 0 HD2 LYS B 16 8.285 -3.671 -8.800 1.00 0.00 H new ATOM 0 HD3 LYS B 16 7.263 -5.000 -8.289 1.00 0.00 H new ATOM 0 HE2 LYS B 16 5.810 -4.564 -9.947 1.00 0.00 H new ATOM 0 HE3 LYS B 16 5.549 -2.946 -9.326 1.00 0.00 H new ATOM 0 HZ1 LYS B 16 6.343 -2.895 -11.597 1.00 0.00 H new ATOM 0 HZ2 LYS B 16 7.490 -2.186 -10.565 1.00 0.00 H new ATOM 0 HZ3 LYS B 16 7.744 -3.753 -11.167 1.00 0.00 H new ATOM 2223 N ILE B 17 6.444 0.412 -4.944 1.00 0.00 N ATOM 2224 CA ILE B 17 5.608 0.711 -3.787 1.00 0.00 C ATOM 2225 C ILE B 17 4.538 1.737 -4.145 1.00 0.00 C ATOM 2226 O ILE B 17 4.808 2.706 -4.856 1.00 0.00 O ATOM 2227 CB ILE B 17 6.443 1.243 -2.607 1.00 0.00 C ATOM 2228 CG1 ILE B 17 5.544 1.523 -1.403 1.00 0.00 C ATOM 2229 CG2 ILE B 17 7.198 2.497 -3.015 1.00 0.00 C ATOM 2230 CD1 ILE B 17 6.291 1.560 -0.088 1.00 0.00 C ATOM 0 H ILE B 17 6.568 1.194 -5.587 1.00 0.00 H new ATOM 0 HA ILE B 17 5.133 -0.223 -3.486 1.00 0.00 H new ATOM 0 HB ILE B 17 7.170 0.482 -2.324 1.00 0.00 H new ATOM 0 HG12 ILE B 17 5.038 2.477 -1.551 1.00 0.00 H new ATOM 0 HG13 ILE B 17 4.771 0.757 -1.351 1.00 0.00 H new ATOM 0 HG21 ILE B 17 7.783 2.860 -2.170 1.00 0.00 H new ATOM 0 HG22 ILE B 17 7.865 2.266 -3.846 1.00 0.00 H new ATOM 0 HG23 ILE B 17 6.488 3.265 -3.322 1.00 0.00 H new ATOM 0 HD11 ILE B 17 5.591 1.763 0.722 1.00 0.00 H new ATOM 0 HD12 ILE B 17 6.775 0.598 0.083 1.00 0.00 H new ATOM 0 HD13 ILE B 17 7.046 2.345 -0.121 1.00 0.00 H new ATOM 2242 N VAL B 18 3.323 1.516 -3.656 1.00 0.00 N ATOM 2243 CA VAL B 18 2.214 2.421 -3.933 1.00 0.00 C ATOM 2244 C VAL B 18 1.658 3.033 -2.652 1.00 0.00 C ATOM 2245 O VAL B 18 1.125 2.327 -1.795 1.00 0.00 O ATOM 2246 CB VAL B 18 1.075 1.695 -4.676 1.00 0.00 C ATOM 2247 CG1 VAL B 18 -0.046 2.665 -5.022 1.00 0.00 C ATOM 2248 CG2 VAL B 18 1.604 1.013 -5.929 1.00 0.00 C ATOM 0 H VAL B 18 3.081 0.719 -3.067 1.00 0.00 H new ATOM 0 HA VAL B 18 2.609 3.217 -4.565 1.00 0.00 H new ATOM 0 HB VAL B 18 0.669 0.929 -4.016 1.00 0.00 H new ATOM 0 HG11 VAL B 18 -0.840 2.132 -5.546 1.00 0.00 H new ATOM 0 HG12 VAL B 18 -0.445 3.101 -4.106 1.00 0.00 H new ATOM 0 HG13 VAL B 18 0.343 3.457 -5.662 1.00 0.00 H new ATOM 0 HG21 VAL B 18 0.786 0.506 -6.440 1.00 0.00 H new ATOM 0 HG22 VAL B 18 2.040 1.759 -6.593 1.00 0.00 H new ATOM 0 HG23 VAL B 18 2.366 0.284 -5.652 1.00 0.00 H new ATOM 2258 N PHE B 19 1.775 4.352 -2.532 1.00 0.00 N ATOM 2259 CA PHE B 19 1.273 5.060 -1.360 1.00 0.00 C ATOM 2260 C PHE B 19 -0.249 5.130 -1.396 1.00 0.00 C ATOM 2261 O PHE B 19 -0.826 6.007 -2.040 1.00 0.00 O ATOM 2262 CB PHE B 19 1.862 6.470 -1.298 1.00 0.00 C ATOM 2263 CG PHE B 19 3.237 6.521 -0.694 1.00 0.00 C ATOM 2264 CD1 PHE B 19 4.167 5.532 -0.973 1.00 0.00 C ATOM 2265 CD2 PHE B 19 3.598 7.557 0.152 1.00 0.00 C ATOM 2266 CE1 PHE B 19 5.433 5.577 -0.419 1.00 0.00 C ATOM 2267 CE2 PHE B 19 4.862 7.607 0.709 1.00 0.00 C ATOM 2268 CZ PHE B 19 5.781 6.614 0.423 1.00 0.00 C ATOM 0 H PHE B 19 2.213 4.951 -3.232 1.00 0.00 H new ATOM 0 HA PHE B 19 1.578 4.513 -0.468 1.00 0.00 H new ATOM 0 HB2 PHE B 19 1.901 6.883 -2.306 1.00 0.00 H new ATOM 0 HB3 PHE B 19 1.195 7.108 -0.718 1.00 0.00 H new ATOM 0 HD1 PHE B 19 3.900 4.718 -1.630 1.00 0.00 H new ATOM 0 HD2 PHE B 19 2.884 8.334 0.379 1.00 0.00 H new ATOM 0 HE1 PHE B 19 6.149 4.801 -0.645 1.00 0.00 H new ATOM 0 HE2 PHE B 19 5.132 8.420 1.367 1.00 0.00 H new ATOM 0 HZ PHE B 19 6.769 6.650 0.858 1.00 0.00 H new ATOM 2278 N ASN B 20 -0.895 4.195 -0.710 1.00 0.00 N ATOM 2279 CA ASN B 20 -2.351 4.140 -0.675 1.00 0.00 C ATOM 2280 C ASN B 20 -2.936 5.294 0.136 1.00 0.00 C ATOM 2281 O ASN B 20 -2.457 5.611 1.225 1.00 0.00 O ATOM 2282 CB ASN B 20 -2.818 2.805 -0.093 1.00 0.00 C ATOM 2283 CG ASN B 20 -2.395 1.624 -0.947 1.00 0.00 C ATOM 2284 OD1 ASN B 20 -3.003 1.337 -1.979 1.00 0.00 O ATOM 2285 ND2 ASN B 20 -1.345 0.932 -0.519 1.00 0.00 N ATOM 0 H ASN B 20 -0.433 3.464 -0.170 1.00 0.00 H new ATOM 0 HA ASN B 20 -2.710 4.232 -1.700 1.00 0.00 H new ATOM 0 HB2 ASN B 20 -2.412 2.688 0.912 1.00 0.00 H new ATOM 0 HB3 ASN B 20 -3.904 2.812 0.001 1.00 0.00 H new ATOM 0 HD21 ASN B 20 -1.013 0.128 -1.051 1.00 0.00 H new ATOM 0 HD22 ASN B 20 -0.871 1.205 0.342 1.00 0.00 H new ATOM 2292 N ALA B 21 -3.984 5.906 -0.406 1.00 0.00 N ATOM 2293 CA ALA B 21 -4.659 7.018 0.253 1.00 0.00 C ATOM 2294 C ALA B 21 -5.513 6.509 1.417 1.00 0.00 C ATOM 2295 O ALA B 21 -5.657 5.299 1.591 1.00 0.00 O ATOM 2296 CB ALA B 21 -5.515 7.766 -0.760 1.00 0.00 C ATOM 0 H ALA B 21 -4.387 5.648 -1.307 1.00 0.00 H new ATOM 0 HA ALA B 21 -3.914 7.703 0.658 1.00 0.00 H new ATOM 0 HB1 ALA B 21 -6.019 8.597 -0.267 1.00 0.00 H new ATOM 0 HB2 ALA B 21 -4.881 8.149 -1.560 1.00 0.00 H new ATOM 0 HB3 ALA B 21 -6.258 7.088 -1.180 1.00 0.00 H new ATOM 2302 N PRO B 22 -6.092 7.409 2.241 1.00 0.00 N ATOM 2303 CA PRO B 22 -5.965 8.866 2.095 1.00 0.00 C ATOM 2304 C PRO B 22 -4.675 9.414 2.695 1.00 0.00 C ATOM 2305 O PRO B 22 -4.004 8.745 3.481 1.00 0.00 O ATOM 2306 CB PRO B 22 -7.167 9.383 2.880 1.00 0.00 C ATOM 2307 CG PRO B 22 -7.356 8.384 3.968 1.00 0.00 C ATOM 2308 CD PRO B 22 -6.938 7.052 3.398 1.00 0.00 C ATOM 0 HA PRO B 22 -5.936 9.170 1.049 1.00 0.00 H new ATOM 0 HB2 PRO B 22 -6.980 10.379 3.283 1.00 0.00 H new ATOM 0 HB3 PRO B 22 -8.053 9.455 2.249 1.00 0.00 H new ATOM 0 HG2 PRO B 22 -6.754 8.640 4.840 1.00 0.00 H new ATOM 0 HG3 PRO B 22 -8.395 8.358 4.295 1.00 0.00 H new ATOM 0 HD2 PRO B 22 -6.386 6.460 4.129 1.00 0.00 H new ATOM 0 HD3 PRO B 22 -7.801 6.459 3.094 1.00 0.00 H new ATOM 2316 N TYR B 23 -4.341 10.644 2.318 1.00 0.00 N ATOM 2317 CA TYR B 23 -3.137 11.300 2.814 1.00 0.00 C ATOM 2318 C TYR B 23 -3.481 12.314 3.900 1.00 0.00 C ATOM 2319 O TYR B 23 -2.980 13.439 3.897 1.00 0.00 O ATOM 2320 CB TYR B 23 -2.400 11.991 1.669 1.00 0.00 C ATOM 2321 CG TYR B 23 -1.793 11.022 0.686 1.00 0.00 C ATOM 2322 CD1 TYR B 23 -0.937 10.019 1.118 1.00 0.00 C ATOM 2323 CD2 TYR B 23 -2.080 11.103 -0.669 1.00 0.00 C ATOM 2324 CE1 TYR B 23 -0.382 9.123 0.227 1.00 0.00 C ATOM 2325 CE2 TYR B 23 -1.529 10.211 -1.567 1.00 0.00 C ATOM 2326 CZ TYR B 23 -0.681 9.223 -1.116 1.00 0.00 C ATOM 2327 OH TYR B 23 -0.129 8.333 -2.008 1.00 0.00 O ATOM 0 H TYR B 23 -4.889 11.208 1.669 1.00 0.00 H new ATOM 0 HA TYR B 23 -2.488 10.538 3.245 1.00 0.00 H new ATOM 0 HB2 TYR B 23 -3.093 12.647 1.142 1.00 0.00 H new ATOM 0 HB3 TYR B 23 -1.613 12.623 2.080 1.00 0.00 H new ATOM 0 HD1 TYR B 23 -0.701 9.938 2.169 1.00 0.00 H new ATOM 0 HD2 TYR B 23 -2.745 11.876 -1.027 1.00 0.00 H new ATOM 0 HE1 TYR B 23 0.283 8.348 0.579 1.00 0.00 H new ATOM 0 HE2 TYR B 23 -1.762 10.287 -2.619 1.00 0.00 H new ATOM 0 HH TYR B 23 -0.787 7.641 -2.229 1.00 0.00 H new ATOM 2337 N ASP B 24 -4.339 11.905 4.826 1.00 0.00 N ATOM 2338 CA ASP B 24 -4.756 12.771 5.923 1.00 0.00 C ATOM 2339 C ASP B 24 -4.505 12.114 7.280 1.00 0.00 C ATOM 2340 O ASP B 24 -4.931 12.633 8.313 1.00 0.00 O ATOM 2341 CB ASP B 24 -6.237 13.116 5.785 1.00 0.00 C ATOM 2342 CG ASP B 24 -6.530 13.911 4.528 1.00 0.00 C ATOM 2343 OD1 ASP B 24 -5.840 14.925 4.292 1.00 0.00 O ATOM 2344 OD2 ASP B 24 -7.450 13.519 3.779 1.00 0.00 O ATOM 0 H ASP B 24 -4.761 10.977 4.840 1.00 0.00 H new ATOM 0 HA ASP B 24 -4.162 13.683 5.871 1.00 0.00 H new ATOM 0 HB2 ASP B 24 -6.822 12.196 5.775 1.00 0.00 H new ATOM 0 HB3 ASP B 24 -6.557 13.688 6.656 1.00 0.00 H new ATOM 2349 N ASP B 25 -3.819 10.972 7.280 1.00 0.00 N ATOM 2350 CA ASP B 25 -3.528 10.262 8.521 1.00 0.00 C ATOM 2351 C ASP B 25 -2.084 9.762 8.562 1.00 0.00 C ATOM 2352 O ASP B 25 -1.709 9.012 9.463 1.00 0.00 O ATOM 2353 CB ASP B 25 -4.487 9.083 8.684 1.00 0.00 C ATOM 2354 CG ASP B 25 -4.660 8.676 10.134 1.00 0.00 C ATOM 2355 OD1 ASP B 25 -5.489 9.299 10.830 1.00 0.00 O ATOM 2356 OD2 ASP B 25 -3.969 7.734 10.573 1.00 0.00 O ATOM 0 H ASP B 25 -3.457 10.522 6.439 1.00 0.00 H new ATOM 0 HA ASP B 25 -3.663 10.964 9.344 1.00 0.00 H new ATOM 0 HB2 ASP B 25 -5.458 9.347 8.265 1.00 0.00 H new ATOM 0 HB3 ASP B 25 -4.114 8.233 8.113 1.00 0.00 H new ATOM 2361 N LYS B 26 -1.276 10.174 7.588 1.00 0.00 N ATOM 2362 CA LYS B 26 0.119 9.754 7.533 1.00 0.00 C ATOM 2363 C LYS B 26 0.224 8.242 7.359 1.00 0.00 C ATOM 2364 O LYS B 26 -0.518 7.485 7.985 1.00 0.00 O ATOM 2365 CB LYS B 26 0.854 10.185 8.803 1.00 0.00 C ATOM 2366 CG LYS B 26 0.916 11.692 8.989 1.00 0.00 C ATOM 2367 CD LYS B 26 1.758 12.071 10.197 1.00 0.00 C ATOM 2368 CE LYS B 26 2.792 13.128 9.846 1.00 0.00 C ATOM 2369 NZ LYS B 26 3.184 13.937 11.033 1.00 0.00 N ATOM 0 H LYS B 26 -1.562 10.795 6.831 1.00 0.00 H new ATOM 0 HA LYS B 26 0.584 10.235 6.672 1.00 0.00 H new ATOM 0 HB2 LYS B 26 0.360 9.741 9.667 1.00 0.00 H new ATOM 0 HB3 LYS B 26 1.869 9.788 8.778 1.00 0.00 H new ATOM 0 HG2 LYS B 26 1.334 12.153 8.094 1.00 0.00 H new ATOM 0 HG3 LYS B 26 -0.093 12.086 9.109 1.00 0.00 H new ATOM 0 HD2 LYS B 26 1.110 12.444 10.991 1.00 0.00 H new ATOM 0 HD3 LYS B 26 2.260 11.184 10.585 1.00 0.00 H new ATOM 0 HE2 LYS B 26 3.676 12.646 9.427 1.00 0.00 H new ATOM 0 HE3 LYS B 26 2.391 13.786 9.075 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 3.891 14.646 10.752 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 2.346 14.417 11.418 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 3.590 13.313 11.759 1.00 0.00 H new ATOM 2383 N HIS B 27 1.147 7.810 6.508 1.00 0.00 N ATOM 2384 CA HIS B 27 1.344 6.388 6.256 1.00 0.00 C ATOM 2385 C HIS B 27 2.828 6.057 6.125 1.00 0.00 C ATOM 2386 O HIS B 27 3.413 6.198 5.052 1.00 0.00 O ATOM 2387 CB HIS B 27 0.602 5.966 4.986 1.00 0.00 C ATOM 2388 CG HIS B 27 -0.775 5.441 5.246 1.00 0.00 C ATOM 2389 ND1 HIS B 27 -1.058 4.440 6.149 1.00 0.00 N ATOM 2390 CD2 HIS B 27 -1.965 5.799 4.700 1.00 0.00 C ATOM 2391 CE1 HIS B 27 -2.380 4.225 6.123 1.00 0.00 C ATOM 2392 NE2 HIS B 27 -2.977 5.025 5.260 1.00 0.00 N ATOM 0 H HIS B 27 1.770 8.423 5.982 1.00 0.00 H new ATOM 0 HA HIS B 27 0.941 5.836 7.105 1.00 0.00 H new ATOM 0 HB2 HIS B 27 0.535 6.821 4.313 1.00 0.00 H new ATOM 0 HB3 HIS B 27 1.183 5.200 4.472 1.00 0.00 H new ATOM 0 HD2 HIS B 27 -2.104 6.563 3.950 1.00 0.00 H new ATOM 0 HE1 HIS B 27 -2.891 3.492 6.730 1.00 0.00 H new ATOM 0 HE2 HIS B 27 -3.974 5.067 5.047 1.00 0.00 H new ATOM 2400 N THR B 28 3.429 5.616 7.225 1.00 0.00 N ATOM 2401 CA THR B 28 4.842 5.265 7.233 1.00 0.00 C ATOM 2402 C THR B 28 5.071 3.916 6.557 1.00 0.00 C ATOM 2403 O THR B 28 4.561 2.891 7.007 1.00 0.00 O ATOM 2404 CB THR B 28 5.371 5.225 8.667 1.00 0.00 C ATOM 2405 OG1 THR B 28 4.949 6.368 9.390 1.00 0.00 O ATOM 2406 CG2 THR B 28 6.882 5.164 8.747 1.00 0.00 C ATOM 0 H THR B 28 2.959 5.494 8.122 1.00 0.00 H new ATOM 0 HA THR B 28 5.383 6.028 6.674 1.00 0.00 H new ATOM 0 HB THR B 28 4.963 4.311 9.099 1.00 0.00 H new ATOM 0 HG1 THR B 28 5.296 6.323 10.305 1.00 0.00 H new ATOM 0 HG21 THR B 28 7.190 5.138 9.792 1.00 0.00 H new ATOM 0 HG22 THR B 28 7.237 4.266 8.241 1.00 0.00 H new ATOM 0 HG23 THR B 28 7.308 6.044 8.265 1.00 0.00 H new ATOM 2414 N TYR B 29 5.842 3.926 5.475 1.00 0.00 N ATOM 2415 CA TYR B 29 6.140 2.704 4.737 1.00 0.00 C ATOM 2416 C TYR B 29 7.539 2.201 5.072 1.00 0.00 C ATOM 2417 O TYR B 29 8.537 2.833 4.725 1.00 0.00 O ATOM 2418 CB TYR B 29 6.015 2.948 3.232 1.00 0.00 C ATOM 2419 CG TYR B 29 4.609 3.289 2.791 1.00 0.00 C ATOM 2420 CD1 TYR B 29 3.656 2.294 2.611 1.00 0.00 C ATOM 2421 CD2 TYR B 29 4.235 4.606 2.556 1.00 0.00 C ATOM 2422 CE1 TYR B 29 2.370 2.602 2.210 1.00 0.00 C ATOM 2423 CE2 TYR B 29 2.950 4.922 2.156 1.00 0.00 C ATOM 2424 CZ TYR B 29 2.023 3.917 1.984 1.00 0.00 C ATOM 2425 OH TYR B 29 0.742 4.228 1.586 1.00 0.00 O ATOM 0 H TYR B 29 6.272 4.767 5.090 1.00 0.00 H new ATOM 0 HA TYR B 29 5.418 1.942 5.032 1.00 0.00 H new ATOM 0 HB2 TYR B 29 6.684 3.760 2.947 1.00 0.00 H new ATOM 0 HB3 TYR B 29 6.349 2.058 2.699 1.00 0.00 H new ATOM 0 HD1 TYR B 29 3.925 1.263 2.787 1.00 0.00 H new ATOM 0 HD2 TYR B 29 4.960 5.396 2.688 1.00 0.00 H new ATOM 0 HE1 TYR B 29 1.641 1.817 2.074 1.00 0.00 H new ATOM 0 HE2 TYR B 29 2.674 5.951 1.979 1.00 0.00 H new ATOM 0 HH TYR B 29 0.662 5.198 1.471 1.00 0.00 H new ATOM 2435 N HIS B 30 7.603 1.062 5.754 1.00 0.00 N ATOM 2436 CA HIS B 30 8.880 0.475 6.144 1.00 0.00 C ATOM 2437 C HIS B 30 9.467 -0.369 5.017 1.00 0.00 C ATOM 2438 O HIS B 30 8.764 -1.156 4.383 1.00 0.00 O ATOM 2439 CB HIS B 30 8.706 -0.383 7.398 1.00 0.00 C ATOM 2440 CG HIS B 30 8.940 0.364 8.674 1.00 0.00 C ATOM 2441 ND1 HIS B 30 7.934 0.917 9.435 1.00 0.00 N ATOM 2442 CD2 HIS B 30 10.099 0.645 9.324 1.00 0.00 C ATOM 2443 CE1 HIS B 30 8.500 1.504 10.499 1.00 0.00 C ATOM 2444 NE2 HIS B 30 9.812 1.367 10.479 1.00 0.00 N ATOM 0 H HIS B 30 6.786 0.527 6.048 1.00 0.00 H new ATOM 0 HA HIS B 30 9.572 1.290 6.357 1.00 0.00 H new ATOM 0 HB2 HIS B 30 7.697 -0.796 7.408 1.00 0.00 H new ATOM 0 HB3 HIS B 30 9.395 -1.226 7.349 1.00 0.00 H new ATOM 0 HD2 HIS B 30 11.086 0.354 8.997 1.00 0.00 H new ATOM 0 HE1 HIS B 30 7.953 2.022 11.273 1.00 0.00 H new ATOM 0 HE2 HIS B 30 10.478 1.718 11.167 1.00 0.00 H new ATOM 2452 N ILE B 31 10.764 -0.202 4.779 1.00 0.00 N ATOM 2453 CA ILE B 31 11.457 -0.950 3.737 1.00 0.00 C ATOM 2454 C ILE B 31 12.468 -1.914 4.347 1.00 0.00 C ATOM 2455 O ILE B 31 13.175 -1.569 5.294 1.00 0.00 O ATOM 2456 CB ILE B 31 12.183 -0.008 2.756 1.00 0.00 C ATOM 2457 CG1 ILE B 31 11.191 0.972 2.125 1.00 0.00 C ATOM 2458 CG2 ILE B 31 12.900 -0.810 1.680 1.00 0.00 C ATOM 2459 CD1 ILE B 31 11.812 1.865 1.073 1.00 0.00 C ATOM 0 H ILE B 31 11.358 0.447 5.296 1.00 0.00 H new ATOM 0 HA ILE B 31 10.702 -1.513 3.189 1.00 0.00 H new ATOM 0 HB ILE B 31 12.927 0.564 3.311 1.00 0.00 H new ATOM 0 HG12 ILE B 31 10.373 0.410 1.676 1.00 0.00 H new ATOM 0 HG13 ILE B 31 10.758 1.594 2.909 1.00 0.00 H new ATOM 0 HG21 ILE B 31 13.407 -0.129 0.996 1.00 0.00 H new ATOM 0 HG22 ILE B 31 13.633 -1.470 2.145 1.00 0.00 H new ATOM 0 HG23 ILE B 31 12.175 -1.406 1.127 1.00 0.00 H new ATOM 0 HD11 ILE B 31 11.052 2.534 0.669 1.00 0.00 H new ATOM 0 HD12 ILE B 31 12.612 2.454 1.522 1.00 0.00 H new ATOM 0 HD13 ILE B 31 12.220 1.251 0.270 1.00 0.00 H new ATOM 2471 N LYS B 32 12.530 -3.125 3.804 1.00 0.00 N ATOM 2472 CA LYS B 32 13.454 -4.137 4.305 1.00 0.00 C ATOM 2473 C LYS B 32 14.550 -4.435 3.287 1.00 0.00 C ATOM 2474 O LYS B 32 14.271 -4.770 2.136 1.00 0.00 O ATOM 2475 CB LYS B 32 12.699 -5.421 4.647 1.00 0.00 C ATOM 2476 CG LYS B 32 12.582 -5.677 6.140 1.00 0.00 C ATOM 2477 CD LYS B 32 12.901 -7.121 6.483 1.00 0.00 C ATOM 2478 CE LYS B 32 11.909 -7.688 7.486 1.00 0.00 C ATOM 2479 NZ LYS B 32 10.554 -7.854 6.892 1.00 0.00 N ATOM 0 H LYS B 32 11.954 -3.429 3.019 1.00 0.00 H new ATOM 0 HA LYS B 32 13.923 -3.745 5.208 1.00 0.00 H new ATOM 0 HB2 LYS B 32 11.699 -5.371 4.216 1.00 0.00 H new ATOM 0 HB3 LYS B 32 13.205 -6.266 4.180 1.00 0.00 H new ATOM 0 HG2 LYS B 32 13.261 -5.016 6.678 1.00 0.00 H new ATOM 0 HG3 LYS B 32 11.572 -5.437 6.473 1.00 0.00 H new ATOM 0 HD2 LYS B 32 12.886 -7.724 5.575 1.00 0.00 H new ATOM 0 HD3 LYS B 32 13.910 -7.185 6.891 1.00 0.00 H new ATOM 0 HE2 LYS B 32 12.268 -8.652 7.847 1.00 0.00 H new ATOM 0 HE3 LYS B 32 11.848 -7.027 8.350 1.00 0.00 H new ATOM 0 HZ1 LYS B 32 10.013 -8.545 7.450 1.00 0.00 H new ATOM 0 HZ2 LYS B 32 10.058 -6.940 6.898 1.00 0.00 H new ATOM 0 HZ3 LYS B 32 10.643 -8.193 5.913 1.00 0.00 H new ATOM 2493 N ILE B 33 15.800 -4.316 3.724 1.00 0.00 N ATOM 2494 CA ILE B 33 16.942 -4.579 2.857 1.00 0.00 C ATOM 2495 C ILE B 33 17.809 -5.696 3.425 1.00 0.00 C ATOM 2496 O ILE B 33 17.811 -5.942 4.630 1.00 0.00 O ATOM 2497 CB ILE B 33 17.807 -3.319 2.665 1.00 0.00 C ATOM 2498 CG1 ILE B 33 16.933 -2.127 2.273 1.00 0.00 C ATOM 2499 CG2 ILE B 33 18.879 -3.567 1.614 1.00 0.00 C ATOM 2500 CD1 ILE B 33 17.545 -0.789 2.626 1.00 0.00 C ATOM 0 H ILE B 33 16.047 -4.039 4.674 1.00 0.00 H new ATOM 0 HA ILE B 33 16.543 -4.884 1.889 1.00 0.00 H new ATOM 0 HB ILE B 33 18.299 -3.088 3.610 1.00 0.00 H new ATOM 0 HG12 ILE B 33 16.746 -2.161 1.200 1.00 0.00 H new ATOM 0 HG13 ILE B 33 15.966 -2.217 2.768 1.00 0.00 H new ATOM 0 HG21 ILE B 33 19.482 -2.667 1.490 1.00 0.00 H new ATOM 0 HG22 ILE B 33 19.518 -4.391 1.933 1.00 0.00 H new ATOM 0 HG23 ILE B 33 18.406 -3.821 0.665 1.00 0.00 H new ATOM 0 HD11 ILE B 33 16.871 0.011 2.320 1.00 0.00 H new ATOM 0 HD12 ILE B 33 17.706 -0.735 3.703 1.00 0.00 H new ATOM 0 HD13 ILE B 33 18.499 -0.678 2.110 1.00 0.00 H new ATOM 2512 N THR B 34 18.543 -6.373 2.549 1.00 0.00 N ATOM 2513 CA THR B 34 19.412 -7.466 2.970 1.00 0.00 C ATOM 2514 C THR B 34 20.615 -7.603 2.046 1.00 0.00 C ATOM 2515 O THR B 34 20.590 -7.154 0.900 1.00 0.00 O ATOM 2516 CB THR B 34 18.630 -8.782 3.005 1.00 0.00 C ATOM 2517 OG1 THR B 34 17.629 -8.743 4.007 1.00 0.00 O ATOM 2518 CG2 THR B 34 19.500 -9.993 3.273 1.00 0.00 C ATOM 0 H THR B 34 18.554 -6.185 1.546 1.00 0.00 H new ATOM 0 HA THR B 34 19.776 -7.236 3.972 1.00 0.00 H new ATOM 0 HB THR B 34 18.193 -8.883 2.011 1.00 0.00 H new ATOM 0 HG1 THR B 34 17.139 -9.592 4.013 1.00 0.00 H new ATOM 0 HG21 THR B 34 18.881 -10.890 3.284 1.00 0.00 H new ATOM 0 HG22 THR B 34 20.253 -10.081 2.489 1.00 0.00 H new ATOM 0 HG23 THR B 34 19.993 -9.880 4.239 1.00 0.00 H new ATOM 2526 N ASN B 35 21.665 -8.232 2.559 1.00 0.00 N ATOM 2527 CA ASN B 35 22.886 -8.442 1.792 1.00 0.00 C ATOM 2528 C ASN B 35 22.892 -9.828 1.157 1.00 0.00 C ATOM 2529 O ASN B 35 23.034 -10.839 1.844 1.00 0.00 O ATOM 2530 CB ASN B 35 24.111 -8.273 2.692 1.00 0.00 C ATOM 2531 CG ASN B 35 25.210 -7.470 2.027 1.00 0.00 C ATOM 2532 OD1 ASN B 35 25.872 -6.653 2.666 1.00 0.00 O ATOM 2533 ND2 ASN B 35 25.409 -7.698 0.733 1.00 0.00 N ATOM 0 H ASN B 35 21.695 -8.607 3.507 1.00 0.00 H new ATOM 0 HA ASN B 35 22.924 -7.697 0.997 1.00 0.00 H new ATOM 0 HB2 ASN B 35 23.813 -7.780 3.617 1.00 0.00 H new ATOM 0 HB3 ASN B 35 24.497 -9.255 2.964 1.00 0.00 H new ATOM 0 HD21 ASN B 35 26.134 -7.186 0.231 1.00 0.00 H new ATOM 0 HD22 ASN B 35 24.837 -8.385 0.242 1.00 0.00 H new ATOM 2540 N ALA B 36 22.740 -9.869 -0.160 1.00 0.00 N ATOM 2541 CA ALA B 36 22.730 -11.130 -0.890 1.00 0.00 C ATOM 2542 C ALA B 36 24.113 -11.452 -1.448 1.00 0.00 C ATOM 2543 O ALA B 36 24.245 -12.211 -2.408 1.00 0.00 O ATOM 2544 CB ALA B 36 21.709 -11.077 -2.013 1.00 0.00 C ATOM 0 H ALA B 36 22.622 -9.042 -0.746 1.00 0.00 H new ATOM 0 HA ALA B 36 22.453 -11.923 -0.195 1.00 0.00 H new ATOM 0 HB1 ALA B 36 21.711 -12.025 -2.551 1.00 0.00 H new ATOM 0 HB2 ALA B 36 20.718 -10.898 -1.596 1.00 0.00 H new ATOM 0 HB3 ALA B 36 21.964 -10.270 -2.699 1.00 0.00 H new ATOM 2550 N GLY B 37 25.138 -10.867 -0.842 1.00 0.00 N ATOM 2551 CA GLY B 37 26.497 -11.098 -1.290 1.00 0.00 C ATOM 2552 C GLY B 37 27.343 -11.805 -0.249 1.00 0.00 C ATOM 2553 O GLY B 37 26.825 -12.559 0.574 1.00 0.00 O ATOM 0 H GLY B 37 25.052 -10.235 -0.046 1.00 0.00 H new ATOM 0 HA2 GLY B 37 26.478 -11.694 -2.203 1.00 0.00 H new ATOM 0 HA3 GLY B 37 26.960 -10.144 -1.541 1.00 0.00 H new ATOM 2557 N GLY B 38 28.649 -11.562 -0.287 1.00 0.00 N ATOM 2558 CA GLY B 38 29.549 -12.189 0.664 1.00 0.00 C ATOM 2559 C GLY B 38 30.264 -11.180 1.543 1.00 0.00 C ATOM 2560 O GLY B 38 30.771 -11.530 2.609 1.00 0.00 O ATOM 0 H GLY B 38 29.101 -10.942 -0.959 1.00 0.00 H new ATOM 0 HA2 GLY B 38 28.985 -12.878 1.293 1.00 0.00 H new ATOM 0 HA3 GLY B 38 30.287 -12.782 0.124 1.00 0.00 H new ATOM 2564 N ARG B 39 30.307 -9.928 1.098 1.00 0.00 N ATOM 2565 CA ARG B 39 30.968 -8.871 1.854 1.00 0.00 C ATOM 2566 C ARG B 39 29.999 -7.736 2.168 1.00 0.00 C ATOM 2567 O ARG B 39 29.037 -7.506 1.434 1.00 0.00 O ATOM 2568 CB ARG B 39 32.166 -8.329 1.072 1.00 0.00 C ATOM 2569 CG ARG B 39 32.996 -9.411 0.403 1.00 0.00 C ATOM 2570 CD ARG B 39 34.434 -9.392 0.895 1.00 0.00 C ATOM 2571 NE ARG B 39 35.333 -8.759 -0.066 1.00 0.00 N ATOM 2572 CZ ARG B 39 36.609 -8.486 0.190 1.00 0.00 C ATOM 2573 NH1 ARG B 39 37.130 -8.791 1.370 1.00 0.00 N ATOM 2574 NH2 ARG B 39 37.364 -7.909 -0.734 1.00 0.00 N ATOM 0 H ARG B 39 29.892 -9.621 0.218 1.00 0.00 H new ATOM 0 HA ARG B 39 31.317 -9.297 2.794 1.00 0.00 H new ATOM 0 HB2 ARG B 39 31.809 -7.635 0.312 1.00 0.00 H new ATOM 0 HB3 ARG B 39 32.804 -7.760 1.749 1.00 0.00 H new ATOM 0 HG2 ARG B 39 32.554 -10.387 0.604 1.00 0.00 H new ATOM 0 HG3 ARG B 39 32.978 -9.269 -0.678 1.00 0.00 H new ATOM 0 HD2 ARG B 39 34.485 -8.859 1.845 1.00 0.00 H new ATOM 0 HD3 ARG B 39 34.766 -10.413 1.084 1.00 0.00 H new ATOM 0 HE ARG B 39 34.962 -8.513 -0.984 1.00 0.00 H new ATOM 0 HH11 ARG B 39 36.552 -9.236 2.083 1.00 0.00 H new ATOM 0 HH12 ARG B 39 38.109 -8.581 1.565 1.00 0.00 H new ATOM 0 HH21 ARG B 39 36.966 -7.674 -1.643 1.00 0.00 H new ATOM 0 HH22 ARG B 39 38.343 -7.700 -0.536 1.00 0.00 H new ATOM 2588 N ARG B 40 30.261 -7.027 3.262 1.00 0.00 N ATOM 2589 CA ARG B 40 29.412 -5.911 3.670 1.00 0.00 C ATOM 2590 C ARG B 40 29.255 -4.909 2.531 1.00 0.00 C ATOM 2591 O ARG B 40 29.959 -4.986 1.525 1.00 0.00 O ATOM 2592 CB ARG B 40 30.000 -5.219 4.901 1.00 0.00 C ATOM 2593 CG ARG B 40 31.515 -5.089 4.863 1.00 0.00 C ATOM 2594 CD ARG B 40 32.176 -5.960 5.921 1.00 0.00 C ATOM 2595 NE ARG B 40 31.846 -5.521 7.275 1.00 0.00 N ATOM 2596 CZ ARG B 40 32.031 -6.271 8.358 1.00 0.00 C ATOM 2597 NH1 ARG B 40 32.535 -7.492 8.243 1.00 0.00 N ATOM 2598 NH2 ARG B 40 31.709 -5.801 9.555 1.00 0.00 N ATOM 0 H ARG B 40 31.052 -7.204 3.881 1.00 0.00 H new ATOM 0 HA ARG B 40 28.428 -6.305 3.923 1.00 0.00 H new ATOM 0 HB2 ARG B 40 29.561 -4.226 4.993 1.00 0.00 H new ATOM 0 HB3 ARG B 40 29.714 -5.778 5.792 1.00 0.00 H new ATOM 0 HG2 ARG B 40 31.881 -5.373 3.876 1.00 0.00 H new ATOM 0 HG3 ARG B 40 31.796 -4.048 5.020 1.00 0.00 H new ATOM 0 HD2 ARG B 40 31.860 -6.995 5.788 1.00 0.00 H new ATOM 0 HD3 ARG B 40 33.257 -5.937 5.786 1.00 0.00 H new ATOM 0 HE ARG B 40 31.452 -4.588 7.397 1.00 0.00 H new ATOM 0 HH11 ARG B 40 32.781 -7.857 7.323 1.00 0.00 H new ATOM 0 HH12 ARG B 40 32.676 -8.066 9.074 1.00 0.00 H new ATOM 0 HH21 ARG B 40 31.319 -4.863 9.647 1.00 0.00 H new ATOM 0 HH22 ARG B 40 31.851 -6.377 10.384 1.00 0.00 H new ATOM 2612 N ILE B 41 28.327 -3.971 2.694 1.00 0.00 N ATOM 2613 CA ILE B 41 28.082 -2.958 1.673 1.00 0.00 C ATOM 2614 C ILE B 41 27.469 -1.697 2.269 1.00 0.00 C ATOM 2615 O ILE B 41 26.728 -1.757 3.250 1.00 0.00 O ATOM 2616 CB ILE B 41 27.141 -3.487 0.574 1.00 0.00 C ATOM 2617 CG1 ILE B 41 25.774 -3.830 1.166 1.00 0.00 C ATOM 2618 CG2 ILE B 41 27.748 -4.701 -0.110 1.00 0.00 C ATOM 2619 CD1 ILE B 41 24.802 -4.399 0.154 1.00 0.00 C ATOM 0 H ILE B 41 27.734 -3.891 3.520 1.00 0.00 H new ATOM 0 HA ILE B 41 29.053 -2.717 1.239 1.00 0.00 H new ATOM 0 HB ILE B 41 27.008 -2.706 -0.174 1.00 0.00 H new ATOM 0 HG12 ILE B 41 25.907 -4.549 1.974 1.00 0.00 H new ATOM 0 HG13 ILE B 41 25.342 -2.932 1.607 1.00 0.00 H new ATOM 0 HG21 ILE B 41 27.069 -5.060 -0.883 1.00 0.00 H new ATOM 0 HG22 ILE B 41 28.700 -4.425 -0.563 1.00 0.00 H new ATOM 0 HG23 ILE B 41 27.911 -5.489 0.625 1.00 0.00 H new ATOM 0 HD11 ILE B 41 23.854 -4.619 0.644 1.00 0.00 H new ATOM 0 HD12 ILE B 41 24.639 -3.673 -0.642 1.00 0.00 H new ATOM 0 HD13 ILE B 41 25.213 -5.316 -0.269 1.00 0.00 H new ATOM 2631 N GLY B 42 27.773 -0.557 1.655 1.00 0.00 N ATOM 2632 CA GLY B 42 27.236 0.709 2.118 1.00 0.00 C ATOM 2633 C GLY B 42 26.162 1.232 1.186 1.00 0.00 C ATOM 2634 O GLY B 42 26.443 1.577 0.039 1.00 0.00 O ATOM 0 H GLY B 42 28.385 -0.488 0.842 1.00 0.00 H new ATOM 0 HA2 GLY B 42 26.822 0.585 3.119 1.00 0.00 H new ATOM 0 HA3 GLY B 42 28.041 1.440 2.194 1.00 0.00 H new ATOM 2638 N TRP B 43 24.925 1.272 1.671 1.00 0.00 N ATOM 2639 CA TRP B 43 23.802 1.735 0.862 1.00 0.00 C ATOM 2640 C TRP B 43 23.392 3.158 1.219 1.00 0.00 C ATOM 2641 O TRP B 43 23.718 3.667 2.291 1.00 0.00 O ATOM 2642 CB TRP B 43 22.609 0.796 1.040 1.00 0.00 C ATOM 2643 CG TRP B 43 22.216 0.605 2.472 1.00 0.00 C ATOM 2644 CD1 TRP B 43 22.701 -0.335 3.337 1.00 0.00 C ATOM 2645 CD2 TRP B 43 21.258 1.372 3.209 1.00 0.00 C ATOM 2646 NE1 TRP B 43 22.103 -0.199 4.566 1.00 0.00 N ATOM 2647 CE2 TRP B 43 21.213 0.843 4.513 1.00 0.00 C ATOM 2648 CE3 TRP B 43 20.436 2.457 2.893 1.00 0.00 C ATOM 2649 CZ2 TRP B 43 20.376 1.361 5.499 1.00 0.00 C ATOM 2650 CZ3 TRP B 43 19.606 2.970 3.873 1.00 0.00 C ATOM 2651 CH2 TRP B 43 19.581 2.422 5.161 1.00 0.00 C ATOM 0 H TRP B 43 24.675 0.990 2.619 1.00 0.00 H new ATOM 0 HA TRP B 43 24.124 1.732 -0.179 1.00 0.00 H new ATOM 0 HB2 TRP B 43 21.758 1.192 0.486 1.00 0.00 H new ATOM 0 HB3 TRP B 43 22.850 -0.173 0.604 1.00 0.00 H new ATOM 0 HD1 TRP B 43 23.446 -1.077 3.090 1.00 0.00 H new ATOM 0 HE1 TRP B 43 22.290 -0.778 5.384 1.00 0.00 H new ATOM 0 HE3 TRP B 43 20.449 2.887 1.902 1.00 0.00 H new ATOM 0 HZ2 TRP B 43 20.355 0.940 6.494 1.00 0.00 H new ATOM 0 HZ3 TRP B 43 18.966 3.808 3.641 1.00 0.00 H new ATOM 0 HH2 TRP B 43 18.921 2.846 5.903 1.00 0.00 H new ATOM 2662 N ALA B 44 22.661 3.784 0.304 1.00 0.00 N ATOM 2663 CA ALA B 44 22.175 5.144 0.492 1.00 0.00 C ATOM 2664 C ALA B 44 20.810 5.310 -0.168 1.00 0.00 C ATOM 2665 O ALA B 44 20.497 4.621 -1.139 1.00 0.00 O ATOM 2666 CB ALA B 44 23.168 6.148 -0.073 1.00 0.00 C ATOM 0 H ALA B 44 22.390 3.364 -0.585 1.00 0.00 H new ATOM 0 HA ALA B 44 22.070 5.333 1.560 1.00 0.00 H new ATOM 0 HB1 ALA B 44 22.788 7.159 0.076 1.00 0.00 H new ATOM 0 HB2 ALA B 44 24.125 6.041 0.438 1.00 0.00 H new ATOM 0 HB3 ALA B 44 23.304 5.965 -1.139 1.00 0.00 H new ATOM 2672 N ILE B 45 19.996 6.214 0.367 1.00 0.00 N ATOM 2673 CA ILE B 45 18.663 6.445 -0.175 1.00 0.00 C ATOM 2674 C ILE B 45 18.520 7.848 -0.752 1.00 0.00 C ATOM 2675 O ILE B 45 19.077 8.811 -0.226 1.00 0.00 O ATOM 2676 CB ILE B 45 17.579 6.235 0.899 1.00 0.00 C ATOM 2677 CG1 ILE B 45 17.844 4.942 1.674 1.00 0.00 C ATOM 2678 CG2 ILE B 45 16.199 6.202 0.259 1.00 0.00 C ATOM 2679 CD1 ILE B 45 17.744 3.696 0.823 1.00 0.00 C ATOM 0 H ILE B 45 20.234 6.795 1.171 1.00 0.00 H new ATOM 0 HA ILE B 45 18.527 5.719 -0.976 1.00 0.00 H new ATOM 0 HB ILE B 45 17.613 7.070 1.599 1.00 0.00 H new ATOM 0 HG12 ILE B 45 18.839 4.991 2.117 1.00 0.00 H new ATOM 0 HG13 ILE B 45 17.132 4.869 2.496 1.00 0.00 H new ATOM 0 HG21 ILE B 45 15.444 6.053 1.031 1.00 0.00 H new ATOM 0 HG22 ILE B 45 16.013 7.146 -0.253 1.00 0.00 H new ATOM 0 HG23 ILE B 45 16.150 5.383 -0.459 1.00 0.00 H new ATOM 0 HD11 ILE B 45 17.944 2.818 1.438 1.00 0.00 H new ATOM 0 HD12 ILE B 45 16.742 3.623 0.401 1.00 0.00 H new ATOM 0 HD13 ILE B 45 18.475 3.747 0.016 1.00 0.00 H new ATOM 2691 N LYS B 46 17.760 7.951 -1.838 1.00 0.00 N ATOM 2692 CA LYS B 46 17.523 9.229 -2.499 1.00 0.00 C ATOM 2693 C LYS B 46 16.045 9.381 -2.845 1.00 0.00 C ATOM 2694 O LYS B 46 15.381 8.410 -3.197 1.00 0.00 O ATOM 2695 CB LYS B 46 18.370 9.336 -3.767 1.00 0.00 C ATOM 2696 CG LYS B 46 19.764 9.890 -3.523 1.00 0.00 C ATOM 2697 CD LYS B 46 19.742 11.403 -3.382 1.00 0.00 C ATOM 2698 CE LYS B 46 20.872 12.050 -4.166 1.00 0.00 C ATOM 2699 NZ LYS B 46 22.206 11.702 -3.604 1.00 0.00 N ATOM 0 H LYS B 46 17.295 7.159 -2.281 1.00 0.00 H new ATOM 0 HA LYS B 46 17.809 10.029 -1.816 1.00 0.00 H new ATOM 0 HB2 LYS B 46 18.455 8.349 -4.221 1.00 0.00 H new ATOM 0 HB3 LYS B 46 17.855 9.974 -4.485 1.00 0.00 H new ATOM 0 HG2 LYS B 46 20.181 9.445 -2.620 1.00 0.00 H new ATOM 0 HG3 LYS B 46 20.418 9.609 -4.348 1.00 0.00 H new ATOM 0 HD2 LYS B 46 18.785 11.789 -3.734 1.00 0.00 H new ATOM 0 HD3 LYS B 46 19.826 11.673 -2.329 1.00 0.00 H new ATOM 0 HE2 LYS B 46 20.822 11.730 -5.207 1.00 0.00 H new ATOM 0 HE3 LYS B 46 20.746 13.133 -4.159 1.00 0.00 H new ATOM 0 HZ1 LYS B 46 22.950 12.162 -4.166 1.00 0.00 H new ATOM 0 HZ2 LYS B 46 22.264 12.030 -2.619 1.00 0.00 H new ATOM 0 HZ3 LYS B 46 22.337 10.671 -3.634 1.00 0.00 H new ATOM 2713 N THR B 47 15.533 10.602 -2.740 1.00 0.00 N ATOM 2714 CA THR B 47 14.131 10.869 -3.041 1.00 0.00 C ATOM 2715 C THR B 47 13.977 12.172 -3.818 1.00 0.00 C ATOM 2716 O THR B 47 14.780 13.093 -3.672 1.00 0.00 O ATOM 2717 CB THR B 47 13.315 10.932 -1.749 1.00 0.00 C ATOM 2718 OG1 THR B 47 13.822 11.933 -0.884 1.00 0.00 O ATOM 2719 CG2 THR B 47 13.303 9.626 -0.984 1.00 0.00 C ATOM 0 H THR B 47 16.066 11.421 -2.449 1.00 0.00 H new ATOM 0 HA THR B 47 13.757 10.054 -3.661 1.00 0.00 H new ATOM 0 HB THR B 47 12.296 11.160 -2.062 1.00 0.00 H new ATOM 0 HG1 THR B 47 13.286 11.959 -0.064 1.00 0.00 H new ATOM 0 HG21 THR B 47 12.707 9.740 -0.079 1.00 0.00 H new ATOM 0 HG22 THR B 47 12.870 8.843 -1.607 1.00 0.00 H new ATOM 0 HG23 THR B 47 14.323 9.353 -0.714 1.00 0.00 H new ATOM 2727 N THR B 48 12.938 12.240 -4.644 1.00 0.00 N ATOM 2728 CA THR B 48 12.674 13.430 -5.446 1.00 0.00 C ATOM 2729 C THR B 48 12.432 14.642 -4.555 1.00 0.00 C ATOM 2730 O THR B 48 12.825 15.760 -4.889 1.00 0.00 O ATOM 2731 CB THR B 48 11.465 13.200 -6.354 1.00 0.00 C ATOM 2732 OG1 THR B 48 10.570 12.269 -5.771 1.00 0.00 O ATOM 2733 CG2 THR B 48 11.838 12.683 -7.725 1.00 0.00 C ATOM 0 H THR B 48 12.265 11.485 -4.776 1.00 0.00 H new ATOM 0 HA THR B 48 13.551 13.625 -6.063 1.00 0.00 H new ATOM 0 HB THR B 48 10.998 14.178 -6.467 1.00 0.00 H new ATOM 0 HG1 THR B 48 9.655 12.616 -5.826 1.00 0.00 H new ATOM 0 HG21 THR B 48 10.935 12.541 -8.319 1.00 0.00 H new ATOM 0 HG22 THR B 48 12.489 13.403 -8.221 1.00 0.00 H new ATOM 0 HG23 THR B 48 12.360 11.731 -7.625 1.00 0.00 H new ATOM 2741 N ASN B 49 11.781 14.413 -3.420 1.00 0.00 N ATOM 2742 CA ASN B 49 11.483 15.486 -2.478 1.00 0.00 C ATOM 2743 C ASN B 49 11.735 15.035 -1.044 1.00 0.00 C ATOM 2744 O ASN B 49 11.053 14.145 -0.534 1.00 0.00 O ATOM 2745 CB ASN B 49 10.031 15.941 -2.634 1.00 0.00 C ATOM 2746 CG ASN B 49 9.803 16.720 -3.915 1.00 0.00 C ATOM 2747 OD1 ASN B 49 9.019 16.312 -4.772 1.00 0.00 O ATOM 2748 ND2 ASN B 49 10.489 17.850 -4.052 1.00 0.00 N ATOM 0 H ASN B 49 11.449 13.493 -3.130 1.00 0.00 H new ATOM 0 HA ASN B 49 12.145 16.324 -2.698 1.00 0.00 H new ATOM 0 HB2 ASN B 49 9.377 15.069 -2.621 1.00 0.00 H new ATOM 0 HB3 ASN B 49 9.754 16.561 -1.781 1.00 0.00 H new ATOM 0 HD21 ASN B 49 10.376 18.416 -4.893 1.00 0.00 H new ATOM 0 HD22 ASN B 49 11.128 18.151 -3.316 1.00 0.00 H new ATOM 2755 N MET B 50 12.718 15.654 -0.397 1.00 0.00 N ATOM 2756 CA MET B 50 13.058 15.314 0.979 1.00 0.00 C ATOM 2757 C MET B 50 12.275 16.168 1.978 1.00 0.00 C ATOM 2758 O MET B 50 12.571 16.159 3.173 1.00 0.00 O ATOM 2759 CB MET B 50 14.560 15.489 1.211 1.00 0.00 C ATOM 2760 CG MET B 50 15.422 14.674 0.261 1.00 0.00 C ATOM 2761 SD MET B 50 17.090 14.411 0.892 1.00 0.00 S ATOM 2762 CE MET B 50 16.783 13.186 2.162 1.00 0.00 C ATOM 0 H MET B 50 13.292 16.393 -0.804 1.00 0.00 H new ATOM 0 HA MET B 50 12.785 14.271 1.139 1.00 0.00 H new ATOM 0 HB2 MET B 50 14.815 16.543 1.105 1.00 0.00 H new ATOM 0 HB3 MET B 50 14.796 15.205 2.237 1.00 0.00 H new ATOM 0 HG2 MET B 50 14.948 13.709 0.084 1.00 0.00 H new ATOM 0 HG3 MET B 50 15.477 15.183 -0.701 1.00 0.00 H new ATOM 0 HE1 MET B 50 17.718 12.689 2.422 1.00 0.00 H new ATOM 0 HE2 MET B 50 16.373 13.674 3.046 1.00 0.00 H new ATOM 0 HE3 MET B 50 16.071 12.448 1.792 1.00 0.00 H new ATOM 2772 N ARG B 51 11.277 16.902 1.490 1.00 0.00 N ATOM 2773 CA ARG B 51 10.464 17.750 2.354 1.00 0.00 C ATOM 2774 C ARG B 51 9.160 17.051 2.718 1.00 0.00 C ATOM 2775 O ARG B 51 8.651 17.200 3.829 1.00 0.00 O ATOM 2776 CB ARG B 51 10.170 19.083 1.664 1.00 0.00 C ATOM 2777 CG ARG B 51 9.750 18.936 0.210 1.00 0.00 C ATOM 2778 CD ARG B 51 8.619 19.889 -0.142 1.00 0.00 C ATOM 2779 NE ARG B 51 7.764 19.355 -1.198 1.00 0.00 N ATOM 2780 CZ ARG B 51 8.069 19.408 -2.491 1.00 0.00 C ATOM 2781 NH1 ARG B 51 9.203 19.972 -2.883 1.00 0.00 N ATOM 2782 NH2 ARG B 51 7.241 18.898 -3.392 1.00 0.00 N ATOM 0 H ARG B 51 11.014 16.926 0.505 1.00 0.00 H new ATOM 0 HA ARG B 51 11.022 17.942 3.270 1.00 0.00 H new ATOM 0 HB2 ARG B 51 9.381 19.599 2.211 1.00 0.00 H new ATOM 0 HB3 ARG B 51 11.058 19.713 1.715 1.00 0.00 H new ATOM 0 HG2 ARG B 51 10.605 19.129 -0.438 1.00 0.00 H new ATOM 0 HG3 ARG B 51 9.434 17.910 0.023 1.00 0.00 H new ATOM 0 HD2 ARG B 51 8.019 20.084 0.747 1.00 0.00 H new ATOM 0 HD3 ARG B 51 9.036 20.844 -0.461 1.00 0.00 H new ATOM 0 HE ARG B 51 6.883 18.917 -0.929 1.00 0.00 H new ATOM 0 HH11 ARG B 51 9.842 20.366 -2.192 1.00 0.00 H new ATOM 0 HH12 ARG B 51 9.436 20.012 -3.875 1.00 0.00 H new ATOM 0 HH21 ARG B 51 6.368 18.464 -3.094 1.00 0.00 H new ATOM 0 HH22 ARG B 51 7.477 18.940 -4.383 1.00 0.00 H new ATOM 2796 N ARG B 52 8.627 16.282 1.774 1.00 0.00 N ATOM 2797 CA ARG B 52 7.384 15.552 1.991 1.00 0.00 C ATOM 2798 C ARG B 52 7.668 14.125 2.448 1.00 0.00 C ATOM 2799 O ARG B 52 6.845 13.499 3.117 1.00 0.00 O ATOM 2800 CB ARG B 52 6.547 15.535 0.710 1.00 0.00 C ATOM 2801 CG ARG B 52 5.072 15.260 0.949 1.00 0.00 C ATOM 2802 CD ARG B 52 4.192 16.291 0.261 1.00 0.00 C ATOM 2803 NE ARG B 52 4.559 17.655 0.628 1.00 0.00 N ATOM 2804 CZ ARG B 52 4.012 18.736 0.081 1.00 0.00 C ATOM 2805 NH1 ARG B 52 3.076 18.611 -0.849 1.00 0.00 N ATOM 2806 NH2 ARG B 52 4.402 19.945 0.466 1.00 0.00 N ATOM 0 H ARG B 52 9.038 16.148 0.850 1.00 0.00 H new ATOM 0 HA ARG B 52 6.822 16.061 2.774 1.00 0.00 H new ATOM 0 HB2 ARG B 52 6.652 16.495 0.205 1.00 0.00 H new ATOM 0 HB3 ARG B 52 6.945 14.776 0.036 1.00 0.00 H new ATOM 0 HG2 ARG B 52 4.823 14.265 0.581 1.00 0.00 H new ATOM 0 HG3 ARG B 52 4.869 15.264 2.020 1.00 0.00 H new ATOM 0 HD2 ARG B 52 4.272 16.172 -0.820 1.00 0.00 H new ATOM 0 HD3 ARG B 52 3.150 16.112 0.525 1.00 0.00 H new ATOM 0 HE ARG B 52 5.274 17.786 1.343 1.00 0.00 H new ATOM 0 HH11 ARG B 52 2.774 17.683 -1.147 1.00 0.00 H new ATOM 0 HH12 ARG B 52 2.658 19.442 -1.267 1.00 0.00 H new ATOM 0 HH21 ARG B 52 5.122 20.045 1.182 1.00 0.00 H new ATOM 0 HH22 ARG B 52 3.982 20.774 0.046 1.00 0.00 H new ATOM 2820 N LEU B 53 8.842 13.615 2.085 1.00 0.00 N ATOM 2821 CA LEU B 53 9.239 12.262 2.457 1.00 0.00 C ATOM 2822 C LEU B 53 10.518 12.280 3.286 1.00 0.00 C ATOM 2823 O LEU B 53 11.431 13.061 3.020 1.00 0.00 O ATOM 2824 CB LEU B 53 9.443 11.406 1.205 1.00 0.00 C ATOM 2825 CG LEU B 53 8.470 11.693 0.060 1.00 0.00 C ATOM 2826 CD1 LEU B 53 9.099 11.327 -1.277 1.00 0.00 C ATOM 2827 CD2 LEU B 53 7.170 10.930 0.264 1.00 0.00 C ATOM 0 H LEU B 53 9.535 14.120 1.533 1.00 0.00 H new ATOM 0 HA LEU B 53 8.441 11.829 3.060 1.00 0.00 H new ATOM 0 HB2 LEU B 53 10.460 11.555 0.843 1.00 0.00 H new ATOM 0 HB3 LEU B 53 9.354 10.356 1.483 1.00 0.00 H new ATOM 0 HG LEU B 53 8.247 12.760 0.055 1.00 0.00 H new ATOM 0 HD11 LEU B 53 8.393 11.537 -2.081 1.00 0.00 H new ATOM 0 HD12 LEU B 53 10.005 11.915 -1.426 1.00 0.00 H new ATOM 0 HD13 LEU B 53 9.350 10.266 -1.283 1.00 0.00 H new ATOM 0 HD21 LEU B 53 6.489 11.145 -0.559 1.00 0.00 H new ATOM 0 HD22 LEU B 53 7.377 9.860 0.294 1.00 0.00 H new ATOM 0 HD23 LEU B 53 6.712 11.237 1.204 1.00 0.00 H new ATOM 2839 N SER B 54 10.578 11.416 4.294 1.00 0.00 N ATOM 2840 CA SER B 54 11.747 11.335 5.163 1.00 0.00 C ATOM 2841 C SER B 54 12.168 9.885 5.380 1.00 0.00 C ATOM 2842 O SER B 54 11.469 9.119 6.043 1.00 0.00 O ATOM 2843 CB SER B 54 11.456 12.001 6.508 1.00 0.00 C ATOM 2844 OG SER B 54 10.473 11.282 7.232 1.00 0.00 O ATOM 0 H SER B 54 9.831 10.762 4.529 1.00 0.00 H new ATOM 0 HA SER B 54 12.567 11.861 4.674 1.00 0.00 H new ATOM 0 HB2 SER B 54 12.373 12.060 7.094 1.00 0.00 H new ATOM 0 HB3 SER B 54 11.116 13.024 6.345 1.00 0.00 H new ATOM 0 HG SER B 54 10.543 10.328 7.020 1.00 0.00 H new ATOM 2850 N VAL B 55 13.314 9.516 4.817 1.00 0.00 N ATOM 2851 CA VAL B 55 13.828 8.161 4.949 1.00 0.00 C ATOM 2852 C VAL B 55 14.929 8.093 6.001 1.00 0.00 C ATOM 2853 O VAL B 55 15.943 8.784 5.898 1.00 0.00 O ATOM 2854 CB VAL B 55 14.380 7.632 3.611 1.00 0.00 C ATOM 2855 CG1 VAL B 55 13.263 7.037 2.770 1.00 0.00 C ATOM 2856 CG2 VAL B 55 15.105 8.732 2.848 1.00 0.00 C ATOM 0 H VAL B 55 13.904 10.139 4.265 1.00 0.00 H new ATOM 0 HA VAL B 55 12.991 7.536 5.258 1.00 0.00 H new ATOM 0 HB VAL B 55 15.101 6.844 3.829 1.00 0.00 H new ATOM 0 HG11 VAL B 55 13.672 6.669 1.829 1.00 0.00 H new ATOM 0 HG12 VAL B 55 12.800 6.212 3.312 1.00 0.00 H new ATOM 0 HG13 VAL B 55 12.515 7.802 2.565 1.00 0.00 H new ATOM 0 HG21 VAL B 55 15.485 8.333 1.908 1.00 0.00 H new ATOM 0 HG22 VAL B 55 14.413 9.549 2.642 1.00 0.00 H new ATOM 0 HG23 VAL B 55 15.937 9.103 3.447 1.00 0.00 H new ATOM 2866 N ASP B 56 14.722 7.259 7.014 1.00 0.00 N ATOM 2867 CA ASP B 56 15.700 7.105 8.086 1.00 0.00 C ATOM 2868 C ASP B 56 15.789 5.643 8.539 1.00 0.00 C ATOM 2869 O ASP B 56 14.765 5.011 8.799 1.00 0.00 O ATOM 2870 CB ASP B 56 15.322 7.991 9.274 1.00 0.00 C ATOM 2871 CG ASP B 56 16.468 8.165 10.252 1.00 0.00 C ATOM 2872 OD1 ASP B 56 17.569 8.559 9.812 1.00 0.00 O ATOM 2873 OD2 ASP B 56 16.265 7.907 11.457 1.00 0.00 O ATOM 0 H ASP B 56 13.888 6.680 7.116 1.00 0.00 H new ATOM 0 HA ASP B 56 16.674 7.410 7.703 1.00 0.00 H new ATOM 0 HB2 ASP B 56 15.007 8.969 8.909 1.00 0.00 H new ATOM 0 HB3 ASP B 56 14.468 7.554 9.792 1.00 0.00 H new ATOM 2878 N PRO B 57 17.011 5.078 8.646 1.00 0.00 N ATOM 2879 CA PRO B 57 18.265 5.785 8.349 1.00 0.00 C ATOM 2880 C PRO B 57 18.451 6.019 6.851 1.00 0.00 C ATOM 2881 O PRO B 57 18.128 5.154 6.037 1.00 0.00 O ATOM 2882 CB PRO B 57 19.341 4.839 8.882 1.00 0.00 C ATOM 2883 CG PRO B 57 18.722 3.487 8.806 1.00 0.00 C ATOM 2884 CD PRO B 57 17.255 3.687 9.069 1.00 0.00 C ATOM 0 HA PRO B 57 18.294 6.777 8.800 1.00 0.00 H new ATOM 0 HB2 PRO B 57 20.249 4.894 8.282 1.00 0.00 H new ATOM 0 HB3 PRO B 57 19.619 5.091 9.905 1.00 0.00 H new ATOM 0 HG2 PRO B 57 18.885 3.038 7.826 1.00 0.00 H new ATOM 0 HG3 PRO B 57 19.162 2.814 9.542 1.00 0.00 H new ATOM 0 HD2 PRO B 57 16.647 2.983 8.501 1.00 0.00 H new ATOM 0 HD3 PRO B 57 17.013 3.540 10.122 1.00 0.00 H new ATOM 2892 N PRO B 58 18.976 7.195 6.463 1.00 0.00 N ATOM 2893 CA PRO B 58 19.201 7.530 5.052 1.00 0.00 C ATOM 2894 C PRO B 58 20.288 6.669 4.421 1.00 0.00 C ATOM 2895 O PRO B 58 20.173 6.249 3.271 1.00 0.00 O ATOM 2896 CB PRO B 58 19.638 8.997 5.097 1.00 0.00 C ATOM 2897 CG PRO B 58 20.193 9.186 6.466 1.00 0.00 C ATOM 2898 CD PRO B 58 19.392 8.285 7.364 1.00 0.00 C ATOM 0 HA PRO B 58 18.312 7.357 4.446 1.00 0.00 H new ATOM 0 HB2 PRO B 58 20.386 9.211 4.334 1.00 0.00 H new ATOM 0 HB3 PRO B 58 18.797 9.666 4.915 1.00 0.00 H new ATOM 0 HG2 PRO B 58 21.251 8.928 6.497 1.00 0.00 H new ATOM 0 HG3 PRO B 58 20.109 10.226 6.781 1.00 0.00 H new ATOM 0 HD2 PRO B 58 19.988 7.913 8.197 1.00 0.00 H new ATOM 0 HD3 PRO B 58 18.534 8.803 7.792 1.00 0.00 H new ATOM 2906 N CYS B 59 21.342 6.409 5.184 1.00 0.00 N ATOM 2907 CA CYS B 59 22.453 5.596 4.705 1.00 0.00 C ATOM 2908 C CYS B 59 22.926 4.639 5.794 1.00 0.00 C ATOM 2909 O CYS B 59 22.553 4.778 6.959 1.00 0.00 O ATOM 2910 CB CYS B 59 23.612 6.489 4.257 1.00 0.00 C ATOM 2911 SG CYS B 59 23.121 7.841 3.162 1.00 0.00 S ATOM 0 H CYS B 59 21.451 6.750 6.139 1.00 0.00 H new ATOM 0 HA CYS B 59 22.106 5.012 3.853 1.00 0.00 H new ATOM 0 HB2 CYS B 59 24.096 6.908 5.139 1.00 0.00 H new ATOM 0 HB3 CYS B 59 24.354 5.874 3.748 1.00 0.00 H new ATOM 0 HG CYS B 59 24.168 8.540 2.840 1.00 0.00 H new ATOM 2917 N GLY B 60 23.747 3.667 5.412 1.00 0.00 N ATOM 2918 CA GLY B 60 24.250 2.706 6.376 1.00 0.00 C ATOM 2919 C GLY B 60 25.057 1.598 5.730 1.00 0.00 C ATOM 2920 O GLY B 60 25.405 1.675 4.553 1.00 0.00 O ATOM 0 H GLY B 60 24.072 3.527 4.455 1.00 0.00 H new ATOM 0 HA2 GLY B 60 24.871 3.223 7.108 1.00 0.00 H new ATOM 0 HA3 GLY B 60 23.412 2.270 6.920 1.00 0.00 H new ATOM 2924 N VAL B 61 25.353 0.562 6.508 1.00 0.00 N ATOM 2925 CA VAL B 61 26.123 -0.573 6.012 1.00 0.00 C ATOM 2926 C VAL B 61 25.738 -1.851 6.749 1.00 0.00 C ATOM 2927 O VAL B 61 25.545 -1.841 7.965 1.00 0.00 O ATOM 2928 CB VAL B 61 27.637 -0.335 6.169 1.00 0.00 C ATOM 2929 CG1 VAL B 61 28.005 -0.175 7.635 1.00 0.00 C ATOM 2930 CG2 VAL B 61 28.426 -1.471 5.534 1.00 0.00 C ATOM 0 H VAL B 61 25.071 0.485 7.485 1.00 0.00 H new ATOM 0 HA VAL B 61 25.891 -0.681 4.952 1.00 0.00 H new ATOM 0 HB VAL B 61 27.895 0.589 5.652 1.00 0.00 H new ATOM 0 HG11 VAL B 61 29.078 -0.008 7.725 1.00 0.00 H new ATOM 0 HG12 VAL B 61 27.469 0.677 8.054 1.00 0.00 H new ATOM 0 HG13 VAL B 61 27.732 -1.079 8.179 1.00 0.00 H new ATOM 0 HG21 VAL B 61 29.493 -1.285 5.655 1.00 0.00 H new ATOM 0 HG22 VAL B 61 28.164 -2.411 6.019 1.00 0.00 H new ATOM 0 HG23 VAL B 61 28.186 -1.531 4.472 1.00 0.00 H new ATOM 2940 N LEU B 62 25.626 -2.950 6.010 1.00 0.00 N ATOM 2941 CA LEU B 62 25.261 -4.230 6.608 1.00 0.00 C ATOM 2942 C LEU B 62 26.159 -5.353 6.099 1.00 0.00 C ATOM 2943 O LEU B 62 26.671 -5.295 4.982 1.00 0.00 O ATOM 2944 CB LEU B 62 23.794 -4.557 6.315 1.00 0.00 C ATOM 2945 CG LEU B 62 23.435 -4.678 4.833 1.00 0.00 C ATOM 2946 CD1 LEU B 62 22.272 -5.638 4.642 1.00 0.00 C ATOM 2947 CD2 LEU B 62 23.102 -3.311 4.253 1.00 0.00 C ATOM 0 H LEU B 62 25.782 -2.981 5.002 1.00 0.00 H new ATOM 0 HA LEU B 62 25.398 -4.146 7.686 1.00 0.00 H new ATOM 0 HB2 LEU B 62 23.542 -5.494 6.811 1.00 0.00 H new ATOM 0 HB3 LEU B 62 23.170 -3.783 6.761 1.00 0.00 H new ATOM 0 HG LEU B 62 24.298 -5.077 4.300 1.00 0.00 H new ATOM 0 HD11 LEU B 62 22.031 -5.711 3.582 1.00 0.00 H new ATOM 0 HD12 LEU B 62 22.547 -6.623 5.020 1.00 0.00 H new ATOM 0 HD13 LEU B 62 21.403 -5.270 5.187 1.00 0.00 H new ATOM 0 HD21 LEU B 62 22.849 -3.415 3.198 1.00 0.00 H new ATOM 0 HD22 LEU B 62 22.254 -2.885 4.789 1.00 0.00 H new ATOM 0 HD23 LEU B 62 23.964 -2.652 4.356 1.00 0.00 H new ATOM 2959 N ASP B 63 26.344 -6.373 6.931 1.00 0.00 N ATOM 2960 CA ASP B 63 27.180 -7.514 6.572 1.00 0.00 C ATOM 2961 C ASP B 63 26.388 -8.534 5.760 1.00 0.00 C ATOM 2962 O ASP B 63 25.194 -8.356 5.517 1.00 0.00 O ATOM 2963 CB ASP B 63 27.742 -8.175 7.833 1.00 0.00 C ATOM 2964 CG ASP B 63 29.223 -7.901 8.018 1.00 0.00 C ATOM 2965 OD1 ASP B 63 29.916 -7.680 7.004 1.00 0.00 O ATOM 2966 OD2 ASP B 63 29.687 -7.908 9.177 1.00 0.00 O ATOM 0 H ASP B 63 25.926 -6.433 7.859 1.00 0.00 H new ATOM 0 HA ASP B 63 28.006 -7.151 5.960 1.00 0.00 H new ATOM 0 HB2 ASP B 63 27.196 -7.812 8.704 1.00 0.00 H new ATOM 0 HB3 ASP B 63 27.578 -9.251 7.780 1.00 0.00 H new ATOM 2971 N PRO B 64 27.046 -9.621 5.320 1.00 0.00 N ATOM 2972 CA PRO B 64 26.401 -10.673 4.526 1.00 0.00 C ATOM 2973 C PRO B 64 25.276 -11.369 5.286 1.00 0.00 C ATOM 2974 O PRO B 64 25.471 -11.849 6.403 1.00 0.00 O ATOM 2975 CB PRO B 64 27.535 -11.663 4.236 1.00 0.00 C ATOM 2976 CG PRO B 64 28.793 -10.900 4.478 1.00 0.00 C ATOM 2977 CD PRO B 64 28.470 -9.909 5.557 1.00 0.00 C ATOM 0 HA PRO B 64 25.935 -10.267 3.629 1.00 0.00 H new ATOM 0 HB2 PRO B 64 27.472 -12.535 4.887 1.00 0.00 H new ATOM 0 HB3 PRO B 64 27.487 -12.027 3.210 1.00 0.00 H new ATOM 0 HG2 PRO B 64 29.600 -11.565 4.787 1.00 0.00 H new ATOM 0 HG3 PRO B 64 29.125 -10.396 3.571 1.00 0.00 H new ATOM 0 HD2 PRO B 64 28.639 -10.324 6.551 1.00 0.00 H new ATOM 0 HD3 PRO B 64 29.083 -9.011 5.478 1.00 0.00 H new ATOM 2985 N LYS B 65 24.095 -11.424 4.667 1.00 0.00 N ATOM 2986 CA LYS B 65 22.921 -12.067 5.269 1.00 0.00 C ATOM 2987 C LYS B 65 22.204 -11.142 6.255 1.00 0.00 C ATOM 2988 O LYS B 65 21.117 -11.467 6.733 1.00 0.00 O ATOM 2989 CB LYS B 65 23.310 -13.373 5.973 1.00 0.00 C ATOM 2990 CG LYS B 65 22.127 -14.283 6.261 1.00 0.00 C ATOM 2991 CD LYS B 65 22.081 -15.461 5.301 1.00 0.00 C ATOM 2992 CE LYS B 65 20.657 -15.774 4.871 1.00 0.00 C ATOM 2993 NZ LYS B 65 20.094 -14.708 3.997 1.00 0.00 N ATOM 0 H LYS B 65 23.924 -11.028 3.742 1.00 0.00 H new ATOM 0 HA LYS B 65 22.233 -12.292 4.454 1.00 0.00 H new ATOM 0 HB2 LYS B 65 24.029 -13.910 5.354 1.00 0.00 H new ATOM 0 HB3 LYS B 65 23.812 -13.135 6.911 1.00 0.00 H new ATOM 0 HG2 LYS B 65 22.190 -14.650 7.285 1.00 0.00 H new ATOM 0 HG3 LYS B 65 21.201 -13.713 6.183 1.00 0.00 H new ATOM 0 HD2 LYS B 65 22.687 -15.240 4.423 1.00 0.00 H new ATOM 0 HD3 LYS B 65 22.519 -16.338 5.778 1.00 0.00 H new ATOM 0 HE2 LYS B 65 20.639 -16.726 4.340 1.00 0.00 H new ATOM 0 HE3 LYS B 65 20.028 -15.889 5.754 1.00 0.00 H new ATOM 0 HZ1 LYS B 65 19.289 -15.089 3.459 1.00 0.00 H new ATOM 0 HZ2 LYS B 65 19.772 -13.912 4.584 1.00 0.00 H new ATOM 0 HZ3 LYS B 65 20.826 -14.378 3.337 1.00 0.00 H new ATOM 3007 N GLU B 66 22.805 -9.994 6.560 1.00 0.00 N ATOM 3008 CA GLU B 66 22.202 -9.046 7.487 1.00 0.00 C ATOM 3009 C GLU B 66 21.148 -8.197 6.787 1.00 0.00 C ATOM 3010 O GLU B 66 21.174 -8.037 5.567 1.00 0.00 O ATOM 3011 CB GLU B 66 23.275 -8.145 8.101 1.00 0.00 C ATOM 3012 CG GLU B 66 23.731 -8.597 9.479 1.00 0.00 C ATOM 3013 CD GLU B 66 23.645 -7.492 10.514 1.00 0.00 C ATOM 3014 OE1 GLU B 66 22.521 -7.022 10.788 1.00 0.00 O ATOM 3015 OE2 GLU B 66 24.702 -7.095 11.048 1.00 0.00 O ATOM 0 H GLU B 66 23.705 -9.701 6.180 1.00 0.00 H new ATOM 0 HA GLU B 66 21.717 -9.613 8.282 1.00 0.00 H new ATOM 0 HB2 GLU B 66 24.137 -8.113 7.434 1.00 0.00 H new ATOM 0 HB3 GLU B 66 22.888 -7.128 8.170 1.00 0.00 H new ATOM 0 HG2 GLU B 66 23.120 -9.440 9.801 1.00 0.00 H new ATOM 0 HG3 GLU B 66 24.759 -8.954 9.418 1.00 0.00 H new ATOM 3022 N LYS B 67 20.219 -7.657 7.567 1.00 0.00 N ATOM 3023 CA LYS B 67 19.153 -6.826 7.023 1.00 0.00 C ATOM 3024 C LYS B 67 18.979 -5.552 7.845 1.00 0.00 C ATOM 3025 O LYS B 67 19.233 -5.540 9.050 1.00 0.00 O ATOM 3026 CB LYS B 67 17.838 -7.607 6.987 1.00 0.00 C ATOM 3027 CG LYS B 67 17.496 -8.283 8.305 1.00 0.00 C ATOM 3028 CD LYS B 67 18.007 -9.715 8.345 1.00 0.00 C ATOM 3029 CE LYS B 67 17.681 -10.385 9.670 1.00 0.00 C ATOM 3030 NZ LYS B 67 16.527 -11.319 9.549 1.00 0.00 N ATOM 0 H LYS B 67 20.183 -7.780 8.579 1.00 0.00 H new ATOM 0 HA LYS B 67 19.430 -6.545 6.007 1.00 0.00 H new ATOM 0 HB2 LYS B 67 17.029 -6.928 6.716 1.00 0.00 H new ATOM 0 HB3 LYS B 67 17.896 -8.363 6.204 1.00 0.00 H new ATOM 0 HG2 LYS B 67 17.931 -7.717 9.129 1.00 0.00 H new ATOM 0 HG3 LYS B 67 16.416 -8.277 8.449 1.00 0.00 H new ATOM 0 HD2 LYS B 67 17.562 -10.284 7.529 1.00 0.00 H new ATOM 0 HD3 LYS B 67 19.086 -9.722 8.188 1.00 0.00 H new ATOM 0 HE2 LYS B 67 18.555 -10.931 10.026 1.00 0.00 H new ATOM 0 HE3 LYS B 67 17.455 -9.623 10.416 1.00 0.00 H new ATOM 0 HZ1 LYS B 67 16.336 -11.756 10.473 1.00 0.00 H new ATOM 0 HZ2 LYS B 67 15.687 -10.794 9.234 1.00 0.00 H new ATOM 0 HZ3 LYS B 67 16.752 -12.061 8.855 1.00 0.00 H new ATOM 3044 N VAL B 68 18.546 -4.482 7.185 1.00 0.00 N ATOM 3045 CA VAL B 68 18.339 -3.202 7.854 1.00 0.00 C ATOM 3046 C VAL B 68 16.897 -2.729 7.700 1.00 0.00 C ATOM 3047 O VAL B 68 16.223 -3.063 6.725 1.00 0.00 O ATOM 3048 CB VAL B 68 19.283 -2.119 7.300 1.00 0.00 C ATOM 3049 CG1 VAL B 68 20.719 -2.397 7.718 1.00 0.00 C ATOM 3050 CG2 VAL B 68 19.167 -2.032 5.786 1.00 0.00 C ATOM 0 H VAL B 68 18.332 -4.476 6.188 1.00 0.00 H new ATOM 0 HA VAL B 68 18.558 -3.358 8.910 1.00 0.00 H new ATOM 0 HB VAL B 68 18.987 -1.157 7.719 1.00 0.00 H new ATOM 0 HG11 VAL B 68 21.371 -1.621 7.317 1.00 0.00 H new ATOM 0 HG12 VAL B 68 20.787 -2.402 8.806 1.00 0.00 H new ATOM 0 HG13 VAL B 68 21.029 -3.368 7.331 1.00 0.00 H new ATOM 0 HG21 VAL B 68 19.842 -1.261 5.413 1.00 0.00 H new ATOM 0 HG22 VAL B 68 19.434 -2.992 5.345 1.00 0.00 H new ATOM 0 HG23 VAL B 68 18.142 -1.780 5.513 1.00 0.00 H new ATOM 3060 N LEU B 69 16.431 -1.949 8.671 1.00 0.00 N ATOM 3061 CA LEU B 69 15.069 -1.428 8.646 1.00 0.00 C ATOM 3062 C LEU B 69 15.058 0.050 8.267 1.00 0.00 C ATOM 3063 O LEU B 69 15.893 0.827 8.730 1.00 0.00 O ATOM 3064 CB LEU B 69 14.404 -1.619 10.010 1.00 0.00 C ATOM 3065 CG LEU B 69 13.662 -2.943 10.190 1.00 0.00 C ATOM 3066 CD1 LEU B 69 13.226 -3.120 11.636 1.00 0.00 C ATOM 3067 CD2 LEU B 69 12.463 -3.011 9.257 1.00 0.00 C ATOM 0 H LEU B 69 16.977 -1.664 9.484 1.00 0.00 H new ATOM 0 HA LEU B 69 14.509 -1.982 7.893 1.00 0.00 H new ATOM 0 HB2 LEU B 69 15.168 -1.540 10.783 1.00 0.00 H new ATOM 0 HB3 LEU B 69 13.701 -0.802 10.172 1.00 0.00 H new ATOM 0 HG LEU B 69 14.342 -3.756 9.937 1.00 0.00 H new ATOM 0 HD11 LEU B 69 12.700 -4.068 11.744 1.00 0.00 H new ATOM 0 HD12 LEU B 69 14.103 -3.116 12.283 1.00 0.00 H new ATOM 0 HD13 LEU B 69 12.563 -2.303 11.919 1.00 0.00 H new ATOM 0 HD21 LEU B 69 11.946 -3.960 9.398 1.00 0.00 H new ATOM 0 HD22 LEU B 69 11.782 -2.190 9.480 1.00 0.00 H new ATOM 0 HD23 LEU B 69 12.801 -2.932 8.224 1.00 0.00 H new ATOM 3079 N MET B 70 14.104 0.431 7.423 1.00 0.00 N ATOM 3080 CA MET B 70 13.981 1.815 6.981 1.00 0.00 C ATOM 3081 C MET B 70 12.556 2.321 7.170 1.00 0.00 C ATOM 3082 O MET B 70 11.605 1.539 7.182 1.00 0.00 O ATOM 3083 CB MET B 70 14.390 1.940 5.513 1.00 0.00 C ATOM 3084 CG MET B 70 15.770 1.377 5.215 1.00 0.00 C ATOM 3085 SD MET B 70 16.418 1.928 3.627 1.00 0.00 S ATOM 3086 CE MET B 70 15.138 1.345 2.519 1.00 0.00 C ATOM 0 H MET B 70 13.405 -0.200 7.032 1.00 0.00 H new ATOM 0 HA MET B 70 14.647 2.427 7.590 1.00 0.00 H new ATOM 0 HB2 MET B 70 13.655 1.424 4.895 1.00 0.00 H new ATOM 0 HB3 MET B 70 14.366 2.991 5.226 1.00 0.00 H new ATOM 0 HG2 MET B 70 16.458 1.675 6.006 1.00 0.00 H new ATOM 0 HG3 MET B 70 15.724 0.288 5.226 1.00 0.00 H new ATOM 0 HE1 MET B 70 15.467 1.466 1.487 1.00 0.00 H new ATOM 0 HE2 MET B 70 14.939 0.291 2.715 1.00 0.00 H new ATOM 0 HE3 MET B 70 14.227 1.922 2.680 1.00 0.00 H new ATOM 3096 N ALA B 71 12.413 3.633 7.322 1.00 0.00 N ATOM 3097 CA ALA B 71 11.102 4.240 7.513 1.00 0.00 C ATOM 3098 C ALA B 71 10.960 5.522 6.699 1.00 0.00 C ATOM 3099 O ALA B 71 11.688 6.491 6.915 1.00 0.00 O ATOM 3100 CB ALA B 71 10.860 4.525 8.987 1.00 0.00 C ATOM 0 H ALA B 71 13.188 4.296 7.317 1.00 0.00 H new ATOM 0 HA ALA B 71 10.352 3.532 7.160 1.00 0.00 H new ATOM 0 HB1 ALA B 71 9.877 4.978 9.113 1.00 0.00 H new ATOM 0 HB2 ALA B 71 10.905 3.593 9.550 1.00 0.00 H new ATOM 0 HB3 ALA B 71 11.625 5.209 9.356 1.00 0.00 H new ATOM 3106 N VAL B 72 10.014 5.519 5.766 1.00 0.00 N ATOM 3107 CA VAL B 72 9.770 6.682 4.923 1.00 0.00 C ATOM 3108 C VAL B 72 8.481 7.386 5.335 1.00 0.00 C ATOM 3109 O VAL B 72 7.410 7.110 4.796 1.00 0.00 O ATOM 3110 CB VAL B 72 9.678 6.291 3.436 1.00 0.00 C ATOM 3111 CG1 VAL B 72 8.561 5.283 3.216 1.00 0.00 C ATOM 3112 CG2 VAL B 72 9.473 7.524 2.570 1.00 0.00 C ATOM 0 H VAL B 72 9.404 4.724 5.575 1.00 0.00 H new ATOM 0 HA VAL B 72 10.614 7.358 5.057 1.00 0.00 H new ATOM 0 HB VAL B 72 10.619 5.824 3.144 1.00 0.00 H new ATOM 0 HG11 VAL B 72 8.512 5.019 2.160 1.00 0.00 H new ATOM 0 HG12 VAL B 72 8.758 4.387 3.805 1.00 0.00 H new ATOM 0 HG13 VAL B 72 7.611 5.719 3.526 1.00 0.00 H new ATOM 0 HG21 VAL B 72 9.411 7.227 1.523 1.00 0.00 H new ATOM 0 HG22 VAL B 72 8.549 8.024 2.861 1.00 0.00 H new ATOM 0 HG23 VAL B 72 10.312 8.206 2.704 1.00 0.00 H new ATOM 3122 N SER B 73 8.593 8.293 6.301 1.00 0.00 N ATOM 3123 CA SER B 73 7.437 9.031 6.793 1.00 0.00 C ATOM 3124 C SER B 73 6.975 10.072 5.779 1.00 0.00 C ATOM 3125 O SER B 73 7.777 10.849 5.260 1.00 0.00 O ATOM 3126 CB SER B 73 7.769 9.710 8.122 1.00 0.00 C ATOM 3127 OG SER B 73 7.716 8.786 9.195 1.00 0.00 O ATOM 0 H SER B 73 9.473 8.534 6.758 1.00 0.00 H new ATOM 0 HA SER B 73 6.625 8.320 6.946 1.00 0.00 H new ATOM 0 HB2 SER B 73 8.763 10.153 8.069 1.00 0.00 H new ATOM 0 HB3 SER B 73 7.067 10.523 8.304 1.00 0.00 H new ATOM 0 HG SER B 73 7.934 9.245 10.033 1.00 0.00 H new ATOM 3133 N CYS B 74 5.675 10.082 5.505 1.00 0.00 N ATOM 3134 CA CYS B 74 5.097 11.027 4.557 1.00 0.00 C ATOM 3135 C CYS B 74 3.992 11.845 5.217 1.00 0.00 C ATOM 3136 O CYS B 74 2.852 11.395 5.323 1.00 0.00 O ATOM 3137 CB CYS B 74 4.544 10.286 3.339 1.00 0.00 C ATOM 3138 SG CYS B 74 3.456 8.902 3.749 1.00 0.00 S ATOM 0 H CYS B 74 5.000 9.444 5.927 1.00 0.00 H new ATOM 0 HA CYS B 74 5.884 11.707 4.230 1.00 0.00 H new ATOM 0 HB2 CYS B 74 3.996 10.992 2.715 1.00 0.00 H new ATOM 0 HB3 CYS B 74 5.378 9.915 2.743 1.00 0.00 H new ATOM 0 HG CYS B 74 4.160 7.928 4.244 1.00 0.00 H new ATOM 3144 N ASP B 75 4.340 13.049 5.660 1.00 0.00 N ATOM 3145 CA ASP B 75 3.378 13.931 6.314 1.00 0.00 C ATOM 3146 C ASP B 75 2.125 14.103 5.462 1.00 0.00 C ATOM 3147 O ASP B 75 2.185 14.058 4.233 1.00 0.00 O ATOM 3148 CB ASP B 75 4.011 15.296 6.588 1.00 0.00 C ATOM 3149 CG ASP B 75 4.612 15.917 5.343 1.00 0.00 C ATOM 3150 OD1 ASP B 75 3.939 15.910 4.291 1.00 0.00 O ATOM 3151 OD2 ASP B 75 5.757 16.411 5.419 1.00 0.00 O ATOM 0 H ASP B 75 5.280 13.437 5.578 1.00 0.00 H new ATOM 0 HA ASP B 75 3.091 13.472 7.260 1.00 0.00 H new ATOM 0 HB2 ASP B 75 3.256 15.968 6.997 1.00 0.00 H new ATOM 0 HB3 ASP B 75 4.786 15.188 7.347 1.00 0.00 H new ATOM 3156 N THR B 76 0.991 14.300 6.126 1.00 0.00 N ATOM 3157 CA THR B 76 -0.281 14.480 5.439 1.00 0.00 C ATOM 3158 C THR B 76 -0.271 15.756 4.601 1.00 0.00 C ATOM 3159 O THR B 76 0.225 16.794 5.038 1.00 0.00 O ATOM 3160 CB THR B 76 -1.421 14.533 6.452 1.00 0.00 C ATOM 3161 OG1 THR B 76 -1.549 15.833 6.999 1.00 0.00 O ATOM 3162 CG2 THR B 76 -1.247 13.564 7.602 1.00 0.00 C ATOM 0 H THR B 76 0.928 14.339 7.143 1.00 0.00 H new ATOM 0 HA THR B 76 -0.432 13.631 4.772 1.00 0.00 H new ATOM 0 HB THR B 76 -2.314 14.252 5.894 1.00 0.00 H new ATOM 0 HG1 THR B 76 -2.286 15.845 7.644 1.00 0.00 H new ATOM 0 HG21 THR B 76 -2.092 13.654 8.284 1.00 0.00 H new ATOM 0 HG22 THR B 76 -1.199 12.546 7.216 1.00 0.00 H new ATOM 0 HG23 THR B 76 -0.324 13.794 8.135 1.00 0.00 H new ATOM 3170 N PHE B 77 -0.825 15.670 3.395 1.00 0.00 N ATOM 3171 CA PHE B 77 -0.883 16.817 2.497 1.00 0.00 C ATOM 3172 C PHE B 77 -2.050 16.687 1.525 1.00 0.00 C ATOM 3173 O PHE B 77 -2.866 15.773 1.639 1.00 0.00 O ATOM 3174 CB PHE B 77 0.431 16.953 1.723 1.00 0.00 C ATOM 3175 CG PHE B 77 0.673 15.837 0.748 1.00 0.00 C ATOM 3176 CD1 PHE B 77 1.054 14.581 1.194 1.00 0.00 C ATOM 3177 CD2 PHE B 77 0.519 16.043 -0.613 1.00 0.00 C ATOM 3178 CE1 PHE B 77 1.278 13.552 0.300 1.00 0.00 C ATOM 3179 CE2 PHE B 77 0.743 15.018 -1.512 1.00 0.00 C ATOM 3180 CZ PHE B 77 1.122 13.770 -1.055 1.00 0.00 C ATOM 0 H PHE B 77 -1.240 14.818 3.018 1.00 0.00 H new ATOM 0 HA PHE B 77 -1.034 17.712 3.100 1.00 0.00 H new ATOM 0 HB2 PHE B 77 0.429 17.901 1.184 1.00 0.00 H new ATOM 0 HB3 PHE B 77 1.258 16.991 2.432 1.00 0.00 H new ATOM 0 HD1 PHE B 77 1.177 14.405 2.252 1.00 0.00 H new ATOM 0 HD2 PHE B 77 0.221 17.016 -0.976 1.00 0.00 H new ATOM 0 HE1 PHE B 77 1.575 12.578 0.660 1.00 0.00 H new ATOM 0 HE2 PHE B 77 0.622 15.192 -2.571 1.00 0.00 H new ATOM 0 HZ PHE B 77 1.296 12.967 -1.756 1.00 0.00 H new ATOM 3190 N ASN B 78 -2.126 17.609 0.570 1.00 0.00 N ATOM 3191 CA ASN B 78 -3.198 17.595 -0.420 1.00 0.00 C ATOM 3192 C ASN B 78 -2.683 17.120 -1.775 1.00 0.00 C ATOM 3193 O ASN B 78 -1.930 17.826 -2.445 1.00 0.00 O ATOM 3194 CB ASN B 78 -3.814 18.989 -0.555 1.00 0.00 C ATOM 3195 CG ASN B 78 -4.815 19.288 0.544 1.00 0.00 C ATOM 3196 OD1 ASN B 78 -5.854 18.637 0.647 1.00 0.00 O ATOM 3197 ND2 ASN B 78 -4.504 20.277 1.373 1.00 0.00 N ATOM 0 H ASN B 78 -1.460 18.374 0.461 1.00 0.00 H new ATOM 0 HA ASN B 78 -3.964 16.898 -0.079 1.00 0.00 H new ATOM 0 HB2 ASN B 78 -3.021 19.737 -0.534 1.00 0.00 H new ATOM 0 HB3 ASN B 78 -4.306 19.073 -1.524 1.00 0.00 H new ATOM 0 HD21 ASN B 78 -5.138 20.524 2.133 1.00 0.00 H new ATOM 0 HD22 ASN B 78 -3.631 20.790 1.250 1.00 0.00 H new ATOM 3204 N ALA B 79 -3.096 15.921 -2.173 1.00 0.00 N ATOM 3205 CA ALA B 79 -2.679 15.354 -3.448 1.00 0.00 C ATOM 3206 C ALA B 79 -3.714 15.614 -4.539 1.00 0.00 C ATOM 3207 O ALA B 79 -3.726 14.938 -5.568 1.00 0.00 O ATOM 3208 CB ALA B 79 -2.433 13.861 -3.301 1.00 0.00 C ATOM 0 H ALA B 79 -3.719 15.324 -1.630 1.00 0.00 H new ATOM 0 HA ALA B 79 -1.751 15.842 -3.745 1.00 0.00 H new ATOM 0 HB1 ALA B 79 -2.122 13.447 -4.260 1.00 0.00 H new ATOM 0 HB2 ALA B 79 -1.650 13.692 -2.562 1.00 0.00 H new ATOM 0 HB3 ALA B 79 -3.351 13.371 -2.975 1.00 0.00 H new ATOM 3214 N ALA B 80 -4.580 16.596 -4.311 1.00 0.00 N ATOM 3215 CA ALA B 80 -5.616 16.942 -5.277 1.00 0.00 C ATOM 3216 C ALA B 80 -5.112 17.976 -6.276 1.00 0.00 C ATOM 3217 O ALA B 80 -5.628 18.083 -7.388 1.00 0.00 O ATOM 3218 CB ALA B 80 -6.850 17.466 -4.562 1.00 0.00 C ATOM 0 H ALA B 80 -4.585 17.166 -3.465 1.00 0.00 H new ATOM 0 HA ALA B 80 -5.879 16.038 -5.826 1.00 0.00 H new ATOM 0 HB1 ALA B 80 -7.615 17.720 -5.296 1.00 0.00 H new ATOM 0 HB2 ALA B 80 -7.233 16.699 -3.889 1.00 0.00 H new ATOM 0 HB3 ALA B 80 -6.588 18.355 -3.988 1.00 0.00 H new ATOM 3224 N THR B 81 -4.107 18.744 -5.870 1.00 0.00 N ATOM 3225 CA THR B 81 -3.541 19.776 -6.728 1.00 0.00 C ATOM 3226 C THR B 81 -2.020 19.811 -6.615 1.00 0.00 C ATOM 3227 O THR B 81 -1.430 20.864 -6.373 1.00 0.00 O ATOM 3228 CB THR B 81 -4.129 21.135 -6.360 1.00 0.00 C ATOM 3229 OG1 THR B 81 -3.770 21.500 -5.038 1.00 0.00 O ATOM 3230 CG2 THR B 81 -5.638 21.164 -6.454 1.00 0.00 C ATOM 0 H THR B 81 -3.668 18.671 -4.952 1.00 0.00 H new ATOM 0 HA THR B 81 -3.796 19.542 -7.762 1.00 0.00 H new ATOM 0 HB THR B 81 -3.717 21.840 -7.082 1.00 0.00 H new ATOM 0 HG1 THR B 81 -2.796 21.589 -4.976 1.00 0.00 H new ATOM 0 HG21 THR B 81 -6.001 22.155 -6.181 1.00 0.00 H new ATOM 0 HG22 THR B 81 -5.943 20.934 -7.475 1.00 0.00 H new ATOM 0 HG23 THR B 81 -6.059 20.424 -5.774 1.00 0.00 H new ATOM 3238 N GLU B 82 -1.392 18.653 -6.794 1.00 0.00 N ATOM 3239 CA GLU B 82 0.060 18.549 -6.714 1.00 0.00 C ATOM 3240 C GLU B 82 0.595 17.582 -7.765 1.00 0.00 C ATOM 3241 O GLU B 82 -0.175 16.951 -8.491 1.00 0.00 O ATOM 3242 CB GLU B 82 0.485 18.090 -5.318 1.00 0.00 C ATOM 3243 CG GLU B 82 -0.133 18.907 -4.195 1.00 0.00 C ATOM 3244 CD GLU B 82 0.469 20.294 -4.086 1.00 0.00 C ATOM 3245 OE1 GLU B 82 0.917 20.830 -5.122 1.00 0.00 O ATOM 3246 OE2 GLU B 82 0.494 20.845 -2.965 1.00 0.00 O ATOM 0 H GLU B 82 -1.867 17.773 -6.996 1.00 0.00 H new ATOM 0 HA GLU B 82 0.480 19.536 -6.907 1.00 0.00 H new ATOM 0 HB2 GLU B 82 0.209 17.043 -5.189 1.00 0.00 H new ATOM 0 HB3 GLU B 82 1.571 18.145 -5.241 1.00 0.00 H new ATOM 0 HG2 GLU B 82 -1.207 18.993 -4.361 1.00 0.00 H new ATOM 0 HG3 GLU B 82 0.002 18.381 -3.250 1.00 0.00 H new ATOM 3253 N ASP B 83 1.917 17.469 -7.844 1.00 0.00 N ATOM 3254 CA ASP B 83 2.553 16.579 -8.808 1.00 0.00 C ATOM 3255 C ASP B 83 3.057 15.311 -8.127 1.00 0.00 C ATOM 3256 O ASP B 83 3.996 15.353 -7.330 1.00 0.00 O ATOM 3257 CB ASP B 83 3.714 17.292 -9.504 1.00 0.00 C ATOM 3258 CG ASP B 83 3.241 18.283 -10.550 1.00 0.00 C ATOM 3259 OD1 ASP B 83 2.543 19.250 -10.180 1.00 0.00 O ATOM 3260 OD2 ASP B 83 3.571 18.093 -11.740 1.00 0.00 O ATOM 0 H ASP B 83 2.569 17.983 -7.251 1.00 0.00 H new ATOM 0 HA ASP B 83 1.808 16.300 -9.553 1.00 0.00 H new ATOM 0 HB2 ASP B 83 4.315 17.813 -8.759 1.00 0.00 H new ATOM 0 HB3 ASP B 83 4.361 16.552 -9.975 1.00 0.00 H new ATOM 3265 N LEU B 84 2.430 14.183 -8.446 1.00 0.00 N ATOM 3266 CA LEU B 84 2.816 12.903 -7.864 1.00 0.00 C ATOM 3267 C LEU B 84 2.911 11.823 -8.937 1.00 0.00 C ATOM 3268 O LEU B 84 2.199 10.820 -8.885 1.00 0.00 O ATOM 3269 CB LEU B 84 1.811 12.482 -6.790 1.00 0.00 C ATOM 3270 CG LEU B 84 1.508 13.546 -5.734 1.00 0.00 C ATOM 3271 CD1 LEU B 84 0.292 13.149 -4.911 1.00 0.00 C ATOM 3272 CD2 LEU B 84 2.716 13.760 -4.834 1.00 0.00 C ATOM 0 H LEU B 84 1.653 14.130 -9.104 1.00 0.00 H new ATOM 0 HA LEU B 84 3.798 13.023 -7.406 1.00 0.00 H new ATOM 0 HB2 LEU B 84 0.878 12.200 -7.278 1.00 0.00 H new ATOM 0 HB3 LEU B 84 2.190 11.592 -6.288 1.00 0.00 H new ATOM 0 HG LEU B 84 1.287 14.484 -6.242 1.00 0.00 H new ATOM 0 HD11 LEU B 84 0.091 13.918 -4.165 1.00 0.00 H new ATOM 0 HD12 LEU B 84 -0.573 13.045 -5.566 1.00 0.00 H new ATOM 0 HD13 LEU B 84 0.485 12.200 -4.411 1.00 0.00 H new ATOM 0 HD21 LEU B 84 2.484 14.520 -4.088 1.00 0.00 H new ATOM 0 HD22 LEU B 84 2.967 12.825 -4.333 1.00 0.00 H new ATOM 0 HD23 LEU B 84 3.564 14.088 -5.435 1.00 0.00 H new ATOM 3284 N ASN B 85 3.795 12.032 -9.907 1.00 0.00 N ATOM 3285 CA ASN B 85 3.980 11.073 -10.991 1.00 0.00 C ATOM 3286 C ASN B 85 5.451 10.954 -11.384 1.00 0.00 C ATOM 3287 O ASN B 85 5.772 10.452 -12.463 1.00 0.00 O ATOM 3288 CB ASN B 85 3.149 11.484 -12.208 1.00 0.00 C ATOM 3289 CG ASN B 85 1.664 11.266 -11.996 1.00 0.00 C ATOM 3290 OD1 ASN B 85 1.256 10.466 -11.155 1.00 0.00 O ATOM 3291 ND2 ASN B 85 0.847 11.979 -12.763 1.00 0.00 N ATOM 0 H ASN B 85 4.394 12.856 -9.965 1.00 0.00 H new ATOM 0 HA ASN B 85 3.643 10.099 -10.635 1.00 0.00 H new ATOM 0 HB2 ASN B 85 3.331 12.536 -12.430 1.00 0.00 H new ATOM 0 HB3 ASN B 85 3.476 10.914 -13.077 1.00 0.00 H new ATOM 0 HD21 ASN B 85 -0.163 11.875 -12.667 1.00 0.00 H new ATOM 0 HD22 ASN B 85 1.230 12.631 -13.448 1.00 0.00 H new ATOM 3298 N ASN B 86 6.344 11.415 -10.511 1.00 0.00 N ATOM 3299 CA ASN B 86 7.776 11.354 -10.784 1.00 0.00 C ATOM 3300 C ASN B 86 8.578 10.979 -9.536 1.00 0.00 C ATOM 3301 O ASN B 86 9.807 11.064 -9.535 1.00 0.00 O ATOM 3302 CB ASN B 86 8.264 12.699 -11.320 1.00 0.00 C ATOM 3303 CG ASN B 86 8.510 12.674 -12.816 1.00 0.00 C ATOM 3304 OD1 ASN B 86 9.298 11.870 -13.314 1.00 0.00 O ATOM 3305 ND2 ASN B 86 7.833 13.556 -13.542 1.00 0.00 N ATOM 0 H ASN B 86 6.102 11.833 -9.613 1.00 0.00 H new ATOM 0 HA ASN B 86 7.934 10.577 -11.532 1.00 0.00 H new ATOM 0 HB2 ASN B 86 7.526 13.468 -11.089 1.00 0.00 H new ATOM 0 HB3 ASN B 86 9.185 12.978 -10.808 1.00 0.00 H new ATOM 0 HD21 ASN B 86 7.956 13.585 -14.554 1.00 0.00 H new ATOM 0 HD22 ASN B 86 7.190 14.204 -13.088 1.00 0.00 H new ATOM 3312 N ASP B 87 7.888 10.568 -8.476 1.00 0.00 N ATOM 3313 CA ASP B 87 8.553 10.187 -7.236 1.00 0.00 C ATOM 3314 C ASP B 87 9.177 8.801 -7.356 1.00 0.00 C ATOM 3315 O ASP B 87 8.569 7.881 -7.903 1.00 0.00 O ATOM 3316 CB ASP B 87 7.561 10.214 -6.071 1.00 0.00 C ATOM 3317 CG ASP B 87 7.111 11.622 -5.728 1.00 0.00 C ATOM 3318 OD1 ASP B 87 7.881 12.571 -5.986 1.00 0.00 O ATOM 3319 OD2 ASP B 87 5.989 11.773 -5.202 1.00 0.00 O ATOM 0 H ASP B 87 6.871 10.491 -8.452 1.00 0.00 H new ATOM 0 HA ASP B 87 9.348 10.908 -7.044 1.00 0.00 H new ATOM 0 HB2 ASP B 87 6.691 9.609 -6.324 1.00 0.00 H new ATOM 0 HB3 ASP B 87 8.022 9.759 -5.194 1.00 0.00 H new ATOM 3324 N ARG B 88 10.396 8.658 -6.845 1.00 0.00 N ATOM 3325 CA ARG B 88 11.101 7.383 -6.898 1.00 0.00 C ATOM 3326 C ARG B 88 12.267 7.361 -5.915 1.00 0.00 C ATOM 3327 O ARG B 88 13.048 8.309 -5.841 1.00 0.00 O ATOM 3328 CB ARG B 88 11.611 7.116 -8.316 1.00 0.00 C ATOM 3329 CG ARG B 88 12.116 8.362 -9.026 1.00 0.00 C ATOM 3330 CD ARG B 88 12.891 8.008 -10.285 1.00 0.00 C ATOM 3331 NE ARG B 88 13.094 9.170 -11.146 1.00 0.00 N ATOM 3332 CZ ARG B 88 13.990 9.211 -12.127 1.00 0.00 C ATOM 3333 NH1 ARG B 88 14.759 8.159 -12.369 1.00 0.00 N ATOM 3334 NH2 ARG B 88 14.115 10.304 -12.866 1.00 0.00 N ATOM 0 H ARG B 88 10.915 9.409 -6.390 1.00 0.00 H new ATOM 0 HA ARG B 88 10.398 6.599 -6.617 1.00 0.00 H new ATOM 0 HB2 ARG B 88 12.416 6.382 -8.272 1.00 0.00 H new ATOM 0 HB3 ARG B 88 10.808 6.673 -8.905 1.00 0.00 H new ATOM 0 HG2 ARG B 88 11.273 9.002 -9.284 1.00 0.00 H new ATOM 0 HG3 ARG B 88 12.755 8.933 -8.352 1.00 0.00 H new ATOM 0 HD2 ARG B 88 13.858 7.587 -10.009 1.00 0.00 H new ATOM 0 HD3 ARG B 88 12.354 7.237 -10.837 1.00 0.00 H new ATOM 0 HE ARG B 88 12.517 9.995 -10.986 1.00 0.00 H new ATOM 0 HH11 ARG B 88 14.664 7.316 -11.802 1.00 0.00 H new ATOM 0 HH12 ARG B 88 15.446 8.192 -13.122 1.00 0.00 H new ATOM 0 HH21 ARG B 88 13.523 11.114 -12.682 1.00 0.00 H new ATOM 0 HH22 ARG B 88 14.803 10.335 -13.619 1.00 0.00 H new ATOM 3348 N ILE B 89 12.380 6.269 -5.165 1.00 0.00 N ATOM 3349 CA ILE B 89 13.453 6.118 -4.188 1.00 0.00 C ATOM 3350 C ILE B 89 14.611 5.315 -4.771 1.00 0.00 C ATOM 3351 O ILE B 89 14.478 4.120 -5.036 1.00 0.00 O ATOM 3352 CB ILE B 89 12.954 5.423 -2.907 1.00 0.00 C ATOM 3353 CG1 ILE B 89 11.780 6.194 -2.302 1.00 0.00 C ATOM 3354 CG2 ILE B 89 14.085 5.295 -1.896 1.00 0.00 C ATOM 3355 CD1 ILE B 89 11.234 5.568 -1.036 1.00 0.00 C ATOM 0 H ILE B 89 11.741 5.475 -5.215 1.00 0.00 H new ATOM 0 HA ILE B 89 13.797 7.121 -3.935 1.00 0.00 H new ATOM 0 HB ILE B 89 12.610 4.422 -3.169 1.00 0.00 H new ATOM 0 HG12 ILE B 89 12.098 7.214 -2.085 1.00 0.00 H new ATOM 0 HG13 ILE B 89 10.980 6.260 -3.040 1.00 0.00 H new ATOM 0 HG21 ILE B 89 13.715 4.802 -0.997 1.00 0.00 H new ATOM 0 HG22 ILE B 89 14.893 4.705 -2.327 1.00 0.00 H new ATOM 0 HG23 ILE B 89 14.457 6.287 -1.639 1.00 0.00 H new ATOM 0 HD11 ILE B 89 10.404 6.167 -0.662 1.00 0.00 H new ATOM 0 HD12 ILE B 89 10.885 4.558 -1.251 1.00 0.00 H new ATOM 0 HD13 ILE B 89 12.020 5.527 -0.282 1.00 0.00 H new ATOM 3367 N THR B 90 15.745 5.978 -4.976 1.00 0.00 N ATOM 3368 CA THR B 90 16.921 5.323 -5.534 1.00 0.00 C ATOM 3369 C THR B 90 17.852 4.819 -4.432 1.00 0.00 C ATOM 3370 O THR B 90 18.314 5.592 -3.594 1.00 0.00 O ATOM 3371 CB THR B 90 17.676 6.284 -6.454 1.00 0.00 C ATOM 3372 OG1 THR B 90 16.842 6.724 -7.510 1.00 0.00 O ATOM 3373 CG2 THR B 90 18.915 5.672 -7.072 1.00 0.00 C ATOM 0 H THR B 90 15.873 6.967 -4.764 1.00 0.00 H new ATOM 0 HA THR B 90 16.581 4.463 -6.112 1.00 0.00 H new ATOM 0 HB THR B 90 17.980 7.115 -5.818 1.00 0.00 H new ATOM 0 HG1 THR B 90 17.341 7.339 -8.087 1.00 0.00 H new ATOM 0 HG21 THR B 90 19.403 6.407 -7.713 1.00 0.00 H new ATOM 0 HG22 THR B 90 19.602 5.366 -6.283 1.00 0.00 H new ATOM 0 HG23 THR B 90 18.634 4.802 -7.666 1.00 0.00 H new ATOM 3381 N ILE B 91 18.124 3.518 -4.448 1.00 0.00 N ATOM 3382 CA ILE B 91 19.002 2.904 -3.460 1.00 0.00 C ATOM 3383 C ILE B 91 20.302 2.435 -4.105 1.00 0.00 C ATOM 3384 O ILE B 91 20.311 1.476 -4.876 1.00 0.00 O ATOM 3385 CB ILE B 91 18.324 1.703 -2.774 1.00 0.00 C ATOM 3386 CG1 ILE B 91 16.958 2.108 -2.218 1.00 0.00 C ATOM 3387 CG2 ILE B 91 19.212 1.153 -1.667 1.00 0.00 C ATOM 3388 CD1 ILE B 91 15.842 2.020 -3.237 1.00 0.00 C ATOM 0 H ILE B 91 17.747 2.867 -5.137 1.00 0.00 H new ATOM 0 HA ILE B 91 19.219 3.665 -2.711 1.00 0.00 H new ATOM 0 HB ILE B 91 18.174 0.918 -3.516 1.00 0.00 H new ATOM 0 HG12 ILE B 91 16.716 1.468 -1.369 1.00 0.00 H new ATOM 0 HG13 ILE B 91 17.016 3.129 -1.841 1.00 0.00 H new ATOM 0 HG21 ILE B 91 18.719 0.305 -1.192 1.00 0.00 H new ATOM 0 HG22 ILE B 91 20.163 0.829 -2.090 1.00 0.00 H new ATOM 0 HG23 ILE B 91 19.392 1.930 -0.924 1.00 0.00 H new ATOM 0 HD11 ILE B 91 14.902 2.321 -2.774 1.00 0.00 H new ATOM 0 HD12 ILE B 91 16.062 2.681 -4.075 1.00 0.00 H new ATOM 0 HD13 ILE B 91 15.757 0.994 -3.596 1.00 0.00 H new ATOM 3400 N GLU B 92 21.397 3.118 -3.787 1.00 0.00 N ATOM 3401 CA GLU B 92 22.702 2.769 -4.340 1.00 0.00 C ATOM 3402 C GLU B 92 23.626 2.222 -3.259 1.00 0.00 C ATOM 3403 O GLU B 92 23.758 2.810 -2.186 1.00 0.00 O ATOM 3404 CB GLU B 92 23.342 3.992 -5.001 1.00 0.00 C ATOM 3405 CG GLU B 92 23.285 5.246 -4.145 1.00 0.00 C ATOM 3406 CD GLU B 92 24.233 6.325 -4.629 1.00 0.00 C ATOM 3407 OE1 GLU B 92 25.299 5.976 -5.178 1.00 0.00 O ATOM 3408 OE2 GLU B 92 23.909 7.519 -4.459 1.00 0.00 O ATOM 0 H GLU B 92 21.407 3.915 -3.151 1.00 0.00 H new ATOM 0 HA GLU B 92 22.553 1.993 -5.090 1.00 0.00 H new ATOM 0 HB2 GLU B 92 24.383 3.767 -5.232 1.00 0.00 H new ATOM 0 HB3 GLU B 92 22.840 4.186 -5.949 1.00 0.00 H new ATOM 0 HG2 GLU B 92 22.267 5.635 -4.145 1.00 0.00 H new ATOM 0 HG3 GLU B 92 23.528 4.989 -3.114 1.00 0.00 H new ATOM 3415 N TRP B 93 24.268 1.094 -3.548 1.00 0.00 N ATOM 3416 CA TRP B 93 25.181 0.472 -2.596 1.00 0.00 C ATOM 3417 C TRP B 93 26.454 -0.003 -3.289 1.00 0.00 C ATOM 3418 O TRP B 93 26.414 -0.501 -4.414 1.00 0.00 O ATOM 3419 CB TRP B 93 24.498 -0.705 -1.892 1.00 0.00 C ATOM 3420 CG TRP B 93 24.288 -1.893 -2.779 1.00 0.00 C ATOM 3421 CD1 TRP B 93 24.924 -3.099 -2.702 1.00 0.00 C ATOM 3422 CD2 TRP B 93 23.378 -1.988 -3.880 1.00 0.00 C ATOM 3423 NE1 TRP B 93 24.465 -3.938 -3.688 1.00 0.00 N ATOM 3424 CE2 TRP B 93 23.514 -3.279 -4.425 1.00 0.00 C ATOM 3425 CE3 TRP B 93 22.459 -1.107 -4.458 1.00 0.00 C ATOM 3426 CZ2 TRP B 93 22.767 -3.709 -5.519 1.00 0.00 C ATOM 3427 CZ3 TRP B 93 21.718 -1.535 -5.543 1.00 0.00 C ATOM 3428 CH2 TRP B 93 21.875 -2.826 -6.064 1.00 0.00 C ATOM 0 H TRP B 93 24.173 0.593 -4.432 1.00 0.00 H new ATOM 0 HA TRP B 93 25.453 1.221 -1.853 1.00 0.00 H new ATOM 0 HB2 TRP B 93 25.101 -1.004 -1.034 1.00 0.00 H new ATOM 0 HB3 TRP B 93 23.534 -0.376 -1.505 1.00 0.00 H new ATOM 0 HD1 TRP B 93 25.678 -3.356 -1.972 1.00 0.00 H new ATOM 0 HE1 TRP B 93 24.780 -4.895 -3.846 1.00 0.00 H new ATOM 0 HE3 TRP B 93 22.331 -0.110 -4.064 1.00 0.00 H new ATOM 0 HZ2 TRP B 93 22.887 -4.703 -5.923 1.00 0.00 H new ATOM 0 HZ3 TRP B 93 21.005 -0.863 -5.997 1.00 0.00 H new ATOM 0 HH2 TRP B 93 21.280 -3.130 -6.913 1.00 0.00 H new ATOM 3439 N THR B 94 27.586 0.153 -2.608 1.00 0.00 N ATOM 3440 CA THR B 94 28.872 -0.260 -3.156 1.00 0.00 C ATOM 3441 C THR B 94 29.659 -1.079 -2.138 1.00 0.00 C ATOM 3442 O THR B 94 29.598 -0.819 -0.936 1.00 0.00 O ATOM 3443 CB THR B 94 29.686 0.962 -3.584 1.00 0.00 C ATOM 3444 OG1 THR B 94 31.036 0.607 -3.823 1.00 0.00 O ATOM 3445 CG2 THR B 94 29.680 2.075 -2.558 1.00 0.00 C ATOM 0 H THR B 94 27.638 0.563 -1.675 1.00 0.00 H new ATOM 0 HA THR B 94 28.682 -0.884 -4.029 1.00 0.00 H new ATOM 0 HB THR B 94 29.206 1.324 -4.493 1.00 0.00 H new ATOM 0 HG1 THR B 94 31.540 1.402 -4.097 1.00 0.00 H new ATOM 0 HG21 THR B 94 30.276 2.911 -2.925 1.00 0.00 H new ATOM 0 HG22 THR B 94 28.656 2.407 -2.387 1.00 0.00 H new ATOM 0 HG23 THR B 94 30.104 1.710 -1.623 1.00 0.00 H new ATOM 3453 N ASN B 95 30.398 -2.070 -2.625 1.00 0.00 N ATOM 3454 CA ASN B 95 31.197 -2.926 -1.756 1.00 0.00 C ATOM 3455 C ASN B 95 32.135 -2.095 -0.887 1.00 0.00 C ATOM 3456 O ASN B 95 32.676 -1.083 -1.332 1.00 0.00 O ATOM 3457 CB ASN B 95 32.005 -3.923 -2.589 1.00 0.00 C ATOM 3458 CG ASN B 95 31.300 -5.258 -2.737 1.00 0.00 C ATOM 3459 OD1 ASN B 95 30.085 -5.312 -2.933 1.00 0.00 O ATOM 3460 ND2 ASN B 95 32.060 -6.342 -2.645 1.00 0.00 N ATOM 0 H ASN B 95 30.460 -2.300 -3.617 1.00 0.00 H new ATOM 0 HA ASN B 95 30.517 -3.475 -1.104 1.00 0.00 H new ATOM 0 HB2 ASN B 95 32.190 -3.501 -3.577 1.00 0.00 H new ATOM 0 HB3 ASN B 95 32.977 -4.079 -2.122 1.00 0.00 H new ATOM 0 HD21 ASN B 95 31.642 -7.268 -2.737 1.00 0.00 H new ATOM 0 HD22 ASN B 95 33.063 -6.250 -2.482 1.00 0.00 H new ATOM 3467 N THR B 96 32.324 -2.529 0.354 1.00 0.00 N ATOM 3468 CA THR B 96 33.197 -1.826 1.286 1.00 0.00 C ATOM 3469 C THR B 96 34.661 -2.170 1.026 1.00 0.00 C ATOM 3470 O THR B 96 34.988 -3.303 0.673 1.00 0.00 O ATOM 3471 CB THR B 96 32.825 -2.176 2.727 1.00 0.00 C ATOM 3472 OG1 THR B 96 32.409 -3.526 2.824 1.00 0.00 O ATOM 3473 CG2 THR B 96 31.715 -1.313 3.286 1.00 0.00 C ATOM 0 H THR B 96 31.884 -3.365 0.738 1.00 0.00 H new ATOM 0 HA THR B 96 33.063 -0.755 1.134 1.00 0.00 H new ATOM 0 HB THR B 96 33.729 -1.998 3.309 1.00 0.00 H new ATOM 0 HG1 THR B 96 33.179 -4.116 2.688 1.00 0.00 H new ATOM 0 HG21 THR B 96 31.501 -1.615 4.311 1.00 0.00 H new ATOM 0 HG22 THR B 96 32.025 -0.268 3.272 1.00 0.00 H new ATOM 0 HG23 THR B 96 30.819 -1.434 2.678 1.00 0.00 H new ATOM 3481 N PRO B 97 35.568 -1.193 1.202 1.00 0.00 N ATOM 3482 CA PRO B 97 37.004 -1.398 0.986 1.00 0.00 C ATOM 3483 C PRO B 97 37.614 -2.337 2.020 1.00 0.00 C ATOM 3484 O PRO B 97 37.056 -2.534 3.100 1.00 0.00 O ATOM 3485 CB PRO B 97 37.594 0.008 1.126 1.00 0.00 C ATOM 3486 CG PRO B 97 36.613 0.752 1.964 1.00 0.00 C ATOM 3487 CD PRO B 97 35.263 0.187 1.625 1.00 0.00 C ATOM 0 HA PRO B 97 37.208 -1.863 0.021 1.00 0.00 H new ATOM 0 HB2 PRO B 97 38.576 -0.021 1.598 1.00 0.00 H new ATOM 0 HB3 PRO B 97 37.722 0.482 0.153 1.00 0.00 H new ATOM 0 HG2 PRO B 97 36.833 0.627 3.024 1.00 0.00 H new ATOM 0 HG3 PRO B 97 36.652 1.821 1.754 1.00 0.00 H new ATOM 0 HD2 PRO B 97 34.592 0.205 2.484 1.00 0.00 H new ATOM 0 HD3 PRO B 97 34.778 0.753 0.830 1.00 0.00 H new ATOM 3495 N ASP B 98 38.760 -2.917 1.682 1.00 0.00 N ATOM 3496 CA ASP B 98 39.446 -3.836 2.582 1.00 0.00 C ATOM 3497 C ASP B 98 39.624 -3.217 3.965 1.00 0.00 C ATOM 3498 O ASP B 98 40.201 -2.139 4.103 1.00 0.00 O ATOM 3499 CB ASP B 98 40.810 -4.224 2.007 1.00 0.00 C ATOM 3500 CG ASP B 98 41.661 -3.015 1.671 1.00 0.00 C ATOM 3501 OD1 ASP B 98 41.148 -1.881 1.775 1.00 0.00 O ATOM 3502 OD2 ASP B 98 42.840 -3.203 1.304 1.00 0.00 O ATOM 0 H ASP B 98 39.234 -2.767 0.791 1.00 0.00 H new ATOM 0 HA ASP B 98 38.831 -4.731 2.681 1.00 0.00 H new ATOM 0 HB2 ASP B 98 41.340 -4.849 2.726 1.00 0.00 H new ATOM 0 HB3 ASP B 98 40.665 -4.824 1.109 1.00 0.00 H new ATOM 3507 N GLY B 99 39.125 -3.907 4.986 1.00 0.00 N ATOM 3508 CA GLY B 99 39.240 -3.409 6.344 1.00 0.00 C ATOM 3509 C GLY B 99 38.538 -2.080 6.537 1.00 0.00 C ATOM 3510 O GLY B 99 39.008 -1.225 7.287 1.00 0.00 O ATOM 0 H GLY B 99 38.643 -4.802 4.897 1.00 0.00 H new ATOM 0 HA2 GLY B 99 38.819 -4.142 7.033 1.00 0.00 H new ATOM 0 HA3 GLY B 99 40.294 -3.300 6.599 1.00 0.00 H new ATOM 3514 N ALA B 100 37.408 -1.907 5.858 1.00 0.00 N ATOM 3515 CA ALA B 100 36.639 -0.672 5.958 1.00 0.00 C ATOM 3516 C ALA B 100 36.086 -0.483 7.366 1.00 0.00 C ATOM 3517 O ALA B 100 35.570 -1.424 7.972 1.00 0.00 O ATOM 3518 CB ALA B 100 35.509 -0.668 4.940 1.00 0.00 C ATOM 0 H ALA B 100 37.005 -2.606 5.233 1.00 0.00 H new ATOM 0 HA ALA B 100 37.308 0.161 5.743 1.00 0.00 H new ATOM 0 HB1 ALA B 100 34.944 0.260 5.027 1.00 0.00 H new ATOM 0 HB2 ALA B 100 35.924 -0.747 3.935 1.00 0.00 H new ATOM 0 HB3 ALA B 100 34.848 -1.514 5.127 1.00 0.00 H new ATOM 3524 N ALA B 101 36.194 0.736 7.880 1.00 0.00 N ATOM 3525 CA ALA B 101 35.703 1.049 9.218 1.00 0.00 C ATOM 3526 C ALA B 101 34.242 0.664 9.373 1.00 0.00 C ATOM 3527 O ALA B 101 33.535 0.436 8.392 1.00 0.00 O ATOM 3528 CB ALA B 101 35.886 2.527 9.519 1.00 0.00 C ATOM 0 H ALA B 101 36.617 1.525 7.391 1.00 0.00 H new ATOM 0 HA ALA B 101 36.286 0.466 9.931 1.00 0.00 H new ATOM 0 HB1 ALA B 101 35.515 2.743 10.521 1.00 0.00 H new ATOM 0 HB2 ALA B 101 36.944 2.782 9.462 1.00 0.00 H new ATOM 0 HB3 ALA B 101 35.331 3.118 8.791 1.00 0.00 H new ATOM 3534 N LYS B 102 33.796 0.602 10.620 1.00 0.00 N ATOM 3535 CA LYS B 102 32.414 0.252 10.919 1.00 0.00 C ATOM 3536 C LYS B 102 31.544 1.498 10.969 1.00 0.00 C ATOM 3537 O LYS B 102 31.082 1.910 12.033 1.00 0.00 O ATOM 3538 CB LYS B 102 32.326 -0.508 12.245 1.00 0.00 C ATOM 3539 CG LYS B 102 32.952 0.233 13.414 1.00 0.00 C ATOM 3540 CD LYS B 102 34.234 -0.440 13.876 1.00 0.00 C ATOM 3541 CE LYS B 102 34.575 -0.066 15.309 1.00 0.00 C ATOM 3542 NZ LYS B 102 34.851 1.390 15.453 1.00 0.00 N ATOM 0 H LYS B 102 34.371 0.790 11.441 1.00 0.00 H new ATOM 0 HA LYS B 102 32.047 -0.395 10.122 1.00 0.00 H new ATOM 0 HB2 LYS B 102 31.278 -0.707 12.471 1.00 0.00 H new ATOM 0 HB3 LYS B 102 32.817 -1.475 12.133 1.00 0.00 H new ATOM 0 HG2 LYS B 102 33.164 1.262 13.123 1.00 0.00 H new ATOM 0 HG3 LYS B 102 32.243 0.275 14.241 1.00 0.00 H new ATOM 0 HD2 LYS B 102 34.127 -1.522 13.797 1.00 0.00 H new ATOM 0 HD3 LYS B 102 35.054 -0.152 13.219 1.00 0.00 H new ATOM 0 HE2 LYS B 102 33.749 -0.345 15.963 1.00 0.00 H new ATOM 0 HE3 LYS B 102 35.446 -0.634 15.635 1.00 0.00 H new ATOM 0 HZ1 LYS B 102 35.145 1.593 16.430 1.00 0.00 H new ATOM 0 HZ2 LYS B 102 35.611 1.666 14.798 1.00 0.00 H new ATOM 0 HZ3 LYS B 102 33.990 1.930 15.232 1.00 0.00 H new ATOM 3556 N GLN B 103 31.328 2.090 9.804 1.00 0.00 N ATOM 3557 CA GLN B 103 30.513 3.294 9.692 1.00 0.00 C ATOM 3558 C GLN B 103 30.464 3.785 8.250 1.00 0.00 C ATOM 3559 O GLN B 103 31.472 3.770 7.545 1.00 0.00 O ATOM 3560 CB GLN B 103 31.065 4.395 10.601 1.00 0.00 C ATOM 3561 CG GLN B 103 30.142 4.748 11.755 1.00 0.00 C ATOM 3562 CD GLN B 103 29.046 5.713 11.349 1.00 0.00 C ATOM 3563 OE1 GLN B 103 28.130 5.354 10.609 1.00 0.00 O ATOM 3564 NE2 GLN B 103 29.134 6.947 11.832 1.00 0.00 N ATOM 0 H GLN B 103 31.707 1.756 8.918 1.00 0.00 H new ATOM 0 HA GLN B 103 29.499 3.047 10.007 1.00 0.00 H new ATOM 0 HB2 GLN B 103 32.028 4.076 11.001 1.00 0.00 H new ATOM 0 HB3 GLN B 103 31.247 5.289 10.005 1.00 0.00 H new ATOM 0 HG2 GLN B 103 29.692 3.836 12.147 1.00 0.00 H new ATOM 0 HG3 GLN B 103 30.727 5.187 12.563 1.00 0.00 H new ATOM 0 HE21 GLN B 103 29.911 7.202 12.442 1.00 0.00 H new ATOM 0 HE22 GLN B 103 28.425 7.640 11.593 1.00 0.00 H new ATOM 3573 N PHE B 104 29.284 4.217 7.817 1.00 0.00 N ATOM 3574 CA PHE B 104 29.103 4.712 6.458 1.00 0.00 C ATOM 3575 C PHE B 104 30.160 5.755 6.111 1.00 0.00 C ATOM 3576 O PHE B 104 30.497 6.607 6.933 1.00 0.00 O ATOM 3577 CB PHE B 104 27.705 5.310 6.293 1.00 0.00 C ATOM 3578 CG PHE B 104 27.445 5.859 4.919 1.00 0.00 C ATOM 3579 CD1 PHE B 104 26.980 5.034 3.906 1.00 0.00 C ATOM 3580 CD2 PHE B 104 27.665 7.198 4.640 1.00 0.00 C ATOM 3581 CE1 PHE B 104 26.740 5.536 2.641 1.00 0.00 C ATOM 3582 CE2 PHE B 104 27.427 7.705 3.377 1.00 0.00 C ATOM 3583 CZ PHE B 104 26.963 6.873 2.376 1.00 0.00 C ATOM 0 H PHE B 104 28.439 4.234 8.388 1.00 0.00 H new ATOM 0 HA PHE B 104 29.214 3.870 5.775 1.00 0.00 H new ATOM 0 HB2 PHE B 104 26.962 4.544 6.516 1.00 0.00 H new ATOM 0 HB3 PHE B 104 27.571 6.106 7.025 1.00 0.00 H new ATOM 0 HD1 PHE B 104 26.803 3.988 4.108 1.00 0.00 H new ATOM 0 HD2 PHE B 104 28.027 7.853 5.419 1.00 0.00 H new ATOM 0 HE1 PHE B 104 26.378 4.883 1.860 1.00 0.00 H new ATOM 0 HE2 PHE B 104 27.603 8.751 3.172 1.00 0.00 H new ATOM 0 HZ PHE B 104 26.775 7.267 1.388 1.00 0.00 H new ATOM 3593 N ARG B 105 30.679 5.682 4.890 1.00 0.00 N ATOM 3594 CA ARG B 105 31.698 6.621 4.435 1.00 0.00 C ATOM 3595 C ARG B 105 31.321 7.222 3.085 1.00 0.00 C ATOM 3596 O ARG B 105 30.671 6.573 2.264 1.00 0.00 O ATOM 3597 CB ARG B 105 33.056 5.924 4.337 1.00 0.00 C ATOM 3598 CG ARG B 105 33.737 5.725 5.681 1.00 0.00 C ATOM 3599 CD ARG B 105 34.415 6.999 6.155 1.00 0.00 C ATOM 3600 NE ARG B 105 33.843 7.491 7.405 1.00 0.00 N ATOM 3601 CZ ARG B 105 34.351 8.503 8.100 1.00 0.00 C ATOM 3602 NH1 ARG B 105 35.438 9.127 7.668 1.00 0.00 N ATOM 3603 NH2 ARG B 105 33.773 8.893 9.227 1.00 0.00 N ATOM 0 H ARG B 105 30.411 4.982 4.198 1.00 0.00 H new ATOM 0 HA ARG B 105 31.764 7.428 5.164 1.00 0.00 H new ATOM 0 HB2 ARG B 105 32.923 4.953 3.859 1.00 0.00 H new ATOM 0 HB3 ARG B 105 33.710 6.510 3.691 1.00 0.00 H new ATOM 0 HG2 ARG B 105 33.001 5.407 6.419 1.00 0.00 H new ATOM 0 HG3 ARG B 105 34.475 4.927 5.602 1.00 0.00 H new ATOM 0 HD2 ARG B 105 35.480 6.813 6.292 1.00 0.00 H new ATOM 0 HD3 ARG B 105 34.322 7.767 5.387 1.00 0.00 H new ATOM 0 HE ARG B 105 33.006 7.032 7.765 1.00 0.00 H new ATOM 0 HH11 ARG B 105 35.886 8.830 6.801 1.00 0.00 H new ATOM 0 HH12 ARG B 105 35.827 9.904 8.203 1.00 0.00 H new ATOM 0 HH21 ARG B 105 32.936 8.416 9.563 1.00 0.00 H new ATOM 0 HH22 ARG B 105 34.165 9.670 9.759 1.00 0.00 H new ATOM 3617 N ARG B 106 31.735 8.466 2.861 1.00 0.00 N ATOM 3618 CA ARG B 106 31.441 9.155 1.610 1.00 0.00 C ATOM 3619 C ARG B 106 32.398 8.716 0.508 1.00 0.00 C ATOM 3620 O ARG B 106 32.028 8.666 -0.666 1.00 0.00 O ATOM 3621 CB ARG B 106 31.533 10.671 1.805 1.00 0.00 C ATOM 3622 CG ARG B 106 31.215 11.465 0.549 1.00 0.00 C ATOM 3623 CD ARG B 106 32.360 12.393 0.171 1.00 0.00 C ATOM 3624 NE ARG B 106 31.902 13.756 -0.077 1.00 0.00 N ATOM 3625 CZ ARG B 106 32.693 14.733 -0.508 1.00 0.00 C ATOM 3626 NH1 ARG B 106 33.978 14.497 -0.736 1.00 0.00 N ATOM 3627 NH2 ARG B 106 32.202 15.948 -0.711 1.00 0.00 N ATOM 0 H ARG B 106 32.274 9.016 3.529 1.00 0.00 H new ATOM 0 HA ARG B 106 30.426 8.893 1.311 1.00 0.00 H new ATOM 0 HB2 ARG B 106 30.847 10.970 2.597 1.00 0.00 H new ATOM 0 HB3 ARG B 106 32.538 10.926 2.141 1.00 0.00 H new ATOM 0 HG2 ARG B 106 31.014 10.780 -0.275 1.00 0.00 H new ATOM 0 HG3 ARG B 106 30.308 12.049 0.707 1.00 0.00 H new ATOM 0 HD2 ARG B 106 33.100 12.400 0.971 1.00 0.00 H new ATOM 0 HD3 ARG B 106 32.857 12.010 -0.720 1.00 0.00 H new ATOM 0 HE ARG B 106 30.919 13.971 0.090 1.00 0.00 H new ATOM 0 HH11 ARG B 106 34.361 13.564 -0.581 1.00 0.00 H new ATOM 0 HH12 ARG B 106 34.584 15.248 -1.067 1.00 0.00 H new ATOM 0 HH21 ARG B 106 31.215 16.135 -0.536 1.00 0.00 H new ATOM 0 HH22 ARG B 106 32.812 16.696 -1.042 1.00 0.00 H new ATOM 3641 N GLU B 107 33.629 8.397 0.892 1.00 0.00 N ATOM 3642 CA GLU B 107 34.641 7.961 -0.065 1.00 0.00 C ATOM 3643 C GLU B 107 34.406 6.519 -0.517 1.00 0.00 C ATOM 3644 O GLU B 107 35.058 6.043 -1.445 1.00 0.00 O ATOM 3645 CB GLU B 107 36.036 8.095 0.546 1.00 0.00 C ATOM 3646 CG GLU B 107 36.943 9.049 -0.214 1.00 0.00 C ATOM 3647 CD GLU B 107 38.413 8.724 -0.034 1.00 0.00 C ATOM 3648 OE1 GLU B 107 38.940 8.952 1.076 1.00 0.00 O ATOM 3649 OE2 GLU B 107 39.037 8.241 -1.002 1.00 0.00 O ATOM 0 H GLU B 107 33.951 8.432 1.859 1.00 0.00 H new ATOM 0 HA GLU B 107 34.565 8.604 -0.942 1.00 0.00 H new ATOM 0 HB2 GLU B 107 35.941 8.440 1.576 1.00 0.00 H new ATOM 0 HB3 GLU B 107 36.504 7.111 0.581 1.00 0.00 H new ATOM 0 HG2 GLU B 107 36.694 9.014 -1.275 1.00 0.00 H new ATOM 0 HG3 GLU B 107 36.756 10.068 0.123 1.00 0.00 H new ATOM 3656 N TRP B 108 33.475 5.825 0.138 1.00 0.00 N ATOM 3657 CA TRP B 108 33.171 4.443 -0.213 1.00 0.00 C ATOM 3658 C TRP B 108 32.627 4.340 -1.637 1.00 0.00 C ATOM 3659 O TRP B 108 32.635 3.264 -2.236 1.00 0.00 O ATOM 3660 CB TRP B 108 32.165 3.855 0.778 1.00 0.00 C ATOM 3661 CG TRP B 108 32.804 3.328 2.027 1.00 0.00 C ATOM 3662 CD1 TRP B 108 34.137 3.316 2.320 1.00 0.00 C ATOM 3663 CD2 TRP B 108 32.140 2.733 3.147 1.00 0.00 C ATOM 3664 NE1 TRP B 108 34.342 2.751 3.555 1.00 0.00 N ATOM 3665 CE2 TRP B 108 33.132 2.386 4.083 1.00 0.00 C ATOM 3666 CE3 TRP B 108 30.802 2.462 3.451 1.00 0.00 C ATOM 3667 CZ2 TRP B 108 32.829 1.780 5.300 1.00 0.00 C ATOM 3668 CZ3 TRP B 108 30.503 1.862 4.661 1.00 0.00 C ATOM 3669 CH2 TRP B 108 31.513 1.527 5.572 1.00 0.00 C ATOM 0 H TRP B 108 32.922 6.197 0.910 1.00 0.00 H new ATOM 0 HA TRP B 108 34.098 3.872 -0.163 1.00 0.00 H new ATOM 0 HB2 TRP B 108 31.438 4.622 1.046 1.00 0.00 H new ATOM 0 HB3 TRP B 108 31.614 3.050 0.292 1.00 0.00 H new ATOM 0 HD1 TRP B 108 34.916 3.695 1.675 1.00 0.00 H new ATOM 0 HE1 TRP B 108 35.248 2.624 4.006 1.00 0.00 H new ATOM 0 HE3 TRP B 108 30.017 2.716 2.754 1.00 0.00 H new ATOM 0 HZ2 TRP B 108 33.606 1.519 6.004 1.00 0.00 H new ATOM 0 HZ3 TRP B 108 29.473 1.648 4.907 1.00 0.00 H new ATOM 0 HH2 TRP B 108 31.247 1.059 6.508 1.00 0.00 H new ATOM 3680 N PHE B 109 32.157 5.462 -2.178 1.00 0.00 N ATOM 3681 CA PHE B 109 31.615 5.489 -3.531 1.00 0.00 C ATOM 3682 C PHE B 109 32.599 6.138 -4.498 1.00 0.00 C ATOM 3683 O PHE B 109 32.201 6.725 -5.505 1.00 0.00 O ATOM 3684 CB PHE B 109 30.287 6.247 -3.556 1.00 0.00 C ATOM 3685 CG PHE B 109 29.141 5.472 -2.971 1.00 0.00 C ATOM 3686 CD1 PHE B 109 29.158 5.086 -1.641 1.00 0.00 C ATOM 3687 CD2 PHE B 109 28.048 5.129 -3.752 1.00 0.00 C ATOM 3688 CE1 PHE B 109 28.105 4.372 -1.099 1.00 0.00 C ATOM 3689 CE2 PHE B 109 26.993 4.416 -3.216 1.00 0.00 C ATOM 3690 CZ PHE B 109 27.021 4.038 -1.888 1.00 0.00 C ATOM 0 H PHE B 109 32.141 6.363 -1.699 1.00 0.00 H new ATOM 0 HA PHE B 109 31.445 4.460 -3.847 1.00 0.00 H new ATOM 0 HB2 PHE B 109 30.401 7.181 -3.006 1.00 0.00 H new ATOM 0 HB3 PHE B 109 30.048 6.511 -4.586 1.00 0.00 H new ATOM 0 HD1 PHE B 109 30.003 5.345 -1.020 1.00 0.00 H new ATOM 0 HD2 PHE B 109 28.021 5.422 -4.791 1.00 0.00 H new ATOM 0 HE1 PHE B 109 28.130 4.076 -0.061 1.00 0.00 H new ATOM 0 HE2 PHE B 109 26.147 4.155 -3.835 1.00 0.00 H new ATOM 0 HZ PHE B 109 26.197 3.482 -1.467 1.00 0.00 H new ATOM 3700 N GLN B 110 33.886 6.030 -4.187 1.00 0.00 N ATOM 3701 CA GLN B 110 34.927 6.607 -5.029 1.00 0.00 C ATOM 3702 C GLN B 110 36.217 5.801 -4.930 1.00 0.00 C ATOM 3703 O GLN B 110 37.314 6.353 -5.026 1.00 0.00 O ATOM 3704 CB GLN B 110 35.187 8.061 -4.630 1.00 0.00 C ATOM 3705 CG GLN B 110 34.066 9.009 -5.024 1.00 0.00 C ATOM 3706 CD GLN B 110 34.452 10.467 -4.866 1.00 0.00 C ATOM 3707 OE1 GLN B 110 34.756 11.150 -5.844 1.00 0.00 O ATOM 3708 NE2 GLN B 110 34.444 10.950 -3.629 1.00 0.00 N ATOM 0 H GLN B 110 34.233 5.548 -3.358 1.00 0.00 H new ATOM 0 HA GLN B 110 34.581 6.577 -6.062 1.00 0.00 H new ATOM 0 HB2 GLN B 110 35.333 8.113 -3.551 1.00 0.00 H new ATOM 0 HB3 GLN B 110 36.115 8.396 -5.094 1.00 0.00 H new ATOM 0 HG2 GLN B 110 33.784 8.822 -6.060 1.00 0.00 H new ATOM 0 HG3 GLN B 110 33.188 8.801 -4.413 1.00 0.00 H new ATOM 0 HE21 GLN B 110 34.185 10.347 -2.848 1.00 0.00 H new ATOM 0 HE22 GLN B 110 34.697 11.924 -3.460 1.00 0.00 H new ATOM 3717 N GLY B 111 36.080 4.494 -4.739 1.00 0.00 N ATOM 3718 CA GLY B 111 37.243 3.633 -4.632 1.00 0.00 C ATOM 3719 C GLY B 111 37.259 2.546 -5.689 1.00 0.00 C ATOM 3720 O GLY B 111 36.862 2.776 -6.831 1.00 0.00 O ATOM 0 H GLY B 111 35.183 4.015 -4.656 1.00 0.00 H new ATOM 0 HA2 GLY B 111 38.147 4.236 -4.721 1.00 0.00 H new ATOM 0 HA3 GLY B 111 37.262 3.174 -3.643 1.00 0.00 H new ATOM 3724 N ASP B 112 37.717 1.358 -5.307 1.00 0.00 N ATOM 3725 CA ASP B 112 37.782 0.232 -6.231 1.00 0.00 C ATOM 3726 C ASP B 112 36.458 -0.526 -6.258 1.00 0.00 C ATOM 3727 O ASP B 112 35.814 -0.706 -5.224 1.00 0.00 O ATOM 3728 CB ASP B 112 38.917 -0.714 -5.838 1.00 0.00 C ATOM 3729 CG ASP B 112 39.877 -0.975 -6.983 1.00 0.00 C ATOM 3730 OD1 ASP B 112 39.976 -0.113 -7.881 1.00 0.00 O ATOM 3731 OD2 ASP B 112 40.529 -2.041 -6.981 1.00 0.00 O ATOM 0 H ASP B 112 38.048 1.151 -4.365 1.00 0.00 H new ATOM 0 HA ASP B 112 37.976 0.624 -7.229 1.00 0.00 H new ATOM 0 HB2 ASP B 112 39.466 -0.289 -4.998 1.00 0.00 H new ATOM 0 HB3 ASP B 112 38.496 -1.660 -5.498 1.00 0.00 H new ATOM 3736 N GLY B 113 36.059 -0.970 -7.445 1.00 0.00 N ATOM 3737 CA GLY B 113 34.816 -1.703 -7.584 1.00 0.00 C ATOM 3738 C GLY B 113 33.755 -0.913 -8.323 1.00 0.00 C ATOM 3739 O GLY B 113 33.993 0.221 -8.740 1.00 0.00 O ATOM 0 H GLY B 113 36.576 -0.835 -8.314 1.00 0.00 H new ATOM 0 HA2 GLY B 113 35.006 -2.636 -8.115 1.00 0.00 H new ATOM 0 HA3 GLY B 113 34.443 -1.970 -6.595 1.00 0.00 H new ATOM 3743 N MET B 114 32.580 -1.512 -8.488 1.00 0.00 N ATOM 3744 CA MET B 114 31.478 -0.858 -9.182 1.00 0.00 C ATOM 3745 C MET B 114 30.333 -0.554 -8.222 1.00 0.00 C ATOM 3746 O MET B 114 30.116 -1.279 -7.251 1.00 0.00 O ATOM 3747 CB MET B 114 30.975 -1.738 -10.329 1.00 0.00 C ATOM 3748 CG MET B 114 31.519 -1.336 -11.690 1.00 0.00 C ATOM 3749 SD MET B 114 33.252 -1.784 -11.906 1.00 0.00 S ATOM 3750 CE MET B 114 33.124 -3.030 -13.187 1.00 0.00 C ATOM 0 H MET B 114 32.367 -2.450 -8.150 1.00 0.00 H new ATOM 0 HA MET B 114 31.847 0.083 -9.589 1.00 0.00 H new ATOM 0 HB2 MET B 114 31.250 -2.773 -10.129 1.00 0.00 H new ATOM 0 HB3 MET B 114 29.886 -1.697 -10.356 1.00 0.00 H new ATOM 0 HG2 MET B 114 30.925 -1.813 -12.470 1.00 0.00 H new ATOM 0 HG3 MET B 114 31.408 -0.259 -11.818 1.00 0.00 H new ATOM 0 HE1 MET B 114 34.118 -3.405 -13.431 1.00 0.00 H new ATOM 0 HE2 MET B 114 32.502 -3.853 -12.834 1.00 0.00 H new ATOM 0 HE3 MET B 114 32.673 -2.591 -14.077 1.00 0.00 H new ATOM 3760 N VAL B 115 29.604 0.521 -8.500 1.00 0.00 N ATOM 3761 CA VAL B 115 28.479 0.919 -7.663 1.00 0.00 C ATOM 3762 C VAL B 115 27.152 0.619 -8.350 1.00 0.00 C ATOM 3763 O VAL B 115 26.950 0.971 -9.513 1.00 0.00 O ATOM 3764 CB VAL B 115 28.541 2.420 -7.319 1.00 0.00 C ATOM 3765 CG1 VAL B 115 27.547 2.756 -6.218 1.00 0.00 C ATOM 3766 CG2 VAL B 115 29.952 2.817 -6.913 1.00 0.00 C ATOM 0 H VAL B 115 29.772 1.132 -9.299 1.00 0.00 H new ATOM 0 HA VAL B 115 28.546 0.340 -6.742 1.00 0.00 H new ATOM 0 HB VAL B 115 28.270 2.990 -8.208 1.00 0.00 H new ATOM 0 HG11 VAL B 115 27.605 3.820 -5.988 1.00 0.00 H new ATOM 0 HG12 VAL B 115 26.539 2.511 -6.551 1.00 0.00 H new ATOM 0 HG13 VAL B 115 27.785 2.178 -5.325 1.00 0.00 H new ATOM 0 HG21 VAL B 115 29.976 3.880 -6.674 1.00 0.00 H new ATOM 0 HG22 VAL B 115 30.255 2.241 -6.038 1.00 0.00 H new ATOM 0 HG23 VAL B 115 30.638 2.614 -7.736 1.00 0.00 H new ATOM 3776 N ARG B 116 26.251 -0.037 -7.628 1.00 0.00 N ATOM 3777 CA ARG B 116 24.944 -0.388 -8.172 1.00 0.00 C ATOM 3778 C ARG B 116 23.900 0.666 -7.815 1.00 0.00 C ATOM 3779 O ARG B 116 23.827 1.121 -6.672 1.00 0.00 O ATOM 3780 CB ARG B 116 24.502 -1.757 -7.652 1.00 0.00 C ATOM 3781 CG ARG B 116 25.380 -2.901 -8.134 1.00 0.00 C ATOM 3782 CD ARG B 116 24.731 -4.250 -7.867 1.00 0.00 C ATOM 3783 NE ARG B 116 25.059 -5.230 -8.899 1.00 0.00 N ATOM 3784 CZ ARG B 116 24.576 -5.185 -10.136 1.00 0.00 C ATOM 3785 NH1 ARG B 116 23.748 -4.211 -10.491 1.00 0.00 N ATOM 3786 NH2 ARG B 116 24.918 -6.113 -11.019 1.00 0.00 N ATOM 0 H ARG B 116 26.401 -0.337 -6.665 1.00 0.00 H new ATOM 0 HA ARG B 116 25.032 -0.430 -9.258 1.00 0.00 H new ATOM 0 HB2 ARG B 116 24.505 -1.741 -6.562 1.00 0.00 H new ATOM 0 HB3 ARG B 116 23.474 -1.941 -7.965 1.00 0.00 H new ATOM 0 HG2 ARG B 116 25.569 -2.792 -9.202 1.00 0.00 H new ATOM 0 HG3 ARG B 116 26.347 -2.855 -7.633 1.00 0.00 H new ATOM 0 HD2 ARG B 116 25.057 -4.623 -6.896 1.00 0.00 H new ATOM 0 HD3 ARG B 116 23.649 -4.128 -7.814 1.00 0.00 H new ATOM 0 HE ARG B 116 25.694 -5.991 -8.657 1.00 0.00 H new ATOM 0 HH11 ARG B 116 23.482 -3.496 -9.814 1.00 0.00 H new ATOM 0 HH12 ARG B 116 23.378 -4.177 -11.441 1.00 0.00 H new ATOM 0 HH21 ARG B 116 25.553 -6.864 -10.749 1.00 0.00 H new ATOM 0 HH22 ARG B 116 24.546 -6.076 -11.968 1.00 0.00 H new ATOM 3800 N ARG B 117 23.095 1.051 -8.801 1.00 0.00 N ATOM 3801 CA ARG B 117 22.056 2.052 -8.594 1.00 0.00 C ATOM 3802 C ARG B 117 20.685 1.504 -8.976 1.00 0.00 C ATOM 3803 O ARG B 117 20.448 1.142 -10.129 1.00 0.00 O ATOM 3804 CB ARG B 117 22.361 3.310 -9.409 1.00 0.00 C ATOM 3805 CG ARG B 117 21.301 4.392 -9.281 1.00 0.00 C ATOM 3806 CD ARG B 117 21.776 5.709 -9.873 1.00 0.00 C ATOM 3807 NE ARG B 117 22.476 6.531 -8.890 1.00 0.00 N ATOM 3808 CZ ARG B 117 23.047 7.696 -9.178 1.00 0.00 C ATOM 3809 NH1 ARG B 117 23.005 8.171 -10.415 1.00 0.00 N ATOM 3810 NH2 ARG B 117 23.664 8.387 -8.228 1.00 0.00 N ATOM 0 H ARG B 117 23.143 0.684 -9.751 1.00 0.00 H new ATOM 0 HA ARG B 117 22.041 2.308 -7.535 1.00 0.00 H new ATOM 0 HB2 ARG B 117 23.321 3.715 -9.090 1.00 0.00 H new ATOM 0 HB3 ARG B 117 22.463 3.036 -10.459 1.00 0.00 H new ATOM 0 HG2 ARG B 117 20.390 4.072 -9.787 1.00 0.00 H new ATOM 0 HG3 ARG B 117 21.049 4.534 -8.230 1.00 0.00 H new ATOM 0 HD2 ARG B 117 22.438 5.510 -10.716 1.00 0.00 H new ATOM 0 HD3 ARG B 117 20.920 6.260 -10.263 1.00 0.00 H new ATOM 0 HE ARG B 117 22.530 6.192 -7.929 1.00 0.00 H new ATOM 0 HH11 ARG B 117 22.534 7.642 -11.149 1.00 0.00 H new ATOM 0 HH12 ARG B 117 23.444 9.065 -10.633 1.00 0.00 H new ATOM 0 HH21 ARG B 117 23.700 8.024 -7.275 1.00 0.00 H new ATOM 0 HH22 ARG B 117 24.102 9.281 -8.450 1.00 0.00 H new ATOM 3824 N LYS B 118 19.784 1.449 -8.000 1.00 0.00 N ATOM 3825 CA LYS B 118 18.434 0.948 -8.227 1.00 0.00 C ATOM 3826 C LYS B 118 17.403 2.036 -7.961 1.00 0.00 C ATOM 3827 O LYS B 118 17.700 3.046 -7.324 1.00 0.00 O ATOM 3828 CB LYS B 118 18.159 -0.263 -7.333 1.00 0.00 C ATOM 3829 CG LYS B 118 18.468 -1.594 -7.999 1.00 0.00 C ATOM 3830 CD LYS B 118 17.203 -2.398 -8.252 1.00 0.00 C ATOM 3831 CE LYS B 118 17.044 -3.518 -7.236 1.00 0.00 C ATOM 3832 NZ LYS B 118 16.543 -4.772 -7.865 1.00 0.00 N ATOM 0 H LYS B 118 19.966 1.746 -7.041 1.00 0.00 H new ATOM 0 HA LYS B 118 18.355 0.643 -9.271 1.00 0.00 H new ATOM 0 HB2 LYS B 118 18.753 -0.175 -6.423 1.00 0.00 H new ATOM 0 HB3 LYS B 118 17.111 -0.251 -7.032 1.00 0.00 H new ATOM 0 HG2 LYS B 118 18.984 -1.418 -8.943 1.00 0.00 H new ATOM 0 HG3 LYS B 118 19.146 -2.169 -7.368 1.00 0.00 H new ATOM 0 HD2 LYS B 118 16.336 -1.739 -8.207 1.00 0.00 H new ATOM 0 HD3 LYS B 118 17.232 -2.818 -9.257 1.00 0.00 H new ATOM 0 HE2 LYS B 118 18.003 -3.711 -6.755 1.00 0.00 H new ATOM 0 HE3 LYS B 118 16.353 -3.203 -6.454 1.00 0.00 H new ATOM 0 HZ1 LYS B 118 15.837 -5.215 -7.242 1.00 0.00 H new ATOM 0 HZ2 LYS B 118 16.105 -4.550 -8.782 1.00 0.00 H new ATOM 0 HZ3 LYS B 118 17.336 -5.428 -8.011 1.00 0.00 H new ATOM 3846 N ASN B 119 16.192 1.823 -8.457 1.00 0.00 N ATOM 3847 CA ASN B 119 15.110 2.786 -8.276 1.00 0.00 C ATOM 3848 C ASN B 119 13.782 2.080 -8.021 1.00 0.00 C ATOM 3849 O ASN B 119 13.505 1.028 -8.597 1.00 0.00 O ATOM 3850 CB ASN B 119 14.992 3.693 -9.502 1.00 0.00 C ATOM 3851 CG ASN B 119 15.236 2.951 -10.801 1.00 0.00 C ATOM 3852 OD1 ASN B 119 14.584 1.948 -11.089 1.00 0.00 O ATOM 3853 ND2 ASN B 119 16.183 3.441 -11.593 1.00 0.00 N ATOM 0 H ASN B 119 15.932 0.992 -8.988 1.00 0.00 H new ATOM 0 HA ASN B 119 15.347 3.395 -7.404 1.00 0.00 H new ATOM 0 HB2 ASN B 119 13.998 4.140 -9.524 1.00 0.00 H new ATOM 0 HB3 ASN B 119 15.708 4.511 -9.415 1.00 0.00 H new ATOM 0 HD21 ASN B 119 16.394 2.983 -12.480 1.00 0.00 H new ATOM 0 HD22 ASN B 119 16.699 4.275 -11.315 1.00 0.00 H new ATOM 3860 N LEU B 120 12.963 2.669 -7.155 1.00 0.00 N ATOM 3861 CA LEU B 120 11.662 2.102 -6.820 1.00 0.00 C ATOM 3862 C LEU B 120 10.548 3.118 -7.070 1.00 0.00 C ATOM 3863 O LEU B 120 10.372 4.057 -6.294 1.00 0.00 O ATOM 3864 CB LEU B 120 11.637 1.655 -5.356 1.00 0.00 C ATOM 3865 CG LEU B 120 12.934 1.020 -4.846 1.00 0.00 C ATOM 3866 CD1 LEU B 120 12.698 0.327 -3.514 1.00 0.00 C ATOM 3867 CD2 LEU B 120 13.487 0.037 -5.869 1.00 0.00 C ATOM 0 H LEU B 120 13.179 3.541 -6.672 1.00 0.00 H new ATOM 0 HA LEU B 120 11.495 1.236 -7.460 1.00 0.00 H new ATOM 0 HB2 LEU B 120 11.405 2.519 -4.733 1.00 0.00 H new ATOM 0 HB3 LEU B 120 10.825 0.940 -5.225 1.00 0.00 H new ATOM 0 HG LEU B 120 13.670 1.811 -4.698 1.00 0.00 H new ATOM 0 HD11 LEU B 120 13.630 -0.119 -3.166 1.00 0.00 H new ATOM 0 HD12 LEU B 120 12.348 1.055 -2.782 1.00 0.00 H new ATOM 0 HD13 LEU B 120 11.947 -0.453 -3.638 1.00 0.00 H new ATOM 0 HD21 LEU B 120 14.409 -0.404 -5.489 1.00 0.00 H new ATOM 0 HD22 LEU B 120 12.755 -0.751 -6.049 1.00 0.00 H new ATOM 0 HD23 LEU B 120 13.694 0.561 -6.802 1.00 0.00 H new ATOM 3879 N PRO B 121 9.779 2.950 -8.161 1.00 0.00 N ATOM 3880 CA PRO B 121 8.683 3.865 -8.502 1.00 0.00 C ATOM 3881 C PRO B 121 7.656 3.987 -7.380 1.00 0.00 C ATOM 3882 O PRO B 121 7.290 2.995 -6.750 1.00 0.00 O ATOM 3883 CB PRO B 121 8.046 3.224 -9.739 1.00 0.00 C ATOM 3884 CG PRO B 121 9.113 2.358 -10.315 1.00 0.00 C ATOM 3885 CD PRO B 121 9.914 1.862 -9.147 1.00 0.00 C ATOM 0 HA PRO B 121 9.044 4.880 -8.671 1.00 0.00 H new ATOM 0 HB2 PRO B 121 7.165 2.640 -9.472 1.00 0.00 H new ATOM 0 HB3 PRO B 121 7.723 3.981 -10.454 1.00 0.00 H new ATOM 0 HG2 PRO B 121 8.683 1.527 -10.875 1.00 0.00 H new ATOM 0 HG3 PRO B 121 9.740 2.919 -11.009 1.00 0.00 H new ATOM 0 HD2 PRO B 121 9.524 0.919 -8.763 1.00 0.00 H new ATOM 0 HD3 PRO B 121 10.956 1.690 -9.417 1.00 0.00 H new ATOM 3893 N ILE B 122 7.193 5.210 -7.142 1.00 0.00 N ATOM 3894 CA ILE B 122 6.205 5.465 -6.101 1.00 0.00 C ATOM 3895 C ILE B 122 4.884 5.928 -6.705 1.00 0.00 C ATOM 3896 O ILE B 122 4.758 7.072 -7.143 1.00 0.00 O ATOM 3897 CB ILE B 122 6.699 6.527 -5.101 1.00 0.00 C ATOM 3898 CG1 ILE B 122 8.164 6.278 -4.739 1.00 0.00 C ATOM 3899 CG2 ILE B 122 5.831 6.524 -3.850 1.00 0.00 C ATOM 3900 CD1 ILE B 122 8.399 4.951 -4.052 1.00 0.00 C ATOM 0 H ILE B 122 7.487 6.040 -7.657 1.00 0.00 H new ATOM 0 HA ILE B 122 6.053 4.525 -5.571 1.00 0.00 H new ATOM 0 HB ILE B 122 6.622 7.508 -5.570 1.00 0.00 H new ATOM 0 HG12 ILE B 122 8.766 6.320 -5.646 1.00 0.00 H new ATOM 0 HG13 ILE B 122 8.511 7.081 -4.089 1.00 0.00 H new ATOM 0 HG21 ILE B 122 6.194 7.280 -3.154 1.00 0.00 H new ATOM 0 HG22 ILE B 122 4.799 6.747 -4.122 1.00 0.00 H new ATOM 0 HG23 ILE B 122 5.878 5.543 -3.377 1.00 0.00 H new ATOM 0 HD11 ILE B 122 9.459 4.842 -3.825 1.00 0.00 H new ATOM 0 HD12 ILE B 122 7.824 4.913 -3.127 1.00 0.00 H new ATOM 0 HD13 ILE B 122 8.083 4.140 -4.709 1.00 0.00 H new ATOM 3912 N GLU B 123 3.902 5.034 -6.726 1.00 0.00 N ATOM 3913 CA GLU B 123 2.590 5.351 -7.277 1.00 0.00 C ATOM 3914 C GLU B 123 1.616 5.751 -6.173 1.00 0.00 C ATOM 3915 O GLU B 123 1.312 4.957 -5.282 1.00 0.00 O ATOM 3916 CB GLU B 123 2.037 4.153 -8.052 1.00 0.00 C ATOM 3917 CG GLU B 123 2.777 3.873 -9.349 1.00 0.00 C ATOM 3918 CD GLU B 123 1.841 3.559 -10.499 1.00 0.00 C ATOM 3919 OE1 GLU B 123 1.370 4.509 -11.158 1.00 0.00 O ATOM 3920 OE2 GLU B 123 1.579 2.362 -10.742 1.00 0.00 O ATOM 0 H GLU B 123 3.990 4.083 -6.367 1.00 0.00 H new ATOM 0 HA GLU B 123 2.704 6.195 -7.957 1.00 0.00 H new ATOM 0 HB2 GLU B 123 2.085 3.268 -7.418 1.00 0.00 H new ATOM 0 HB3 GLU B 123 0.985 4.329 -8.275 1.00 0.00 H new ATOM 0 HG2 GLU B 123 3.388 4.738 -9.608 1.00 0.00 H new ATOM 0 HG3 GLU B 123 3.458 3.035 -9.201 1.00 0.00 H new ATOM 3927 N TYR B 124 1.132 6.986 -6.237 1.00 0.00 N ATOM 3928 CA TYR B 124 0.191 7.492 -5.245 1.00 0.00 C ATOM 3929 C TYR B 124 -1.230 7.038 -5.564 1.00 0.00 C ATOM 3930 O TYR B 124 -1.905 7.625 -6.411 1.00 0.00 O ATOM 3931 CB TYR B 124 0.251 9.020 -5.185 1.00 0.00 C ATOM 3932 CG TYR B 124 1.508 9.555 -4.534 1.00 0.00 C ATOM 3933 CD1 TYR B 124 2.757 9.320 -5.094 1.00 0.00 C ATOM 3934 CD2 TYR B 124 1.444 10.295 -3.360 1.00 0.00 C ATOM 3935 CE1 TYR B 124 3.907 9.806 -4.500 1.00 0.00 C ATOM 3936 CE2 TYR B 124 2.589 10.784 -2.762 1.00 0.00 C ATOM 3937 CZ TYR B 124 3.817 10.538 -3.335 1.00 0.00 C ATOM 3938 OH TYR B 124 4.960 11.023 -2.742 1.00 0.00 O ATOM 0 H TYR B 124 1.376 7.656 -6.966 1.00 0.00 H new ATOM 0 HA TYR B 124 0.473 7.088 -4.273 1.00 0.00 H new ATOM 0 HB2 TYR B 124 0.180 9.417 -6.197 1.00 0.00 H new ATOM 0 HB3 TYR B 124 -0.616 9.387 -4.636 1.00 0.00 H new ATOM 0 HD1 TYR B 124 2.831 8.749 -6.008 1.00 0.00 H new ATOM 0 HD2 TYR B 124 0.483 10.491 -2.907 1.00 0.00 H new ATOM 0 HE1 TYR B 124 4.871 9.613 -4.946 1.00 0.00 H new ATOM 0 HE2 TYR B 124 2.522 11.357 -1.849 1.00 0.00 H new ATOM 0 HH TYR B 124 5.559 11.381 -3.430 1.00 0.00 H new ATOM 3948 N ASN B 125 -1.677 5.988 -4.884 1.00 0.00 N ATOM 3949 CA ASN B 125 -3.016 5.450 -5.096 1.00 0.00 C ATOM 3950 C ASN B 125 -4.076 6.362 -4.486 1.00 0.00 C ATOM 3951 O ASN B 125 -4.533 6.136 -3.368 1.00 0.00 O ATOM 3952 CB ASN B 125 -3.125 4.049 -4.493 1.00 0.00 C ATOM 3953 CG ASN B 125 -3.344 2.979 -5.545 1.00 0.00 C ATOM 3954 OD1 ASN B 125 -3.215 3.234 -6.743 1.00 0.00 O ATOM 3955 ND2 ASN B 125 -3.676 1.772 -5.102 1.00 0.00 N ATOM 0 H ASN B 125 -1.131 5.492 -4.180 1.00 0.00 H new ATOM 0 HA ASN B 125 -3.190 5.392 -6.171 1.00 0.00 H new ATOM 0 HB2 ASN B 125 -2.215 3.825 -3.936 1.00 0.00 H new ATOM 0 HB3 ASN B 125 -3.949 4.027 -3.780 1.00 0.00 H new ATOM 0 HD21 ASN B 125 -3.835 1.012 -5.763 1.00 0.00 H new ATOM 0 HD22 ASN B 125 -3.772 1.605 -4.100 1.00 0.00 H new ATOM 3962 N LEU B 126 -4.467 7.390 -5.231 1.00 0.00 N ATOM 3963 CA LEU B 126 -5.478 8.330 -4.761 1.00 0.00 C ATOM 3964 C LEU B 126 -6.839 7.652 -4.644 1.00 0.00 C ATOM 3965 O LEU B 126 -7.090 7.006 -3.605 1.00 0.00 O ATOM 3966 CB LEU B 126 -5.572 9.528 -5.708 1.00 0.00 C ATOM 3967 CG LEU B 126 -4.440 10.549 -5.575 1.00 0.00 C ATOM 3968 CD1 LEU B 126 -4.643 11.701 -6.548 1.00 0.00 C ATOM 3969 CD2 LEU B 126 -4.354 11.065 -4.146 1.00 0.00 C ATOM 3970 OXT LEU B 126 -7.642 7.773 -5.593 1.00 0.00 O ATOM 0 H LEU B 126 -4.100 7.593 -6.161 1.00 0.00 H new ATOM 0 HA LEU B 126 -5.180 8.680 -3.773 1.00 0.00 H new ATOM 0 HB2 LEU B 126 -5.590 9.160 -6.734 1.00 0.00 H new ATOM 0 HB3 LEU B 126 -6.521 10.036 -5.534 1.00 0.00 H new ATOM 0 HG LEU B 126 -3.500 10.055 -5.820 1.00 0.00 H new ATOM 0 HD11 LEU B 126 -3.828 12.417 -6.439 1.00 0.00 H new ATOM 0 HD12 LEU B 126 -4.655 11.318 -7.568 1.00 0.00 H new ATOM 0 HD13 LEU B 126 -5.591 12.195 -6.335 1.00 0.00 H new ATOM 0 HD21 LEU B 126 -3.544 11.790 -4.069 1.00 0.00 H new ATOM 0 HD22 LEU B 126 -5.295 11.543 -3.874 1.00 0.00 H new ATOM 0 HD23 LEU B 126 -4.161 10.232 -3.469 1.00 0.00 H new TER 3982 LEU B 126