USER MOD reduce.3.24.130724 H: found=0, std=0, add=1822, rem=0, adj=60 USER MOD reduce.3.24.130724 removed 1828 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 81 CYS SG : rot 77:sc= 1.19 USER MOD Set 1.2: B 110 THR OG1 : rot 67:sc= 0.56 USER MOD Set 2.1: B 57 TYR OH : rot -108:sc= -1.27! USER MOD Set 2.2: B 61 HIS : no HE2:sc= 0.421 K(o=-0.85,f=-3.5) USER MOD Set 3.1: B 47 THR OG1 : rot 117:sc= 0.308 USER MOD Set 3.2: B 49 THR OG1 : rot 180:sc= 0.318 USER MOD Set 4.1: B 28 LYS NZ :NH3+ -116:sc= 1.21 (180deg=-0.324) USER MOD Set 4.2: B 29 ASN : amide:sc= -0.135 K(o=1.1,f=-5.1!) USER MOD Set 5.1: A 81 CYS SG : rot 77:sc= 1.23 USER MOD Set 5.2: A 110 THR OG1 : rot 67:sc= 0.586 USER MOD Set 6.1: A 57 TYR OH : rot -109:sc= -1.21! USER MOD Set 6.2: A 61 HIS : no HE2:sc= 0.429 K(o=-0.78,f=-3.3) USER MOD Set 7.1: A 47 THR OG1 : rot 117:sc= 0.244 USER MOD Set 7.2: A 49 THR OG1 : rot 180:sc= 0.256 USER MOD Set 8.1: A 28 LYS NZ :NH3+ -119:sc= 1.31 (180deg=-0.361) USER MOD Set 8.2: A 29 ASN : amide:sc= -0.184 K(o=1.1,f=-5.1!) USER MOD Single : A 2 SER OG : rot 38:sc= 0.0483 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 SER OG : rot 47:sc= -0.357 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 LYS NZ :NH3+ -170:sc= -0.0182 (180deg=-0.176) USER MOD Single : A 22 CYS SG : rot 71:sc= 0.0776 USER MOD Single : A 23 MET CE :methyl -128:sc= -1.17 (180deg=-1.5) USER MOD Single : A 24 SER OG : rot 10:sc= -0.189 USER MOD Single : A 26 THR OG1 : rot 176:sc= 0.349 USER MOD Single : A 30 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 37 SER OG : rot -160:sc= 0 USER MOD Single : A 39 SER OG : rot 180:sc= 0.00633 USER MOD Single : A 45 ASN : amide:sc= -0.179 K(o=-0.18,f=-2.9!) USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 53 LYS NZ :NH3+ 162:sc= -0.968 (180deg=-1.63) USER MOD Single : A 58 CYS SG : rot 93:sc= -0.124 USER MOD Single : A 60 HIS : no HD1:sc= 0 X(o=0,f=-0.08) USER MOD Single : A 62 HIS : no HD1:sc= -0.567 X(o=-0.57,f=-0.64) USER MOD Single : A 63 GLN : amide:sc= 0 X(o=0,f=-0.28) USER MOD Single : A 64 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 76 TYR OH : rot -21:sc= 0.951 USER MOD Single : A 82 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0724) USER MOD Single : A 85 GLN : amide:sc= -0.41 X(o=-0.41,f=-0.59) USER MOD Single : A 87 THR OG1 : rot -170:sc= -0.287 USER MOD Single : A 96 ASN : amide:sc= 0 X(o=0,f=-0.43) USER MOD Single : A 97 TYR OH : rot 180:sc= -0.87 USER MOD Single : A 101 LYS NZ :NH3+ -165:sc= -0.428 (180deg=-0.948) USER MOD Single : A 107 THR OG1 : rot 66:sc= 0.176 USER MOD Single : A 108 CYS SG : rot 73:sc= 0.971 USER MOD Single : A 109 LYS NZ :NH3+ -108:sc= 0.211 (180deg=-0.14) USER MOD Single : A 113 ASN : amide:sc= -0.0174 K(o=-0.017,f=-0.67) USER MOD Single : A 114 MET CE :methyl -130:sc= -0.923 (180deg=-2.19!) USER MOD Single : B 2 SER OG : rot 33:sc= 0.0743 USER MOD Single : B 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 8 SER OG : rot 50:sc= -0.335 USER MOD Single : B 9 SER OG : rot 180:sc= 0 USER MOD Single : B 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 18 LYS NZ :NH3+ -172:sc=-0.00477 (180deg=-0.0912) USER MOD Single : B 22 CYS SG : rot 77:sc= 0.263 USER MOD Single : B 23 MET CE :methyl -129:sc= -1.05 (180deg=-1.29) USER MOD Single : B 24 SER OG : rot 8:sc= -0.146 USER MOD Single : B 26 THR OG1 : rot 176:sc= 0.397 USER MOD Single : B 30 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 37 SER OG : rot -160:sc= 0 USER MOD Single : B 39 SER OG : rot 180:sc= 0 USER MOD Single : B 45 ASN : amide:sc= -0.226 K(o=-0.23,f=-3!) USER MOD Single : B 48 SER OG : rot 180:sc= 0 USER MOD Single : B 53 LYS NZ :NH3+ 163:sc= -0.811 (180deg=-1.48) USER MOD Single : B 58 CYS SG : rot 92:sc= -0.241 USER MOD Single : B 60 HIS : no HD1:sc= 0 X(o=0,f=-0.12) USER MOD Single : B 62 HIS : no HD1:sc= -0.617 X(o=-0.62,f=-0.58) USER MOD Single : B 63 GLN : amide:sc= 0 X(o=0,f=-0.35) USER MOD Single : B 64 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 68 SER OG : rot 180:sc= 0 USER MOD Single : B 76 TYR OH : rot -21:sc= 0.956 USER MOD Single : B 82 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0629) USER MOD Single : B 85 GLN : amide:sc= -0.0888 X(o=-0.089,f=-0.56) USER MOD Single : B 87 THR OG1 : rot 179:sc= -0.255 USER MOD Single : B 96 ASN : amide:sc= 0 X(o=0,f=-0.43) USER MOD Single : B 97 TYR OH : rot 180:sc= -0.81 USER MOD Single : B 101 LYS NZ :NH3+ -175:sc= -0.0165 (180deg=-0.253) USER MOD Single : B 107 THR OG1 : rot 67:sc= 0.159 USER MOD Single : B 108 CYS SG : rot 74:sc= 1.01 USER MOD Single : B 109 LYS NZ :NH3+ -108:sc= 0.282 (180deg=-0.138) USER MOD Single : B 113 ASN : amide:sc= -0.0225 K(o=-0.022,f=-0.7) USER MOD Single : B 114 MET CE :methyl -132:sc= -1.15 (180deg=-2.49!) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 2 -15.064 -12.503 -19.519 1.00 34.53 N ATOM 2 CA SER A 2 -15.821 -13.019 -18.352 1.00 11.44 C ATOM 3 C SER A 2 -15.969 -11.907 -17.316 1.00 52.22 C ATOM 4 O SER A 2 -14.968 -11.416 -16.801 1.00 51.45 O ATOM 5 CB SER A 2 -15.101 -14.236 -17.738 1.00 3.32 C ATOM 6 OG SER A 2 -14.970 -15.281 -18.684 1.00 23.24 O ATOM 0 HA SER A 2 -16.810 -13.341 -18.678 1.00 11.44 H new ATOM 0 HB2 SER A 2 -14.115 -13.938 -17.382 1.00 3.32 H new ATOM 0 HB3 SER A 2 -15.658 -14.593 -16.872 1.00 3.32 H new ATOM 0 HG SER A 2 -14.781 -14.901 -19.567 1.00 23.24 H new ATOM 14 N LEU A 3 -17.216 -11.513 -17.015 1.00 33.31 N ATOM 15 CA LEU A 3 -17.505 -10.354 -16.160 1.00 22.24 C ATOM 16 C LEU A 3 -18.129 -10.797 -14.828 1.00 62.21 C ATOM 17 O LEU A 3 -19.181 -11.442 -14.815 1.00 50.35 O ATOM 18 CB LEU A 3 -18.458 -9.388 -16.910 1.00 72.24 C ATOM 19 CG LEU A 3 -17.923 -8.817 -18.259 1.00 13.22 C ATOM 20 CD1 LEU A 3 -19.049 -8.141 -19.057 1.00 64.04 C ATOM 21 CD2 LEU A 3 -16.741 -7.856 -18.035 1.00 41.42 C ATOM 0 H LEU A 3 -18.051 -11.989 -17.358 1.00 33.31 H new ATOM 0 HA LEU A 3 -16.571 -9.839 -15.935 1.00 22.24 H new ATOM 0 HB2 LEU A 3 -19.395 -9.910 -17.104 1.00 72.24 H new ATOM 0 HB3 LEU A 3 -18.690 -8.552 -16.250 1.00 72.24 H new ATOM 0 HG LEU A 3 -17.553 -9.655 -18.849 1.00 13.22 H new ATOM 0 HD11 LEU A 3 -18.648 -7.752 -19.993 1.00 64.04 H new ATOM 0 HD12 LEU A 3 -19.831 -8.870 -19.272 1.00 64.04 H new ATOM 0 HD13 LEU A 3 -19.468 -7.322 -18.473 1.00 64.04 H new ATOM 0 HD21 LEU A 3 -16.393 -7.477 -18.996 1.00 41.42 H new ATOM 0 HD22 LEU A 3 -17.063 -7.022 -17.411 1.00 41.42 H new ATOM 0 HD23 LEU A 3 -15.929 -8.388 -17.539 1.00 41.42 H new ATOM 33 N VAL A 4 -17.451 -10.476 -13.715 1.00 32.42 N ATOM 34 CA VAL A 4 -18.019 -10.568 -12.358 1.00 3.21 C ATOM 35 C VAL A 4 -18.473 -9.161 -11.929 1.00 53.22 C ATOM 36 O VAL A 4 -17.877 -8.157 -12.334 1.00 33.01 O ATOM 37 CB VAL A 4 -17.000 -11.164 -11.313 1.00 45.41 C ATOM 38 CG1 VAL A 4 -16.629 -12.620 -11.674 1.00 14.33 C ATOM 39 CG2 VAL A 4 -15.733 -10.282 -11.176 1.00 71.52 C ATOM 0 H VAL A 4 -16.487 -10.143 -13.730 1.00 32.42 H new ATOM 0 HA VAL A 4 -18.865 -11.255 -12.382 1.00 3.21 H new ATOM 0 HB VAL A 4 -17.494 -11.170 -10.342 1.00 45.41 H new ATOM 0 HG11 VAL A 4 -15.925 -13.009 -10.938 1.00 14.33 H new ATOM 0 HG12 VAL A 4 -17.529 -13.235 -11.676 1.00 14.33 H new ATOM 0 HG13 VAL A 4 -16.171 -12.644 -12.663 1.00 14.33 H new ATOM 0 HG21 VAL A 4 -15.057 -10.728 -10.447 1.00 71.52 H new ATOM 0 HG22 VAL A 4 -15.231 -10.213 -12.141 1.00 71.52 H new ATOM 0 HG23 VAL A 4 -16.019 -9.284 -10.844 1.00 71.52 H new ATOM 49 N LYS A 5 -19.528 -9.092 -11.117 1.00 33.13 N ATOM 50 CA LYS A 5 -20.190 -7.826 -10.778 1.00 2.23 C ATOM 51 C LYS A 5 -19.645 -7.257 -9.455 1.00 14.12 C ATOM 52 O LYS A 5 -19.503 -7.990 -8.475 1.00 60.21 O ATOM 53 CB LYS A 5 -21.718 -8.061 -10.697 1.00 22.21 C ATOM 54 CG LYS A 5 -22.354 -8.598 -12.003 1.00 50.13 C ATOM 55 CD LYS A 5 -23.888 -8.780 -11.887 1.00 42.12 C ATOM 56 CE LYS A 5 -24.531 -9.290 -13.185 1.00 34.51 C ATOM 57 NZ LYS A 5 -26.006 -9.453 -13.042 1.00 74.02 N ATOM 0 H LYS A 5 -19.949 -9.909 -10.675 1.00 33.13 H new ATOM 0 HA LYS A 5 -19.982 -7.090 -11.555 1.00 2.23 H new ATOM 0 HB2 LYS A 5 -21.922 -8.766 -9.891 1.00 22.21 H new ATOM 0 HB3 LYS A 5 -22.204 -7.122 -10.430 1.00 22.21 H new ATOM 0 HG2 LYS A 5 -22.134 -7.910 -12.819 1.00 50.13 H new ATOM 0 HG3 LYS A 5 -21.897 -9.554 -12.259 1.00 50.13 H new ATOM 0 HD2 LYS A 5 -24.105 -9.480 -11.081 1.00 42.12 H new ATOM 0 HD3 LYS A 5 -24.342 -7.828 -11.613 1.00 42.12 H new ATOM 0 HE2 LYS A 5 -24.319 -8.592 -13.995 1.00 34.51 H new ATOM 0 HE3 LYS A 5 -24.084 -10.245 -13.462 1.00 34.51 H new ATOM 0 HZ1 LYS A 5 -26.406 -9.799 -13.938 1.00 74.02 H new ATOM 0 HZ2 LYS A 5 -26.208 -10.138 -12.286 1.00 74.02 H new ATOM 0 HZ3 LYS A 5 -26.435 -8.536 -12.803 1.00 74.02 H new ATOM 71 N LEU A 6 -19.317 -5.950 -9.451 1.00 51.25 N ATOM 72 CA LEU A 6 -18.870 -5.214 -8.247 1.00 72.35 C ATOM 73 C LEU A 6 -19.802 -4.020 -8.000 1.00 64.41 C ATOM 74 O LEU A 6 -19.757 -3.036 -8.740 1.00 2.45 O ATOM 75 CB LEU A 6 -17.406 -4.701 -8.403 1.00 12.35 C ATOM 76 CG LEU A 6 -16.306 -5.783 -8.599 1.00 31.14 C ATOM 77 CD1 LEU A 6 -14.931 -5.122 -8.786 1.00 44.13 C ATOM 78 CD2 LEU A 6 -16.281 -6.798 -7.435 1.00 75.12 C ATOM 0 H LEU A 6 -19.354 -5.369 -10.289 1.00 51.25 H new ATOM 0 HA LEU A 6 -18.903 -5.900 -7.401 1.00 72.35 H new ATOM 0 HB2 LEU A 6 -17.372 -4.022 -9.255 1.00 12.35 H new ATOM 0 HB3 LEU A 6 -17.154 -4.115 -7.519 1.00 12.35 H new ATOM 0 HG LEU A 6 -16.549 -6.342 -9.503 1.00 31.14 H new ATOM 0 HD11 LEU A 6 -14.172 -5.893 -8.922 1.00 44.13 H new ATOM 0 HD12 LEU A 6 -14.954 -4.477 -9.664 1.00 44.13 H new ATOM 0 HD13 LEU A 6 -14.690 -4.527 -7.905 1.00 44.13 H new ATOM 0 HD21 LEU A 6 -15.498 -7.536 -7.612 1.00 75.12 H new ATOM 0 HD22 LEU A 6 -16.081 -6.275 -6.500 1.00 75.12 H new ATOM 0 HD23 LEU A 6 -17.246 -7.301 -7.370 1.00 75.12 H new ATOM 90 N GLU A 7 -20.647 -4.113 -6.968 1.00 11.31 N ATOM 91 CA GLU A 7 -21.519 -3.001 -6.561 1.00 11.34 C ATOM 92 C GLU A 7 -20.735 -2.045 -5.655 1.00 33.10 C ATOM 93 O GLU A 7 -20.259 -2.450 -4.608 1.00 25.03 O ATOM 94 CB GLU A 7 -22.816 -3.517 -5.856 1.00 63.24 C ATOM 95 CG GLU A 7 -24.073 -3.440 -6.744 1.00 52.23 C ATOM 96 CD GLU A 7 -25.357 -3.848 -6.017 1.00 52.41 C ATOM 97 OE1 GLU A 7 -25.953 -2.991 -5.325 1.00 22.55 O ATOM 98 OE2 GLU A 7 -25.777 -5.021 -6.122 1.00 42.33 O ATOM 0 H GLU A 7 -20.747 -4.951 -6.395 1.00 11.31 H new ATOM 0 HA GLU A 7 -21.840 -2.462 -7.453 1.00 11.34 H new ATOM 0 HB2 GLU A 7 -22.664 -4.551 -5.545 1.00 63.24 H new ATOM 0 HB3 GLU A 7 -22.984 -2.933 -4.951 1.00 63.24 H new ATOM 0 HG2 GLU A 7 -24.183 -2.422 -7.117 1.00 52.23 H new ATOM 0 HG3 GLU A 7 -23.935 -4.084 -7.612 1.00 52.23 H new ATOM 105 N SER A 8 -20.602 -0.785 -6.078 1.00 60.13 N ATOM 106 CA SER A 8 -19.962 0.278 -5.278 1.00 2.24 C ATOM 107 C SER A 8 -20.885 0.744 -4.128 1.00 54.20 C ATOM 108 O SER A 8 -21.985 0.203 -3.934 1.00 64.42 O ATOM 109 CB SER A 8 -19.620 1.453 -6.218 1.00 70.41 C ATOM 110 OG SER A 8 -20.768 1.882 -6.937 1.00 62.32 O ATOM 0 H SER A 8 -20.935 -0.466 -6.988 1.00 60.13 H new ATOM 0 HA SER A 8 -19.052 -0.108 -4.819 1.00 2.24 H new ATOM 0 HB2 SER A 8 -19.220 2.284 -5.637 1.00 70.41 H new ATOM 0 HB3 SER A 8 -18.841 1.149 -6.917 1.00 70.41 H new ATOM 0 HG SER A 8 -21.524 1.976 -6.320 1.00 62.32 H new ATOM 116 N SER A 9 -20.420 1.759 -3.366 1.00 54.22 N ATOM 117 CA SER A 9 -21.223 2.423 -2.315 1.00 72.41 C ATOM 118 C SER A 9 -22.497 3.090 -2.901 1.00 24.12 C ATOM 119 O SER A 9 -23.470 3.316 -2.182 1.00 65.11 O ATOM 120 CB SER A 9 -20.355 3.470 -1.574 1.00 15.50 C ATOM 121 OG SER A 9 -21.061 4.073 -0.502 1.00 45.50 O ATOM 0 H SER A 9 -19.479 2.140 -3.462 1.00 54.22 H new ATOM 0 HA SER A 9 -21.551 1.661 -1.608 1.00 72.41 H new ATOM 0 HB2 SER A 9 -19.454 2.991 -1.192 1.00 15.50 H new ATOM 0 HB3 SER A 9 -20.034 4.239 -2.276 1.00 15.50 H new ATOM 0 HG SER A 9 -20.483 4.727 -0.056 1.00 45.50 H new ATOM 127 N ASP A 10 -22.468 3.392 -4.209 1.00 52.41 N ATOM 128 CA ASP A 10 -23.587 4.023 -4.934 1.00 71.11 C ATOM 129 C ASP A 10 -24.474 2.968 -5.632 1.00 53.54 C ATOM 130 O ASP A 10 -25.305 3.326 -6.483 1.00 14.13 O ATOM 131 CB ASP A 10 -23.021 5.021 -5.979 1.00 11.53 C ATOM 132 CG ASP A 10 -22.213 6.160 -5.338 1.00 31.31 C ATOM 133 OD1 ASP A 10 -22.737 7.286 -5.209 1.00 72.10 O ATOM 134 OD2 ASP A 10 -21.035 5.938 -4.989 1.00 11.24 O ATOM 0 H ASP A 10 -21.659 3.204 -4.801 1.00 52.41 H new ATOM 0 HA ASP A 10 -24.211 4.554 -4.215 1.00 71.11 H new ATOM 0 HB2 ASP A 10 -22.386 4.482 -6.682 1.00 11.53 H new ATOM 0 HB3 ASP A 10 -23.845 5.445 -6.553 1.00 11.53 H new ATOM 139 N GLU A 11 -24.269 1.665 -5.284 1.00 22.01 N ATOM 140 CA GLU A 11 -25.072 0.525 -5.802 1.00 42.31 C ATOM 141 C GLU A 11 -24.871 0.309 -7.318 1.00 20.33 C ATOM 142 O GLU A 11 -25.654 -0.403 -7.957 1.00 72.15 O ATOM 143 CB GLU A 11 -26.584 0.704 -5.453 1.00 32.42 C ATOM 144 CG GLU A 11 -26.894 0.757 -3.939 1.00 11.24 C ATOM 145 CD GLU A 11 -28.368 1.091 -3.634 1.00 5.55 C ATOM 146 OE1 GLU A 11 -28.683 2.262 -3.341 1.00 3.11 O ATOM 147 OE2 GLU A 11 -29.228 0.194 -3.710 1.00 43.35 O ATOM 0 H GLU A 11 -23.538 1.378 -4.633 1.00 22.01 H new ATOM 0 HA GLU A 11 -24.710 -0.375 -5.304 1.00 42.31 H new ATOM 0 HB2 GLU A 11 -26.944 1.623 -5.916 1.00 32.42 H new ATOM 0 HB3 GLU A 11 -27.145 -0.118 -5.897 1.00 32.42 H new ATOM 0 HG2 GLU A 11 -26.645 -0.204 -3.490 1.00 11.24 H new ATOM 0 HG3 GLU A 11 -26.254 1.504 -3.469 1.00 11.24 H new ATOM 154 N LYS A 12 -23.798 0.911 -7.880 1.00 64.12 N ATOM 155 CA LYS A 12 -23.482 0.818 -9.315 1.00 11.34 C ATOM 156 C LYS A 12 -22.746 -0.499 -9.598 1.00 51.54 C ATOM 157 O LYS A 12 -21.686 -0.754 -9.018 1.00 11.41 O ATOM 158 CB LYS A 12 -22.622 2.033 -9.756 1.00 42.34 C ATOM 159 CG LYS A 12 -23.325 3.403 -9.630 1.00 35.21 C ATOM 160 CD LYS A 12 -24.578 3.523 -10.529 1.00 51.45 C ATOM 161 CE LYS A 12 -25.249 4.900 -10.432 1.00 51.12 C ATOM 162 NZ LYS A 12 -26.446 4.997 -11.317 1.00 63.41 N ATOM 0 H LYS A 12 -23.132 1.472 -7.349 1.00 64.12 H new ATOM 0 HA LYS A 12 -24.409 0.832 -9.888 1.00 11.34 H new ATOM 0 HB2 LYS A 12 -21.711 2.052 -9.158 1.00 42.34 H new ATOM 0 HB3 LYS A 12 -22.320 1.889 -10.793 1.00 42.34 H new ATOM 0 HG2 LYS A 12 -23.613 3.563 -8.591 1.00 35.21 H new ATOM 0 HG3 LYS A 12 -22.620 4.192 -9.891 1.00 35.21 H new ATOM 0 HD2 LYS A 12 -24.296 3.333 -11.565 1.00 51.45 H new ATOM 0 HD3 LYS A 12 -25.296 2.753 -10.248 1.00 51.45 H new ATOM 0 HE2 LYS A 12 -25.544 5.089 -9.400 1.00 51.12 H new ATOM 0 HE3 LYS A 12 -24.532 5.674 -10.705 1.00 51.12 H new ATOM 0 HZ1 LYS A 12 -26.871 5.941 -11.223 1.00 63.41 H new ATOM 0 HZ2 LYS A 12 -26.161 4.842 -12.305 1.00 63.41 H new ATOM 0 HZ3 LYS A 12 -27.142 4.275 -11.040 1.00 63.41 H new ATOM 176 N VAL A 13 -23.330 -1.314 -10.490 1.00 53.11 N ATOM 177 CA VAL A 13 -22.811 -2.637 -10.858 1.00 33.23 C ATOM 178 C VAL A 13 -21.716 -2.499 -11.934 1.00 63.11 C ATOM 179 O VAL A 13 -22.007 -2.379 -13.132 1.00 24.03 O ATOM 180 CB VAL A 13 -23.977 -3.577 -11.367 1.00 43.32 C ATOM 181 CG1 VAL A 13 -23.460 -4.977 -11.775 1.00 52.43 C ATOM 182 CG2 VAL A 13 -25.096 -3.688 -10.304 1.00 1.05 C ATOM 0 H VAL A 13 -24.189 -1.067 -10.982 1.00 53.11 H new ATOM 0 HA VAL A 13 -22.373 -3.094 -9.971 1.00 33.23 H new ATOM 0 HB VAL A 13 -24.395 -3.117 -12.262 1.00 43.32 H new ATOM 0 HG11 VAL A 13 -24.295 -5.588 -12.118 1.00 52.43 H new ATOM 0 HG12 VAL A 13 -22.731 -4.876 -12.579 1.00 52.43 H new ATOM 0 HG13 VAL A 13 -22.989 -5.455 -10.916 1.00 52.43 H new ATOM 0 HG21 VAL A 13 -25.887 -4.339 -10.675 1.00 1.05 H new ATOM 0 HG22 VAL A 13 -24.685 -4.105 -9.385 1.00 1.05 H new ATOM 0 HG23 VAL A 13 -25.505 -2.698 -10.102 1.00 1.05 H new ATOM 192 N PHE A 14 -20.458 -2.456 -11.484 1.00 22.11 N ATOM 193 CA PHE A 14 -19.288 -2.491 -12.368 1.00 12.33 C ATOM 194 C PHE A 14 -18.952 -3.944 -12.707 1.00 72.31 C ATOM 195 O PHE A 14 -18.279 -4.634 -11.931 1.00 35.13 O ATOM 196 CB PHE A 14 -18.083 -1.778 -11.703 1.00 41.02 C ATOM 197 CG PHE A 14 -18.301 -0.285 -11.512 1.00 13.11 C ATOM 198 CD1 PHE A 14 -18.100 0.599 -12.572 1.00 71.14 C ATOM 199 CD2 PHE A 14 -18.726 0.234 -10.291 1.00 24.13 C ATOM 200 CE1 PHE A 14 -18.318 1.947 -12.416 1.00 21.44 C ATOM 201 CE2 PHE A 14 -18.938 1.583 -10.136 1.00 72.42 C ATOM 202 CZ PHE A 14 -18.735 2.442 -11.200 1.00 23.34 C ATOM 0 H PHE A 14 -20.222 -2.396 -10.494 1.00 22.11 H new ATOM 0 HA PHE A 14 -19.515 -1.959 -13.292 1.00 12.33 H new ATOM 0 HB2 PHE A 14 -17.887 -2.237 -10.734 1.00 41.02 H new ATOM 0 HB3 PHE A 14 -17.194 -1.934 -12.315 1.00 41.02 H new ATOM 0 HD1 PHE A 14 -17.769 0.219 -13.527 1.00 71.14 H new ATOM 0 HD2 PHE A 14 -18.891 -0.432 -9.457 1.00 24.13 H new ATOM 0 HE1 PHE A 14 -18.162 2.619 -13.247 1.00 21.44 H new ATOM 0 HE2 PHE A 14 -19.263 1.972 -9.183 1.00 72.42 H new ATOM 0 HZ PHE A 14 -18.903 3.502 -11.078 1.00 23.34 H new ATOM 212 N GLU A 15 -19.495 -4.420 -13.837 1.00 64.54 N ATOM 213 CA GLU A 15 -19.175 -5.745 -14.371 1.00 74.34 C ATOM 214 C GLU A 15 -17.745 -5.709 -14.928 1.00 0.02 C ATOM 215 O GLU A 15 -17.510 -5.269 -16.060 1.00 2.15 O ATOM 216 CB GLU A 15 -20.182 -6.157 -15.468 1.00 64.21 C ATOM 217 CG GLU A 15 -21.648 -6.171 -15.004 1.00 53.41 C ATOM 218 CD GLU A 15 -22.624 -6.575 -16.114 1.00 60.23 C ATOM 219 OE1 GLU A 15 -22.948 -5.726 -16.960 1.00 3.14 O ATOM 220 OE2 GLU A 15 -23.069 -7.740 -16.142 1.00 14.23 O ATOM 0 H GLU A 15 -20.165 -3.898 -14.402 1.00 64.54 H new ATOM 0 HA GLU A 15 -19.244 -6.488 -13.576 1.00 74.34 H new ATOM 0 HB2 GLU A 15 -20.086 -5.472 -16.310 1.00 64.21 H new ATOM 0 HB3 GLU A 15 -19.919 -7.150 -15.833 1.00 64.21 H new ATOM 0 HG2 GLU A 15 -21.752 -6.862 -14.167 1.00 53.41 H new ATOM 0 HG3 GLU A 15 -21.916 -5.181 -14.635 1.00 53.41 H new ATOM 227 N ILE A 16 -16.797 -6.102 -14.082 1.00 53.11 N ATOM 228 CA ILE A 16 -15.366 -6.080 -14.398 1.00 64.03 C ATOM 229 C ILE A 16 -14.917 -7.485 -14.834 1.00 45.13 C ATOM 230 O ILE A 16 -15.531 -8.481 -14.442 1.00 45.01 O ATOM 231 CB ILE A 16 -14.542 -5.597 -13.141 1.00 3.01 C ATOM 232 CG1 ILE A 16 -13.072 -5.250 -13.516 1.00 4.31 C ATOM 233 CG2 ILE A 16 -14.577 -6.649 -12.004 1.00 75.22 C ATOM 234 CD1 ILE A 16 -12.917 -4.147 -14.552 1.00 43.12 C ATOM 0 H ILE A 16 -17.000 -6.450 -13.145 1.00 53.11 H new ATOM 0 HA ILE A 16 -15.184 -5.382 -15.215 1.00 64.03 H new ATOM 0 HB ILE A 16 -15.020 -4.687 -12.779 1.00 3.01 H new ATOM 0 HG12 ILE A 16 -12.542 -4.955 -12.611 1.00 4.31 H new ATOM 0 HG13 ILE A 16 -12.586 -6.151 -13.891 1.00 4.31 H new ATOM 0 HG21 ILE A 16 -14.000 -6.285 -11.154 1.00 75.22 H new ATOM 0 HG22 ILE A 16 -15.609 -6.818 -11.697 1.00 75.22 H new ATOM 0 HG23 ILE A 16 -14.147 -7.585 -12.361 1.00 75.22 H new ATOM 0 HD11 ILE A 16 -11.858 -3.977 -14.747 1.00 43.12 H new ATOM 0 HD12 ILE A 16 -13.413 -4.443 -15.476 1.00 43.12 H new ATOM 0 HD13 ILE A 16 -13.368 -3.229 -14.176 1.00 43.12 H new ATOM 246 N GLU A 17 -13.861 -7.554 -15.662 1.00 40.42 N ATOM 247 CA GLU A 17 -13.253 -8.828 -16.062 1.00 55.32 C ATOM 248 C GLU A 17 -12.705 -9.580 -14.837 1.00 21.01 C ATOM 249 O GLU A 17 -12.142 -8.972 -13.913 1.00 11.32 O ATOM 250 CB GLU A 17 -12.143 -8.599 -17.123 1.00 11.10 C ATOM 251 CG GLU A 17 -12.666 -8.390 -18.562 1.00 10.13 C ATOM 252 CD GLU A 17 -13.304 -9.664 -19.161 1.00 10.42 C ATOM 253 OE1 GLU A 17 -12.638 -10.726 -19.164 1.00 13.40 O ATOM 254 OE2 GLU A 17 -14.449 -9.613 -19.650 1.00 32.42 O ATOM 0 H GLU A 17 -13.410 -6.734 -16.068 1.00 40.42 H new ATOM 0 HA GLU A 17 -14.026 -9.448 -16.516 1.00 55.32 H new ATOM 0 HB2 GLU A 17 -11.555 -7.728 -16.833 1.00 11.10 H new ATOM 0 HB3 GLU A 17 -11.469 -9.455 -17.116 1.00 11.10 H new ATOM 0 HG2 GLU A 17 -13.402 -7.586 -18.562 1.00 10.13 H new ATOM 0 HG3 GLU A 17 -11.842 -8.068 -19.199 1.00 10.13 H new ATOM 261 N LYS A 18 -12.881 -10.908 -14.872 1.00 71.23 N ATOM 262 CA LYS A 18 -12.515 -11.824 -13.789 1.00 15.40 C ATOM 263 C LYS A 18 -11.004 -11.776 -13.516 1.00 13.44 C ATOM 264 O LYS A 18 -10.588 -11.796 -12.357 1.00 11.41 O ATOM 265 CB LYS A 18 -12.972 -13.266 -14.155 1.00 30.30 C ATOM 266 CG LYS A 18 -12.575 -14.355 -13.133 1.00 73.03 C ATOM 267 CD LYS A 18 -13.168 -14.133 -11.723 1.00 5.42 C ATOM 268 CE LYS A 18 -12.676 -15.194 -10.724 1.00 75.44 C ATOM 269 NZ LYS A 18 -12.972 -16.575 -11.184 1.00 24.52 N ATOM 0 H LYS A 18 -13.292 -11.384 -15.675 1.00 71.23 H new ATOM 0 HA LYS A 18 -13.020 -11.514 -12.874 1.00 15.40 H new ATOM 0 HB2 LYS A 18 -14.056 -13.270 -14.266 1.00 30.30 H new ATOM 0 HB3 LYS A 18 -12.552 -13.529 -15.126 1.00 30.30 H new ATOM 0 HG2 LYS A 18 -12.901 -15.326 -13.506 1.00 73.03 H new ATOM 0 HG3 LYS A 18 -11.488 -14.391 -13.058 1.00 73.03 H new ATOM 0 HD2 LYS A 18 -12.893 -13.141 -11.365 1.00 5.42 H new ATOM 0 HD3 LYS A 18 -14.256 -14.162 -11.777 1.00 5.42 H new ATOM 0 HE2 LYS A 18 -11.601 -15.083 -10.578 1.00 75.44 H new ATOM 0 HE3 LYS A 18 -13.148 -15.026 -9.756 1.00 75.44 H new ATOM 0 HZ1 LYS A 18 -12.780 -17.246 -10.413 1.00 24.52 H new ATOM 0 HZ2 LYS A 18 -13.972 -16.642 -11.460 1.00 24.52 H new ATOM 0 HZ3 LYS A 18 -12.371 -16.805 -12.001 1.00 24.52 H new ATOM 283 N GLU A 19 -10.209 -11.677 -14.596 1.00 5.52 N ATOM 284 CA GLU A 19 -8.735 -11.620 -14.512 1.00 50.23 C ATOM 285 C GLU A 19 -8.280 -10.384 -13.712 1.00 52.31 C ATOM 286 O GLU A 19 -7.360 -10.459 -12.899 1.00 73.34 O ATOM 287 CB GLU A 19 -8.113 -11.594 -15.936 1.00 24.03 C ATOM 288 CG GLU A 19 -8.709 -12.618 -16.928 1.00 1.03 C ATOM 289 CD GLU A 19 -8.730 -14.066 -16.393 1.00 20.24 C ATOM 290 OE1 GLU A 19 -9.802 -14.539 -15.944 1.00 42.14 O ATOM 291 OE2 GLU A 19 -7.671 -14.726 -16.413 1.00 12.33 O ATOM 0 H GLU A 19 -10.567 -11.634 -15.550 1.00 5.52 H new ATOM 0 HA GLU A 19 -8.389 -12.513 -13.992 1.00 50.23 H new ATOM 0 HB2 GLU A 19 -8.236 -10.594 -16.352 1.00 24.03 H new ATOM 0 HB3 GLU A 19 -7.041 -11.774 -15.851 1.00 24.03 H new ATOM 0 HG2 GLU A 19 -9.727 -12.318 -17.177 1.00 1.03 H new ATOM 0 HG3 GLU A 19 -8.133 -12.591 -17.853 1.00 1.03 H new ATOM 298 N ILE A 20 -8.989 -9.263 -13.942 1.00 41.23 N ATOM 299 CA ILE A 20 -8.749 -7.978 -13.266 1.00 22.10 C ATOM 300 C ILE A 20 -9.118 -8.078 -11.772 1.00 73.22 C ATOM 301 O ILE A 20 -8.375 -7.621 -10.898 1.00 53.32 O ATOM 302 CB ILE A 20 -9.590 -6.840 -13.955 1.00 14.04 C ATOM 303 CG1 ILE A 20 -9.171 -6.668 -15.448 1.00 1.24 C ATOM 304 CG2 ILE A 20 -9.483 -5.509 -13.182 1.00 14.14 C ATOM 305 CD1 ILE A 20 -9.973 -5.633 -16.223 1.00 23.23 C ATOM 0 H ILE A 20 -9.756 -9.226 -14.613 1.00 41.23 H new ATOM 0 HA ILE A 20 -7.690 -7.735 -13.347 1.00 22.10 H new ATOM 0 HB ILE A 20 -10.638 -7.140 -13.933 1.00 14.04 H new ATOM 0 HG12 ILE A 20 -8.117 -6.392 -15.485 1.00 1.24 H new ATOM 0 HG13 ILE A 20 -9.266 -7.631 -15.950 1.00 1.24 H new ATOM 0 HG21 ILE A 20 -10.076 -4.746 -13.687 1.00 14.14 H new ATOM 0 HG22 ILE A 20 -9.856 -5.647 -12.167 1.00 14.14 H new ATOM 0 HG23 ILE A 20 -8.441 -5.192 -13.145 1.00 14.14 H new ATOM 0 HD11 ILE A 20 -9.609 -5.585 -17.249 1.00 23.23 H new ATOM 0 HD12 ILE A 20 -11.026 -5.915 -16.224 1.00 23.23 H new ATOM 0 HD13 ILE A 20 -9.859 -4.657 -15.752 1.00 23.23 H new ATOM 317 N ALA A 21 -10.272 -8.706 -11.509 1.00 13.51 N ATOM 318 CA ALA A 21 -10.797 -8.911 -10.149 1.00 34.41 C ATOM 319 C ALA A 21 -9.903 -9.871 -9.334 1.00 31.10 C ATOM 320 O ALA A 21 -9.893 -9.826 -8.102 1.00 62.14 O ATOM 321 CB ALA A 21 -12.234 -9.429 -10.240 1.00 42.31 C ATOM 0 H ALA A 21 -10.873 -9.089 -12.238 1.00 13.51 H new ATOM 0 HA ALA A 21 -10.793 -7.958 -9.620 1.00 34.41 H new ATOM 0 HB1 ALA A 21 -12.629 -9.583 -9.236 1.00 42.31 H new ATOM 0 HB2 ALA A 21 -12.851 -8.700 -10.765 1.00 42.31 H new ATOM 0 HB3 ALA A 21 -12.247 -10.374 -10.784 1.00 42.31 H new ATOM 327 N CYS A 22 -9.175 -10.752 -10.048 1.00 41.32 N ATOM 328 CA CYS A 22 -8.151 -11.626 -9.459 1.00 2.51 C ATOM 329 C CYS A 22 -6.861 -10.835 -9.133 1.00 23.33 C ATOM 330 O CYS A 22 -6.193 -11.131 -8.135 1.00 71.13 O ATOM 331 CB CYS A 22 -7.847 -12.802 -10.406 1.00 61.11 C ATOM 332 SG CYS A 22 -9.268 -13.877 -10.719 1.00 14.44 S ATOM 0 H CYS A 22 -9.284 -10.875 -11.055 1.00 41.32 H new ATOM 0 HA CYS A 22 -8.540 -12.024 -8.522 1.00 2.51 H new ATOM 0 HB2 CYS A 22 -7.486 -12.407 -11.356 1.00 61.11 H new ATOM 0 HB3 CYS A 22 -7.039 -13.398 -9.981 1.00 61.11 H new ATOM 0 HG CYS A 22 -10.130 -13.251 -11.465 1.00 14.44 H new ATOM 338 N MET A 23 -6.506 -9.837 -9.997 1.00 14.41 N ATOM 339 CA MET A 23 -5.341 -8.931 -9.749 1.00 4.03 C ATOM 340 C MET A 23 -5.563 -8.116 -8.462 1.00 65.21 C ATOM 341 O MET A 23 -4.612 -7.791 -7.731 1.00 2.52 O ATOM 342 CB MET A 23 -5.075 -7.946 -10.932 1.00 72.35 C ATOM 343 CG MET A 23 -4.775 -8.590 -12.290 1.00 23.25 C ATOM 344 SD MET A 23 -4.123 -7.404 -13.502 1.00 2.33 S ATOM 345 CE MET A 23 -5.321 -6.063 -13.465 1.00 22.34 C ATOM 0 H MET A 23 -7.005 -9.641 -10.864 1.00 14.41 H new ATOM 0 HA MET A 23 -4.467 -9.575 -9.648 1.00 4.03 H new ATOM 0 HB2 MET A 23 -5.946 -7.300 -11.043 1.00 72.35 H new ATOM 0 HB3 MET A 23 -4.235 -7.305 -10.663 1.00 72.35 H new ATOM 0 HG2 MET A 23 -4.054 -9.396 -12.153 1.00 23.25 H new ATOM 0 HG3 MET A 23 -5.687 -9.040 -12.683 1.00 23.25 H new ATOM 0 HE1 MET A 23 -5.654 -5.844 -14.480 1.00 22.34 H new ATOM 0 HE2 MET A 23 -6.177 -6.357 -12.857 1.00 22.34 H new ATOM 0 HE3 MET A 23 -4.859 -5.174 -13.035 1.00 22.34 H new ATOM 355 N SER A 24 -6.835 -7.776 -8.227 1.00 55.05 N ATOM 356 CA SER A 24 -7.295 -7.213 -6.966 1.00 70.31 C ATOM 357 C SER A 24 -7.291 -8.332 -5.909 1.00 43.41 C ATOM 358 O SER A 24 -8.156 -9.212 -5.936 1.00 62.32 O ATOM 359 CB SER A 24 -8.705 -6.616 -7.136 1.00 10.04 C ATOM 360 OG SER A 24 -9.138 -6.001 -5.943 1.00 42.30 O ATOM 0 H SER A 24 -7.577 -7.888 -8.918 1.00 55.05 H new ATOM 0 HA SER A 24 -6.634 -6.408 -6.645 1.00 70.31 H new ATOM 0 HB2 SER A 24 -8.700 -5.886 -7.945 1.00 10.04 H new ATOM 0 HB3 SER A 24 -9.405 -7.402 -7.420 1.00 10.04 H new ATOM 0 HG SER A 24 -8.392 -5.954 -5.310 1.00 42.30 H new ATOM 366 N VAL A 25 -6.286 -8.308 -5.011 1.00 14.41 N ATOM 367 CA VAL A 25 -6.040 -9.397 -4.048 1.00 3.43 C ATOM 368 C VAL A 25 -7.221 -9.568 -3.064 1.00 75.25 C ATOM 369 O VAL A 25 -7.609 -10.693 -2.775 1.00 33.53 O ATOM 370 CB VAL A 25 -4.687 -9.191 -3.267 1.00 61.44 C ATOM 371 CG1 VAL A 25 -4.396 -10.360 -2.281 1.00 1.31 C ATOM 372 CG2 VAL A 25 -3.503 -8.985 -4.250 1.00 62.02 C ATOM 0 H VAL A 25 -5.625 -7.535 -4.934 1.00 14.41 H new ATOM 0 HA VAL A 25 -5.953 -10.316 -4.628 1.00 3.43 H new ATOM 0 HB VAL A 25 -4.797 -8.286 -2.669 1.00 61.44 H new ATOM 0 HG11 VAL A 25 -3.454 -10.175 -1.765 1.00 1.31 H new ATOM 0 HG12 VAL A 25 -5.202 -10.429 -1.551 1.00 1.31 H new ATOM 0 HG13 VAL A 25 -4.328 -11.296 -2.836 1.00 1.31 H new ATOM 0 HG21 VAL A 25 -2.581 -8.845 -3.685 1.00 62.02 H new ATOM 0 HG22 VAL A 25 -3.406 -9.861 -4.892 1.00 62.02 H new ATOM 0 HG23 VAL A 25 -3.689 -8.104 -4.864 1.00 62.02 H new ATOM 382 N THR A 26 -7.799 -8.441 -2.598 1.00 34.03 N ATOM 383 CA THR A 26 -8.950 -8.436 -1.660 1.00 1.54 C ATOM 384 C THR A 26 -10.213 -9.072 -2.281 1.00 3.34 C ATOM 385 O THR A 26 -10.862 -9.905 -1.644 1.00 73.35 O ATOM 386 CB THR A 26 -9.260 -6.982 -1.171 1.00 65.31 C ATOM 387 OG1 THR A 26 -8.127 -6.474 -0.449 1.00 52.31 O ATOM 388 CG2 THR A 26 -10.524 -6.871 -0.286 1.00 51.43 C ATOM 0 H THR A 26 -7.484 -7.507 -2.859 1.00 34.03 H new ATOM 0 HA THR A 26 -8.664 -9.046 -0.803 1.00 1.54 H new ATOM 0 HB THR A 26 -9.459 -6.391 -2.065 1.00 65.31 H new ATOM 0 HG1 THR A 26 -8.293 -5.543 -0.192 1.00 52.31 H new ATOM 0 HG21 THR A 26 -10.670 -5.833 0.012 1.00 51.43 H new ATOM 0 HG22 THR A 26 -11.393 -7.213 -0.848 1.00 51.43 H new ATOM 0 HG23 THR A 26 -10.401 -7.489 0.603 1.00 51.43 H new ATOM 396 N ILE A 27 -10.540 -8.681 -3.529 1.00 23.41 N ATOM 397 CA ILE A 27 -11.713 -9.222 -4.255 1.00 73.13 C ATOM 398 C ILE A 27 -11.512 -10.727 -4.526 1.00 23.13 C ATOM 399 O ILE A 27 -12.433 -11.525 -4.345 1.00 75.45 O ATOM 400 CB ILE A 27 -11.969 -8.446 -5.599 1.00 33.01 C ATOM 401 CG1 ILE A 27 -12.244 -6.937 -5.309 1.00 4.31 C ATOM 402 CG2 ILE A 27 -13.130 -9.075 -6.414 1.00 74.11 C ATOM 403 CD1 ILE A 27 -12.369 -6.073 -6.551 1.00 64.34 C ATOM 0 H ILE A 27 -10.008 -7.991 -4.059 1.00 23.41 H new ATOM 0 HA ILE A 27 -12.594 -9.086 -3.628 1.00 73.13 H new ATOM 0 HB ILE A 27 -11.069 -8.526 -6.208 1.00 33.01 H new ATOM 0 HG12 ILE A 27 -13.163 -6.853 -4.728 1.00 4.31 H new ATOM 0 HG13 ILE A 27 -11.438 -6.546 -4.689 1.00 4.31 H new ATOM 0 HG21 ILE A 27 -13.276 -8.511 -7.335 1.00 74.11 H new ATOM 0 HG22 ILE A 27 -12.886 -10.109 -6.657 1.00 74.11 H new ATOM 0 HG23 ILE A 27 -14.046 -9.048 -5.823 1.00 74.11 H new ATOM 0 HD11 ILE A 27 -12.559 -5.040 -6.258 1.00 64.34 H new ATOM 0 HD12 ILE A 27 -11.443 -6.123 -7.124 1.00 64.34 H new ATOM 0 HD13 ILE A 27 -13.195 -6.434 -7.164 1.00 64.34 H new ATOM 415 N LYS A 28 -10.275 -11.087 -4.925 1.00 23.54 N ATOM 416 CA LYS A 28 -9.834 -12.486 -5.087 1.00 12.24 C ATOM 417 C LYS A 28 -10.048 -13.286 -3.778 1.00 42.41 C ATOM 418 O LYS A 28 -10.565 -14.401 -3.810 1.00 41.12 O ATOM 419 CB LYS A 28 -8.338 -12.509 -5.488 1.00 71.55 C ATOM 420 CG LYS A 28 -7.722 -13.920 -5.649 1.00 60.14 C ATOM 421 CD LYS A 28 -6.179 -13.911 -5.707 1.00 3.50 C ATOM 422 CE LYS A 28 -5.528 -13.280 -4.460 1.00 0.43 C ATOM 423 NZ LYS A 28 -6.005 -13.882 -3.185 1.00 71.23 N ATOM 0 H LYS A 28 -9.547 -10.407 -5.146 1.00 23.54 H new ATOM 0 HA LYS A 28 -10.429 -12.955 -5.870 1.00 12.24 H new ATOM 0 HB2 LYS A 28 -8.222 -11.970 -6.428 1.00 71.55 H new ATOM 0 HB3 LYS A 28 -7.768 -11.965 -4.735 1.00 71.55 H new ATOM 0 HG2 LYS A 28 -8.044 -14.546 -4.817 1.00 60.14 H new ATOM 0 HG3 LYS A 28 -8.110 -14.376 -6.560 1.00 60.14 H new ATOM 0 HD2 LYS A 28 -5.820 -14.934 -5.818 1.00 3.50 H new ATOM 0 HD3 LYS A 28 -5.858 -13.363 -6.593 1.00 3.50 H new ATOM 0 HE2 LYS A 28 -4.446 -13.393 -4.526 1.00 0.43 H new ATOM 0 HE3 LYS A 28 -5.737 -12.210 -4.450 1.00 0.43 H new ATOM 0 HZ1 LYS A 28 -6.465 -13.150 -2.606 1.00 71.23 H new ATOM 0 HZ2 LYS A 28 -6.687 -14.639 -3.392 1.00 71.23 H new ATOM 0 HZ3 LYS A 28 -5.197 -14.278 -2.664 1.00 71.23 H new ATOM 437 N ASN A 29 -9.673 -12.669 -2.632 1.00 30.15 N ATOM 438 CA ASN A 29 -9.804 -13.286 -1.291 1.00 33.21 C ATOM 439 C ASN A 29 -11.282 -13.512 -0.930 1.00 13.43 C ATOM 440 O ASN A 29 -11.617 -14.529 -0.335 1.00 14.42 O ATOM 441 CB ASN A 29 -9.132 -12.411 -0.195 1.00 74.12 C ATOM 442 CG ASN A 29 -7.606 -12.340 -0.284 1.00 3.51 C ATOM 443 OD1 ASN A 29 -6.939 -13.273 -0.730 1.00 53.45 O ATOM 444 ND2 ASN A 29 -7.039 -11.221 0.141 1.00 35.04 N ATOM 0 H ASN A 29 -9.272 -11.731 -2.611 1.00 30.15 H new ATOM 0 HA ASN A 29 -9.294 -14.249 -1.331 1.00 33.21 H new ATOM 0 HB2 ASN A 29 -9.534 -11.400 -0.259 1.00 74.12 H new ATOM 0 HB3 ASN A 29 -9.408 -12.803 0.784 1.00 74.12 H new ATOM 0 HD21 ASN A 29 -6.025 -11.117 0.103 1.00 35.04 H new ATOM 0 HD22 ASN A 29 -7.616 -10.463 0.506 1.00 35.04 H new ATOM 451 N MET A 30 -12.154 -12.546 -1.309 1.00 10.32 N ATOM 452 CA MET A 30 -13.618 -12.647 -1.106 1.00 11.31 C ATOM 453 C MET A 30 -14.178 -13.863 -1.864 1.00 74.12 C ATOM 454 O MET A 30 -14.944 -14.647 -1.300 1.00 41.02 O ATOM 455 CB MET A 30 -14.359 -11.339 -1.556 1.00 42.31 C ATOM 456 CG MET A 30 -14.565 -10.283 -0.453 1.00 5.44 C ATOM 457 SD MET A 30 -13.029 -9.681 0.284 1.00 40.42 S ATOM 458 CE MET A 30 -13.644 -8.463 1.457 1.00 52.22 C ATOM 0 H MET A 30 -11.863 -11.680 -1.762 1.00 10.32 H new ATOM 0 HA MET A 30 -13.795 -12.777 -0.038 1.00 11.31 H new ATOM 0 HB2 MET A 30 -13.795 -10.884 -2.370 1.00 42.31 H new ATOM 0 HB3 MET A 30 -15.334 -11.614 -1.959 1.00 42.31 H new ATOM 0 HG2 MET A 30 -15.111 -9.437 -0.871 1.00 5.44 H new ATOM 0 HG3 MET A 30 -15.190 -10.709 0.332 1.00 5.44 H new ATOM 0 HE1 MET A 30 -12.805 -8.010 1.985 1.00 52.22 H new ATOM 0 HE2 MET A 30 -14.197 -7.690 0.923 1.00 52.22 H new ATOM 0 HE3 MET A 30 -14.304 -8.950 2.175 1.00 52.22 H new ATOM 468 N ILE A 31 -13.755 -14.006 -3.135 1.00 43.44 N ATOM 469 CA ILE A 31 -14.163 -15.120 -4.012 1.00 74.20 C ATOM 470 C ILE A 31 -13.738 -16.470 -3.391 1.00 20.42 C ATOM 471 O ILE A 31 -14.566 -17.356 -3.223 1.00 14.03 O ATOM 472 CB ILE A 31 -13.555 -14.949 -5.463 1.00 34.30 C ATOM 473 CG1 ILE A 31 -14.084 -13.629 -6.116 1.00 33.42 C ATOM 474 CG2 ILE A 31 -13.854 -16.175 -6.368 1.00 33.45 C ATOM 475 CD1 ILE A 31 -13.436 -13.262 -7.443 1.00 3.31 C ATOM 0 H ILE A 31 -13.117 -13.348 -3.584 1.00 43.44 H new ATOM 0 HA ILE A 31 -15.249 -15.108 -4.104 1.00 74.20 H new ATOM 0 HB ILE A 31 -12.471 -14.885 -5.364 1.00 34.30 H new ATOM 0 HG12 ILE A 31 -15.159 -13.722 -6.268 1.00 33.42 H new ATOM 0 HG13 ILE A 31 -13.931 -12.808 -5.415 1.00 33.42 H new ATOM 0 HG21 ILE A 31 -13.418 -16.014 -7.354 1.00 33.45 H new ATOM 0 HG22 ILE A 31 -13.422 -17.071 -5.922 1.00 33.45 H new ATOM 0 HG23 ILE A 31 -14.932 -16.302 -6.464 1.00 33.45 H new ATOM 0 HD11 ILE A 31 -13.869 -12.333 -7.815 1.00 3.31 H new ATOM 0 HD12 ILE A 31 -12.363 -13.131 -7.300 1.00 3.31 H new ATOM 0 HD13 ILE A 31 -13.611 -14.059 -8.166 1.00 3.31 H new ATOM 487 N GLU A 32 -12.454 -16.560 -2.984 1.00 75.33 N ATOM 488 CA GLU A 32 -11.857 -17.787 -2.399 1.00 41.41 C ATOM 489 C GLU A 32 -12.493 -18.145 -1.033 1.00 23.02 C ATOM 490 O GLU A 32 -12.658 -19.324 -0.717 1.00 75.54 O ATOM 491 CB GLU A 32 -10.322 -17.610 -2.237 1.00 61.24 C ATOM 492 CG GLU A 32 -9.559 -17.402 -3.563 1.00 72.45 C ATOM 493 CD GLU A 32 -8.076 -17.071 -3.345 1.00 32.14 C ATOM 494 OE1 GLU A 32 -7.202 -17.923 -3.622 1.00 22.24 O ATOM 495 OE2 GLU A 32 -7.778 -15.958 -2.872 1.00 31.22 O ATOM 0 H GLU A 32 -11.797 -15.783 -3.051 1.00 75.33 H new ATOM 0 HA GLU A 32 -12.060 -18.609 -3.085 1.00 41.41 H new ATOM 0 HB2 GLU A 32 -10.134 -16.756 -1.586 1.00 61.24 H new ATOM 0 HB3 GLU A 32 -9.919 -18.489 -1.734 1.00 61.24 H new ATOM 0 HG2 GLU A 32 -9.641 -18.303 -4.170 1.00 72.45 H new ATOM 0 HG3 GLU A 32 -10.029 -16.595 -4.125 1.00 72.45 H new ATOM 502 N ASP A 33 -12.854 -17.114 -0.248 1.00 22.22 N ATOM 503 CA ASP A 33 -13.405 -17.277 1.122 1.00 42.41 C ATOM 504 C ASP A 33 -14.853 -17.793 1.075 1.00 50.21 C ATOM 505 O ASP A 33 -15.258 -18.626 1.895 1.00 31.53 O ATOM 506 CB ASP A 33 -13.321 -15.929 1.891 1.00 31.15 C ATOM 507 CG ASP A 33 -13.752 -16.037 3.366 1.00 20.44 C ATOM 508 OD1 ASP A 33 -12.980 -16.580 4.174 1.00 52.14 O ATOM 509 OD2 ASP A 33 -14.851 -15.565 3.731 1.00 41.34 O ATOM 0 H ASP A 33 -12.774 -16.140 -0.540 1.00 22.22 H new ATOM 0 HA ASP A 33 -12.807 -18.019 1.652 1.00 42.41 H new ATOM 0 HB2 ASP A 33 -12.297 -15.557 1.846 1.00 31.15 H new ATOM 0 HB3 ASP A 33 -13.950 -15.194 1.389 1.00 31.15 H new ATOM 514 N ILE A 34 -15.617 -17.293 0.090 1.00 63.21 N ATOM 515 CA ILE A 34 -16.997 -17.752 -0.182 1.00 35.33 C ATOM 516 C ILE A 34 -16.963 -19.036 -1.064 1.00 2.03 C ATOM 517 O ILE A 34 -17.987 -19.685 -1.288 1.00 12.40 O ATOM 518 CB ILE A 34 -17.846 -16.594 -0.872 1.00 55.05 C ATOM 519 CG1 ILE A 34 -17.766 -15.270 -0.035 1.00 13.43 C ATOM 520 CG2 ILE A 34 -19.330 -17.005 -1.068 1.00 15.25 C ATOM 521 CD1 ILE A 34 -18.416 -14.056 -0.689 1.00 35.21 C ATOM 0 H ILE A 34 -15.299 -16.559 -0.543 1.00 63.21 H new ATOM 0 HA ILE A 34 -17.485 -17.998 0.761 1.00 35.33 H new ATOM 0 HB ILE A 34 -17.410 -16.421 -1.856 1.00 55.05 H new ATOM 0 HG12 ILE A 34 -18.239 -15.440 0.932 1.00 13.43 H new ATOM 0 HG13 ILE A 34 -16.718 -15.042 0.158 1.00 13.43 H new ATOM 0 HG21 ILE A 34 -19.874 -16.188 -1.541 1.00 15.25 H new ATOM 0 HG22 ILE A 34 -19.382 -17.890 -1.702 1.00 15.25 H new ATOM 0 HG23 ILE A 34 -19.777 -17.226 -0.099 1.00 15.25 H new ATOM 0 HD11 ILE A 34 -18.310 -13.190 -0.035 1.00 35.21 H new ATOM 0 HD12 ILE A 34 -17.930 -13.853 -1.643 1.00 35.21 H new ATOM 0 HD13 ILE A 34 -19.474 -14.256 -0.857 1.00 35.21 H new ATOM 533 N GLY A 35 -15.755 -19.424 -1.521 1.00 14.11 N ATOM 534 CA GLY A 35 -15.571 -20.572 -2.413 1.00 70.45 C ATOM 535 C GLY A 35 -15.460 -20.126 -3.861 1.00 12.34 C ATOM 536 O GLY A 35 -14.444 -20.369 -4.523 1.00 24.40 O ATOM 0 H GLY A 35 -14.886 -18.948 -1.279 1.00 14.11 H new ATOM 0 HA2 GLY A 35 -14.672 -21.118 -2.127 1.00 70.45 H new ATOM 0 HA3 GLY A 35 -16.410 -21.259 -2.304 1.00 70.45 H new ATOM 540 N GLU A 36 -16.517 -19.441 -4.330 1.00 63.30 N ATOM 541 CA GLU A 36 -16.586 -18.827 -5.664 1.00 22.43 C ATOM 542 C GLU A 36 -17.807 -17.892 -5.713 1.00 5.45 C ATOM 543 O GLU A 36 -18.873 -18.247 -5.207 1.00 22.12 O ATOM 544 CB GLU A 36 -16.670 -19.917 -6.771 1.00 34.23 C ATOM 545 CG GLU A 36 -16.816 -19.367 -8.198 1.00 22.14 C ATOM 546 CD GLU A 36 -16.711 -20.445 -9.286 1.00 65.25 C ATOM 547 OE1 GLU A 36 -17.738 -21.024 -9.668 1.00 52.52 O ATOM 548 OE2 GLU A 36 -15.590 -20.729 -9.747 1.00 64.45 O ATOM 0 H GLU A 36 -17.364 -19.297 -3.780 1.00 63.30 H new ATOM 0 HA GLU A 36 -15.680 -18.249 -5.850 1.00 22.43 H new ATOM 0 HB2 GLU A 36 -15.773 -20.535 -6.723 1.00 34.23 H new ATOM 0 HB3 GLU A 36 -17.518 -20.568 -6.558 1.00 34.23 H new ATOM 0 HG2 GLU A 36 -17.779 -18.865 -8.288 1.00 22.14 H new ATOM 0 HG3 GLU A 36 -16.046 -18.614 -8.369 1.00 22.14 H new ATOM 555 N SER A 37 -17.649 -16.694 -6.317 1.00 43.32 N ATOM 556 CA SER A 37 -18.729 -15.694 -6.407 1.00 22.24 C ATOM 557 C SER A 37 -18.613 -14.878 -7.703 1.00 23.42 C ATOM 558 O SER A 37 -17.616 -14.178 -7.915 1.00 42.10 O ATOM 559 CB SER A 37 -18.689 -14.750 -5.182 1.00 62.44 C ATOM 560 OG SER A 37 -18.861 -15.463 -3.972 1.00 4.40 O ATOM 0 H SER A 37 -16.775 -16.397 -6.752 1.00 43.32 H new ATOM 0 HA SER A 37 -19.682 -16.223 -6.417 1.00 22.24 H new ATOM 0 HB2 SER A 37 -17.737 -14.220 -5.161 1.00 62.44 H new ATOM 0 HB3 SER A 37 -19.471 -13.997 -5.276 1.00 62.44 H new ATOM 0 HG SER A 37 -19.146 -14.846 -3.266 1.00 4.40 H new ATOM 566 N ASP A 38 -19.622 -15.020 -8.580 1.00 21.13 N ATOM 567 CA ASP A 38 -19.823 -14.143 -9.757 1.00 62.40 C ATOM 568 C ASP A 38 -20.827 -13.020 -9.414 1.00 24.45 C ATOM 569 O ASP A 38 -20.977 -12.047 -10.172 1.00 32.14 O ATOM 570 CB ASP A 38 -20.347 -14.983 -10.959 1.00 70.34 C ATOM 571 CG ASP A 38 -21.777 -15.543 -10.744 1.00 72.10 C ATOM 572 OD1 ASP A 38 -21.933 -16.534 -9.999 1.00 73.44 O ATOM 573 OD2 ASP A 38 -22.749 -14.993 -11.305 1.00 15.34 O ATOM 0 H ASP A 38 -20.329 -15.751 -8.495 1.00 21.13 H new ATOM 0 HA ASP A 38 -18.870 -13.690 -10.031 1.00 62.40 H new ATOM 0 HB2 ASP A 38 -20.339 -14.364 -11.856 1.00 70.34 H new ATOM 0 HB3 ASP A 38 -19.663 -15.813 -11.138 1.00 70.34 H new ATOM 578 N SER A 39 -21.517 -13.207 -8.269 1.00 62.30 N ATOM 579 CA SER A 39 -22.561 -12.315 -7.735 1.00 44.32 C ATOM 580 C SER A 39 -22.058 -10.852 -7.525 1.00 31.22 C ATOM 581 O SER A 39 -20.844 -10.628 -7.447 1.00 44.55 O ATOM 582 CB SER A 39 -23.050 -12.932 -6.399 1.00 0.44 C ATOM 583 OG SER A 39 -21.954 -13.233 -5.542 1.00 41.34 O ATOM 0 H SER A 39 -21.354 -14.016 -7.670 1.00 62.30 H new ATOM 0 HA SER A 39 -23.375 -12.240 -8.456 1.00 44.32 H new ATOM 0 HB2 SER A 39 -23.726 -12.237 -5.900 1.00 0.44 H new ATOM 0 HB3 SER A 39 -23.618 -13.840 -6.601 1.00 0.44 H new ATOM 0 HG SER A 39 -22.289 -13.619 -4.706 1.00 41.34 H new ATOM 589 N PRO A 40 -22.983 -9.829 -7.466 1.00 31.21 N ATOM 590 CA PRO A 40 -22.597 -8.425 -7.183 1.00 44.13 C ATOM 591 C PRO A 40 -21.940 -8.262 -5.793 1.00 20.52 C ATOM 592 O PRO A 40 -22.632 -8.144 -4.777 1.00 44.32 O ATOM 593 CB PRO A 40 -23.933 -7.636 -7.298 1.00 13.21 C ATOM 594 CG PRO A 40 -24.860 -8.536 -8.064 1.00 35.30 C ATOM 595 CD PRO A 40 -24.455 -9.947 -7.696 1.00 33.23 C ATOM 0 HA PRO A 40 -21.839 -8.060 -7.876 1.00 44.13 H new ATOM 0 HB2 PRO A 40 -24.337 -7.401 -6.313 1.00 13.21 H new ATOM 0 HB3 PRO A 40 -23.787 -6.689 -7.817 1.00 13.21 H new ATOM 0 HG2 PRO A 40 -25.900 -8.345 -7.798 1.00 35.30 H new ATOM 0 HG3 PRO A 40 -24.769 -8.370 -9.137 1.00 35.30 H new ATOM 0 HD2 PRO A 40 -24.975 -10.296 -6.804 1.00 33.23 H new ATOM 0 HD3 PRO A 40 -24.683 -10.653 -8.495 1.00 33.23 H new ATOM 603 N ILE A 41 -20.593 -8.324 -5.774 1.00 24.15 N ATOM 604 CA ILE A 41 -19.781 -8.155 -4.556 1.00 64.32 C ATOM 605 C ILE A 41 -19.816 -6.670 -4.118 1.00 73.41 C ATOM 606 O ILE A 41 -19.282 -5.808 -4.831 1.00 30.11 O ATOM 607 CB ILE A 41 -18.288 -8.634 -4.785 1.00 62.13 C ATOM 608 CG1 ILE A 41 -18.246 -10.136 -5.225 1.00 32.34 C ATOM 609 CG2 ILE A 41 -17.405 -8.403 -3.529 1.00 74.51 C ATOM 610 CD1 ILE A 41 -18.843 -11.116 -4.222 1.00 55.21 C ATOM 0 H ILE A 41 -20.036 -8.494 -6.611 1.00 24.15 H new ATOM 0 HA ILE A 41 -20.204 -8.777 -3.767 1.00 64.32 H new ATOM 0 HB ILE A 41 -17.873 -8.026 -5.589 1.00 62.13 H new ATOM 0 HG12 ILE A 41 -18.778 -10.237 -6.171 1.00 32.34 H new ATOM 0 HG13 ILE A 41 -17.209 -10.416 -5.411 1.00 32.34 H new ATOM 0 HG21 ILE A 41 -16.390 -8.745 -3.730 1.00 74.51 H new ATOM 0 HG22 ILE A 41 -17.388 -7.340 -3.286 1.00 74.51 H new ATOM 0 HG23 ILE A 41 -17.816 -8.961 -2.688 1.00 74.51 H new ATOM 0 HD11 ILE A 41 -18.768 -12.130 -4.615 1.00 55.21 H new ATOM 0 HD12 ILE A 41 -18.297 -11.051 -3.281 1.00 55.21 H new ATOM 0 HD13 ILE A 41 -19.891 -10.869 -4.052 1.00 55.21 H new ATOM 622 N PRO A 42 -20.478 -6.345 -2.956 1.00 32.53 N ATOM 623 CA PRO A 42 -20.600 -4.954 -2.485 1.00 72.21 C ATOM 624 C PRO A 42 -19.291 -4.447 -1.827 1.00 31.13 C ATOM 625 O PRO A 42 -18.729 -5.090 -0.929 1.00 65.15 O ATOM 626 CB PRO A 42 -21.783 -5.026 -1.490 1.00 75.01 C ATOM 627 CG PRO A 42 -21.734 -6.418 -0.932 1.00 44.43 C ATOM 628 CD PRO A 42 -21.154 -7.299 -2.027 1.00 13.21 C ATOM 0 HA PRO A 42 -20.775 -4.240 -3.290 1.00 72.21 H new ATOM 0 HB2 PRO A 42 -21.682 -4.280 -0.701 1.00 75.01 H new ATOM 0 HB3 PRO A 42 -22.732 -4.834 -1.990 1.00 75.01 H new ATOM 0 HG2 PRO A 42 -21.116 -6.455 -0.035 1.00 44.43 H new ATOM 0 HG3 PRO A 42 -22.730 -6.757 -0.647 1.00 44.43 H new ATOM 0 HD2 PRO A 42 -20.449 -8.024 -1.621 1.00 13.21 H new ATOM 0 HD3 PRO A 42 -21.934 -7.864 -2.537 1.00 13.21 H new ATOM 636 N LEU A 43 -18.815 -3.294 -2.313 1.00 63.45 N ATOM 637 CA LEU A 43 -17.589 -2.629 -1.864 1.00 72.12 C ATOM 638 C LEU A 43 -17.976 -1.241 -1.282 1.00 41.22 C ATOM 639 O LEU A 43 -18.009 -0.239 -2.014 1.00 23.22 O ATOM 640 CB LEU A 43 -16.589 -2.510 -3.063 1.00 51.15 C ATOM 641 CG LEU A 43 -16.165 -3.855 -3.752 1.00 44.41 C ATOM 642 CD1 LEU A 43 -15.340 -3.595 -5.031 1.00 21.43 C ATOM 643 CD2 LEU A 43 -15.407 -4.783 -2.773 1.00 65.43 C ATOM 0 H LEU A 43 -19.291 -2.782 -3.056 1.00 63.45 H new ATOM 0 HA LEU A 43 -17.090 -3.205 -1.085 1.00 72.12 H new ATOM 0 HB2 LEU A 43 -17.037 -1.865 -3.819 1.00 51.15 H new ATOM 0 HB3 LEU A 43 -15.688 -2.008 -2.709 1.00 51.15 H new ATOM 0 HG LEU A 43 -17.079 -4.371 -4.047 1.00 44.41 H new ATOM 0 HD11 LEU A 43 -15.062 -4.546 -5.484 1.00 21.43 H new ATOM 0 HD12 LEU A 43 -15.936 -3.017 -5.737 1.00 21.43 H new ATOM 0 HD13 LEU A 43 -14.439 -3.038 -4.776 1.00 21.43 H new ATOM 0 HD21 LEU A 43 -15.130 -5.704 -3.286 1.00 65.43 H new ATOM 0 HD22 LEU A 43 -14.507 -4.280 -2.418 1.00 65.43 H new ATOM 0 HD23 LEU A 43 -16.049 -5.019 -1.925 1.00 65.43 H new ATOM 655 N PRO A 44 -18.341 -1.179 0.041 1.00 31.45 N ATOM 656 CA PRO A 44 -18.899 0.051 0.672 1.00 42.04 C ATOM 657 C PRO A 44 -17.864 1.178 0.882 1.00 54.44 C ATOM 658 O PRO A 44 -18.228 2.356 0.904 1.00 4.34 O ATOM 659 CB PRO A 44 -19.436 -0.473 2.028 1.00 24.51 C ATOM 660 CG PRO A 44 -18.556 -1.643 2.352 1.00 63.35 C ATOM 661 CD PRO A 44 -18.267 -2.308 1.024 1.00 44.32 C ATOM 0 HA PRO A 44 -19.652 0.519 0.038 1.00 42.04 H new ATOM 0 HB2 PRO A 44 -19.378 0.293 2.801 1.00 24.51 H new ATOM 0 HB3 PRO A 44 -20.482 -0.771 1.952 1.00 24.51 H new ATOM 0 HG2 PRO A 44 -17.636 -1.320 2.838 1.00 63.35 H new ATOM 0 HG3 PRO A 44 -19.053 -2.331 3.036 1.00 63.35 H new ATOM 0 HD2 PRO A 44 -17.285 -2.781 1.018 1.00 44.32 H new ATOM 0 HD3 PRO A 44 -18.997 -3.085 0.798 1.00 44.32 H new ATOM 669 N ASN A 45 -16.575 0.808 1.025 1.00 42.25 N ATOM 670 CA ASN A 45 -15.488 1.762 1.365 1.00 71.05 C ATOM 671 C ASN A 45 -14.902 2.451 0.116 1.00 62.20 C ATOM 672 O ASN A 45 -13.830 3.068 0.190 1.00 55.13 O ATOM 673 CB ASN A 45 -14.363 1.038 2.159 1.00 1.44 C ATOM 674 CG ASN A 45 -14.796 0.537 3.543 1.00 72.22 C ATOM 675 OD1 ASN A 45 -15.963 0.210 3.773 1.00 72.34 O ATOM 676 ND2 ASN A 45 -13.859 0.464 4.481 1.00 75.31 N ATOM 0 H ASN A 45 -16.255 -0.154 0.910 1.00 42.25 H new ATOM 0 HA ASN A 45 -15.926 2.541 1.988 1.00 71.05 H new ATOM 0 HB2 ASN A 45 -14.007 0.191 1.573 1.00 1.44 H new ATOM 0 HB3 ASN A 45 -13.521 1.720 2.278 1.00 1.44 H new ATOM 0 HD21 ASN A 45 -14.098 0.132 5.415 1.00 75.31 H new ATOM 0 HD22 ASN A 45 -12.901 0.740 4.267 1.00 75.31 H new ATOM 683 N VAL A 46 -15.610 2.362 -1.021 1.00 35.22 N ATOM 684 CA VAL A 46 -15.216 3.030 -2.265 1.00 3.52 C ATOM 685 C VAL A 46 -16.480 3.478 -3.035 1.00 61.10 C ATOM 686 O VAL A 46 -17.441 2.703 -3.191 1.00 51.22 O ATOM 687 CB VAL A 46 -14.289 2.107 -3.152 1.00 53.23 C ATOM 688 CG1 VAL A 46 -15.004 0.816 -3.604 1.00 1.12 C ATOM 689 CG2 VAL A 46 -13.698 2.885 -4.349 1.00 42.32 C ATOM 0 H VAL A 46 -16.473 1.823 -1.101 1.00 35.22 H new ATOM 0 HA VAL A 46 -14.628 3.913 -2.017 1.00 3.52 H new ATOM 0 HB VAL A 46 -13.457 1.794 -2.521 1.00 53.23 H new ATOM 0 HG11 VAL A 46 -14.325 0.217 -4.210 1.00 1.12 H new ATOM 0 HG12 VAL A 46 -15.309 0.244 -2.728 1.00 1.12 H new ATOM 0 HG13 VAL A 46 -15.884 1.075 -4.193 1.00 1.12 H new ATOM 0 HG21 VAL A 46 -13.066 2.221 -4.938 1.00 42.32 H new ATOM 0 HG22 VAL A 46 -14.508 3.263 -4.973 1.00 42.32 H new ATOM 0 HG23 VAL A 46 -13.103 3.721 -3.981 1.00 42.32 H new ATOM 699 N THR A 47 -16.492 4.749 -3.473 1.00 64.15 N ATOM 700 CA THR A 47 -17.590 5.315 -4.279 1.00 13.25 C ATOM 701 C THR A 47 -17.506 4.810 -5.728 1.00 63.31 C ATOM 702 O THR A 47 -16.481 4.259 -6.134 1.00 72.41 O ATOM 703 CB THR A 47 -17.549 6.879 -4.264 1.00 24.42 C ATOM 704 OG1 THR A 47 -16.268 7.333 -4.736 1.00 64.24 O ATOM 705 CG2 THR A 47 -17.812 7.447 -2.857 1.00 0.42 C ATOM 0 H THR A 47 -15.742 5.413 -3.279 1.00 64.15 H new ATOM 0 HA THR A 47 -18.531 4.987 -3.838 1.00 13.25 H new ATOM 0 HB THR A 47 -18.340 7.239 -4.921 1.00 24.42 H new ATOM 0 HG1 THR A 47 -16.387 7.848 -5.561 1.00 64.24 H new ATOM 0 HG21 THR A 47 -17.775 8.536 -2.891 1.00 0.42 H new ATOM 0 HG22 THR A 47 -18.796 7.128 -2.514 1.00 0.42 H new ATOM 0 HG23 THR A 47 -17.051 7.079 -2.168 1.00 0.42 H new ATOM 713 N SER A 48 -18.587 5.020 -6.494 1.00 41.32 N ATOM 714 CA SER A 48 -18.682 4.582 -7.899 1.00 44.22 C ATOM 715 C SER A 48 -17.644 5.286 -8.786 1.00 0.00 C ATOM 716 O SER A 48 -17.053 4.657 -9.659 1.00 13.13 O ATOM 717 CB SER A 48 -20.108 4.822 -8.429 1.00 23.11 C ATOM 718 OG SER A 48 -20.510 6.172 -8.271 1.00 41.25 O ATOM 0 H SER A 48 -19.423 5.499 -6.158 1.00 41.32 H new ATOM 0 HA SER A 48 -18.464 3.515 -7.936 1.00 44.22 H new ATOM 0 HB2 SER A 48 -20.154 4.551 -9.484 1.00 23.11 H new ATOM 0 HB3 SER A 48 -20.806 4.171 -7.902 1.00 23.11 H new ATOM 0 HG SER A 48 -21.419 6.286 -8.620 1.00 41.25 H new ATOM 724 N THR A 49 -17.422 6.580 -8.520 1.00 10.12 N ATOM 725 CA THR A 49 -16.485 7.420 -9.280 1.00 1.21 C ATOM 726 C THR A 49 -15.025 6.937 -9.131 1.00 1.34 C ATOM 727 O THR A 49 -14.305 6.798 -10.129 1.00 4.33 O ATOM 728 CB THR A 49 -16.610 8.897 -8.803 1.00 0.24 C ATOM 729 OG1 THR A 49 -16.481 8.944 -7.369 1.00 75.34 O ATOM 730 CG2 THR A 49 -17.958 9.520 -9.213 1.00 11.55 C ATOM 0 H THR A 49 -17.892 7.078 -7.764 1.00 10.12 H new ATOM 0 HA THR A 49 -16.746 7.346 -10.336 1.00 1.21 H new ATOM 0 HB THR A 49 -15.816 9.473 -9.279 1.00 0.24 H new ATOM 0 HG1 THR A 49 -16.557 9.872 -7.064 1.00 75.34 H new ATOM 0 HG21 THR A 49 -18.005 10.551 -8.861 1.00 11.55 H new ATOM 0 HG22 THR A 49 -18.051 9.503 -10.299 1.00 11.55 H new ATOM 0 HG23 THR A 49 -18.773 8.948 -8.770 1.00 11.55 H new ATOM 738 N ILE A 50 -14.609 6.670 -7.877 1.00 1.42 N ATOM 739 CA ILE A 50 -13.244 6.213 -7.563 1.00 4.11 C ATOM 740 C ILE A 50 -13.058 4.756 -8.042 1.00 11.05 C ATOM 741 O ILE A 50 -12.065 4.449 -8.707 1.00 63.22 O ATOM 742 CB ILE A 50 -12.933 6.339 -6.021 1.00 20.04 C ATOM 743 CG1 ILE A 50 -13.071 7.820 -5.533 1.00 21.02 C ATOM 744 CG2 ILE A 50 -11.537 5.773 -5.659 1.00 10.55 C ATOM 745 CD1 ILE A 50 -12.110 8.817 -6.170 1.00 73.52 C ATOM 0 H ILE A 50 -15.209 6.765 -7.057 1.00 1.42 H new ATOM 0 HA ILE A 50 -12.537 6.855 -8.090 1.00 4.11 H new ATOM 0 HB ILE A 50 -13.676 5.735 -5.500 1.00 20.04 H new ATOM 0 HG12 ILE A 50 -14.091 8.153 -5.725 1.00 21.02 H new ATOM 0 HG13 ILE A 50 -12.926 7.843 -4.453 1.00 21.02 H new ATOM 0 HG21 ILE A 50 -11.367 5.881 -4.588 1.00 10.55 H new ATOM 0 HG22 ILE A 50 -11.491 4.718 -5.929 1.00 10.55 H new ATOM 0 HG23 ILE A 50 -10.769 6.321 -6.205 1.00 10.55 H new ATOM 0 HD11 ILE A 50 -12.292 9.811 -5.760 1.00 73.52 H new ATOM 0 HD12 ILE A 50 -11.083 8.520 -5.957 1.00 73.52 H new ATOM 0 HD13 ILE A 50 -12.266 8.835 -7.249 1.00 73.52 H new ATOM 757 N LEU A 51 -14.058 3.886 -7.737 1.00 53.21 N ATOM 758 CA LEU A 51 -14.036 2.444 -8.104 1.00 62.02 C ATOM 759 C LEU A 51 -13.952 2.261 -9.629 1.00 74.01 C ATOM 760 O LEU A 51 -13.272 1.349 -10.103 1.00 62.20 O ATOM 761 CB LEU A 51 -15.288 1.687 -7.556 1.00 60.02 C ATOM 762 CG LEU A 51 -15.317 0.140 -7.805 1.00 44.12 C ATOM 763 CD1 LEU A 51 -14.095 -0.561 -7.177 1.00 2.24 C ATOM 764 CD2 LEU A 51 -16.631 -0.493 -7.302 1.00 4.02 C ATOM 0 H LEU A 51 -14.899 4.164 -7.231 1.00 53.21 H new ATOM 0 HA LEU A 51 -13.145 2.017 -7.643 1.00 62.02 H new ATOM 0 HB2 LEU A 51 -15.354 1.864 -6.482 1.00 60.02 H new ATOM 0 HB3 LEU A 51 -16.179 2.125 -8.007 1.00 60.02 H new ATOM 0 HG LEU A 51 -15.268 -0.008 -8.884 1.00 44.12 H new ATOM 0 HD11 LEU A 51 -14.151 -1.632 -7.371 1.00 2.24 H new ATOM 0 HD12 LEU A 51 -13.181 -0.160 -7.615 1.00 2.24 H new ATOM 0 HD13 LEU A 51 -14.089 -0.387 -6.101 1.00 2.24 H new ATOM 0 HD21 LEU A 51 -16.614 -1.566 -7.492 1.00 4.02 H new ATOM 0 HD22 LEU A 51 -16.734 -0.316 -6.231 1.00 4.02 H new ATOM 0 HD23 LEU A 51 -17.475 -0.045 -7.827 1.00 4.02 H new ATOM 776 N GLU A 52 -14.639 3.156 -10.370 1.00 42.40 N ATOM 777 CA GLU A 52 -14.612 3.173 -11.839 1.00 65.03 C ATOM 778 C GLU A 52 -13.166 3.289 -12.333 1.00 14.24 C ATOM 779 O GLU A 52 -12.721 2.472 -13.129 1.00 35.11 O ATOM 780 CB GLU A 52 -15.448 4.357 -12.380 1.00 51.43 C ATOM 781 CG GLU A 52 -15.522 4.431 -13.916 1.00 12.33 C ATOM 782 CD GLU A 52 -16.305 5.650 -14.416 1.00 21.14 C ATOM 783 OE1 GLU A 52 -15.685 6.695 -14.702 1.00 63.51 O ATOM 784 OE2 GLU A 52 -17.548 5.575 -14.511 1.00 54.55 O ATOM 0 H GLU A 52 -15.226 3.884 -9.963 1.00 42.40 H new ATOM 0 HA GLU A 52 -15.044 2.242 -12.207 1.00 65.03 H new ATOM 0 HB2 GLU A 52 -16.460 4.283 -11.982 1.00 51.43 H new ATOM 0 HB3 GLU A 52 -15.024 5.288 -12.003 1.00 51.43 H new ATOM 0 HG2 GLU A 52 -14.511 4.463 -14.323 1.00 12.33 H new ATOM 0 HG3 GLU A 52 -15.990 3.523 -14.297 1.00 12.33 H new ATOM 791 N LYS A 53 -12.444 4.278 -11.771 1.00 44.13 N ATOM 792 CA LYS A 53 -11.067 4.612 -12.173 1.00 51.41 C ATOM 793 C LYS A 53 -10.059 3.539 -11.737 1.00 15.54 C ATOM 794 O LYS A 53 -9.115 3.243 -12.474 1.00 73.14 O ATOM 795 CB LYS A 53 -10.660 5.990 -11.603 1.00 32.51 C ATOM 796 CG LYS A 53 -11.530 7.154 -12.116 1.00 31.43 C ATOM 797 CD LYS A 53 -10.994 8.542 -11.701 1.00 33.21 C ATOM 798 CE LYS A 53 -9.569 8.822 -12.212 1.00 73.53 C ATOM 799 NZ LYS A 53 -9.259 10.277 -12.193 1.00 60.51 N ATOM 0 H LYS A 53 -12.803 4.870 -11.022 1.00 44.13 H new ATOM 0 HA LYS A 53 -11.049 4.652 -13.262 1.00 51.41 H new ATOM 0 HB2 LYS A 53 -10.720 5.955 -10.515 1.00 32.51 H new ATOM 0 HB3 LYS A 53 -9.619 6.186 -11.859 1.00 32.51 H new ATOM 0 HG2 LYS A 53 -11.588 7.104 -13.203 1.00 31.43 H new ATOM 0 HG3 LYS A 53 -12.545 7.035 -11.737 1.00 31.43 H new ATOM 0 HD2 LYS A 53 -11.666 9.312 -12.080 1.00 33.21 H new ATOM 0 HD3 LYS A 53 -11.004 8.617 -10.614 1.00 33.21 H new ATOM 0 HE2 LYS A 53 -8.848 8.287 -11.594 1.00 73.53 H new ATOM 0 HE3 LYS A 53 -9.464 8.440 -13.227 1.00 73.53 H new ATOM 0 HZ1 LYS A 53 -8.229 10.413 -12.243 1.00 60.51 H new ATOM 0 HZ2 LYS A 53 -9.710 10.739 -13.009 1.00 60.51 H new ATOM 0 HZ3 LYS A 53 -9.621 10.698 -11.313 1.00 60.51 H new ATOM 813 N VAL A 54 -10.274 2.955 -10.547 1.00 41.32 N ATOM 814 CA VAL A 54 -9.397 1.906 -10.000 1.00 61.30 C ATOM 815 C VAL A 54 -9.450 0.653 -10.897 1.00 43.33 C ATOM 816 O VAL A 54 -8.413 0.060 -11.228 1.00 45.52 O ATOM 817 CB VAL A 54 -9.780 1.564 -8.508 1.00 70.45 C ATOM 818 CG1 VAL A 54 -8.964 0.373 -7.960 1.00 32.42 C ATOM 819 CG2 VAL A 54 -9.589 2.803 -7.603 1.00 72.40 C ATOM 0 H VAL A 54 -11.057 3.195 -9.939 1.00 41.32 H new ATOM 0 HA VAL A 54 -8.373 2.278 -9.991 1.00 61.30 H new ATOM 0 HB VAL A 54 -10.831 1.274 -8.502 1.00 70.45 H new ATOM 0 HG11 VAL A 54 -9.260 0.172 -6.930 1.00 32.42 H new ATOM 0 HG12 VAL A 54 -9.154 -0.510 -8.571 1.00 32.42 H new ATOM 0 HG13 VAL A 54 -7.902 0.615 -7.992 1.00 32.42 H new ATOM 0 HG21 VAL A 54 -9.858 2.549 -6.578 1.00 72.40 H new ATOM 0 HG22 VAL A 54 -8.547 3.121 -7.637 1.00 72.40 H new ATOM 0 HG23 VAL A 54 -10.227 3.613 -7.956 1.00 72.40 H new ATOM 829 N LEU A 55 -10.669 0.303 -11.331 1.00 63.43 N ATOM 830 CA LEU A 55 -10.897 -0.815 -12.261 1.00 54.54 C ATOM 831 C LEU A 55 -10.454 -0.445 -13.695 1.00 31.13 C ATOM 832 O LEU A 55 -9.979 -1.307 -14.433 1.00 52.01 O ATOM 833 CB LEU A 55 -12.393 -1.233 -12.234 1.00 24.44 C ATOM 834 CG LEU A 55 -12.929 -1.764 -10.864 1.00 4.35 C ATOM 835 CD1 LEU A 55 -14.431 -2.099 -10.950 1.00 14.03 C ATOM 836 CD2 LEU A 55 -12.109 -2.974 -10.356 1.00 11.44 C ATOM 0 H LEU A 55 -11.523 0.784 -11.049 1.00 63.43 H new ATOM 0 HA LEU A 55 -10.292 -1.662 -11.938 1.00 54.54 H new ATOM 0 HB2 LEU A 55 -12.996 -0.374 -12.530 1.00 24.44 H new ATOM 0 HB3 LEU A 55 -12.548 -2.006 -12.987 1.00 24.44 H new ATOM 0 HG LEU A 55 -12.806 -0.965 -10.133 1.00 4.35 H new ATOM 0 HD11 LEU A 55 -14.778 -2.466 -9.984 1.00 14.03 H new ATOM 0 HD12 LEU A 55 -14.989 -1.202 -11.219 1.00 14.03 H new ATOM 0 HD13 LEU A 55 -14.590 -2.866 -11.708 1.00 14.03 H new ATOM 0 HD21 LEU A 55 -12.513 -3.313 -9.402 1.00 11.44 H new ATOM 0 HD22 LEU A 55 -12.167 -3.784 -11.083 1.00 11.44 H new ATOM 0 HD23 LEU A 55 -11.068 -2.679 -10.225 1.00 11.44 H new ATOM 848 N ASP A 56 -10.594 0.852 -14.047 1.00 34.23 N ATOM 849 CA ASP A 56 -10.292 1.400 -15.396 1.00 53.43 C ATOM 850 C ASP A 56 -8.787 1.323 -15.714 1.00 44.31 C ATOM 851 O ASP A 56 -8.393 0.920 -16.811 1.00 2.41 O ATOM 852 CB ASP A 56 -10.801 2.867 -15.487 1.00 5.20 C ATOM 853 CG ASP A 56 -10.577 3.523 -16.854 1.00 15.41 C ATOM 854 OD1 ASP A 56 -11.324 3.201 -17.803 1.00 22.22 O ATOM 855 OD2 ASP A 56 -9.669 4.375 -16.985 1.00 60.15 O ATOM 0 H ASP A 56 -10.925 1.562 -13.394 1.00 34.23 H new ATOM 0 HA ASP A 56 -10.809 0.793 -16.139 1.00 53.43 H new ATOM 0 HB2 ASP A 56 -11.866 2.886 -15.257 1.00 5.20 H new ATOM 0 HB3 ASP A 56 -10.300 3.462 -14.724 1.00 5.20 H new ATOM 860 N TYR A 57 -7.958 1.698 -14.730 1.00 62.03 N ATOM 861 CA TYR A 57 -6.492 1.573 -14.816 1.00 11.21 C ATOM 862 C TYR A 57 -6.090 0.093 -15.000 1.00 72.24 C ATOM 863 O TYR A 57 -5.186 -0.237 -15.773 1.00 44.54 O ATOM 864 CB TYR A 57 -5.831 2.148 -13.532 1.00 4.34 C ATOM 865 CG TYR A 57 -4.309 1.946 -13.473 1.00 33.45 C ATOM 866 CD1 TYR A 57 -3.446 2.812 -14.141 1.00 33.43 C ATOM 867 CD2 TYR A 57 -3.746 0.861 -12.788 1.00 63.12 C ATOM 868 CE1 TYR A 57 -2.086 2.601 -14.133 1.00 30.13 C ATOM 869 CE2 TYR A 57 -2.384 0.656 -12.772 1.00 12.21 C ATOM 870 CZ TYR A 57 -1.559 1.527 -13.448 1.00 64.15 C ATOM 871 OH TYR A 57 -0.204 1.302 -13.476 1.00 50.11 O ATOM 0 H TYR A 57 -8.283 2.097 -13.850 1.00 62.03 H new ATOM 0 HA TYR A 57 -6.143 2.141 -15.679 1.00 11.21 H new ATOM 0 HB2 TYR A 57 -6.049 3.214 -13.469 1.00 4.34 H new ATOM 0 HB3 TYR A 57 -6.284 1.678 -12.660 1.00 4.34 H new ATOM 0 HD1 TYR A 57 -3.850 3.661 -14.673 1.00 33.43 H new ATOM 0 HD2 TYR A 57 -4.392 0.173 -12.263 1.00 63.12 H new ATOM 0 HE1 TYR A 57 -1.432 3.277 -14.663 1.00 30.13 H new ATOM 0 HE2 TYR A 57 -1.966 -0.182 -12.233 1.00 12.21 H new ATOM 0 HH TYR A 57 -0.015 0.510 -14.021 1.00 50.11 H new ATOM 881 N CYS A 58 -6.762 -0.778 -14.243 1.00 2.12 N ATOM 882 CA CYS A 58 -6.543 -2.224 -14.286 1.00 34.14 C ATOM 883 C CYS A 58 -7.002 -2.840 -15.640 1.00 74.15 C ATOM 884 O CYS A 58 -6.459 -3.871 -16.066 1.00 75.51 O ATOM 885 CB CYS A 58 -7.233 -2.868 -13.075 1.00 24.12 C ATOM 886 SG CYS A 58 -6.575 -2.308 -11.487 1.00 55.35 S ATOM 0 H CYS A 58 -7.481 -0.495 -13.577 1.00 2.12 H new ATOM 0 HA CYS A 58 -5.475 -2.431 -14.224 1.00 34.14 H new ATOM 0 HB2 CYS A 58 -8.300 -2.648 -13.115 1.00 24.12 H new ATOM 0 HB3 CYS A 58 -7.129 -3.951 -13.141 1.00 24.12 H new ATOM 0 HG CYS A 58 -7.280 -1.305 -11.055 1.00 55.35 H new ATOM 892 N ARG A 59 -8.009 -2.204 -16.296 1.00 61.31 N ATOM 893 CA ARG A 59 -8.435 -2.560 -17.679 1.00 40.12 C ATOM 894 C ARG A 59 -7.267 -2.403 -18.664 1.00 13.11 C ATOM 895 O ARG A 59 -7.097 -3.218 -19.560 1.00 34.50 O ATOM 896 CB ARG A 59 -9.629 -1.688 -18.176 1.00 65.40 C ATOM 897 CG ARG A 59 -10.949 -1.887 -17.410 1.00 64.11 C ATOM 898 CD ARG A 59 -12.068 -0.966 -17.925 1.00 0.44 C ATOM 899 NE ARG A 59 -13.283 -1.049 -17.096 1.00 61.33 N ATOM 900 CZ ARG A 59 -14.514 -1.340 -17.544 1.00 42.21 C ATOM 901 NH1 ARG A 59 -14.728 -1.586 -18.840 1.00 32.22 N ATOM 902 NH2 ARG A 59 -15.534 -1.370 -16.698 1.00 11.43 N ATOM 0 H ARG A 59 -8.544 -1.438 -15.887 1.00 61.31 H new ATOM 0 HA ARG A 59 -8.759 -3.600 -17.642 1.00 40.12 H new ATOM 0 HB2 ARG A 59 -9.344 -0.638 -18.110 1.00 65.40 H new ATOM 0 HB3 ARG A 59 -9.803 -1.905 -19.230 1.00 65.40 H new ATOM 0 HG2 ARG A 59 -11.266 -2.926 -17.501 1.00 64.11 H new ATOM 0 HG3 ARG A 59 -10.783 -1.696 -16.350 1.00 64.11 H new ATOM 0 HD2 ARG A 59 -11.710 0.064 -17.940 1.00 0.44 H new ATOM 0 HD3 ARG A 59 -12.313 -1.234 -18.953 1.00 0.44 H new ATOM 0 HE ARG A 59 -13.180 -0.870 -16.097 1.00 61.33 H new ATOM 0 HH11 ARG A 59 -13.951 -1.554 -19.500 1.00 32.22 H new ATOM 0 HH12 ARG A 59 -15.668 -1.806 -19.169 1.00 32.22 H new ATOM 0 HH21 ARG A 59 -15.382 -1.172 -15.709 1.00 11.43 H new ATOM 0 HH22 ARG A 59 -16.471 -1.591 -17.036 1.00 11.43 H new ATOM 916 N HIS A 60 -6.477 -1.328 -18.473 1.00 23.02 N ATOM 917 CA HIS A 60 -5.259 -1.050 -19.272 1.00 53.13 C ATOM 918 C HIS A 60 -4.235 -2.194 -19.143 1.00 41.22 C ATOM 919 O HIS A 60 -3.544 -2.517 -20.104 1.00 61.21 O ATOM 920 CB HIS A 60 -4.630 0.301 -18.830 1.00 11.13 C ATOM 921 CG HIS A 60 -3.362 0.703 -19.546 1.00 20.04 C ATOM 922 ND1 HIS A 60 -3.361 1.317 -20.775 1.00 52.52 N ATOM 923 CD2 HIS A 60 -2.059 0.580 -19.191 1.00 31.32 C ATOM 924 CE1 HIS A 60 -2.120 1.566 -21.141 1.00 74.31 C ATOM 925 NE2 HIS A 60 -1.302 1.127 -20.198 1.00 74.42 N ATOM 0 H HIS A 60 -6.663 -0.624 -17.759 1.00 23.02 H new ATOM 0 HA HIS A 60 -5.546 -0.980 -20.321 1.00 53.13 H new ATOM 0 HB2 HIS A 60 -5.370 1.088 -18.973 1.00 11.13 H new ATOM 0 HB3 HIS A 60 -4.421 0.250 -17.762 1.00 11.13 H new ATOM 0 HD2 HIS A 60 -1.685 0.133 -18.282 1.00 31.32 H new ATOM 0 HE1 HIS A 60 -1.820 2.049 -22.059 1.00 74.31 H new ATOM 0 HE2 HIS A 60 -0.284 1.185 -20.216 1.00 74.42 H new ATOM 934 N HIS A 61 -4.146 -2.785 -17.939 1.00 61.23 N ATOM 935 CA HIS A 61 -3.224 -3.910 -17.651 1.00 10.25 C ATOM 936 C HIS A 61 -3.772 -5.253 -18.174 1.00 42.14 C ATOM 937 O HIS A 61 -3.014 -6.212 -18.330 1.00 2.11 O ATOM 938 CB HIS A 61 -2.919 -3.976 -16.128 1.00 45.53 C ATOM 939 CG HIS A 61 -1.955 -2.912 -15.668 1.00 25.55 C ATOM 940 ND1 HIS A 61 -0.748 -3.200 -15.066 1.00 50.13 N ATOM 941 CD2 HIS A 61 -2.005 -1.561 -15.767 1.00 55.01 C ATOM 942 CE1 HIS A 61 -0.102 -2.081 -14.816 1.00 63.45 C ATOM 943 NE2 HIS A 61 -0.841 -1.076 -15.233 1.00 12.21 N ATOM 0 H HIS A 61 -4.708 -2.501 -17.136 1.00 61.23 H new ATOM 0 HA HIS A 61 -2.291 -3.725 -18.184 1.00 10.25 H new ATOM 0 HB2 HIS A 61 -3.852 -3.877 -15.573 1.00 45.53 H new ATOM 0 HB3 HIS A 61 -2.509 -4.957 -15.889 1.00 45.53 H new ATOM 0 HD1 HIS A 61 -0.408 -4.137 -14.848 1.00 50.13 H new ATOM 0 HD2 HIS A 61 -2.811 -0.977 -16.188 1.00 55.01 H new ATOM 0 HE1 HIS A 61 0.868 -2.002 -14.349 1.00 63.45 H new ATOM 952 N HIS A 62 -5.090 -5.321 -18.415 1.00 70.25 N ATOM 953 CA HIS A 62 -5.736 -6.505 -19.024 1.00 73.30 C ATOM 954 C HIS A 62 -5.598 -6.476 -20.557 1.00 72.23 C ATOM 955 O HIS A 62 -5.243 -7.485 -21.178 1.00 5.15 O ATOM 956 CB HIS A 62 -7.219 -6.564 -18.596 1.00 54.34 C ATOM 957 CG HIS A 62 -8.026 -7.706 -19.172 1.00 42.22 C ATOM 958 ND1 HIS A 62 -7.570 -9.010 -19.239 1.00 52.24 N ATOM 959 CD2 HIS A 62 -9.275 -7.733 -19.686 1.00 4.03 C ATOM 960 CE1 HIS A 62 -8.507 -9.778 -19.762 1.00 32.55 C ATOM 961 NE2 HIS A 62 -9.547 -9.025 -20.039 1.00 5.21 N ATOM 0 H HIS A 62 -5.739 -4.565 -18.197 1.00 70.25 H new ATOM 0 HA HIS A 62 -5.235 -7.406 -18.670 1.00 73.30 H new ATOM 0 HB2 HIS A 62 -7.261 -6.626 -17.509 1.00 54.34 H new ATOM 0 HB3 HIS A 62 -7.697 -5.627 -18.880 1.00 54.34 H new ATOM 0 HD2 HIS A 62 -9.938 -6.888 -19.798 1.00 4.03 H new ATOM 0 HE1 HIS A 62 -8.432 -10.842 -19.933 1.00 32.55 H new ATOM 0 HE2 HIS A 62 -10.420 -9.353 -20.452 1.00 5.21 H new ATOM 970 N GLN A 63 -5.877 -5.303 -21.146 1.00 52.21 N ATOM 971 CA GLN A 63 -5.849 -5.092 -22.611 1.00 13.55 C ATOM 972 C GLN A 63 -4.402 -4.983 -23.116 1.00 55.24 C ATOM 973 O GLN A 63 -4.098 -5.343 -24.258 1.00 72.02 O ATOM 974 CB GLN A 63 -6.664 -3.821 -22.980 1.00 73.21 C ATOM 975 CG GLN A 63 -8.146 -3.877 -22.548 1.00 21.43 C ATOM 976 CD GLN A 63 -8.958 -2.625 -22.904 1.00 55.43 C ATOM 977 OE1 GLN A 63 -8.691 -1.947 -23.894 1.00 62.52 O ATOM 978 NE2 GLN A 63 -9.959 -2.310 -22.098 1.00 4.13 N ATOM 0 H GLN A 63 -6.130 -4.466 -20.621 1.00 52.21 H new ATOM 0 HA GLN A 63 -6.308 -5.952 -23.099 1.00 13.55 H new ATOM 0 HB2 GLN A 63 -6.194 -2.953 -22.517 1.00 73.21 H new ATOM 0 HB3 GLN A 63 -6.616 -3.672 -24.059 1.00 73.21 H new ATOM 0 HG2 GLN A 63 -8.615 -4.744 -23.014 1.00 21.43 H new ATOM 0 HG3 GLN A 63 -8.192 -4.030 -21.470 1.00 21.43 H new ATOM 0 HE21 GLN A 63 -10.159 -2.890 -21.283 1.00 4.13 H new ATOM 0 HE22 GLN A 63 -10.530 -1.488 -22.292 1.00 4.13 H new ATOM 987 N HIS A 64 -3.525 -4.456 -22.251 1.00 21.41 N ATOM 988 CA HIS A 64 -2.078 -4.361 -22.501 1.00 75.53 C ATOM 989 C HIS A 64 -1.341 -4.901 -21.257 1.00 63.03 C ATOM 990 O HIS A 64 -1.121 -4.137 -20.309 1.00 23.11 O ATOM 991 CB HIS A 64 -1.645 -2.889 -22.797 1.00 60.22 C ATOM 992 CG HIS A 64 -2.338 -2.256 -23.970 1.00 51.42 C ATOM 993 ND1 HIS A 64 -1.812 -2.248 -25.244 1.00 55.14 N ATOM 994 CD2 HIS A 64 -3.531 -1.622 -24.060 1.00 34.55 C ATOM 995 CE1 HIS A 64 -2.649 -1.640 -26.058 1.00 21.32 C ATOM 996 NE2 HIS A 64 -3.693 -1.250 -25.363 1.00 34.21 N ATOM 0 H HIS A 64 -3.803 -4.078 -21.345 1.00 21.41 H new ATOM 0 HA HIS A 64 -1.822 -4.951 -23.381 1.00 75.53 H new ATOM 0 HB2 HIS A 64 -1.834 -2.284 -21.910 1.00 60.22 H new ATOM 0 HB3 HIS A 64 -0.570 -2.869 -22.973 1.00 60.22 H new ATOM 0 HD2 HIS A 64 -4.225 -1.444 -23.252 1.00 34.55 H new ATOM 0 HE1 HIS A 64 -2.502 -1.488 -27.117 1.00 21.32 H new ATOM 0 HE2 HIS A 64 -4.498 -0.748 -25.738 1.00 34.21 H new ATOM 1005 N PRO A 65 -1.022 -6.241 -21.203 1.00 21.41 N ATOM 1006 CA PRO A 65 -0.301 -6.858 -20.055 1.00 0.51 C ATOM 1007 C PRO A 65 1.036 -6.142 -19.754 1.00 4.34 C ATOM 1008 O PRO A 65 2.063 -6.387 -20.405 1.00 0.04 O ATOM 1009 CB PRO A 65 -0.098 -8.342 -20.491 1.00 10.41 C ATOM 1010 CG PRO A 65 -0.353 -8.355 -21.972 1.00 23.24 C ATOM 1011 CD PRO A 65 -1.371 -7.265 -22.227 1.00 32.42 C ATOM 0 HA PRO A 65 -0.858 -6.777 -19.122 1.00 0.51 H new ATOM 0 HB2 PRO A 65 0.911 -8.685 -20.262 1.00 10.41 H new ATOM 0 HB3 PRO A 65 -0.787 -9.004 -19.967 1.00 10.41 H new ATOM 0 HG2 PRO A 65 0.566 -8.169 -22.528 1.00 23.24 H new ATOM 0 HG3 PRO A 65 -0.730 -9.325 -22.295 1.00 23.24 H new ATOM 0 HD2 PRO A 65 -1.293 -6.868 -23.239 1.00 32.42 H new ATOM 0 HD3 PRO A 65 -2.391 -7.628 -22.105 1.00 32.42 H new ATOM 1019 N GLY A 66 0.974 -5.191 -18.801 1.00 53.01 N ATOM 1020 CA GLY A 66 2.108 -4.343 -18.430 1.00 42.22 C ATOM 1021 C GLY A 66 2.193 -3.082 -19.288 1.00 42.44 C ATOM 1022 O GLY A 66 2.320 -1.968 -18.757 1.00 74.22 O ATOM 0 H GLY A 66 0.127 -4.994 -18.268 1.00 53.01 H new ATOM 0 HA2 GLY A 66 2.020 -4.061 -17.381 1.00 42.22 H new ATOM 0 HA3 GLY A 66 3.032 -4.912 -18.531 1.00 42.22 H new ATOM 1026 N GLY A 67 2.086 -3.260 -20.623 1.00 34.13 N ATOM 1027 CA GLY A 67 2.297 -2.174 -21.581 1.00 11.20 C ATOM 1028 C GLY A 67 3.785 -1.911 -21.759 1.00 50.11 C ATOM 1029 O GLY A 67 4.443 -2.603 -22.549 1.00 63.51 O ATOM 0 H GLY A 67 1.853 -4.154 -21.055 1.00 34.13 H new ATOM 0 HA2 GLY A 67 1.849 -2.433 -22.540 1.00 11.20 H new ATOM 0 HA3 GLY A 67 1.800 -1.269 -21.231 1.00 11.20 H new ATOM 1033 N SER A 68 4.303 -0.924 -20.998 1.00 45.21 N ATOM 1034 CA SER A 68 5.750 -0.632 -20.863 1.00 32.14 C ATOM 1035 C SER A 68 6.442 -0.237 -22.192 1.00 54.41 C ATOM 1036 O SER A 68 5.793 -0.098 -23.239 1.00 34.05 O ATOM 1037 CB SER A 68 6.466 -1.830 -20.182 1.00 44.35 C ATOM 1038 OG SER A 68 5.904 -2.106 -18.906 1.00 54.15 O ATOM 0 H SER A 68 3.718 -0.294 -20.449 1.00 45.21 H new ATOM 0 HA SER A 68 5.835 0.252 -20.231 1.00 32.14 H new ATOM 0 HB2 SER A 68 6.386 -2.713 -20.816 1.00 44.35 H new ATOM 0 HB3 SER A 68 7.528 -1.609 -20.075 1.00 44.35 H new ATOM 0 HG SER A 68 6.372 -2.865 -18.500 1.00 54.15 H new ATOM 1044 N GLY A 69 7.763 0.008 -22.109 1.00 21.21 N ATOM 1045 CA GLY A 69 8.588 0.274 -23.284 1.00 2.24 C ATOM 1046 C GLY A 69 9.866 1.000 -22.908 1.00 12.25 C ATOM 1047 O GLY A 69 10.462 0.718 -21.861 1.00 31.20 O ATOM 0 H GLY A 69 8.278 0.025 -21.229 1.00 21.21 H new ATOM 0 HA2 GLY A 69 8.833 -0.666 -23.779 1.00 2.24 H new ATOM 0 HA3 GLY A 69 8.024 0.873 -23.999 1.00 2.24 H new ATOM 1051 N LEU A 70 10.297 1.925 -23.781 1.00 63.25 N ATOM 1052 CA LEU A 70 11.425 2.830 -23.517 1.00 65.10 C ATOM 1053 C LEU A 70 10.926 4.016 -22.675 1.00 34.33 C ATOM 1054 O LEU A 70 11.619 4.499 -21.770 1.00 72.13 O ATOM 1055 CB LEU A 70 12.040 3.316 -24.860 1.00 0.21 C ATOM 1056 CG LEU A 70 13.236 4.315 -24.749 1.00 31.22 C ATOM 1057 CD1 LEU A 70 14.432 3.687 -24.001 1.00 1.21 C ATOM 1058 CD2 LEU A 70 13.655 4.839 -26.141 1.00 65.51 C ATOM 0 H LEU A 70 9.869 2.066 -24.696 1.00 63.25 H new ATOM 0 HA LEU A 70 12.204 2.306 -22.963 1.00 65.10 H new ATOM 0 HB2 LEU A 70 12.374 2.442 -25.420 1.00 0.21 H new ATOM 0 HB3 LEU A 70 11.252 3.789 -25.447 1.00 0.21 H new ATOM 0 HG LEU A 70 12.898 5.168 -24.161 1.00 31.22 H new ATOM 0 HD11 LEU A 70 15.245 4.410 -23.943 1.00 1.21 H new ATOM 0 HD12 LEU A 70 14.124 3.405 -22.994 1.00 1.21 H new ATOM 0 HD13 LEU A 70 14.772 2.801 -24.537 1.00 1.21 H new ATOM 0 HD21 LEU A 70 14.489 5.532 -26.033 1.00 65.51 H new ATOM 0 HD22 LEU A 70 13.958 4.001 -26.769 1.00 65.51 H new ATOM 0 HD23 LEU A 70 12.813 5.354 -26.604 1.00 65.51 H new ATOM 1070 N ASP A 71 9.710 4.469 -23.006 1.00 43.24 N ATOM 1071 CA ASP A 71 8.975 5.481 -22.240 1.00 14.43 C ATOM 1072 C ASP A 71 7.759 4.805 -21.597 1.00 1.11 C ATOM 1073 O ASP A 71 6.805 4.417 -22.285 1.00 14.31 O ATOM 1074 CB ASP A 71 8.545 6.662 -23.145 1.00 23.02 C ATOM 1075 CG ASP A 71 7.795 7.769 -22.368 1.00 52.45 C ATOM 1076 OD1 ASP A 71 8.459 8.633 -21.753 1.00 24.41 O ATOM 1077 OD2 ASP A 71 6.547 7.785 -22.376 1.00 5.33 O ATOM 0 H ASP A 71 9.202 4.137 -23.826 1.00 43.24 H new ATOM 0 HA ASP A 71 9.618 5.897 -21.465 1.00 14.43 H new ATOM 0 HB2 ASP A 71 9.428 7.091 -23.619 1.00 23.02 H new ATOM 0 HB3 ASP A 71 7.905 6.288 -23.944 1.00 23.02 H new ATOM 1082 N ASP A 72 7.825 4.640 -20.278 1.00 11.53 N ATOM 1083 CA ASP A 72 6.767 3.991 -19.469 1.00 62.23 C ATOM 1084 C ASP A 72 5.731 4.995 -18.954 1.00 74.04 C ATOM 1085 O ASP A 72 5.076 4.743 -17.934 1.00 41.30 O ATOM 1086 CB ASP A 72 7.416 3.183 -18.294 1.00 45.35 C ATOM 1087 CG ASP A 72 7.840 1.764 -18.707 1.00 10.31 C ATOM 1088 OD1 ASP A 72 7.287 0.782 -18.162 1.00 34.42 O ATOM 1089 OD2 ASP A 72 8.710 1.628 -19.593 1.00 14.11 O ATOM 0 H ASP A 72 8.621 4.954 -19.723 1.00 11.53 H new ATOM 0 HA ASP A 72 6.226 3.300 -20.115 1.00 62.23 H new ATOM 0 HB2 ASP A 72 8.287 3.724 -17.925 1.00 45.35 H new ATOM 0 HB3 ASP A 72 6.707 3.119 -17.468 1.00 45.35 H new ATOM 1094 N ILE A 73 5.538 6.111 -19.686 1.00 11.11 N ATOM 1095 CA ILE A 73 4.452 7.069 -19.410 1.00 42.23 C ATOM 1096 C ILE A 73 3.517 7.133 -20.645 1.00 40.24 C ATOM 1097 O ILE A 73 3.714 7.965 -21.536 1.00 14.42 O ATOM 1098 CB ILE A 73 4.998 8.513 -19.058 1.00 45.12 C ATOM 1099 CG1 ILE A 73 6.077 8.459 -17.926 1.00 13.02 C ATOM 1100 CG2 ILE A 73 3.840 9.477 -18.670 1.00 3.30 C ATOM 1101 CD1 ILE A 73 5.576 7.962 -16.577 1.00 44.01 C ATOM 0 H ILE A 73 6.126 6.371 -20.478 1.00 11.11 H new ATOM 0 HA ILE A 73 3.903 6.721 -18.535 1.00 42.23 H new ATOM 0 HB ILE A 73 5.476 8.904 -19.956 1.00 45.12 H new ATOM 0 HG12 ILE A 73 6.892 7.813 -18.253 1.00 13.02 H new ATOM 0 HG13 ILE A 73 6.494 9.458 -17.795 1.00 13.02 H new ATOM 0 HG21 ILE A 73 4.248 10.460 -18.434 1.00 3.30 H new ATOM 0 HG22 ILE A 73 3.144 9.564 -19.504 1.00 3.30 H new ATOM 0 HG23 ILE A 73 3.315 9.084 -17.799 1.00 3.30 H new ATOM 0 HD11 ILE A 73 6.398 7.962 -15.861 1.00 44.01 H new ATOM 0 HD12 ILE A 73 4.783 8.619 -16.219 1.00 44.01 H new ATOM 0 HD13 ILE A 73 5.188 6.949 -16.684 1.00 44.01 H new ATOM 1113 N PRO A 74 2.518 6.192 -20.769 1.00 24.25 N ATOM 1114 CA PRO A 74 1.503 6.247 -21.853 1.00 2.34 C ATOM 1115 C PRO A 74 0.474 7.371 -21.593 1.00 14.25 C ATOM 1116 O PRO A 74 0.163 7.640 -20.430 1.00 51.31 O ATOM 1117 CB PRO A 74 0.840 4.830 -21.808 1.00 21.51 C ATOM 1118 CG PRO A 74 1.718 4.008 -20.900 1.00 1.45 C ATOM 1119 CD PRO A 74 2.303 4.993 -19.917 1.00 60.14 C ATOM 0 HA PRO A 74 1.931 6.474 -22.829 1.00 2.34 H new ATOM 0 HB2 PRO A 74 -0.179 4.885 -21.425 1.00 21.51 H new ATOM 0 HB3 PRO A 74 0.784 4.390 -22.804 1.00 21.51 H new ATOM 0 HG2 PRO A 74 1.143 3.236 -20.389 1.00 1.45 H new ATOM 0 HG3 PRO A 74 2.502 3.501 -21.463 1.00 1.45 H new ATOM 0 HD2 PRO A 74 1.622 5.197 -19.090 1.00 60.14 H new ATOM 0 HD3 PRO A 74 3.234 4.630 -19.481 1.00 60.14 H new ATOM 1127 N PRO A 75 -0.061 8.044 -22.667 1.00 32.33 N ATOM 1128 CA PRO A 75 -1.093 9.115 -22.528 1.00 35.04 C ATOM 1129 C PRO A 75 -2.278 8.724 -21.613 1.00 22.11 C ATOM 1130 O PRO A 75 -2.775 9.549 -20.851 1.00 41.33 O ATOM 1131 CB PRO A 75 -1.562 9.334 -23.981 1.00 50.24 C ATOM 1132 CG PRO A 75 -0.365 8.987 -24.817 1.00 13.15 C ATOM 1133 CD PRO A 75 0.325 7.845 -24.097 1.00 45.44 C ATOM 0 HA PRO A 75 -0.685 10.006 -22.050 1.00 35.04 H new ATOM 0 HB2 PRO A 75 -2.414 8.698 -24.224 1.00 50.24 H new ATOM 0 HB3 PRO A 75 -1.876 10.365 -24.146 1.00 50.24 H new ATOM 0 HG2 PRO A 75 -0.663 8.692 -25.823 1.00 13.15 H new ATOM 0 HG3 PRO A 75 0.301 9.843 -24.920 1.00 13.15 H new ATOM 0 HD2 PRO A 75 -0.008 6.877 -24.471 1.00 45.44 H new ATOM 0 HD3 PRO A 75 1.406 7.883 -24.229 1.00 45.44 H new ATOM 1141 N TYR A 76 -2.675 7.440 -21.689 1.00 24.33 N ATOM 1142 CA TYR A 76 -3.776 6.861 -20.892 1.00 44.10 C ATOM 1143 C TYR A 76 -3.524 7.039 -19.375 1.00 43.52 C ATOM 1144 O TYR A 76 -4.337 7.634 -18.660 1.00 24.30 O ATOM 1145 CB TYR A 76 -3.907 5.347 -21.243 1.00 63.00 C ATOM 1146 CG TYR A 76 -5.114 4.622 -20.623 1.00 64.01 C ATOM 1147 CD1 TYR A 76 -5.110 4.190 -19.287 1.00 31.44 C ATOM 1148 CD2 TYR A 76 -6.255 4.357 -21.381 1.00 41.05 C ATOM 1149 CE1 TYR A 76 -6.187 3.520 -18.749 1.00 3.22 C ATOM 1150 CE2 TYR A 76 -7.330 3.690 -20.843 1.00 22.32 C ATOM 1151 CZ TYR A 76 -7.296 3.275 -19.530 1.00 1.40 C ATOM 1152 OH TYR A 76 -8.364 2.598 -19.011 1.00 1.13 O ATOM 0 H TYR A 76 -2.235 6.765 -22.314 1.00 24.33 H new ATOM 0 HA TYR A 76 -4.702 7.382 -21.134 1.00 44.10 H new ATOM 0 HB2 TYR A 76 -3.964 5.248 -22.327 1.00 63.00 H new ATOM 0 HB3 TYR A 76 -2.997 4.839 -20.924 1.00 63.00 H new ATOM 0 HD1 TYR A 76 -4.246 4.387 -18.669 1.00 31.44 H new ATOM 0 HD2 TYR A 76 -6.294 4.682 -22.410 1.00 41.05 H new ATOM 0 HE1 TYR A 76 -6.162 3.189 -17.721 1.00 3.22 H new ATOM 0 HE2 TYR A 76 -8.201 3.491 -21.450 1.00 22.32 H new ATOM 0 HH TYR A 76 -8.075 2.081 -18.230 1.00 1.13 H new ATOM 1162 N ASP A 77 -2.374 6.526 -18.928 1.00 32.53 N ATOM 1163 CA ASP A 77 -1.984 6.468 -17.504 1.00 52.34 C ATOM 1164 C ASP A 77 -1.599 7.871 -16.991 1.00 53.20 C ATOM 1165 O ASP A 77 -1.756 8.180 -15.804 1.00 64.04 O ATOM 1166 CB ASP A 77 -0.809 5.468 -17.337 1.00 32.44 C ATOM 1167 CG ASP A 77 -1.121 4.074 -17.932 1.00 4.32 C ATOM 1168 OD1 ASP A 77 -1.323 3.102 -17.174 1.00 23.42 O ATOM 1169 OD2 ASP A 77 -1.184 3.960 -19.175 1.00 0.32 O ATOM 0 H ASP A 77 -1.671 6.130 -19.552 1.00 32.53 H new ATOM 0 HA ASP A 77 -2.829 6.122 -16.908 1.00 52.34 H new ATOM 0 HB2 ASP A 77 0.080 5.874 -17.820 1.00 32.44 H new ATOM 0 HB3 ASP A 77 -0.575 5.362 -16.278 1.00 32.44 H new ATOM 1174 N ARG A 78 -1.109 8.706 -17.919 1.00 35.41 N ATOM 1175 CA ARG A 78 -0.769 10.114 -17.664 1.00 31.33 C ATOM 1176 C ARG A 78 -2.043 10.931 -17.360 1.00 72.43 C ATOM 1177 O ARG A 78 -2.054 11.777 -16.458 1.00 3.43 O ATOM 1178 CB ARG A 78 -0.018 10.687 -18.900 1.00 64.40 C ATOM 1179 CG ARG A 78 0.572 12.103 -18.728 1.00 33.24 C ATOM 1180 CD ARG A 78 1.260 12.600 -20.014 1.00 63.01 C ATOM 1181 NE ARG A 78 1.900 13.915 -19.851 1.00 11.42 N ATOM 1182 CZ ARG A 78 2.163 14.783 -20.849 1.00 54.31 C ATOM 1183 NH1 ARG A 78 1.842 14.502 -22.114 1.00 2.14 N ATOM 1184 NH2 ARG A 78 2.772 15.927 -20.573 1.00 35.34 N ATOM 0 H ARG A 78 -0.935 8.418 -18.882 1.00 35.41 H new ATOM 0 HA ARG A 78 -0.120 10.182 -16.791 1.00 31.33 H new ATOM 0 HB2 ARG A 78 0.792 10.005 -19.158 1.00 64.40 H new ATOM 0 HB3 ARG A 78 -0.705 10.700 -19.746 1.00 64.40 H new ATOM 0 HG2 ARG A 78 -0.222 12.796 -18.451 1.00 33.24 H new ATOM 0 HG3 ARG A 78 1.292 12.099 -17.910 1.00 33.24 H new ATOM 0 HD2 ARG A 78 2.011 11.872 -20.323 1.00 63.01 H new ATOM 0 HD3 ARG A 78 0.523 12.657 -20.815 1.00 63.01 H new ATOM 0 HE ARG A 78 2.166 14.193 -18.906 1.00 11.42 H new ATOM 0 HH11 ARG A 78 1.389 13.617 -22.341 1.00 2.14 H new ATOM 0 HH12 ARG A 78 2.050 15.173 -22.854 1.00 2.14 H new ATOM 0 HH21 ARG A 78 3.038 16.145 -19.613 1.00 35.34 H new ATOM 0 HH22 ARG A 78 2.975 16.590 -21.321 1.00 35.34 H new ATOM 1198 N ASP A 79 -3.116 10.665 -18.129 1.00 41.24 N ATOM 1199 CA ASP A 79 -4.431 11.315 -17.928 1.00 4.12 C ATOM 1200 C ASP A 79 -5.181 10.702 -16.735 1.00 73.24 C ATOM 1201 O ASP A 79 -6.040 11.358 -16.151 1.00 12.34 O ATOM 1202 CB ASP A 79 -5.301 11.254 -19.216 1.00 54.22 C ATOM 1203 CG ASP A 79 -4.793 12.183 -20.338 1.00 2.22 C ATOM 1204 OD1 ASP A 79 -4.656 13.403 -20.097 1.00 0.53 O ATOM 1205 OD2 ASP A 79 -4.556 11.714 -21.467 1.00 10.34 O ATOM 0 H ASP A 79 -3.100 9.999 -18.902 1.00 41.24 H new ATOM 0 HA ASP A 79 -4.241 12.365 -17.704 1.00 4.12 H new ATOM 0 HB2 ASP A 79 -5.322 10.228 -19.584 1.00 54.22 H new ATOM 0 HB3 ASP A 79 -6.327 11.524 -18.967 1.00 54.22 H new ATOM 1210 N PHE A 80 -4.859 9.437 -16.388 1.00 42.01 N ATOM 1211 CA PHE A 80 -5.382 8.774 -15.170 1.00 53.24 C ATOM 1212 C PHE A 80 -4.904 9.525 -13.906 1.00 61.14 C ATOM 1213 O PHE A 80 -5.647 9.652 -12.916 1.00 44.31 O ATOM 1214 CB PHE A 80 -4.945 7.275 -15.125 1.00 65.44 C ATOM 1215 CG PHE A 80 -5.341 6.547 -13.843 1.00 45.14 C ATOM 1216 CD1 PHE A 80 -6.667 6.191 -13.610 1.00 21.23 C ATOM 1217 CD2 PHE A 80 -4.394 6.246 -12.854 1.00 21.12 C ATOM 1218 CE1 PHE A 80 -7.032 5.566 -12.437 1.00 40.13 C ATOM 1219 CE2 PHE A 80 -4.765 5.613 -11.685 1.00 64.34 C ATOM 1220 CZ PHE A 80 -6.087 5.273 -11.474 1.00 64.22 C ATOM 0 H PHE A 80 -4.234 8.849 -16.939 1.00 42.01 H new ATOM 0 HA PHE A 80 -6.471 8.805 -15.198 1.00 53.24 H new ATOM 0 HB2 PHE A 80 -5.384 6.754 -15.976 1.00 65.44 H new ATOM 0 HB3 PHE A 80 -3.863 7.220 -15.242 1.00 65.44 H new ATOM 0 HD1 PHE A 80 -7.417 6.407 -14.356 1.00 21.23 H new ATOM 0 HD2 PHE A 80 -3.359 6.513 -13.009 1.00 21.12 H new ATOM 0 HE1 PHE A 80 -8.066 5.303 -12.270 1.00 40.13 H new ATOM 0 HE2 PHE A 80 -4.022 5.384 -10.936 1.00 64.34 H new ATOM 0 HZ PHE A 80 -6.380 4.780 -10.559 1.00 64.22 H new ATOM 1230 N CYS A 81 -3.656 10.031 -13.977 1.00 15.11 N ATOM 1231 CA CYS A 81 -3.024 10.795 -12.892 1.00 54.44 C ATOM 1232 C CYS A 81 -3.671 12.188 -12.695 1.00 51.21 C ATOM 1233 O CYS A 81 -3.337 12.882 -11.727 1.00 3.15 O ATOM 1234 CB CYS A 81 -1.511 10.924 -13.164 1.00 43.14 C ATOM 1235 SG CYS A 81 -0.650 9.338 -13.220 1.00 23.13 S ATOM 0 H CYS A 81 -3.058 9.918 -14.796 1.00 15.11 H new ATOM 0 HA CYS A 81 -3.181 10.248 -11.962 1.00 54.44 H new ATOM 0 HB2 CYS A 81 -1.363 11.442 -14.112 1.00 43.14 H new ATOM 0 HB3 CYS A 81 -1.062 11.545 -12.388 1.00 43.14 H new ATOM 0 HG CYS A 81 -0.894 8.751 -14.354 1.00 23.13 H new ATOM 1241 N LYS A 82 -4.570 12.602 -13.619 1.00 64.45 N ATOM 1242 CA LYS A 82 -5.402 13.805 -13.432 1.00 14.44 C ATOM 1243 C LYS A 82 -6.459 13.539 -12.347 1.00 34.21 C ATOM 1244 O LYS A 82 -7.555 13.036 -12.624 1.00 72.33 O ATOM 1245 CB LYS A 82 -6.070 14.270 -14.763 1.00 62.11 C ATOM 1246 CG LYS A 82 -5.134 15.031 -15.727 1.00 1.24 C ATOM 1247 CD LYS A 82 -4.603 16.343 -15.101 1.00 31.34 C ATOM 1248 CE LYS A 82 -3.746 17.167 -16.074 1.00 2.44 C ATOM 1249 NZ LYS A 82 -2.606 16.380 -16.615 1.00 62.32 N ATOM 0 H LYS A 82 -4.735 12.117 -14.501 1.00 64.45 H new ATOM 0 HA LYS A 82 -4.753 14.619 -13.109 1.00 14.44 H new ATOM 0 HB2 LYS A 82 -6.466 13.395 -15.279 1.00 62.11 H new ATOM 0 HB3 LYS A 82 -6.919 14.910 -14.523 1.00 62.11 H new ATOM 0 HG2 LYS A 82 -4.294 14.392 -15.997 1.00 1.24 H new ATOM 0 HG3 LYS A 82 -5.670 15.259 -16.648 1.00 1.24 H new ATOM 0 HD2 LYS A 82 -5.446 16.947 -14.767 1.00 31.34 H new ATOM 0 HD3 LYS A 82 -4.012 16.104 -14.217 1.00 31.34 H new ATOM 0 HE2 LYS A 82 -4.368 17.517 -16.898 1.00 2.44 H new ATOM 0 HE3 LYS A 82 -3.366 18.051 -15.563 1.00 2.44 H new ATOM 0 HZ1 LYS A 82 -1.996 17.000 -17.186 1.00 62.32 H new ATOM 0 HZ2 LYS A 82 -2.055 15.981 -15.828 1.00 62.32 H new ATOM 0 HZ3 LYS A 82 -2.969 15.608 -17.210 1.00 62.32 H new ATOM 1263 N VAL A 83 -6.061 13.814 -11.100 1.00 72.14 N ATOM 1264 CA VAL A 83 -6.918 13.755 -9.911 1.00 15.24 C ATOM 1265 C VAL A 83 -6.581 14.946 -8.995 1.00 41.24 C ATOM 1266 O VAL A 83 -5.418 15.376 -8.923 1.00 74.24 O ATOM 1267 CB VAL A 83 -6.743 12.390 -9.126 1.00 64.44 C ATOM 1268 CG1 VAL A 83 -7.506 11.239 -9.806 1.00 10.23 C ATOM 1269 CG2 VAL A 83 -5.254 12.013 -8.970 1.00 63.33 C ATOM 0 H VAL A 83 -5.104 14.092 -10.884 1.00 72.14 H new ATOM 0 HA VAL A 83 -7.959 13.810 -10.230 1.00 15.24 H new ATOM 0 HB VAL A 83 -7.168 12.545 -8.134 1.00 64.44 H new ATOM 0 HG11 VAL A 83 -7.361 10.320 -9.238 1.00 10.23 H new ATOM 0 HG12 VAL A 83 -8.569 11.479 -9.843 1.00 10.23 H new ATOM 0 HG13 VAL A 83 -7.129 11.102 -10.820 1.00 10.23 H new ATOM 0 HG21 VAL A 83 -5.172 11.072 -8.427 1.00 63.33 H new ATOM 0 HG22 VAL A 83 -4.801 11.904 -9.955 1.00 63.33 H new ATOM 0 HG23 VAL A 83 -4.736 12.797 -8.417 1.00 63.33 H new ATOM 1279 N ASP A 84 -7.607 15.478 -8.318 1.00 41.12 N ATOM 1280 CA ASP A 84 -7.468 16.586 -7.345 1.00 21.31 C ATOM 1281 C ASP A 84 -6.660 16.102 -6.121 1.00 41.03 C ATOM 1282 O ASP A 84 -6.589 14.894 -5.888 1.00 5.32 O ATOM 1283 CB ASP A 84 -8.885 17.078 -6.941 1.00 51.03 C ATOM 1284 CG ASP A 84 -8.901 18.279 -5.980 1.00 34.32 C ATOM 1285 OD1 ASP A 84 -9.747 18.309 -5.065 1.00 44.35 O ATOM 1286 OD2 ASP A 84 -8.070 19.201 -6.134 1.00 41.05 O ATOM 0 H ASP A 84 -8.568 15.153 -8.426 1.00 41.12 H new ATOM 0 HA ASP A 84 -6.926 17.421 -7.789 1.00 21.31 H new ATOM 0 HB2 ASP A 84 -9.432 17.346 -7.845 1.00 51.03 H new ATOM 0 HB3 ASP A 84 -9.422 16.251 -6.476 1.00 51.03 H new ATOM 1291 N GLN A 85 -6.061 17.037 -5.349 1.00 12.51 N ATOM 1292 CA GLN A 85 -5.080 16.704 -4.277 1.00 24.21 C ATOM 1293 C GLN A 85 -5.626 15.638 -3.258 1.00 75.13 C ATOM 1294 O GLN A 85 -4.927 14.640 -3.015 1.00 31.23 O ATOM 1295 CB GLN A 85 -4.550 18.012 -3.593 1.00 41.42 C ATOM 1296 CG GLN A 85 -3.211 17.875 -2.814 1.00 71.41 C ATOM 1297 CD GLN A 85 -3.310 17.163 -1.456 1.00 12.43 C ATOM 1298 OE1 GLN A 85 -4.328 17.224 -0.773 1.00 73.40 O ATOM 1299 NE2 GLN A 85 -2.250 16.475 -1.053 1.00 62.04 N ATOM 0 H GLN A 85 -6.238 18.037 -5.446 1.00 12.51 H new ATOM 0 HA GLN A 85 -4.224 16.217 -4.745 1.00 24.21 H new ATOM 0 HB2 GLN A 85 -4.425 18.776 -4.361 1.00 41.42 H new ATOM 0 HB3 GLN A 85 -5.313 18.374 -2.904 1.00 41.42 H new ATOM 0 HG2 GLN A 85 -2.500 17.333 -3.438 1.00 71.41 H new ATOM 0 HG3 GLN A 85 -2.800 18.872 -2.654 1.00 71.41 H new ATOM 0 HE21 GLN A 85 -1.414 16.438 -1.637 1.00 62.04 H new ATOM 0 HE22 GLN A 85 -2.271 15.983 -0.160 1.00 62.04 H new ATOM 1308 N PRO A 86 -6.867 15.795 -2.652 1.00 73.41 N ATOM 1309 CA PRO A 86 -7.491 14.712 -1.828 1.00 24.42 C ATOM 1310 C PRO A 86 -7.778 13.417 -2.630 1.00 20.31 C ATOM 1311 O PRO A 86 -7.699 12.319 -2.079 1.00 34.24 O ATOM 1312 CB PRO A 86 -8.806 15.356 -1.301 1.00 33.42 C ATOM 1313 CG PRO A 86 -9.077 16.500 -2.233 1.00 31.31 C ATOM 1314 CD PRO A 86 -7.718 17.025 -2.629 1.00 3.22 C ATOM 0 HA PRO A 86 -6.822 14.383 -1.033 1.00 24.42 H new ATOM 0 HB2 PRO A 86 -9.627 14.639 -1.307 1.00 33.42 H new ATOM 0 HB3 PRO A 86 -8.692 15.702 -0.274 1.00 33.42 H new ATOM 0 HG2 PRO A 86 -9.641 16.171 -3.106 1.00 31.31 H new ATOM 0 HG3 PRO A 86 -9.670 17.273 -1.744 1.00 31.31 H new ATOM 0 HD2 PRO A 86 -7.744 17.514 -3.603 1.00 3.22 H new ATOM 0 HD3 PRO A 86 -7.346 17.758 -1.913 1.00 3.22 H new ATOM 1322 N THR A 87 -8.094 13.566 -3.931 1.00 2.21 N ATOM 1323 CA THR A 87 -8.493 12.448 -4.813 1.00 1.12 C ATOM 1324 C THR A 87 -7.315 11.471 -5.085 1.00 44.22 C ATOM 1325 O THR A 87 -7.554 10.280 -5.332 1.00 13.44 O ATOM 1326 CB THR A 87 -9.110 12.983 -6.153 1.00 14.25 C ATOM 1327 OG1 THR A 87 -10.053 14.027 -5.859 1.00 65.12 O ATOM 1328 CG2 THR A 87 -9.820 11.884 -6.973 1.00 44.25 C ATOM 0 H THR A 87 -8.080 14.470 -4.404 1.00 2.21 H new ATOM 0 HA THR A 87 -9.262 11.880 -4.289 1.00 1.12 H new ATOM 0 HB THR A 87 -8.283 13.356 -6.757 1.00 14.25 H new ATOM 0 HG1 THR A 87 -10.553 14.254 -6.670 1.00 65.12 H new ATOM 0 HG21 THR A 87 -10.225 12.317 -7.888 1.00 44.25 H new ATOM 0 HG22 THR A 87 -9.105 11.101 -7.228 1.00 44.25 H new ATOM 0 HG23 THR A 87 -10.631 11.457 -6.383 1.00 44.25 H new ATOM 1336 N LEU A 88 -6.047 11.977 -5.051 1.00 54.25 N ATOM 1337 CA LEU A 88 -4.842 11.095 -5.062 1.00 15.12 C ATOM 1338 C LEU A 88 -4.926 10.075 -3.905 1.00 5.41 C ATOM 1339 O LEU A 88 -4.712 8.877 -4.105 1.00 0.35 O ATOM 1340 CB LEU A 88 -3.485 11.877 -4.944 1.00 25.30 C ATOM 1341 CG LEU A 88 -2.960 12.629 -6.219 1.00 0.41 C ATOM 1342 CD1 LEU A 88 -3.624 13.997 -6.399 1.00 13.11 C ATOM 1343 CD2 LEU A 88 -1.421 12.764 -6.213 1.00 43.24 C ATOM 0 H LEU A 88 -5.836 12.974 -5.016 1.00 54.25 H new ATOM 0 HA LEU A 88 -4.845 10.596 -6.031 1.00 15.12 H new ATOM 0 HB2 LEU A 88 -3.589 12.609 -4.143 1.00 25.30 H new ATOM 0 HB3 LEU A 88 -2.717 11.169 -4.632 1.00 25.30 H new ATOM 0 HG LEU A 88 -3.240 12.014 -7.074 1.00 0.41 H new ATOM 0 HD11 LEU A 88 -3.229 14.478 -7.293 1.00 13.11 H new ATOM 0 HD12 LEU A 88 -4.701 13.868 -6.503 1.00 13.11 H new ATOM 0 HD13 LEU A 88 -3.415 14.620 -5.529 1.00 13.11 H new ATOM 0 HD21 LEU A 88 -1.098 13.290 -7.112 1.00 43.24 H new ATOM 0 HD22 LEU A 88 -1.108 13.325 -5.332 1.00 43.24 H new ATOM 0 HD23 LEU A 88 -0.969 11.772 -6.191 1.00 43.24 H new ATOM 1355 N PHE A 89 -5.274 10.581 -2.704 1.00 20.10 N ATOM 1356 CA PHE A 89 -5.388 9.767 -1.481 1.00 10.50 C ATOM 1357 C PHE A 89 -6.586 8.814 -1.549 1.00 54.30 C ATOM 1358 O PHE A 89 -6.529 7.733 -0.989 1.00 60.43 O ATOM 1359 CB PHE A 89 -5.500 10.670 -0.230 1.00 54.54 C ATOM 1360 CG PHE A 89 -4.314 11.606 -0.037 1.00 42.25 C ATOM 1361 CD1 PHE A 89 -3.024 11.098 0.081 1.00 52.42 C ATOM 1362 CD2 PHE A 89 -4.484 12.987 0.038 1.00 73.44 C ATOM 1363 CE1 PHE A 89 -1.951 11.937 0.265 1.00 1.42 C ATOM 1364 CE2 PHE A 89 -3.409 13.824 0.221 1.00 42.11 C ATOM 1365 CZ PHE A 89 -2.139 13.303 0.336 1.00 64.23 C ATOM 0 H PHE A 89 -5.484 11.568 -2.557 1.00 20.10 H new ATOM 0 HA PHE A 89 -4.481 9.167 -1.404 1.00 10.50 H new ATOM 0 HB2 PHE A 89 -6.411 11.264 -0.303 1.00 54.54 H new ATOM 0 HB3 PHE A 89 -5.600 10.040 0.653 1.00 54.54 H new ATOM 0 HD1 PHE A 89 -2.864 10.031 0.027 1.00 52.42 H new ATOM 0 HD2 PHE A 89 -5.476 13.406 -0.049 1.00 73.44 H new ATOM 0 HE1 PHE A 89 -0.956 11.526 0.354 1.00 1.42 H new ATOM 0 HE2 PHE A 89 -3.560 14.892 0.275 1.00 42.11 H new ATOM 0 HZ PHE A 89 -1.294 13.960 0.481 1.00 64.23 H new ATOM 1375 N GLU A 90 -7.658 9.227 -2.247 1.00 25.31 N ATOM 1376 CA GLU A 90 -8.853 8.380 -2.457 1.00 70.02 C ATOM 1377 C GLU A 90 -8.503 7.138 -3.306 1.00 30.41 C ATOM 1378 O GLU A 90 -9.048 6.052 -3.080 1.00 54.33 O ATOM 1379 CB GLU A 90 -9.987 9.186 -3.135 1.00 54.23 C ATOM 1380 CG GLU A 90 -10.447 10.433 -2.355 1.00 33.13 C ATOM 1381 CD GLU A 90 -10.987 10.125 -0.945 1.00 23.45 C ATOM 1382 OE1 GLU A 90 -12.203 9.849 -0.813 1.00 33.23 O ATOM 1383 OE2 GLU A 90 -10.211 10.175 0.034 1.00 14.40 O ATOM 0 H GLU A 90 -7.724 10.148 -2.679 1.00 25.31 H new ATOM 0 HA GLU A 90 -9.201 8.046 -1.480 1.00 70.02 H new ATOM 0 HB2 GLU A 90 -9.652 9.497 -4.125 1.00 54.23 H new ATOM 0 HB3 GLU A 90 -10.844 8.529 -3.281 1.00 54.23 H new ATOM 0 HG2 GLU A 90 -9.609 11.125 -2.269 1.00 33.13 H new ATOM 0 HG3 GLU A 90 -11.223 10.941 -2.927 1.00 33.13 H new ATOM 1390 N LEU A 91 -7.586 7.327 -4.286 1.00 73.11 N ATOM 1391 CA LEU A 91 -7.052 6.229 -5.117 1.00 43.30 C ATOM 1392 C LEU A 91 -6.115 5.318 -4.292 1.00 12.12 C ATOM 1393 O LEU A 91 -6.125 4.106 -4.477 1.00 75.30 O ATOM 1394 CB LEU A 91 -6.299 6.775 -6.367 1.00 13.21 C ATOM 1395 CG LEU A 91 -7.132 7.600 -7.401 1.00 3.14 C ATOM 1396 CD1 LEU A 91 -6.255 7.975 -8.618 1.00 72.34 C ATOM 1397 CD2 LEU A 91 -8.408 6.846 -7.844 1.00 52.41 C ATOM 0 H LEU A 91 -7.200 8.242 -4.519 1.00 73.11 H new ATOM 0 HA LEU A 91 -7.902 5.640 -5.461 1.00 43.30 H new ATOM 0 HB2 LEU A 91 -5.477 7.401 -6.019 1.00 13.21 H new ATOM 0 HB3 LEU A 91 -5.855 5.928 -6.890 1.00 13.21 H new ATOM 0 HG LEU A 91 -7.459 8.518 -6.912 1.00 3.14 H new ATOM 0 HD11 LEU A 91 -6.847 8.549 -9.330 1.00 72.34 H new ATOM 0 HD12 LEU A 91 -5.407 8.574 -8.285 1.00 72.34 H new ATOM 0 HD13 LEU A 91 -5.891 7.067 -9.098 1.00 72.34 H new ATOM 0 HD21 LEU A 91 -8.959 7.453 -8.562 1.00 52.41 H new ATOM 0 HD22 LEU A 91 -8.129 5.900 -8.307 1.00 52.41 H new ATOM 0 HD23 LEU A 91 -9.037 6.653 -6.975 1.00 52.41 H new ATOM 1409 N ILE A 92 -5.298 5.930 -3.397 1.00 43.13 N ATOM 1410 CA ILE A 92 -4.414 5.188 -2.456 1.00 3.12 C ATOM 1411 C ILE A 92 -5.254 4.318 -1.490 1.00 23.33 C ATOM 1412 O ILE A 92 -4.933 3.148 -1.253 1.00 72.55 O ATOM 1413 CB ILE A 92 -3.485 6.171 -1.627 1.00 63.10 C ATOM 1414 CG1 ILE A 92 -2.559 6.988 -2.581 1.00 62.43 C ATOM 1415 CG2 ILE A 92 -2.644 5.416 -0.559 1.00 44.43 C ATOM 1416 CD1 ILE A 92 -1.671 8.018 -1.897 1.00 3.11 C ATOM 0 H ILE A 92 -5.232 6.944 -3.306 1.00 43.13 H new ATOM 0 HA ILE A 92 -3.773 4.541 -3.055 1.00 3.12 H new ATOM 0 HB ILE A 92 -4.138 6.863 -1.095 1.00 63.10 H new ATOM 0 HG12 ILE A 92 -1.925 6.292 -3.130 1.00 62.43 H new ATOM 0 HG13 ILE A 92 -3.181 7.499 -3.316 1.00 62.43 H new ATOM 0 HG21 ILE A 92 -2.023 6.128 -0.015 1.00 44.43 H new ATOM 0 HG22 ILE A 92 -3.311 4.910 0.138 1.00 44.43 H new ATOM 0 HG23 ILE A 92 -2.007 4.680 -1.051 1.00 44.43 H new ATOM 0 HD11 ILE A 92 -1.067 8.532 -2.645 1.00 3.11 H new ATOM 0 HD12 ILE A 92 -2.293 8.743 -1.372 1.00 3.11 H new ATOM 0 HD13 ILE A 92 -1.017 7.518 -1.183 1.00 3.11 H new ATOM 1428 N LEU A 93 -6.354 4.908 -0.971 1.00 3.30 N ATOM 1429 CA LEU A 93 -7.270 4.248 -0.020 1.00 11.11 C ATOM 1430 C LEU A 93 -7.999 3.069 -0.690 1.00 72.05 C ATOM 1431 O LEU A 93 -8.144 2.012 -0.086 1.00 55.54 O ATOM 1432 CB LEU A 93 -8.300 5.273 0.560 1.00 41.11 C ATOM 1433 CG LEU A 93 -7.730 6.346 1.548 1.00 23.10 C ATOM 1434 CD1 LEU A 93 -8.813 7.370 1.951 1.00 51.45 C ATOM 1435 CD2 LEU A 93 -7.101 5.688 2.792 1.00 13.41 C ATOM 0 H LEU A 93 -6.631 5.862 -1.203 1.00 3.30 H new ATOM 0 HA LEU A 93 -6.675 3.856 0.805 1.00 11.11 H new ATOM 0 HB2 LEU A 93 -8.772 5.792 -0.274 1.00 41.11 H new ATOM 0 HB3 LEU A 93 -9.084 4.717 1.074 1.00 41.11 H new ATOM 0 HG LEU A 93 -6.941 6.885 1.023 1.00 23.10 H new ATOM 0 HD11 LEU A 93 -8.385 8.101 2.637 1.00 51.45 H new ATOM 0 HD12 LEU A 93 -9.181 7.880 1.061 1.00 51.45 H new ATOM 0 HD13 LEU A 93 -9.639 6.853 2.440 1.00 51.45 H new ATOM 0 HD21 LEU A 93 -6.715 6.461 3.457 1.00 13.41 H new ATOM 0 HD22 LEU A 93 -7.857 5.103 3.316 1.00 13.41 H new ATOM 0 HD23 LEU A 93 -6.285 5.034 2.484 1.00 13.41 H new ATOM 1447 N ALA A 94 -8.430 3.274 -1.950 1.00 52.21 N ATOM 1448 CA ALA A 94 -9.147 2.254 -2.740 1.00 22.31 C ATOM 1449 C ALA A 94 -8.198 1.149 -3.241 1.00 42.35 C ATOM 1450 O ALA A 94 -8.602 -0.006 -3.372 1.00 23.30 O ATOM 1451 CB ALA A 94 -9.871 2.920 -3.913 1.00 21.33 C ATOM 0 H ALA A 94 -8.291 4.153 -2.449 1.00 52.21 H new ATOM 0 HA ALA A 94 -9.881 1.777 -2.091 1.00 22.31 H new ATOM 0 HB1 ALA A 94 -10.398 2.162 -4.493 1.00 21.33 H new ATOM 0 HB2 ALA A 94 -10.586 3.649 -3.532 1.00 21.33 H new ATOM 0 HB3 ALA A 94 -9.144 3.424 -4.550 1.00 21.33 H new ATOM 1457 N ALA A 95 -6.935 1.522 -3.523 1.00 22.24 N ATOM 1458 CA ALA A 95 -5.897 0.572 -3.970 1.00 22.20 C ATOM 1459 C ALA A 95 -5.425 -0.313 -2.808 1.00 1.52 C ATOM 1460 O ALA A 95 -5.084 -1.468 -3.018 1.00 61.24 O ATOM 1461 CB ALA A 95 -4.710 1.313 -4.591 1.00 70.35 C ATOM 0 H ALA A 95 -6.606 2.485 -3.448 1.00 22.24 H new ATOM 0 HA ALA A 95 -6.339 -0.070 -4.732 1.00 22.20 H new ATOM 0 HB1 ALA A 95 -3.959 0.592 -4.912 1.00 70.35 H new ATOM 0 HB2 ALA A 95 -5.051 1.890 -5.451 1.00 70.35 H new ATOM 0 HB3 ALA A 95 -4.274 1.986 -3.852 1.00 70.35 H new ATOM 1467 N ASN A 96 -5.383 0.264 -1.590 1.00 52.53 N ATOM 1468 CA ASN A 96 -5.054 -0.475 -0.351 1.00 20.43 C ATOM 1469 C ASN A 96 -6.268 -1.321 0.103 1.00 3.04 C ATOM 1470 O ASN A 96 -6.105 -2.448 0.584 1.00 64.44 O ATOM 1471 CB ASN A 96 -4.595 0.528 0.758 1.00 35.24 C ATOM 1472 CG ASN A 96 -4.059 -0.129 2.046 1.00 10.01 C ATOM 1473 OD1 ASN A 96 -3.565 -1.256 2.037 1.00 32.15 O ATOM 1474 ND2 ASN A 96 -4.110 0.594 3.159 1.00 74.22 N ATOM 0 H ASN A 96 -5.576 1.254 -1.436 1.00 52.53 H new ATOM 0 HA ASN A 96 -4.229 -1.162 -0.542 1.00 20.43 H new ATOM 0 HB2 ASN A 96 -3.818 1.172 0.346 1.00 35.24 H new ATOM 0 HB3 ASN A 96 -5.437 1.170 1.018 1.00 35.24 H new ATOM 0 HD21 ASN A 96 -3.735 0.217 4.030 1.00 74.22 H new ATOM 0 HD22 ASN A 96 -4.524 1.526 3.143 1.00 74.22 H new ATOM 1481 N TYR A 97 -7.488 -0.779 -0.104 1.00 34.14 N ATOM 1482 CA TYR A 97 -8.761 -1.465 0.238 1.00 64.55 C ATOM 1483 C TYR A 97 -8.951 -2.729 -0.620 1.00 61.24 C ATOM 1484 O TYR A 97 -9.327 -3.783 -0.103 1.00 42.50 O ATOM 1485 CB TYR A 97 -9.976 -0.501 0.049 1.00 25.54 C ATOM 1486 CG TYR A 97 -11.363 -1.155 0.211 1.00 70.50 C ATOM 1487 CD1 TYR A 97 -12.292 -1.185 -0.839 1.00 64.42 C ATOM 1488 CD2 TYR A 97 -11.732 -1.766 1.414 1.00 33.15 C ATOM 1489 CE1 TYR A 97 -13.522 -1.801 -0.693 1.00 45.21 C ATOM 1490 CE2 TYR A 97 -12.962 -2.377 1.560 1.00 41.25 C ATOM 1491 CZ TYR A 97 -13.852 -2.393 0.507 1.00 54.03 C ATOM 1492 OH TYR A 97 -15.071 -3.014 0.653 1.00 50.40 O ATOM 0 H TYR A 97 -7.622 0.146 -0.513 1.00 34.14 H new ATOM 0 HA TYR A 97 -8.710 -1.762 1.286 1.00 64.55 H new ATOM 0 HB2 TYR A 97 -9.889 0.313 0.769 1.00 25.54 H new ATOM 0 HB3 TYR A 97 -9.915 -0.056 -0.944 1.00 25.54 H new ATOM 0 HD1 TYR A 97 -12.042 -0.718 -1.780 1.00 64.42 H new ATOM 0 HD2 TYR A 97 -11.042 -1.760 2.245 1.00 33.15 H new ATOM 0 HE1 TYR A 97 -14.221 -1.818 -1.516 1.00 45.21 H new ATOM 0 HE2 TYR A 97 -13.227 -2.842 2.498 1.00 41.25 H new ATOM 0 HH TYR A 97 -15.145 -3.381 1.559 1.00 50.40 H new ATOM 1502 N LEU A 98 -8.703 -2.591 -1.931 1.00 11.51 N ATOM 1503 CA LEU A 98 -8.818 -3.694 -2.902 1.00 10.35 C ATOM 1504 C LEU A 98 -7.497 -4.477 -3.012 1.00 4.34 C ATOM 1505 O LEU A 98 -7.450 -5.537 -3.655 1.00 53.14 O ATOM 1506 CB LEU A 98 -9.246 -3.133 -4.281 1.00 24.03 C ATOM 1507 CG LEU A 98 -10.651 -2.451 -4.332 1.00 11.13 C ATOM 1508 CD1 LEU A 98 -10.978 -1.952 -5.754 1.00 60.43 C ATOM 1509 CD2 LEU A 98 -11.752 -3.391 -3.799 1.00 71.14 C ATOM 0 H LEU A 98 -8.415 -1.707 -2.351 1.00 11.51 H new ATOM 0 HA LEU A 98 -9.581 -4.390 -2.552 1.00 10.35 H new ATOM 0 HB2 LEU A 98 -8.499 -2.408 -4.605 1.00 24.03 H new ATOM 0 HB3 LEU A 98 -9.233 -3.949 -5.004 1.00 24.03 H new ATOM 0 HG LEU A 98 -10.619 -1.581 -3.676 1.00 11.13 H new ATOM 0 HD11 LEU A 98 -11.962 -1.482 -5.758 1.00 60.43 H new ATOM 0 HD12 LEU A 98 -10.228 -1.225 -6.066 1.00 60.43 H new ATOM 0 HD13 LEU A 98 -10.976 -2.795 -6.445 1.00 60.43 H new ATOM 0 HD21 LEU A 98 -12.717 -2.886 -3.848 1.00 71.14 H new ATOM 0 HD22 LEU A 98 -11.784 -4.295 -4.407 1.00 71.14 H new ATOM 0 HD23 LEU A 98 -11.534 -3.657 -2.765 1.00 71.14 H new ATOM 1521 N ASP A 99 -6.442 -3.931 -2.373 1.00 11.31 N ATOM 1522 CA ASP A 99 -5.091 -4.524 -2.303 1.00 2.30 C ATOM 1523 C ASP A 99 -4.481 -4.693 -3.719 1.00 72.23 C ATOM 1524 O ASP A 99 -3.708 -5.622 -3.985 1.00 15.41 O ATOM 1525 CB ASP A 99 -5.122 -5.846 -1.479 1.00 43.13 C ATOM 1526 CG ASP A 99 -3.753 -6.340 -0.965 1.00 13.00 C ATOM 1527 OD1 ASP A 99 -3.654 -7.522 -0.580 1.00 53.12 O ATOM 1528 OD2 ASP A 99 -2.793 -5.548 -0.877 1.00 51.43 O ATOM 0 H ASP A 99 -6.508 -3.042 -1.878 1.00 11.31 H new ATOM 0 HA ASP A 99 -4.426 -3.841 -1.773 1.00 2.30 H new ATOM 0 HB2 ASP A 99 -5.783 -5.705 -0.623 1.00 43.13 H new ATOM 0 HB3 ASP A 99 -5.563 -6.629 -2.097 1.00 43.13 H new ATOM 1533 N ILE A 100 -4.843 -3.759 -4.629 1.00 12.52 N ATOM 1534 CA ILE A 100 -4.233 -3.654 -5.962 1.00 64.15 C ATOM 1535 C ILE A 100 -2.904 -2.899 -5.813 1.00 0.23 C ATOM 1536 O ILE A 100 -2.835 -1.677 -5.976 1.00 72.52 O ATOM 1537 CB ILE A 100 -5.165 -2.940 -7.021 1.00 2.13 C ATOM 1538 CG1 ILE A 100 -6.590 -3.569 -6.993 1.00 34.32 C ATOM 1539 CG2 ILE A 100 -4.544 -3.016 -8.445 1.00 33.15 C ATOM 1540 CD1 ILE A 100 -7.579 -3.002 -7.997 1.00 20.30 C ATOM 0 H ILE A 100 -5.566 -3.061 -4.454 1.00 12.52 H new ATOM 0 HA ILE A 100 -4.072 -4.661 -6.348 1.00 64.15 H new ATOM 0 HB ILE A 100 -5.251 -1.886 -6.756 1.00 2.13 H new ATOM 0 HG12 ILE A 100 -6.498 -4.641 -7.167 1.00 34.32 H new ATOM 0 HG13 ILE A 100 -7.003 -3.443 -5.992 1.00 34.32 H new ATOM 0 HG21 ILE A 100 -5.203 -2.518 -9.156 1.00 33.15 H new ATOM 0 HG22 ILE A 100 -3.572 -2.523 -8.445 1.00 33.15 H new ATOM 0 HG23 ILE A 100 -4.421 -4.060 -8.733 1.00 33.15 H new ATOM 0 HD11 ILE A 100 -8.537 -3.511 -7.891 1.00 20.30 H new ATOM 0 HD12 ILE A 100 -7.712 -1.936 -7.814 1.00 20.30 H new ATOM 0 HD13 ILE A 100 -7.198 -3.152 -9.007 1.00 20.30 H new ATOM 1552 N LYS A 101 -1.877 -3.660 -5.415 1.00 61.40 N ATOM 1553 CA LYS A 101 -0.509 -3.160 -5.206 1.00 32.25 C ATOM 1554 C LYS A 101 0.169 -2.620 -6.507 1.00 61.34 C ATOM 1555 O LYS A 101 0.978 -1.692 -6.392 1.00 44.44 O ATOM 1556 CB LYS A 101 0.355 -4.252 -4.550 1.00 12.20 C ATOM 1557 CG LYS A 101 -0.157 -4.721 -3.168 1.00 30.33 C ATOM 1558 CD LYS A 101 0.779 -5.773 -2.536 1.00 41.13 C ATOM 1559 CE LYS A 101 2.189 -5.212 -2.282 1.00 71.15 C ATOM 1560 NZ LYS A 101 3.146 -6.265 -1.873 1.00 3.55 N ATOM 0 H LYS A 101 -1.973 -4.658 -5.225 1.00 61.40 H new ATOM 0 HA LYS A 101 -0.589 -2.302 -4.538 1.00 32.25 H new ATOM 0 HB2 LYS A 101 0.403 -5.112 -5.218 1.00 12.20 H new ATOM 0 HB3 LYS A 101 1.373 -3.877 -4.440 1.00 12.20 H new ATOM 0 HG2 LYS A 101 -0.242 -3.863 -2.501 1.00 30.33 H new ATOM 0 HG3 LYS A 101 -1.157 -5.142 -3.275 1.00 30.33 H new ATOM 0 HD2 LYS A 101 0.352 -6.120 -1.595 1.00 41.13 H new ATOM 0 HD3 LYS A 101 0.847 -6.640 -3.194 1.00 41.13 H new ATOM 0 HE2 LYS A 101 2.553 -4.725 -3.187 1.00 71.15 H new ATOM 0 HE3 LYS A 101 2.140 -4.448 -1.506 1.00 71.15 H new ATOM 0 HZ1 LYS A 101 3.998 -5.823 -1.472 1.00 3.55 H new ATOM 0 HZ2 LYS A 101 2.704 -6.877 -1.158 1.00 3.55 H new ATOM 0 HZ3 LYS A 101 3.410 -6.835 -2.702 1.00 3.55 H new ATOM 1574 N PRO A 102 -0.093 -3.204 -7.750 1.00 20.43 N ATOM 1575 CA PRO A 102 0.289 -2.544 -9.037 1.00 34.42 C ATOM 1576 C PRO A 102 -0.134 -1.054 -9.111 1.00 63.01 C ATOM 1577 O PRO A 102 0.699 -0.188 -9.388 1.00 52.52 O ATOM 1578 CB PRO A 102 -0.452 -3.396 -10.098 1.00 21.42 C ATOM 1579 CG PRO A 102 -0.475 -4.777 -9.512 1.00 60.43 C ATOM 1580 CD PRO A 102 -0.647 -4.578 -8.015 1.00 61.15 C ATOM 0 HA PRO A 102 1.370 -2.512 -9.174 1.00 34.42 H new ATOM 0 HB2 PRO A 102 -1.460 -3.022 -10.275 1.00 21.42 H new ATOM 0 HB3 PRO A 102 0.068 -3.379 -11.056 1.00 21.42 H new ATOM 0 HG2 PRO A 102 -1.293 -5.366 -9.926 1.00 60.43 H new ATOM 0 HG3 PRO A 102 0.448 -5.313 -9.734 1.00 60.43 H new ATOM 0 HD2 PRO A 102 -1.695 -4.646 -7.724 1.00 61.15 H new ATOM 0 HD3 PRO A 102 -0.109 -5.339 -7.449 1.00 61.15 H new ATOM 1588 N LEU A 103 -1.430 -0.774 -8.839 1.00 52.22 N ATOM 1589 CA LEU A 103 -1.980 0.604 -8.863 1.00 12.13 C ATOM 1590 C LEU A 103 -1.395 1.430 -7.705 1.00 24.20 C ATOM 1591 O LEU A 103 -1.013 2.589 -7.905 1.00 41.42 O ATOM 1592 CB LEU A 103 -3.536 0.566 -8.807 1.00 1.23 C ATOM 1593 CG LEU A 103 -4.315 1.891 -9.183 1.00 54.22 C ATOM 1594 CD1 LEU A 103 -5.740 1.572 -9.663 1.00 43.13 C ATOM 1595 CD2 LEU A 103 -4.372 2.911 -8.021 1.00 3.24 C ATOM 0 H LEU A 103 -2.118 -1.488 -8.599 1.00 52.22 H new ATOM 0 HA LEU A 103 -1.692 1.087 -9.797 1.00 12.13 H new ATOM 0 HB2 LEU A 103 -3.877 -0.225 -9.475 1.00 1.23 H new ATOM 0 HB3 LEU A 103 -3.829 0.279 -7.797 1.00 1.23 H new ATOM 0 HG LEU A 103 -3.750 2.353 -9.993 1.00 54.22 H new ATOM 0 HD11 LEU A 103 -6.255 2.499 -9.915 1.00 43.13 H new ATOM 0 HD12 LEU A 103 -5.692 0.932 -10.544 1.00 43.13 H new ATOM 0 HD13 LEU A 103 -6.285 1.059 -8.870 1.00 43.13 H new ATOM 0 HD21 LEU A 103 -4.919 3.798 -8.342 1.00 3.24 H new ATOM 0 HD22 LEU A 103 -4.878 2.461 -7.167 1.00 3.24 H new ATOM 0 HD23 LEU A 103 -3.359 3.194 -7.735 1.00 3.24 H new ATOM 1607 N LEU A 104 -1.321 0.807 -6.508 1.00 4.53 N ATOM 1608 CA LEU A 104 -0.828 1.449 -5.268 1.00 33.15 C ATOM 1609 C LEU A 104 0.572 2.054 -5.470 1.00 60.14 C ATOM 1610 O LEU A 104 0.788 3.225 -5.166 1.00 24.44 O ATOM 1611 CB LEU A 104 -0.798 0.410 -4.110 1.00 64.32 C ATOM 1612 CG LEU A 104 -0.195 0.880 -2.742 1.00 23.30 C ATOM 1613 CD1 LEU A 104 -1.030 2.011 -2.109 1.00 64.24 C ATOM 1614 CD2 LEU A 104 -0.026 -0.313 -1.776 1.00 63.34 C ATOM 0 H LEU A 104 -1.604 -0.164 -6.374 1.00 4.53 H new ATOM 0 HA LEU A 104 -1.510 2.259 -5.011 1.00 33.15 H new ATOM 0 HB2 LEU A 104 -1.819 0.074 -3.931 1.00 64.32 H new ATOM 0 HB3 LEU A 104 -0.231 -0.457 -4.449 1.00 64.32 H new ATOM 0 HG LEU A 104 0.795 1.291 -2.940 1.00 23.30 H new ATOM 0 HD11 LEU A 104 -0.580 2.309 -1.162 1.00 64.24 H new ATOM 0 HD12 LEU A 104 -1.055 2.866 -2.784 1.00 64.24 H new ATOM 0 HD13 LEU A 104 -2.046 1.658 -1.932 1.00 64.24 H new ATOM 0 HD21 LEU A 104 0.394 0.039 -0.834 1.00 63.34 H new ATOM 0 HD22 LEU A 104 -0.997 -0.772 -1.591 1.00 63.34 H new ATOM 0 HD23 LEU A 104 0.645 -1.049 -2.220 1.00 63.34 H new ATOM 1626 N ASP A 105 1.483 1.242 -6.039 1.00 61.40 N ATOM 1627 CA ASP A 105 2.892 1.619 -6.261 1.00 21.32 C ATOM 1628 C ASP A 105 3.017 2.768 -7.276 1.00 32.13 C ATOM 1629 O ASP A 105 3.829 3.672 -7.086 1.00 14.55 O ATOM 1630 CB ASP A 105 3.716 0.388 -6.725 1.00 60.13 C ATOM 1631 CG ASP A 105 5.224 0.704 -6.854 1.00 54.15 C ATOM 1632 OD1 ASP A 105 5.910 0.792 -5.812 1.00 23.23 O ATOM 1633 OD2 ASP A 105 5.724 0.889 -7.994 1.00 2.21 O ATOM 0 H ASP A 105 1.261 0.300 -6.360 1.00 61.40 H new ATOM 0 HA ASP A 105 3.295 1.973 -5.312 1.00 21.32 H new ATOM 0 HB2 ASP A 105 3.578 -0.427 -6.015 1.00 60.13 H new ATOM 0 HB3 ASP A 105 3.336 0.041 -7.686 1.00 60.13 H new ATOM 1638 N VAL A 106 2.197 2.729 -8.339 1.00 23.50 N ATOM 1639 CA VAL A 106 2.173 3.775 -9.382 1.00 43.24 C ATOM 1640 C VAL A 106 1.662 5.123 -8.813 1.00 3.51 C ATOM 1641 O VAL A 106 2.224 6.176 -9.122 1.00 41.04 O ATOM 1642 CB VAL A 106 1.308 3.302 -10.612 1.00 0.41 C ATOM 1643 CG1 VAL A 106 1.094 4.420 -11.663 1.00 50.44 C ATOM 1644 CG2 VAL A 106 1.958 2.056 -11.261 1.00 24.13 C ATOM 0 H VAL A 106 1.532 1.973 -8.502 1.00 23.50 H new ATOM 0 HA VAL A 106 3.193 3.939 -9.729 1.00 43.24 H new ATOM 0 HB VAL A 106 0.319 3.044 -10.234 1.00 0.41 H new ATOM 0 HG11 VAL A 106 0.492 4.035 -12.486 1.00 50.44 H new ATOM 0 HG12 VAL A 106 0.579 5.262 -11.199 1.00 50.44 H new ATOM 0 HG13 VAL A 106 2.060 4.751 -12.044 1.00 50.44 H new ATOM 0 HG21 VAL A 106 1.357 1.733 -12.111 1.00 24.13 H new ATOM 0 HG22 VAL A 106 2.963 2.306 -11.602 1.00 24.13 H new ATOM 0 HG23 VAL A 106 2.013 1.251 -10.528 1.00 24.13 H new ATOM 1654 N THR A 107 0.620 5.071 -7.965 1.00 41.23 N ATOM 1655 CA THR A 107 0.079 6.268 -7.280 1.00 70.45 C ATOM 1656 C THR A 107 1.064 6.767 -6.190 1.00 20.35 C ATOM 1657 O THR A 107 1.143 7.971 -5.905 1.00 3.04 O ATOM 1658 CB THR A 107 -1.337 5.976 -6.676 1.00 64.32 C ATOM 1659 OG1 THR A 107 -2.154 5.357 -7.681 1.00 3.14 O ATOM 1660 CG2 THR A 107 -2.052 7.254 -6.187 1.00 54.34 C ATOM 0 H THR A 107 0.129 4.207 -7.733 1.00 41.23 H new ATOM 0 HA THR A 107 -0.035 7.062 -8.018 1.00 70.45 H new ATOM 0 HB THR A 107 -1.193 5.323 -5.815 1.00 64.32 H new ATOM 0 HG1 THR A 107 -1.784 4.478 -7.907 1.00 3.14 H new ATOM 0 HG21 THR A 107 -3.028 6.991 -5.779 1.00 54.34 H new ATOM 0 HG22 THR A 107 -1.452 7.733 -5.413 1.00 54.34 H new ATOM 0 HG23 THR A 107 -2.182 7.941 -7.023 1.00 54.34 H new ATOM 1668 N CYS A 108 1.835 5.821 -5.612 1.00 43.22 N ATOM 1669 CA CYS A 108 2.927 6.131 -4.671 1.00 41.00 C ATOM 1670 C CYS A 108 4.087 6.839 -5.402 1.00 63.10 C ATOM 1671 O CYS A 108 4.768 7.678 -4.815 1.00 74.33 O ATOM 1672 CB CYS A 108 3.425 4.855 -3.956 1.00 20.24 C ATOM 1673 SG CYS A 108 2.219 4.119 -2.827 1.00 52.44 S ATOM 0 H CYS A 108 1.716 4.823 -5.786 1.00 43.22 H new ATOM 0 HA CYS A 108 2.536 6.807 -3.911 1.00 41.00 H new ATOM 0 HB2 CYS A 108 3.701 4.115 -4.707 1.00 20.24 H new ATOM 0 HB3 CYS A 108 4.330 5.095 -3.397 1.00 20.24 H new ATOM 0 HG CYS A 108 1.279 3.539 -3.513 1.00 52.44 H new ATOM 1679 N LYS A 109 4.297 6.496 -6.691 1.00 51.35 N ATOM 1680 CA LYS A 109 5.256 7.203 -7.564 1.00 14.04 C ATOM 1681 C LYS A 109 4.734 8.617 -7.885 1.00 63.02 C ATOM 1682 O LYS A 109 5.511 9.564 -7.881 1.00 55.52 O ATOM 1683 CB LYS A 109 5.547 6.396 -8.883 1.00 34.23 C ATOM 1684 CG LYS A 109 6.843 5.541 -8.870 1.00 71.21 C ATOM 1685 CD LYS A 109 6.854 4.439 -7.786 1.00 32.21 C ATOM 1686 CE LYS A 109 8.129 3.581 -7.839 1.00 31.10 C ATOM 1687 NZ LYS A 109 8.107 2.484 -6.834 1.00 74.50 N ATOM 0 H LYS A 109 3.810 5.727 -7.152 1.00 51.35 H new ATOM 0 HA LYS A 109 6.201 7.290 -7.028 1.00 14.04 H new ATOM 0 HB2 LYS A 109 4.700 5.738 -9.080 1.00 34.23 H new ATOM 0 HB3 LYS A 109 5.605 7.099 -9.714 1.00 34.23 H new ATOM 0 HG2 LYS A 109 6.970 5.077 -9.848 1.00 71.21 H new ATOM 0 HG3 LYS A 109 7.699 6.198 -8.715 1.00 71.21 H new ATOM 0 HD2 LYS A 109 6.769 4.900 -6.802 1.00 32.21 H new ATOM 0 HD3 LYS A 109 5.982 3.798 -7.914 1.00 32.21 H new ATOM 0 HE2 LYS A 109 8.238 3.156 -8.837 1.00 31.10 H new ATOM 0 HE3 LYS A 109 8.999 4.214 -7.665 1.00 31.10 H new ATOM 0 HZ1 LYS A 109 8.779 2.699 -6.070 1.00 74.50 H new ATOM 0 HZ2 LYS A 109 7.150 2.396 -6.438 1.00 74.50 H new ATOM 0 HZ3 LYS A 109 8.377 1.589 -7.291 1.00 74.50 H new ATOM 1701 N THR A 110 3.413 8.735 -8.140 1.00 44.34 N ATOM 1702 CA THR A 110 2.753 10.018 -8.472 1.00 73.02 C ATOM 1703 C THR A 110 2.903 11.051 -7.328 1.00 41.34 C ATOM 1704 O THR A 110 3.279 12.206 -7.575 1.00 20.13 O ATOM 1705 CB THR A 110 1.235 9.793 -8.802 1.00 74.33 C ATOM 1706 OG1 THR A 110 1.115 8.807 -9.839 1.00 75.30 O ATOM 1707 CG2 THR A 110 0.518 11.087 -9.257 1.00 42.41 C ATOM 0 H THR A 110 2.772 7.942 -8.122 1.00 44.34 H new ATOM 0 HA THR A 110 3.251 10.420 -9.355 1.00 73.02 H new ATOM 0 HB THR A 110 0.755 9.459 -7.882 1.00 74.33 H new ATOM 0 HG1 THR A 110 1.416 7.938 -9.501 1.00 75.30 H new ATOM 0 HG21 THR A 110 -0.528 10.867 -9.471 1.00 42.41 H new ATOM 0 HG22 THR A 110 0.578 11.834 -8.465 1.00 42.41 H new ATOM 0 HG23 THR A 110 0.999 11.472 -10.156 1.00 42.41 H new ATOM 1715 N VAL A 111 2.639 10.615 -6.079 1.00 43.41 N ATOM 1716 CA VAL A 111 2.778 11.477 -4.887 1.00 15.10 C ATOM 1717 C VAL A 111 4.265 11.786 -4.597 1.00 1.43 C ATOM 1718 O VAL A 111 4.601 12.894 -4.148 1.00 22.14 O ATOM 1719 CB VAL A 111 2.074 10.864 -3.617 1.00 12.42 C ATOM 1720 CG1 VAL A 111 0.550 10.701 -3.836 1.00 44.21 C ATOM 1721 CG2 VAL A 111 2.709 9.525 -3.187 1.00 70.15 C ATOM 0 H VAL A 111 2.327 9.667 -5.869 1.00 43.41 H new ATOM 0 HA VAL A 111 2.268 12.413 -5.113 1.00 15.10 H new ATOM 0 HB VAL A 111 2.227 11.574 -2.804 1.00 12.42 H new ATOM 0 HG11 VAL A 111 0.097 10.276 -2.940 1.00 44.21 H new ATOM 0 HG12 VAL A 111 0.105 11.675 -4.040 1.00 44.21 H new ATOM 0 HG13 VAL A 111 0.373 10.037 -4.682 1.00 44.21 H new ATOM 0 HG21 VAL A 111 2.190 9.142 -2.308 1.00 70.15 H new ATOM 0 HG22 VAL A 111 2.625 8.805 -4.001 1.00 70.15 H new ATOM 0 HG23 VAL A 111 3.761 9.681 -2.948 1.00 70.15 H new ATOM 1731 N ALA A 112 5.148 10.804 -4.893 1.00 5.04 N ATOM 1732 CA ALA A 112 6.606 10.958 -4.752 1.00 22.21 C ATOM 1733 C ALA A 112 7.163 11.953 -5.787 1.00 54.11 C ATOM 1734 O ALA A 112 8.128 12.659 -5.510 1.00 15.24 O ATOM 1735 CB ALA A 112 7.308 9.601 -4.879 1.00 22.53 C ATOM 0 H ALA A 112 4.865 9.886 -5.235 1.00 5.04 H new ATOM 0 HA ALA A 112 6.805 11.359 -3.758 1.00 22.21 H new ATOM 0 HB1 ALA A 112 8.384 9.737 -4.772 1.00 22.53 H new ATOM 0 HB2 ALA A 112 6.947 8.930 -4.099 1.00 22.53 H new ATOM 0 HB3 ALA A 112 7.092 9.170 -5.857 1.00 22.53 H new ATOM 1741 N ASN A 113 6.522 12.007 -6.974 1.00 21.32 N ATOM 1742 CA ASN A 113 6.909 12.926 -8.068 1.00 3.23 C ATOM 1743 C ASN A 113 6.637 14.386 -7.681 1.00 30.50 C ATOM 1744 O ASN A 113 7.415 15.279 -8.030 1.00 14.21 O ATOM 1745 CB ASN A 113 6.159 12.577 -9.392 1.00 61.32 C ATOM 1746 CG ASN A 113 6.683 11.322 -10.097 1.00 13.04 C ATOM 1747 OD1 ASN A 113 7.869 10.999 -10.036 1.00 24.33 O ATOM 1748 ND2 ASN A 113 5.794 10.600 -10.770 1.00 53.21 N ATOM 0 H ASN A 113 5.723 11.416 -7.202 1.00 21.32 H new ATOM 0 HA ASN A 113 7.979 12.802 -8.235 1.00 3.23 H new ATOM 0 HB2 ASN A 113 5.100 12.441 -9.172 1.00 61.32 H new ATOM 0 HB3 ASN A 113 6.237 13.423 -10.075 1.00 61.32 H new ATOM 0 HD21 ASN A 113 6.088 9.752 -11.255 1.00 53.21 H new ATOM 0 HD22 ASN A 113 4.818 10.894 -10.802 1.00 53.21 H new ATOM 1755 N MET A 114 5.528 14.611 -6.943 1.00 54.33 N ATOM 1756 CA MET A 114 5.126 15.960 -6.488 1.00 33.34 C ATOM 1757 C MET A 114 6.191 16.557 -5.546 1.00 63.23 C ATOM 1758 O MET A 114 6.588 17.715 -5.688 1.00 10.44 O ATOM 1759 CB MET A 114 3.749 15.933 -5.763 1.00 3.14 C ATOM 1760 CG MET A 114 2.583 15.379 -6.592 1.00 73.41 C ATOM 1761 SD MET A 114 0.974 15.630 -5.794 1.00 4.43 S ATOM 1762 CE MET A 114 1.189 14.878 -4.172 1.00 71.24 C ATOM 0 H MET A 114 4.892 13.870 -6.648 1.00 54.33 H new ATOM 0 HA MET A 114 5.036 16.586 -7.376 1.00 33.34 H new ATOM 0 HB2 MET A 114 3.846 15.335 -4.857 1.00 3.14 H new ATOM 0 HB3 MET A 114 3.501 16.947 -5.450 1.00 3.14 H new ATOM 0 HG2 MET A 114 2.578 15.860 -7.570 1.00 73.41 H new ATOM 0 HG3 MET A 114 2.737 14.313 -6.762 1.00 73.41 H new ATOM 0 HE1 MET A 114 0.361 14.197 -3.974 1.00 71.24 H new ATOM 0 HE2 MET A 114 2.128 14.325 -4.149 1.00 71.24 H new ATOM 0 HE3 MET A 114 1.208 15.657 -3.410 1.00 71.24 H new ATOM 1772 N ILE A 115 6.661 15.731 -4.603 1.00 42.12 N ATOM 1773 CA ILE A 115 7.618 16.156 -3.559 1.00 25.23 C ATOM 1774 C ILE A 115 9.085 16.045 -4.034 1.00 12.41 C ATOM 1775 O ILE A 115 9.994 16.556 -3.368 1.00 11.42 O ATOM 1776 CB ILE A 115 7.417 15.305 -2.254 1.00 4.24 C ATOM 1777 CG1 ILE A 115 7.742 13.801 -2.519 1.00 44.34 C ATOM 1778 CG2 ILE A 115 5.979 15.479 -1.707 1.00 54.32 C ATOM 1779 CD1 ILE A 115 7.656 12.886 -1.312 1.00 42.35 C ATOM 0 H ILE A 115 6.392 14.749 -4.537 1.00 42.12 H new ATOM 0 HA ILE A 115 7.416 17.206 -3.346 1.00 25.23 H new ATOM 0 HB ILE A 115 8.111 15.667 -1.496 1.00 4.24 H new ATOM 0 HG12 ILE A 115 7.058 13.430 -3.283 1.00 44.34 H new ATOM 0 HG13 ILE A 115 8.748 13.733 -2.932 1.00 44.34 H new ATOM 0 HG21 ILE A 115 5.859 14.882 -0.803 1.00 54.32 H new ATOM 0 HG22 ILE A 115 5.803 16.529 -1.474 1.00 54.32 H new ATOM 0 HG23 ILE A 115 5.262 15.148 -2.458 1.00 54.32 H new ATOM 0 HD11 ILE A 115 7.901 11.867 -1.610 1.00 42.35 H new ATOM 0 HD12 ILE A 115 8.361 13.221 -0.551 1.00 42.35 H new ATOM 0 HD13 ILE A 115 6.645 12.912 -0.907 1.00 42.35 H new ATOM 1791 N ARG A 116 9.290 15.371 -5.188 1.00 71.21 N ATOM 1792 CA ARG A 116 10.630 15.096 -5.745 1.00 13.23 C ATOM 1793 C ARG A 116 11.330 16.400 -6.168 1.00 11.52 C ATOM 1794 O ARG A 116 12.528 16.574 -5.923 1.00 11.52 O ATOM 1795 CB ARG A 116 10.517 14.108 -6.943 1.00 62.44 C ATOM 1796 CG ARG A 116 11.862 13.635 -7.537 1.00 72.44 C ATOM 1797 CD ARG A 116 11.700 12.481 -8.547 1.00 1.40 C ATOM 1798 NE ARG A 116 10.904 12.844 -9.741 1.00 4.23 N ATOM 1799 CZ ARG A 116 10.888 12.144 -10.896 1.00 71.34 C ATOM 1800 NH1 ARG A 116 11.622 11.036 -11.041 1.00 21.34 N ATOM 1801 NH2 ARG A 116 10.132 12.549 -11.912 1.00 21.25 N ATOM 0 H ARG A 116 8.529 15.003 -5.759 1.00 71.21 H new ATOM 0 HA ARG A 116 11.240 14.633 -4.970 1.00 13.23 H new ATOM 0 HB2 ARG A 116 9.954 13.233 -6.619 1.00 62.44 H new ATOM 0 HB3 ARG A 116 9.937 14.585 -7.733 1.00 62.44 H new ATOM 0 HG2 ARG A 116 12.352 14.475 -8.029 1.00 72.44 H new ATOM 0 HG3 ARG A 116 12.518 13.313 -6.728 1.00 72.44 H new ATOM 0 HD2 ARG A 116 12.687 12.148 -8.867 1.00 1.40 H new ATOM 0 HD3 ARG A 116 11.225 11.636 -8.048 1.00 1.40 H new ATOM 0 HE ARG A 116 10.326 13.683 -9.688 1.00 4.23 H new ATOM 0 HH11 ARG A 116 12.206 10.707 -10.272 1.00 21.34 H new ATOM 0 HH12 ARG A 116 11.598 10.520 -11.920 1.00 21.34 H new ATOM 0 HH21 ARG A 116 9.562 13.390 -11.820 1.00 21.25 H new ATOM 0 HH22 ARG A 116 10.122 12.019 -12.783 1.00 21.25 H new ATOM 1815 N GLY A 117 10.564 17.318 -6.779 1.00 71.13 N ATOM 1816 CA GLY A 117 11.098 18.617 -7.191 1.00 14.20 C ATOM 1817 C GLY A 117 11.751 18.551 -8.575 1.00 41.43 C ATOM 1818 O GLY A 117 11.132 18.971 -9.567 1.00 45.14 O ATOM 1819 OXT GLY A 117 12.872 18.012 -8.685 1.00 37.41 O ATOM 0 H GLY A 117 9.577 17.181 -6.996 1.00 71.13 H new ATOM 0 HA2 GLY A 117 10.294 19.353 -7.203 1.00 14.20 H new ATOM 0 HA3 GLY A 117 11.831 18.957 -6.459 1.00 14.20 H new TER 1823 GLY A 117 ATOM 1824 N SER B 2 15.494 -12.332 19.396 1.00 24.14 N ATOM 1825 CA SER B 2 16.266 -12.817 18.225 1.00 63.24 C ATOM 1826 C SER B 2 16.382 -11.697 17.183 1.00 42.14 C ATOM 1827 O SER B 2 15.364 -11.209 16.703 1.00 33.33 O ATOM 1828 CB SER B 2 15.576 -14.058 17.618 1.00 25.25 C ATOM 1829 OG SER B 2 15.479 -15.094 18.579 1.00 25.33 O ATOM 0 HA SER B 2 17.269 -13.102 18.544 1.00 63.24 H new ATOM 0 HB2 SER B 2 14.581 -13.790 17.262 1.00 25.25 H new ATOM 0 HB3 SER B 2 16.140 -14.408 16.753 1.00 25.25 H new ATOM 0 HG SER B 2 15.362 -14.704 19.470 1.00 25.33 H new ATOM 1837 N LEU B 3 17.621 -11.301 16.833 1.00 74.53 N ATOM 1838 CA LEU B 3 17.872 -10.135 15.964 1.00 64.44 C ATOM 1839 C LEU B 3 18.480 -10.569 14.621 1.00 50.54 C ATOM 1840 O LEU B 3 19.538 -11.213 14.586 1.00 24.11 O ATOM 1841 CB LEU B 3 18.820 -9.142 16.687 1.00 74.33 C ATOM 1842 CG LEU B 3 18.305 -8.575 18.046 1.00 74.05 C ATOM 1843 CD1 LEU B 3 19.436 -7.889 18.822 1.00 1.42 C ATOM 1844 CD2 LEU B 3 17.110 -7.621 17.850 1.00 54.43 C ATOM 0 H LEU B 3 18.469 -11.776 17.142 1.00 74.53 H new ATOM 0 HA LEU B 3 16.921 -9.643 15.758 1.00 64.44 H new ATOM 0 HB2 LEU B 3 19.773 -9.641 16.862 1.00 74.33 H new ATOM 0 HB3 LEU B 3 19.017 -8.305 16.017 1.00 74.33 H new ATOM 0 HG LEU B 3 17.953 -9.420 18.638 1.00 74.05 H new ATOM 0 HD11 LEU B 3 19.048 -7.503 19.765 1.00 1.42 H new ATOM 0 HD12 LEU B 3 20.229 -8.610 19.023 1.00 1.42 H new ATOM 0 HD13 LEU B 3 19.836 -7.066 18.230 1.00 1.42 H new ATOM 0 HD21 LEU B 3 16.780 -7.247 18.819 1.00 54.43 H new ATOM 0 HD22 LEU B 3 17.413 -6.783 17.222 1.00 54.43 H new ATOM 0 HD23 LEU B 3 16.291 -8.157 17.370 1.00 54.43 H new ATOM 1856 N VAL B 4 17.774 -10.251 13.523 1.00 4.54 N ATOM 1857 CA VAL B 4 18.308 -10.328 12.153 1.00 62.12 C ATOM 1858 C VAL B 4 18.723 -8.912 11.713 1.00 41.14 C ATOM 1859 O VAL B 4 18.107 -7.919 12.122 1.00 44.42 O ATOM 1860 CB VAL B 4 17.272 -10.940 11.131 1.00 20.42 C ATOM 1861 CG1 VAL B 4 16.934 -12.401 11.497 1.00 73.12 C ATOM 1862 CG2 VAL B 4 15.988 -10.080 11.023 1.00 12.05 C ATOM 0 H VAL B 4 16.807 -9.930 13.562 1.00 4.54 H new ATOM 0 HA VAL B 4 19.168 -10.998 12.156 1.00 62.12 H new ATOM 0 HB VAL B 4 17.744 -10.936 10.149 1.00 20.42 H new ATOM 0 HG11 VAL B 4 16.218 -12.800 10.778 1.00 73.12 H new ATOM 0 HG12 VAL B 4 17.844 -13.001 11.475 1.00 73.12 H new ATOM 0 HG13 VAL B 4 16.501 -12.435 12.497 1.00 73.12 H new ATOM 0 HG21 VAL B 4 15.303 -10.537 10.309 1.00 12.05 H new ATOM 0 HG22 VAL B 4 15.508 -10.019 12.000 1.00 12.05 H new ATOM 0 HG23 VAL B 4 16.249 -9.077 10.684 1.00 12.05 H new ATOM 1872 N LYS B 5 19.767 -8.822 10.888 1.00 44.03 N ATOM 1873 CA LYS B 5 20.388 -7.540 10.528 1.00 2.14 C ATOM 1874 C LYS B 5 19.799 -6.984 9.218 1.00 42.14 C ATOM 1875 O LYS B 5 19.649 -7.722 8.243 1.00 73.01 O ATOM 1876 CB LYS B 5 21.917 -7.742 10.406 1.00 55.42 C ATOM 1877 CG LYS B 5 22.597 -8.268 11.694 1.00 62.21 C ATOM 1878 CD LYS B 5 24.129 -8.413 11.540 1.00 73.24 C ATOM 1879 CE LYS B 5 24.818 -8.894 12.825 1.00 42.00 C ATOM 1880 NZ LYS B 5 26.285 -9.049 12.634 1.00 14.13 N ATOM 0 H LYS B 5 20.207 -9.631 10.450 1.00 44.03 H new ATOM 0 HA LYS B 5 20.179 -6.808 11.308 1.00 2.14 H new ATOM 0 HB2 LYS B 5 22.115 -8.441 9.593 1.00 55.42 H new ATOM 0 HB3 LYS B 5 22.376 -6.793 10.129 1.00 55.42 H new ATOM 0 HG2 LYS B 5 22.381 -7.588 12.518 1.00 62.21 H new ATOM 0 HG3 LYS B 5 22.169 -9.235 11.958 1.00 62.21 H new ATOM 0 HD2 LYS B 5 24.343 -9.116 10.735 1.00 73.24 H new ATOM 0 HD3 LYS B 5 24.552 -7.452 11.245 1.00 73.24 H new ATOM 0 HE2 LYS B 5 24.628 -8.182 13.629 1.00 42.00 H new ATOM 0 HE3 LYS B 5 24.388 -9.847 13.135 1.00 42.00 H new ATOM 0 HZ1 LYS B 5 26.718 -9.375 13.522 1.00 14.13 H new ATOM 0 HZ2 LYS B 5 26.466 -9.746 11.884 1.00 14.13 H new ATOM 0 HZ3 LYS B 5 26.698 -8.134 12.363 1.00 14.13 H new ATOM 1894 N LEU B 6 19.445 -5.683 9.223 1.00 75.42 N ATOM 1895 CA LEU B 6 18.954 -4.955 8.030 1.00 53.05 C ATOM 1896 C LEU B 6 19.855 -3.743 7.763 1.00 0.03 C ATOM 1897 O LEU B 6 19.812 -2.761 8.508 1.00 34.03 O ATOM 1898 CB LEU B 6 17.486 -4.472 8.226 1.00 63.14 C ATOM 1899 CG LEU B 6 16.411 -5.576 8.444 1.00 2.22 C ATOM 1900 CD1 LEU B 6 15.029 -4.945 8.661 1.00 61.35 C ATOM 1901 CD2 LEU B 6 16.384 -6.590 7.278 1.00 40.44 C ATOM 0 H LEU B 6 19.491 -5.102 10.060 1.00 75.42 H new ATOM 0 HA LEU B 6 18.980 -5.638 7.181 1.00 53.05 H new ATOM 0 HB2 LEU B 6 17.461 -3.798 9.083 1.00 63.14 H new ATOM 0 HB3 LEU B 6 17.201 -3.887 7.352 1.00 63.14 H new ATOM 0 HG LEU B 6 16.682 -6.130 9.343 1.00 2.22 H new ATOM 0 HD11 LEU B 6 14.290 -5.731 8.812 1.00 61.35 H new ATOM 0 HD12 LEU B 6 15.057 -4.300 9.539 1.00 61.35 H new ATOM 0 HD13 LEU B 6 14.757 -4.354 7.786 1.00 61.35 H new ATOM 0 HD21 LEU B 6 15.620 -7.344 7.469 1.00 40.44 H new ATOM 0 HD22 LEU B 6 16.155 -6.069 6.348 1.00 40.44 H new ATOM 0 HD23 LEU B 6 17.357 -7.073 7.193 1.00 40.44 H new ATOM 1913 N GLU B 7 20.672 -3.813 6.704 1.00 10.23 N ATOM 1914 CA GLU B 7 21.514 -2.684 6.283 1.00 22.35 C ATOM 1915 C GLU B 7 20.701 -1.743 5.390 1.00 40.12 C ATOM 1916 O GLU B 7 20.233 -2.151 4.342 1.00 5.21 O ATOM 1917 CB GLU B 7 22.806 -3.176 5.555 1.00 40.41 C ATOM 1918 CG GLU B 7 24.073 -3.078 6.421 1.00 14.34 C ATOM 1919 CD GLU B 7 25.350 -3.473 5.673 1.00 14.00 C ATOM 1920 OE1 GLU B 7 25.911 -2.624 4.949 1.00 72.40 O ATOM 1921 OE2 GLU B 7 25.805 -4.630 5.805 1.00 53.34 O ATOM 0 H GLU B 7 20.768 -4.644 6.120 1.00 10.23 H new ATOM 0 HA GLU B 7 21.836 -2.139 7.170 1.00 22.35 H new ATOM 0 HB2 GLU B 7 22.667 -4.212 5.245 1.00 40.41 H new ATOM 0 HB3 GLU B 7 22.949 -2.588 4.648 1.00 40.41 H new ATOM 0 HG2 GLU B 7 24.176 -2.057 6.788 1.00 14.34 H new ATOM 0 HG3 GLU B 7 23.958 -3.720 7.294 1.00 14.34 H new ATOM 1928 N SER B 8 20.549 -0.489 5.818 1.00 71.43 N ATOM 1929 CA SER B 8 19.872 0.562 5.031 1.00 73.32 C ATOM 1930 C SER B 8 20.765 1.055 3.871 1.00 53.23 C ATOM 1931 O SER B 8 21.880 0.555 3.674 1.00 63.53 O ATOM 1932 CB SER B 8 19.523 1.728 5.977 1.00 4.10 C ATOM 1933 OG SER B 8 20.675 2.179 6.675 1.00 41.41 O ATOM 0 H SER B 8 20.891 -0.165 6.723 1.00 71.43 H new ATOM 0 HA SER B 8 18.964 0.154 4.588 1.00 73.32 H new ATOM 0 HB2 SER B 8 19.095 2.551 5.404 1.00 4.10 H new ATOM 0 HB3 SER B 8 18.763 1.408 6.690 1.00 4.10 H new ATOM 0 HG SER B 8 21.403 2.334 6.038 1.00 41.41 H new ATOM 1939 N SER B 9 20.265 2.056 3.118 1.00 72.55 N ATOM 1940 CA SER B 9 21.026 2.732 2.046 1.00 11.31 C ATOM 1941 C SER B 9 22.301 3.427 2.604 1.00 43.23 C ATOM 1942 O SER B 9 23.263 3.664 1.871 1.00 65.23 O ATOM 1943 CB SER B 9 20.105 3.751 1.332 1.00 50.33 C ATOM 1944 OG SER B 9 20.753 4.358 0.231 1.00 74.23 O ATOM 0 H SER B 9 19.319 2.420 3.236 1.00 72.55 H new ATOM 0 HA SER B 9 21.361 1.984 1.327 1.00 11.31 H new ATOM 0 HB2 SER B 9 19.201 3.247 0.990 1.00 50.33 H new ATOM 0 HB3 SER B 9 19.794 4.519 2.040 1.00 50.33 H new ATOM 0 HG SER B 9 20.143 4.994 -0.198 1.00 74.23 H new ATOM 1950 N ASP B 10 22.284 3.733 3.916 1.00 71.32 N ATOM 1951 CA ASP B 10 23.406 4.372 4.626 1.00 43.11 C ATOM 1952 C ASP B 10 24.321 3.326 5.301 1.00 45.14 C ATOM 1953 O ASP B 10 25.146 3.696 6.145 1.00 51.34 O ATOM 1954 CB ASP B 10 22.853 5.359 5.687 1.00 53.32 C ATOM 1955 CG ASP B 10 22.020 6.487 5.069 1.00 1.41 C ATOM 1956 OD1 ASP B 10 22.539 7.598 4.895 1.00 74.30 O ATOM 1957 OD2 ASP B 10 20.833 6.267 4.768 1.00 31.13 O ATOM 0 H ASP B 10 21.483 3.541 4.517 1.00 71.32 H new ATOM 0 HA ASP B 10 24.007 4.914 3.896 1.00 43.11 H new ATOM 0 HB2 ASP B 10 22.240 4.811 6.403 1.00 53.32 H new ATOM 0 HB3 ASP B 10 23.685 5.790 6.244 1.00 53.32 H new ATOM 1962 N GLU B 11 24.155 2.022 4.937 1.00 51.14 N ATOM 1963 CA GLU B 11 24.989 0.896 5.448 1.00 60.24 C ATOM 1964 C GLU B 11 24.803 0.663 6.965 1.00 20.15 C ATOM 1965 O GLU B 11 25.585 -0.073 7.578 1.00 2.31 O ATOM 1966 CB GLU B 11 26.501 1.108 5.104 1.00 40.53 C ATOM 1967 CG GLU B 11 26.826 1.161 3.595 1.00 25.22 C ATOM 1968 CD GLU B 11 28.300 1.515 3.310 1.00 15.45 C ATOM 1969 OE1 GLU B 11 28.604 2.704 3.073 1.00 54.20 O ATOM 1970 OE2 GLU B 11 29.165 0.613 3.345 1.00 24.22 O ATOM 0 H GLU B 11 23.436 1.722 4.278 1.00 51.14 H new ATOM 0 HA GLU B 11 24.641 -0.003 4.939 1.00 60.24 H new ATOM 0 HB2 GLU B 11 26.836 2.037 5.565 1.00 40.53 H new ATOM 0 HB3 GLU B 11 27.078 0.301 5.556 1.00 40.53 H new ATOM 0 HG2 GLU B 11 26.596 0.195 3.145 1.00 25.22 H new ATOM 0 HG3 GLU B 11 26.181 1.898 3.115 1.00 25.22 H new ATOM 1977 N LYS B 12 23.753 1.269 7.556 1.00 55.13 N ATOM 1978 CA LYS B 12 23.477 1.169 9.001 1.00 41.44 C ATOM 1979 C LYS B 12 22.774 -0.162 9.303 1.00 64.11 C ATOM 1980 O LYS B 12 21.705 -0.438 8.753 1.00 13.51 O ATOM 1981 CB LYS B 12 22.607 2.364 9.472 1.00 15.12 C ATOM 1982 CG LYS B 12 23.277 3.750 9.327 1.00 63.31 C ATOM 1983 CD LYS B 12 24.552 3.899 10.190 1.00 24.23 C ATOM 1984 CE LYS B 12 25.189 5.293 10.067 1.00 72.41 C ATOM 1985 NZ LYS B 12 26.421 5.414 10.898 1.00 44.02 N ATOM 0 H LYS B 12 23.077 1.838 7.047 1.00 55.13 H new ATOM 0 HA LYS B 12 24.421 1.202 9.545 1.00 41.44 H new ATOM 0 HB2 LYS B 12 21.677 2.364 8.904 1.00 15.12 H new ATOM 0 HB3 LYS B 12 22.341 2.212 10.518 1.00 15.12 H new ATOM 0 HG2 LYS B 12 23.532 3.916 8.280 1.00 63.31 H new ATOM 0 HG3 LYS B 12 22.563 4.524 9.608 1.00 63.31 H new ATOM 0 HD2 LYS B 12 24.304 3.708 11.234 1.00 24.23 H new ATOM 0 HD3 LYS B 12 25.279 3.144 9.891 1.00 24.23 H new ATOM 0 HE2 LYS B 12 25.434 5.490 9.023 1.00 72.41 H new ATOM 0 HE3 LYS B 12 24.468 6.051 10.374 1.00 72.41 H new ATOM 0 HZ1 LYS B 12 26.821 6.368 10.789 1.00 44.02 H new ATOM 0 HZ2 LYS B 12 26.183 5.251 11.897 1.00 44.02 H new ATOM 0 HZ3 LYS B 12 27.119 4.708 10.589 1.00 44.02 H new ATOM 1999 N VAL B 13 23.395 -0.963 10.184 1.00 11.21 N ATOM 2000 CA VAL B 13 22.912 -2.298 10.562 1.00 54.33 C ATOM 2001 C VAL B 13 21.834 -2.191 11.665 1.00 52.23 C ATOM 2002 O VAL B 13 22.147 -2.081 12.860 1.00 31.02 O ATOM 2003 CB VAL B 13 24.110 -3.211 11.044 1.00 13.54 C ATOM 2004 CG1 VAL B 13 23.627 -4.618 11.464 1.00 23.21 C ATOM 2005 CG2 VAL B 13 25.207 -3.296 9.953 1.00 13.15 C ATOM 0 H VAL B 13 24.258 -0.697 10.659 1.00 11.21 H new ATOM 0 HA VAL B 13 22.463 -2.761 9.683 1.00 54.33 H new ATOM 0 HB VAL B 13 24.544 -2.746 11.929 1.00 13.54 H new ATOM 0 HG11 VAL B 13 24.480 -5.214 11.788 1.00 23.21 H new ATOM 0 HG12 VAL B 13 22.914 -4.528 12.284 1.00 23.21 H new ATOM 0 HG13 VAL B 13 23.145 -5.105 10.616 1.00 23.21 H new ATOM 0 HG21 VAL B 13 26.022 -3.929 10.305 1.00 13.15 H new ATOM 0 HG22 VAL B 13 24.783 -3.722 9.044 1.00 13.15 H new ATOM 0 HG23 VAL B 13 25.589 -2.297 9.742 1.00 13.15 H new ATOM 2015 N PHE B 14 20.564 -2.162 11.239 1.00 24.44 N ATOM 2016 CA PHE B 14 19.410 -2.229 12.143 1.00 65.44 C ATOM 2017 C PHE B 14 19.110 -3.693 12.481 1.00 64.34 C ATOM 2018 O PHE B 14 18.432 -4.396 11.720 1.00 4.04 O ATOM 2019 CB PHE B 14 18.175 -1.536 11.509 1.00 0.25 C ATOM 2020 CG PHE B 14 18.362 -0.036 11.310 1.00 32.15 C ATOM 2021 CD1 PHE B 14 18.170 0.845 12.372 1.00 54.32 C ATOM 2022 CD2 PHE B 14 18.751 0.487 10.079 1.00 15.34 C ATOM 2023 CE1 PHE B 14 18.363 2.200 12.211 1.00 0.32 C ATOM 2024 CE2 PHE B 14 18.938 1.842 9.918 1.00 64.14 C ATOM 2025 CZ PHE B 14 18.746 2.698 10.985 1.00 44.01 C ATOM 0 H PHE B 14 20.308 -2.091 10.254 1.00 24.44 H new ATOM 0 HA PHE B 14 19.646 -1.698 13.065 1.00 65.44 H new ATOM 0 HB2 PHE B 14 17.961 -2.000 10.546 1.00 0.25 H new ATOM 0 HB3 PHE B 14 17.306 -1.706 12.144 1.00 0.25 H new ATOM 0 HD1 PHE B 14 17.866 0.461 13.334 1.00 54.32 H new ATOM 0 HD2 PHE B 14 18.908 -0.177 9.242 1.00 15.34 H new ATOM 0 HE1 PHE B 14 18.214 2.870 13.045 1.00 0.32 H new ATOM 0 HE2 PHE B 14 19.235 2.235 8.957 1.00 64.14 H new ATOM 0 HZ PHE B 14 18.896 3.760 10.858 1.00 44.01 H new ATOM 2035 N GLU B 15 19.691 -4.157 13.596 1.00 0.22 N ATOM 2036 CA GLU B 15 19.417 -5.488 14.144 1.00 60.41 C ATOM 2037 C GLU B 15 18.000 -5.493 14.731 1.00 41.02 C ATOM 2038 O GLU B 15 17.784 -5.075 15.871 1.00 74.11 O ATOM 2039 CB GLU B 15 20.460 -5.865 15.222 1.00 51.32 C ATOM 2040 CG GLU B 15 21.911 -5.868 14.715 1.00 74.32 C ATOM 2041 CD GLU B 15 22.914 -6.319 15.784 1.00 11.01 C ATOM 2042 OE1 GLU B 15 23.360 -5.472 16.590 1.00 20.55 O ATOM 2043 OE2 GLU B 15 23.252 -7.521 15.830 1.00 25.14 O ATOM 0 H GLU B 15 20.364 -3.618 14.142 1.00 0.22 H new ATOM 0 HA GLU B 15 19.487 -6.232 13.350 1.00 60.41 H new ATOM 0 HB2 GLU B 15 20.378 -5.164 16.053 1.00 51.32 H new ATOM 0 HB3 GLU B 15 20.221 -6.854 15.614 1.00 51.32 H new ATOM 0 HG2 GLU B 15 21.987 -6.528 13.851 1.00 74.32 H new ATOM 0 HG3 GLU B 15 22.174 -4.866 14.376 1.00 74.32 H new ATOM 2050 N ILE B 16 17.039 -5.894 13.902 1.00 62.33 N ATOM 2051 CA ILE B 16 15.611 -5.902 14.254 1.00 3.13 C ATOM 2052 C ILE B 16 15.193 -7.316 14.704 1.00 21.01 C ATOM 2053 O ILE B 16 15.806 -8.304 14.288 1.00 2.32 O ATOM 2054 CB ILE B 16 14.745 -5.435 13.018 1.00 64.14 C ATOM 2055 CG1 ILE B 16 13.277 -5.113 13.429 1.00 3.35 C ATOM 2056 CG2 ILE B 16 14.775 -6.482 11.876 1.00 3.22 C ATOM 2057 CD1 ILE B 16 13.127 -4.007 14.463 1.00 54.54 C ATOM 0 H ILE B 16 17.226 -6.227 12.956 1.00 62.33 H new ATOM 0 HA ILE B 16 15.440 -5.208 15.077 1.00 3.13 H new ATOM 0 HB ILE B 16 15.196 -4.515 12.646 1.00 64.14 H new ATOM 0 HG12 ILE B 16 12.719 -4.833 12.536 1.00 3.35 H new ATOM 0 HG13 ILE B 16 12.818 -6.021 13.821 1.00 3.35 H new ATOM 0 HG21 ILE B 16 14.169 -6.128 11.042 1.00 3.22 H new ATOM 0 HG22 ILE B 16 15.802 -6.627 11.542 1.00 3.22 H new ATOM 0 HG23 ILE B 16 14.375 -7.428 12.240 1.00 3.22 H new ATOM 0 HD11 ILE B 16 12.070 -3.856 14.684 1.00 54.54 H new ATOM 0 HD12 ILE B 16 13.652 -4.289 15.376 1.00 54.54 H new ATOM 0 HD13 ILE B 16 13.551 -3.083 14.071 1.00 54.54 H new ATOM 2069 N GLU B 17 14.159 -7.406 15.563 1.00 12.23 N ATOM 2070 CA GLU B 17 13.585 -8.695 15.982 1.00 22.02 C ATOM 2071 C GLU B 17 13.028 -9.459 14.770 1.00 1.04 C ATOM 2072 O GLU B 17 12.427 -8.860 13.864 1.00 21.32 O ATOM 2073 CB GLU B 17 12.489 -8.483 17.057 1.00 52.31 C ATOM 2074 CG GLU B 17 13.028 -8.197 18.475 1.00 4.22 C ATOM 2075 CD GLU B 17 13.672 -9.440 19.120 1.00 35.11 C ATOM 2076 OE1 GLU B 17 12.960 -10.450 19.309 1.00 31.20 O ATOM 2077 OE2 GLU B 17 14.869 -9.420 19.455 1.00 71.00 O ATOM 0 H GLU B 17 13.704 -6.595 15.981 1.00 12.23 H new ATOM 0 HA GLU B 17 14.378 -9.297 16.425 1.00 22.02 H new ATOM 0 HB2 GLU B 17 11.853 -7.653 16.750 1.00 52.31 H new ATOM 0 HB3 GLU B 17 11.858 -9.371 17.094 1.00 52.31 H new ATOM 0 HG2 GLU B 17 13.763 -7.394 18.426 1.00 4.22 H new ATOM 0 HG3 GLU B 17 12.213 -7.844 19.107 1.00 4.22 H new ATOM 2084 N LYS B 18 13.233 -10.786 14.789 1.00 43.23 N ATOM 2085 CA LYS B 18 12.856 -11.700 13.705 1.00 2.34 C ATOM 2086 C LYS B 18 11.340 -11.679 13.464 1.00 75.42 C ATOM 2087 O LYS B 18 10.898 -11.701 12.314 1.00 70.04 O ATOM 2088 CB LYS B 18 13.349 -13.138 14.048 1.00 34.13 C ATOM 2089 CG LYS B 18 12.945 -14.234 13.038 1.00 34.33 C ATOM 2090 CD LYS B 18 13.508 -13.989 11.621 1.00 74.34 C ATOM 2091 CE LYS B 18 13.035 -15.052 10.618 1.00 64.04 C ATOM 2092 NZ LYS B 18 13.425 -16.429 11.031 1.00 31.35 N ATOM 0 H LYS B 18 13.675 -11.261 15.576 1.00 43.23 H new ATOM 0 HA LYS B 18 13.333 -11.371 12.782 1.00 2.34 H new ATOM 0 HB2 LYS B 18 14.436 -13.122 14.126 1.00 34.13 H new ATOM 0 HB3 LYS B 18 12.963 -13.412 15.030 1.00 34.13 H new ATOM 0 HG2 LYS B 18 13.296 -15.200 13.400 1.00 34.33 H new ATOM 0 HG3 LYS B 18 11.858 -14.289 12.986 1.00 34.33 H new ATOM 0 HD2 LYS B 18 13.200 -13.002 11.275 1.00 74.34 H new ATOM 0 HD3 LYS B 18 14.597 -13.987 11.660 1.00 74.34 H new ATOM 0 HE2 LYS B 18 11.951 -14.998 10.518 1.00 64.04 H new ATOM 0 HE3 LYS B 18 13.457 -14.836 9.636 1.00 64.04 H new ATOM 0 HZ1 LYS B 18 13.207 -17.096 10.264 1.00 31.35 H new ATOM 0 HZ2 LYS B 18 14.445 -16.455 11.233 1.00 31.35 H new ATOM 0 HZ3 LYS B 18 12.896 -16.698 11.885 1.00 31.35 H new ATOM 2106 N GLU B 19 10.567 -11.600 14.562 1.00 12.22 N ATOM 2107 CA GLU B 19 9.092 -11.564 14.509 1.00 75.34 C ATOM 2108 C GLU B 19 8.604 -10.329 13.721 1.00 24.23 C ATOM 2109 O GLU B 19 7.674 -10.415 12.920 1.00 23.34 O ATOM 2110 CB GLU B 19 8.493 -11.553 15.944 1.00 3.11 C ATOM 2111 CG GLU B 19 9.110 -12.575 16.925 1.00 63.53 C ATOM 2112 CD GLU B 19 9.145 -14.023 16.391 1.00 3.44 C ATOM 2113 OE1 GLU B 19 10.214 -14.482 15.925 1.00 1.32 O ATOM 2114 OE2 GLU B 19 8.103 -14.707 16.451 1.00 65.20 O ATOM 0 H GLU B 19 10.944 -11.559 15.509 1.00 12.22 H new ATOM 0 HA GLU B 19 8.750 -12.462 13.994 1.00 75.34 H new ATOM 0 HB2 GLU B 19 8.614 -10.554 16.363 1.00 3.11 H new ATOM 0 HB3 GLU B 19 7.422 -11.742 15.874 1.00 3.11 H new ATOM 0 HG2 GLU B 19 10.127 -12.263 17.165 1.00 63.53 H new ATOM 0 HG3 GLU B 19 8.543 -12.556 17.856 1.00 63.53 H new ATOM 2121 N ILE B 20 9.290 -9.198 13.950 1.00 15.10 N ATOM 2122 CA ILE B 20 9.010 -7.918 13.279 1.00 23.22 C ATOM 2123 C ILE B 20 9.345 -8.015 11.776 1.00 74.35 C ATOM 2124 O ILE B 20 8.571 -7.576 10.919 1.00 73.01 O ATOM 2125 CB ILE B 20 9.844 -6.764 13.945 1.00 32.03 C ATOM 2126 CG1 ILE B 20 9.457 -6.602 15.447 1.00 73.44 C ATOM 2127 CG2 ILE B 20 9.690 -5.437 13.175 1.00 65.02 C ATOM 2128 CD1 ILE B 20 10.259 -5.551 16.204 1.00 73.34 C ATOM 0 H ILE B 20 10.063 -9.146 14.613 1.00 15.10 H new ATOM 0 HA ILE B 20 7.949 -7.694 13.386 1.00 23.22 H new ATOM 0 HB ILE B 20 10.897 -7.040 13.897 1.00 32.03 H new ATOM 0 HG12 ILE B 20 8.399 -6.346 15.509 1.00 73.44 H new ATOM 0 HG13 ILE B 20 9.582 -7.563 15.946 1.00 73.44 H new ATOM 0 HG21 ILE B 20 10.280 -4.662 13.664 1.00 65.02 H new ATOM 0 HG22 ILE B 20 10.040 -5.568 12.151 1.00 65.02 H new ATOM 0 HG23 ILE B 20 8.641 -5.142 13.165 1.00 65.02 H new ATOM 0 HD11 ILE B 20 9.920 -5.510 17.239 1.00 73.34 H new ATOM 0 HD12 ILE B 20 11.317 -5.813 16.179 1.00 73.34 H new ATOM 0 HD13 ILE B 20 10.115 -4.577 15.736 1.00 73.34 H new ATOM 2140 N ALA B 21 10.505 -8.621 11.485 1.00 30.03 N ATOM 2141 CA ALA B 21 10.997 -8.822 10.110 1.00 60.10 C ATOM 2142 C ALA B 21 10.098 -9.803 9.319 1.00 25.42 C ATOM 2143 O ALA B 21 10.059 -9.762 8.087 1.00 4.05 O ATOM 2144 CB ALA B 21 12.447 -9.309 10.162 1.00 74.40 C ATOM 0 H ALA B 21 11.134 -8.988 12.199 1.00 30.03 H new ATOM 0 HA ALA B 21 10.959 -7.871 9.579 1.00 60.10 H new ATOM 0 HB1 ALA B 21 12.817 -9.460 9.148 1.00 74.40 H new ATOM 0 HB2 ALA B 21 13.063 -8.564 10.666 1.00 74.40 H new ATOM 0 HB3 ALA B 21 12.495 -10.250 10.709 1.00 74.40 H new ATOM 2150 N CYS B 22 9.401 -10.693 10.053 1.00 72.23 N ATOM 2151 CA CYS B 22 8.377 -11.588 9.491 1.00 74.24 C ATOM 2152 C CYS B 22 7.065 -10.822 9.200 1.00 21.10 C ATOM 2153 O CYS B 22 6.366 -11.147 8.229 1.00 10.03 O ATOM 2154 CB CYS B 22 8.123 -12.771 10.448 1.00 43.41 C ATOM 2155 SG CYS B 22 9.574 -13.817 10.719 1.00 32.01 S ATOM 0 H CYS B 22 9.535 -10.810 11.057 1.00 72.23 H new ATOM 0 HA CYS B 22 8.746 -11.980 8.543 1.00 74.24 H new ATOM 0 HB2 CYS B 22 7.782 -12.383 11.408 1.00 43.41 H new ATOM 0 HB3 CYS B 22 7.315 -13.383 10.047 1.00 43.41 H new ATOM 0 HG CYS B 22 10.389 -13.224 11.540 1.00 32.01 H new ATOM 2161 N MET B 23 6.724 -9.816 10.056 1.00 23.24 N ATOM 2162 CA MET B 23 5.538 -8.936 9.831 1.00 0.24 C ATOM 2163 C MET B 23 5.718 -8.125 8.535 1.00 51.23 C ATOM 2164 O MET B 23 4.748 -7.834 7.813 1.00 51.12 O ATOM 2165 CB MET B 23 5.276 -7.952 11.015 1.00 73.43 C ATOM 2166 CG MET B 23 5.000 -8.599 12.381 1.00 14.10 C ATOM 2167 SD MET B 23 4.332 -7.429 13.600 1.00 22.54 S ATOM 2168 CE MET B 23 5.516 -6.076 13.556 1.00 21.55 C ATOM 0 H MET B 23 7.249 -9.595 10.902 1.00 23.24 H new ATOM 0 HA MET B 23 4.674 -9.596 9.753 1.00 0.24 H new ATOM 0 HB2 MET B 23 6.141 -7.296 11.114 1.00 73.43 H new ATOM 0 HB3 MET B 23 4.426 -7.321 10.756 1.00 73.43 H new ATOM 0 HG2 MET B 23 4.296 -9.421 12.252 1.00 14.10 H new ATOM 0 HG3 MET B 23 5.925 -9.028 12.767 1.00 14.10 H new ATOM 0 HE1 MET B 23 5.839 -5.842 14.570 1.00 21.55 H new ATOM 0 HE2 MET B 23 6.379 -6.367 12.958 1.00 21.55 H new ATOM 0 HE3 MET B 23 5.048 -5.197 13.113 1.00 21.55 H new ATOM 2178 N SER B 24 6.975 -7.752 8.276 1.00 74.34 N ATOM 2179 CA SER B 24 7.396 -7.182 7.001 1.00 34.34 C ATOM 2180 C SER B 24 7.390 -8.301 5.946 1.00 70.31 C ATOM 2181 O SER B 24 8.269 -9.167 5.958 1.00 54.10 O ATOM 2182 CB SER B 24 8.799 -6.560 7.140 1.00 13.31 C ATOM 2183 OG SER B 24 9.195 -5.935 5.936 1.00 62.15 O ATOM 0 H SER B 24 7.732 -7.840 8.954 1.00 74.34 H new ATOM 0 HA SER B 24 6.712 -6.391 6.693 1.00 34.34 H new ATOM 0 HB2 SER B 24 8.799 -5.831 7.950 1.00 13.31 H new ATOM 0 HB3 SER B 24 9.519 -7.333 7.407 1.00 13.31 H new ATOM 0 HG SER B 24 8.438 -5.915 5.313 1.00 62.15 H new ATOM 2189 N VAL B 25 6.371 -8.292 5.066 1.00 24.45 N ATOM 2190 CA VAL B 25 6.125 -9.390 4.114 1.00 55.42 C ATOM 2191 C VAL B 25 7.288 -9.539 3.101 1.00 5.30 C ATOM 2192 O VAL B 25 7.687 -10.657 2.799 1.00 5.24 O ATOM 2193 CB VAL B 25 4.753 -9.211 3.362 1.00 3.40 C ATOM 2194 CG1 VAL B 25 4.466 -10.382 2.385 1.00 11.32 C ATOM 2195 CG2 VAL B 25 3.586 -9.023 4.369 1.00 21.34 C ATOM 0 H VAL B 25 5.699 -7.528 4.995 1.00 24.45 H new ATOM 0 HA VAL B 25 6.069 -10.308 4.699 1.00 55.42 H new ATOM 0 HB VAL B 25 4.832 -8.306 2.760 1.00 3.40 H new ATOM 0 HG11 VAL B 25 3.510 -10.216 1.889 1.00 11.32 H new ATOM 0 HG12 VAL B 25 5.258 -10.435 1.638 1.00 11.32 H new ATOM 0 HG13 VAL B 25 4.428 -11.319 2.941 1.00 11.32 H new ATOM 0 HG21 VAL B 25 2.650 -8.902 3.823 1.00 21.34 H new ATOM 0 HG22 VAL B 25 3.518 -9.898 5.015 1.00 21.34 H new ATOM 0 HG23 VAL B 25 3.769 -8.137 4.977 1.00 21.34 H new ATOM 2205 N THR B 26 7.836 -8.400 2.623 1.00 64.50 N ATOM 2206 CA THR B 26 8.966 -8.379 1.656 1.00 41.52 C ATOM 2207 C THR B 26 10.253 -8.989 2.252 1.00 15.12 C ATOM 2208 O THR B 26 10.901 -9.815 1.604 1.00 44.41 O ATOM 2209 CB THR B 26 9.241 -6.923 1.151 1.00 25.34 C ATOM 2210 OG1 THR B 26 8.078 -6.432 0.462 1.00 75.52 O ATOM 2211 CG2 THR B 26 10.472 -6.811 0.221 1.00 55.34 C ATOM 0 H THR B 26 7.512 -7.471 2.893 1.00 64.50 H new ATOM 0 HA THR B 26 8.670 -8.997 0.809 1.00 41.52 H new ATOM 0 HB THR B 26 9.461 -6.322 2.033 1.00 25.34 H new ATOM 0 HG1 THR B 26 8.219 -5.496 0.207 1.00 75.52 H new ATOM 0 HG21 THR B 26 10.601 -5.774 -0.089 1.00 55.34 H new ATOM 0 HG22 THR B 26 11.363 -7.143 0.755 1.00 55.34 H new ATOM 0 HG23 THR B 26 10.322 -7.437 -0.659 1.00 55.34 H new ATOM 2219 N ILE B 27 10.601 -8.588 3.490 1.00 55.42 N ATOM 2220 CA ILE B 27 11.799 -9.103 4.192 1.00 11.21 C ATOM 2221 C ILE B 27 11.636 -10.611 4.470 1.00 45.43 C ATOM 2222 O ILE B 27 12.569 -11.390 4.277 1.00 33.35 O ATOM 2223 CB ILE B 27 12.067 -8.322 5.531 1.00 2.14 C ATOM 2224 CG1 ILE B 27 12.304 -6.808 5.236 1.00 42.13 C ATOM 2225 CG2 ILE B 27 13.256 -8.927 6.324 1.00 43.14 C ATOM 2226 CD1 ILE B 27 12.439 -5.940 6.473 1.00 3.44 C ATOM 0 H ILE B 27 10.068 -7.906 4.029 1.00 55.42 H new ATOM 0 HA ILE B 27 12.663 -8.948 3.545 1.00 11.21 H new ATOM 0 HB ILE B 27 11.181 -8.421 6.158 1.00 2.14 H new ATOM 0 HG12 ILE B 27 13.207 -6.705 4.635 1.00 42.13 H new ATOM 0 HG13 ILE B 27 11.476 -6.434 4.634 1.00 42.13 H new ATOM 0 HG21 ILE B 27 13.408 -8.359 7.242 1.00 43.14 H new ATOM 0 HG22 ILE B 27 13.037 -9.966 6.572 1.00 43.14 H new ATOM 0 HG23 ILE B 27 14.159 -8.882 5.716 1.00 43.14 H new ATOM 0 HD11 ILE B 27 12.601 -4.904 6.175 1.00 3.44 H new ATOM 0 HD12 ILE B 27 11.527 -6.008 7.067 1.00 3.44 H new ATOM 0 HD13 ILE B 27 13.286 -6.283 7.068 1.00 3.44 H new ATOM 2238 N LYS B 28 10.412 -10.994 4.890 1.00 43.45 N ATOM 2239 CA LYS B 28 10.002 -12.401 5.064 1.00 72.04 C ATOM 2240 C LYS B 28 10.200 -13.195 3.750 1.00 11.42 C ATOM 2241 O LYS B 28 10.745 -14.296 3.766 1.00 23.22 O ATOM 2242 CB LYS B 28 8.513 -12.452 5.499 1.00 75.01 C ATOM 2243 CG LYS B 28 7.924 -13.873 5.668 1.00 23.42 C ATOM 2244 CD LYS B 28 6.381 -13.896 5.751 1.00 72.42 C ATOM 2245 CE LYS B 28 5.690 -13.274 4.524 1.00 41.54 C ATOM 2246 NZ LYS B 28 6.156 -13.855 3.237 1.00 51.45 N ATOM 0 H LYS B 28 9.674 -10.328 5.120 1.00 43.45 H new ATOM 0 HA LYS B 28 10.623 -12.858 5.834 1.00 72.04 H new ATOM 0 HB2 LYS B 28 8.409 -11.918 6.444 1.00 75.01 H new ATOM 0 HB3 LYS B 28 7.917 -11.914 4.761 1.00 75.01 H new ATOM 0 HG2 LYS B 28 8.244 -14.492 4.830 1.00 23.42 H new ATOM 0 HG3 LYS B 28 8.335 -14.323 6.572 1.00 23.42 H new ATOM 0 HD2 LYS B 28 6.047 -14.927 5.862 1.00 72.42 H new ATOM 0 HD3 LYS B 28 6.065 -13.360 6.646 1.00 72.42 H new ATOM 0 HE2 LYS B 28 4.613 -13.415 4.611 1.00 41.54 H new ATOM 0 HE3 LYS B 28 5.872 -12.199 4.518 1.00 41.54 H new ATOM 0 HZ1 LYS B 28 6.631 -13.119 2.676 1.00 51.45 H new ATOM 0 HZ2 LYS B 28 6.823 -14.630 3.427 1.00 51.45 H new ATOM 0 HZ3 LYS B 28 5.340 -14.222 2.707 1.00 51.45 H new ATOM 2260 N ASN B 29 9.788 -12.583 2.617 1.00 33.31 N ATOM 2261 CA ASN B 29 9.896 -13.195 1.272 1.00 61.34 C ATOM 2262 C ASN B 29 11.367 -13.389 0.868 1.00 42.43 C ATOM 2263 O ASN B 29 11.699 -14.383 0.230 1.00 14.20 O ATOM 2264 CB ASN B 29 9.175 -12.333 0.194 1.00 43.55 C ATOM 2265 CG ASN B 29 7.650 -12.334 0.296 1.00 10.03 C ATOM 2266 OD1 ASN B 29 7.041 -13.298 0.749 1.00 24.20 O ATOM 2267 ND2 ASN B 29 7.025 -11.250 -0.138 1.00 33.43 N ATOM 0 H ASN B 29 9.372 -11.652 2.609 1.00 33.31 H new ATOM 0 HA ASN B 29 9.409 -14.168 1.327 1.00 61.34 H new ATOM 0 HB2 ASN B 29 9.531 -11.306 0.271 1.00 43.55 H new ATOM 0 HB3 ASN B 29 9.461 -12.696 -0.793 1.00 43.55 H new ATOM 0 HD21 ASN B 29 6.007 -11.199 -0.101 1.00 33.43 H new ATOM 0 HD22 ASN B 29 7.562 -10.466 -0.509 1.00 33.43 H new ATOM 2274 N MET B 30 12.229 -12.418 1.243 1.00 23.22 N ATOM 2275 CA MET B 30 13.687 -12.487 1.005 1.00 65.45 C ATOM 2276 C MET B 30 14.293 -13.691 1.748 1.00 22.23 C ATOM 2277 O MET B 30 15.059 -14.461 1.165 1.00 33.21 O ATOM 2278 CB MET B 30 14.404 -11.162 1.440 1.00 42.35 C ATOM 2279 CG MET B 30 14.557 -10.096 0.337 1.00 20.32 C ATOM 2280 SD MET B 30 12.996 -9.541 -0.386 1.00 32.41 S ATOM 2281 CE MET B 30 13.570 -8.312 -1.571 1.00 65.12 C ATOM 0 H MET B 30 11.933 -11.565 1.719 1.00 23.22 H new ATOM 0 HA MET B 30 13.844 -12.614 -0.066 1.00 65.45 H new ATOM 0 HB2 MET B 30 13.848 -10.724 2.269 1.00 42.35 H new ATOM 0 HB3 MET B 30 15.395 -11.413 1.818 1.00 42.35 H new ATOM 0 HG2 MET B 30 15.078 -9.233 0.752 1.00 20.32 H new ATOM 0 HG3 MET B 30 15.188 -10.499 -0.456 1.00 20.32 H new ATOM 0 HE1 MET B 30 12.715 -7.883 -2.093 1.00 65.12 H new ATOM 0 HE2 MET B 30 14.107 -7.523 -1.045 1.00 65.12 H new ATOM 0 HE3 MET B 30 14.236 -8.785 -2.293 1.00 65.12 H new ATOM 2291 N ILE B 31 13.906 -13.843 3.033 1.00 13.41 N ATOM 2292 CA ILE B 31 14.360 -14.947 3.901 1.00 53.41 C ATOM 2293 C ILE B 31 13.956 -16.305 3.290 1.00 15.34 C ATOM 2294 O ILE B 31 14.801 -17.170 3.100 1.00 75.22 O ATOM 2295 CB ILE B 31 13.783 -14.789 5.366 1.00 70.13 C ATOM 2296 CG1 ILE B 31 14.297 -13.458 6.011 1.00 54.12 C ATOM 2297 CG2 ILE B 31 14.128 -16.006 6.267 1.00 74.45 C ATOM 2298 CD1 ILE B 31 13.670 -13.107 7.349 1.00 74.02 C ATOM 0 H ILE B 31 13.266 -13.199 3.498 1.00 13.41 H new ATOM 0 HA ILE B 31 15.447 -14.909 3.969 1.00 53.41 H new ATOM 0 HB ILE B 31 12.697 -14.749 5.287 1.00 70.13 H new ATOM 0 HG12 ILE B 31 15.377 -13.529 6.141 1.00 54.12 H new ATOM 0 HG13 ILE B 31 14.112 -12.640 5.315 1.00 54.12 H new ATOM 0 HG21 ILE B 31 13.711 -15.852 7.262 1.00 74.45 H new ATOM 0 HG22 ILE B 31 13.705 -16.912 5.833 1.00 74.45 H new ATOM 0 HG23 ILE B 31 15.211 -16.110 6.339 1.00 74.45 H new ATOM 0 HD11 ILE B 31 14.091 -12.170 7.713 1.00 74.02 H new ATOM 0 HD12 ILE B 31 12.592 -12.998 7.228 1.00 74.02 H new ATOM 0 HD13 ILE B 31 13.877 -13.901 8.067 1.00 74.02 H new ATOM 2310 N GLU B 32 12.666 -16.424 2.914 1.00 61.22 N ATOM 2311 CA GLU B 32 12.087 -17.664 2.340 1.00 63.52 C ATOM 2312 C GLU B 32 12.715 -18.016 0.971 1.00 63.24 C ATOM 2313 O GLU B 32 12.946 -19.194 0.673 1.00 15.53 O ATOM 2314 CB GLU B 32 10.549 -17.507 2.199 1.00 22.12 C ATOM 2315 CG GLU B 32 9.801 -17.330 3.538 1.00 44.05 C ATOM 2316 CD GLU B 32 8.310 -17.025 3.344 1.00 30.43 C ATOM 2317 OE1 GLU B 32 7.457 -17.902 3.595 1.00 54.32 O ATOM 2318 OE2 GLU B 32 7.985 -15.904 2.903 1.00 41.20 O ATOM 0 H GLU B 32 11.992 -15.663 2.999 1.00 61.22 H new ATOM 0 HA GLU B 32 12.312 -18.484 3.022 1.00 63.52 H new ATOM 0 HB2 GLU B 32 10.341 -16.646 1.564 1.00 22.12 H new ATOM 0 HB3 GLU B 32 10.152 -18.384 1.688 1.00 22.12 H new ATOM 0 HG2 GLU B 32 9.908 -18.237 4.133 1.00 44.05 H new ATOM 0 HG3 GLU B 32 10.263 -16.521 4.104 1.00 44.05 H new ATOM 2325 N ASP B 33 13.002 -16.979 0.166 1.00 21.14 N ATOM 2326 CA ASP B 33 13.530 -17.127 -1.213 1.00 52.13 C ATOM 2327 C ASP B 33 14.994 -17.604 -1.203 1.00 30.15 C ATOM 2328 O ASP B 33 15.400 -18.411 -2.047 1.00 60.01 O ATOM 2329 CB ASP B 33 13.393 -15.785 -1.982 1.00 75.34 C ATOM 2330 CG ASP B 33 13.755 -15.893 -3.475 1.00 60.25 C ATOM 2331 OD1 ASP B 33 12.998 -16.545 -4.226 1.00 73.50 O ATOM 2332 OD2 ASP B 33 14.774 -15.320 -3.910 1.00 12.20 O ATOM 0 H ASP B 33 12.876 -16.007 0.449 1.00 21.14 H new ATOM 0 HA ASP B 33 12.941 -17.888 -1.725 1.00 52.13 H new ATOM 0 HB2 ASP B 33 12.368 -15.426 -1.890 1.00 75.34 H new ATOM 0 HB3 ASP B 33 14.036 -15.040 -1.513 1.00 75.34 H new ATOM 2337 N ILE B 34 15.773 -17.096 -0.232 1.00 63.14 N ATOM 2338 CA ILE B 34 17.170 -17.532 0.014 1.00 22.13 C ATOM 2339 C ILE B 34 17.179 -18.812 0.910 1.00 22.21 C ATOM 2340 O ILE B 34 18.224 -19.436 1.135 1.00 12.42 O ATOM 2341 CB ILE B 34 18.009 -16.355 0.676 1.00 13.42 C ATOM 2342 CG1 ILE B 34 17.882 -15.038 -0.165 1.00 41.42 C ATOM 2343 CG2 ILE B 34 19.506 -16.730 0.847 1.00 73.24 C ATOM 2344 CD1 ILE B 34 18.519 -13.809 0.475 1.00 62.14 C ATOM 0 H ILE B 34 15.456 -16.369 0.409 1.00 63.14 H new ATOM 0 HA ILE B 34 17.641 -17.780 -0.937 1.00 22.13 H new ATOM 0 HB ILE B 34 17.590 -16.188 1.668 1.00 13.42 H new ATOM 0 HG12 ILE B 34 18.339 -15.201 -1.141 1.00 41.42 H new ATOM 0 HG13 ILE B 34 16.825 -14.834 -0.338 1.00 41.42 H new ATOM 0 HG21 ILE B 34 20.040 -15.896 1.303 1.00 73.24 H new ATOM 0 HG22 ILE B 34 19.590 -17.608 1.487 1.00 73.24 H new ATOM 0 HG23 ILE B 34 19.940 -16.949 -0.129 1.00 73.24 H new ATOM 0 HD11 ILE B 34 18.382 -12.947 -0.177 1.00 62.14 H new ATOM 0 HD12 ILE B 34 18.047 -13.614 1.438 1.00 62.14 H new ATOM 0 HD13 ILE B 34 19.584 -13.987 0.623 1.00 62.14 H new ATOM 2356 N GLY B 35 15.987 -19.220 1.383 1.00 73.21 N ATOM 2357 CA GLY B 35 15.832 -20.371 2.273 1.00 42.53 C ATOM 2358 C GLY B 35 15.745 -19.928 3.721 1.00 32.04 C ATOM 2359 O GLY B 35 14.741 -20.173 4.398 1.00 31.54 O ATOM 0 H GLY B 35 15.107 -18.756 1.155 1.00 73.21 H new ATOM 0 HA2 GLY B 35 14.933 -20.926 2.004 1.00 42.53 H new ATOM 0 HA3 GLY B 35 16.675 -21.050 2.146 1.00 42.53 H new ATOM 2363 N GLU B 36 16.804 -19.229 4.170 1.00 52.50 N ATOM 2364 CA GLU B 36 16.881 -18.604 5.499 1.00 52.00 C ATOM 2365 C GLU B 36 18.089 -17.650 5.521 1.00 23.41 C ATOM 2366 O GLU B 36 19.148 -17.984 4.979 1.00 40.05 O ATOM 2367 CB GLU B 36 16.989 -19.684 6.609 1.00 72.32 C ATOM 2368 CG GLU B 36 17.100 -19.130 8.039 1.00 53.40 C ATOM 2369 CD GLU B 36 17.076 -20.226 9.112 1.00 3.24 C ATOM 2370 OE1 GLU B 36 18.133 -20.833 9.379 1.00 4.52 O ATOM 2371 OE2 GLU B 36 16.003 -20.491 9.691 1.00 73.54 O ATOM 0 H GLU B 36 17.643 -19.082 3.609 1.00 52.50 H new ATOM 0 HA GLU B 36 15.972 -18.036 5.697 1.00 52.00 H new ATOM 0 HB2 GLU B 36 16.114 -20.332 6.552 1.00 72.32 H new ATOM 0 HB3 GLU B 36 17.861 -20.307 6.407 1.00 72.32 H new ATOM 0 HG2 GLU B 36 18.025 -18.560 8.131 1.00 53.40 H new ATOM 0 HG3 GLU B 36 16.279 -18.436 8.218 1.00 53.40 H new ATOM 2378 N SER B 37 17.924 -16.452 6.131 1.00 72.41 N ATOM 2379 CA SER B 37 18.983 -15.423 6.186 1.00 12.21 C ATOM 2380 C SER B 37 18.891 -14.589 7.480 1.00 41.22 C ATOM 2381 O SER B 37 17.902 -13.878 7.695 1.00 30.12 O ATOM 2382 CB SER B 37 18.891 -14.496 4.947 1.00 74.30 C ATOM 2383 OG SER B 37 19.066 -15.219 3.743 1.00 13.41 O ATOM 0 H SER B 37 17.059 -16.176 6.595 1.00 72.41 H new ATOM 0 HA SER B 37 19.946 -15.933 6.183 1.00 12.21 H new ATOM 0 HB2 SER B 37 17.922 -13.998 4.936 1.00 74.30 H new ATOM 0 HB3 SER B 37 19.649 -13.716 5.018 1.00 74.30 H new ATOM 0 HG SER B 37 19.319 -14.602 3.025 1.00 13.41 H new ATOM 2389 N ASP B 38 19.910 -14.725 8.354 1.00 23.44 N ATOM 2390 CA ASP B 38 20.128 -13.820 9.515 1.00 44.40 C ATOM 2391 C ASP B 38 21.119 -12.699 9.134 1.00 1.20 C ATOM 2392 O ASP B 38 21.294 -11.728 9.885 1.00 1.13 O ATOM 2393 CB ASP B 38 20.678 -14.607 10.739 1.00 61.20 C ATOM 2394 CG ASP B 38 22.063 -15.235 10.486 1.00 12.04 C ATOM 2395 OD1 ASP B 38 22.130 -16.297 9.830 1.00 32.43 O ATOM 2396 OD2 ASP B 38 23.091 -14.677 10.927 1.00 4.42 O ATOM 0 H ASP B 38 20.609 -15.464 8.279 1.00 23.44 H new ATOM 0 HA ASP B 38 19.168 -13.381 9.787 1.00 44.40 H new ATOM 0 HB2 ASP B 38 20.742 -13.936 11.595 1.00 61.20 H new ATOM 0 HB3 ASP B 38 19.972 -15.394 11.003 1.00 61.20 H new ATOM 2401 N SER B 39 21.773 -12.884 7.968 1.00 54.33 N ATOM 2402 CA SER B 39 22.794 -11.974 7.416 1.00 74.11 C ATOM 2403 C SER B 39 22.256 -10.527 7.218 1.00 52.21 C ATOM 2404 O SER B 39 21.036 -10.333 7.152 1.00 12.31 O ATOM 2405 CB SER B 39 23.286 -12.576 6.073 1.00 41.25 C ATOM 2406 OG SER B 39 22.199 -12.887 5.212 1.00 14.15 O ATOM 0 H SER B 39 21.600 -13.692 7.370 1.00 54.33 H new ATOM 0 HA SER B 39 23.619 -11.888 8.123 1.00 74.11 H new ATOM 0 HB2 SER B 39 23.952 -11.869 5.579 1.00 41.25 H new ATOM 0 HB3 SER B 39 23.866 -13.478 6.268 1.00 41.25 H new ATOM 0 HG SER B 39 22.542 -13.262 4.374 1.00 14.15 H new ATOM 2412 N PRO B 40 23.156 -9.483 7.154 1.00 0.33 N ATOM 2413 CA PRO B 40 22.729 -8.092 6.885 1.00 73.02 C ATOM 2414 C PRO B 40 22.035 -7.955 5.509 1.00 1.32 C ATOM 2415 O PRO B 40 22.701 -7.874 4.474 1.00 64.33 O ATOM 2416 CB PRO B 40 24.049 -7.266 6.976 1.00 70.20 C ATOM 2417 CG PRO B 40 25.016 -8.147 7.719 1.00 53.22 C ATOM 2418 CD PRO B 40 24.633 -9.568 7.354 1.00 53.14 C ATOM 0 HA PRO B 40 21.979 -7.740 7.594 1.00 73.02 H new ATOM 0 HB2 PRO B 40 24.426 -7.016 5.984 1.00 70.20 H new ATOM 0 HB3 PRO B 40 23.889 -6.325 7.503 1.00 70.20 H new ATOM 0 HG2 PRO B 40 26.045 -7.931 7.430 1.00 53.22 H new ATOM 0 HG3 PRO B 40 24.947 -7.986 8.795 1.00 53.22 H new ATOM 0 HD2 PRO B 40 25.143 -9.903 6.451 1.00 53.14 H new ATOM 0 HD3 PRO B 40 24.892 -10.271 8.146 1.00 53.14 H new ATOM 2426 N ILE B 41 20.687 -8.026 5.525 1.00 41.10 N ATOM 2427 CA ILE B 41 19.844 -7.881 4.326 1.00 62.53 C ATOM 2428 C ILE B 41 19.844 -6.401 3.880 1.00 72.00 C ATOM 2429 O ILE B 41 19.314 -5.544 4.601 1.00 23.52 O ATOM 2430 CB ILE B 41 18.362 -8.381 4.590 1.00 52.53 C ATOM 2431 CG1 ILE B 41 18.351 -9.879 5.036 1.00 61.04 C ATOM 2432 CG2 ILE B 41 17.452 -8.168 3.349 1.00 40.21 C ATOM 2433 CD1 ILE B 41 18.936 -10.854 4.025 1.00 20.40 C ATOM 0 H ILE B 41 20.152 -8.187 6.378 1.00 41.10 H new ATOM 0 HA ILE B 41 20.259 -8.504 3.533 1.00 62.53 H new ATOM 0 HB ILE B 41 17.955 -7.777 5.401 1.00 52.53 H new ATOM 0 HG12 ILE B 41 18.907 -9.969 5.969 1.00 61.04 H new ATOM 0 HG13 ILE B 41 17.323 -10.172 5.248 1.00 61.04 H new ATOM 0 HG21 ILE B 41 16.446 -8.523 3.571 1.00 40.21 H new ATOM 0 HG22 ILE B 41 17.416 -7.107 3.102 1.00 40.21 H new ATOM 0 HG23 ILE B 41 17.855 -8.724 2.503 1.00 40.21 H new ATOM 0 HD11 ILE B 41 18.884 -11.867 4.424 1.00 20.40 H new ATOM 0 HD12 ILE B 41 18.367 -10.800 3.097 1.00 20.40 H new ATOM 0 HD13 ILE B 41 19.976 -10.594 3.829 1.00 20.40 H new ATOM 2445 N PRO B 42 20.470 -6.072 2.704 1.00 73.41 N ATOM 2446 CA PRO B 42 20.560 -4.686 2.227 1.00 23.15 C ATOM 2447 C PRO B 42 19.228 -4.193 1.598 1.00 30.51 C ATOM 2448 O PRO B 42 18.662 -4.837 0.710 1.00 63.00 O ATOM 2449 CB PRO B 42 21.722 -4.752 1.210 1.00 73.22 C ATOM 2450 CG PRO B 42 21.679 -6.141 0.651 1.00 13.40 C ATOM 2451 CD PRO B 42 21.142 -7.023 1.765 1.00 72.11 C ATOM 0 HA PRO B 42 20.740 -3.964 3.023 1.00 23.15 H new ATOM 0 HB2 PRO B 42 21.599 -4.007 0.423 1.00 73.22 H new ATOM 0 HB3 PRO B 42 22.679 -4.551 1.692 1.00 73.22 H new ATOM 0 HG2 PRO B 42 21.037 -6.188 -0.228 1.00 13.40 H new ATOM 0 HG3 PRO B 42 22.671 -6.467 0.339 1.00 13.40 H new ATOM 0 HD2 PRO B 42 20.441 -7.764 1.381 1.00 72.11 H new ATOM 0 HD3 PRO B 42 21.944 -7.570 2.260 1.00 72.11 H new ATOM 2459 N LEU B 43 18.735 -3.055 2.106 1.00 40.20 N ATOM 2460 CA LEU B 43 17.488 -2.407 1.676 1.00 34.33 C ATOM 2461 C LEU B 43 17.842 -1.012 1.088 1.00 5.51 C ATOM 2462 O LEU B 43 17.883 -0.014 1.826 1.00 33.11 O ATOM 2463 CB LEU B 43 16.511 -2.304 2.895 1.00 72.35 C ATOM 2464 CG LEU B 43 16.129 -3.654 3.596 1.00 20.14 C ATOM 2465 CD1 LEU B 43 15.328 -3.413 4.897 1.00 75.34 C ATOM 2466 CD2 LEU B 43 15.365 -4.597 2.634 1.00 22.34 C ATOM 0 H LEU B 43 19.208 -2.544 2.851 1.00 40.20 H new ATOM 0 HA LEU B 43 16.984 -2.989 0.904 1.00 34.33 H new ATOM 0 HB2 LEU B 43 16.961 -1.647 3.640 1.00 72.35 H new ATOM 0 HB3 LEU B 43 15.593 -1.822 2.558 1.00 72.35 H new ATOM 0 HG LEU B 43 17.060 -4.149 3.871 1.00 20.14 H new ATOM 0 HD11 LEU B 43 15.081 -4.371 5.355 1.00 75.34 H new ATOM 0 HD12 LEU B 43 15.928 -2.824 5.590 1.00 75.34 H new ATOM 0 HD13 LEU B 43 14.409 -2.875 4.664 1.00 75.34 H new ATOM 0 HD21 LEU B 43 15.116 -5.523 3.153 1.00 22.34 H new ATOM 0 HD22 LEU B 43 14.448 -4.111 2.300 1.00 22.34 H new ATOM 0 HD23 LEU B 43 15.992 -4.822 1.771 1.00 22.34 H new ATOM 2478 N PRO B 44 18.166 -0.936 -0.245 1.00 24.03 N ATOM 2479 CA PRO B 44 18.682 0.308 -0.888 1.00 13.33 C ATOM 2480 C PRO B 44 17.621 1.414 -1.049 1.00 1.41 C ATOM 2481 O PRO B 44 17.955 2.599 -1.012 1.00 32.03 O ATOM 2482 CB PRO B 44 19.183 -0.197 -2.266 1.00 44.04 C ATOM 2483 CG PRO B 44 18.326 -1.387 -2.565 1.00 55.01 C ATOM 2484 CD PRO B 44 18.090 -2.062 -1.229 1.00 42.24 C ATOM 0 HA PRO B 44 19.451 0.785 -0.280 1.00 13.33 H new ATOM 0 HB2 PRO B 44 19.077 0.571 -3.032 1.00 44.04 H new ATOM 0 HB3 PRO B 44 20.238 -0.467 -2.230 1.00 44.04 H new ATOM 0 HG2 PRO B 44 17.384 -1.087 -3.025 1.00 55.01 H new ATOM 0 HG3 PRO B 44 18.821 -2.062 -3.264 1.00 55.01 H new ATOM 0 HD2 PRO B 44 17.120 -2.558 -1.196 1.00 42.24 H new ATOM 0 HD3 PRO B 44 18.844 -2.823 -1.026 1.00 42.24 H new ATOM 2492 N ASN B 45 16.346 1.018 -1.203 1.00 52.43 N ATOM 2493 CA ASN B 45 15.235 1.954 -1.514 1.00 44.50 C ATOM 2494 C ASN B 45 14.662 2.631 -0.249 1.00 41.55 C ATOM 2495 O ASN B 45 13.580 3.235 -0.302 1.00 54.43 O ATOM 2496 CB ASN B 45 14.113 1.208 -2.289 1.00 72.13 C ATOM 2497 CG ASN B 45 14.534 0.714 -3.681 1.00 54.03 C ATOM 2498 OD1 ASN B 45 15.702 0.420 -3.935 1.00 2.53 O ATOM 2499 ND2 ASN B 45 13.581 0.610 -4.595 1.00 74.14 N ATOM 0 H ASN B 45 16.050 0.046 -1.117 1.00 52.43 H new ATOM 0 HA ASN B 45 15.643 2.748 -2.140 1.00 44.50 H new ATOM 0 HB2 ASN B 45 13.783 0.354 -1.697 1.00 72.13 H new ATOM 0 HB3 ASN B 45 13.256 1.873 -2.395 1.00 72.13 H new ATOM 0 HD21 ASN B 45 13.808 0.280 -5.533 1.00 74.14 H new ATOM 0 HD22 ASN B 45 12.620 0.860 -4.361 1.00 74.14 H new ATOM 2506 N VAL B 46 15.394 2.553 0.876 1.00 44.44 N ATOM 2507 CA VAL B 46 15.016 3.219 2.131 1.00 1.10 C ATOM 2508 C VAL B 46 16.289 3.691 2.877 1.00 13.30 C ATOM 2509 O VAL B 46 17.262 2.930 3.019 1.00 20.21 O ATOM 2510 CB VAL B 46 14.125 2.276 3.034 1.00 61.02 C ATOM 2511 CG1 VAL B 46 14.872 0.998 3.471 1.00 1.02 C ATOM 2512 CG2 VAL B 46 13.544 3.041 4.244 1.00 62.01 C ATOM 0 H VAL B 46 16.265 2.026 0.939 1.00 44.44 H new ATOM 0 HA VAL B 46 14.410 4.095 1.897 1.00 1.10 H new ATOM 0 HB VAL B 46 13.288 1.947 2.417 1.00 61.02 H new ATOM 0 HG11 VAL B 46 14.215 0.386 4.089 1.00 1.02 H new ATOM 0 HG12 VAL B 46 15.172 0.432 2.589 1.00 1.02 H new ATOM 0 HG13 VAL B 46 15.758 1.272 4.044 1.00 1.02 H new ATOM 0 HG21 VAL B 46 12.936 2.364 4.845 1.00 62.01 H new ATOM 0 HG22 VAL B 46 14.359 3.433 4.852 1.00 62.01 H new ATOM 0 HG23 VAL B 46 12.926 3.866 3.890 1.00 62.01 H new ATOM 2522 N THR B 47 16.290 4.964 3.313 1.00 11.23 N ATOM 2523 CA THR B 47 17.395 5.546 4.102 1.00 64.02 C ATOM 2524 C THR B 47 17.341 5.037 5.551 1.00 4.32 C ATOM 2525 O THR B 47 16.330 4.475 5.974 1.00 72.53 O ATOM 2526 CB THR B 47 17.333 7.110 4.094 1.00 43.31 C ATOM 2527 OG1 THR B 47 16.058 7.537 4.603 1.00 13.54 O ATOM 2528 CG2 THR B 47 17.550 7.684 2.682 1.00 4.21 C ATOM 0 H THR B 47 15.528 5.617 3.130 1.00 11.23 H new ATOM 0 HA THR B 47 18.333 5.234 3.642 1.00 64.02 H new ATOM 0 HB THR B 47 18.136 7.485 4.729 1.00 43.31 H new ATOM 0 HG1 THR B 47 16.190 8.045 5.431 1.00 13.54 H new ATOM 0 HG21 THR B 47 17.499 8.772 2.720 1.00 4.21 H new ATOM 0 HG22 THR B 47 18.529 7.379 2.312 1.00 4.21 H new ATOM 0 HG23 THR B 47 16.776 7.308 2.013 1.00 4.21 H new ATOM 2536 N SER B 48 18.428 5.263 6.300 1.00 70.01 N ATOM 2537 CA SER B 48 18.558 4.826 7.699 1.00 5.21 C ATOM 2538 C SER B 48 17.539 5.525 8.609 1.00 42.31 C ATOM 2539 O SER B 48 16.999 4.901 9.519 1.00 3.42 O ATOM 2540 CB SER B 48 19.993 5.078 8.194 1.00 33.51 C ATOM 2541 OG SER B 48 20.374 6.429 8.018 1.00 72.43 O ATOM 0 H SER B 48 19.249 5.758 5.951 1.00 70.01 H new ATOM 0 HA SER B 48 18.348 3.757 7.741 1.00 5.21 H new ATOM 0 HB2 SER B 48 20.067 4.813 9.249 1.00 33.51 H new ATOM 0 HB3 SER B 48 20.684 4.431 7.654 1.00 33.51 H new ATOM 0 HG SER B 48 21.290 6.556 8.344 1.00 72.43 H new ATOM 2547 N THR B 49 17.282 6.811 8.337 1.00 32.51 N ATOM 2548 CA THR B 49 16.345 7.634 9.112 1.00 61.15 C ATOM 2549 C THR B 49 14.898 7.104 8.993 1.00 1.55 C ATOM 2550 O THR B 49 14.214 6.919 10.006 1.00 74.25 O ATOM 2551 CB THR B 49 16.417 9.113 8.624 1.00 53.52 C ATOM 2552 OG1 THR B 49 16.264 9.150 7.193 1.00 32.30 O ATOM 2553 CG2 THR B 49 17.748 9.778 9.011 1.00 44.44 C ATOM 0 H THR B 49 17.722 7.313 7.566 1.00 32.51 H new ATOM 0 HA THR B 49 16.633 7.582 10.162 1.00 61.15 H new ATOM 0 HB THR B 49 15.612 9.666 9.108 1.00 53.52 H new ATOM 0 HG1 THR B 49 16.307 10.079 6.883 1.00 32.30 H new ATOM 0 HG21 THR B 49 17.758 10.807 8.653 1.00 44.44 H new ATOM 0 HG22 THR B 49 17.857 9.770 10.096 1.00 44.44 H new ATOM 0 HG23 THR B 49 18.574 9.229 8.560 1.00 44.44 H new ATOM 2561 N ILE B 50 14.459 6.847 7.744 1.00 0.32 N ATOM 2562 CA ILE B 50 13.098 6.362 7.458 1.00 1.20 C ATOM 2563 C ILE B 50 12.950 4.902 7.948 1.00 22.45 C ATOM 2564 O ILE B 50 11.980 4.579 8.637 1.00 3.52 O ATOM 2565 CB ILE B 50 12.756 6.477 5.922 1.00 22.14 C ATOM 2566 CG1 ILE B 50 12.858 7.959 5.424 1.00 73.14 C ATOM 2567 CG2 ILE B 50 11.360 5.888 5.597 1.00 5.34 C ATOM 2568 CD1 ILE B 50 11.887 8.937 6.077 1.00 73.52 C ATOM 0 H ILE B 50 15.036 6.970 6.912 1.00 0.32 H new ATOM 0 HA ILE B 50 12.388 6.991 7.995 1.00 1.20 H new ATOM 0 HB ILE B 50 13.499 5.885 5.387 1.00 22.14 H new ATOM 0 HG12 ILE B 50 13.874 8.313 5.596 1.00 73.14 H new ATOM 0 HG13 ILE B 50 12.693 7.975 4.347 1.00 73.14 H new ATOM 0 HG21 ILE B 50 11.163 5.987 4.530 1.00 5.34 H new ATOM 0 HG22 ILE B 50 11.336 4.834 5.874 1.00 5.34 H new ATOM 0 HG23 ILE B 50 10.598 6.428 6.158 1.00 5.34 H new ATOM 0 HD11 ILE B 50 12.040 9.933 5.662 1.00 73.52 H new ATOM 0 HD12 ILE B 50 10.863 8.617 5.884 1.00 73.52 H new ATOM 0 HD13 ILE B 50 12.063 8.961 7.152 1.00 73.52 H new ATOM 2580 N LEU B 51 13.959 4.049 7.620 1.00 30.31 N ATOM 2581 CA LEU B 51 13.972 2.608 7.991 1.00 13.21 C ATOM 2582 C LEU B 51 13.920 2.423 9.517 1.00 32.53 C ATOM 2583 O LEU B 51 13.259 1.500 10.004 1.00 33.44 O ATOM 2584 CB LEU B 51 15.227 1.876 7.418 1.00 61.41 C ATOM 2585 CG LEU B 51 15.294 0.329 7.669 1.00 4.01 C ATOM 2586 CD1 LEU B 51 14.072 -0.395 7.069 1.00 22.01 C ATOM 2587 CD2 LEU B 51 16.609 -0.279 7.140 1.00 64.21 C ATOM 0 H LEU B 51 14.782 4.340 7.093 1.00 30.31 H new ATOM 0 HA LEU B 51 13.080 2.163 7.550 1.00 13.21 H new ATOM 0 HB2 LEU B 51 15.266 2.052 6.343 1.00 61.41 H new ATOM 0 HB3 LEU B 51 16.118 2.333 7.849 1.00 61.41 H new ATOM 0 HG LEU B 51 15.273 0.181 8.749 1.00 4.01 H new ATOM 0 HD11 LEU B 51 14.152 -1.465 7.262 1.00 22.01 H new ATOM 0 HD12 LEU B 51 13.160 -0.011 7.527 1.00 22.01 H new ATOM 0 HD13 LEU B 51 14.038 -0.222 5.993 1.00 22.01 H new ATOM 0 HD21 LEU B 51 16.617 -1.352 7.333 1.00 64.21 H new ATOM 0 HD22 LEU B 51 16.686 -0.102 6.067 1.00 64.21 H new ATOM 0 HD23 LEU B 51 17.455 0.187 7.646 1.00 64.21 H new ATOM 2599 N GLU B 52 14.605 3.328 10.248 1.00 23.42 N ATOM 2600 CA GLU B 52 14.611 3.339 11.720 1.00 61.02 C ATOM 2601 C GLU B 52 13.174 3.431 12.246 1.00 75.41 C ATOM 2602 O GLU B 52 12.758 2.607 13.047 1.00 13.51 O ATOM 2603 CB GLU B 52 15.447 4.536 12.244 1.00 1.34 C ATOM 2604 CG GLU B 52 15.568 4.609 13.776 1.00 64.53 C ATOM 2605 CD GLU B 52 16.368 5.827 14.260 1.00 1.21 C ATOM 2606 OE1 GLU B 52 15.759 6.884 14.517 1.00 40.51 O ATOM 2607 OE2 GLU B 52 17.608 5.730 14.398 1.00 65.25 O ATOM 0 H GLU B 52 15.168 4.070 9.831 1.00 23.42 H new ATOM 0 HA GLU B 52 15.063 2.414 12.078 1.00 61.02 H new ATOM 0 HB2 GLU B 52 16.448 4.479 11.816 1.00 1.34 H new ATOM 0 HB3 GLU B 52 14.998 5.462 11.883 1.00 1.34 H new ATOM 0 HG2 GLU B 52 14.570 4.641 14.212 1.00 64.53 H new ATOM 0 HG3 GLU B 52 16.046 3.700 14.140 1.00 64.53 H new ATOM 2614 N LYS B 53 12.423 4.406 11.698 1.00 40.35 N ATOM 2615 CA LYS B 53 11.048 4.717 12.132 1.00 12.11 C ATOM 2616 C LYS B 53 10.051 3.625 11.719 1.00 65.23 C ATOM 2617 O LYS B 53 9.130 3.310 12.475 1.00 72.55 O ATOM 2618 CB LYS B 53 10.604 6.090 11.569 1.00 23.12 C ATOM 2619 CG LYS B 53 11.474 7.267 12.047 1.00 43.12 C ATOM 2620 CD LYS B 53 10.912 8.646 11.642 1.00 1.31 C ATOM 2621 CE LYS B 53 9.498 8.910 12.197 1.00 51.50 C ATOM 2622 NZ LYS B 53 9.170 10.361 12.194 1.00 51.21 N ATOM 0 H LYS B 53 12.755 5.002 10.939 1.00 40.35 H new ATOM 0 HA LYS B 53 11.053 4.759 13.221 1.00 12.11 H new ATOM 0 HB2 LYS B 53 10.628 6.051 10.480 1.00 23.12 H new ATOM 0 HB3 LYS B 53 9.569 6.274 11.858 1.00 23.12 H new ATOM 0 HG2 LYS B 53 11.566 7.224 13.132 1.00 43.12 H new ATOM 0 HG3 LYS B 53 12.478 7.157 11.638 1.00 43.12 H new ATOM 0 HD2 LYS B 53 11.586 9.425 11.997 1.00 1.31 H new ATOM 0 HD3 LYS B 53 10.888 8.717 10.555 1.00 1.31 H new ATOM 0 HE2 LYS B 53 8.765 8.370 11.598 1.00 51.50 H new ATOM 0 HE3 LYS B 53 9.427 8.523 13.213 1.00 51.50 H new ATOM 0 HZ1 LYS B 53 8.142 10.485 12.293 1.00 51.21 H new ATOM 0 HZ2 LYS B 53 9.653 10.828 12.988 1.00 51.21 H new ATOM 0 HZ3 LYS B 53 9.485 10.786 11.299 1.00 51.21 H new ATOM 2636 N VAL B 54 10.249 3.048 10.523 1.00 22.35 N ATOM 2637 CA VAL B 54 9.385 1.978 9.994 1.00 43.41 C ATOM 2638 C VAL B 54 9.484 0.726 10.891 1.00 31.45 C ATOM 2639 O VAL B 54 8.467 0.116 11.249 1.00 62.30 O ATOM 2640 CB VAL B 54 9.744 1.643 8.495 1.00 5.22 C ATOM 2641 CG1 VAL B 54 8.941 0.436 7.965 1.00 4.41 C ATOM 2642 CG2 VAL B 54 9.506 2.881 7.594 1.00 12.22 C ATOM 0 H VAL B 54 11.010 3.309 9.896 1.00 22.35 H new ATOM 0 HA VAL B 54 8.353 2.328 10.006 1.00 43.41 H new ATOM 0 HB VAL B 54 10.800 1.374 8.465 1.00 5.22 H new ATOM 0 HG11 VAL B 54 9.219 0.240 6.929 1.00 4.41 H new ATOM 0 HG12 VAL B 54 9.161 -0.442 8.572 1.00 4.41 H new ATOM 0 HG13 VAL B 54 7.875 0.656 8.019 1.00 4.41 H new ATOM 0 HG21 VAL B 54 9.758 2.634 6.563 1.00 12.22 H new ATOM 0 HG22 VAL B 54 8.458 3.176 7.651 1.00 12.22 H new ATOM 0 HG23 VAL B 54 10.134 3.705 7.934 1.00 12.22 H new ATOM 2652 N LEU B 55 10.720 0.397 11.292 1.00 12.03 N ATOM 2653 CA LEU B 55 10.991 -0.716 12.213 1.00 72.42 C ATOM 2654 C LEU B 55 10.570 -0.355 13.658 1.00 41.23 C ATOM 2655 O LEU B 55 10.132 -1.230 14.405 1.00 61.52 O ATOM 2656 CB LEU B 55 12.495 -1.104 12.154 1.00 2.01 C ATOM 2657 CG LEU B 55 13.012 -1.623 10.774 1.00 64.00 C ATOM 2658 CD1 LEU B 55 14.523 -1.927 10.828 1.00 42.51 C ATOM 2659 CD2 LEU B 55 12.206 -2.848 10.282 1.00 24.15 C ATOM 0 H LEU B 55 11.558 0.893 10.988 1.00 12.03 H new ATOM 0 HA LEU B 55 10.398 -1.576 11.901 1.00 72.42 H new ATOM 0 HB2 LEU B 55 13.086 -0.233 12.438 1.00 2.01 H new ATOM 0 HB3 LEU B 55 12.681 -1.874 12.903 1.00 2.01 H new ATOM 0 HG LEU B 55 12.857 -0.826 10.046 1.00 64.00 H new ATOM 0 HD11 LEU B 55 14.857 -2.287 9.855 1.00 42.51 H new ATOM 0 HD12 LEU B 55 15.068 -1.019 11.086 1.00 42.51 H new ATOM 0 HD13 LEU B 55 14.714 -2.691 11.582 1.00 42.51 H new ATOM 0 HD21 LEU B 55 12.597 -3.178 9.320 1.00 24.15 H new ATOM 0 HD22 LEU B 55 12.295 -3.657 11.007 1.00 24.15 H new ATOM 0 HD23 LEU B 55 11.157 -2.573 10.173 1.00 24.15 H new ATOM 2671 N ASP B 56 10.686 0.943 14.007 1.00 62.31 N ATOM 2672 CA ASP B 56 10.399 1.483 15.363 1.00 60.13 C ATOM 2673 C ASP B 56 8.906 1.375 15.713 1.00 64.23 C ATOM 2674 O ASP B 56 8.544 0.965 16.820 1.00 61.24 O ATOM 2675 CB ASP B 56 10.876 2.957 15.458 1.00 32.44 C ATOM 2676 CG ASP B 56 10.679 3.575 16.847 1.00 21.42 C ATOM 2677 OD1 ASP B 56 11.425 3.191 17.777 1.00 10.14 O ATOM 2678 OD2 ASP B 56 9.789 4.442 17.024 1.00 31.10 O ATOM 0 H ASP B 56 10.986 1.661 13.348 1.00 62.31 H new ATOM 0 HA ASP B 56 10.947 0.882 16.088 1.00 60.13 H new ATOM 0 HB2 ASP B 56 11.932 3.007 15.193 1.00 32.44 H new ATOM 0 HB3 ASP B 56 10.335 3.554 14.723 1.00 32.44 H new ATOM 2683 N TYR B 57 8.048 1.740 14.750 1.00 4.23 N ATOM 2684 CA TYR B 57 6.588 1.582 14.868 1.00 12.12 C ATOM 2685 C TYR B 57 6.222 0.093 15.054 1.00 64.01 C ATOM 2686 O TYR B 57 5.338 -0.256 15.844 1.00 72.03 O ATOM 2687 CB TYR B 57 5.889 2.148 13.601 1.00 61.34 C ATOM 2688 CG TYR B 57 4.370 1.920 13.575 1.00 31.44 C ATOM 2689 CD1 TYR B 57 3.507 2.767 14.262 1.00 72.42 C ATOM 2690 CD2 TYR B 57 3.813 0.823 12.902 1.00 50.51 C ATOM 2691 CE1 TYR B 57 2.152 2.532 14.285 1.00 1.42 C ATOM 2692 CE2 TYR B 57 2.456 0.594 12.914 1.00 75.02 C ATOM 2693 CZ TYR B 57 1.630 1.448 13.612 1.00 65.23 C ATOM 2694 OH TYR B 57 0.280 1.198 13.673 1.00 34.12 O ATOM 0 H TYR B 57 8.345 2.154 13.866 1.00 4.23 H new ATOM 0 HA TYR B 57 6.245 2.137 15.741 1.00 12.12 H new ATOM 0 HB2 TYR B 57 6.087 3.218 13.536 1.00 61.34 H new ATOM 0 HB3 TYR B 57 6.331 1.687 12.718 1.00 61.34 H new ATOM 0 HD1 TYR B 57 3.907 3.623 14.786 1.00 72.42 H new ATOM 0 HD2 TYR B 57 4.460 0.146 12.365 1.00 50.51 H new ATOM 0 HE1 TYR B 57 1.497 3.196 14.830 1.00 1.42 H new ATOM 0 HE2 TYR B 57 2.042 -0.249 12.380 1.00 75.02 H new ATOM 0 HH TYR B 57 0.118 0.409 14.232 1.00 34.12 H new ATOM 2704 N CYS B 58 6.902 -0.762 14.288 1.00 3.34 N ATOM 2705 CA CYS B 58 6.714 -2.213 14.334 1.00 1.32 C ATOM 2706 C CYS B 58 7.218 -2.823 15.675 1.00 51.23 C ATOM 2707 O CYS B 58 6.704 -3.861 16.113 1.00 41.53 O ATOM 2708 CB CYS B 58 7.388 -2.838 13.105 1.00 33.11 C ATOM 2709 SG CYS B 58 6.684 -2.291 11.534 1.00 24.01 S ATOM 0 H CYS B 58 7.605 -0.464 13.612 1.00 3.34 H new ATOM 0 HA CYS B 58 5.649 -2.443 14.299 1.00 1.32 H new ATOM 0 HB2 CYS B 58 8.450 -2.595 13.121 1.00 33.11 H new ATOM 0 HB3 CYS B 58 7.308 -3.923 13.170 1.00 33.11 H new ATOM 0 HG CYS B 58 7.343 -1.258 11.099 1.00 24.01 H new ATOM 2715 N ARG B 59 8.231 -2.166 16.309 1.00 45.01 N ATOM 2716 CA ARG B 59 8.693 -2.519 17.679 1.00 44.24 C ATOM 2717 C ARG B 59 7.537 -2.387 18.689 1.00 63.21 C ATOM 2718 O ARG B 59 7.404 -3.210 19.586 1.00 23.35 O ATOM 2719 CB ARG B 59 9.878 -1.625 18.157 1.00 0.53 C ATOM 2720 CG ARG B 59 11.187 -1.773 17.361 1.00 65.55 C ATOM 2721 CD ARG B 59 12.284 -0.808 17.857 1.00 54.04 C ATOM 2722 NE ARG B 59 13.487 -0.847 17.010 1.00 10.13 N ATOM 2723 CZ ARG B 59 14.729 -1.142 17.428 1.00 12.41 C ATOM 2724 NH1 ARG B 59 14.966 -1.442 18.709 1.00 2.12 N ATOM 2725 NH2 ARG B 59 15.739 -1.116 16.566 1.00 72.13 N ATOM 0 H ARG B 59 8.742 -1.389 15.890 1.00 45.01 H new ATOM 0 HA ARG B 59 9.040 -3.551 17.631 1.00 44.24 H new ATOM 0 HB2 ARG B 59 9.563 -0.582 18.113 1.00 0.53 H new ATOM 0 HB3 ARG B 59 10.082 -1.853 19.203 1.00 0.53 H new ATOM 0 HG2 ARG B 59 11.545 -2.799 17.442 1.00 65.55 H new ATOM 0 HG3 ARG B 59 10.991 -1.586 16.305 1.00 65.55 H new ATOM 0 HD2 ARG B 59 11.889 0.208 17.877 1.00 54.04 H new ATOM 0 HD3 ARG B 59 12.555 -1.065 18.881 1.00 54.04 H new ATOM 0 HE ARG B 59 13.367 -0.631 16.020 1.00 10.13 H new ATOM 0 HH11 ARG B 59 14.199 -1.449 19.382 1.00 2.12 H new ATOM 0 HH12 ARG B 59 15.914 -1.664 19.014 1.00 2.12 H new ATOM 0 HH21 ARG B 59 15.570 -0.873 15.590 1.00 72.13 H new ATOM 0 HH22 ARG B 59 16.683 -1.339 16.880 1.00 72.13 H new ATOM 2739 N HIS B 60 6.719 -1.329 18.514 1.00 64.53 N ATOM 2740 CA HIS B 60 5.518 -1.073 19.344 1.00 11.44 C ATOM 2741 C HIS B 60 4.514 -2.233 19.245 1.00 11.15 C ATOM 2742 O HIS B 60 3.856 -2.570 20.223 1.00 11.13 O ATOM 2743 CB HIS B 60 4.849 0.265 18.922 1.00 32.13 C ATOM 2744 CG HIS B 60 3.594 0.643 19.675 1.00 25.32 C ATOM 2745 ND1 HIS B 60 3.608 1.252 20.906 1.00 13.31 N ATOM 2746 CD2 HIS B 60 2.285 0.517 19.341 1.00 32.43 C ATOM 2747 CE1 HIS B 60 2.370 1.492 21.292 1.00 33.14 C ATOM 2748 NE2 HIS B 60 1.544 1.055 20.362 1.00 22.21 N ATOM 0 H HIS B 60 6.871 -0.625 17.792 1.00 64.53 H new ATOM 0 HA HIS B 60 5.835 -0.996 20.384 1.00 11.44 H new ATOM 0 HB2 HIS B 60 5.577 1.067 19.043 1.00 32.13 H new ATOM 0 HB3 HIS B 60 4.609 0.210 17.860 1.00 32.13 H new ATOM 0 HD2 HIS B 60 1.897 0.074 18.436 1.00 32.43 H new ATOM 0 HE1 HIS B 60 2.081 1.968 22.217 1.00 33.14 H new ATOM 0 HE2 HIS B 60 0.526 1.108 20.396 1.00 22.21 H new ATOM 2757 N HIS B 61 4.410 -2.825 18.046 1.00 73.34 N ATOM 2758 CA HIS B 61 3.502 -3.962 17.773 1.00 61.30 C ATOM 2759 C HIS B 61 4.082 -5.299 18.282 1.00 23.10 C ATOM 2760 O HIS B 61 3.341 -6.274 18.446 1.00 31.33 O ATOM 2761 CB HIS B 61 3.175 -4.022 16.258 1.00 2.01 C ATOM 2762 CG HIS B 61 2.175 -2.982 15.821 1.00 64.34 C ATOM 2763 ND1 HIS B 61 0.963 -3.301 15.243 1.00 21.43 N ATOM 2764 CD2 HIS B 61 2.192 -1.629 15.915 1.00 42.11 C ATOM 2765 CE1 HIS B 61 0.287 -2.199 15.000 1.00 55.13 C ATOM 2766 NE2 HIS B 61 1.008 -1.174 15.400 1.00 50.24 N ATOM 0 H HIS B 61 4.952 -2.532 17.233 1.00 73.34 H new ATOM 0 HA HIS B 61 2.576 -3.799 18.324 1.00 61.30 H new ATOM 0 HB2 HIS B 61 4.096 -3.892 15.689 1.00 2.01 H new ATOM 0 HB3 HIS B 61 2.788 -5.012 16.016 1.00 2.01 H new ATOM 0 HD1 HIS B 61 0.641 -4.246 15.036 1.00 21.43 H new ATOM 0 HD2 HIS B 61 2.990 -1.024 16.320 1.00 42.11 H new ATOM 0 HE1 HIS B 61 -0.693 -2.145 14.549 1.00 55.13 H new ATOM 2775 N HIS B 62 5.404 -5.344 18.504 1.00 5.34 N ATOM 2776 CA HIS B 62 6.083 -6.517 19.102 1.00 43.51 C ATOM 2777 C HIS B 62 5.974 -6.491 20.640 1.00 50.13 C ATOM 2778 O HIS B 62 5.648 -7.505 21.271 1.00 14.34 O ATOM 2779 CB HIS B 62 7.562 -6.538 18.646 1.00 42.33 C ATOM 2780 CG HIS B 62 8.416 -7.651 19.208 1.00 72.12 C ATOM 2781 ND1 HIS B 62 8.019 -8.973 19.258 1.00 24.34 N ATOM 2782 CD2 HIS B 62 9.667 -7.626 19.728 1.00 42.22 C ATOM 2783 CE1 HIS B 62 8.990 -9.702 19.778 1.00 10.02 C ATOM 2784 NE2 HIS B 62 9.996 -8.910 20.070 1.00 63.22 N ATOM 0 H HIS B 62 6.035 -4.575 18.277 1.00 5.34 H new ATOM 0 HA HIS B 62 5.594 -7.429 18.759 1.00 43.51 H new ATOM 0 HB2 HIS B 62 7.585 -6.604 17.558 1.00 42.33 H new ATOM 0 HB3 HIS B 62 8.018 -5.586 18.917 1.00 42.33 H new ATOM 0 HD2 HIS B 62 10.291 -6.753 19.850 1.00 42.22 H new ATOM 0 HE1 HIS B 62 8.961 -10.770 19.936 1.00 10.02 H new ATOM 0 HE2 HIS B 62 10.880 -9.204 20.485 1.00 63.22 H new ATOM 2793 N GLN B 63 6.252 -5.310 21.219 1.00 44.01 N ATOM 2794 CA GLN B 63 6.252 -5.089 22.683 1.00 74.24 C ATOM 2795 C GLN B 63 4.814 -4.993 23.224 1.00 73.31 C ATOM 2796 O GLN B 63 4.550 -5.321 24.383 1.00 73.41 O ATOM 2797 CB GLN B 63 7.043 -3.795 23.027 1.00 74.30 C ATOM 2798 CG GLN B 63 8.518 -3.808 22.572 1.00 43.30 C ATOM 2799 CD GLN B 63 9.290 -2.527 22.918 1.00 65.43 C ATOM 2800 OE1 GLN B 63 9.005 -1.857 23.915 1.00 40.30 O ATOM 2801 NE2 GLN B 63 10.273 -2.178 22.100 1.00 45.45 N ATOM 0 H GLN B 63 6.485 -4.474 20.684 1.00 44.01 H new ATOM 0 HA GLN B 63 6.738 -5.941 23.159 1.00 74.24 H new ATOM 0 HB2 GLN B 63 6.541 -2.944 22.567 1.00 74.30 H new ATOM 0 HB3 GLN B 63 7.010 -3.639 24.105 1.00 74.30 H new ATOM 0 HG2 GLN B 63 9.022 -4.659 23.031 1.00 43.30 H new ATOM 0 HG3 GLN B 63 8.553 -3.961 21.493 1.00 43.30 H new ATOM 0 HE21 GLN B 63 10.485 -2.752 21.284 1.00 45.45 H new ATOM 0 HE22 GLN B 63 10.817 -1.336 22.287 1.00 45.45 H new ATOM 2810 N HIS B 64 3.904 -4.503 22.370 1.00 74.42 N ATOM 2811 CA HIS B 64 2.461 -4.422 22.655 1.00 54.51 C ATOM 2812 C HIS B 64 1.704 -4.977 21.425 1.00 53.32 C ATOM 2813 O HIS B 64 1.458 -4.220 20.478 1.00 73.45 O ATOM 2814 CB HIS B 64 2.017 -2.952 22.947 1.00 10.20 C ATOM 2815 CG HIS B 64 2.729 -2.298 24.097 1.00 31.15 C ATOM 2816 ND1 HIS B 64 2.241 -2.301 25.380 1.00 34.44 N ATOM 2817 CD2 HIS B 64 3.905 -1.629 24.151 1.00 13.44 C ATOM 2818 CE1 HIS B 64 3.078 -1.670 26.169 1.00 34.04 C ATOM 2819 NE2 HIS B 64 4.098 -1.252 25.451 1.00 71.01 N ATOM 0 H HIS B 64 4.152 -4.146 21.447 1.00 74.42 H new ATOM 0 HA HIS B 64 2.232 -5.007 23.546 1.00 54.51 H new ATOM 0 HB2 HIS B 64 2.177 -2.353 22.050 1.00 10.20 H new ATOM 0 HB3 HIS B 64 0.946 -2.944 23.148 1.00 10.20 H new ATOM 0 HD2 HIS B 64 4.567 -1.430 23.321 1.00 13.44 H new ATOM 0 HE1 HIS B 64 2.951 -1.519 27.231 1.00 34.04 H new ATOM 0 HE2 HIS B 64 4.901 -0.732 25.806 1.00 71.01 H new ATOM 2828 N PRO B 65 1.398 -6.319 21.382 1.00 33.24 N ATOM 2829 CA PRO B 65 0.660 -6.950 20.249 1.00 75.34 C ATOM 2830 C PRO B 65 -0.694 -6.255 19.975 1.00 3.24 C ATOM 2831 O PRO B 65 -1.696 -6.501 20.661 1.00 43.33 O ATOM 2832 CB PRO B 65 0.488 -8.434 20.691 1.00 4.51 C ATOM 2833 CG PRO B 65 0.777 -8.442 22.167 1.00 3.53 C ATOM 2834 CD PRO B 65 1.776 -7.330 22.403 1.00 61.04 C ATOM 0 HA PRO B 65 1.196 -6.862 19.304 1.00 75.34 H new ATOM 0 HB2 PRO B 65 -0.521 -8.792 20.485 1.00 4.51 H new ATOM 0 HB3 PRO B 65 1.174 -9.087 20.152 1.00 4.51 H new ATOM 0 HG2 PRO B 65 -0.133 -8.277 22.744 1.00 3.53 H new ATOM 0 HG3 PRO B 65 1.183 -9.404 22.480 1.00 3.53 H new ATOM 0 HD2 PRO B 65 1.703 -6.929 23.414 1.00 61.04 H new ATOM 0 HD3 PRO B 65 2.802 -7.674 22.270 1.00 61.04 H new ATOM 2842 N GLY B 66 -0.671 -5.317 19.006 1.00 24.41 N ATOM 2843 CA GLY B 66 -1.823 -4.482 18.667 1.00 72.30 C ATOM 2844 C GLY B 66 -1.897 -3.217 19.523 1.00 11.02 C ATOM 2845 O GLY B 66 -2.034 -2.103 18.995 1.00 42.32 O ATOM 0 H GLY B 66 0.154 -5.123 18.439 1.00 24.41 H new ATOM 0 HA2 GLY B 66 -1.769 -4.203 17.615 1.00 72.30 H new ATOM 0 HA3 GLY B 66 -2.738 -5.060 18.797 1.00 72.30 H new ATOM 2849 N GLY B 67 -1.761 -3.390 20.855 1.00 43.44 N ATOM 2850 CA GLY B 67 -1.953 -2.300 21.812 1.00 65.53 C ATOM 2851 C GLY B 67 -3.436 -2.049 22.038 1.00 21.52 C ATOM 2852 O GLY B 67 -4.048 -2.715 22.876 1.00 44.23 O ATOM 0 H GLY B 67 -1.518 -4.282 21.285 1.00 43.44 H new ATOM 0 HA2 GLY B 67 -1.471 -2.549 22.758 1.00 65.53 H new ATOM 0 HA3 GLY B 67 -1.476 -1.393 21.440 1.00 65.53 H new ATOM 2856 N SER B 68 -4.003 -1.094 21.268 1.00 33.24 N ATOM 2857 CA SER B 68 -5.463 -0.841 21.179 1.00 5.23 C ATOM 2858 C SER B 68 -6.134 -0.468 22.529 1.00 64.53 C ATOM 2859 O SER B 68 -5.470 -0.328 23.565 1.00 75.54 O ATOM 2860 CB SER B 68 -6.164 -2.067 20.529 1.00 30.43 C ATOM 2861 OG SER B 68 -5.639 -2.332 19.233 1.00 71.44 O ATOM 0 H SER B 68 -3.453 -0.467 20.681 1.00 33.24 H new ATOM 0 HA SER B 68 -5.586 0.042 20.551 1.00 5.23 H new ATOM 0 HB2 SER B 68 -6.033 -2.943 21.164 1.00 30.43 H new ATOM 0 HB3 SER B 68 -7.236 -1.882 20.459 1.00 30.43 H new ATOM 0 HG SER B 68 -6.096 -3.108 18.847 1.00 71.44 H new ATOM 2867 N GLY B 69 -7.464 -0.251 22.474 1.00 24.01 N ATOM 2868 CA GLY B 69 -8.269 -0.011 23.668 1.00 44.14 C ATOM 2869 C GLY B 69 -9.574 0.687 23.327 1.00 14.04 C ATOM 2870 O GLY B 69 -10.186 0.406 22.286 1.00 1.10 O ATOM 0 H GLY B 69 -7.997 -0.239 21.605 1.00 24.01 H new ATOM 0 HA2 GLY B 69 -8.480 -0.959 24.162 1.00 44.14 H new ATOM 0 HA3 GLY B 69 -7.703 0.597 24.374 1.00 44.14 H new ATOM 2874 N LEU B 70 -10.007 1.591 24.218 1.00 13.42 N ATOM 2875 CA LEU B 70 -11.154 2.476 23.981 1.00 2.51 C ATOM 2876 C LEU B 70 -10.686 3.677 23.142 1.00 41.24 C ATOM 2877 O LEU B 70 -11.403 4.165 22.264 1.00 15.54 O ATOM 2878 CB LEU B 70 -11.759 2.943 25.334 1.00 70.23 C ATOM 2879 CG LEU B 70 -12.964 3.933 25.242 1.00 21.24 C ATOM 2880 CD1 LEU B 70 -14.169 3.297 24.512 1.00 5.30 C ATOM 2881 CD2 LEU B 70 -13.364 4.462 26.638 1.00 52.04 C ATOM 0 H LEU B 70 -9.568 1.728 25.128 1.00 13.42 H new ATOM 0 HA LEU B 70 -11.932 1.941 23.437 1.00 2.51 H new ATOM 0 HB2 LEU B 70 -12.081 2.061 25.889 1.00 70.23 H new ATOM 0 HB3 LEU B 70 -10.970 3.416 25.918 1.00 70.23 H new ATOM 0 HG LEU B 70 -12.640 4.787 24.647 1.00 21.24 H new ATOM 0 HD11 LEU B 70 -14.988 4.015 24.467 1.00 5.30 H new ATOM 0 HD12 LEU B 70 -13.875 3.018 23.500 1.00 5.30 H new ATOM 0 HD13 LEU B 70 -14.495 2.409 25.053 1.00 5.30 H new ATOM 0 HD21 LEU B 70 -14.205 5.148 26.540 1.00 52.04 H new ATOM 0 HD22 LEU B 70 -13.651 3.626 27.276 1.00 52.04 H new ATOM 0 HD23 LEU B 70 -12.519 4.986 27.085 1.00 52.04 H new ATOM 2893 N ASP B 71 -9.466 4.141 23.440 1.00 42.22 N ATOM 2894 CA ASP B 71 -8.764 5.162 22.656 1.00 33.24 C ATOM 2895 C ASP B 71 -7.553 4.509 21.982 1.00 34.40 C ATOM 2896 O ASP B 71 -6.587 4.126 22.650 1.00 23.43 O ATOM 2897 CB ASP B 71 -8.330 6.344 23.556 1.00 5.11 C ATOM 2898 CG ASP B 71 -7.611 7.449 22.761 1.00 13.11 C ATOM 2899 OD1 ASP B 71 -8.301 8.281 22.140 1.00 33.12 O ATOM 2900 OD2 ASP B 71 -6.362 7.494 22.752 1.00 63.31 O ATOM 0 H ASP B 71 -8.932 3.812 24.244 1.00 42.22 H new ATOM 0 HA ASP B 71 -9.431 5.566 21.894 1.00 33.24 H new ATOM 0 HB2 ASP B 71 -9.207 6.765 24.047 1.00 5.11 H new ATOM 0 HB3 ASP B 71 -7.670 5.976 24.342 1.00 5.11 H new ATOM 2905 N ASP B 72 -7.635 4.359 20.659 1.00 50.02 N ATOM 2906 CA ASP B 72 -6.573 3.745 19.826 1.00 12.43 C ATOM 2907 C ASP B 72 -5.579 4.784 19.290 1.00 22.52 C ATOM 2908 O ASP B 72 -4.939 4.554 18.257 1.00 60.53 O ATOM 2909 CB ASP B 72 -7.222 2.925 18.662 1.00 11.44 C ATOM 2910 CG ASP B 72 -7.643 1.513 19.091 1.00 50.13 C ATOM 2911 OD1 ASP B 72 -7.128 0.521 18.523 1.00 51.22 O ATOM 2912 OD2 ASP B 72 -8.494 1.388 20.004 1.00 20.44 O ATOM 0 H ASP B 72 -8.446 4.661 20.119 1.00 50.02 H new ATOM 0 HA ASP B 72 -5.997 3.070 20.459 1.00 12.43 H new ATOM 0 HB2 ASP B 72 -8.094 3.461 18.288 1.00 11.44 H new ATOM 0 HB3 ASP B 72 -6.514 2.853 17.836 1.00 11.44 H new ATOM 2917 N ILE B 73 -5.400 5.908 20.014 1.00 5.22 N ATOM 2918 CA ILE B 73 -4.343 6.894 19.706 1.00 30.34 C ATOM 2919 C ILE B 73 -3.371 6.985 20.912 1.00 72.14 C ATOM 2920 O ILE B 73 -3.541 7.840 21.790 1.00 42.42 O ATOM 2921 CB ILE B 73 -4.933 8.323 19.361 1.00 11.25 C ATOM 2922 CG1 ILE B 73 -6.035 8.245 18.252 1.00 64.34 C ATOM 2923 CG2 ILE B 73 -3.807 9.315 18.950 1.00 73.22 C ATOM 2924 CD1 ILE B 73 -5.556 7.753 16.890 1.00 34.11 C ATOM 0 H ILE B 73 -5.976 6.156 20.819 1.00 5.22 H new ATOM 0 HA ILE B 73 -3.810 6.554 18.818 1.00 30.34 H new ATOM 0 HB ILE B 73 -5.404 8.701 20.268 1.00 11.25 H new ATOM 0 HG12 ILE B 73 -6.830 7.585 18.599 1.00 64.34 H new ATOM 0 HG13 ILE B 73 -6.474 9.235 18.129 1.00 64.34 H new ATOM 0 HG21 ILE B 73 -4.244 10.286 18.719 1.00 73.22 H new ATOM 0 HG22 ILE B 73 -3.098 9.422 19.771 1.00 73.22 H new ATOM 0 HG23 ILE B 73 -3.288 8.933 18.071 1.00 73.22 H new ATOM 0 HD11 ILE B 73 -6.395 7.736 16.194 1.00 34.11 H new ATOM 0 HD12 ILE B 73 -4.784 8.423 16.512 1.00 34.11 H new ATOM 0 HD13 ILE B 73 -5.146 6.748 16.990 1.00 34.11 H new ATOM 2936 N PRO B 74 -2.364 6.047 21.023 1.00 65.23 N ATOM 2937 CA PRO B 74 -1.327 6.115 22.082 1.00 5.42 C ATOM 2938 C PRO B 74 -0.321 7.251 21.801 1.00 13.41 C ATOM 2939 O PRO B 74 -0.028 7.519 20.632 1.00 74.32 O ATOM 2940 CB PRO B 74 -0.645 4.708 22.023 1.00 40.22 C ATOM 2941 CG PRO B 74 -1.531 3.871 21.139 1.00 21.04 C ATOM 2942 CD PRO B 74 -2.159 4.846 20.174 1.00 2.30 C ATOM 0 HA PRO B 74 -1.737 6.336 23.067 1.00 5.42 H new ATOM 0 HB2 PRO B 74 0.364 4.777 21.616 1.00 40.22 H new ATOM 0 HB3 PRO B 74 -0.558 4.272 23.018 1.00 40.22 H new ATOM 0 HG2 PRO B 74 -0.956 3.110 20.612 1.00 21.04 H new ATOM 0 HG3 PRO B 74 -2.290 3.350 21.722 1.00 21.04 H new ATOM 0 HD2 PRO B 74 -1.507 5.055 19.326 1.00 2.30 H new ATOM 0 HD3 PRO B 74 -3.098 4.469 19.769 1.00 2.30 H new ATOM 2950 N PRO B 75 0.217 7.934 22.866 1.00 33.22 N ATOM 2951 CA PRO B 75 1.224 9.026 22.713 1.00 33.24 C ATOM 2952 C PRO B 75 2.403 8.671 21.770 1.00 22.44 C ATOM 2953 O PRO B 75 2.870 9.514 21.010 1.00 52.33 O ATOM 2954 CB PRO B 75 1.719 9.240 24.159 1.00 41.51 C ATOM 2955 CG PRO B 75 0.550 8.862 25.022 1.00 4.52 C ATOM 2956 CD PRO B 75 -0.143 7.723 24.301 1.00 33.24 C ATOM 0 HA PRO B 75 0.787 9.910 22.249 1.00 33.24 H new ATOM 0 HB2 PRO B 75 2.588 8.619 24.376 1.00 41.51 H new ATOM 0 HB3 PRO B 75 2.017 10.275 24.327 1.00 41.51 H new ATOM 0 HG2 PRO B 75 0.880 8.554 26.014 1.00 4.52 H new ATOM 0 HG3 PRO B 75 -0.125 9.707 25.158 1.00 4.52 H new ATOM 0 HD2 PRO B 75 0.202 6.754 24.661 1.00 33.24 H new ATOM 0 HD3 PRO B 75 -1.222 7.753 24.451 1.00 33.24 H new ATOM 2964 N TYR B 76 2.827 7.396 21.829 1.00 2.30 N ATOM 2965 CA TYR B 76 3.922 6.833 21.011 1.00 21.12 C ATOM 2966 C TYR B 76 3.635 6.999 19.500 1.00 32.35 C ATOM 2967 O TYR B 76 4.430 7.590 18.762 1.00 54.13 O ATOM 2968 CB TYR B 76 4.085 5.320 21.366 1.00 22.12 C ATOM 2969 CG TYR B 76 5.287 4.605 20.723 1.00 74.34 C ATOM 2970 CD1 TYR B 76 5.257 4.165 19.390 1.00 14.23 C ATOM 2971 CD2 TYR B 76 6.448 4.346 21.458 1.00 2.52 C ATOM 2972 CE1 TYR B 76 6.330 3.505 18.826 1.00 63.45 C ATOM 2973 CE2 TYR B 76 7.520 3.688 20.896 1.00 24.24 C ATOM 2974 CZ TYR B 76 7.459 3.270 19.586 1.00 64.45 C ATOM 2975 OH TYR B 76 8.527 2.603 19.041 1.00 62.01 O ATOM 0 H TYR B 76 2.410 6.711 22.460 1.00 2.30 H new ATOM 0 HA TYR B 76 4.844 7.371 21.231 1.00 21.12 H new ATOM 0 HB2 TYR B 76 4.169 5.228 22.449 1.00 22.12 H new ATOM 0 HB3 TYR B 76 3.175 4.797 21.071 1.00 22.12 H new ATOM 0 HD1 TYR B 76 4.375 4.347 18.793 1.00 14.23 H new ATOM 0 HD2 TYR B 76 6.506 4.668 22.487 1.00 2.52 H new ATOM 0 HE1 TYR B 76 6.287 3.175 17.799 1.00 63.45 H new ATOM 0 HE2 TYR B 76 8.407 3.500 21.483 1.00 24.24 H new ATOM 0 HH TYR B 76 8.227 2.082 18.267 1.00 62.01 H new ATOM 2985 N ASP B 77 2.481 6.469 19.082 1.00 11.44 N ATOM 2986 CA ASP B 77 2.058 6.399 17.669 1.00 61.15 C ATOM 2987 C ASP B 77 1.635 7.790 17.160 1.00 41.11 C ATOM 2988 O ASP B 77 1.750 8.095 15.968 1.00 13.22 O ATOM 2989 CB ASP B 77 0.896 5.377 17.528 1.00 52.14 C ATOM 2990 CG ASP B 77 1.246 3.988 18.111 1.00 43.52 C ATOM 2991 OD1 ASP B 77 1.454 3.022 17.347 1.00 41.30 O ATOM 2992 OD2 ASP B 77 1.332 3.873 19.355 1.00 1.32 O ATOM 0 H ASP B 77 1.798 6.067 19.724 1.00 11.44 H new ATOM 0 HA ASP B 77 2.897 6.065 17.058 1.00 61.15 H new ATOM 0 HB2 ASP B 77 0.012 5.766 18.034 1.00 52.14 H new ATOM 0 HB3 ASP B 77 0.639 5.269 16.474 1.00 52.14 H new ATOM 2997 N ARG B 78 1.155 8.620 18.099 1.00 33.11 N ATOM 2998 CA ARG B 78 0.767 10.018 17.848 1.00 15.42 C ATOM 2999 C ARG B 78 2.014 10.867 17.510 1.00 13.22 C ATOM 3000 O ARG B 78 1.991 11.698 16.594 1.00 12.15 O ATOM 3001 CB ARG B 78 0.039 10.565 19.108 1.00 21.14 C ATOM 3002 CG ARG B 78 -0.583 11.968 18.958 1.00 41.13 C ATOM 3003 CD ARG B 78 -1.236 12.454 20.267 1.00 41.24 C ATOM 3004 NE ARG B 78 -1.905 13.754 20.116 1.00 61.42 N ATOM 3005 CZ ARG B 78 -2.172 14.620 21.111 1.00 11.34 C ATOM 3006 NH1 ARG B 78 -1.820 14.361 22.372 1.00 13.10 N ATOM 3007 NH2 ARG B 78 -2.817 15.743 20.834 1.00 42.13 N ATOM 0 H ARG B 78 1.023 8.335 19.069 1.00 33.11 H new ATOM 0 HA ARG B 78 0.092 10.072 16.994 1.00 15.42 H new ATOM 0 HB2 ARG B 78 -0.749 9.865 19.383 1.00 21.14 H new ATOM 0 HB3 ARG B 78 0.749 10.588 19.935 1.00 21.14 H new ATOM 0 HG2 ARG B 78 0.188 12.676 18.653 1.00 41.13 H new ATOM 0 HG3 ARG B 78 -1.331 11.950 18.165 1.00 41.13 H new ATOM 0 HD2 ARG B 78 -1.961 11.713 20.604 1.00 41.24 H new ATOM 0 HD3 ARG B 78 -0.474 12.530 21.043 1.00 41.24 H new ATOM 0 HE ARG B 78 -2.192 14.023 19.175 1.00 61.42 H new ATOM 0 HH11 ARG B 78 -1.338 13.491 22.598 1.00 13.10 H new ATOM 0 HH12 ARG B 78 -2.033 15.033 23.109 1.00 13.10 H new ATOM 0 HH21 ARG B 78 -3.105 15.943 19.876 1.00 42.13 H new ATOM 0 HH22 ARG B 78 -3.026 16.408 21.579 1.00 42.13 H new ATOM 3021 N ASP B 79 3.106 10.619 18.256 1.00 70.04 N ATOM 3022 CA ASP B 79 4.407 11.289 18.036 1.00 42.43 C ATOM 3023 C ASP B 79 5.144 10.688 16.830 1.00 10.41 C ATOM 3024 O ASP B 79 5.991 11.355 16.239 1.00 23.24 O ATOM 3025 CB ASP B 79 5.306 11.226 19.304 1.00 25.32 C ATOM 3026 CG ASP B 79 4.813 12.129 20.453 1.00 63.31 C ATOM 3027 OD1 ASP B 79 4.557 13.321 20.211 1.00 22.04 O ATOM 3028 OD2 ASP B 79 4.717 11.676 21.606 1.00 4.20 O ATOM 0 H ASP B 79 3.115 9.951 19.027 1.00 70.04 H new ATOM 0 HA ASP B 79 4.195 12.337 17.824 1.00 42.43 H new ATOM 0 HB2 ASP B 79 5.352 10.196 19.656 1.00 25.32 H new ATOM 0 HB3 ASP B 79 6.322 11.516 19.035 1.00 25.32 H new ATOM 3033 N PHE B 80 4.834 9.420 16.485 1.00 10.00 N ATOM 3034 CA PHE B 80 5.344 8.766 15.256 1.00 4.05 C ATOM 3035 C PHE B 80 4.826 9.509 14.005 1.00 23.23 C ATOM 3036 O PHE B 80 5.542 9.643 12.998 1.00 31.12 O ATOM 3037 CB PHE B 80 4.936 7.260 15.219 1.00 20.23 C ATOM 3038 CG PHE B 80 5.322 6.536 13.927 1.00 0.14 C ATOM 3039 CD1 PHE B 80 6.648 6.200 13.671 1.00 31.11 C ATOM 3040 CD2 PHE B 80 4.364 6.224 12.955 1.00 51.11 C ATOM 3041 CE1 PHE B 80 7.003 5.580 12.492 1.00 50.43 C ATOM 3042 CE2 PHE B 80 4.724 5.595 11.777 1.00 15.14 C ATOM 3043 CZ PHE B 80 6.047 5.278 11.544 1.00 41.42 C ATOM 0 H PHE B 80 4.227 8.822 17.045 1.00 10.00 H new ATOM 0 HA PHE B 80 6.433 8.815 15.262 1.00 4.05 H new ATOM 0 HB2 PHE B 80 5.401 6.748 16.062 1.00 20.23 H new ATOM 0 HB3 PHE B 80 3.857 7.184 15.356 1.00 20.23 H new ATOM 0 HD1 PHE B 80 7.408 6.428 14.404 1.00 31.11 H new ATOM 0 HD2 PHE B 80 3.329 6.478 13.128 1.00 51.11 H new ATOM 0 HE1 PHE B 80 8.037 5.329 12.309 1.00 50.43 H new ATOM 0 HE2 PHE B 80 3.972 5.352 11.041 1.00 15.14 H new ATOM 0 HZ PHE B 80 6.333 4.795 10.622 1.00 41.42 H new ATOM 3053 N CYS B 81 3.575 10.002 14.105 1.00 73.11 N ATOM 3054 CA CYS B 81 2.908 10.754 13.032 1.00 62.40 C ATOM 3055 C CYS B 81 3.522 12.159 12.820 1.00 54.31 C ATOM 3056 O CYS B 81 3.145 12.852 11.865 1.00 72.40 O ATOM 3057 CB CYS B 81 1.398 10.853 13.331 1.00 70.30 C ATOM 3058 SG CYS B 81 0.568 9.250 13.404 1.00 60.43 S ATOM 0 H CYS B 81 2.999 9.887 14.939 1.00 73.11 H new ATOM 0 HA CYS B 81 3.060 10.209 12.100 1.00 62.40 H new ATOM 0 HB2 CYS B 81 1.257 11.369 14.281 1.00 70.30 H new ATOM 0 HB3 CYS B 81 0.923 11.464 12.563 1.00 70.30 H new ATOM 0 HG CYS B 81 0.832 8.676 14.540 1.00 60.43 H new ATOM 3064 N LYS B 82 4.451 12.583 13.710 1.00 34.22 N ATOM 3065 CA LYS B 82 5.245 13.807 13.509 1.00 1.12 C ATOM 3066 C LYS B 82 6.287 13.578 12.401 1.00 62.42 C ATOM 3067 O LYS B 82 7.410 13.126 12.653 1.00 44.44 O ATOM 3068 CB LYS B 82 5.926 14.279 14.832 1.00 4.25 C ATOM 3069 CG LYS B 82 4.993 15.027 15.806 1.00 0.11 C ATOM 3070 CD LYS B 82 4.416 16.320 15.178 1.00 3.43 C ATOM 3071 CE LYS B 82 3.567 17.138 16.157 1.00 63.25 C ATOM 3072 NZ LYS B 82 2.470 16.332 16.758 1.00 40.01 N ATOM 0 H LYS B 82 4.665 12.089 14.576 1.00 34.22 H new ATOM 0 HA LYS B 82 4.569 14.604 13.199 1.00 1.12 H new ATOM 0 HB2 LYS B 82 6.339 13.409 15.342 1.00 4.25 H new ATOM 0 HB3 LYS B 82 6.764 14.929 14.581 1.00 4.25 H new ATOM 0 HG2 LYS B 82 4.174 14.370 16.100 1.00 0.11 H new ATOM 0 HG3 LYS B 82 5.542 15.278 16.713 1.00 0.11 H new ATOM 0 HD2 LYS B 82 5.237 16.938 14.815 1.00 3.43 H new ATOM 0 HD3 LYS B 82 3.808 16.056 14.312 1.00 3.43 H new ATOM 0 HE2 LYS B 82 4.205 17.529 16.950 1.00 63.25 H new ATOM 0 HE3 LYS B 82 3.142 17.997 15.637 1.00 63.25 H new ATOM 0 HZ1 LYS B 82 1.852 16.951 17.320 1.00 40.01 H new ATOM 0 HZ2 LYS B 82 1.915 15.883 16.002 1.00 40.01 H new ATOM 0 HZ3 LYS B 82 2.875 15.598 17.373 1.00 40.01 H new ATOM 3086 N VAL B 83 5.845 13.818 11.162 1.00 3.02 N ATOM 3087 CA VAL B 83 6.680 13.776 9.955 1.00 22.24 C ATOM 3088 C VAL B 83 6.308 14.968 9.051 1.00 23.33 C ATOM 3089 O VAL B 83 5.143 15.391 9.019 1.00 14.42 O ATOM 3090 CB VAL B 83 6.511 12.405 9.175 1.00 32.43 C ATOM 3091 CG1 VAL B 83 7.309 11.270 9.847 1.00 21.42 C ATOM 3092 CG2 VAL B 83 5.027 11.999 9.048 1.00 74.13 C ATOM 0 H VAL B 83 4.872 14.053 10.965 1.00 3.02 H new ATOM 0 HA VAL B 83 7.728 13.847 10.248 1.00 22.24 H new ATOM 0 HB VAL B 83 6.910 12.565 8.174 1.00 32.43 H new ATOM 0 HG11 VAL B 83 7.170 10.346 9.286 1.00 21.42 H new ATOM 0 HG12 VAL B 83 8.368 11.529 9.863 1.00 21.42 H new ATOM 0 HG13 VAL B 83 6.954 11.131 10.868 1.00 21.42 H new ATOM 0 HG21 VAL B 83 4.953 11.055 8.508 1.00 74.13 H new ATOM 0 HG22 VAL B 83 4.595 11.883 10.042 1.00 74.13 H new ATOM 0 HG23 VAL B 83 4.484 12.772 8.504 1.00 74.13 H new ATOM 3102 N ASP B 84 7.314 15.521 8.355 1.00 23.42 N ATOM 3103 CA ASP B 84 7.131 16.623 7.381 1.00 45.41 C ATOM 3104 C ASP B 84 6.301 16.117 6.177 1.00 14.21 C ATOM 3105 O ASP B 84 6.251 14.907 5.947 1.00 3.34 O ATOM 3106 CB ASP B 84 8.533 17.147 6.944 1.00 53.43 C ATOM 3107 CG ASP B 84 8.505 18.358 5.993 1.00 15.25 C ATOM 3108 OD1 ASP B 84 9.313 18.412 5.046 1.00 53.22 O ATOM 3109 OD2 ASP B 84 7.667 19.265 6.187 1.00 60.23 O ATOM 0 H ASP B 84 8.284 15.219 8.448 1.00 23.42 H new ATOM 0 HA ASP B 84 6.583 17.450 7.833 1.00 45.41 H new ATOM 0 HB2 ASP B 84 9.098 17.417 7.836 1.00 53.43 H new ATOM 0 HB3 ASP B 84 9.073 16.334 6.458 1.00 53.43 H new ATOM 3114 N GLN B 85 5.652 17.034 5.423 1.00 4.40 N ATOM 3115 CA GLN B 85 4.647 16.673 4.377 1.00 52.15 C ATOM 3116 C GLN B 85 5.194 15.621 3.345 1.00 62.40 C ATOM 3117 O GLN B 85 4.510 14.611 3.103 1.00 30.45 O ATOM 3118 CB GLN B 85 4.072 17.967 3.704 1.00 64.20 C ATOM 3119 CG GLN B 85 2.712 17.815 2.968 1.00 43.24 C ATOM 3120 CD GLN B 85 2.771 17.091 1.613 1.00 34.34 C ATOM 3121 OE1 GLN B 85 3.771 17.145 0.891 1.00 74.44 O ATOM 3122 NE2 GLN B 85 1.691 16.417 1.249 1.00 14.15 N ATOM 0 H GLN B 85 5.803 18.039 5.515 1.00 4.40 H new ATOM 0 HA GLN B 85 3.816 16.167 4.868 1.00 52.15 H new ATOM 0 HB2 GLN B 85 3.961 18.732 4.473 1.00 64.20 H new ATOM 0 HB3 GLN B 85 4.808 18.337 2.990 1.00 64.20 H new ATOM 0 HG2 GLN B 85 2.024 17.275 3.619 1.00 43.24 H new ATOM 0 HG3 GLN B 85 2.290 18.808 2.812 1.00 43.24 H new ATOM 0 HE21 GLN B 85 0.877 16.387 1.863 1.00 14.15 H new ATOM 0 HE22 GLN B 85 1.673 15.927 0.354 1.00 14.15 H new ATOM 3131 N PRO B 86 6.422 15.804 2.725 1.00 4.04 N ATOM 3132 CA PRO B 86 7.057 14.739 1.892 1.00 25.44 C ATOM 3133 C PRO B 86 7.383 13.450 2.680 1.00 74.12 C ATOM 3134 O PRO B 86 7.304 12.352 2.130 1.00 61.11 O ATOM 3135 CB PRO B 86 8.349 15.414 1.349 1.00 31.43 C ATOM 3136 CG PRO B 86 8.601 16.569 2.264 1.00 22.30 C ATOM 3137 CD PRO B 86 7.240 17.051 2.694 1.00 75.14 C ATOM 0 HA PRO B 86 6.383 14.397 1.107 1.00 25.44 H new ATOM 0 HB2 PRO B 86 9.188 14.718 1.352 1.00 31.43 H new ATOM 0 HB3 PRO B 86 8.216 15.748 0.320 1.00 31.43 H new ATOM 0 HG2 PRO B 86 9.198 16.265 3.123 1.00 22.30 H new ATOM 0 HG3 PRO B 86 9.154 17.359 1.755 1.00 22.30 H new ATOM 0 HD2 PRO B 86 7.275 17.532 3.671 1.00 75.14 H new ATOM 0 HD3 PRO B 86 6.833 17.781 1.994 1.00 75.14 H new ATOM 3145 N THR B 87 7.732 13.603 3.967 1.00 52.32 N ATOM 3146 CA THR B 87 8.167 12.496 4.836 1.00 13.30 C ATOM 3147 C THR B 87 7.010 11.500 5.134 1.00 63.51 C ATOM 3148 O THR B 87 7.274 10.313 5.371 1.00 14.24 O ATOM 3149 CB THR B 87 8.799 13.045 6.156 1.00 30.43 C ATOM 3150 OG1 THR B 87 9.715 14.104 5.839 1.00 53.23 O ATOM 3151 CG2 THR B 87 9.545 11.964 6.958 1.00 24.12 C ATOM 0 H THR B 87 7.720 14.507 4.439 1.00 52.32 H new ATOM 0 HA THR B 87 8.933 11.938 4.298 1.00 13.30 H new ATOM 0 HB THR B 87 7.979 13.406 6.777 1.00 30.43 H new ATOM 0 HG1 THR B 87 10.100 14.462 6.666 1.00 53.23 H new ATOM 0 HG21 THR B 87 9.962 12.405 7.863 1.00 24.12 H new ATOM 0 HG22 THR B 87 8.851 11.168 7.229 1.00 24.12 H new ATOM 0 HG23 THR B 87 10.351 11.552 6.351 1.00 24.12 H new ATOM 3159 N LEU B 88 5.734 11.988 5.130 1.00 43.05 N ATOM 3160 CA LEU B 88 4.543 11.090 5.165 1.00 74.11 C ATOM 3161 C LEU B 88 4.621 10.068 4.010 1.00 54.42 C ATOM 3162 O LEU B 88 4.430 8.867 4.215 1.00 12.41 O ATOM 3163 CB LEU B 88 3.173 11.854 5.073 1.00 40.13 C ATOM 3164 CG LEU B 88 2.654 12.593 6.362 1.00 74.33 C ATOM 3165 CD1 LEU B 88 3.275 13.986 6.525 1.00 14.34 C ATOM 3166 CD2 LEU B 88 1.112 12.673 6.393 1.00 71.41 C ATOM 0 H LEU B 88 5.508 12.982 5.103 1.00 43.05 H new ATOM 0 HA LEU B 88 4.570 10.592 6.134 1.00 74.11 H new ATOM 0 HB2 LEU B 88 3.254 12.592 4.275 1.00 40.13 H new ATOM 0 HB3 LEU B 88 2.410 11.137 4.768 1.00 40.13 H new ATOM 0 HG LEU B 88 2.978 11.992 7.211 1.00 74.33 H new ATOM 0 HD11 LEU B 88 2.885 14.455 7.429 1.00 14.34 H new ATOM 0 HD12 LEU B 88 4.358 13.895 6.602 1.00 14.34 H new ATOM 0 HD13 LEU B 88 3.023 14.600 5.660 1.00 14.34 H new ATOM 0 HD21 LEU B 88 0.793 13.190 7.298 1.00 71.41 H new ATOM 0 HD22 LEU B 88 0.758 13.220 5.519 1.00 71.41 H new ATOM 0 HD23 LEU B 88 0.695 11.666 6.384 1.00 71.41 H new ATOM 3178 N PHE B 89 4.932 10.578 2.801 1.00 41.12 N ATOM 3179 CA PHE B 89 5.033 9.764 1.576 1.00 73.24 C ATOM 3180 C PHE B 89 6.250 8.833 1.617 1.00 35.02 C ATOM 3181 O PHE B 89 6.200 7.751 1.058 1.00 62.24 O ATOM 3182 CB PHE B 89 5.099 10.668 0.324 1.00 63.30 C ATOM 3183 CG PHE B 89 3.893 11.584 0.163 1.00 1.41 C ATOM 3184 CD1 PHE B 89 2.611 11.052 0.088 1.00 31.02 C ATOM 3185 CD2 PHE B 89 4.037 12.968 0.072 1.00 55.32 C ATOM 3186 CE1 PHE B 89 1.517 11.871 -0.070 1.00 63.34 C ATOM 3187 CE2 PHE B 89 2.941 13.784 -0.085 1.00 31.44 C ATOM 3188 CZ PHE B 89 1.679 13.238 -0.158 1.00 53.32 C ATOM 0 H PHE B 89 5.120 11.569 2.648 1.00 41.12 H new ATOM 0 HA PHE B 89 4.137 9.146 1.520 1.00 73.24 H new ATOM 0 HB2 PHE B 89 6.002 11.277 0.374 1.00 63.30 H new ATOM 0 HB3 PHE B 89 5.187 10.040 -0.562 1.00 63.30 H new ATOM 0 HD1 PHE B 89 2.472 9.983 0.155 1.00 31.02 H new ATOM 0 HD2 PHE B 89 5.023 13.405 0.126 1.00 55.32 H new ATOM 0 HE1 PHE B 89 0.527 11.442 -0.125 1.00 63.34 H new ATOM 0 HE2 PHE B 89 3.070 14.854 -0.151 1.00 31.44 H new ATOM 0 HZ PHE B 89 0.818 13.878 -0.284 1.00 53.32 H new ATOM 3198 N GLU B 90 7.332 9.268 2.287 1.00 71.32 N ATOM 3199 CA GLU B 90 8.547 8.443 2.466 1.00 61.22 C ATOM 3200 C GLU B 90 8.239 7.194 3.323 1.00 32.54 C ATOM 3201 O GLU B 90 8.794 6.117 3.080 1.00 55.35 O ATOM 3202 CB GLU B 90 9.688 9.269 3.114 1.00 74.13 C ATOM 3203 CG GLU B 90 10.105 10.529 2.327 1.00 51.55 C ATOM 3204 CD GLU B 90 10.599 10.241 0.892 1.00 42.32 C ATOM 3205 OE1 GLU B 90 11.808 9.953 0.717 1.00 52.44 O ATOM 3206 OE2 GLU B 90 9.794 10.316 -0.059 1.00 13.04 O ATOM 0 H GLU B 90 7.392 10.191 2.717 1.00 71.32 H new ATOM 0 HA GLU B 90 8.877 8.116 1.480 1.00 61.22 H new ATOM 0 HB2 GLU B 90 9.376 9.570 4.114 1.00 74.13 H new ATOM 0 HB3 GLU B 90 10.561 8.626 3.232 1.00 74.13 H new ATOM 0 HG2 GLU B 90 9.256 11.211 2.278 1.00 51.55 H new ATOM 0 HG3 GLU B 90 10.895 11.042 2.876 1.00 51.55 H new ATOM 3213 N LEU B 91 7.342 7.365 4.325 1.00 44.02 N ATOM 3214 CA LEU B 91 6.850 6.254 5.167 1.00 21.53 C ATOM 3215 C LEU B 91 5.910 5.326 4.364 1.00 65.54 C ATOM 3216 O LEU B 91 5.942 4.114 4.552 1.00 22.01 O ATOM 3217 CB LEU B 91 6.117 6.782 6.438 1.00 24.42 C ATOM 3218 CG LEU B 91 6.956 7.626 7.451 1.00 31.35 C ATOM 3219 CD1 LEU B 91 6.099 7.989 8.686 1.00 25.22 C ATOM 3220 CD2 LEU B 91 8.257 6.899 7.864 1.00 62.32 C ATOM 0 H LEU B 91 6.943 8.272 4.569 1.00 44.02 H new ATOM 0 HA LEU B 91 7.721 5.682 5.487 1.00 21.53 H new ATOM 0 HB2 LEU B 91 5.272 7.388 6.112 1.00 24.42 H new ATOM 0 HB3 LEU B 91 5.707 5.924 6.972 1.00 24.42 H new ATOM 0 HG LEU B 91 7.253 8.549 6.954 1.00 31.35 H new ATOM 0 HD11 LEU B 91 6.696 8.577 9.383 1.00 25.22 H new ATOM 0 HD12 LEU B 91 5.233 8.571 8.370 1.00 25.22 H new ATOM 0 HD13 LEU B 91 5.763 7.076 9.177 1.00 25.22 H new ATOM 0 HD21 LEU B 91 8.812 7.518 8.569 1.00 62.32 H new ATOM 0 HD22 LEU B 91 8.009 5.948 8.334 1.00 62.32 H new ATOM 0 HD23 LEU B 91 8.869 6.718 6.980 1.00 62.32 H new ATOM 3232 N ILE B 92 5.066 5.921 3.483 1.00 34.54 N ATOM 3233 CA ILE B 92 4.177 5.161 2.562 1.00 52.14 C ATOM 3234 C ILE B 92 5.014 4.307 1.580 1.00 62.04 C ATOM 3235 O ILE B 92 4.715 3.129 1.358 1.00 22.23 O ATOM 3236 CB ILE B 92 3.214 6.125 1.753 1.00 5.11 C ATOM 3237 CG1 ILE B 92 2.294 6.926 2.727 1.00 75.02 C ATOM 3238 CG2 ILE B 92 2.364 5.354 0.705 1.00 73.11 C ATOM 3239 CD1 ILE B 92 1.369 7.936 2.063 1.00 52.32 C ATOM 0 H ILE B 92 4.981 6.933 3.390 1.00 34.54 H new ATOM 0 HA ILE B 92 3.561 4.502 3.174 1.00 52.14 H new ATOM 0 HB ILE B 92 3.842 6.828 1.206 1.00 5.11 H new ATOM 0 HG12 ILE B 92 1.687 6.218 3.292 1.00 75.02 H new ATOM 0 HG13 ILE B 92 2.923 7.451 3.446 1.00 75.02 H new ATOM 0 HG21 ILE B 92 1.719 6.054 0.174 1.00 73.11 H new ATOM 0 HG22 ILE B 92 3.025 4.859 -0.006 1.00 73.11 H new ATOM 0 HG23 ILE B 92 1.751 4.608 1.211 1.00 73.11 H new ATOM 0 HD11 ILE B 92 0.773 8.439 2.824 1.00 52.32 H new ATOM 0 HD12 ILE B 92 1.963 8.673 1.522 1.00 52.32 H new ATOM 0 HD13 ILE B 92 0.708 7.421 1.366 1.00 52.32 H new ATOM 3251 N LEU B 93 6.088 4.920 1.036 1.00 60.43 N ATOM 3252 CA LEU B 93 6.999 4.278 0.066 1.00 22.21 C ATOM 3253 C LEU B 93 7.759 3.110 0.718 1.00 71.32 C ATOM 3254 O LEU B 93 7.908 2.056 0.107 1.00 5.04 O ATOM 3255 CB LEU B 93 8.003 5.320 -0.525 1.00 21.11 C ATOM 3256 CG LEU B 93 7.403 6.388 -1.497 1.00 0.25 C ATOM 3257 CD1 LEU B 93 8.459 7.440 -1.895 1.00 73.20 C ATOM 3258 CD2 LEU B 93 6.781 5.723 -2.739 1.00 13.22 C ATOM 0 H LEU B 93 6.348 5.881 1.260 1.00 60.43 H new ATOM 0 HA LEU B 93 6.395 3.881 -0.750 1.00 22.21 H new ATOM 0 HB2 LEU B 93 8.481 5.842 0.304 1.00 21.11 H new ATOM 0 HB3 LEU B 93 8.786 4.778 -1.054 1.00 21.11 H new ATOM 0 HG LEU B 93 6.606 6.908 -0.965 1.00 0.25 H new ATOM 0 HD11 LEU B 93 8.011 8.168 -2.571 1.00 73.20 H new ATOM 0 HD12 LEU B 93 8.820 7.949 -1.001 1.00 73.20 H new ATOM 0 HD13 LEU B 93 9.293 6.947 -2.394 1.00 73.20 H new ATOM 0 HD21 LEU B 93 6.372 6.490 -3.396 1.00 13.22 H new ATOM 0 HD22 LEU B 93 7.547 5.159 -3.272 1.00 13.22 H new ATOM 0 HD23 LEU B 93 5.983 5.048 -2.429 1.00 13.22 H new ATOM 3270 N ALA B 94 8.213 3.322 1.968 1.00 11.23 N ATOM 3271 CA ALA B 94 8.970 2.317 2.741 1.00 44.15 C ATOM 3272 C ALA B 94 8.055 1.195 3.266 1.00 60.21 C ATOM 3273 O ALA B 94 8.486 0.047 3.389 1.00 32.25 O ATOM 3274 CB ALA B 94 9.710 2.999 3.893 1.00 53.40 C ATOM 0 H ALA B 94 8.065 4.197 2.472 1.00 11.23 H new ATOM 0 HA ALA B 94 9.697 1.853 2.075 1.00 44.15 H new ATOM 0 HB1 ALA B 94 10.267 2.253 4.460 1.00 53.40 H new ATOM 0 HB2 ALA B 94 10.401 3.741 3.493 1.00 53.40 H new ATOM 0 HB3 ALA B 94 8.990 3.490 4.548 1.00 53.40 H new ATOM 3280 N ALA B 95 6.791 1.542 3.579 1.00 2.24 N ATOM 3281 CA ALA B 95 5.782 0.570 4.045 1.00 33.54 C ATOM 3282 C ALA B 95 5.299 -0.324 2.892 1.00 61.54 C ATOM 3283 O ALA B 95 4.976 -1.481 3.108 1.00 12.04 O ATOM 3284 CB ALA B 95 4.594 1.288 4.691 1.00 32.32 C ATOM 0 H ALA B 95 6.442 2.498 3.516 1.00 2.24 H new ATOM 0 HA ALA B 95 6.255 -0.065 4.794 1.00 33.54 H new ATOM 0 HB1 ALA B 95 3.863 0.552 5.027 1.00 32.32 H new ATOM 0 HB2 ALA B 95 4.941 1.870 5.544 1.00 32.32 H new ATOM 0 HB3 ALA B 95 4.131 1.953 3.962 1.00 32.32 H new ATOM 3290 N ASN B 96 5.233 0.250 1.674 1.00 35.40 N ATOM 3291 CA ASN B 96 4.882 -0.491 0.440 1.00 61.22 C ATOM 3292 C ASN B 96 6.099 -1.319 -0.048 1.00 45.01 C ATOM 3293 O ASN B 96 5.942 -2.441 -0.547 1.00 23.13 O ATOM 3294 CB ASN B 96 4.396 0.510 -0.653 1.00 54.25 C ATOM 3295 CG ASN B 96 3.849 -0.149 -1.934 1.00 74.31 C ATOM 3296 OD1 ASN B 96 3.354 -1.275 -1.917 1.00 3.13 O ATOM 3297 ND2 ASN B 96 3.894 0.572 -3.046 1.00 31.24 N ATOM 0 H ASN B 96 5.421 1.240 1.515 1.00 35.40 H new ATOM 0 HA ASN B 96 4.069 -1.187 0.649 1.00 61.22 H new ATOM 0 HB2 ASN B 96 3.618 1.143 -0.226 1.00 54.25 H new ATOM 0 HB3 ASN B 96 5.226 1.163 -0.923 1.00 54.25 H new ATOM 0 HD21 ASN B 96 3.513 0.195 -3.914 1.00 31.24 H new ATOM 0 HD22 ASN B 96 4.310 1.503 -3.034 1.00 31.24 H new ATOM 3304 N TYR B 97 7.316 -0.752 0.142 1.00 4.22 N ATOM 3305 CA TYR B 97 8.600 -1.403 -0.226 1.00 1.45 C ATOM 3306 C TYR B 97 8.832 -2.666 0.626 1.00 61.02 C ATOM 3307 O TYR B 97 9.215 -3.715 0.101 1.00 64.41 O ATOM 3308 CB TYR B 97 9.796 -0.407 -0.059 1.00 63.04 C ATOM 3309 CG TYR B 97 11.193 -1.028 -0.268 1.00 33.02 C ATOM 3310 CD1 TYR B 97 12.137 -1.066 0.767 1.00 74.44 C ATOM 3311 CD2 TYR B 97 11.549 -1.616 -1.486 1.00 51.51 C ATOM 3312 CE1 TYR B 97 13.366 -1.664 0.599 1.00 53.12 C ATOM 3313 CE2 TYR B 97 12.790 -2.210 -1.659 1.00 43.43 C ATOM 3314 CZ TYR B 97 13.691 -2.233 -0.606 1.00 40.52 C ATOM 3315 OH TYR B 97 14.917 -2.836 -0.743 1.00 33.11 O ATOM 0 H TYR B 97 7.436 0.172 0.556 1.00 4.22 H new ATOM 0 HA TYR B 97 8.542 -1.697 -1.274 1.00 1.45 H new ATOM 0 HB2 TYR B 97 9.669 0.412 -0.767 1.00 63.04 H new ATOM 0 HB3 TYR B 97 9.753 0.026 0.941 1.00 63.04 H new ATOM 0 HD1 TYR B 97 11.895 -0.616 1.718 1.00 74.44 H new ATOM 0 HD2 TYR B 97 10.846 -1.607 -2.305 1.00 51.51 H new ATOM 0 HE1 TYR B 97 14.073 -1.685 1.415 1.00 53.12 H new ATOM 0 HE2 TYR B 97 13.053 -2.652 -2.609 1.00 43.43 H new ATOM 0 HH TYR B 97 15.005 -3.195 -1.651 1.00 33.11 H new ATOM 3325 N LEU B 98 8.609 -2.535 1.942 1.00 3.33 N ATOM 3326 CA LEU B 98 8.769 -3.636 2.910 1.00 52.23 C ATOM 3327 C LEU B 98 7.464 -4.446 3.051 1.00 13.04 C ATOM 3328 O LEU B 98 7.453 -5.505 3.700 1.00 73.32 O ATOM 3329 CB LEU B 98 9.218 -3.063 4.277 1.00 41.22 C ATOM 3330 CG LEU B 98 10.606 -2.351 4.296 1.00 3.43 C ATOM 3331 CD1 LEU B 98 10.950 -1.846 5.712 1.00 3.44 C ATOM 3332 CD2 LEU B 98 11.714 -3.269 3.739 1.00 75.54 C ATOM 0 H LEU B 98 8.311 -1.658 2.369 1.00 3.33 H new ATOM 0 HA LEU B 98 9.536 -4.318 2.543 1.00 52.23 H new ATOM 0 HB2 LEU B 98 8.463 -2.354 4.617 1.00 41.22 H new ATOM 0 HB3 LEU B 98 9.239 -3.878 5.001 1.00 41.22 H new ATOM 0 HG LEU B 98 10.544 -1.482 3.641 1.00 3.43 H new ATOM 0 HD11 LEU B 98 11.922 -1.354 5.697 1.00 3.44 H new ATOM 0 HD12 LEU B 98 10.190 -1.137 6.040 1.00 3.44 H new ATOM 0 HD13 LEU B 98 10.981 -2.690 6.402 1.00 3.44 H new ATOM 0 HD21 LEU B 98 12.669 -2.744 3.766 1.00 75.54 H new ATOM 0 HD22 LEU B 98 11.779 -4.171 4.347 1.00 75.54 H new ATOM 0 HD23 LEU B 98 11.478 -3.541 2.710 1.00 75.54 H new ATOM 3344 N ASP B 99 6.385 -3.926 2.433 1.00 24.25 N ATOM 3345 CA ASP B 99 5.042 -4.544 2.401 1.00 12.51 C ATOM 3346 C ASP B 99 4.473 -4.722 3.831 1.00 72.04 C ATOM 3347 O ASP B 99 3.736 -5.672 4.124 1.00 24.53 O ATOM 3348 CB ASP B 99 5.070 -5.869 1.577 1.00 0.44 C ATOM 3349 CG ASP B 99 3.692 -6.401 1.125 1.00 23.13 C ATOM 3350 OD1 ASP B 99 3.615 -7.578 0.705 1.00 3.33 O ATOM 3351 OD2 ASP B 99 2.702 -5.641 1.107 1.00 12.01 O ATOM 0 H ASP B 99 6.423 -3.040 1.928 1.00 24.25 H new ATOM 0 HA ASP B 99 4.354 -3.872 1.888 1.00 12.51 H new ATOM 0 HB2 ASP B 99 5.688 -5.713 0.692 1.00 0.44 H new ATOM 0 HB3 ASP B 99 5.558 -6.638 2.175 1.00 0.44 H new ATOM 3356 N ILE B 100 4.830 -3.773 4.723 1.00 62.41 N ATOM 3357 CA ILE B 100 4.246 -3.677 6.069 1.00 4.53 C ATOM 3358 C ILE B 100 2.898 -2.952 5.949 1.00 60.20 C ATOM 3359 O ILE B 100 2.803 -1.735 6.114 1.00 35.22 O ATOM 3360 CB ILE B 100 5.187 -2.946 7.107 1.00 35.45 C ATOM 3361 CG1 ILE B 100 6.622 -3.549 7.048 1.00 5.23 C ATOM 3362 CG2 ILE B 100 4.599 -3.036 8.546 1.00 43.43 C ATOM 3363 CD1 ILE B 100 7.622 -2.964 8.031 1.00 44.53 C ATOM 0 H ILE B 100 5.529 -3.057 4.527 1.00 62.41 H new ATOM 0 HA ILE B 100 4.113 -4.686 6.460 1.00 4.53 H new ATOM 0 HB ILE B 100 5.247 -1.891 6.840 1.00 35.45 H new ATOM 0 HG12 ILE B 100 6.553 -4.623 7.224 1.00 5.23 H new ATOM 0 HG13 ILE B 100 7.011 -3.415 6.039 1.00 5.23 H new ATOM 0 HG21 ILE B 100 5.264 -2.526 9.243 1.00 43.43 H new ATOM 0 HG22 ILE B 100 3.617 -2.563 8.568 1.00 43.43 H new ATOM 0 HG23 ILE B 100 4.504 -4.083 8.835 1.00 43.43 H new ATOM 0 HD11 ILE B 100 8.587 -3.455 7.904 1.00 44.53 H new ATOM 0 HD12 ILE B 100 7.732 -1.895 7.846 1.00 44.53 H new ATOM 0 HD13 ILE B 100 7.266 -3.121 9.049 1.00 44.53 H new ATOM 3375 N LYS B 101 1.880 -3.741 5.571 1.00 40.53 N ATOM 3376 CA LYS B 101 0.495 -3.275 5.393 1.00 30.34 C ATOM 3377 C LYS B 101 -0.163 -2.750 6.711 1.00 52.21 C ATOM 3378 O LYS B 101 -0.998 -1.842 6.614 1.00 33.43 O ATOM 3379 CB LYS B 101 -0.362 -4.389 4.758 1.00 60.21 C ATOM 3380 CG LYS B 101 0.125 -4.852 3.364 1.00 74.31 C ATOM 3381 CD LYS B 101 -0.799 -5.933 2.759 1.00 61.40 C ATOM 3382 CE LYS B 101 -2.224 -5.406 2.520 1.00 45.15 C ATOM 3383 NZ LYS B 101 -3.174 -6.475 2.120 1.00 43.25 N ATOM 0 H LYS B 101 1.997 -4.736 5.377 1.00 40.53 H new ATOM 0 HA LYS B 101 0.538 -2.418 4.720 1.00 30.34 H new ATOM 0 HB2 LYS B 101 -0.375 -5.248 5.429 1.00 60.21 H new ATOM 0 HB3 LYS B 101 -1.390 -4.036 4.672 1.00 60.21 H new ATOM 0 HG2 LYS B 101 0.169 -3.995 2.692 1.00 74.31 H new ATOM 0 HG3 LYS B 101 1.138 -5.245 3.446 1.00 74.31 H new ATOM 0 HD2 LYS B 101 -0.379 -6.282 1.816 1.00 61.40 H new ATOM 0 HD3 LYS B 101 -0.838 -6.792 3.428 1.00 61.40 H new ATOM 0 HE2 LYS B 101 -2.586 -4.926 3.429 1.00 45.15 H new ATOM 0 HE3 LYS B 101 -2.198 -4.641 1.744 1.00 45.15 H new ATOM 0 HZ1 LYS B 101 -4.096 -6.052 1.890 1.00 43.25 H new ATOM 0 HZ2 LYS B 101 -2.804 -6.974 1.286 1.00 43.25 H new ATOM 0 HZ3 LYS B 101 -3.288 -7.149 2.904 1.00 43.25 H new ATOM 3397 N PRO B 102 0.143 -3.322 7.951 1.00 14.21 N ATOM 3398 CA PRO B 102 -0.219 -2.665 9.245 1.00 55.33 C ATOM 3399 C PRO B 102 0.178 -1.165 9.303 1.00 74.13 C ATOM 3400 O PRO B 102 -0.665 -0.316 9.591 1.00 13.24 O ATOM 3401 CB PRO B 102 0.561 -3.504 10.294 1.00 14.02 C ATOM 3402 CG PRO B 102 0.600 -4.882 9.707 1.00 22.23 C ATOM 3403 CD PRO B 102 0.734 -4.682 8.204 1.00 65.43 C ATOM 0 HA PRO B 102 -1.296 -2.651 9.409 1.00 55.33 H new ATOM 0 HB2 PRO B 102 1.565 -3.110 10.452 1.00 14.02 H new ATOM 0 HB3 PRO B 102 0.060 -3.497 11.262 1.00 14.02 H new ATOM 0 HG2 PRO B 102 1.440 -5.453 10.103 1.00 22.23 H new ATOM 0 HG3 PRO B 102 -0.306 -5.437 9.949 1.00 22.23 H new ATOM 0 HD2 PRO B 102 1.777 -4.727 7.889 1.00 65.43 H new ATOM 0 HD3 PRO B 102 0.201 -5.456 7.651 1.00 65.43 H new ATOM 3411 N LEU B 103 1.460 -0.860 9.000 1.00 31.21 N ATOM 3412 CA LEU B 103 1.979 0.529 9.011 1.00 2.04 C ATOM 3413 C LEU B 103 1.352 1.342 7.866 1.00 5.10 C ATOM 3414 O LEU B 103 0.961 2.496 8.070 1.00 74.04 O ATOM 3415 CB LEU B 103 3.534 0.524 8.925 1.00 15.04 C ATOM 3416 CG LEU B 103 4.291 1.866 9.287 1.00 43.11 C ATOM 3417 CD1 LEU B 103 5.733 1.574 9.736 1.00 30.55 C ATOM 3418 CD2 LEU B 103 4.304 2.888 8.126 1.00 70.43 C ATOM 0 H LEU B 103 2.157 -1.559 8.744 1.00 31.21 H new ATOM 0 HA LEU B 103 1.699 1.007 9.950 1.00 2.04 H new ATOM 0 HB2 LEU B 103 3.905 -0.260 9.586 1.00 15.04 H new ATOM 0 HB3 LEU B 103 3.814 0.244 7.909 1.00 15.04 H new ATOM 0 HG LEU B 103 3.733 2.316 10.108 1.00 43.11 H new ATOM 0 HD11 LEU B 103 6.235 2.510 9.980 1.00 30.55 H new ATOM 0 HD12 LEU B 103 5.717 0.931 10.616 1.00 30.55 H new ATOM 0 HD13 LEU B 103 6.271 1.073 8.931 1.00 30.55 H new ATOM 0 HD21 LEU B 103 4.838 3.786 8.438 1.00 70.43 H new ATOM 0 HD22 LEU B 103 4.804 2.450 7.262 1.00 70.43 H new ATOM 0 HD23 LEU B 103 3.280 3.149 7.859 1.00 70.43 H new ATOM 3430 N LEU B 104 1.256 0.713 6.672 1.00 44.12 N ATOM 3431 CA LEU B 104 0.721 1.346 5.445 1.00 5.22 C ATOM 3432 C LEU B 104 -0.682 1.925 5.682 1.00 40.45 C ATOM 3433 O LEU B 104 -0.932 3.091 5.373 1.00 63.31 O ATOM 3434 CB LEU B 104 0.669 0.308 4.287 1.00 44.14 C ATOM 3435 CG LEU B 104 0.035 0.782 2.935 1.00 75.13 C ATOM 3436 CD1 LEU B 104 0.851 1.924 2.295 1.00 33.50 C ATOM 3437 CD2 LEU B 104 -0.146 -0.406 1.965 1.00 53.31 C ATOM 0 H LEU B 104 1.549 -0.254 6.532 1.00 44.12 H new ATOM 0 HA LEU B 104 1.388 2.164 5.173 1.00 5.22 H new ATOM 0 HB2 LEU B 104 1.687 -0.026 4.085 1.00 44.14 H new ATOM 0 HB3 LEU B 104 0.112 -0.561 4.636 1.00 44.14 H new ATOM 0 HG LEU B 104 -0.954 1.184 3.153 1.00 75.13 H new ATOM 0 HD11 LEU B 104 0.381 2.227 1.359 1.00 33.50 H new ATOM 0 HD12 LEU B 104 0.883 2.774 2.976 1.00 33.50 H new ATOM 0 HD13 LEU B 104 1.866 1.579 2.097 1.00 33.50 H new ATOM 0 HD21 LEU B 104 -0.588 -0.051 1.034 1.00 53.31 H new ATOM 0 HD22 LEU B 104 0.824 -0.857 1.758 1.00 53.31 H new ATOM 0 HD23 LEU B 104 -0.802 -1.149 2.418 1.00 53.31 H new ATOM 3449 N ASP B 105 -1.556 1.094 6.277 1.00 24.22 N ATOM 3450 CA ASP B 105 -2.967 1.440 6.530 1.00 12.01 C ATOM 3451 C ASP B 105 -3.095 2.592 7.541 1.00 35.02 C ATOM 3452 O ASP B 105 -3.927 3.482 7.363 1.00 4.34 O ATOM 3453 CB ASP B 105 -3.754 0.196 7.017 1.00 0.23 C ATOM 3454 CG ASP B 105 -5.259 0.486 7.176 1.00 22.35 C ATOM 3455 OD1 ASP B 105 -5.953 0.625 6.144 1.00 31.10 O ATOM 3456 OD2 ASP B 105 -5.757 0.585 8.324 1.00 63.40 O ATOM 0 H ASP B 105 -1.303 0.159 6.597 1.00 24.22 H new ATOM 0 HA ASP B 105 -3.398 1.779 5.588 1.00 12.01 H new ATOM 0 HB2 ASP B 105 -3.616 -0.620 6.308 1.00 0.23 H new ATOM 0 HB3 ASP B 105 -3.347 -0.139 7.971 1.00 0.23 H new ATOM 3461 N VAL B 106 -2.252 2.570 8.582 1.00 23.13 N ATOM 3462 CA VAL B 106 -2.221 3.616 9.622 1.00 23.34 C ATOM 3463 C VAL B 106 -1.754 4.974 9.043 1.00 35.31 C ATOM 3464 O VAL B 106 -2.332 6.016 9.360 1.00 31.33 O ATOM 3465 CB VAL B 106 -1.321 3.160 10.831 1.00 32.43 C ATOM 3466 CG1 VAL B 106 -1.111 4.282 11.880 1.00 4.15 C ATOM 3467 CG2 VAL B 106 -1.928 1.897 11.494 1.00 71.34 C ATOM 0 H VAL B 106 -1.570 1.826 8.730 1.00 23.13 H new ATOM 0 HA VAL B 106 -3.236 3.761 9.992 1.00 23.34 H new ATOM 0 HB VAL B 106 -0.335 2.923 10.430 1.00 32.43 H new ATOM 0 HG11 VAL B 106 -0.483 3.910 12.690 1.00 4.15 H new ATOM 0 HG12 VAL B 106 -0.626 5.136 11.407 1.00 4.15 H new ATOM 0 HG13 VAL B 106 -2.076 4.590 12.282 1.00 4.15 H new ATOM 0 HG21 VAL B 106 -1.300 1.587 12.329 1.00 71.34 H new ATOM 0 HG22 VAL B 106 -2.930 2.123 11.858 1.00 71.34 H new ATOM 0 HG23 VAL B 106 -1.981 1.091 10.762 1.00 71.34 H new ATOM 3477 N THR B 107 -0.729 4.943 8.173 1.00 44.42 N ATOM 3478 CA THR B 107 -0.228 6.150 7.476 1.00 24.54 C ATOM 3479 C THR B 107 -1.249 6.627 6.407 1.00 30.13 C ATOM 3480 O THR B 107 -1.356 7.830 6.127 1.00 3.21 O ATOM 3481 CB THR B 107 1.182 5.889 6.843 1.00 52.04 C ATOM 3482 OG1 THR B 107 2.034 5.286 7.832 1.00 44.23 O ATOM 3483 CG2 THR B 107 1.860 7.181 6.342 1.00 21.32 C ATOM 0 H THR B 107 -0.225 4.090 7.932 1.00 44.42 H new ATOM 0 HA THR B 107 -0.114 6.947 8.211 1.00 24.54 H new ATOM 0 HB THR B 107 1.034 5.234 5.984 1.00 52.04 H new ATOM 0 HG1 THR B 107 1.698 4.392 8.052 1.00 44.23 H new ATOM 0 HG21 THR B 107 2.833 6.939 5.914 1.00 21.32 H new ATOM 0 HG22 THR B 107 1.235 7.648 5.581 1.00 21.32 H new ATOM 0 HG23 THR B 107 1.992 7.870 7.176 1.00 21.32 H new ATOM 3491 N CYS B 108 -2.019 5.668 5.848 1.00 44.43 N ATOM 3492 CA CYS B 108 -3.136 5.960 4.929 1.00 53.51 C ATOM 3493 C CYS B 108 -4.293 6.645 5.686 1.00 73.21 C ATOM 3494 O CYS B 108 -5.012 7.460 5.109 1.00 54.15 O ATOM 3495 CB CYS B 108 -3.632 4.680 4.219 1.00 23.40 C ATOM 3496 SG CYS B 108 -2.438 3.967 3.062 1.00 43.14 S ATOM 0 H CYS B 108 -1.882 4.672 6.022 1.00 44.43 H new ATOM 0 HA CYS B 108 -2.768 6.642 4.163 1.00 53.51 H new ATOM 0 HB2 CYS B 108 -3.882 3.933 4.973 1.00 23.40 H new ATOM 0 HB3 CYS B 108 -4.551 4.909 3.680 1.00 23.40 H new ATOM 0 HG CYS B 108 -1.484 3.385 3.726 1.00 43.14 H new ATOM 3502 N LYS B 109 -4.468 6.300 6.979 1.00 55.01 N ATOM 3503 CA LYS B 109 -5.421 6.993 7.871 1.00 54.04 C ATOM 3504 C LYS B 109 -4.915 8.416 8.183 1.00 10.34 C ATOM 3505 O LYS B 109 -5.704 9.351 8.189 1.00 11.24 O ATOM 3506 CB LYS B 109 -5.677 6.180 9.193 1.00 22.42 C ATOM 3507 CG LYS B 109 -6.961 5.308 9.197 1.00 74.44 C ATOM 3508 CD LYS B 109 -6.968 4.190 8.128 1.00 62.32 C ATOM 3509 CE LYS B 109 -8.218 3.297 8.222 1.00 63.55 C ATOM 3510 NZ LYS B 109 -8.174 2.171 7.251 1.00 44.33 N ATOM 0 H LYS B 109 -3.958 5.541 7.431 1.00 55.01 H new ATOM 0 HA LYS B 109 -6.377 7.067 7.353 1.00 54.04 H new ATOM 0 HB2 LYS B 109 -4.818 5.534 9.375 1.00 22.42 H new ATOM 0 HB3 LYS B 109 -5.731 6.881 10.026 1.00 22.42 H new ATOM 0 HG2 LYS B 109 -7.077 4.855 10.182 1.00 74.44 H new ATOM 0 HG3 LYS B 109 -7.826 5.953 9.039 1.00 74.44 H new ATOM 0 HD2 LYS B 109 -6.919 4.639 7.136 1.00 62.32 H new ATOM 0 HD3 LYS B 109 -6.076 3.575 8.244 1.00 62.32 H new ATOM 0 HE2 LYS B 109 -8.304 2.900 9.233 1.00 63.55 H new ATOM 0 HE3 LYS B 109 -9.108 3.899 8.039 1.00 63.55 H new ATOM 0 HZ1 LYS B 109 -8.860 2.343 6.489 1.00 44.33 H new ATOM 0 HZ2 LYS B 109 -7.219 2.098 6.847 1.00 44.33 H new ATOM 0 HZ3 LYS B 109 -8.412 1.283 7.738 1.00 44.33 H new ATOM 3524 N THR B 110 -3.592 8.557 8.416 1.00 54.33 N ATOM 3525 CA THR B 110 -2.948 9.851 8.733 1.00 11.01 C ATOM 3526 C THR B 110 -3.143 10.881 7.590 1.00 1.33 C ATOM 3527 O THR B 110 -3.539 12.028 7.847 1.00 23.05 O ATOM 3528 CB THR B 110 -1.420 9.654 9.032 1.00 43.01 C ATOM 3529 OG1 THR B 110 -1.261 8.670 10.064 1.00 65.31 O ATOM 3530 CG2 THR B 110 -0.718 10.960 9.471 1.00 5.11 C ATOM 0 H THR B 110 -2.938 7.774 8.390 1.00 54.33 H new ATOM 0 HA THR B 110 -3.433 10.245 9.626 1.00 11.01 H new ATOM 0 HB THR B 110 -0.952 9.329 8.103 1.00 43.01 H new ATOM 0 HG1 THR B 110 -1.551 7.796 9.730 1.00 65.31 H new ATOM 0 HG21 THR B 110 0.336 10.760 9.663 1.00 5.11 H new ATOM 0 HG22 THR B 110 -0.807 11.705 8.680 1.00 5.11 H new ATOM 0 HG23 THR B 110 -1.187 11.338 10.380 1.00 5.11 H new ATOM 3538 N VAL B 111 -2.899 10.449 6.334 1.00 1.11 N ATOM 3539 CA VAL B 111 -3.083 11.310 5.146 1.00 21.50 C ATOM 3540 C VAL B 111 -4.583 11.590 4.891 1.00 22.32 C ATOM 3541 O VAL B 111 -4.948 12.692 4.452 1.00 53.33 O ATOM 3542 CB VAL B 111 -2.397 10.717 3.852 1.00 44.30 C ATOM 3543 CG1 VAL B 111 -0.865 10.588 4.033 1.00 31.14 C ATOM 3544 CG2 VAL B 111 -3.014 9.368 3.433 1.00 45.13 C ATOM 0 H VAL B 111 -2.573 9.507 6.117 1.00 1.11 H new ATOM 0 HA VAL B 111 -2.584 12.254 5.365 1.00 21.50 H new ATOM 0 HB VAL B 111 -2.586 11.425 3.045 1.00 44.30 H new ATOM 0 HG11 VAL B 111 -0.425 10.177 3.125 1.00 31.14 H new ATOM 0 HG12 VAL B 111 -0.438 11.571 4.231 1.00 31.14 H new ATOM 0 HG13 VAL B 111 -0.652 9.925 4.871 1.00 31.14 H new ATOM 0 HG21 VAL B 111 -2.510 9.000 2.539 1.00 45.13 H new ATOM 0 HG22 VAL B 111 -2.894 8.646 4.241 1.00 45.13 H new ATOM 0 HG23 VAL B 111 -4.075 9.503 3.222 1.00 45.13 H new ATOM 3554 N ALA B 112 -5.440 10.593 5.205 1.00 55.04 N ATOM 3555 CA ALA B 112 -6.904 10.719 5.093 1.00 10.30 C ATOM 3556 C ALA B 112 -7.457 11.713 6.132 1.00 70.03 C ATOM 3557 O ALA B 112 -8.434 12.406 5.867 1.00 25.14 O ATOM 3558 CB ALA B 112 -7.580 9.350 5.245 1.00 64.23 C ATOM 0 H ALA B 112 -5.133 9.681 5.543 1.00 55.04 H new ATOM 0 HA ALA B 112 -7.131 11.108 4.100 1.00 10.30 H new ATOM 0 HB1 ALA B 112 -8.660 9.466 5.159 1.00 64.23 H new ATOM 0 HB2 ALA B 112 -7.224 8.679 4.463 1.00 64.23 H new ATOM 0 HB3 ALA B 112 -7.337 8.930 6.221 1.00 64.23 H new ATOM 3564 N ASN B 113 -6.797 11.779 7.308 1.00 55.05 N ATOM 3565 CA ASN B 113 -7.179 12.690 8.413 1.00 13.22 C ATOM 3566 C ASN B 113 -6.929 14.158 8.030 1.00 22.21 C ATOM 3567 O ASN B 113 -7.694 15.046 8.428 1.00 51.22 O ATOM 3568 CB ASN B 113 -6.401 12.348 9.722 1.00 4.24 C ATOM 3569 CG ASN B 113 -6.881 11.073 10.426 1.00 41.03 C ATOM 3570 OD1 ASN B 113 -8.060 10.720 10.379 1.00 13.44 O ATOM 3571 ND2 ASN B 113 -5.965 10.374 11.088 1.00 10.43 N ATOM 0 H ASN B 113 -5.983 11.202 7.520 1.00 55.05 H new ATOM 0 HA ASN B 113 -8.245 12.550 8.594 1.00 13.22 H new ATOM 0 HB2 ASN B 113 -5.343 12.241 9.484 1.00 4.24 H new ATOM 0 HB3 ASN B 113 -6.490 13.186 10.413 1.00 4.24 H new ATOM 0 HD21 ASN B 113 -6.231 9.519 11.576 1.00 10.43 H new ATOM 0 HD22 ASN B 113 -4.996 10.693 11.108 1.00 10.43 H new ATOM 3578 N MET B 114 -5.849 14.395 7.252 1.00 23.21 N ATOM 3579 CA MET B 114 -5.469 15.746 6.790 1.00 2.34 C ATOM 3580 C MET B 114 -6.550 16.327 5.861 1.00 61.23 C ATOM 3581 O MET B 114 -6.940 17.487 5.997 1.00 13.25 O ATOM 3582 CB MET B 114 -4.103 15.733 6.045 1.00 1.34 C ATOM 3583 CG MET B 114 -2.916 15.196 6.854 1.00 34.53 C ATOM 3584 SD MET B 114 -1.324 15.462 6.026 1.00 43.33 S ATOM 3585 CE MET B 114 -1.570 14.705 4.411 1.00 42.04 C ATOM 0 H MET B 114 -5.221 13.659 6.929 1.00 23.21 H new ATOM 0 HA MET B 114 -5.375 16.374 7.676 1.00 2.34 H new ATOM 0 HB2 MET B 114 -4.207 15.131 5.142 1.00 1.34 H new ATOM 0 HB3 MET B 114 -3.873 16.750 5.726 1.00 1.34 H new ATOM 0 HG2 MET B 114 -2.898 15.681 7.830 1.00 34.53 H new ATOM 0 HG3 MET B 114 -3.055 14.129 7.030 1.00 34.53 H new ATOM 0 HE1 MET B 114 -0.724 14.057 4.180 1.00 42.04 H new ATOM 0 HE2 MET B 114 -2.487 14.116 4.421 1.00 42.04 H new ATOM 0 HE3 MET B 114 -1.648 15.484 3.652 1.00 42.04 H new ATOM 3595 N ILE B 115 -7.034 15.491 4.930 1.00 33.40 N ATOM 3596 CA ILE B 115 -8.030 15.905 3.915 1.00 33.24 C ATOM 3597 C ILE B 115 -9.479 15.770 4.435 1.00 12.23 C ATOM 3598 O ILE B 115 -10.407 16.295 3.813 1.00 11.50 O ATOM 3599 CB ILE B 115 -7.857 15.067 2.593 1.00 25.40 C ATOM 3600 CG1 ILE B 115 -8.138 13.551 2.853 1.00 62.22 C ATOM 3601 CG2 ILE B 115 -6.442 15.281 2.003 1.00 32.41 C ATOM 3602 CD1 ILE B 115 -8.049 12.649 1.634 1.00 42.12 C ATOM 0 H ILE B 115 -6.752 14.514 4.855 1.00 33.40 H new ATOM 0 HA ILE B 115 -7.848 16.958 3.701 1.00 33.24 H new ATOM 0 HB ILE B 115 -8.587 15.417 1.863 1.00 25.40 H new ATOM 0 HG12 ILE B 115 -7.431 13.192 3.601 1.00 62.22 H new ATOM 0 HG13 ILE B 115 -9.135 13.453 3.283 1.00 62.22 H new ATOM 0 HG21 ILE B 115 -6.336 14.696 1.090 1.00 32.41 H new ATOM 0 HG22 ILE B 115 -6.298 16.337 1.776 1.00 32.41 H new ATOM 0 HG23 ILE B 115 -5.693 14.961 2.728 1.00 32.41 H new ATOM 0 HD11 ILE B 115 -8.261 11.621 1.926 1.00 42.12 H new ATOM 0 HD12 ILE B 115 -8.776 12.972 0.889 1.00 42.12 H new ATOM 0 HD13 ILE B 115 -7.046 12.706 1.211 1.00 42.12 H new ATOM 3614 N ARG B 116 -9.652 15.061 5.575 1.00 11.40 N ATOM 3615 CA ARG B 116 -10.978 14.765 6.161 1.00 71.31 C ATOM 3616 C ARG B 116 -11.700 16.053 6.603 1.00 72.12 C ATOM 3617 O ARG B 116 -12.909 16.192 6.398 1.00 20.20 O ATOM 3618 CB ARG B 116 -10.822 13.786 7.362 1.00 62.13 C ATOM 3619 CG ARG B 116 -12.149 13.309 7.991 1.00 0.53 C ATOM 3620 CD ARG B 116 -11.956 12.156 8.998 1.00 0.03 C ATOM 3621 NE ARG B 116 -11.126 12.525 10.160 1.00 73.04 N ATOM 3622 CZ ARG B 116 -11.071 11.825 11.316 1.00 44.43 C ATOM 3623 NH1 ARG B 116 -11.796 10.715 11.484 1.00 62.33 N ATOM 3624 NH2 ARG B 116 -10.289 12.236 12.299 1.00 31.32 N ATOM 0 H ARG B 116 -8.875 14.678 6.114 1.00 11.40 H new ATOM 0 HA ARG B 116 -11.591 14.293 5.393 1.00 71.31 H new ATOM 0 HB2 ARG B 116 -10.260 12.913 7.029 1.00 62.13 H new ATOM 0 HB3 ARG B 116 -10.226 14.273 8.134 1.00 62.13 H new ATOM 0 HG2 ARG B 116 -12.629 14.148 8.495 1.00 0.53 H new ATOM 0 HG3 ARG B 116 -12.824 12.984 7.199 1.00 0.53 H new ATOM 0 HD2 ARG B 116 -12.933 11.823 9.350 1.00 0.03 H new ATOM 0 HD3 ARG B 116 -11.496 11.310 8.487 1.00 0.03 H new ATOM 0 HE ARG B 116 -10.554 13.366 10.087 1.00 73.04 H new ATOM 0 HH11 ARG B 116 -12.403 10.384 10.734 1.00 62.33 H new ATOM 0 HH12 ARG B 116 -11.743 10.199 12.362 1.00 62.33 H new ATOM 0 HH21 ARG B 116 -9.728 13.080 12.185 1.00 31.32 H new ATOM 0 HH22 ARG B 116 -10.247 11.709 13.171 1.00 31.32 H new ATOM 3638 N GLY B 117 -10.937 16.980 7.201 1.00 40.35 N ATOM 3639 CA GLY B 117 -11.462 18.272 7.661 1.00 4.45 C ATOM 3640 C GLY B 117 -12.032 18.206 9.085 1.00 54.40 C ATOM 3641 O GLY B 117 -11.804 19.137 9.882 1.00 51.22 O ATOM 3642 OXT GLY B 117 -12.738 17.228 9.412 1.00 37.41 O ATOM 0 H GLY B 117 -9.940 16.854 7.379 1.00 40.35 H new ATOM 0 HA2 GLY B 117 -10.666 19.016 7.627 1.00 4.45 H new ATOM 0 HA3 GLY B 117 -12.242 18.607 6.977 1.00 4.45 H new TER 3646 GLY B 117