USER MOD reduce.3.24.130724 H: found=0, std=0, add=1822, rem=0, adj=65 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 76:sc= 1.18 USER MOD Set 1.2: B 110 THR OG1 : rot 69:sc= 1.05 USER MOD Set 2.1: B 47 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: B 49 THR OG1 : rot 180:sc= 0 USER MOD Set 3.1: B 30 MET CE :methyl -127:sc= 0 (180deg=-1.57!) USER MOD Set 3.2: B 97 TYR OH : rot 180:sc= 0 USER MOD Set 4.1: B 23 MET CE :methyl 155:sc= -0.0822 (180deg=-0.783) USER MOD Set 4.2: B 61 HIS : no HE2:sc= -0.173 K(o=-0.25,f=-0.99) USER MOD Set 5.1: A 81 CYS SG : rot 74:sc= 1.12 USER MOD Set 5.2: A 110 THR OG1 : rot 68:sc= 1.05 USER MOD Set 6.1: A 47 THR OG1 : rot 180:sc= 0 USER MOD Set 6.2: A 49 THR OG1 : rot 180:sc= 0 USER MOD Set 7.1: A 30 MET CE :methyl -127:sc= 0 (180deg=-1.59!) USER MOD Set 7.2: A 97 TYR OH : rot 180:sc= 0 USER MOD Set 8.1: A 23 MET CE :methyl 153:sc= -0.137 (180deg=-0.855) USER MOD Set 8.2: A 61 HIS : no HD1:sc= -0.0802 K(o=-0.22,f=-0.77) USER MOD Single : A 2 SER OG : rot 180:sc= -0.101 USER MOD Single : A 5 LYS NZ :NH3+ 164:sc= 0.326 (180deg=0.271) USER MOD Single : A 8 SER OG : rot -80:sc= 0.281 USER MOD Single : A 9 SER OG : rot 112:sc= 0.174 USER MOD Single : A 12 LYS NZ :NH3+ 145:sc= 1.08 (180deg=0.393) USER MOD Single : A 18 LYS NZ :NH3+ -176:sc= 0.686 (180deg=0.675) USER MOD Single : A 22 CYS SG : rot 71:sc= 1.24 USER MOD Single : A 24 SER OG : rot 17:sc= -0.276 USER MOD Single : A 26 THR OG1 : rot 178:sc= 0.47 USER MOD Single : A 28 LYS NZ :NH3+ -170:sc= 0.6 (180deg=0.51) USER MOD Single : A 29 ASN : amide:sc= -0.715 X(o=-0.71,f=-0.57) USER MOD Single : A 37 SER OG : rot -100:sc= -0.683 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 45 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 48 SER OG : rot -149:sc= 0.457 USER MOD Single : A 53 LYS NZ :NH3+ -147:sc= 1.21 (180deg=0.114) USER MOD Single : A 57 TYR OH : rot 32:sc= -1.22 USER MOD Single : A 58 CYS SG : rot 87:sc= -4.1! USER MOD Single : A 60 HIS : no HE2:sc= -0.621 X(o=-0.62,f=-0.46) USER MOD Single : A 62 HIS : no HD1:sc= -0.156 K(o=-0.08,f=-2.9!) USER MOD Single : A 63 GLN : amide:sc= 0 X(o=0,f=0) 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 51:sc= 0.202 USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 GLN : amide:sc= 0.159 X(o=0.16,f=-0.063) USER MOD Single : A 87 THR OG1 : rot 180:sc= -0.425 USER MOD Single : A 96 ASN : amide:sc= -1.28 X(o=-1.3,f=-1.2) USER MOD Single : A 101 LYS NZ :NH3+ 138:sc= 0.973 (180deg=-0.138) USER MOD Single : A 107 THR OG1 : rot 83:sc= 0.41 USER MOD Single : A 108 CYS SG : rot 85:sc= -0.801 USER MOD Single : A 109 LYS NZ :NH3+ 161:sc= 0.746 (180deg=0.368) USER MOD Single : A 113 ASN : amide:sc= -0.0801 X(o=-0.08,f=-0.55) USER MOD Single : A 114 MET CE :methyl -142:sc= -1.75 (180deg=-2.46!) USER MOD Single : B 2 SER OG : rot 180:sc= -0.0316 USER MOD Single : B 5 LYS NZ :NH3+ 172:sc= 0.334 (180deg=0.254) USER MOD Single : B 8 SER OG : rot -77:sc= 0.31 USER MOD Single : B 9 SER OG : rot 112:sc= 0.259 USER MOD Single : B 12 LYS NZ :NH3+ 145:sc= 1.04 (180deg=0.331) USER MOD Single : B 18 LYS NZ :NH3+ -178:sc= 0.759 (180deg=0.756) USER MOD Single : B 22 CYS SG : rot 44:sc= 1.21 USER MOD Single : B 24 SER OG : rot 14:sc= -0.315 USER MOD Single : B 26 THR OG1 : rot 177:sc= 0.518 USER MOD Single : B 28 LYS NZ :NH3+ -173:sc= 0.579 (180deg=0.538) USER MOD Single : B 29 ASN : amide:sc= -0.662 X(o=-0.66,f=-0.72) USER MOD Single : B 37 SER OG : rot -112:sc= -0.358 USER MOD Single : B 39 SER OG : rot 180:sc= 0.00263 USER MOD Single : B 45 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 48 SER OG : rot -147:sc= 0.504 USER MOD Single : B 53 LYS NZ :NH3+ -152:sc= 1.21 (180deg=0.0857) USER MOD Single : B 57 TYR OH : rot 180:sc= -1.37 USER MOD Single : B 58 CYS SG : rot 80:sc= -4.16! USER MOD Single : B 60 HIS : no HE2:sc= -0.668 X(o=-0.67,f=-0.36) USER MOD Single : B 62 HIS : no HD1:sc= -0.0783 K(o=-0.013,f=-3.2!) USER MOD Single : B 63 GLN : amide:sc=-0.00943 X(o=-0.0094,f=-0.0094) 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 53:sc= 0.227 USER MOD Single : B 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 85 GLN : amide:sc= 0.138 X(o=0.14,f=-0.057) USER MOD Single : B 87 THR OG1 : rot 180:sc= -0.461 USER MOD Single : B 96 ASN : amide:sc= -1.13 X(o=-1.1,f=-1.1) USER MOD Single : B 101 LYS NZ :NH3+ 141:sc= 0.976 (180deg=-0.234) USER MOD Single : B 107 THR OG1 : rot 84:sc= 0.42 USER MOD Single : B 108 CYS SG : rot 84:sc= -0.825 USER MOD Single : B 109 LYS NZ :NH3+ 161:sc= 0.696 (180deg=0.381) USER MOD Single : B 113 ASN : amide:sc= -0.0784 X(o=-0.078,f=-0.48) USER MOD Single : B 114 MET CE :methyl -142:sc= -1.71 (180deg=-2.55!) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 2 -18.354 -15.836 -15.270 1.00 61.12 N ATOM 2 CA SER A 2 -19.002 -14.569 -15.692 1.00 35.40 C ATOM 3 C SER A 2 -18.280 -13.364 -15.057 1.00 12.42 C ATOM 4 O SER A 2 -17.394 -13.535 -14.207 1.00 55.22 O ATOM 5 CB SER A 2 -20.503 -14.594 -15.304 1.00 22.40 C ATOM 6 OG SER A 2 -21.191 -13.432 -15.747 1.00 44.42 O ATOM 0 HA SER A 2 -18.930 -14.468 -16.775 1.00 35.40 H new ATOM 0 HB2 SER A 2 -20.973 -15.479 -15.734 1.00 22.40 H new ATOM 0 HB3 SER A 2 -20.595 -14.678 -14.221 1.00 22.40 H new ATOM 0 HG SER A 2 -22.133 -13.489 -15.483 1.00 44.42 H new ATOM 14 N LEU A 3 -18.657 -12.147 -15.493 1.00 13.32 N ATOM 15 CA LEU A 3 -18.111 -10.892 -14.954 1.00 71.31 C ATOM 16 C LEU A 3 -18.524 -10.727 -13.477 1.00 73.54 C ATOM 17 O LEU A 3 -19.727 -10.662 -13.180 1.00 42.51 O ATOM 18 CB LEU A 3 -18.655 -9.704 -15.786 1.00 33.35 C ATOM 19 CG LEU A 3 -18.259 -9.664 -17.293 1.00 41.12 C ATOM 20 CD1 LEU A 3 -19.086 -8.613 -18.058 1.00 22.00 C ATOM 21 CD2 LEU A 3 -16.754 -9.404 -17.462 1.00 32.42 C ATOM 0 H LEU A 3 -19.349 -12.009 -16.229 1.00 13.32 H new ATOM 0 HA LEU A 3 -17.023 -10.915 -15.013 1.00 71.31 H new ATOM 0 HB2 LEU A 3 -19.743 -9.713 -15.720 1.00 33.35 H new ATOM 0 HB3 LEU A 3 -18.315 -8.779 -15.320 1.00 33.35 H new ATOM 0 HG LEU A 3 -18.482 -10.642 -17.720 1.00 41.12 H new ATOM 0 HD11 LEU A 3 -18.788 -8.608 -19.106 1.00 22.00 H new ATOM 0 HD12 LEU A 3 -20.145 -8.859 -17.983 1.00 22.00 H new ATOM 0 HD13 LEU A 3 -18.911 -7.628 -17.626 1.00 22.00 H new ATOM 0 HD21 LEU A 3 -16.506 -9.381 -18.523 1.00 32.42 H new ATOM 0 HD22 LEU A 3 -16.497 -8.447 -17.008 1.00 32.42 H new ATOM 0 HD23 LEU A 3 -16.190 -10.199 -16.974 1.00 32.42 H new ATOM 33 N VAL A 4 -17.532 -10.674 -12.563 1.00 34.12 N ATOM 34 CA VAL A 4 -17.792 -10.487 -11.126 1.00 55.45 C ATOM 35 C VAL A 4 -18.312 -9.054 -10.880 1.00 51.51 C ATOM 36 O VAL A 4 -17.666 -8.059 -11.244 1.00 24.20 O ATOM 37 CB VAL A 4 -16.540 -10.816 -10.226 1.00 52.53 C ATOM 38 CG1 VAL A 4 -16.209 -12.325 -10.284 1.00 1.14 C ATOM 39 CG2 VAL A 4 -15.305 -9.975 -10.616 1.00 55.30 C ATOM 0 H VAL A 4 -16.543 -10.759 -12.799 1.00 34.12 H new ATOM 0 HA VAL A 4 -18.558 -11.203 -10.829 1.00 55.45 H new ATOM 0 HB VAL A 4 -16.801 -10.551 -9.202 1.00 52.53 H new ATOM 0 HG11 VAL A 4 -15.342 -12.532 -9.656 1.00 1.14 H new ATOM 0 HG12 VAL A 4 -17.063 -12.899 -9.924 1.00 1.14 H new ATOM 0 HG13 VAL A 4 -15.988 -12.610 -11.313 1.00 1.14 H new ATOM 0 HG21 VAL A 4 -14.468 -10.236 -9.969 1.00 55.30 H new ATOM 0 HG22 VAL A 4 -15.039 -10.178 -11.653 1.00 55.30 H new ATOM 0 HG23 VAL A 4 -15.535 -8.916 -10.502 1.00 55.30 H new ATOM 49 N LYS A 5 -19.515 -8.983 -10.310 1.00 4.13 N ATOM 50 CA LYS A 5 -20.275 -7.748 -10.157 1.00 44.42 C ATOM 51 C LYS A 5 -19.777 -6.954 -8.927 1.00 64.12 C ATOM 52 O LYS A 5 -20.331 -7.088 -7.828 1.00 21.43 O ATOM 53 CB LYS A 5 -21.787 -8.098 -10.030 1.00 64.54 C ATOM 54 CG LYS A 5 -22.372 -8.972 -11.168 1.00 30.22 C ATOM 55 CD LYS A 5 -23.871 -9.293 -10.946 1.00 41.41 C ATOM 56 CE LYS A 5 -24.437 -10.283 -11.982 1.00 65.33 C ATOM 57 NZ LYS A 5 -24.420 -9.733 -13.363 1.00 4.14 N ATOM 0 H LYS A 5 -19.996 -9.801 -9.935 1.00 4.13 H new ATOM 0 HA LYS A 5 -20.130 -7.115 -11.032 1.00 44.42 H new ATOM 0 HB2 LYS A 5 -21.943 -8.615 -9.083 1.00 64.54 H new ATOM 0 HB3 LYS A 5 -22.354 -7.168 -9.983 1.00 64.54 H new ATOM 0 HG2 LYS A 5 -22.250 -8.456 -12.120 1.00 30.22 H new ATOM 0 HG3 LYS A 5 -21.809 -9.903 -11.235 1.00 30.22 H new ATOM 0 HD2 LYS A 5 -24.004 -9.707 -9.946 1.00 41.41 H new ATOM 0 HD3 LYS A 5 -24.445 -8.367 -10.986 1.00 41.41 H new ATOM 0 HE2 LYS A 5 -23.856 -11.205 -11.954 1.00 65.33 H new ATOM 0 HE3 LYS A 5 -25.460 -10.543 -11.710 1.00 65.33 H new ATOM 0 HZ1 LYS A 5 -24.548 -10.507 -14.046 1.00 4.14 H new ATOM 0 HZ2 LYS A 5 -25.191 -9.044 -13.472 1.00 4.14 H new ATOM 0 HZ3 LYS A 5 -23.509 -9.263 -13.538 1.00 4.14 H new ATOM 71 N LEU A 6 -18.699 -6.169 -9.106 1.00 63.35 N ATOM 72 CA LEU A 6 -18.118 -5.360 -8.019 1.00 23.40 C ATOM 73 C LEU A 6 -18.990 -4.119 -7.757 1.00 2.42 C ATOM 74 O LEU A 6 -18.786 -3.052 -8.345 1.00 2.33 O ATOM 75 CB LEU A 6 -16.644 -4.976 -8.320 1.00 52.24 C ATOM 76 CG LEU A 6 -15.642 -6.167 -8.479 1.00 74.43 C ATOM 77 CD1 LEU A 6 -14.194 -5.665 -8.582 1.00 21.32 C ATOM 78 CD2 LEU A 6 -15.779 -7.191 -7.338 1.00 45.32 C ATOM 0 H LEU A 6 -18.211 -6.078 -9.997 1.00 63.35 H new ATOM 0 HA LEU A 6 -18.105 -5.963 -7.111 1.00 23.40 H new ATOM 0 HB2 LEU A 6 -16.623 -4.385 -9.236 1.00 52.24 H new ATOM 0 HB3 LEU A 6 -16.286 -4.331 -7.517 1.00 52.24 H new ATOM 0 HG LEU A 6 -15.898 -6.674 -9.409 1.00 74.43 H new ATOM 0 HD11 LEU A 6 -13.521 -6.515 -8.692 1.00 21.32 H new ATOM 0 HD12 LEU A 6 -14.096 -5.011 -9.448 1.00 21.32 H new ATOM 0 HD13 LEU A 6 -13.936 -5.112 -7.679 1.00 21.32 H new ATOM 0 HD21 LEU A 6 -15.065 -8.001 -7.488 1.00 45.32 H new ATOM 0 HD22 LEU A 6 -15.578 -6.702 -6.385 1.00 45.32 H new ATOM 0 HD23 LEU A 6 -16.791 -7.596 -7.332 1.00 45.32 H new ATOM 90 N GLU A 7 -19.996 -4.314 -6.898 1.00 30.31 N ATOM 91 CA GLU A 7 -20.969 -3.290 -6.523 1.00 51.03 C ATOM 92 C GLU A 7 -20.342 -2.327 -5.496 1.00 43.22 C ATOM 93 O GLU A 7 -20.036 -2.727 -4.374 1.00 62.23 O ATOM 94 CB GLU A 7 -22.228 -3.986 -5.954 1.00 32.21 C ATOM 95 CG GLU A 7 -23.392 -3.044 -5.595 1.00 62.24 C ATOM 96 CD GLU A 7 -24.624 -3.813 -5.092 1.00 24.42 C ATOM 97 OE1 GLU A 7 -25.278 -4.495 -5.902 1.00 70.44 O ATOM 98 OE2 GLU A 7 -24.929 -3.766 -3.885 1.00 33.12 O ATOM 0 H GLU A 7 -20.157 -5.209 -6.436 1.00 30.31 H new ATOM 0 HA GLU A 7 -21.259 -2.701 -7.394 1.00 51.03 H new ATOM 0 HB2 GLU A 7 -22.582 -4.714 -6.684 1.00 32.21 H new ATOM 0 HB3 GLU A 7 -21.944 -4.543 -5.061 1.00 32.21 H new ATOM 0 HG2 GLU A 7 -23.066 -2.341 -4.828 1.00 62.24 H new ATOM 0 HG3 GLU A 7 -23.665 -2.456 -6.471 1.00 62.24 H new ATOM 105 N SER A 8 -20.151 -1.066 -5.898 1.00 62.14 N ATOM 106 CA SER A 8 -19.487 -0.037 -5.073 1.00 62.05 C ATOM 107 C SER A 8 -20.376 0.442 -3.908 1.00 51.21 C ATOM 108 O SER A 8 -21.542 0.033 -3.781 1.00 13.10 O ATOM 109 CB SER A 8 -19.103 1.154 -5.978 1.00 51.41 C ATOM 110 OG SER A 8 -20.245 1.704 -6.625 1.00 64.01 O ATOM 0 H SER A 8 -20.453 -0.723 -6.810 1.00 62.14 H new ATOM 0 HA SER A 8 -18.596 -0.478 -4.627 1.00 62.05 H new ATOM 0 HB2 SER A 8 -18.615 1.924 -5.381 1.00 51.41 H new ATOM 0 HB3 SER A 8 -18.381 0.826 -6.726 1.00 51.41 H new ATOM 0 HG SER A 8 -20.482 1.150 -7.398 1.00 64.01 H new ATOM 116 N SER A 9 -19.791 1.307 -3.058 1.00 21.24 N ATOM 117 CA SER A 9 -20.504 2.004 -1.965 1.00 74.33 C ATOM 118 C SER A 9 -21.632 2.900 -2.526 1.00 32.02 C ATOM 119 O SER A 9 -22.660 3.111 -1.879 1.00 70.21 O ATOM 120 CB SER A 9 -19.498 2.859 -1.158 1.00 74.00 C ATOM 121 OG SER A 9 -20.102 3.459 -0.021 1.00 32.23 O ATOM 0 H SER A 9 -18.801 1.545 -3.109 1.00 21.24 H new ATOM 0 HA SER A 9 -20.958 1.259 -1.311 1.00 74.33 H new ATOM 0 HB2 SER A 9 -18.665 2.233 -0.838 1.00 74.00 H new ATOM 0 HB3 SER A 9 -19.084 3.636 -1.801 1.00 74.00 H new ATOM 0 HG SER A 9 -19.740 3.053 0.794 1.00 32.23 H new ATOM 127 N ASP A 10 -21.421 3.393 -3.760 1.00 62.41 N ATOM 128 CA ASP A 10 -22.378 4.262 -4.480 1.00 13.24 C ATOM 129 C ASP A 10 -23.403 3.414 -5.288 1.00 34.34 C ATOM 130 O ASP A 10 -24.148 3.941 -6.115 1.00 52.31 O ATOM 131 CB ASP A 10 -21.566 5.227 -5.387 1.00 1.31 C ATOM 132 CG ASP A 10 -22.415 6.278 -6.138 1.00 14.42 C ATOM 133 OD1 ASP A 10 -22.895 7.233 -5.496 1.00 1.41 O ATOM 134 OD2 ASP A 10 -22.608 6.148 -7.367 1.00 4.01 O ATOM 0 H ASP A 10 -20.573 3.199 -4.293 1.00 62.41 H new ATOM 0 HA ASP A 10 -22.964 4.848 -3.773 1.00 13.24 H new ATOM 0 HB2 ASP A 10 -20.830 5.746 -4.774 1.00 1.31 H new ATOM 0 HB3 ASP A 10 -21.013 4.637 -6.118 1.00 1.31 H new ATOM 139 N GLU A 11 -23.428 2.082 -5.016 1.00 31.14 N ATOM 140 CA GLU A 11 -24.425 1.105 -5.543 1.00 12.25 C ATOM 141 C GLU A 11 -24.218 0.750 -7.032 1.00 71.32 C ATOM 142 O GLU A 11 -24.941 -0.102 -7.566 1.00 72.01 O ATOM 143 CB GLU A 11 -25.893 1.593 -5.310 1.00 42.22 C ATOM 144 CG GLU A 11 -26.247 1.913 -3.838 1.00 33.21 C ATOM 145 CD GLU A 11 -27.600 2.625 -3.685 1.00 5.03 C ATOM 146 OE1 GLU A 11 -27.658 3.856 -3.865 1.00 5.21 O ATOM 147 OE2 GLU A 11 -28.616 1.966 -3.401 1.00 40.32 O ATOM 0 H GLU A 11 -22.737 1.644 -4.407 1.00 31.14 H new ATOM 0 HA GLU A 11 -24.256 0.193 -4.971 1.00 12.25 H new ATOM 0 HB2 GLU A 11 -26.064 2.486 -5.912 1.00 42.22 H new ATOM 0 HB3 GLU A 11 -26.577 0.827 -5.675 1.00 42.22 H new ATOM 0 HG2 GLU A 11 -26.264 0.986 -3.265 1.00 33.21 H new ATOM 0 HG3 GLU A 11 -25.464 2.538 -3.410 1.00 33.21 H new ATOM 154 N LYS A 12 -23.227 1.373 -7.694 1.00 22.34 N ATOM 155 CA LYS A 12 -22.953 1.117 -9.126 1.00 14.32 C ATOM 156 C LYS A 12 -22.178 -0.203 -9.285 1.00 14.12 C ATOM 157 O LYS A 12 -21.105 -0.381 -8.700 1.00 63.14 O ATOM 158 CB LYS A 12 -22.202 2.315 -9.771 1.00 24.33 C ATOM 159 CG LYS A 12 -23.084 3.573 -9.945 1.00 0.02 C ATOM 160 CD LYS A 12 -22.365 4.724 -10.686 1.00 62.12 C ATOM 161 CE LYS A 12 -23.306 5.892 -11.046 1.00 50.31 C ATOM 162 NZ LYS A 12 -23.975 6.472 -9.845 1.00 4.55 N ATOM 0 H LYS A 12 -22.602 2.056 -7.265 1.00 22.34 H new ATOM 0 HA LYS A 12 -23.900 1.015 -9.656 1.00 14.32 H new ATOM 0 HB2 LYS A 12 -21.340 2.568 -9.154 1.00 24.33 H new ATOM 0 HB3 LYS A 12 -21.819 2.012 -10.745 1.00 24.33 H new ATOM 0 HG2 LYS A 12 -23.986 3.303 -10.495 1.00 0.02 H new ATOM 0 HG3 LYS A 12 -23.402 3.924 -8.963 1.00 0.02 H new ATOM 0 HD2 LYS A 12 -21.553 5.098 -10.063 1.00 62.12 H new ATOM 0 HD3 LYS A 12 -21.913 4.335 -11.598 1.00 62.12 H new ATOM 0 HE2 LYS A 12 -22.737 6.671 -11.554 1.00 50.31 H new ATOM 0 HE3 LYS A 12 -24.063 5.542 -11.748 1.00 50.31 H new ATOM 0 HZ1 LYS A 12 -24.087 7.498 -9.972 1.00 4.55 H new ATOM 0 HZ2 LYS A 12 -24.911 6.034 -9.723 1.00 4.55 H new ATOM 0 HZ3 LYS A 12 -23.395 6.288 -9.002 1.00 4.55 H new ATOM 176 N VAL A 13 -22.752 -1.115 -10.077 1.00 3.15 N ATOM 177 CA VAL A 13 -22.289 -2.503 -10.221 1.00 21.13 C ATOM 178 C VAL A 13 -21.277 -2.621 -11.381 1.00 24.05 C ATOM 179 O VAL A 13 -21.659 -2.643 -12.557 1.00 12.33 O ATOM 180 CB VAL A 13 -23.530 -3.444 -10.456 1.00 21.50 C ATOM 181 CG1 VAL A 13 -23.114 -4.907 -10.677 1.00 13.01 C ATOM 182 CG2 VAL A 13 -24.552 -3.316 -9.292 1.00 1.21 C ATOM 0 H VAL A 13 -23.570 -0.906 -10.649 1.00 3.15 H new ATOM 0 HA VAL A 13 -21.780 -2.810 -9.308 1.00 21.13 H new ATOM 0 HB VAL A 13 -24.018 -3.113 -11.373 1.00 21.50 H new ATOM 0 HG11 VAL A 13 -24.003 -5.518 -10.835 1.00 13.01 H new ATOM 0 HG12 VAL A 13 -22.468 -4.973 -11.552 1.00 13.01 H new ATOM 0 HG13 VAL A 13 -22.576 -5.269 -9.801 1.00 13.01 H new ATOM 0 HG21 VAL A 13 -25.400 -3.976 -9.478 1.00 1.21 H new ATOM 0 HG22 VAL A 13 -24.072 -3.597 -8.354 1.00 1.21 H new ATOM 0 HG23 VAL A 13 -24.902 -2.286 -9.226 1.00 1.21 H new ATOM 192 N PHE A 14 -19.982 -2.666 -11.036 1.00 21.30 N ATOM 193 CA PHE A 14 -18.886 -2.752 -12.017 1.00 41.24 C ATOM 194 C PHE A 14 -18.553 -4.217 -12.309 1.00 23.35 C ATOM 195 O PHE A 14 -17.791 -4.858 -11.575 1.00 71.54 O ATOM 196 CB PHE A 14 -17.645 -1.977 -11.506 1.00 20.43 C ATOM 197 CG PHE A 14 -17.930 -0.501 -11.297 1.00 75.53 C ATOM 198 CD1 PHE A 14 -18.038 0.360 -12.391 1.00 62.42 C ATOM 199 CD2 PHE A 14 -18.119 0.024 -10.021 1.00 15.24 C ATOM 200 CE1 PHE A 14 -18.331 1.691 -12.210 1.00 4.24 C ATOM 201 CE2 PHE A 14 -18.405 1.354 -9.845 1.00 72.42 C ATOM 202 CZ PHE A 14 -18.513 2.189 -10.937 1.00 24.42 C ATOM 0 H PHE A 14 -19.663 -2.644 -10.068 1.00 21.30 H new ATOM 0 HA PHE A 14 -19.205 -2.289 -12.951 1.00 41.24 H new ATOM 0 HB2 PHE A 14 -17.308 -2.416 -10.567 1.00 20.43 H new ATOM 0 HB3 PHE A 14 -16.830 -2.089 -12.221 1.00 20.43 H new ATOM 0 HD1 PHE A 14 -17.890 -0.024 -13.390 1.00 62.42 H new ATOM 0 HD2 PHE A 14 -18.039 -0.623 -9.160 1.00 15.24 H new ATOM 0 HE1 PHE A 14 -18.419 2.346 -13.064 1.00 4.24 H new ATOM 0 HE2 PHE A 14 -18.546 1.748 -8.849 1.00 72.42 H new ATOM 0 HZ PHE A 14 -18.741 3.235 -10.795 1.00 24.42 H new ATOM 212 N GLU A 15 -19.188 -4.749 -13.364 1.00 40.25 N ATOM 213 CA GLU A 15 -18.956 -6.113 -13.845 1.00 63.32 C ATOM 214 C GLU A 15 -17.600 -6.191 -14.571 1.00 75.24 C ATOM 215 O GLU A 15 -17.522 -6.035 -15.791 1.00 73.41 O ATOM 216 CB GLU A 15 -20.120 -6.550 -14.776 1.00 24.21 C ATOM 217 CG GLU A 15 -21.491 -6.643 -14.077 1.00 33.13 C ATOM 218 CD GLU A 15 -22.635 -7.052 -15.023 1.00 1.25 C ATOM 219 OE1 GLU A 15 -23.259 -6.167 -15.642 1.00 30.50 O ATOM 220 OE2 GLU A 15 -22.903 -8.264 -15.155 1.00 72.15 O ATOM 0 H GLU A 15 -19.882 -4.238 -13.910 1.00 40.25 H new ATOM 0 HA GLU A 15 -18.925 -6.797 -12.997 1.00 63.32 H new ATOM 0 HB2 GLU A 15 -20.194 -5.843 -15.602 1.00 24.21 H new ATOM 0 HB3 GLU A 15 -19.879 -7.521 -15.208 1.00 24.21 H new ATOM 0 HG2 GLU A 15 -21.427 -7.365 -13.263 1.00 33.13 H new ATOM 0 HG3 GLU A 15 -21.728 -5.678 -13.629 1.00 33.13 H new ATOM 227 N ILE A 16 -16.532 -6.370 -13.794 1.00 34.23 N ATOM 228 CA ILE A 16 -15.161 -6.523 -14.323 1.00 73.24 C ATOM 229 C ILE A 16 -14.872 -8.027 -14.508 1.00 64.42 C ATOM 230 O ILE A 16 -15.522 -8.871 -13.864 1.00 73.43 O ATOM 231 CB ILE A 16 -14.104 -5.858 -13.345 1.00 15.55 C ATOM 232 CG1 ILE A 16 -12.659 -5.807 -13.951 1.00 2.51 C ATOM 233 CG2 ILE A 16 -14.090 -6.583 -11.987 1.00 42.43 C ATOM 234 CD1 ILE A 16 -12.531 -4.992 -15.227 1.00 72.11 C ATOM 0 H ILE A 16 -16.585 -6.414 -12.776 1.00 34.23 H new ATOM 0 HA ILE A 16 -15.078 -6.015 -15.284 1.00 73.24 H new ATOM 0 HB ILE A 16 -14.422 -4.826 -13.199 1.00 15.55 H new ATOM 0 HG12 ILE A 16 -11.981 -5.394 -13.204 1.00 2.51 H new ATOM 0 HG13 ILE A 16 -12.329 -6.826 -14.153 1.00 2.51 H new ATOM 0 HG21 ILE A 16 -13.359 -6.112 -11.330 1.00 42.43 H new ATOM 0 HG22 ILE A 16 -15.079 -6.522 -11.532 1.00 42.43 H new ATOM 0 HG23 ILE A 16 -13.823 -7.629 -12.136 1.00 42.43 H new ATOM 0 HD11 ILE A 16 -11.497 -5.015 -15.571 1.00 72.11 H new ATOM 0 HD12 ILE A 16 -13.179 -5.415 -15.995 1.00 72.11 H new ATOM 0 HD13 ILE A 16 -12.826 -3.961 -15.031 1.00 72.11 H new ATOM 246 N GLU A 17 -13.925 -8.363 -15.407 1.00 24.11 N ATOM 247 CA GLU A 17 -13.471 -9.749 -15.594 1.00 22.43 C ATOM 248 C GLU A 17 -12.847 -10.276 -14.292 1.00 3.12 C ATOM 249 O GLU A 17 -12.087 -9.553 -13.625 1.00 72.52 O ATOM 250 CB GLU A 17 -12.456 -9.849 -16.762 1.00 13.33 C ATOM 251 CG GLU A 17 -12.996 -9.343 -18.116 1.00 32.41 C ATOM 252 CD GLU A 17 -11.985 -9.505 -19.265 1.00 73.00 C ATOM 253 OE1 GLU A 17 -11.891 -10.609 -19.834 1.00 40.33 O ATOM 254 OE2 GLU A 17 -11.270 -8.538 -19.598 1.00 30.23 O ATOM 0 H GLU A 17 -13.461 -7.688 -16.015 1.00 24.11 H new ATOM 0 HA GLU A 17 -14.335 -10.364 -15.848 1.00 22.43 H new ATOM 0 HB2 GLU A 17 -11.564 -9.278 -16.503 1.00 13.33 H new ATOM 0 HB3 GLU A 17 -12.148 -10.889 -16.872 1.00 13.33 H new ATOM 0 HG2 GLU A 17 -13.908 -9.886 -18.363 1.00 32.41 H new ATOM 0 HG3 GLU A 17 -13.266 -8.291 -18.023 1.00 32.41 H new ATOM 261 N LYS A 18 -13.199 -11.521 -13.942 1.00 31.11 N ATOM 262 CA LYS A 18 -12.770 -12.181 -12.694 1.00 22.10 C ATOM 263 C LYS A 18 -11.238 -12.208 -12.577 1.00 35.14 C ATOM 264 O LYS A 18 -10.687 -11.934 -11.507 1.00 61.00 O ATOM 265 CB LYS A 18 -13.345 -13.614 -12.661 1.00 14.11 C ATOM 266 CG LYS A 18 -13.026 -14.434 -11.385 1.00 11.02 C ATOM 267 CD LYS A 18 -13.619 -15.864 -11.450 1.00 54.02 C ATOM 268 CE LYS A 18 -15.140 -15.865 -11.655 1.00 74.31 C ATOM 269 NZ LYS A 18 -15.691 -17.239 -11.751 1.00 42.13 N ATOM 0 H LYS A 18 -13.797 -12.108 -14.523 1.00 31.11 H new ATOM 0 HA LYS A 18 -13.150 -11.615 -11.843 1.00 22.10 H new ATOM 0 HB2 LYS A 18 -14.428 -13.555 -12.772 1.00 14.11 H new ATOM 0 HB3 LYS A 18 -12.966 -14.159 -13.526 1.00 14.11 H new ATOM 0 HG2 LYS A 18 -11.946 -14.495 -11.254 1.00 11.02 H new ATOM 0 HG3 LYS A 18 -13.424 -13.916 -10.512 1.00 11.02 H new ATOM 0 HD2 LYS A 18 -13.146 -16.412 -12.265 1.00 54.02 H new ATOM 0 HD3 LYS A 18 -13.380 -16.394 -10.528 1.00 54.02 H new ATOM 0 HE2 LYS A 18 -15.617 -15.341 -10.827 1.00 74.31 H new ATOM 0 HE3 LYS A 18 -15.383 -15.314 -12.563 1.00 74.31 H new ATOM 0 HZ1 LYS A 18 -16.709 -17.191 -11.957 1.00 42.13 H new ATOM 0 HZ2 LYS A 18 -15.208 -17.754 -12.514 1.00 42.13 H new ATOM 0 HZ3 LYS A 18 -15.543 -17.736 -10.850 1.00 42.13 H new ATOM 283 N GLU A 19 -10.580 -12.492 -13.717 1.00 24.20 N ATOM 284 CA GLU A 19 -9.112 -12.550 -13.826 1.00 23.23 C ATOM 285 C GLU A 19 -8.432 -11.201 -13.470 1.00 75.12 C ATOM 286 O GLU A 19 -7.319 -11.178 -12.937 1.00 74.45 O ATOM 287 CB GLU A 19 -8.725 -13.010 -15.253 1.00 20.44 C ATOM 288 CG GLU A 19 -9.239 -12.101 -16.392 1.00 32.32 C ATOM 289 CD GLU A 19 -8.924 -12.652 -17.793 1.00 15.21 C ATOM 290 OE1 GLU A 19 -9.855 -12.942 -18.568 1.00 61.23 O ATOM 291 OE2 GLU A 19 -7.732 -12.811 -18.122 1.00 60.25 O ATOM 0 H GLU A 19 -11.058 -12.689 -14.596 1.00 24.20 H new ATOM 0 HA GLU A 19 -8.748 -13.272 -13.096 1.00 23.23 H new ATOM 0 HB2 GLU A 19 -7.639 -13.069 -15.318 1.00 20.44 H new ATOM 0 HB3 GLU A 19 -9.109 -14.018 -15.411 1.00 20.44 H new ATOM 0 HG2 GLU A 19 -10.317 -11.977 -16.291 1.00 32.32 H new ATOM 0 HG3 GLU A 19 -8.793 -11.112 -16.289 1.00 32.32 H new ATOM 298 N ILE A 20 -9.119 -10.088 -13.769 1.00 33.24 N ATOM 299 CA ILE A 20 -8.625 -8.726 -13.481 1.00 43.35 C ATOM 300 C ILE A 20 -8.893 -8.367 -12.003 1.00 33.23 C ATOM 301 O ILE A 20 -8.100 -7.669 -11.364 1.00 71.04 O ATOM 302 CB ILE A 20 -9.305 -7.679 -14.441 1.00 5.12 C ATOM 303 CG1 ILE A 20 -9.101 -8.103 -15.933 1.00 33.10 C ATOM 304 CG2 ILE A 20 -8.776 -6.248 -14.182 1.00 73.53 C ATOM 305 CD1 ILE A 20 -9.728 -7.178 -16.965 1.00 63.30 C ATOM 0 H ILE A 20 -10.035 -10.103 -14.218 1.00 33.24 H new ATOM 0 HA ILE A 20 -7.549 -8.698 -13.655 1.00 43.35 H new ATOM 0 HB ILE A 20 -10.375 -7.666 -14.232 1.00 5.12 H new ATOM 0 HG12 ILE A 20 -8.031 -8.169 -16.131 1.00 33.10 H new ATOM 0 HG13 ILE A 20 -9.513 -9.103 -16.068 1.00 33.10 H new ATOM 0 HG21 ILE A 20 -9.266 -5.550 -14.861 1.00 73.53 H new ATOM 0 HG22 ILE A 20 -8.990 -5.962 -13.152 1.00 73.53 H new ATOM 0 HG23 ILE A 20 -7.699 -6.222 -14.350 1.00 73.53 H new ATOM 0 HD11 ILE A 20 -9.529 -7.561 -17.966 1.00 63.30 H new ATOM 0 HD12 ILE A 20 -10.805 -7.129 -16.803 1.00 63.30 H new ATOM 0 HD13 ILE A 20 -9.300 -6.180 -16.867 1.00 63.30 H new ATOM 317 N ALA A 21 -10.019 -8.871 -11.470 1.00 3.24 N ATOM 318 CA ALA A 21 -10.398 -8.682 -10.055 1.00 13.02 C ATOM 319 C ALA A 21 -9.490 -9.503 -9.110 1.00 15.35 C ATOM 320 O ALA A 21 -9.416 -9.215 -7.909 1.00 13.12 O ATOM 321 CB ALA A 21 -11.875 -9.045 -9.867 1.00 44.43 C ATOM 0 H ALA A 21 -10.692 -9.420 -12.005 1.00 3.24 H new ATOM 0 HA ALA A 21 -10.258 -7.633 -9.792 1.00 13.02 H new ATOM 0 HB1 ALA A 21 -12.154 -8.905 -8.823 1.00 44.43 H new ATOM 0 HB2 ALA A 21 -12.491 -8.402 -10.496 1.00 44.43 H new ATOM 0 HB3 ALA A 21 -12.032 -10.086 -10.148 1.00 44.43 H new ATOM 327 N CYS A 22 -8.804 -10.519 -9.674 1.00 71.44 N ATOM 328 CA CYS A 22 -7.808 -11.320 -8.948 1.00 60.33 C ATOM 329 C CYS A 22 -6.521 -10.511 -8.667 1.00 24.33 C ATOM 330 O CYS A 22 -5.794 -10.816 -7.715 1.00 5.31 O ATOM 331 CB CYS A 22 -7.482 -12.593 -9.744 1.00 43.44 C ATOM 332 SG CYS A 22 -8.909 -13.660 -10.043 1.00 11.52 S ATOM 0 H CYS A 22 -8.928 -10.804 -10.646 1.00 71.44 H new ATOM 0 HA CYS A 22 -8.234 -11.598 -7.984 1.00 60.33 H new ATOM 0 HB2 CYS A 22 -7.047 -12.308 -10.702 1.00 43.44 H new ATOM 0 HB3 CYS A 22 -6.723 -13.161 -9.206 1.00 43.44 H new ATOM 0 HG CYS A 22 -9.696 -13.099 -10.912 1.00 11.52 H new ATOM 338 N MET A 23 -6.243 -9.482 -9.506 1.00 31.04 N ATOM 339 CA MET A 23 -5.086 -8.569 -9.315 1.00 51.41 C ATOM 340 C MET A 23 -5.206 -7.828 -7.970 1.00 25.54 C ATOM 341 O MET A 23 -4.204 -7.578 -7.283 1.00 22.14 O ATOM 342 CB MET A 23 -4.986 -7.552 -10.480 1.00 71.03 C ATOM 343 CG MET A 23 -4.762 -8.176 -11.862 1.00 2.35 C ATOM 344 SD MET A 23 -4.721 -6.931 -13.174 1.00 4.14 S ATOM 345 CE MET A 23 -3.321 -5.911 -12.689 1.00 72.33 C ATOM 0 H MET A 23 -6.808 -9.262 -10.326 1.00 31.04 H new ATOM 0 HA MET A 23 -4.176 -9.170 -9.307 1.00 51.41 H new ATOM 0 HB2 MET A 23 -5.902 -6.962 -10.508 1.00 71.03 H new ATOM 0 HB3 MET A 23 -4.168 -6.862 -10.272 1.00 71.03 H new ATOM 0 HG2 MET A 23 -3.824 -8.731 -11.861 1.00 2.35 H new ATOM 0 HG3 MET A 23 -5.557 -8.893 -12.068 1.00 2.35 H new ATOM 0 HE1 MET A 23 -2.887 -5.445 -13.573 1.00 72.33 H new ATOM 0 HE2 MET A 23 -3.657 -5.137 -11.999 1.00 72.33 H new ATOM 0 HE3 MET A 23 -2.570 -6.532 -12.200 1.00 72.33 H new ATOM 355 N SER A 24 -6.454 -7.480 -7.618 1.00 64.43 N ATOM 356 CA SER A 24 -6.797 -6.992 -6.286 1.00 2.33 C ATOM 357 C SER A 24 -6.649 -8.148 -5.295 1.00 44.24 C ATOM 358 O SER A 24 -7.428 -9.103 -5.347 1.00 41.41 O ATOM 359 CB SER A 24 -8.240 -6.435 -6.262 1.00 31.33 C ATOM 360 OG SER A 24 -8.582 -5.956 -4.971 1.00 74.12 O ATOM 0 H SER A 24 -7.249 -7.532 -8.254 1.00 64.43 H new ATOM 0 HA SER A 24 -6.127 -6.178 -6.008 1.00 2.33 H new ATOM 0 HB2 SER A 24 -8.334 -5.628 -6.989 1.00 31.33 H new ATOM 0 HB3 SER A 24 -8.939 -7.216 -6.560 1.00 31.33 H new ATOM 0 HG SER A 24 -7.767 -5.832 -4.441 1.00 74.12 H new ATOM 366 N VAL A 25 -5.619 -8.071 -4.435 1.00 31.50 N ATOM 367 CA VAL A 25 -5.305 -9.130 -3.464 1.00 54.31 C ATOM 368 C VAL A 25 -6.472 -9.323 -2.476 1.00 35.00 C ATOM 369 O VAL A 25 -6.862 -10.453 -2.211 1.00 13.40 O ATOM 370 CB VAL A 25 -3.957 -8.832 -2.696 1.00 41.22 C ATOM 371 CG1 VAL A 25 -3.630 -9.917 -1.634 1.00 51.12 C ATOM 372 CG2 VAL A 25 -2.784 -8.669 -3.697 1.00 73.44 C ATOM 0 H VAL A 25 -4.983 -7.275 -4.394 1.00 31.50 H new ATOM 0 HA VAL A 25 -5.166 -10.059 -4.017 1.00 54.31 H new ATOM 0 HB VAL A 25 -4.093 -7.894 -2.159 1.00 41.22 H new ATOM 0 HG11 VAL A 25 -2.694 -9.666 -1.134 1.00 51.12 H new ATOM 0 HG12 VAL A 25 -4.434 -9.961 -0.899 1.00 51.12 H new ATOM 0 HG13 VAL A 25 -3.532 -10.886 -2.123 1.00 51.12 H new ATOM 0 HG21 VAL A 25 -1.864 -8.464 -3.149 1.00 73.44 H new ATOM 0 HG22 VAL A 25 -2.667 -9.587 -4.273 1.00 73.44 H new ATOM 0 HG23 VAL A 25 -2.995 -7.841 -4.374 1.00 73.44 H new ATOM 382 N THR A 26 -7.045 -8.202 -1.989 1.00 64.43 N ATOM 383 CA THR A 26 -8.160 -8.212 -1.019 1.00 10.32 C ATOM 384 C THR A 26 -9.434 -8.868 -1.609 1.00 2.41 C ATOM 385 O THR A 26 -10.004 -9.769 -0.985 1.00 53.33 O ATOM 386 CB THR A 26 -8.475 -6.761 -0.528 1.00 23.20 C ATOM 387 OG1 THR A 26 -7.278 -6.148 -0.027 1.00 63.41 O ATOM 388 CG2 THR A 26 -9.556 -6.725 0.572 1.00 5.20 C ATOM 0 H THR A 26 -6.747 -7.264 -2.258 1.00 64.43 H new ATOM 0 HA THR A 26 -7.843 -8.814 -0.167 1.00 10.32 H new ATOM 0 HB THR A 26 -8.860 -6.212 -1.388 1.00 23.20 H new ATOM 0 HG1 THR A 26 -7.472 -5.228 0.249 1.00 63.41 H new ATOM 0 HG21 THR A 26 -9.733 -5.693 0.874 1.00 5.20 H new ATOM 0 HG22 THR A 26 -10.481 -7.155 0.187 1.00 5.20 H new ATOM 0 HG23 THR A 26 -9.218 -7.302 1.433 1.00 5.20 H new ATOM 396 N ILE A 27 -9.851 -8.426 -2.821 1.00 20.22 N ATOM 397 CA ILE A 27 -11.042 -8.981 -3.514 1.00 74.45 C ATOM 398 C ILE A 27 -10.825 -10.474 -3.827 1.00 62.44 C ATOM 399 O ILE A 27 -11.734 -11.284 -3.630 1.00 32.22 O ATOM 400 CB ILE A 27 -11.376 -8.180 -4.835 1.00 54.45 C ATOM 401 CG1 ILE A 27 -11.754 -6.705 -4.492 1.00 70.30 C ATOM 402 CG2 ILE A 27 -12.498 -8.863 -5.670 1.00 31.13 C ATOM 403 CD1 ILE A 27 -12.014 -5.811 -5.697 1.00 61.24 C ATOM 0 H ILE A 27 -9.380 -7.685 -3.340 1.00 20.22 H new ATOM 0 HA ILE A 27 -11.896 -8.877 -2.845 1.00 74.45 H new ATOM 0 HB ILE A 27 -10.479 -8.179 -5.454 1.00 54.45 H new ATOM 0 HG12 ILE A 27 -12.645 -6.711 -3.864 1.00 70.30 H new ATOM 0 HG13 ILE A 27 -10.950 -6.268 -3.901 1.00 70.30 H new ATOM 0 HG21 ILE A 27 -12.692 -8.276 -6.568 1.00 31.13 H new ATOM 0 HG22 ILE A 27 -12.180 -9.866 -5.954 1.00 31.13 H new ATOM 0 HG23 ILE A 27 -13.408 -8.926 -5.074 1.00 31.13 H new ATOM 0 HD11 ILE A 27 -12.269 -4.807 -5.357 1.00 61.24 H new ATOM 0 HD12 ILE A 27 -11.119 -5.768 -6.318 1.00 61.24 H new ATOM 0 HD13 ILE A 27 -12.840 -6.217 -6.280 1.00 61.24 H new ATOM 415 N LYS A 28 -9.596 -10.822 -4.269 1.00 64.45 N ATOM 416 CA LYS A 28 -9.212 -12.215 -4.553 1.00 54.32 C ATOM 417 C LYS A 28 -9.302 -13.067 -3.279 1.00 43.02 C ATOM 418 O LYS A 28 -9.782 -14.187 -3.327 1.00 21.10 O ATOM 419 CB LYS A 28 -7.782 -12.288 -5.147 1.00 30.34 C ATOM 420 CG LYS A 28 -7.330 -13.711 -5.570 1.00 73.44 C ATOM 421 CD LYS A 28 -5.888 -13.752 -6.119 1.00 63.50 C ATOM 422 CE LYS A 28 -4.832 -13.310 -5.081 1.00 2.40 C ATOM 423 NZ LYS A 28 -4.789 -14.201 -3.884 1.00 51.14 N ATOM 0 H LYS A 28 -8.850 -10.147 -4.437 1.00 64.45 H new ATOM 0 HA LYS A 28 -9.908 -12.612 -5.291 1.00 54.32 H new ATOM 0 HB2 LYS A 28 -7.730 -11.631 -6.015 1.00 30.34 H new ATOM 0 HB3 LYS A 28 -7.077 -11.901 -4.411 1.00 30.34 H new ATOM 0 HG2 LYS A 28 -7.404 -14.379 -4.712 1.00 73.44 H new ATOM 0 HG3 LYS A 28 -8.012 -14.091 -6.330 1.00 73.44 H new ATOM 0 HD2 LYS A 28 -5.661 -14.765 -6.451 1.00 63.50 H new ATOM 0 HD3 LYS A 28 -5.820 -13.107 -6.995 1.00 63.50 H new ATOM 0 HE2 LYS A 28 -3.849 -13.295 -5.553 1.00 2.40 H new ATOM 0 HE3 LYS A 28 -5.048 -12.290 -4.762 1.00 2.40 H new ATOM 0 HZ1 LYS A 28 -4.191 -13.769 -3.151 1.00 51.14 H new ATOM 0 HZ2 LYS A 28 -5.752 -14.331 -3.513 1.00 51.14 H new ATOM 0 HZ3 LYS A 28 -4.394 -15.125 -4.153 1.00 51.14 H new ATOM 437 N ASN A 29 -8.878 -12.498 -2.133 1.00 1.12 N ATOM 438 CA ASN A 29 -8.914 -13.196 -0.834 1.00 72.33 C ATOM 439 C ASN A 29 -10.360 -13.384 -0.349 1.00 21.25 C ATOM 440 O ASN A 29 -10.635 -14.342 0.365 1.00 14.43 O ATOM 441 CB ASN A 29 -8.069 -12.456 0.247 1.00 60.15 C ATOM 442 CG ASN A 29 -6.552 -12.493 0.011 1.00 53.33 C ATOM 443 OD1 ASN A 29 -5.842 -11.561 0.386 1.00 11.44 O ATOM 444 ND2 ASN A 29 -6.031 -13.566 -0.579 1.00 21.52 N ATOM 0 H ASN A 29 -8.504 -11.550 -2.082 1.00 1.12 H new ATOM 0 HA ASN A 29 -8.468 -14.179 -0.987 1.00 72.33 H new ATOM 0 HB2 ASN A 29 -8.391 -11.416 0.291 1.00 60.15 H new ATOM 0 HB3 ASN A 29 -8.283 -12.897 1.221 1.00 60.15 H new ATOM 0 HD21 ASN A 29 -5.024 -13.627 -0.728 1.00 21.52 H new ATOM 0 HD22 ASN A 29 -6.639 -14.327 -0.882 1.00 21.52 H new ATOM 451 N MET A 30 -11.269 -12.455 -0.736 1.00 60.14 N ATOM 452 CA MET A 30 -12.720 -12.569 -0.448 1.00 53.24 C ATOM 453 C MET A 30 -13.336 -13.729 -1.258 1.00 50.32 C ATOM 454 O MET A 30 -14.187 -14.471 -0.752 1.00 41.02 O ATOM 455 CB MET A 30 -13.465 -11.238 -0.768 1.00 33.12 C ATOM 456 CG MET A 30 -13.082 -10.046 0.120 1.00 13.03 C ATOM 457 SD MET A 30 -13.964 -8.537 -0.349 1.00 70.45 S ATOM 458 CE MET A 30 -13.359 -7.356 0.858 1.00 2.13 C ATOM 0 H MET A 30 -11.019 -11.612 -1.253 1.00 60.14 H new ATOM 0 HA MET A 30 -12.836 -12.775 0.616 1.00 53.24 H new ATOM 0 HB2 MET A 30 -13.272 -10.973 -1.808 1.00 33.12 H new ATOM 0 HB3 MET A 30 -14.538 -11.409 -0.676 1.00 33.12 H new ATOM 0 HG2 MET A 30 -13.301 -10.285 1.161 1.00 13.03 H new ATOM 0 HG3 MET A 30 -12.008 -9.874 0.052 1.00 13.03 H new ATOM 0 HE1 MET A 30 -14.204 -6.879 1.355 1.00 2.13 H new ATOM 0 HE2 MET A 30 -12.748 -7.873 1.598 1.00 2.13 H new ATOM 0 HE3 MET A 30 -12.758 -6.598 0.356 1.00 2.13 H new ATOM 468 N ILE A 31 -12.880 -13.858 -2.519 1.00 61.22 N ATOM 469 CA ILE A 31 -13.276 -14.944 -3.432 1.00 50.13 C ATOM 470 C ILE A 31 -12.817 -16.308 -2.859 1.00 34.34 C ATOM 471 O ILE A 31 -13.633 -17.204 -2.657 1.00 33.41 O ATOM 472 CB ILE A 31 -12.659 -14.690 -4.869 1.00 31.31 C ATOM 473 CG1 ILE A 31 -13.265 -13.392 -5.500 1.00 73.43 C ATOM 474 CG2 ILE A 31 -12.832 -15.905 -5.813 1.00 24.42 C ATOM 475 CD1 ILE A 31 -12.613 -12.931 -6.802 1.00 40.13 C ATOM 0 H ILE A 31 -12.219 -13.203 -2.936 1.00 61.22 H new ATOM 0 HA ILE A 31 -14.362 -14.963 -3.526 1.00 50.13 H new ATOM 0 HB ILE A 31 -11.586 -14.550 -4.741 1.00 31.31 H new ATOM 0 HG12 ILE A 31 -14.326 -13.559 -5.684 1.00 73.43 H new ATOM 0 HG13 ILE A 31 -13.191 -12.585 -4.771 1.00 73.43 H new ATOM 0 HG21 ILE A 31 -12.392 -15.677 -6.784 1.00 24.42 H new ATOM 0 HG22 ILE A 31 -12.333 -16.774 -5.383 1.00 24.42 H new ATOM 0 HG23 ILE A 31 -13.893 -16.121 -5.938 1.00 24.42 H new ATOM 0 HD11 ILE A 31 -13.106 -12.025 -7.155 1.00 40.13 H new ATOM 0 HD12 ILE A 31 -11.557 -12.725 -6.627 1.00 40.13 H new ATOM 0 HD13 ILE A 31 -12.710 -13.714 -7.554 1.00 40.13 H new ATOM 487 N GLU A 32 -11.510 -16.395 -2.531 1.00 53.00 N ATOM 488 CA GLU A 32 -10.854 -17.616 -2.007 1.00 14.11 C ATOM 489 C GLU A 32 -11.404 -18.004 -0.619 1.00 70.20 C ATOM 490 O GLU A 32 -11.413 -19.191 -0.256 1.00 4.01 O ATOM 491 CB GLU A 32 -9.313 -17.401 -1.926 1.00 3.51 C ATOM 492 CG GLU A 32 -8.635 -17.110 -3.288 1.00 73.21 C ATOM 493 CD GLU A 32 -7.164 -16.672 -3.151 1.00 41.20 C ATOM 494 OE1 GLU A 32 -6.250 -17.414 -3.571 1.00 41.31 O ATOM 495 OE2 GLU A 32 -6.920 -15.570 -2.611 1.00 3.45 O ATOM 0 H GLU A 32 -10.869 -15.607 -2.624 1.00 53.00 H new ATOM 0 HA GLU A 32 -11.072 -18.433 -2.695 1.00 14.11 H new ATOM 0 HB2 GLU A 32 -9.109 -16.572 -1.248 1.00 3.51 H new ATOM 0 HB3 GLU A 32 -8.857 -18.289 -1.489 1.00 3.51 H new ATOM 0 HG2 GLU A 32 -8.685 -18.004 -3.910 1.00 73.21 H new ATOM 0 HG3 GLU A 32 -9.193 -16.330 -3.805 1.00 73.21 H new ATOM 502 N ASP A 33 -11.857 -16.987 0.141 1.00 43.52 N ATOM 503 CA ASP A 33 -12.429 -17.164 1.493 1.00 13.45 C ATOM 504 C ASP A 33 -13.704 -18.021 1.442 1.00 41.32 C ATOM 505 O ASP A 33 -13.887 -18.946 2.242 1.00 61.22 O ATOM 506 CB ASP A 33 -12.742 -15.778 2.117 1.00 43.33 C ATOM 507 CG ASP A 33 -13.306 -15.858 3.543 1.00 14.40 C ATOM 508 OD1 ASP A 33 -12.518 -16.033 4.489 1.00 51.21 O ATOM 509 OD2 ASP A 33 -14.536 -15.743 3.729 1.00 4.32 O ATOM 0 H ASP A 33 -11.837 -16.015 -0.166 1.00 43.52 H new ATOM 0 HA ASP A 33 -11.697 -17.681 2.113 1.00 13.45 H new ATOM 0 HB2 ASP A 33 -11.831 -15.180 2.129 1.00 43.33 H new ATOM 0 HB3 ASP A 33 -13.457 -15.256 1.481 1.00 43.33 H new ATOM 514 N ILE A 34 -14.553 -17.714 0.454 1.00 61.53 N ATOM 515 CA ILE A 34 -15.835 -18.410 0.213 1.00 54.14 C ATOM 516 C ILE A 34 -15.605 -19.590 -0.778 1.00 20.22 C ATOM 517 O ILE A 34 -16.552 -20.220 -1.259 1.00 33.25 O ATOM 518 CB ILE A 34 -16.898 -17.368 -0.348 1.00 72.22 C ATOM 519 CG1 ILE A 34 -16.886 -16.060 0.515 1.00 42.13 C ATOM 520 CG2 ILE A 34 -18.333 -17.959 -0.402 1.00 31.43 C ATOM 521 CD1 ILE A 34 -17.813 -14.949 0.039 1.00 23.24 C ATOM 0 H ILE A 34 -14.371 -16.965 -0.214 1.00 61.53 H new ATOM 0 HA ILE A 34 -16.225 -18.825 1.143 1.00 54.14 H new ATOM 0 HB ILE A 34 -16.606 -17.131 -1.371 1.00 72.22 H new ATOM 0 HG12 ILE A 34 -17.155 -16.319 1.539 1.00 42.13 H new ATOM 0 HG13 ILE A 34 -15.867 -15.673 0.541 1.00 42.13 H new ATOM 0 HG21 ILE A 34 -19.021 -17.209 -0.792 1.00 31.43 H new ATOM 0 HG22 ILE A 34 -18.342 -18.833 -1.053 1.00 31.43 H new ATOM 0 HG23 ILE A 34 -18.644 -18.251 0.601 1.00 31.43 H new ATOM 0 HD11 ILE A 34 -17.726 -14.092 0.707 1.00 23.24 H new ATOM 0 HD12 ILE A 34 -17.535 -14.651 -0.972 1.00 23.24 H new ATOM 0 HD13 ILE A 34 -18.842 -15.308 0.041 1.00 23.24 H new ATOM 533 N GLY A 35 -14.325 -19.912 -1.055 1.00 65.32 N ATOM 534 CA GLY A 35 -13.963 -20.892 -2.079 1.00 60.11 C ATOM 535 C GLY A 35 -13.861 -20.203 -3.428 1.00 64.23 C ATOM 536 O GLY A 35 -12.773 -20.070 -3.999 1.00 0.14 O ATOM 0 H GLY A 35 -13.525 -19.500 -0.575 1.00 65.32 H new ATOM 0 HA2 GLY A 35 -13.013 -21.363 -1.827 1.00 60.11 H new ATOM 0 HA3 GLY A 35 -14.711 -21.684 -2.119 1.00 60.11 H new ATOM 540 N GLU A 36 -15.020 -19.729 -3.911 1.00 4.41 N ATOM 541 CA GLU A 36 -15.117 -18.822 -5.062 1.00 4.34 C ATOM 542 C GLU A 36 -16.433 -18.026 -4.969 1.00 62.31 C ATOM 543 O GLU A 36 -17.411 -18.506 -4.374 1.00 30.41 O ATOM 544 CB GLU A 36 -15.024 -19.589 -6.406 1.00 34.11 C ATOM 545 CG GLU A 36 -14.848 -18.669 -7.627 1.00 41.41 C ATOM 546 CD GLU A 36 -14.768 -19.433 -8.946 1.00 51.00 C ATOM 547 OE1 GLU A 36 -15.724 -19.378 -9.743 1.00 71.11 O ATOM 548 OE2 GLU A 36 -13.739 -20.097 -9.199 1.00 50.20 O ATOM 0 H GLU A 36 -15.926 -19.968 -3.508 1.00 4.41 H new ATOM 0 HA GLU A 36 -14.274 -18.132 -5.036 1.00 4.34 H new ATOM 0 HB2 GLU A 36 -14.186 -20.284 -6.361 1.00 34.11 H new ATOM 0 HB3 GLU A 36 -15.927 -20.186 -6.538 1.00 34.11 H new ATOM 0 HG2 GLU A 36 -15.682 -17.969 -7.670 1.00 41.41 H new ATOM 0 HG3 GLU A 36 -13.941 -18.078 -7.501 1.00 41.41 H new ATOM 555 N SER A 37 -16.448 -16.803 -5.524 1.00 54.31 N ATOM 556 CA SER A 37 -17.627 -15.920 -5.515 1.00 23.42 C ATOM 557 C SER A 37 -17.706 -15.127 -6.836 1.00 63.14 C ATOM 558 O SER A 37 -17.114 -14.052 -6.972 1.00 11.35 O ATOM 559 CB SER A 37 -17.563 -14.974 -4.290 1.00 34.14 C ATOM 560 OG SER A 37 -17.562 -15.690 -3.068 1.00 33.43 O ATOM 0 H SER A 37 -15.639 -16.397 -5.994 1.00 54.31 H new ATOM 0 HA SER A 37 -18.532 -16.522 -5.433 1.00 23.42 H new ATOM 0 HB2 SER A 37 -16.664 -14.361 -4.352 1.00 34.14 H new ATOM 0 HB3 SER A 37 -18.415 -14.294 -4.312 1.00 34.14 H new ATOM 0 HG SER A 37 -18.463 -15.681 -2.683 1.00 33.43 H new ATOM 566 N ASP A 38 -18.387 -15.724 -7.822 1.00 61.10 N ATOM 567 CA ASP A 38 -18.690 -15.092 -9.125 1.00 61.02 C ATOM 568 C ASP A 38 -19.805 -14.035 -8.943 1.00 63.53 C ATOM 569 O ASP A 38 -19.883 -13.044 -9.687 1.00 24.21 O ATOM 570 CB ASP A 38 -19.118 -16.199 -10.135 1.00 0.14 C ATOM 571 CG ASP A 38 -19.300 -15.706 -11.582 1.00 52.14 C ATOM 572 OD1 ASP A 38 -20.421 -15.300 -11.960 1.00 21.44 O ATOM 573 OD2 ASP A 38 -18.320 -15.743 -12.349 1.00 62.41 O ATOM 0 H ASP A 38 -18.751 -16.673 -7.742 1.00 61.10 H new ATOM 0 HA ASP A 38 -17.808 -14.585 -9.516 1.00 61.02 H new ATOM 0 HB2 ASP A 38 -18.369 -16.991 -10.126 1.00 0.14 H new ATOM 0 HB3 ASP A 38 -20.054 -16.642 -9.795 1.00 0.14 H new ATOM 578 N SER A 39 -20.635 -14.274 -7.910 1.00 23.30 N ATOM 579 CA SER A 39 -21.764 -13.423 -7.505 1.00 53.31 C ATOM 580 C SER A 39 -21.311 -11.992 -7.061 1.00 40.54 C ATOM 581 O SER A 39 -20.123 -11.801 -6.750 1.00 33.03 O ATOM 582 CB SER A 39 -22.500 -14.155 -6.357 1.00 1.42 C ATOM 583 OG SER A 39 -21.617 -14.466 -5.284 1.00 75.13 O ATOM 0 H SER A 39 -20.532 -15.096 -7.314 1.00 23.30 H new ATOM 0 HA SER A 39 -22.425 -13.267 -8.358 1.00 53.31 H new ATOM 0 HB2 SER A 39 -23.315 -13.531 -5.990 1.00 1.42 H new ATOM 0 HB3 SER A 39 -22.948 -15.073 -6.738 1.00 1.42 H new ATOM 0 HG SER A 39 -22.113 -14.926 -4.575 1.00 75.13 H new ATOM 589 N PRO A 40 -22.256 -10.972 -7.031 1.00 40.00 N ATOM 590 CA PRO A 40 -21.938 -9.563 -6.668 1.00 13.31 C ATOM 591 C PRO A 40 -21.152 -9.394 -5.349 1.00 73.04 C ATOM 592 O PRO A 40 -21.677 -9.647 -4.257 1.00 50.41 O ATOM 593 CB PRO A 40 -23.336 -8.862 -6.593 1.00 3.14 C ATOM 594 CG PRO A 40 -24.342 -9.980 -6.603 1.00 61.13 C ATOM 595 CD PRO A 40 -23.696 -11.086 -7.405 1.00 31.55 C ATOM 0 HA PRO A 40 -21.267 -9.126 -7.407 1.00 13.31 H new ATOM 0 HB2 PRO A 40 -23.426 -8.260 -5.689 1.00 3.14 H new ATOM 0 HB3 PRO A 40 -23.485 -8.191 -7.439 1.00 3.14 H new ATOM 0 HG2 PRO A 40 -24.573 -10.311 -5.591 1.00 61.13 H new ATOM 0 HG3 PRO A 40 -25.281 -9.661 -7.056 1.00 61.13 H new ATOM 0 HD2 PRO A 40 -24.104 -12.063 -7.147 1.00 31.55 H new ATOM 0 HD3 PRO A 40 -23.847 -10.950 -8.476 1.00 31.55 H new ATOM 603 N ILE A 41 -19.878 -8.988 -5.484 1.00 1.24 N ATOM 604 CA ILE A 41 -19.015 -8.633 -4.353 1.00 24.22 C ATOM 605 C ILE A 41 -19.179 -7.127 -4.058 1.00 62.31 C ATOM 606 O ILE A 41 -18.815 -6.298 -4.904 1.00 75.01 O ATOM 607 CB ILE A 41 -17.498 -8.967 -4.651 1.00 3.41 C ATOM 608 CG1 ILE A 41 -17.311 -10.486 -4.949 1.00 23.05 C ATOM 609 CG2 ILE A 41 -16.557 -8.511 -3.500 1.00 3.11 C ATOM 610 CD1 ILE A 41 -17.743 -11.411 -3.823 1.00 54.43 C ATOM 0 H ILE A 41 -19.418 -8.897 -6.390 1.00 1.24 H new ATOM 0 HA ILE A 41 -19.313 -9.222 -3.486 1.00 24.22 H new ATOM 0 HB ILE A 41 -17.216 -8.401 -5.539 1.00 3.41 H new ATOM 0 HG12 ILE A 41 -17.876 -10.739 -5.846 1.00 23.05 H new ATOM 0 HG13 ILE A 41 -16.260 -10.672 -5.171 1.00 23.05 H new ATOM 0 HG21 ILE A 41 -15.527 -8.762 -3.751 1.00 3.11 H new ATOM 0 HG22 ILE A 41 -16.645 -7.433 -3.364 1.00 3.11 H new ATOM 0 HG23 ILE A 41 -16.839 -9.018 -2.577 1.00 3.11 H new ATOM 0 HD11 ILE A 41 -17.577 -12.447 -4.119 1.00 54.43 H new ATOM 0 HD12 ILE A 41 -17.161 -11.191 -2.928 1.00 54.43 H new ATOM 0 HD13 ILE A 41 -18.802 -11.259 -3.613 1.00 54.43 H new ATOM 622 N PRO A 42 -19.773 -6.746 -2.885 1.00 40.31 N ATOM 623 CA PRO A 42 -19.920 -5.337 -2.489 1.00 64.44 C ATOM 624 C PRO A 42 -18.632 -4.791 -1.839 1.00 31.22 C ATOM 625 O PRO A 42 -18.070 -5.416 -0.927 1.00 22.34 O ATOM 626 CB PRO A 42 -21.118 -5.361 -1.485 1.00 63.42 C ATOM 627 CG PRO A 42 -21.535 -6.809 -1.363 1.00 50.53 C ATOM 628 CD PRO A 42 -20.361 -7.630 -1.851 1.00 50.10 C ATOM 0 HA PRO A 42 -20.100 -4.676 -3.337 1.00 64.44 H new ATOM 0 HB2 PRO A 42 -20.823 -4.958 -0.516 1.00 63.42 H new ATOM 0 HB3 PRO A 42 -21.943 -4.747 -1.848 1.00 63.42 H new ATOM 0 HG2 PRO A 42 -21.781 -7.057 -0.331 1.00 50.53 H new ATOM 0 HG3 PRO A 42 -22.425 -7.009 -1.960 1.00 50.53 H new ATOM 0 HD2 PRO A 42 -19.654 -7.847 -1.050 1.00 50.10 H new ATOM 0 HD3 PRO A 42 -20.677 -8.587 -2.265 1.00 50.10 H new ATOM 636 N LEU A 43 -18.162 -3.632 -2.328 1.00 41.22 N ATOM 637 CA LEU A 43 -17.058 -2.871 -1.723 1.00 4.01 C ATOM 638 C LEU A 43 -17.654 -1.608 -1.055 1.00 44.12 C ATOM 639 O LEU A 43 -17.780 -0.559 -1.706 1.00 52.35 O ATOM 640 CB LEU A 43 -15.968 -2.487 -2.781 1.00 24.42 C ATOM 641 CG LEU A 43 -15.189 -3.655 -3.495 1.00 20.31 C ATOM 642 CD1 LEU A 43 -14.615 -4.666 -2.481 1.00 50.31 C ATOM 643 CD2 LEU A 43 -16.047 -4.348 -4.576 1.00 2.12 C ATOM 0 H LEU A 43 -18.543 -3.192 -3.165 1.00 41.22 H new ATOM 0 HA LEU A 43 -16.558 -3.489 -0.978 1.00 4.01 H new ATOM 0 HB2 LEU A 43 -16.448 -1.885 -3.552 1.00 24.42 H new ATOM 0 HB3 LEU A 43 -15.235 -1.848 -2.289 1.00 24.42 H new ATOM 0 HG LEU A 43 -14.341 -3.202 -4.008 1.00 20.31 H new ATOM 0 HD11 LEU A 43 -14.085 -5.455 -3.014 1.00 50.31 H new ATOM 0 HD12 LEU A 43 -13.925 -4.156 -1.809 1.00 50.31 H new ATOM 0 HD13 LEU A 43 -15.429 -5.102 -1.902 1.00 50.31 H new ATOM 0 HD21 LEU A 43 -15.470 -5.147 -5.042 1.00 2.12 H new ATOM 0 HD22 LEU A 43 -16.942 -4.768 -4.116 1.00 2.12 H new ATOM 0 HD23 LEU A 43 -16.336 -3.619 -5.334 1.00 2.12 H new ATOM 655 N PRO A 44 -18.071 -1.694 0.257 1.00 23.41 N ATOM 656 CA PRO A 44 -18.789 -0.590 0.946 1.00 61.24 C ATOM 657 C PRO A 44 -17.869 0.581 1.341 1.00 72.30 C ATOM 658 O PRO A 44 -18.355 1.652 1.708 1.00 42.12 O ATOM 659 CB PRO A 44 -19.384 -1.291 2.189 1.00 34.05 C ATOM 660 CG PRO A 44 -18.404 -2.382 2.509 1.00 62.34 C ATOM 661 CD PRO A 44 -17.882 -2.869 1.166 1.00 3.42 C ATOM 0 HA PRO A 44 -19.536 -0.122 0.305 1.00 61.24 H new ATOM 0 HB2 PRO A 44 -19.492 -0.597 3.023 1.00 34.05 H new ATOM 0 HB3 PRO A 44 -20.375 -1.695 1.981 1.00 34.05 H new ATOM 0 HG2 PRO A 44 -17.592 -2.009 3.133 1.00 62.34 H new ATOM 0 HG3 PRO A 44 -18.884 -3.191 3.060 1.00 62.34 H new ATOM 0 HD2 PRO A 44 -16.834 -3.162 1.227 1.00 3.42 H new ATOM 0 HD3 PRO A 44 -18.436 -3.739 0.814 1.00 3.42 H new ATOM 669 N ASN A 45 -16.551 0.359 1.269 1.00 41.35 N ATOM 670 CA ASN A 45 -15.545 1.386 1.575 1.00 31.03 C ATOM 671 C ASN A 45 -15.399 2.361 0.393 1.00 72.22 C ATOM 672 O ASN A 45 -15.625 3.561 0.546 1.00 12.22 O ATOM 673 CB ASN A 45 -14.193 0.712 1.917 1.00 21.42 C ATOM 674 CG ASN A 45 -13.043 1.700 2.168 1.00 13.22 C ATOM 675 OD1 ASN A 45 -12.297 2.052 1.254 1.00 3.34 O ATOM 676 ND2 ASN A 45 -12.896 2.153 3.402 1.00 3.52 N ATOM 0 H ASN A 45 -16.150 -0.539 0.997 1.00 41.35 H new ATOM 0 HA ASN A 45 -15.870 1.961 2.442 1.00 31.03 H new ATOM 0 HB2 ASN A 45 -14.323 0.091 2.803 1.00 21.42 H new ATOM 0 HB3 ASN A 45 -13.914 0.047 1.100 1.00 21.42 H new ATOM 0 HD21 ASN A 45 -12.148 2.813 3.617 1.00 3.52 H new ATOM 0 HD22 ASN A 45 -13.530 1.843 4.138 1.00 3.52 H new ATOM 683 N VAL A 46 -15.053 1.820 -0.790 1.00 54.24 N ATOM 684 CA VAL A 46 -14.708 2.634 -1.975 1.00 13.20 C ATOM 685 C VAL A 46 -15.970 2.962 -2.819 1.00 32.23 C ATOM 686 O VAL A 46 -16.824 2.096 -3.058 1.00 1.44 O ATOM 687 CB VAL A 46 -13.600 1.910 -2.839 1.00 21.00 C ATOM 688 CG1 VAL A 46 -14.076 0.545 -3.374 1.00 10.34 C ATOM 689 CG2 VAL A 46 -13.089 2.811 -3.985 1.00 63.52 C ATOM 0 H VAL A 46 -15.004 0.814 -0.953 1.00 54.24 H new ATOM 0 HA VAL A 46 -14.297 3.583 -1.632 1.00 13.20 H new ATOM 0 HB VAL A 46 -12.762 1.718 -2.169 1.00 21.00 H new ATOM 0 HG11 VAL A 46 -13.280 0.087 -3.961 1.00 10.34 H new ATOM 0 HG12 VAL A 46 -14.330 -0.105 -2.537 1.00 10.34 H new ATOM 0 HG13 VAL A 46 -14.955 0.687 -4.003 1.00 10.34 H new ATOM 0 HG21 VAL A 46 -12.329 2.278 -4.556 1.00 63.52 H new ATOM 0 HG22 VAL A 46 -13.920 3.071 -4.641 1.00 63.52 H new ATOM 0 HG23 VAL A 46 -12.658 3.721 -3.568 1.00 63.52 H new ATOM 699 N THR A 47 -16.074 4.231 -3.248 1.00 31.22 N ATOM 700 CA THR A 47 -17.198 4.741 -4.062 1.00 63.13 C ATOM 701 C THR A 47 -17.029 4.369 -5.545 1.00 34.41 C ATOM 702 O THR A 47 -15.997 3.825 -5.937 1.00 73.41 O ATOM 703 CB THR A 47 -17.314 6.291 -3.920 1.00 64.32 C ATOM 704 OG1 THR A 47 -16.061 6.899 -4.283 1.00 14.45 O ATOM 705 CG2 THR A 47 -17.705 6.708 -2.486 1.00 31.14 C ATOM 0 H THR A 47 -15.374 4.942 -3.039 1.00 31.22 H new ATOM 0 HA THR A 47 -18.111 4.275 -3.692 1.00 63.13 H new ATOM 0 HB THR A 47 -18.104 6.634 -4.589 1.00 64.32 H new ATOM 0 HG1 THR A 47 -16.132 7.873 -4.196 1.00 14.45 H new ATOM 0 HG21 THR A 47 -17.775 7.794 -2.429 1.00 31.14 H new ATOM 0 HG22 THR A 47 -18.669 6.268 -2.229 1.00 31.14 H new ATOM 0 HG23 THR A 47 -16.948 6.356 -1.786 1.00 31.14 H new ATOM 713 N SER A 48 -18.049 4.700 -6.352 1.00 33.33 N ATOM 714 CA SER A 48 -18.130 4.319 -7.769 1.00 61.24 C ATOM 715 C SER A 48 -17.048 4.989 -8.620 1.00 64.14 C ATOM 716 O SER A 48 -16.385 4.318 -9.394 1.00 25.33 O ATOM 717 CB SER A 48 -19.519 4.686 -8.316 1.00 25.05 C ATOM 718 OG SER A 48 -19.786 6.067 -8.136 1.00 22.22 O ATOM 0 H SER A 48 -18.850 5.246 -6.034 1.00 33.33 H new ATOM 0 HA SER A 48 -17.967 3.243 -7.829 1.00 61.24 H new ATOM 0 HB2 SER A 48 -19.574 4.436 -9.376 1.00 25.05 H new ATOM 0 HB3 SER A 48 -20.282 4.095 -7.809 1.00 25.05 H new ATOM 0 HG SER A 48 -20.749 6.201 -8.017 1.00 22.22 H new ATOM 724 N THR A 49 -16.886 6.311 -8.448 1.00 71.15 N ATOM 725 CA THR A 49 -15.957 7.133 -9.248 1.00 22.20 C ATOM 726 C THR A 49 -14.506 6.636 -9.113 1.00 42.23 C ATOM 727 O THR A 49 -13.772 6.524 -10.104 1.00 0.50 O ATOM 728 CB THR A 49 -16.045 8.625 -8.795 1.00 40.01 C ATOM 729 OG1 THR A 49 -15.784 8.705 -7.378 1.00 73.42 O ATOM 730 CG2 THR A 49 -17.428 9.244 -9.095 1.00 30.20 C ATOM 0 H THR A 49 -17.398 6.845 -7.746 1.00 71.15 H new ATOM 0 HA THR A 49 -16.249 7.047 -10.295 1.00 22.20 H new ATOM 0 HB THR A 49 -15.301 9.189 -9.357 1.00 40.01 H new ATOM 0 HG1 THR A 49 -15.836 9.640 -7.088 1.00 73.42 H new ATOM 0 HG21 THR A 49 -17.442 10.282 -8.763 1.00 30.20 H new ATOM 0 HG22 THR A 49 -17.620 9.204 -10.167 1.00 30.20 H new ATOM 0 HG23 THR A 49 -18.200 8.684 -8.567 1.00 30.20 H new ATOM 738 N ILE A 50 -14.124 6.320 -7.869 1.00 5.42 N ATOM 739 CA ILE A 50 -12.772 5.875 -7.537 1.00 63.05 C ATOM 740 C ILE A 50 -12.567 4.413 -7.980 1.00 33.43 C ATOM 741 O ILE A 50 -11.596 4.118 -8.674 1.00 24.32 O ATOM 742 CB ILE A 50 -12.495 6.055 -5.997 1.00 61.14 C ATOM 743 CG1 ILE A 50 -12.756 7.536 -5.559 1.00 72.42 C ATOM 744 CG2 ILE A 50 -11.063 5.611 -5.620 1.00 21.24 C ATOM 745 CD1 ILE A 50 -11.899 8.580 -6.263 1.00 25.24 C ATOM 0 H ILE A 50 -14.749 6.367 -7.064 1.00 5.42 H new ATOM 0 HA ILE A 50 -12.054 6.492 -8.077 1.00 63.05 H new ATOM 0 HB ILE A 50 -13.188 5.409 -5.458 1.00 61.14 H new ATOM 0 HG12 ILE A 50 -13.806 7.771 -5.736 1.00 72.42 H new ATOM 0 HG13 ILE A 50 -12.588 7.616 -4.485 1.00 72.42 H new ATOM 0 HG21 ILE A 50 -10.909 5.750 -4.550 1.00 21.24 H new ATOM 0 HG22 ILE A 50 -10.930 4.559 -5.872 1.00 21.24 H new ATOM 0 HG23 ILE A 50 -10.339 6.211 -6.172 1.00 21.24 H new ATOM 0 HD11 ILE A 50 -12.155 9.572 -5.891 1.00 25.24 H new ATOM 0 HD12 ILE A 50 -10.846 8.379 -6.066 1.00 25.24 H new ATOM 0 HD13 ILE A 50 -12.082 8.537 -7.337 1.00 25.24 H new ATOM 757 N LEU A 51 -13.536 3.530 -7.636 1.00 0.24 N ATOM 758 CA LEU A 51 -13.471 2.082 -7.952 1.00 53.55 C ATOM 759 C LEU A 51 -13.431 1.845 -9.477 1.00 22.31 C ATOM 760 O LEU A 51 -12.700 0.980 -9.947 1.00 13.22 O ATOM 761 CB LEU A 51 -14.678 1.321 -7.323 1.00 63.10 C ATOM 762 CG LEU A 51 -14.692 -0.237 -7.501 1.00 24.21 C ATOM 763 CD1 LEU A 51 -13.455 -0.902 -6.864 1.00 64.02 C ATOM 764 CD2 LEU A 51 -15.996 -0.855 -6.956 1.00 3.04 C ATOM 0 H LEU A 51 -14.382 3.800 -7.134 1.00 0.24 H new ATOM 0 HA LEU A 51 -12.549 1.693 -7.520 1.00 53.55 H new ATOM 0 HB2 LEU A 51 -14.703 1.543 -6.256 1.00 63.10 H new ATOM 0 HB3 LEU A 51 -15.596 1.722 -7.753 1.00 63.10 H new ATOM 0 HG LEU A 51 -14.650 -0.434 -8.572 1.00 24.21 H new ATOM 0 HD11 LEU A 51 -13.506 -1.981 -7.011 1.00 64.02 H new ATOM 0 HD12 LEU A 51 -12.551 -0.514 -7.334 1.00 64.02 H new ATOM 0 HD13 LEU A 51 -13.433 -0.682 -5.797 1.00 64.02 H new ATOM 0 HD21 LEU A 51 -15.972 -1.936 -7.095 1.00 3.04 H new ATOM 0 HD22 LEU A 51 -16.090 -0.628 -5.894 1.00 3.04 H new ATOM 0 HD23 LEU A 51 -16.848 -0.439 -7.493 1.00 3.04 H new ATOM 776 N GLU A 52 -14.205 2.654 -10.228 1.00 52.12 N ATOM 777 CA GLU A 52 -14.285 2.586 -11.703 1.00 43.34 C ATOM 778 C GLU A 52 -12.901 2.788 -12.328 1.00 55.11 C ATOM 779 O GLU A 52 -12.459 1.981 -13.151 1.00 63.53 O ATOM 780 CB GLU A 52 -15.260 3.667 -12.237 1.00 63.23 C ATOM 781 CG GLU A 52 -15.386 3.720 -13.776 1.00 43.52 C ATOM 782 CD GLU A 52 -16.402 4.760 -14.263 1.00 55.24 C ATOM 783 OE1 GLU A 52 -16.094 5.969 -14.226 1.00 45.44 O ATOM 784 OE2 GLU A 52 -17.507 4.380 -14.699 1.00 42.22 O ATOM 0 H GLU A 52 -14.798 3.380 -9.825 1.00 52.12 H new ATOM 0 HA GLU A 52 -14.656 1.599 -11.979 1.00 43.34 H new ATOM 0 HB2 GLU A 52 -16.247 3.488 -11.811 1.00 63.23 H new ATOM 0 HB3 GLU A 52 -14.930 4.642 -11.879 1.00 63.23 H new ATOM 0 HG2 GLU A 52 -14.410 3.945 -14.206 1.00 43.52 H new ATOM 0 HG3 GLU A 52 -15.677 2.736 -14.144 1.00 43.52 H new ATOM 791 N LYS A 53 -12.241 3.879 -11.904 1.00 40.34 N ATOM 792 CA LYS A 53 -10.896 4.247 -12.362 1.00 23.33 C ATOM 793 C LYS A 53 -9.861 3.167 -11.989 1.00 23.31 C ATOM 794 O LYS A 53 -9.048 2.781 -12.829 1.00 21.13 O ATOM 795 CB LYS A 53 -10.483 5.645 -11.798 1.00 22.31 C ATOM 796 CG LYS A 53 -10.883 6.847 -12.693 1.00 54.20 C ATOM 797 CD LYS A 53 -10.314 8.193 -12.176 1.00 54.30 C ATOM 798 CE LYS A 53 -10.945 8.634 -10.848 1.00 32.13 C ATOM 799 NZ LYS A 53 -12.413 8.829 -10.985 1.00 2.32 N ATOM 0 H LYS A 53 -12.632 4.534 -11.227 1.00 40.34 H new ATOM 0 HA LYS A 53 -10.919 4.315 -13.450 1.00 23.33 H new ATOM 0 HB2 LYS A 53 -10.937 5.774 -10.815 1.00 22.31 H new ATOM 0 HB3 LYS A 53 -9.403 5.659 -11.655 1.00 22.31 H new ATOM 0 HG2 LYS A 53 -10.527 6.673 -13.708 1.00 54.20 H new ATOM 0 HG3 LYS A 53 -11.970 6.912 -12.743 1.00 54.20 H new ATOM 0 HD2 LYS A 53 -9.235 8.101 -12.048 1.00 54.30 H new ATOM 0 HD3 LYS A 53 -10.481 8.965 -12.927 1.00 54.30 H new ATOM 0 HE2 LYS A 53 -10.746 7.885 -10.082 1.00 32.13 H new ATOM 0 HE3 LYS A 53 -10.482 9.563 -10.514 1.00 32.13 H new ATOM 0 HZ1 LYS A 53 -12.721 9.597 -10.356 1.00 2.32 H new ATOM 0 HZ2 LYS A 53 -12.640 9.076 -11.969 1.00 2.32 H new ATOM 0 HZ3 LYS A 53 -12.906 7.950 -10.726 1.00 2.32 H new ATOM 813 N VAL A 54 -9.920 2.680 -10.738 1.00 71.44 N ATOM 814 CA VAL A 54 -8.962 1.692 -10.212 1.00 60.33 C ATOM 815 C VAL A 54 -9.069 0.348 -10.976 1.00 22.51 C ATOM 816 O VAL A 54 -8.047 -0.253 -11.303 1.00 2.20 O ATOM 817 CB VAL A 54 -9.155 1.501 -8.655 1.00 34.10 C ATOM 818 CG1 VAL A 54 -8.288 0.354 -8.095 1.00 75.25 C ATOM 819 CG2 VAL A 54 -8.842 2.821 -7.902 1.00 33.12 C ATOM 0 H VAL A 54 -10.632 2.960 -10.063 1.00 71.44 H new ATOM 0 HA VAL A 54 -7.954 2.073 -10.374 1.00 60.33 H new ATOM 0 HB VAL A 54 -10.199 1.232 -8.494 1.00 34.10 H new ATOM 0 HG11 VAL A 54 -8.455 0.262 -7.022 1.00 75.25 H new ATOM 0 HG12 VAL A 54 -8.560 -0.580 -8.586 1.00 75.25 H new ATOM 0 HG13 VAL A 54 -7.236 0.569 -8.281 1.00 75.25 H new ATOM 0 HG21 VAL A 54 -8.980 2.671 -6.831 1.00 33.12 H new ATOM 0 HG22 VAL A 54 -7.811 3.115 -8.097 1.00 33.12 H new ATOM 0 HG23 VAL A 54 -9.515 3.606 -8.248 1.00 33.12 H new ATOM 829 N LEU A 55 -10.307 -0.084 -11.296 1.00 11.12 N ATOM 830 CA LEU A 55 -10.557 -1.345 -12.039 1.00 63.23 C ATOM 831 C LEU A 55 -10.172 -1.209 -13.523 1.00 13.45 C ATOM 832 O LEU A 55 -9.704 -2.170 -14.137 1.00 3.42 O ATOM 833 CB LEU A 55 -12.045 -1.776 -11.924 1.00 62.34 C ATOM 834 CG LEU A 55 -12.554 -2.151 -10.503 1.00 62.20 C ATOM 835 CD1 LEU A 55 -14.054 -2.508 -10.530 1.00 0.35 C ATOM 836 CD2 LEU A 55 -11.708 -3.285 -9.886 1.00 4.55 C ATOM 0 H LEU A 55 -11.157 0.424 -11.051 1.00 11.12 H new ATOM 0 HA LEU A 55 -9.930 -2.113 -11.586 1.00 63.23 H new ATOM 0 HB2 LEU A 55 -12.665 -0.964 -12.305 1.00 62.34 H new ATOM 0 HB3 LEU A 55 -12.203 -2.632 -12.579 1.00 62.34 H new ATOM 0 HG LEU A 55 -12.437 -1.277 -9.862 1.00 62.20 H new ATOM 0 HD11 LEU A 55 -14.385 -2.766 -9.524 1.00 0.35 H new ATOM 0 HD12 LEU A 55 -14.625 -1.653 -10.891 1.00 0.35 H new ATOM 0 HD13 LEU A 55 -14.214 -3.358 -11.194 1.00 0.35 H new ATOM 0 HD21 LEU A 55 -12.089 -3.524 -8.893 1.00 4.55 H new ATOM 0 HD22 LEU A 55 -11.767 -4.170 -10.520 1.00 4.55 H new ATOM 0 HD23 LEU A 55 -10.669 -2.963 -9.808 1.00 4.55 H new ATOM 848 N ASP A 56 -10.395 -0.005 -14.081 1.00 23.31 N ATOM 849 CA ASP A 56 -10.090 0.303 -15.494 1.00 14.10 C ATOM 850 C ASP A 56 -8.565 0.413 -15.693 1.00 2.33 C ATOM 851 O ASP A 56 -8.037 0.044 -16.748 1.00 3.31 O ATOM 852 CB ASP A 56 -10.820 1.617 -15.913 1.00 53.33 C ATOM 853 CG ASP A 56 -10.730 1.951 -17.415 1.00 72.42 C ATOM 854 OD1 ASP A 56 -10.397 3.097 -17.774 1.00 12.50 O ATOM 855 OD2 ASP A 56 -11.005 1.065 -18.247 1.00 21.22 O ATOM 0 H ASP A 56 -10.791 0.782 -13.567 1.00 23.31 H new ATOM 0 HA ASP A 56 -10.450 -0.503 -16.133 1.00 14.10 H new ATOM 0 HB2 ASP A 56 -11.871 1.538 -15.634 1.00 53.33 H new ATOM 0 HB3 ASP A 56 -10.401 2.447 -15.344 1.00 53.33 H new ATOM 860 N TYR A 57 -7.867 0.894 -14.647 1.00 22.21 N ATOM 861 CA TYR A 57 -6.399 0.976 -14.629 1.00 53.11 C ATOM 862 C TYR A 57 -5.804 -0.429 -14.502 1.00 24.20 C ATOM 863 O TYR A 57 -4.863 -0.774 -15.221 1.00 15.15 O ATOM 864 CB TYR A 57 -5.904 1.873 -13.464 1.00 21.51 C ATOM 865 CG TYR A 57 -4.372 2.059 -13.431 1.00 43.50 C ATOM 866 CD1 TYR A 57 -3.545 1.198 -12.688 1.00 74.14 C ATOM 867 CD2 TYR A 57 -3.757 3.069 -14.173 1.00 23.32 C ATOM 868 CE1 TYR A 57 -2.175 1.344 -12.693 1.00 24.00 C ATOM 869 CE2 TYR A 57 -2.388 3.221 -14.173 1.00 32.42 C ATOM 870 CZ TYR A 57 -1.601 2.357 -13.439 1.00 41.22 C ATOM 871 OH TYR A 57 -0.233 2.493 -13.465 1.00 72.55 O ATOM 0 H TYR A 57 -8.307 1.236 -13.793 1.00 22.21 H new ATOM 0 HA TYR A 57 -6.068 1.426 -15.565 1.00 53.11 H new ATOM 0 HB2 TYR A 57 -6.378 2.851 -13.544 1.00 21.51 H new ATOM 0 HB3 TYR A 57 -6.229 1.438 -12.519 1.00 21.51 H new ATOM 0 HD1 TYR A 57 -3.992 0.408 -12.103 1.00 74.14 H new ATOM 0 HD2 TYR A 57 -4.365 3.743 -14.757 1.00 23.32 H new ATOM 0 HE1 TYR A 57 -1.554 0.672 -12.119 1.00 24.00 H new ATOM 0 HE2 TYR A 57 -1.932 4.014 -14.746 1.00 32.42 H new ATOM 0 HH TYR A 57 0.185 1.611 -13.380 1.00 72.55 H new ATOM 881 N CYS A 58 -6.355 -1.220 -13.556 1.00 65.24 N ATOM 882 CA CYS A 58 -5.929 -2.607 -13.318 1.00 52.41 C ATOM 883 C CYS A 58 -6.175 -3.472 -14.560 1.00 14.13 C ATOM 884 O CYS A 58 -5.418 -4.399 -14.822 1.00 33.15 O ATOM 885 CB CYS A 58 -6.645 -3.194 -12.088 1.00 71.10 C ATOM 886 SG CYS A 58 -6.197 -2.371 -10.545 1.00 34.23 S ATOM 0 H CYS A 58 -7.106 -0.911 -12.939 1.00 65.24 H new ATOM 0 HA CYS A 58 -4.858 -2.605 -13.116 1.00 52.41 H new ATOM 0 HB2 CYS A 58 -7.723 -3.119 -12.233 1.00 71.10 H new ATOM 0 HB3 CYS A 58 -6.407 -4.255 -12.009 1.00 71.10 H new ATOM 0 HG CYS A 58 -6.971 -1.343 -10.361 1.00 34.23 H new ATOM 892 N ARG A 59 -7.238 -3.138 -15.323 1.00 31.41 N ATOM 893 CA ARG A 59 -7.536 -3.785 -16.606 1.00 22.11 C ATOM 894 C ARG A 59 -6.442 -3.476 -17.628 1.00 30.25 C ATOM 895 O ARG A 59 -5.957 -4.387 -18.287 1.00 74.11 O ATOM 896 CB ARG A 59 -8.936 -3.375 -17.140 1.00 3.11 C ATOM 897 CG ARG A 59 -9.240 -3.836 -18.597 1.00 44.14 C ATOM 898 CD ARG A 59 -10.731 -3.746 -18.955 1.00 75.10 C ATOM 899 NE ARG A 59 -11.320 -2.441 -18.612 1.00 51.35 N ATOM 900 CZ ARG A 59 -12.629 -2.216 -18.443 1.00 60.35 C ATOM 901 NH1 ARG A 59 -13.524 -3.202 -18.589 1.00 41.34 N ATOM 902 NH2 ARG A 59 -13.044 -1.007 -18.128 1.00 31.53 N ATOM 0 H ARG A 59 -7.908 -2.414 -15.063 1.00 31.41 H new ATOM 0 HA ARG A 59 -7.557 -4.862 -16.442 1.00 22.11 H new ATOM 0 HB2 ARG A 59 -9.697 -3.787 -16.477 1.00 3.11 H new ATOM 0 HB3 ARG A 59 -9.024 -2.290 -17.091 1.00 3.11 H new ATOM 0 HG2 ARG A 59 -8.667 -3.224 -19.293 1.00 44.14 H new ATOM 0 HG3 ARG A 59 -8.902 -4.865 -18.725 1.00 44.14 H new ATOM 0 HD2 ARG A 59 -10.856 -3.927 -20.023 1.00 75.10 H new ATOM 0 HD3 ARG A 59 -11.274 -4.534 -18.433 1.00 75.10 H new ATOM 0 HE ARG A 59 -10.685 -1.651 -18.495 1.00 51.35 H new ATOM 0 HH11 ARG A 59 -13.212 -4.142 -18.833 1.00 41.34 H new ATOM 0 HH12 ARG A 59 -14.517 -3.013 -18.456 1.00 41.34 H new ATOM 0 HH21 ARG A 59 -12.370 -0.250 -18.014 1.00 31.53 H new ATOM 0 HH22 ARG A 59 -14.040 -0.827 -17.998 1.00 31.53 H new ATOM 916 N HIS A 60 -6.031 -2.194 -17.722 1.00 40.13 N ATOM 917 CA HIS A 60 -4.965 -1.772 -18.656 1.00 41.45 C ATOM 918 C HIS A 60 -3.611 -2.412 -18.268 1.00 33.20 C ATOM 919 O HIS A 60 -2.811 -2.775 -19.141 1.00 13.23 O ATOM 920 CB HIS A 60 -4.845 -0.224 -18.708 1.00 75.10 C ATOM 921 CG HIS A 60 -3.812 0.250 -19.703 1.00 51.32 C ATOM 922 ND1 HIS A 60 -2.684 0.961 -19.358 1.00 33.42 N ATOM 923 CD2 HIS A 60 -3.721 0.040 -21.041 1.00 43.23 C ATOM 924 CE1 HIS A 60 -1.947 1.151 -20.433 1.00 25.22 C ATOM 925 NE2 HIS A 60 -2.556 0.602 -21.465 1.00 43.54 N ATOM 0 H HIS A 60 -6.420 -1.434 -17.164 1.00 40.13 H new ATOM 0 HA HIS A 60 -5.237 -2.121 -19.652 1.00 41.45 H new ATOM 0 HB2 HIS A 60 -5.814 0.202 -18.966 1.00 75.10 H new ATOM 0 HB3 HIS A 60 -4.586 0.149 -17.717 1.00 75.10 H new ATOM 0 HD1 HIS A 60 -2.456 1.288 -18.419 1.00 33.42 H new ATOM 0 HD2 HIS A 60 -4.441 -0.478 -21.657 1.00 43.23 H new ATOM 0 HE1 HIS A 60 -1.001 1.670 -20.464 1.00 25.22 H new ATOM 934 N HIS A 61 -3.391 -2.562 -16.949 1.00 15.33 N ATOM 935 CA HIS A 61 -2.178 -3.189 -16.396 1.00 12.23 C ATOM 936 C HIS A 61 -2.279 -4.731 -16.486 1.00 15.41 C ATOM 937 O HIS A 61 -1.289 -5.433 -16.318 1.00 51.51 O ATOM 938 CB HIS A 61 -1.962 -2.729 -14.926 1.00 14.34 C ATOM 939 CG HIS A 61 -0.571 -2.996 -14.389 1.00 35.02 C ATOM 940 ND1 HIS A 61 -0.144 -4.241 -13.976 1.00 54.32 N ATOM 941 CD2 HIS A 61 0.488 -2.168 -14.209 1.00 71.05 C ATOM 942 CE1 HIS A 61 1.107 -4.167 -13.569 1.00 71.12 C ATOM 943 NE2 HIS A 61 1.513 -2.923 -13.706 1.00 11.54 N ATOM 0 H HIS A 61 -4.051 -2.251 -16.236 1.00 15.33 H new ATOM 0 HA HIS A 61 -1.316 -2.873 -16.984 1.00 12.23 H new ATOM 0 HB2 HIS A 61 -2.167 -1.661 -14.858 1.00 14.34 H new ATOM 0 HB3 HIS A 61 -2.688 -3.234 -14.289 1.00 14.34 H new ATOM 0 HD2 HIS A 61 0.517 -1.110 -14.423 1.00 71.05 H new ATOM 0 HE1 HIS A 61 1.698 -4.987 -13.188 1.00 71.12 H new ATOM 0 HE2 HIS A 61 2.444 -2.576 -13.474 1.00 11.54 H new ATOM 952 N HIS A 62 -3.498 -5.248 -16.712 1.00 72.42 N ATOM 953 CA HIS A 62 -3.733 -6.682 -16.970 1.00 12.54 C ATOM 954 C HIS A 62 -3.450 -6.996 -18.451 1.00 2.31 C ATOM 955 O HIS A 62 -2.960 -8.082 -18.782 1.00 32.24 O ATOM 956 CB HIS A 62 -5.187 -7.056 -16.593 1.00 44.24 C ATOM 957 CG HIS A 62 -5.510 -8.521 -16.663 1.00 61.43 C ATOM 958 ND1 HIS A 62 -5.380 -9.375 -15.588 1.00 20.31 N ATOM 959 CD2 HIS A 62 -5.976 -9.276 -17.681 1.00 64.53 C ATOM 960 CE1 HIS A 62 -5.754 -10.583 -15.947 1.00 2.24 C ATOM 961 NE2 HIS A 62 -6.118 -10.546 -17.212 1.00 53.11 N ATOM 0 H HIS A 62 -4.349 -4.686 -16.721 1.00 72.42 H new ATOM 0 HA HIS A 62 -3.058 -7.277 -16.355 1.00 12.54 H new ATOM 0 HB2 HIS A 62 -5.384 -6.705 -15.580 1.00 44.24 H new ATOM 0 HB3 HIS A 62 -5.866 -6.519 -17.255 1.00 44.24 H new ATOM 0 HD2 HIS A 62 -6.195 -8.935 -18.682 1.00 64.53 H new ATOM 0 HE1 HIS A 62 -5.761 -11.457 -15.313 1.00 2.24 H new ATOM 0 HE2 HIS A 62 -6.453 -11.342 -17.754 1.00 53.11 H new ATOM 970 N GLN A 63 -3.779 -6.030 -19.334 1.00 72.33 N ATOM 971 CA GLN A 63 -3.509 -6.140 -20.780 1.00 23.20 C ATOM 972 C GLN A 63 -1.993 -6.017 -21.039 1.00 31.43 C ATOM 973 O GLN A 63 -1.449 -6.634 -21.962 1.00 63.31 O ATOM 974 CB GLN A 63 -4.272 -5.045 -21.589 1.00 14.34 C ATOM 975 CG GLN A 63 -5.798 -4.941 -21.342 1.00 22.01 C ATOM 976 CD GLN A 63 -6.546 -6.272 -21.440 1.00 71.33 C ATOM 977 OE1 GLN A 63 -6.746 -6.969 -20.440 1.00 44.30 O ATOM 978 NE2 GLN A 63 -6.953 -6.631 -22.647 1.00 71.44 N ATOM 0 H GLN A 63 -4.236 -5.158 -19.066 1.00 72.33 H new ATOM 0 HA GLN A 63 -3.863 -7.115 -21.115 1.00 23.20 H new ATOM 0 HB2 GLN A 63 -3.823 -4.078 -21.362 1.00 14.34 H new ATOM 0 HB3 GLN A 63 -4.110 -5.230 -22.651 1.00 14.34 H new ATOM 0 HG2 GLN A 63 -5.965 -4.516 -20.352 1.00 22.01 H new ATOM 0 HG3 GLN A 63 -6.224 -4.245 -22.064 1.00 22.01 H new ATOM 0 HE21 GLN A 63 -6.768 -6.027 -23.448 1.00 71.44 H new ATOM 0 HE22 GLN A 63 -7.451 -7.511 -22.776 1.00 71.44 H new ATOM 987 N HIS A 64 -1.326 -5.191 -20.208 1.00 3.11 N ATOM 988 CA HIS A 64 0.131 -4.966 -20.265 1.00 61.12 C ATOM 989 C HIS A 64 0.697 -5.118 -18.837 1.00 74.53 C ATOM 990 O HIS A 64 0.686 -4.144 -18.068 1.00 1.42 O ATOM 991 CB HIS A 64 0.450 -3.547 -20.829 1.00 61.05 C ATOM 992 CG HIS A 64 -0.160 -3.264 -22.177 1.00 13.30 C ATOM 993 ND1 HIS A 64 0.433 -3.626 -23.366 1.00 63.43 N ATOM 994 CD2 HIS A 64 -1.319 -2.653 -22.516 1.00 1.51 C ATOM 995 CE1 HIS A 64 -0.341 -3.266 -24.367 1.00 15.14 C ATOM 996 NE2 HIS A 64 -1.409 -2.672 -23.877 1.00 3.32 N ATOM 0 H HIS A 64 -1.788 -4.657 -19.472 1.00 3.11 H new ATOM 0 HA HIS A 64 0.592 -5.695 -20.932 1.00 61.12 H new ATOM 0 HB2 HIS A 64 0.097 -2.799 -20.119 1.00 61.05 H new ATOM 0 HB3 HIS A 64 1.532 -3.432 -20.901 1.00 61.05 H new ATOM 0 HD2 HIS A 64 -2.041 -2.228 -21.834 1.00 1.51 H new ATOM 0 HE1 HIS A 64 -0.135 -3.430 -25.414 1.00 15.14 H new ATOM 0 HE2 HIS A 64 -2.178 -2.288 -24.426 1.00 3.32 H new ATOM 1005 N PRO A 65 1.148 -6.359 -18.430 1.00 5.14 N ATOM 1006 CA PRO A 65 1.673 -6.625 -17.055 1.00 54.32 C ATOM 1007 C PRO A 65 2.932 -5.801 -16.704 1.00 3.13 C ATOM 1008 O PRO A 65 3.323 -5.729 -15.535 1.00 3.21 O ATOM 1009 CB PRO A 65 1.969 -8.155 -17.066 1.00 72.51 C ATOM 1010 CG PRO A 65 2.129 -8.496 -18.519 1.00 2.41 C ATOM 1011 CD PRO A 65 1.155 -7.598 -19.257 1.00 45.12 C ATOM 0 HA PRO A 65 0.957 -6.328 -16.289 1.00 54.32 H new ATOM 0 HB2 PRO A 65 2.872 -8.389 -16.502 1.00 72.51 H new ATOM 0 HB3 PRO A 65 1.155 -8.720 -16.613 1.00 72.51 H new ATOM 0 HG2 PRO A 65 3.152 -8.322 -18.852 1.00 2.41 H new ATOM 0 HG3 PRO A 65 1.908 -9.548 -18.702 1.00 2.41 H new ATOM 0 HD2 PRO A 65 1.483 -7.400 -20.278 1.00 45.12 H new ATOM 0 HD3 PRO A 65 0.163 -8.046 -19.322 1.00 45.12 H new ATOM 1019 N GLY A 66 3.566 -5.206 -17.724 1.00 50.42 N ATOM 1020 CA GLY A 66 4.690 -4.289 -17.536 1.00 51.42 C ATOM 1021 C GLY A 66 4.607 -3.107 -18.493 1.00 33.53 C ATOM 1022 O GLY A 66 4.846 -1.960 -18.104 1.00 34.11 O ATOM 0 H GLY A 66 3.311 -5.349 -18.701 1.00 50.42 H new ATOM 0 HA2 GLY A 66 4.699 -3.927 -16.508 1.00 51.42 H new ATOM 0 HA3 GLY A 66 5.627 -4.822 -17.694 1.00 51.42 H new ATOM 1026 N GLY A 67 4.253 -3.395 -19.758 1.00 53.22 N ATOM 1027 CA GLY A 67 4.176 -2.382 -20.815 1.00 24.14 C ATOM 1028 C GLY A 67 5.497 -2.240 -21.568 1.00 54.21 C ATOM 1029 O GLY A 67 6.555 -2.143 -20.943 1.00 42.11 O ATOM 0 H GLY A 67 4.014 -4.336 -20.072 1.00 53.22 H new ATOM 0 HA2 GLY A 67 3.386 -2.649 -21.516 1.00 24.14 H new ATOM 0 HA3 GLY A 67 3.903 -1.422 -20.378 1.00 24.14 H new ATOM 1033 N SER A 68 5.436 -2.208 -22.911 1.00 34.12 N ATOM 1034 CA SER A 68 6.634 -2.087 -23.774 1.00 22.13 C ATOM 1035 C SER A 68 7.214 -0.645 -23.776 1.00 63.45 C ATOM 1036 O SER A 68 8.273 -0.402 -24.372 1.00 63.15 O ATOM 1037 CB SER A 68 6.275 -2.517 -25.214 1.00 73.53 C ATOM 1038 OG SER A 68 5.714 -3.828 -25.244 1.00 1.22 O ATOM 0 H SER A 68 4.560 -2.265 -23.431 1.00 34.12 H new ATOM 0 HA SER A 68 7.405 -2.742 -23.369 1.00 22.13 H new ATOM 0 HB2 SER A 68 5.566 -1.807 -25.641 1.00 73.53 H new ATOM 0 HB3 SER A 68 7.169 -2.488 -25.837 1.00 73.53 H new ATOM 0 HG SER A 68 5.496 -4.070 -26.168 1.00 1.22 H new ATOM 1044 N GLY A 69 6.501 0.287 -23.113 1.00 25.51 N ATOM 1045 CA GLY A 69 6.927 1.674 -22.987 1.00 51.45 C ATOM 1046 C GLY A 69 8.166 1.838 -22.107 1.00 51.52 C ATOM 1047 O GLY A 69 8.067 1.723 -20.880 1.00 2.44 O ATOM 0 H GLY A 69 5.613 0.087 -22.653 1.00 25.51 H new ATOM 0 HA2 GLY A 69 7.136 2.076 -23.978 1.00 51.45 H new ATOM 0 HA3 GLY A 69 6.110 2.263 -22.570 1.00 51.45 H new ATOM 1051 N LEU A 70 9.329 2.075 -22.748 1.00 24.43 N ATOM 1052 CA LEU A 70 10.609 2.366 -22.055 1.00 71.23 C ATOM 1053 C LEU A 70 10.539 3.734 -21.317 1.00 3.33 C ATOM 1054 O LEU A 70 10.905 4.771 -21.875 1.00 44.25 O ATOM 1055 CB LEU A 70 11.837 2.263 -23.049 1.00 24.24 C ATOM 1056 CG LEU A 70 11.599 2.560 -24.583 1.00 13.24 C ATOM 1057 CD1 LEU A 70 11.088 3.991 -24.853 1.00 20.20 C ATOM 1058 CD2 LEU A 70 12.876 2.283 -25.397 1.00 24.04 C ATOM 0 H LEU A 70 9.411 2.071 -23.765 1.00 24.43 H new ATOM 0 HA LEU A 70 10.771 1.605 -21.291 1.00 71.23 H new ATOM 0 HB2 LEU A 70 12.607 2.949 -22.695 1.00 24.24 H new ATOM 0 HB3 LEU A 70 12.245 1.256 -22.967 1.00 24.24 H new ATOM 0 HG LEU A 70 10.811 1.881 -24.907 1.00 13.24 H new ATOM 0 HD11 LEU A 70 10.945 4.130 -25.925 1.00 20.20 H new ATOM 0 HD12 LEU A 70 10.139 4.142 -24.338 1.00 20.20 H new ATOM 0 HD13 LEU A 70 11.818 4.713 -24.488 1.00 20.20 H new ATOM 0 HD21 LEU A 70 12.689 2.494 -26.450 1.00 24.04 H new ATOM 0 HD22 LEU A 70 13.683 2.921 -25.037 1.00 24.04 H new ATOM 0 HD23 LEU A 70 13.161 1.237 -25.282 1.00 24.04 H new ATOM 1070 N ASP A 71 9.989 3.698 -20.069 1.00 74.45 N ATOM 1071 CA ASP A 71 9.673 4.902 -19.234 1.00 54.23 C ATOM 1072 C ASP A 71 8.554 5.755 -19.903 1.00 12.30 C ATOM 1073 O ASP A 71 8.190 6.843 -19.445 1.00 34.42 O ATOM 1074 CB ASP A 71 10.967 5.728 -18.946 1.00 0.43 C ATOM 1075 CG ASP A 71 10.768 6.963 -18.041 1.00 72.23 C ATOM 1076 OD1 ASP A 71 10.802 8.107 -18.542 1.00 24.21 O ATOM 1077 OD2 ASP A 71 10.571 6.793 -16.823 1.00 11.33 O ATOM 0 H ASP A 71 9.748 2.822 -19.606 1.00 74.45 H new ATOM 0 HA ASP A 71 9.287 4.573 -18.269 1.00 54.23 H new ATOM 0 HB2 ASP A 71 11.703 5.071 -18.482 1.00 0.43 H new ATOM 0 HB3 ASP A 71 11.388 6.057 -19.896 1.00 0.43 H new ATOM 1082 N ASP A 72 7.953 5.192 -20.955 1.00 53.21 N ATOM 1083 CA ASP A 72 6.975 5.867 -21.803 1.00 53.30 C ATOM 1084 C ASP A 72 5.581 5.569 -21.256 1.00 53.34 C ATOM 1085 O ASP A 72 4.993 4.513 -21.533 1.00 41.03 O ATOM 1086 CB ASP A 72 7.138 5.393 -23.274 1.00 72.23 C ATOM 1087 CG ASP A 72 6.074 5.946 -24.244 1.00 34.21 C ATOM 1088 OD1 ASP A 72 6.046 7.169 -24.461 1.00 60.13 O ATOM 1089 OD2 ASP A 72 5.271 5.161 -24.805 1.00 4.41 O ATOM 0 H ASP A 72 8.139 4.232 -21.245 1.00 53.21 H new ATOM 0 HA ASP A 72 7.130 6.946 -21.795 1.00 53.30 H new ATOM 0 HB2 ASP A 72 8.125 5.688 -23.630 1.00 72.23 H new ATOM 0 HB3 ASP A 72 7.103 4.304 -23.298 1.00 72.23 H new ATOM 1094 N ILE A 73 5.114 6.487 -20.410 1.00 64.42 N ATOM 1095 CA ILE A 73 3.800 6.422 -19.773 1.00 24.43 C ATOM 1096 C ILE A 73 2.706 6.725 -20.825 1.00 64.31 C ATOM 1097 O ILE A 73 2.733 7.814 -21.423 1.00 15.34 O ATOM 1098 CB ILE A 73 3.705 7.452 -18.581 1.00 32.24 C ATOM 1099 CG1 ILE A 73 4.855 7.214 -17.545 1.00 74.41 C ATOM 1100 CG2 ILE A 73 2.314 7.398 -17.892 1.00 43.12 C ATOM 1101 CD1 ILE A 73 4.917 8.235 -16.417 1.00 1.33 C ATOM 0 H ILE A 73 5.650 7.313 -20.143 1.00 64.42 H new ATOM 0 HA ILE A 73 3.652 5.421 -19.369 1.00 24.43 H new ATOM 0 HB ILE A 73 3.825 8.452 -18.998 1.00 32.24 H new ATOM 0 HG12 ILE A 73 4.735 6.221 -17.112 1.00 74.41 H new ATOM 0 HG13 ILE A 73 5.808 7.218 -18.074 1.00 74.41 H new ATOM 0 HG21 ILE A 73 2.284 8.120 -17.076 1.00 43.12 H new ATOM 0 HG22 ILE A 73 1.538 7.639 -18.619 1.00 43.12 H new ATOM 0 HG23 ILE A 73 2.142 6.397 -17.497 1.00 43.12 H new ATOM 0 HD11 ILE A 73 5.743 7.990 -15.749 1.00 1.33 H new ATOM 0 HD12 ILE A 73 5.071 9.230 -16.835 1.00 1.33 H new ATOM 0 HD13 ILE A 73 3.981 8.217 -15.858 1.00 1.33 H new ATOM 1113 N PRO A 74 1.755 5.763 -21.102 1.00 61.43 N ATOM 1114 CA PRO A 74 0.645 5.985 -22.064 1.00 32.43 C ATOM 1115 C PRO A 74 -0.270 7.163 -21.631 1.00 52.04 C ATOM 1116 O PRO A 74 -0.414 7.411 -20.425 1.00 64.00 O ATOM 1117 CB PRO A 74 -0.117 4.627 -22.075 1.00 60.11 C ATOM 1118 CG PRO A 74 0.869 3.629 -21.536 1.00 51.32 C ATOM 1119 CD PRO A 74 1.685 4.392 -20.515 1.00 73.21 C ATOM 0 HA PRO A 74 1.002 6.268 -23.054 1.00 32.43 H new ATOM 0 HB2 PRO A 74 -1.013 4.671 -21.456 1.00 60.11 H new ATOM 0 HB3 PRO A 74 -0.438 4.362 -23.082 1.00 60.11 H new ATOM 0 HG2 PRO A 74 0.361 2.780 -21.079 1.00 51.32 H new ATOM 0 HG3 PRO A 74 1.502 3.232 -22.330 1.00 51.32 H new ATOM 0 HD2 PRO A 74 1.206 4.396 -19.536 1.00 73.21 H new ATOM 0 HD3 PRO A 74 2.676 3.958 -20.383 1.00 73.21 H new ATOM 1127 N PRO A 75 -0.885 7.914 -22.612 1.00 32.12 N ATOM 1128 CA PRO A 75 -1.717 9.116 -22.324 1.00 45.03 C ATOM 1129 C PRO A 75 -2.823 8.870 -21.278 1.00 41.53 C ATOM 1130 O PRO A 75 -3.115 9.757 -20.466 1.00 65.02 O ATOM 1131 CB PRO A 75 -2.324 9.473 -23.702 1.00 12.30 C ATOM 1132 CG PRO A 75 -1.342 8.929 -24.694 1.00 63.14 C ATOM 1133 CD PRO A 75 -0.803 7.653 -24.079 1.00 1.31 C ATOM 0 HA PRO A 75 -1.119 9.914 -21.884 1.00 45.03 H new ATOM 0 HB2 PRO A 75 -3.309 9.024 -23.831 1.00 12.30 H new ATOM 0 HB3 PRO A 75 -2.447 10.550 -23.815 1.00 12.30 H new ATOM 0 HG2 PRO A 75 -1.823 8.730 -25.652 1.00 63.14 H new ATOM 0 HG3 PRO A 75 -0.540 9.642 -24.882 1.00 63.14 H new ATOM 0 HD2 PRO A 75 -1.398 6.786 -24.367 1.00 1.31 H new ATOM 0 HD3 PRO A 75 0.221 7.456 -24.395 1.00 1.31 H new ATOM 1141 N TYR A 76 -3.407 7.651 -21.306 1.00 71.23 N ATOM 1142 CA TYR A 76 -4.415 7.215 -20.327 1.00 21.22 C ATOM 1143 C TYR A 76 -3.868 7.328 -18.896 1.00 32.04 C ATOM 1144 O TYR A 76 -4.457 8.002 -18.055 1.00 45.43 O ATOM 1145 CB TYR A 76 -4.881 5.745 -20.608 1.00 23.33 C ATOM 1146 CG TYR A 76 -5.687 5.109 -19.446 1.00 3.05 C ATOM 1147 CD1 TYR A 76 -6.929 5.626 -19.074 1.00 73.35 C ATOM 1148 CD2 TYR A 76 -5.178 4.034 -18.696 1.00 41.44 C ATOM 1149 CE1 TYR A 76 -7.628 5.114 -18.001 1.00 11.34 C ATOM 1150 CE2 TYR A 76 -5.883 3.511 -17.628 1.00 64.33 C ATOM 1151 CZ TYR A 76 -7.104 4.057 -17.283 1.00 22.20 C ATOM 1152 OH TYR A 76 -7.798 3.566 -16.199 1.00 31.14 O ATOM 0 H TYR A 76 -3.189 6.946 -22.010 1.00 71.23 H new ATOM 0 HA TYR A 76 -5.278 7.874 -20.428 1.00 21.22 H new ATOM 0 HB2 TYR A 76 -5.493 5.734 -21.510 1.00 23.33 H new ATOM 0 HB3 TYR A 76 -4.005 5.129 -20.810 1.00 23.33 H new ATOM 0 HD1 TYR A 76 -7.352 6.444 -19.638 1.00 73.35 H new ATOM 0 HD2 TYR A 76 -4.220 3.610 -18.959 1.00 41.44 H new ATOM 0 HE1 TYR A 76 -8.582 5.538 -17.723 1.00 11.34 H new ATOM 0 HE2 TYR A 76 -5.481 2.680 -17.067 1.00 64.33 H new ATOM 0 HH TYR A 76 -8.724 3.379 -16.461 1.00 31.14 H new ATOM 1162 N ASP A 77 -2.727 6.672 -18.666 1.00 43.12 N ATOM 1163 CA ASP A 77 -2.145 6.480 -17.328 1.00 74.13 C ATOM 1164 C ASP A 77 -1.595 7.809 -16.771 1.00 4.22 C ATOM 1165 O ASP A 77 -1.560 8.012 -15.551 1.00 63.43 O ATOM 1166 CB ASP A 77 -1.034 5.397 -17.394 1.00 34.12 C ATOM 1167 CG ASP A 77 -1.519 4.075 -18.033 1.00 13.15 C ATOM 1168 OD1 ASP A 77 -1.666 3.049 -17.330 1.00 22.42 O ATOM 1169 OD2 ASP A 77 -1.780 4.066 -19.257 1.00 53.42 O ATOM 0 H ASP A 77 -2.172 6.253 -19.412 1.00 43.12 H new ATOM 0 HA ASP A 77 -2.925 6.140 -16.647 1.00 74.13 H new ATOM 0 HB2 ASP A 77 -0.191 5.783 -17.966 1.00 34.12 H new ATOM 0 HB3 ASP A 77 -0.670 5.195 -16.387 1.00 34.12 H new ATOM 1174 N ARG A 78 -1.177 8.706 -17.685 1.00 3.24 N ATOM 1175 CA ARG A 78 -0.671 10.043 -17.339 1.00 54.11 C ATOM 1176 C ARG A 78 -1.824 10.953 -16.857 1.00 31.05 C ATOM 1177 O ARG A 78 -1.742 11.568 -15.790 1.00 22.24 O ATOM 1178 CB ARG A 78 0.053 10.675 -18.563 1.00 23.14 C ATOM 1179 CG ARG A 78 0.711 12.047 -18.274 1.00 2.41 C ATOM 1180 CD ARG A 78 1.405 12.663 -19.502 1.00 44.31 C ATOM 1181 NE ARG A 78 2.041 13.948 -19.164 1.00 34.11 N ATOM 1182 CZ ARG A 78 2.160 15.010 -19.978 1.00 5.31 C ATOM 1183 NH1 ARG A 78 1.694 14.977 -21.221 1.00 11.43 N ATOM 1184 NH2 ARG A 78 2.740 16.112 -19.529 1.00 64.14 N ATOM 0 H ARG A 78 -1.182 8.520 -18.688 1.00 3.24 H new ATOM 0 HA ARG A 78 0.046 9.945 -16.524 1.00 54.11 H new ATOM 0 HB2 ARG A 78 0.820 9.984 -18.914 1.00 23.14 H new ATOM 0 HB3 ARG A 78 -0.665 10.793 -19.374 1.00 23.14 H new ATOM 0 HG2 ARG A 78 -0.050 12.738 -17.912 1.00 2.41 H new ATOM 0 HG3 ARG A 78 1.442 11.930 -17.474 1.00 2.41 H new ATOM 0 HD2 ARG A 78 2.156 11.971 -19.884 1.00 44.31 H new ATOM 0 HD3 ARG A 78 0.676 12.813 -20.298 1.00 44.31 H new ATOM 0 HE ARG A 78 2.427 14.040 -18.224 1.00 34.11 H new ATOM 0 HH11 ARG A 78 1.237 14.136 -21.572 1.00 11.43 H new ATOM 0 HH12 ARG A 78 1.793 15.793 -21.825 1.00 11.43 H new ATOM 0 HH21 ARG A 78 3.092 16.150 -18.572 1.00 64.14 H new ATOM 0 HH22 ARG A 78 2.835 16.923 -20.140 1.00 64.14 H new ATOM 1198 N ASP A 79 -2.905 11.015 -17.660 1.00 12.44 N ATOM 1199 CA ASP A 79 -4.110 11.822 -17.342 1.00 51.35 C ATOM 1200 C ASP A 79 -4.916 11.200 -16.182 1.00 44.32 C ATOM 1201 O ASP A 79 -5.706 11.895 -15.528 1.00 13.32 O ATOM 1202 CB ASP A 79 -5.003 12.008 -18.600 1.00 22.22 C ATOM 1203 CG ASP A 79 -4.404 12.977 -19.639 1.00 44.43 C ATOM 1204 OD1 ASP A 79 -4.025 12.542 -20.746 1.00 22.53 O ATOM 1205 OD2 ASP A 79 -4.302 14.186 -19.349 1.00 42.24 O ATOM 0 H ASP A 79 -2.972 10.511 -18.544 1.00 12.44 H new ATOM 0 HA ASP A 79 -3.771 12.806 -17.018 1.00 51.35 H new ATOM 0 HB2 ASP A 79 -5.163 11.037 -19.069 1.00 22.22 H new ATOM 0 HB3 ASP A 79 -5.981 12.378 -18.291 1.00 22.22 H new ATOM 1210 N PHE A 80 -4.722 9.887 -15.966 1.00 64.54 N ATOM 1211 CA PHE A 80 -5.302 9.149 -14.831 1.00 12.54 C ATOM 1212 C PHE A 80 -4.828 9.767 -13.501 1.00 45.13 C ATOM 1213 O PHE A 80 -5.625 9.998 -12.584 1.00 3.54 O ATOM 1214 CB PHE A 80 -4.883 7.652 -14.924 1.00 62.33 C ATOM 1215 CG PHE A 80 -5.462 6.773 -13.833 1.00 41.30 C ATOM 1216 CD1 PHE A 80 -4.801 6.607 -12.613 1.00 15.01 C ATOM 1217 CD2 PHE A 80 -6.678 6.136 -14.016 1.00 2.41 C ATOM 1218 CE1 PHE A 80 -5.344 5.837 -11.622 1.00 73.31 C ATOM 1219 CE2 PHE A 80 -7.214 5.362 -13.026 1.00 71.10 C ATOM 1220 CZ PHE A 80 -6.553 5.212 -11.823 1.00 13.01 C ATOM 0 H PHE A 80 -4.153 9.304 -16.580 1.00 64.54 H new ATOM 0 HA PHE A 80 -6.389 9.215 -14.868 1.00 12.54 H new ATOM 0 HB2 PHE A 80 -5.192 7.260 -15.893 1.00 62.33 H new ATOM 0 HB3 PHE A 80 -3.795 7.588 -14.887 1.00 62.33 H new ATOM 0 HD1 PHE A 80 -3.850 7.093 -12.451 1.00 15.01 H new ATOM 0 HD2 PHE A 80 -7.208 6.252 -14.950 1.00 2.41 H new ATOM 0 HE1 PHE A 80 -4.824 5.720 -10.683 1.00 73.31 H new ATOM 0 HE2 PHE A 80 -8.160 4.865 -13.185 1.00 71.10 H new ATOM 0 HZ PHE A 80 -6.984 4.605 -11.041 1.00 13.01 H new ATOM 1230 N CYS A 81 -3.513 10.030 -13.442 1.00 34.14 N ATOM 1231 CA CYS A 81 -2.849 10.605 -12.268 1.00 13.33 C ATOM 1232 C CYS A 81 -3.235 12.087 -12.062 1.00 71.41 C ATOM 1233 O CYS A 81 -3.053 12.632 -10.964 1.00 15.22 O ATOM 1234 CB CYS A 81 -1.327 10.443 -12.427 1.00 34.13 C ATOM 1235 SG CYS A 81 -0.785 8.724 -12.631 1.00 54.41 S ATOM 0 H CYS A 81 -2.877 9.846 -14.218 1.00 34.14 H new ATOM 0 HA CYS A 81 -3.180 10.071 -11.377 1.00 13.33 H new ATOM 0 HB2 CYS A 81 -0.999 11.022 -13.290 1.00 34.13 H new ATOM 0 HB3 CYS A 81 -0.834 10.867 -11.553 1.00 34.13 H new ATOM 0 HG CYS A 81 -1.086 8.313 -13.827 1.00 54.41 H new ATOM 1241 N LYS A 82 -3.770 12.733 -13.124 1.00 12.43 N ATOM 1242 CA LYS A 82 -4.247 14.123 -13.062 1.00 2.31 C ATOM 1243 C LYS A 82 -5.651 14.171 -12.442 1.00 72.24 C ATOM 1244 O LYS A 82 -6.669 14.247 -13.139 1.00 32.32 O ATOM 1245 CB LYS A 82 -4.236 14.780 -14.463 1.00 2.02 C ATOM 1246 CG LYS A 82 -2.850 14.818 -15.140 1.00 50.13 C ATOM 1247 CD LYS A 82 -2.898 15.564 -16.497 1.00 2.11 C ATOM 1248 CE LYS A 82 -1.550 15.596 -17.231 1.00 2.42 C ATOM 1249 NZ LYS A 82 -1.623 16.429 -18.467 1.00 22.10 N ATOM 0 H LYS A 82 -3.880 12.302 -14.042 1.00 12.43 H new ATOM 0 HA LYS A 82 -3.568 14.693 -12.428 1.00 2.31 H new ATOM 0 HB2 LYS A 82 -4.928 14.240 -15.109 1.00 2.02 H new ATOM 0 HB3 LYS A 82 -4.612 15.799 -14.376 1.00 2.02 H new ATOM 0 HG2 LYS A 82 -2.135 15.309 -14.479 1.00 50.13 H new ATOM 0 HG3 LYS A 82 -2.493 13.800 -15.296 1.00 50.13 H new ATOM 0 HD2 LYS A 82 -3.640 15.087 -17.138 1.00 2.11 H new ATOM 0 HD3 LYS A 82 -3.234 16.587 -16.328 1.00 2.11 H new ATOM 0 HE2 LYS A 82 -0.782 15.993 -16.567 1.00 2.42 H new ATOM 0 HE3 LYS A 82 -1.252 14.581 -17.492 1.00 2.42 H new ATOM 0 HZ1 LYS A 82 -0.697 16.430 -18.940 1.00 22.10 H new ATOM 0 HZ2 LYS A 82 -2.339 16.035 -19.110 1.00 22.10 H new ATOM 0 HZ3 LYS A 82 -1.884 17.403 -18.214 1.00 22.10 H new ATOM 1263 N VAL A 83 -5.680 14.043 -11.120 1.00 33.54 N ATOM 1264 CA VAL A 83 -6.888 14.175 -10.298 1.00 51.32 C ATOM 1265 C VAL A 83 -6.633 15.231 -9.211 1.00 13.33 C ATOM 1266 O VAL A 83 -5.504 15.738 -9.087 1.00 62.30 O ATOM 1267 CB VAL A 83 -7.287 12.794 -9.651 1.00 42.31 C ATOM 1268 CG1 VAL A 83 -7.793 11.786 -10.715 1.00 22.34 C ATOM 1269 CG2 VAL A 83 -6.111 12.195 -8.844 1.00 51.11 C ATOM 0 H VAL A 83 -4.845 13.839 -10.571 1.00 33.54 H new ATOM 0 HA VAL A 83 -7.720 14.490 -10.928 1.00 51.32 H new ATOM 0 HB VAL A 83 -8.110 12.987 -8.962 1.00 42.31 H new ATOM 0 HG11 VAL A 83 -8.058 10.847 -10.229 1.00 22.34 H new ATOM 0 HG12 VAL A 83 -8.670 12.196 -11.216 1.00 22.34 H new ATOM 0 HG13 VAL A 83 -7.007 11.606 -11.449 1.00 22.34 H new ATOM 0 HG21 VAL A 83 -6.416 11.243 -8.409 1.00 51.11 H new ATOM 0 HG22 VAL A 83 -5.259 12.036 -9.506 1.00 51.11 H new ATOM 0 HG23 VAL A 83 -5.828 12.883 -8.048 1.00 51.11 H new ATOM 1279 N ASP A 84 -7.678 15.584 -8.440 1.00 74.41 N ATOM 1280 CA ASP A 84 -7.546 16.521 -7.300 1.00 54.41 C ATOM 1281 C ASP A 84 -6.689 15.879 -6.202 1.00 21.40 C ATOM 1282 O ASP A 84 -6.557 14.658 -6.162 1.00 32.24 O ATOM 1283 CB ASP A 84 -8.933 16.889 -6.728 1.00 21.01 C ATOM 1284 CG ASP A 84 -9.906 17.441 -7.783 1.00 62.45 C ATOM 1285 OD1 ASP A 84 -9.905 18.663 -8.048 1.00 52.52 O ATOM 1286 OD2 ASP A 84 -10.683 16.650 -8.361 1.00 61.12 O ATOM 0 H ASP A 84 -8.626 15.236 -8.583 1.00 74.41 H new ATOM 0 HA ASP A 84 -7.066 17.433 -7.655 1.00 54.41 H new ATOM 0 HB2 ASP A 84 -9.373 16.005 -6.267 1.00 21.01 H new ATOM 0 HB3 ASP A 84 -8.807 17.630 -5.939 1.00 21.01 H new ATOM 1291 N GLN A 85 -6.108 16.702 -5.315 1.00 32.11 N ATOM 1292 CA GLN A 85 -5.246 16.212 -4.218 1.00 24.45 C ATOM 1293 C GLN A 85 -6.024 15.286 -3.214 1.00 1.24 C ATOM 1294 O GLN A 85 -5.458 14.260 -2.800 1.00 33.10 O ATOM 1295 CB GLN A 85 -4.533 17.388 -3.486 1.00 72.32 C ATOM 1296 CG GLN A 85 -3.469 16.969 -2.443 1.00 35.52 C ATOM 1297 CD GLN A 85 -2.341 16.127 -3.051 1.00 74.01 C ATOM 1298 OE1 GLN A 85 -1.339 16.660 -3.531 1.00 24.23 O ATOM 1299 NE2 GLN A 85 -2.487 14.812 -3.026 1.00 71.21 N ATOM 0 H GLN A 85 -6.218 17.716 -5.333 1.00 32.11 H new ATOM 0 HA GLN A 85 -4.474 15.593 -4.675 1.00 24.45 H new ATOM 0 HB2 GLN A 85 -4.056 18.023 -4.232 1.00 72.32 H new ATOM 0 HB3 GLN A 85 -5.288 17.995 -2.987 1.00 72.32 H new ATOM 0 HG2 GLN A 85 -3.044 17.862 -1.986 1.00 35.52 H new ATOM 0 HG3 GLN A 85 -3.951 16.402 -1.647 1.00 35.52 H new ATOM 0 HE21 GLN A 85 -3.328 14.400 -2.622 1.00 71.21 H new ATOM 0 HE22 GLN A 85 -1.759 14.211 -3.411 1.00 71.21 H new ATOM 1308 N PRO A 86 -7.308 15.613 -2.785 1.00 33.35 N ATOM 1309 CA PRO A 86 -8.152 14.653 -2.025 1.00 5.35 C ATOM 1310 C PRO A 86 -8.426 13.364 -2.828 1.00 22.01 C ATOM 1311 O PRO A 86 -8.306 12.269 -2.292 1.00 62.44 O ATOM 1312 CB PRO A 86 -9.468 15.448 -1.739 1.00 54.21 C ATOM 1313 CG PRO A 86 -9.461 16.563 -2.742 1.00 52.15 C ATOM 1314 CD PRO A 86 -8.007 16.928 -2.923 1.00 64.53 C ATOM 0 HA PRO A 86 -7.666 14.310 -1.112 1.00 5.35 H new ATOM 0 HB2 PRO A 86 -10.347 14.815 -1.856 1.00 54.21 H new ATOM 0 HB3 PRO A 86 -9.486 15.832 -0.719 1.00 54.21 H new ATOM 0 HG2 PRO A 86 -9.907 16.247 -3.685 1.00 52.15 H new ATOM 0 HG3 PRO A 86 -10.039 17.416 -2.386 1.00 52.15 H new ATOM 0 HD2 PRO A 86 -7.823 17.382 -3.897 1.00 64.53 H new ATOM 0 HD3 PRO A 86 -7.674 17.643 -2.170 1.00 64.53 H new ATOM 1322 N THR A 87 -8.751 13.531 -4.129 1.00 41.45 N ATOM 1323 CA THR A 87 -9.080 12.427 -5.049 1.00 42.23 C ATOM 1324 C THR A 87 -7.855 11.505 -5.283 1.00 14.15 C ATOM 1325 O THR A 87 -8.001 10.307 -5.523 1.00 11.35 O ATOM 1326 CB THR A 87 -9.599 12.996 -6.411 1.00 13.54 C ATOM 1327 OG1 THR A 87 -10.599 14.000 -6.164 1.00 43.45 O ATOM 1328 CG2 THR A 87 -10.190 11.904 -7.325 1.00 42.01 C ATOM 0 H THR A 87 -8.792 14.449 -4.572 1.00 41.45 H new ATOM 0 HA THR A 87 -9.867 11.829 -4.590 1.00 42.23 H new ATOM 0 HB THR A 87 -8.741 13.426 -6.927 1.00 13.54 H new ATOM 0 HG1 THR A 87 -10.922 14.357 -7.018 1.00 43.45 H new ATOM 0 HG21 THR A 87 -10.534 12.355 -8.255 1.00 42.01 H new ATOM 0 HG22 THR A 87 -9.425 11.160 -7.544 1.00 42.01 H new ATOM 0 HG23 THR A 87 -11.030 11.424 -6.822 1.00 42.01 H new ATOM 1336 N LEU A 88 -6.651 12.097 -5.199 1.00 73.42 N ATOM 1337 CA LEU A 88 -5.371 11.393 -5.363 1.00 33.45 C ATOM 1338 C LEU A 88 -5.178 10.438 -4.180 1.00 34.05 C ATOM 1339 O LEU A 88 -4.788 9.280 -4.359 1.00 24.14 O ATOM 1340 CB LEU A 88 -4.221 12.447 -5.476 1.00 53.04 C ATOM 1341 CG LEU A 88 -2.832 11.968 -6.042 1.00 64.32 C ATOM 1342 CD1 LEU A 88 -1.986 13.170 -6.519 1.00 34.32 C ATOM 1343 CD2 LEU A 88 -2.027 11.138 -5.018 1.00 13.10 C ATOM 0 H LEU A 88 -6.540 13.094 -5.012 1.00 73.42 H new ATOM 0 HA LEU A 88 -5.360 10.797 -6.276 1.00 33.45 H new ATOM 0 HB2 LEU A 88 -4.576 13.262 -6.107 1.00 53.04 H new ATOM 0 HB3 LEU A 88 -4.051 12.864 -4.483 1.00 53.04 H new ATOM 0 HG LEU A 88 -3.054 11.321 -6.890 1.00 64.32 H new ATOM 0 HD11 LEU A 88 -1.032 12.813 -6.905 1.00 34.32 H new ATOM 0 HD12 LEU A 88 -2.520 13.701 -7.307 1.00 34.32 H new ATOM 0 HD13 LEU A 88 -1.809 13.845 -5.682 1.00 34.32 H new ATOM 0 HD21 LEU A 88 -1.079 10.834 -5.461 1.00 13.10 H new ATOM 0 HD22 LEU A 88 -1.836 11.741 -4.130 1.00 13.10 H new ATOM 0 HD23 LEU A 88 -2.597 10.252 -4.739 1.00 13.10 H new ATOM 1355 N PHE A 89 -5.461 10.950 -2.966 1.00 63.35 N ATOM 1356 CA PHE A 89 -5.415 10.154 -1.735 1.00 74.11 C ATOM 1357 C PHE A 89 -6.531 9.104 -1.713 1.00 23.43 C ATOM 1358 O PHE A 89 -6.345 8.052 -1.136 1.00 13.24 O ATOM 1359 CB PHE A 89 -5.448 11.067 -0.478 1.00 31.42 C ATOM 1360 CG PHE A 89 -4.189 11.930 -0.271 1.00 23.22 C ATOM 1361 CD1 PHE A 89 -3.003 11.694 -0.985 1.00 61.34 C ATOM 1362 CD2 PHE A 89 -4.192 12.979 0.648 1.00 54.33 C ATOM 1363 CE1 PHE A 89 -1.888 12.474 -0.785 1.00 44.34 C ATOM 1364 CE2 PHE A 89 -3.073 13.754 0.843 1.00 24.24 C ATOM 1365 CZ PHE A 89 -1.924 13.503 0.129 1.00 14.24 C ATOM 0 H PHE A 89 -5.726 11.924 -2.817 1.00 63.35 H new ATOM 0 HA PHE A 89 -4.468 9.614 -1.716 1.00 74.11 H new ATOM 0 HB2 PHE A 89 -6.314 11.725 -0.547 1.00 31.42 H new ATOM 0 HB3 PHE A 89 -5.592 10.442 0.404 1.00 31.42 H new ATOM 0 HD1 PHE A 89 -2.966 10.887 -1.702 1.00 61.34 H new ATOM 0 HD2 PHE A 89 -5.087 13.186 1.215 1.00 54.33 H new ATOM 0 HE1 PHE A 89 -0.985 12.279 -1.344 1.00 44.34 H new ATOM 0 HE2 PHE A 89 -3.096 14.562 1.559 1.00 24.24 H new ATOM 0 HZ PHE A 89 -1.048 14.115 0.286 1.00 14.24 H new ATOM 1375 N GLU A 90 -7.677 9.400 -2.356 1.00 11.24 N ATOM 1376 CA GLU A 90 -8.781 8.426 -2.523 1.00 30.04 C ATOM 1377 C GLU A 90 -8.322 7.207 -3.343 1.00 32.51 C ATOM 1378 O GLU A 90 -8.698 6.076 -3.032 1.00 30.34 O ATOM 1379 CB GLU A 90 -9.998 9.091 -3.213 1.00 5.24 C ATOM 1380 CG GLU A 90 -10.754 10.118 -2.354 1.00 51.01 C ATOM 1381 CD GLU A 90 -11.442 9.492 -1.131 1.00 11.44 C ATOM 1382 OE1 GLU A 90 -12.493 8.838 -1.308 1.00 41.51 O ATOM 1383 OE2 GLU A 90 -10.944 9.649 0.003 1.00 30.10 O ATOM 0 H GLU A 90 -7.866 10.312 -2.772 1.00 11.24 H new ATOM 0 HA GLU A 90 -9.077 8.088 -1.530 1.00 30.04 H new ATOM 0 HB2 GLU A 90 -9.656 9.583 -4.123 1.00 5.24 H new ATOM 0 HB3 GLU A 90 -10.696 8.310 -3.516 1.00 5.24 H new ATOM 0 HG2 GLU A 90 -10.056 10.885 -2.018 1.00 51.01 H new ATOM 0 HG3 GLU A 90 -11.503 10.616 -2.969 1.00 51.01 H new ATOM 1390 N LEU A 91 -7.523 7.462 -4.403 1.00 13.14 N ATOM 1391 CA LEU A 91 -6.929 6.394 -5.230 1.00 1.34 C ATOM 1392 C LEU A 91 -5.921 5.566 -4.395 1.00 11.54 C ATOM 1393 O LEU A 91 -5.918 4.332 -4.464 1.00 55.24 O ATOM 1394 CB LEU A 91 -6.248 6.992 -6.496 1.00 22.50 C ATOM 1395 CG LEU A 91 -7.179 7.746 -7.505 1.00 60.15 C ATOM 1396 CD1 LEU A 91 -6.361 8.358 -8.664 1.00 71.44 C ATOM 1397 CD2 LEU A 91 -8.295 6.826 -8.043 1.00 15.01 C ATOM 0 H LEU A 91 -7.275 8.404 -4.705 1.00 13.14 H new ATOM 0 HA LEU A 91 -7.725 5.728 -5.563 1.00 1.34 H new ATOM 0 HB2 LEU A 91 -5.470 7.682 -6.170 1.00 22.50 H new ATOM 0 HB3 LEU A 91 -5.752 6.182 -7.031 1.00 22.50 H new ATOM 0 HG LEU A 91 -7.658 8.561 -6.962 1.00 60.15 H new ATOM 0 HD11 LEU A 91 -7.032 8.875 -9.349 1.00 71.44 H new ATOM 0 HD12 LEU A 91 -5.635 9.066 -8.263 1.00 71.44 H new ATOM 0 HD13 LEU A 91 -5.837 7.565 -9.198 1.00 71.44 H new ATOM 0 HD21 LEU A 91 -8.921 7.383 -8.740 1.00 15.01 H new ATOM 0 HD22 LEU A 91 -7.849 5.975 -8.557 1.00 15.01 H new ATOM 0 HD23 LEU A 91 -8.905 6.470 -7.213 1.00 15.01 H new ATOM 1409 N ILE A 92 -5.093 6.270 -3.583 1.00 24.30 N ATOM 1410 CA ILE A 92 -4.129 5.641 -2.649 1.00 64.44 C ATOM 1411 C ILE A 92 -4.867 4.758 -1.618 1.00 44.14 C ATOM 1412 O ILE A 92 -4.437 3.637 -1.347 1.00 21.43 O ATOM 1413 CB ILE A 92 -3.248 6.732 -1.902 1.00 62.21 C ATOM 1414 CG1 ILE A 92 -2.347 7.512 -2.918 1.00 71.20 C ATOM 1415 CG2 ILE A 92 -2.392 6.115 -0.761 1.00 60.22 C ATOM 1416 CD1 ILE A 92 -1.428 8.565 -2.304 1.00 15.31 C ATOM 0 H ILE A 92 -5.076 7.290 -3.558 1.00 24.30 H new ATOM 0 HA ILE A 92 -3.462 5.013 -3.239 1.00 64.44 H new ATOM 0 HB ILE A 92 -3.937 7.438 -1.438 1.00 62.21 H new ATOM 0 HG12 ILE A 92 -1.735 6.792 -3.461 1.00 71.20 H new ATOM 0 HG13 ILE A 92 -2.992 7.999 -3.650 1.00 71.20 H new ATOM 0 HG21 ILE A 92 -1.807 6.899 -0.280 1.00 60.22 H new ATOM 0 HG22 ILE A 92 -3.048 5.649 -0.026 1.00 60.22 H new ATOM 0 HG23 ILE A 92 -1.720 5.364 -1.176 1.00 60.22 H new ATOM 0 HD11 ILE A 92 -0.848 9.046 -3.092 1.00 15.31 H new ATOM 0 HD12 ILE A 92 -2.027 9.314 -1.786 1.00 15.31 H new ATOM 0 HD13 ILE A 92 -0.751 8.088 -1.595 1.00 15.31 H new ATOM 1428 N LEU A 93 -6.001 5.267 -1.093 1.00 14.12 N ATOM 1429 CA LEU A 93 -6.813 4.579 -0.068 1.00 35.44 C ATOM 1430 C LEU A 93 -7.588 3.396 -0.672 1.00 32.54 C ATOM 1431 O LEU A 93 -7.878 2.428 0.032 1.00 72.33 O ATOM 1432 CB LEU A 93 -7.791 5.571 0.629 1.00 52.31 C ATOM 1433 CG LEU A 93 -7.133 6.670 1.524 1.00 1.04 C ATOM 1434 CD1 LEU A 93 -8.183 7.693 2.007 1.00 51.24 C ATOM 1435 CD2 LEU A 93 -6.363 6.047 2.713 1.00 52.24 C ATOM 0 H LEU A 93 -6.381 6.172 -1.370 1.00 14.12 H new ATOM 0 HA LEU A 93 -6.128 4.187 0.684 1.00 35.44 H new ATOM 0 HB2 LEU A 93 -8.385 6.065 -0.140 1.00 52.31 H new ATOM 0 HB3 LEU A 93 -8.482 4.996 1.245 1.00 52.31 H new ATOM 0 HG LEU A 93 -6.406 7.204 0.912 1.00 1.04 H new ATOM 0 HD11 LEU A 93 -7.698 8.446 2.628 1.00 51.24 H new ATOM 0 HD12 LEU A 93 -8.645 8.175 1.145 1.00 51.24 H new ATOM 0 HD13 LEU A 93 -8.949 7.181 2.590 1.00 51.24 H new ATOM 0 HD21 LEU A 93 -5.918 6.840 3.314 1.00 52.24 H new ATOM 0 HD22 LEU A 93 -7.051 5.468 3.329 1.00 52.24 H new ATOM 0 HD23 LEU A 93 -5.576 5.394 2.335 1.00 52.24 H new ATOM 1447 N ALA A 94 -7.907 3.484 -1.978 1.00 21.03 N ATOM 1448 CA ALA A 94 -8.565 2.395 -2.714 1.00 60.24 C ATOM 1449 C ALA A 94 -7.595 1.221 -2.886 1.00 63.22 C ATOM 1450 O ALA A 94 -7.955 0.076 -2.647 1.00 21.35 O ATOM 1451 CB ALA A 94 -9.071 2.889 -4.073 1.00 32.23 C ATOM 0 H ALA A 94 -7.716 4.309 -2.547 1.00 21.03 H new ATOM 0 HA ALA A 94 -9.427 2.053 -2.141 1.00 60.24 H new ATOM 0 HB1 ALA A 94 -9.555 2.068 -4.602 1.00 32.23 H new ATOM 0 HB2 ALA A 94 -9.788 3.696 -3.923 1.00 32.23 H new ATOM 0 HB3 ALA A 94 -8.231 3.255 -4.663 1.00 32.23 H new ATOM 1457 N ALA A 95 -6.351 1.539 -3.280 1.00 3.03 N ATOM 1458 CA ALA A 95 -5.269 0.550 -3.443 1.00 75.44 C ATOM 1459 C ALA A 95 -4.786 0.010 -2.081 1.00 2.25 C ATOM 1460 O ALA A 95 -4.262 -1.096 -2.005 1.00 22.44 O ATOM 1461 CB ALA A 95 -4.107 1.171 -4.217 1.00 41.41 C ATOM 0 H ALA A 95 -6.065 2.494 -3.496 1.00 3.03 H new ATOM 0 HA ALA A 95 -5.664 -0.294 -4.008 1.00 75.44 H new ATOM 0 HB1 ALA A 95 -3.312 0.434 -4.333 1.00 41.41 H new ATOM 0 HB2 ALA A 95 -4.453 1.489 -5.200 1.00 41.41 H new ATOM 0 HB3 ALA A 95 -3.725 2.033 -3.670 1.00 41.41 H new ATOM 1467 N ASN A 96 -4.931 0.840 -1.038 1.00 54.42 N ATOM 1468 CA ASN A 96 -4.614 0.487 0.369 1.00 44.44 C ATOM 1469 C ASN A 96 -5.644 -0.544 0.890 1.00 0.33 C ATOM 1470 O ASN A 96 -5.291 -1.517 1.566 1.00 35.45 O ATOM 1471 CB ASN A 96 -4.646 1.801 1.218 1.00 23.50 C ATOM 1472 CG ASN A 96 -4.093 1.718 2.649 1.00 51.11 C ATOM 1473 OD1 ASN A 96 -4.103 0.681 3.300 1.00 71.23 O ATOM 1474 ND2 ASN A 96 -3.617 2.850 3.156 1.00 71.44 N ATOM 0 H ASN A 96 -5.277 1.794 -1.142 1.00 54.42 H new ATOM 0 HA ASN A 96 -3.625 0.035 0.444 1.00 44.44 H new ATOM 0 HB2 ASN A 96 -4.084 2.565 0.681 1.00 23.50 H new ATOM 0 HB3 ASN A 96 -5.679 2.144 1.273 1.00 23.50 H new ATOM 0 HD21 ASN A 96 -3.249 2.868 4.107 1.00 71.44 H new ATOM 0 HD22 ASN A 96 -3.619 3.701 2.594 1.00 71.44 H new ATOM 1481 N TYR A 97 -6.921 -0.303 0.534 1.00 2.21 N ATOM 1482 CA TYR A 97 -8.067 -1.167 0.893 1.00 63.21 C ATOM 1483 C TYR A 97 -8.093 -2.462 0.056 1.00 12.43 C ATOM 1484 O TYR A 97 -8.500 -3.512 0.554 1.00 31.03 O ATOM 1485 CB TYR A 97 -9.396 -0.361 0.705 1.00 63.12 C ATOM 1486 CG TYR A 97 -10.707 -1.173 0.796 1.00 74.25 C ATOM 1487 CD1 TYR A 97 -11.579 -1.267 -0.299 1.00 55.53 C ATOM 1488 CD2 TYR A 97 -11.070 -1.847 1.969 1.00 34.11 C ATOM 1489 CE1 TYR A 97 -12.749 -1.997 -0.228 1.00 40.51 C ATOM 1490 CE2 TYR A 97 -12.245 -2.579 2.042 1.00 65.55 C ATOM 1491 CZ TYR A 97 -13.081 -2.651 0.941 1.00 34.30 C ATOM 1492 OH TYR A 97 -14.253 -3.374 1.013 1.00 42.41 O ATOM 0 H TYR A 97 -7.191 0.510 -0.020 1.00 2.21 H new ATOM 0 HA TYR A 97 -7.962 -1.465 1.936 1.00 63.21 H new ATOM 0 HB2 TYR A 97 -9.428 0.426 1.458 1.00 63.12 H new ATOM 0 HB3 TYR A 97 -9.364 0.130 -0.268 1.00 63.12 H new ATOM 0 HD1 TYR A 97 -11.330 -0.757 -1.218 1.00 55.53 H new ATOM 0 HD2 TYR A 97 -10.423 -1.795 2.832 1.00 34.11 H new ATOM 0 HE1 TYR A 97 -13.403 -2.056 -1.086 1.00 40.51 H new ATOM 0 HE2 TYR A 97 -12.508 -3.092 2.956 1.00 65.55 H new ATOM 0 HH TYR A 97 -14.337 -3.773 1.904 1.00 42.41 H new ATOM 1502 N LEU A 98 -7.679 -2.371 -1.218 1.00 41.11 N ATOM 1503 CA LEU A 98 -7.769 -3.499 -2.179 1.00 62.25 C ATOM 1504 C LEU A 98 -6.415 -4.226 -2.370 1.00 70.45 C ATOM 1505 O LEU A 98 -6.366 -5.256 -3.066 1.00 15.11 O ATOM 1506 CB LEU A 98 -8.318 -2.983 -3.539 1.00 62.14 C ATOM 1507 CG LEU A 98 -9.773 -2.419 -3.523 1.00 11.34 C ATOM 1508 CD1 LEU A 98 -10.191 -1.882 -4.908 1.00 74.15 C ATOM 1509 CD2 LEU A 98 -10.763 -3.475 -3.006 1.00 2.25 C ATOM 0 H LEU A 98 -7.274 -1.523 -1.616 1.00 41.11 H new ATOM 0 HA LEU A 98 -8.457 -4.235 -1.764 1.00 62.25 H new ATOM 0 HB2 LEU A 98 -7.651 -2.202 -3.904 1.00 62.14 H new ATOM 0 HB3 LEU A 98 -8.275 -3.800 -4.259 1.00 62.14 H new ATOM 0 HG LEU A 98 -9.794 -1.575 -2.834 1.00 11.34 H new ATOM 0 HD11 LEU A 98 -11.210 -1.498 -4.857 1.00 74.15 H new ATOM 0 HD12 LEU A 98 -9.515 -1.080 -5.206 1.00 74.15 H new ATOM 0 HD13 LEU A 98 -10.143 -2.688 -5.640 1.00 74.15 H new ATOM 0 HD21 LEU A 98 -11.770 -3.059 -3.004 1.00 2.25 H new ATOM 0 HD22 LEU A 98 -10.733 -4.350 -3.655 1.00 2.25 H new ATOM 0 HD23 LEU A 98 -10.488 -3.766 -1.992 1.00 2.25 H new ATOM 1521 N ASP A 99 -5.345 -3.691 -1.736 1.00 21.42 N ATOM 1522 CA ASP A 99 -3.955 -4.227 -1.812 1.00 14.35 C ATOM 1523 C ASP A 99 -3.451 -4.348 -3.267 1.00 41.52 C ATOM 1524 O ASP A 99 -2.625 -5.217 -3.592 1.00 34.12 O ATOM 1525 CB ASP A 99 -3.822 -5.583 -1.057 1.00 23.40 C ATOM 1526 CG ASP A 99 -3.939 -5.470 0.468 1.00 2.21 C ATOM 1527 OD1 ASP A 99 -3.271 -4.600 1.060 1.00 52.24 O ATOM 1528 OD2 ASP A 99 -4.669 -6.278 1.096 1.00 2.43 O ATOM 0 H ASP A 99 -5.419 -2.862 -1.147 1.00 21.42 H new ATOM 0 HA ASP A 99 -3.314 -3.501 -1.311 1.00 14.35 H new ATOM 0 HB2 ASP A 99 -4.592 -6.264 -1.419 1.00 23.40 H new ATOM 0 HB3 ASP A 99 -2.859 -6.030 -1.304 1.00 23.40 H new ATOM 1533 N ILE A 100 -3.936 -3.442 -4.133 1.00 25.43 N ATOM 1534 CA ILE A 100 -3.519 -3.383 -5.541 1.00 73.23 C ATOM 1535 C ILE A 100 -2.168 -2.666 -5.634 1.00 64.40 C ATOM 1536 O ILE A 100 -2.101 -1.430 -5.638 1.00 72.13 O ATOM 1537 CB ILE A 100 -4.600 -2.688 -6.453 1.00 10.01 C ATOM 1538 CG1 ILE A 100 -5.950 -3.452 -6.344 1.00 54.52 C ATOM 1539 CG2 ILE A 100 -4.122 -2.593 -7.927 1.00 54.13 C ATOM 1540 CD1 ILE A 100 -7.093 -2.894 -7.176 1.00 62.20 C ATOM 0 H ILE A 100 -4.624 -2.734 -3.877 1.00 25.43 H new ATOM 0 HA ILE A 100 -3.416 -4.402 -5.915 1.00 73.23 H new ATOM 0 HB ILE A 100 -4.747 -1.667 -6.101 1.00 10.01 H new ATOM 0 HG12 ILE A 100 -5.784 -4.489 -6.637 1.00 54.52 H new ATOM 0 HG13 ILE A 100 -6.257 -3.462 -5.298 1.00 54.52 H new ATOM 0 HG21 ILE A 100 -4.891 -2.109 -8.528 1.00 54.13 H new ATOM 0 HG22 ILE A 100 -3.203 -2.009 -7.975 1.00 54.13 H new ATOM 0 HG23 ILE A 100 -3.936 -3.595 -8.314 1.00 54.13 H new ATOM 0 HD11 ILE A 100 -7.984 -3.503 -7.024 1.00 62.20 H new ATOM 0 HD12 ILE A 100 -7.298 -1.868 -6.871 1.00 62.20 H new ATOM 0 HD13 ILE A 100 -6.817 -2.911 -8.230 1.00 62.20 H new ATOM 1552 N LYS A 101 -1.098 -3.475 -5.643 1.00 51.03 N ATOM 1553 CA LYS A 101 0.288 -3.012 -5.741 1.00 43.52 C ATOM 1554 C LYS A 101 0.546 -2.152 -7.016 1.00 23.20 C ATOM 1555 O LYS A 101 1.246 -1.160 -6.886 1.00 4.31 O ATOM 1556 CB LYS A 101 1.272 -4.209 -5.665 1.00 1.13 C ATOM 1557 CG LYS A 101 1.258 -4.973 -4.319 1.00 14.24 C ATOM 1558 CD LYS A 101 2.225 -6.177 -4.296 1.00 4.23 C ATOM 1559 CE LYS A 101 3.679 -5.793 -4.639 1.00 61.24 C ATOM 1560 NZ LYS A 101 4.216 -4.733 -3.745 1.00 33.14 N ATOM 0 H LYS A 101 -1.177 -4.490 -5.581 1.00 51.03 H new ATOM 0 HA LYS A 101 0.467 -2.359 -4.887 1.00 43.52 H new ATOM 0 HB2 LYS A 101 1.035 -4.908 -6.467 1.00 1.13 H new ATOM 0 HB3 LYS A 101 2.282 -3.844 -5.849 1.00 1.13 H new ATOM 0 HG2 LYS A 101 1.523 -4.286 -3.515 1.00 14.24 H new ATOM 0 HG3 LYS A 101 0.246 -5.324 -4.118 1.00 14.24 H new ATOM 0 HD2 LYS A 101 2.200 -6.636 -3.308 1.00 4.23 H new ATOM 0 HD3 LYS A 101 1.877 -6.928 -5.005 1.00 4.23 H new ATOM 0 HE2 LYS A 101 4.311 -6.678 -4.568 1.00 61.24 H new ATOM 0 HE3 LYS A 101 3.726 -5.450 -5.673 1.00 61.24 H new ATOM 0 HZ1 LYS A 101 5.195 -4.965 -3.480 1.00 33.14 H new ATOM 0 HZ2 LYS A 101 4.199 -3.819 -4.241 1.00 33.14 H new ATOM 0 HZ3 LYS A 101 3.631 -4.673 -2.887 1.00 33.14 H new ATOM 1574 N PRO A 102 0.035 -2.518 -8.268 1.00 5.42 N ATOM 1575 CA PRO A 102 0.150 -1.636 -9.473 1.00 72.23 C ATOM 1576 C PRO A 102 -0.296 -0.173 -9.225 1.00 33.45 C ATOM 1577 O PRO A 102 0.453 0.765 -9.499 1.00 53.33 O ATOM 1578 CB PRO A 102 -0.776 -2.332 -10.503 1.00 14.11 C ATOM 1579 CG PRO A 102 -0.705 -3.785 -10.145 1.00 0.02 C ATOM 1580 CD PRO A 102 -0.601 -3.828 -8.636 1.00 2.23 C ATOM 0 HA PRO A 102 1.186 -1.535 -9.796 1.00 72.23 H new ATOM 0 HB2 PRO A 102 -1.797 -1.956 -10.437 1.00 14.11 H new ATOM 0 HB3 PRO A 102 -0.437 -2.157 -11.524 1.00 14.11 H new ATOM 0 HG2 PRO A 102 -1.590 -4.318 -10.492 1.00 0.02 H new ATOM 0 HG3 PRO A 102 0.157 -4.262 -10.611 1.00 0.02 H new ATOM 0 HD2 PRO A 102 -1.582 -3.938 -8.173 1.00 2.23 H new ATOM 0 HD3 PRO A 102 0.004 -4.671 -8.303 1.00 2.23 H new ATOM 1588 N LEU A 103 -1.505 -0.010 -8.667 1.00 73.10 N ATOM 1589 CA LEU A 103 -2.131 1.313 -8.469 1.00 31.43 C ATOM 1590 C LEU A 103 -1.453 2.047 -7.297 1.00 12.24 C ATOM 1591 O LEU A 103 -1.199 3.248 -7.378 1.00 53.44 O ATOM 1592 CB LEU A 103 -3.675 1.137 -8.245 1.00 40.24 C ATOM 1593 CG LEU A 103 -4.602 2.402 -8.418 1.00 51.33 C ATOM 1594 CD1 LEU A 103 -4.579 3.367 -7.218 1.00 63.14 C ATOM 1595 CD2 LEU A 103 -4.263 3.144 -9.716 1.00 25.04 C ATOM 0 H LEU A 103 -2.078 -0.788 -8.340 1.00 73.10 H new ATOM 0 HA LEU A 103 -1.993 1.927 -9.359 1.00 31.43 H new ATOM 0 HB2 LEU A 103 -4.026 0.370 -8.935 1.00 40.24 H new ATOM 0 HB3 LEU A 103 -3.823 0.751 -7.237 1.00 40.24 H new ATOM 0 HG LEU A 103 -5.621 2.020 -8.470 1.00 51.33 H new ATOM 0 HD11 LEU A 103 -5.242 4.210 -7.416 1.00 63.14 H new ATOM 0 HD12 LEU A 103 -4.915 2.843 -6.323 1.00 63.14 H new ATOM 0 HD13 LEU A 103 -3.564 3.732 -7.064 1.00 63.14 H new ATOM 0 HD21 LEU A 103 -4.912 4.013 -9.818 1.00 25.04 H new ATOM 0 HD22 LEU A 103 -3.223 3.469 -9.688 1.00 25.04 H new ATOM 0 HD23 LEU A 103 -4.412 2.478 -10.566 1.00 25.04 H new ATOM 1607 N LEU A 104 -1.157 1.294 -6.219 1.00 61.31 N ATOM 1608 CA LEU A 104 -0.526 1.825 -4.994 1.00 20.30 C ATOM 1609 C LEU A 104 0.862 2.399 -5.312 1.00 10.04 C ATOM 1610 O LEU A 104 1.193 3.521 -4.899 1.00 72.04 O ATOM 1611 CB LEU A 104 -0.393 0.698 -3.934 1.00 44.21 C ATOM 1612 CG LEU A 104 0.181 1.120 -2.546 1.00 22.44 C ATOM 1613 CD1 LEU A 104 -0.800 2.045 -1.794 1.00 73.13 C ATOM 1614 CD2 LEU A 104 0.562 -0.119 -1.711 1.00 44.34 C ATOM 0 H LEU A 104 -1.350 0.294 -6.173 1.00 61.31 H new ATOM 0 HA LEU A 104 -1.156 2.622 -4.598 1.00 20.30 H new ATOM 0 HB2 LEU A 104 -1.378 0.257 -3.778 1.00 44.21 H new ATOM 0 HB3 LEU A 104 0.245 -0.085 -4.345 1.00 44.21 H new ATOM 0 HG LEU A 104 1.093 1.693 -2.714 1.00 22.44 H new ATOM 0 HD11 LEU A 104 -0.373 2.322 -0.830 1.00 73.13 H new ATOM 0 HD12 LEU A 104 -0.978 2.944 -2.384 1.00 73.13 H new ATOM 0 HD13 LEU A 104 -1.744 1.523 -1.636 1.00 73.13 H new ATOM 0 HD21 LEU A 104 0.960 0.200 -0.748 1.00 44.34 H new ATOM 0 HD22 LEU A 104 -0.322 -0.737 -1.552 1.00 44.34 H new ATOM 0 HD23 LEU A 104 1.318 -0.697 -2.242 1.00 44.34 H new ATOM 1626 N ASP A 105 1.649 1.605 -6.066 1.00 21.20 N ATOM 1627 CA ASP A 105 3.027 1.943 -6.457 1.00 1.42 C ATOM 1628 C ASP A 105 3.059 3.254 -7.238 1.00 41.13 C ATOM 1629 O ASP A 105 3.742 4.184 -6.834 1.00 64.14 O ATOM 1630 CB ASP A 105 3.645 0.791 -7.297 1.00 63.32 C ATOM 1631 CG ASP A 105 5.081 1.068 -7.770 1.00 33.50 C ATOM 1632 OD1 ASP A 105 6.030 0.826 -6.988 1.00 24.02 O ATOM 1633 OD2 ASP A 105 5.279 1.522 -8.919 1.00 30.13 O ATOM 0 H ASP A 105 1.339 0.701 -6.423 1.00 21.20 H new ATOM 0 HA ASP A 105 3.622 2.072 -5.553 1.00 1.42 H new ATOM 0 HB2 ASP A 105 3.638 -0.123 -6.703 1.00 63.32 H new ATOM 0 HB3 ASP A 105 3.014 0.610 -8.167 1.00 63.32 H new ATOM 1638 N VAL A 106 2.232 3.329 -8.287 1.00 33.31 N ATOM 1639 CA VAL A 106 2.217 4.453 -9.234 1.00 20.20 C ATOM 1640 C VAL A 106 1.682 5.755 -8.595 1.00 24.13 C ATOM 1641 O VAL A 106 2.355 6.780 -8.657 1.00 64.25 O ATOM 1642 CB VAL A 106 1.388 4.051 -10.511 1.00 51.13 C ATOM 1643 CG1 VAL A 106 1.152 5.243 -11.468 1.00 55.52 C ATOM 1644 CG2 VAL A 106 2.087 2.882 -11.254 1.00 21.14 C ATOM 0 H VAL A 106 1.547 2.605 -8.506 1.00 33.31 H new ATOM 0 HA VAL A 106 3.245 4.665 -9.528 1.00 20.20 H new ATOM 0 HB VAL A 106 0.405 3.726 -10.169 1.00 51.13 H new ATOM 0 HG11 VAL A 106 0.576 4.908 -12.331 1.00 55.52 H new ATOM 0 HG12 VAL A 106 0.602 6.026 -10.946 1.00 55.52 H new ATOM 0 HG13 VAL A 106 2.112 5.636 -11.803 1.00 55.52 H new ATOM 0 HG21 VAL A 106 1.506 2.612 -12.135 1.00 21.14 H new ATOM 0 HG22 VAL A 106 3.087 3.191 -11.559 1.00 21.14 H new ATOM 0 HG23 VAL A 106 2.160 2.021 -10.590 1.00 21.14 H new ATOM 1654 N THR A 107 0.504 5.686 -7.945 1.00 31.41 N ATOM 1655 CA THR A 107 -0.207 6.890 -7.440 1.00 75.23 C ATOM 1656 C THR A 107 0.549 7.559 -6.259 1.00 4.22 C ATOM 1657 O THR A 107 0.645 8.798 -6.197 1.00 22.11 O ATOM 1658 CB THR A 107 -1.680 6.530 -7.033 1.00 0.51 C ATOM 1659 OG1 THR A 107 -2.329 5.876 -8.140 1.00 55.54 O ATOM 1660 CG2 THR A 107 -2.507 7.764 -6.634 1.00 2.43 C ATOM 0 H THR A 107 0.019 4.809 -7.754 1.00 31.41 H new ATOM 0 HA THR A 107 -0.239 7.617 -8.252 1.00 75.23 H new ATOM 0 HB THR A 107 -1.623 5.876 -6.163 1.00 0.51 H new ATOM 0 HG1 THR A 107 -2.095 4.924 -8.140 1.00 55.54 H new ATOM 0 HG21 THR A 107 -3.516 7.454 -6.363 1.00 2.43 H new ATOM 0 HG22 THR A 107 -2.038 8.257 -5.782 1.00 2.43 H new ATOM 0 HG23 THR A 107 -2.554 8.457 -7.474 1.00 2.43 H new ATOM 1668 N CYS A 108 1.106 6.734 -5.344 1.00 55.22 N ATOM 1669 CA CYS A 108 1.913 7.233 -4.206 1.00 33.42 C ATOM 1670 C CYS A 108 3.275 7.779 -4.692 1.00 55.55 C ATOM 1671 O CYS A 108 3.851 8.688 -4.084 1.00 63.34 O ATOM 1672 CB CYS A 108 2.131 6.117 -3.167 1.00 73.32 C ATOM 1673 SG CYS A 108 0.606 5.424 -2.486 1.00 71.22 S ATOM 0 H CYS A 108 1.012 5.719 -5.371 1.00 55.22 H new ATOM 0 HA CYS A 108 1.363 8.048 -3.736 1.00 33.42 H new ATOM 0 HB2 CYS A 108 2.706 5.314 -3.629 1.00 73.32 H new ATOM 0 HB3 CYS A 108 2.734 6.511 -2.349 1.00 73.32 H new ATOM 0 HG CYS A 108 0.166 4.487 -3.273 1.00 71.22 H new ATOM 1679 N LYS A 109 3.788 7.192 -5.787 1.00 10.23 N ATOM 1680 CA LYS A 109 5.055 7.607 -6.417 1.00 25.03 C ATOM 1681 C LYS A 109 4.866 8.921 -7.191 1.00 31.24 C ATOM 1682 O LYS A 109 5.783 9.721 -7.264 1.00 11.10 O ATOM 1683 CB LYS A 109 5.548 6.475 -7.339 1.00 43.13 C ATOM 1684 CG LYS A 109 6.976 6.609 -7.907 1.00 71.01 C ATOM 1685 CD LYS A 109 7.441 5.300 -8.603 1.00 73.53 C ATOM 1686 CE LYS A 109 7.488 4.105 -7.627 1.00 34.43 C ATOM 1687 NZ LYS A 109 7.788 2.831 -8.320 1.00 2.44 N ATOM 0 H LYS A 109 3.334 6.412 -6.263 1.00 10.23 H new ATOM 0 HA LYS A 109 5.808 7.790 -5.650 1.00 25.03 H new ATOM 0 HB2 LYS A 109 5.490 5.537 -6.786 1.00 43.13 H new ATOM 0 HB3 LYS A 109 4.856 6.394 -8.177 1.00 43.13 H new ATOM 0 HG2 LYS A 109 7.008 7.432 -8.621 1.00 71.01 H new ATOM 0 HG3 LYS A 109 7.667 6.858 -7.101 1.00 71.01 H new ATOM 0 HD2 LYS A 109 6.765 5.068 -9.426 1.00 73.53 H new ATOM 0 HD3 LYS A 109 8.430 5.452 -9.036 1.00 73.53 H new ATOM 0 HE2 LYS A 109 8.245 4.290 -6.865 1.00 34.43 H new ATOM 0 HE3 LYS A 109 6.531 4.020 -7.112 1.00 34.43 H new ATOM 0 HZ1 LYS A 109 8.125 2.131 -7.629 1.00 2.44 H new ATOM 0 HZ2 LYS A 109 6.926 2.476 -8.781 1.00 2.44 H new ATOM 0 HZ3 LYS A 109 8.524 2.991 -9.037 1.00 2.44 H new ATOM 1701 N THR A 110 3.651 9.127 -7.746 1.00 31.23 N ATOM 1702 CA THR A 110 3.303 10.339 -8.503 1.00 12.24 C ATOM 1703 C THR A 110 3.218 11.557 -7.568 1.00 33.35 C ATOM 1704 O THR A 110 3.783 12.607 -7.880 1.00 13.41 O ATOM 1705 CB THR A 110 1.956 10.157 -9.286 1.00 53.13 C ATOM 1706 OG1 THR A 110 2.095 9.085 -10.237 1.00 4.20 O ATOM 1707 CG2 THR A 110 1.522 11.438 -10.029 1.00 55.51 C ATOM 0 H THR A 110 2.887 8.454 -7.679 1.00 31.23 H new ATOM 0 HA THR A 110 4.095 10.512 -9.232 1.00 12.24 H new ATOM 0 HB THR A 110 1.185 9.926 -8.551 1.00 53.13 H new ATOM 0 HG1 THR A 110 2.194 8.235 -9.760 1.00 4.20 H new ATOM 0 HG21 THR A 110 0.584 11.254 -10.553 1.00 55.51 H new ATOM 0 HG22 THR A 110 1.384 12.246 -9.311 1.00 55.51 H new ATOM 0 HG23 THR A 110 2.291 11.719 -10.749 1.00 55.51 H new ATOM 1715 N VAL A 111 2.531 11.399 -6.412 1.00 4.00 N ATOM 1716 CA VAL A 111 2.413 12.484 -5.412 1.00 74.43 C ATOM 1717 C VAL A 111 3.806 12.840 -4.847 1.00 12.01 C ATOM 1718 O VAL A 111 4.082 14.002 -4.517 1.00 73.10 O ATOM 1719 CB VAL A 111 1.387 12.137 -4.260 1.00 1.33 C ATOM 1720 CG1 VAL A 111 1.926 11.111 -3.243 1.00 14.41 C ATOM 1721 CG2 VAL A 111 0.851 13.405 -3.559 1.00 50.33 C ATOM 0 H VAL A 111 2.053 10.536 -6.151 1.00 4.00 H new ATOM 0 HA VAL A 111 2.010 13.360 -5.920 1.00 74.43 H new ATOM 0 HB VAL A 111 0.546 11.653 -4.757 1.00 1.33 H new ATOM 0 HG11 VAL A 111 1.169 10.921 -2.482 1.00 14.41 H new ATOM 0 HG12 VAL A 111 2.165 10.180 -3.757 1.00 14.41 H new ATOM 0 HG13 VAL A 111 2.825 11.506 -2.770 1.00 14.41 H new ATOM 0 HG21 VAL A 111 0.150 13.119 -2.775 1.00 50.33 H new ATOM 0 HG22 VAL A 111 1.682 13.956 -3.119 1.00 50.33 H new ATOM 0 HG23 VAL A 111 0.342 14.036 -4.288 1.00 50.33 H new ATOM 1731 N ALA A 112 4.684 11.813 -4.774 1.00 23.04 N ATOM 1732 CA ALA A 112 6.097 11.989 -4.437 1.00 63.24 C ATOM 1733 C ALA A 112 6.819 12.805 -5.532 1.00 14.35 C ATOM 1734 O ALA A 112 7.510 13.757 -5.221 1.00 11.52 O ATOM 1735 CB ALA A 112 6.765 10.627 -4.231 1.00 51.13 C ATOM 0 H ALA A 112 4.423 10.843 -4.949 1.00 23.04 H new ATOM 0 HA ALA A 112 6.169 12.548 -3.504 1.00 63.24 H new ATOM 0 HB1 ALA A 112 7.816 10.771 -3.981 1.00 51.13 H new ATOM 0 HB2 ALA A 112 6.268 10.097 -3.418 1.00 51.13 H new ATOM 0 HB3 ALA A 112 6.687 10.041 -5.147 1.00 51.13 H new ATOM 1741 N ASN A 113 6.601 12.454 -6.818 1.00 24.22 N ATOM 1742 CA ASN A 113 7.242 13.147 -7.976 1.00 74.44 C ATOM 1743 C ASN A 113 6.862 14.641 -8.023 1.00 31.11 C ATOM 1744 O ASN A 113 7.674 15.482 -8.432 1.00 52.32 O ATOM 1745 CB ASN A 113 6.858 12.474 -9.334 1.00 64.00 C ATOM 1746 CG ASN A 113 7.351 11.032 -9.482 1.00 50.43 C ATOM 1747 OD1 ASN A 113 8.377 10.651 -8.922 1.00 14.32 O ATOM 1748 ND2 ASN A 113 6.615 10.220 -10.239 1.00 54.34 N ATOM 0 H ASN A 113 5.982 11.690 -7.090 1.00 24.22 H new ATOM 0 HA ASN A 113 8.319 13.060 -7.831 1.00 74.44 H new ATOM 0 HB2 ASN A 113 5.773 12.488 -9.439 1.00 64.00 H new ATOM 0 HB3 ASN A 113 7.265 13.071 -10.150 1.00 64.00 H new ATOM 0 HD21 ASN A 113 6.897 9.248 -10.369 1.00 54.34 H new ATOM 0 HD22 ASN A 113 5.769 10.570 -10.689 1.00 54.34 H new ATOM 1755 N MET A 114 5.616 14.952 -7.603 1.00 24.32 N ATOM 1756 CA MET A 114 5.085 16.325 -7.613 1.00 21.33 C ATOM 1757 C MET A 114 5.813 17.210 -6.588 1.00 30.13 C ATOM 1758 O MET A 114 6.156 18.358 -6.894 1.00 11.33 O ATOM 1759 CB MET A 114 3.559 16.344 -7.340 1.00 35.02 C ATOM 1760 CG MET A 114 2.699 15.581 -8.361 1.00 31.23 C ATOM 1761 SD MET A 114 0.939 15.985 -8.235 1.00 65.20 S ATOM 1762 CE MET A 114 0.623 15.833 -6.473 1.00 21.13 C ATOM 0 H MET A 114 4.956 14.259 -7.250 1.00 24.32 H new ATOM 0 HA MET A 114 5.261 16.730 -8.610 1.00 21.33 H new ATOM 0 HB2 MET A 114 3.378 15.923 -6.351 1.00 35.02 H new ATOM 0 HB3 MET A 114 3.225 17.381 -7.311 1.00 35.02 H new ATOM 0 HG2 MET A 114 3.049 15.810 -9.368 1.00 31.23 H new ATOM 0 HG3 MET A 114 2.833 14.509 -8.213 1.00 31.23 H new ATOM 0 HE1 MET A 114 -0.362 15.392 -6.317 1.00 21.13 H new ATOM 0 HE2 MET A 114 1.382 15.195 -6.021 1.00 21.13 H new ATOM 0 HE3 MET A 114 0.656 16.820 -6.011 1.00 21.13 H new ATOM 1772 N ILE A 115 6.046 16.674 -5.371 1.00 1.22 N ATOM 1773 CA ILE A 115 6.758 17.420 -4.308 1.00 41.23 C ATOM 1774 C ILE A 115 8.279 17.465 -4.593 1.00 34.52 C ATOM 1775 O ILE A 115 8.956 18.422 -4.210 1.00 35.51 O ATOM 1776 CB ILE A 115 6.486 16.832 -2.863 1.00 12.00 C ATOM 1777 CG1 ILE A 115 7.092 15.406 -2.705 1.00 53.11 C ATOM 1778 CG2 ILE A 115 4.970 16.826 -2.547 1.00 45.33 C ATOM 1779 CD1 ILE A 115 6.994 14.802 -1.320 1.00 73.00 C ATOM 0 H ILE A 115 5.755 15.735 -5.100 1.00 1.22 H new ATOM 0 HA ILE A 115 6.362 18.435 -4.321 1.00 41.23 H new ATOM 0 HB ILE A 115 6.982 17.482 -2.143 1.00 12.00 H new ATOM 0 HG12 ILE A 115 6.594 14.739 -3.409 1.00 53.11 H new ATOM 0 HG13 ILE A 115 8.143 15.444 -2.992 1.00 53.11 H new ATOM 0 HG21 ILE A 115 4.808 16.418 -1.549 1.00 45.33 H new ATOM 0 HG22 ILE A 115 4.586 17.845 -2.589 1.00 45.33 H new ATOM 0 HG23 ILE A 115 4.448 16.211 -3.280 1.00 45.33 H new ATOM 0 HD11 ILE A 115 7.446 13.810 -1.323 1.00 73.00 H new ATOM 0 HD12 ILE A 115 7.519 15.438 -0.608 1.00 73.00 H new ATOM 0 HD13 ILE A 115 5.946 14.722 -1.031 1.00 73.00 H new ATOM 1791 N ARG A 116 8.798 16.424 -5.279 1.00 3.32 N ATOM 1792 CA ARG A 116 10.220 16.332 -5.657 1.00 21.13 C ATOM 1793 C ARG A 116 10.495 17.237 -6.865 1.00 2.22 C ATOM 1794 O ARG A 116 10.351 16.817 -8.019 1.00 54.20 O ATOM 1795 CB ARG A 116 10.620 14.857 -5.964 1.00 41.11 C ATOM 1796 CG ARG A 116 10.505 13.889 -4.764 1.00 33.21 C ATOM 1797 CD ARG A 116 11.517 14.174 -3.649 1.00 44.24 C ATOM 1798 NE ARG A 116 12.899 13.879 -4.064 1.00 60.12 N ATOM 1799 CZ ARG A 116 13.531 12.706 -3.858 1.00 51.11 C ATOM 1800 NH1 ARG A 116 12.915 11.692 -3.242 1.00 0.33 N ATOM 1801 NH2 ARG A 116 14.779 12.559 -4.266 1.00 3.32 N ATOM 0 H ARG A 116 8.241 15.626 -5.585 1.00 3.32 H new ATOM 0 HA ARG A 116 10.829 16.671 -4.819 1.00 21.13 H new ATOM 0 HB2 ARG A 116 9.991 14.486 -6.773 1.00 41.11 H new ATOM 0 HB3 ARG A 116 11.648 14.842 -6.327 1.00 41.11 H new ATOM 0 HG2 ARG A 116 9.497 13.950 -4.353 1.00 33.21 H new ATOM 0 HG3 ARG A 116 10.644 12.867 -5.117 1.00 33.21 H new ATOM 0 HD2 ARG A 116 11.444 15.220 -3.353 1.00 44.24 H new ATOM 0 HD3 ARG A 116 11.267 13.576 -2.772 1.00 44.24 H new ATOM 0 HE ARG A 116 13.416 14.617 -4.543 1.00 60.12 H new ATOM 0 HH11 ARG A 116 11.953 11.799 -2.920 1.00 0.33 H new ATOM 0 HH12 ARG A 116 13.407 10.811 -3.094 1.00 0.33 H new ATOM 0 HH21 ARG A 116 15.257 13.330 -4.733 1.00 3.32 H new ATOM 0 HH22 ARG A 116 15.264 11.675 -4.114 1.00 3.32 H new ATOM 1815 N GLY A 117 10.825 18.501 -6.578 1.00 3.03 N ATOM 1816 CA GLY A 117 11.225 19.474 -7.593 1.00 13.22 C ATOM 1817 C GLY A 117 12.461 20.247 -7.137 1.00 44.44 C ATOM 1818 O GLY A 117 13.590 19.778 -7.387 1.00 20.42 O ATOM 1819 OXT GLY A 117 12.312 21.310 -6.493 1.00 37.27 O ATOM 0 H GLY A 117 10.821 18.877 -5.630 1.00 3.03 H new ATOM 0 HA2 GLY A 117 11.435 18.963 -8.532 1.00 13.22 H new ATOM 0 HA3 GLY A 117 10.406 20.167 -7.784 1.00 13.22 H new TER 1823 GLY A 117 ATOM 1824 N SER B 2 18.657 -15.664 15.131 1.00 22.13 N ATOM 1825 CA SER B 2 19.275 -14.388 15.552 1.00 44.43 C ATOM 1826 C SER B 2 18.521 -13.194 14.923 1.00 3.31 C ATOM 1827 O SER B 2 17.614 -13.383 14.098 1.00 24.11 O ATOM 1828 CB SER B 2 20.780 -14.389 15.174 1.00 31.41 C ATOM 1829 OG SER B 2 21.453 -13.257 15.693 1.00 20.21 O ATOM 0 HA SER B 2 19.201 -14.283 16.634 1.00 44.43 H new ATOM 0 HB2 SER B 2 21.249 -15.297 15.553 1.00 31.41 H new ATOM 0 HB3 SER B 2 20.882 -14.407 14.089 1.00 31.41 H new ATOM 0 HG SER B 2 22.398 -13.292 15.437 1.00 20.21 H new ATOM 1837 N LEU B 3 18.881 -11.965 15.355 1.00 44.45 N ATOM 1838 CA LEU B 3 18.308 -10.714 14.826 1.00 64.40 C ATOM 1839 C LEU B 3 18.705 -10.537 13.344 1.00 12.32 C ATOM 1840 O LEU B 3 19.904 -10.480 13.032 1.00 70.33 O ATOM 1841 CB LEU B 3 18.836 -9.515 15.660 1.00 11.43 C ATOM 1842 CG LEU B 3 18.446 -9.479 17.171 1.00 14.44 C ATOM 1843 CD1 LEU B 3 19.245 -8.399 17.926 1.00 50.41 C ATOM 1844 CD2 LEU B 3 16.935 -9.264 17.353 1.00 25.43 C ATOM 0 H LEU B 3 19.580 -11.816 16.083 1.00 44.45 H new ATOM 0 HA LEU B 3 17.221 -10.756 14.896 1.00 64.40 H new ATOM 0 HB2 LEU B 3 19.924 -9.506 15.590 1.00 11.43 H new ATOM 0 HB3 LEU B 3 18.479 -8.596 15.196 1.00 11.43 H new ATOM 0 HG LEU B 3 18.701 -10.449 17.598 1.00 14.44 H new ATOM 0 HD11 LEU B 3 18.952 -8.397 18.976 1.00 50.41 H new ATOM 0 HD12 LEU B 3 20.311 -8.613 17.847 1.00 50.41 H new ATOM 0 HD13 LEU B 3 19.038 -7.422 17.490 1.00 50.41 H new ATOM 0 HD21 LEU B 3 16.696 -9.244 18.416 1.00 25.43 H new ATOM 0 HD22 LEU B 3 16.645 -8.317 16.898 1.00 25.43 H new ATOM 0 HD23 LEU B 3 16.391 -10.078 16.874 1.00 25.43 H new ATOM 1856 N VAL B 4 17.708 -10.474 12.439 1.00 54.04 N ATOM 1857 CA VAL B 4 17.967 -10.265 11.007 1.00 12.33 C ATOM 1858 C VAL B 4 18.466 -8.822 10.773 1.00 53.12 C ATOM 1859 O VAL B 4 17.805 -7.839 11.143 1.00 33.02 O ATOM 1860 CB VAL B 4 16.721 -10.605 10.105 1.00 71.03 C ATOM 1861 CG1 VAL B 4 16.419 -12.119 10.148 1.00 45.23 C ATOM 1862 CG2 VAL B 4 15.477 -9.787 10.507 1.00 62.31 C ATOM 0 H VAL B 4 16.720 -10.565 12.677 1.00 54.04 H new ATOM 0 HA VAL B 4 18.747 -10.963 10.704 1.00 12.33 H new ATOM 0 HB VAL B 4 16.972 -10.327 9.081 1.00 71.03 H new ATOM 0 HG11 VAL B 4 15.555 -12.336 9.519 1.00 45.23 H new ATOM 0 HG12 VAL B 4 17.283 -12.673 9.781 1.00 45.23 H new ATOM 0 HG13 VAL B 4 16.205 -12.418 11.174 1.00 45.23 H new ATOM 0 HG21 VAL B 4 14.642 -10.053 9.859 1.00 62.31 H new ATOM 0 HG22 VAL B 4 15.217 -10.005 11.543 1.00 62.31 H new ATOM 0 HG23 VAL B 4 15.692 -8.723 10.403 1.00 62.31 H new ATOM 1872 N LYS B 5 19.672 -8.731 10.209 1.00 50.12 N ATOM 1873 CA LYS B 5 20.412 -7.481 10.061 1.00 72.13 C ATOM 1874 C LYS B 5 19.894 -6.689 8.836 1.00 60.35 C ATOM 1875 O LYS B 5 20.441 -6.813 7.734 1.00 64.45 O ATOM 1876 CB LYS B 5 21.929 -7.803 9.923 1.00 23.43 C ATOM 1877 CG LYS B 5 22.538 -8.671 11.055 1.00 21.21 C ATOM 1878 CD LYS B 5 24.041 -8.964 10.823 1.00 53.40 C ATOM 1879 CE LYS B 5 24.639 -9.942 11.858 1.00 63.31 C ATOM 1880 NZ LYS B 5 24.620 -9.396 13.244 1.00 43.23 N ATOM 0 H LYS B 5 20.169 -9.540 9.836 1.00 50.12 H new ATOM 0 HA LYS B 5 20.262 -6.857 10.942 1.00 72.13 H new ATOM 0 HB2 LYS B 5 22.088 -8.313 8.973 1.00 23.43 H new ATOM 0 HB3 LYS B 5 22.478 -6.863 9.876 1.00 23.43 H new ATOM 0 HG2 LYS B 5 22.412 -8.160 12.010 1.00 21.21 H new ATOM 0 HG3 LYS B 5 21.992 -9.612 11.123 1.00 21.21 H new ATOM 0 HD2 LYS B 5 24.173 -9.378 9.823 1.00 53.40 H new ATOM 0 HD3 LYS B 5 24.596 -8.027 10.856 1.00 53.40 H new ATOM 0 HE2 LYS B 5 24.080 -10.877 11.833 1.00 63.31 H new ATOM 0 HE3 LYS B 5 25.666 -10.177 11.579 1.00 63.31 H new ATOM 0 HZ1 LYS B 5 24.905 -10.139 13.914 1.00 43.23 H new ATOM 0 HZ2 LYS B 5 25.282 -8.597 13.311 1.00 43.23 H new ATOM 0 HZ3 LYS B 5 23.660 -9.071 13.476 1.00 43.23 H new ATOM 1894 N LEU B 6 18.809 -5.917 9.024 1.00 31.34 N ATOM 1895 CA LEU B 6 18.214 -5.111 7.943 1.00 51.23 C ATOM 1896 C LEU B 6 19.070 -3.857 7.683 1.00 54.00 C ATOM 1897 O LEU B 6 18.851 -2.795 8.278 1.00 22.33 O ATOM 1898 CB LEU B 6 16.734 -4.749 8.252 1.00 51.23 C ATOM 1899 CG LEU B 6 15.749 -5.957 8.406 1.00 74.05 C ATOM 1900 CD1 LEU B 6 14.295 -5.480 8.517 1.00 44.41 C ATOM 1901 CD2 LEU B 6 15.897 -6.970 7.258 1.00 50.55 C ATOM 0 H LEU B 6 18.325 -5.834 9.918 1.00 31.34 H new ATOM 0 HA LEU B 6 18.205 -5.708 7.031 1.00 51.23 H new ATOM 0 HB2 LEU B 6 16.708 -4.165 9.172 1.00 51.23 H new ATOM 0 HB3 LEU B 6 16.365 -4.104 7.455 1.00 51.23 H new ATOM 0 HG LEU B 6 16.016 -6.465 9.333 1.00 74.05 H new ATOM 0 HD11 LEU B 6 13.636 -6.342 8.623 1.00 44.41 H new ATOM 0 HD12 LEU B 6 14.190 -4.834 9.388 1.00 44.41 H new ATOM 0 HD13 LEU B 6 14.025 -4.925 7.619 1.00 44.41 H new ATOM 0 HD21 LEU B 6 15.195 -7.791 7.405 1.00 50.55 H new ATOM 0 HD22 LEU B 6 15.686 -6.478 6.309 1.00 50.55 H new ATOM 0 HD23 LEU B 6 16.915 -7.360 7.246 1.00 50.55 H new ATOM 1913 N GLU B 7 20.078 -4.030 6.820 1.00 0.23 N ATOM 1914 CA GLU B 7 21.030 -2.982 6.448 1.00 43.42 C ATOM 1915 C GLU B 7 20.372 -2.022 5.436 1.00 73.44 C ATOM 1916 O GLU B 7 20.050 -2.422 4.321 1.00 22.32 O ATOM 1917 CB GLU B 7 22.305 -3.641 5.857 1.00 5.10 C ATOM 1918 CG GLU B 7 23.439 -2.658 5.494 1.00 12.34 C ATOM 1919 CD GLU B 7 24.685 -3.363 4.938 1.00 2.13 C ATOM 1920 OE1 GLU B 7 25.385 -4.052 5.716 1.00 2.24 O ATOM 1921 OE2 GLU B 7 24.975 -3.247 3.727 1.00 1.32 O ATOM 0 H GLU B 7 20.256 -4.919 6.353 1.00 0.23 H new ATOM 0 HA GLU B 7 21.316 -2.402 7.325 1.00 43.42 H new ATOM 0 HB2 GLU B 7 22.688 -4.365 6.576 1.00 5.10 H new ATOM 0 HB3 GLU B 7 22.027 -4.198 4.962 1.00 5.10 H new ATOM 0 HG2 GLU B 7 23.072 -1.944 4.757 1.00 12.34 H new ATOM 0 HG3 GLU B 7 23.716 -2.087 6.380 1.00 12.34 H new ATOM 1928 N SER B 8 20.163 -0.767 5.849 1.00 31.23 N ATOM 1929 CA SER B 8 19.478 0.254 5.032 1.00 33.40 C ATOM 1930 C SER B 8 20.351 0.756 3.862 1.00 5.22 C ATOM 1931 O SER B 8 21.524 0.371 3.721 1.00 75.24 O ATOM 1932 CB SER B 8 19.075 1.433 5.947 1.00 1.22 C ATOM 1933 OG SER B 8 20.210 2.004 6.591 1.00 24.30 O ATOM 0 H SER B 8 20.463 -0.425 6.762 1.00 31.23 H new ATOM 0 HA SER B 8 18.594 -0.202 4.586 1.00 33.40 H new ATOM 0 HB2 SER B 8 18.568 2.196 5.357 1.00 1.22 H new ATOM 0 HB3 SER B 8 18.365 1.086 6.698 1.00 1.22 H new ATOM 0 HG SER B 8 20.490 1.428 7.333 1.00 24.30 H new ATOM 1939 N SER B 9 19.741 1.621 3.029 1.00 24.54 N ATOM 1940 CA SER B 9 20.425 2.343 1.937 1.00 65.22 C ATOM 1941 C SER B 9 21.552 3.248 2.491 1.00 64.33 C ATOM 1942 O SER B 9 22.573 3.472 1.835 1.00 22.43 O ATOM 1943 CB SER B 9 19.379 3.187 1.166 1.00 22.12 C ATOM 1944 OG SER B 9 19.928 3.816 0.022 1.00 44.14 O ATOM 0 H SER B 9 18.747 1.841 3.096 1.00 24.54 H new ATOM 0 HA SER B 9 20.887 1.622 1.262 1.00 65.22 H new ATOM 0 HB2 SER B 9 18.552 2.546 0.862 1.00 22.12 H new ATOM 0 HB3 SER B 9 18.967 3.946 1.831 1.00 22.12 H new ATOM 0 HG SER B 9 19.544 3.417 -0.787 1.00 44.14 H new ATOM 1950 N ASP B 10 21.349 3.728 3.732 1.00 11.53 N ATOM 1951 CA ASP B 10 22.298 4.608 4.454 1.00 2.01 C ATOM 1952 C ASP B 10 23.331 3.767 5.263 1.00 33.31 C ATOM 1953 O ASP B 10 24.047 4.290 6.125 1.00 12.14 O ATOM 1954 CB ASP B 10 21.465 5.552 5.367 1.00 3.51 C ATOM 1955 CG ASP B 10 22.294 6.602 6.138 1.00 25.54 C ATOM 1956 OD1 ASP B 10 22.759 7.571 5.518 1.00 50.43 O ATOM 1957 OD2 ASP B 10 22.485 6.457 7.365 1.00 2.11 O ATOM 0 H ASP B 10 20.511 3.515 4.272 1.00 11.53 H new ATOM 0 HA ASP B 10 22.880 5.205 3.752 1.00 2.01 H new ATOM 0 HB2 ASP B 10 20.728 6.070 4.754 1.00 3.51 H new ATOM 0 HB3 ASP B 10 20.913 4.946 6.085 1.00 3.51 H new ATOM 1962 N GLU B 11 23.389 2.445 4.960 1.00 73.24 N ATOM 1963 CA GLU B 11 24.397 1.482 5.478 1.00 74.54 C ATOM 1964 C GLU B 11 24.197 1.115 6.964 1.00 73.23 C ATOM 1965 O GLU B 11 24.944 0.278 7.488 1.00 2.21 O ATOM 1966 CB GLU B 11 25.857 1.990 5.253 1.00 63.24 C ATOM 1967 CG GLU B 11 26.237 2.297 3.786 1.00 0.54 C ATOM 1968 CD GLU B 11 27.639 2.934 3.666 1.00 3.24 C ATOM 1969 OE1 GLU B 11 27.771 4.140 3.933 1.00 52.41 O ATOM 1970 OE2 GLU B 11 28.616 2.229 3.337 1.00 21.50 O ATOM 0 H GLU B 11 22.717 2.006 4.331 1.00 73.24 H new ATOM 0 HA GLU B 11 24.240 0.573 4.897 1.00 74.54 H new ATOM 0 HB2 GLU B 11 26.004 2.894 5.845 1.00 63.24 H new ATOM 0 HB3 GLU B 11 26.547 1.240 5.639 1.00 63.24 H new ATOM 0 HG2 GLU B 11 26.208 1.375 3.205 1.00 0.54 H new ATOM 0 HG3 GLU B 11 25.496 2.970 3.354 1.00 0.54 H new ATOM 1977 N LYS B 12 23.198 1.715 7.638 1.00 65.41 N ATOM 1978 CA LYS B 12 22.939 1.447 9.066 1.00 10.40 C ATOM 1979 C LYS B 12 22.188 0.117 9.218 1.00 32.03 C ATOM 1980 O LYS B 12 21.108 -0.068 8.649 1.00 44.21 O ATOM 1981 CB LYS B 12 22.175 2.622 9.733 1.00 34.21 C ATOM 1982 CG LYS B 12 23.041 3.890 9.929 1.00 34.23 C ATOM 1983 CD LYS B 12 22.300 5.008 10.695 1.00 25.23 C ATOM 1984 CE LYS B 12 23.214 6.193 11.057 1.00 23.32 C ATOM 1985 NZ LYS B 12 23.849 6.804 9.856 1.00 44.35 N ATOM 0 H LYS B 12 22.557 2.388 7.217 1.00 65.41 H new ATOM 0 HA LYS B 12 23.893 1.362 9.586 1.00 10.40 H new ATOM 0 HB2 LYS B 12 21.308 2.875 9.122 1.00 34.21 H new ATOM 0 HB3 LYS B 12 21.798 2.296 10.702 1.00 34.21 H new ATOM 0 HG2 LYS B 12 23.949 3.624 10.471 1.00 34.23 H new ATOM 0 HG3 LYS B 12 23.351 4.267 8.954 1.00 34.23 H new ATOM 0 HD2 LYS B 12 21.469 5.368 10.088 1.00 25.23 H new ATOM 0 HD3 LYS B 12 21.872 4.594 11.608 1.00 25.23 H new ATOM 0 HE2 LYS B 12 22.632 6.950 11.583 1.00 23.32 H new ATOM 0 HE3 LYS B 12 23.990 5.854 11.743 1.00 23.32 H new ATOM 0 HZ1 LYS B 12 23.936 7.831 9.994 1.00 44.35 H new ATOM 0 HZ2 LYS B 12 24.794 6.392 9.715 1.00 44.35 H new ATOM 0 HZ3 LYS B 12 23.261 6.616 9.019 1.00 44.35 H new ATOM 1999 N VAL B 13 22.787 -0.790 9.991 1.00 62.21 N ATOM 2000 CA VAL B 13 22.341 -2.174 10.143 1.00 64.03 C ATOM 2001 C VAL B 13 21.344 -2.292 11.314 1.00 20.02 C ATOM 2002 O VAL B 13 21.730 -2.233 12.489 1.00 2.44 O ATOM 2003 CB VAL B 13 23.590 -3.106 10.362 1.00 44.21 C ATOM 2004 CG1 VAL B 13 23.182 -4.577 10.561 1.00 40.21 C ATOM 2005 CG2 VAL B 13 24.604 -2.958 9.197 1.00 15.34 C ATOM 0 H VAL B 13 23.618 -0.576 10.543 1.00 62.21 H new ATOM 0 HA VAL B 13 21.825 -2.491 9.237 1.00 64.03 H new ATOM 0 HB VAL B 13 24.079 -2.782 11.281 1.00 44.21 H new ATOM 0 HG11 VAL B 13 24.074 -5.185 10.709 1.00 40.21 H new ATOM 0 HG12 VAL B 13 22.537 -4.661 11.436 1.00 40.21 H new ATOM 0 HG13 VAL B 13 22.645 -4.928 9.680 1.00 40.21 H new ATOM 0 HG21 VAL B 13 25.458 -3.612 9.372 1.00 15.34 H new ATOM 0 HG22 VAL B 13 24.123 -3.233 8.259 1.00 15.34 H new ATOM 0 HG23 VAL B 13 24.945 -1.924 9.140 1.00 15.34 H new ATOM 2015 N PHE B 14 20.051 -2.412 10.975 1.00 34.40 N ATOM 2016 CA PHE B 14 18.957 -2.520 11.953 1.00 70.32 C ATOM 2017 C PHE B 14 18.646 -3.994 12.239 1.00 41.33 C ATOM 2018 O PHE B 14 17.886 -4.636 11.507 1.00 63.30 O ATOM 2019 CB PHE B 14 17.700 -1.764 11.443 1.00 23.31 C ATOM 2020 CG PHE B 14 17.957 -0.282 11.229 1.00 75.31 C ATOM 2021 CD1 PHE B 14 18.062 0.575 12.322 1.00 20.32 C ATOM 2022 CD2 PHE B 14 18.123 0.250 9.955 1.00 65.33 C ATOM 2023 CE1 PHE B 14 18.327 1.909 12.149 1.00 40.45 C ATOM 2024 CE2 PHE B 14 18.382 1.590 9.784 1.00 23.31 C ATOM 2025 CZ PHE B 14 18.487 2.420 10.881 1.00 41.34 C ATOM 0 H PHE B 14 19.733 -2.437 10.006 1.00 34.40 H new ATOM 0 HA PHE B 14 19.269 -2.055 12.888 1.00 70.32 H new ATOM 0 HB2 PHE B 14 17.367 -2.210 10.506 1.00 23.31 H new ATOM 0 HB3 PHE B 14 16.889 -1.889 12.161 1.00 23.31 H new ATOM 0 HD1 PHE B 14 17.933 0.183 13.320 1.00 20.32 H new ATOM 0 HD2 PHE B 14 18.048 -0.395 9.092 1.00 65.33 H new ATOM 0 HE1 PHE B 14 18.410 2.559 13.008 1.00 40.45 H new ATOM 0 HE2 PHE B 14 18.503 1.993 8.789 1.00 23.31 H new ATOM 0 HZ PHE B 14 18.695 3.471 10.745 1.00 41.34 H new ATOM 2035 N GLU B 15 19.292 -4.524 13.285 1.00 0.12 N ATOM 2036 CA GLU B 15 19.073 -5.892 13.764 1.00 24.44 C ATOM 2037 C GLU B 15 17.717 -5.994 14.492 1.00 44.05 C ATOM 2038 O GLU B 15 17.636 -5.847 15.716 1.00 11.51 O ATOM 2039 CB GLU B 15 20.237 -6.319 14.694 1.00 22.50 C ATOM 2040 CG GLU B 15 21.612 -6.406 14.009 1.00 50.23 C ATOM 2041 CD GLU B 15 22.733 -6.822 14.977 1.00 12.41 C ATOM 2042 OE1 GLU B 15 23.348 -5.944 15.613 1.00 21.23 O ATOM 2043 OE2 GLU B 15 22.982 -8.029 15.127 1.00 23.33 O ATOM 0 H GLU B 15 19.987 -4.010 13.826 1.00 0.12 H new ATOM 0 HA GLU B 15 19.049 -6.570 12.910 1.00 24.44 H new ATOM 0 HB2 GLU B 15 20.302 -5.610 15.520 1.00 22.50 H new ATOM 0 HB3 GLU B 15 20.000 -7.291 15.126 1.00 22.50 H new ATOM 0 HG2 GLU B 15 21.560 -7.123 13.190 1.00 50.23 H new ATOM 0 HG3 GLU B 15 21.857 -5.439 13.571 1.00 50.23 H new ATOM 2050 N ILE B 16 16.654 -6.193 13.716 1.00 0.14 N ATOM 2051 CA ILE B 16 15.288 -6.377 14.248 1.00 41.40 C ATOM 2052 C ILE B 16 15.027 -7.888 14.417 1.00 21.35 C ATOM 2053 O ILE B 16 15.691 -8.715 13.763 1.00 12.13 O ATOM 2054 CB ILE B 16 14.220 -5.721 13.279 1.00 12.41 C ATOM 2055 CG1 ILE B 16 12.775 -5.698 13.889 1.00 14.24 C ATOM 2056 CG2 ILE B 16 14.216 -6.429 11.912 1.00 30.31 C ATOM 2057 CD1 ILE B 16 12.637 -4.895 15.172 1.00 3.52 C ATOM 0 H ILE B 16 16.706 -6.233 12.698 1.00 0.14 H new ATOM 0 HA ILE B 16 15.197 -5.882 15.215 1.00 41.40 H new ATOM 0 HB ILE B 16 14.522 -4.682 13.143 1.00 12.41 H new ATOM 0 HG12 ILE B 16 12.089 -5.291 13.146 1.00 14.24 H new ATOM 0 HG13 ILE B 16 12.462 -6.724 14.084 1.00 14.24 H new ATOM 0 HG21 ILE B 16 13.475 -5.962 11.263 1.00 30.31 H new ATOM 0 HG22 ILE B 16 15.202 -6.345 11.456 1.00 30.31 H new ATOM 0 HG23 ILE B 16 13.967 -7.481 12.048 1.00 30.31 H new ATOM 0 HD11 ILE B 16 11.604 -4.937 15.518 1.00 3.52 H new ATOM 0 HD12 ILE B 16 13.293 -5.313 15.935 1.00 3.52 H new ATOM 0 HD13 ILE B 16 12.914 -3.858 14.984 1.00 3.52 H new ATOM 2069 N GLU B 17 14.090 -8.250 15.318 1.00 11.21 N ATOM 2070 CA GLU B 17 13.662 -9.644 15.494 1.00 70.31 C ATOM 2071 C GLU B 17 13.035 -10.163 14.189 1.00 22.01 C ATOM 2072 O GLU B 17 12.246 -9.453 13.542 1.00 41.23 O ATOM 2073 CB GLU B 17 12.659 -9.784 16.671 1.00 74.54 C ATOM 2074 CG GLU B 17 13.207 -9.299 18.031 1.00 61.22 C ATOM 2075 CD GLU B 17 12.224 -9.499 19.203 1.00 22.34 C ATOM 2076 OE1 GLU B 17 12.245 -10.575 19.826 1.00 42.02 O ATOM 2077 OE2 GLU B 17 11.432 -8.582 19.509 1.00 2.33 O ATOM 0 H GLU B 17 13.617 -7.590 15.935 1.00 11.21 H new ATOM 0 HA GLU B 17 14.539 -10.244 15.736 1.00 70.31 H new ATOM 0 HB2 GLU B 17 11.757 -9.220 16.434 1.00 74.54 H new ATOM 0 HB3 GLU B 17 12.367 -10.830 16.762 1.00 74.54 H new ATOM 0 HG2 GLU B 17 14.133 -9.831 18.250 1.00 61.22 H new ATOM 0 HG3 GLU B 17 13.458 -8.241 17.955 1.00 61.22 H new ATOM 2084 N LYS B 18 13.419 -11.391 13.818 1.00 62.35 N ATOM 2085 CA LYS B 18 13.004 -12.053 12.572 1.00 25.12 C ATOM 2086 C LYS B 18 11.471 -12.112 12.458 1.00 53.31 C ATOM 2087 O LYS B 18 10.912 -11.845 11.393 1.00 44.31 O ATOM 2088 CB LYS B 18 13.605 -13.477 12.539 1.00 72.31 C ATOM 2089 CG LYS B 18 13.296 -14.300 11.263 1.00 62.33 C ATOM 2090 CD LYS B 18 13.900 -15.727 11.316 1.00 75.33 C ATOM 2091 CE LYS B 18 15.424 -15.713 11.511 1.00 71.13 C ATOM 2092 NZ LYS B 18 16.003 -17.077 11.596 1.00 73.15 N ATOM 0 H LYS B 18 14.040 -11.966 14.387 1.00 62.35 H new ATOM 0 HA LYS B 18 13.372 -11.477 11.723 1.00 25.12 H new ATOM 0 HB2 LYS B 18 14.687 -13.399 12.647 1.00 72.31 H new ATOM 0 HB3 LYS B 18 13.237 -14.028 13.404 1.00 72.31 H new ATOM 0 HG2 LYS B 18 12.216 -14.371 11.133 1.00 62.33 H new ATOM 0 HG3 LYS B 18 13.688 -13.775 10.392 1.00 62.33 H new ATOM 0 HD2 LYS B 18 13.438 -16.284 12.131 1.00 75.33 H new ATOM 0 HD3 LYS B 18 13.660 -16.254 10.393 1.00 75.33 H new ATOM 0 HE2 LYS B 18 15.887 -15.177 10.683 1.00 71.13 H new ATOM 0 HE3 LYS B 18 15.665 -15.163 12.421 1.00 71.13 H new ATOM 0 HZ1 LYS B 18 17.028 -17.010 11.761 1.00 73.15 H new ATOM 0 HZ2 LYS B 18 15.559 -17.594 12.381 1.00 73.15 H new ATOM 0 HZ3 LYS B 18 15.829 -17.584 10.705 1.00 73.15 H new ATOM 2106 N GLU B 19 10.820 -12.425 13.601 1.00 12.14 N ATOM 2107 CA GLU B 19 9.352 -12.507 13.725 1.00 33.25 C ATOM 2108 C GLU B 19 8.652 -11.167 13.369 1.00 12.14 C ATOM 2109 O GLU B 19 7.552 -11.164 12.811 1.00 74.23 O ATOM 2110 CB GLU B 19 8.984 -12.970 15.162 1.00 30.32 C ATOM 2111 CG GLU B 19 9.510 -12.048 16.295 1.00 13.24 C ATOM 2112 CD GLU B 19 9.254 -12.596 17.713 1.00 44.23 C ATOM 2113 OE1 GLU B 19 10.215 -12.965 18.419 1.00 53.21 O ATOM 2114 OE2 GLU B 19 8.079 -12.686 18.120 1.00 42.10 O ATOM 0 H GLU B 19 11.308 -12.630 14.473 1.00 12.14 H new ATOM 0 HA GLU B 19 8.989 -13.239 13.003 1.00 33.25 H new ATOM 0 HB2 GLU B 19 7.899 -13.037 15.241 1.00 30.32 H new ATOM 0 HB3 GLU B 19 9.377 -13.975 15.317 1.00 30.32 H new ATOM 0 HG2 GLU B 19 10.581 -11.899 16.161 1.00 13.24 H new ATOM 0 HG3 GLU B 19 9.038 -11.070 16.203 1.00 13.24 H new ATOM 2121 N ILE B 20 9.313 -10.041 13.685 1.00 11.40 N ATOM 2122 CA ILE B 20 8.794 -8.684 13.410 1.00 65.42 C ATOM 2123 C ILE B 20 9.047 -8.310 11.935 1.00 61.35 C ATOM 2124 O ILE B 20 8.238 -7.627 11.304 1.00 62.52 O ATOM 2125 CB ILE B 20 9.462 -7.631 14.373 1.00 22.42 C ATOM 2126 CG1 ILE B 20 9.277 -8.068 15.862 1.00 52.43 C ATOM 2127 CG2 ILE B 20 8.903 -6.207 14.130 1.00 61.04 C ATOM 2128 CD1 ILE B 20 9.893 -7.142 16.898 1.00 11.04 C ATOM 0 H ILE B 20 10.226 -10.043 14.140 1.00 11.40 H new ATOM 0 HA ILE B 20 7.719 -8.676 13.592 1.00 65.42 H new ATOM 0 HB ILE B 20 10.529 -7.597 14.155 1.00 22.42 H new ATOM 0 HG12 ILE B 20 8.210 -8.155 16.067 1.00 52.43 H new ATOM 0 HG13 ILE B 20 9.707 -9.062 15.987 1.00 52.43 H new ATOM 0 HG21 ILE B 20 9.385 -5.506 14.811 1.00 61.04 H new ATOM 0 HG22 ILE B 20 9.102 -5.909 13.101 1.00 61.04 H new ATOM 0 HG23 ILE B 20 7.827 -6.203 14.307 1.00 61.04 H new ATOM 0 HD11 ILE B 20 9.707 -7.538 17.896 1.00 11.04 H new ATOM 0 HD12 ILE B 20 10.968 -7.072 16.730 1.00 11.04 H new ATOM 0 HD13 ILE B 20 9.447 -6.151 16.811 1.00 11.04 H new ATOM 2140 N ALA B 21 10.179 -8.790 11.391 1.00 74.41 N ATOM 2141 CA ALA B 21 10.549 -8.584 9.978 1.00 54.34 C ATOM 2142 C ALA B 21 9.656 -9.414 9.031 1.00 0.13 C ATOM 2143 O ALA B 21 9.572 -9.123 7.832 1.00 23.51 O ATOM 2144 CB ALA B 21 12.032 -8.914 9.781 1.00 32.20 C ATOM 0 H ALA B 21 10.864 -9.332 11.918 1.00 74.41 H new ATOM 0 HA ALA B 21 10.386 -7.536 9.725 1.00 54.34 H new ATOM 0 HB1 ALA B 21 12.303 -8.761 8.736 1.00 32.20 H new ATOM 0 HB2 ALA B 21 12.637 -8.263 10.412 1.00 32.20 H new ATOM 0 HB3 ALA B 21 12.213 -9.954 10.054 1.00 32.20 H new ATOM 2150 N CYS B 22 8.989 -10.448 9.593 1.00 13.24 N ATOM 2151 CA CYS B 22 8.007 -11.258 8.863 1.00 73.44 C ATOM 2152 C CYS B 22 6.706 -10.465 8.591 1.00 10.31 C ATOM 2153 O CYS B 22 5.977 -10.781 7.643 1.00 5.21 O ATOM 2154 CB CYS B 22 7.687 -12.536 9.652 1.00 24.13 C ATOM 2155 SG CYS B 22 9.117 -13.587 9.990 1.00 34.13 S ATOM 0 H CYS B 22 9.121 -10.738 10.562 1.00 13.24 H new ATOM 0 HA CYS B 22 8.444 -11.525 7.901 1.00 73.44 H new ATOM 0 HB2 CYS B 22 7.225 -12.257 10.599 1.00 24.13 H new ATOM 0 HB3 CYS B 22 6.950 -13.115 9.097 1.00 24.13 H new ATOM 0 HG CYS B 22 10.116 -12.850 10.377 1.00 34.13 H new ATOM 2161 N MET B 23 6.418 -9.446 9.438 1.00 73.23 N ATOM 2162 CA MET B 23 5.244 -8.554 9.260 1.00 72.13 C ATOM 2163 C MET B 23 5.350 -7.792 7.924 1.00 11.14 C ATOM 2164 O MET B 23 4.343 -7.545 7.243 1.00 52.34 O ATOM 2165 CB MET B 23 5.121 -7.558 10.441 1.00 63.45 C ATOM 2166 CG MET B 23 4.887 -8.209 11.812 1.00 20.30 C ATOM 2167 SD MET B 23 4.812 -6.994 13.151 1.00 61.24 S ATOM 2168 CE MET B 23 3.423 -5.962 12.662 1.00 4.01 C ATOM 0 H MET B 23 6.985 -9.220 10.255 1.00 73.23 H new ATOM 0 HA MET B 23 4.346 -9.172 9.242 1.00 72.13 H new ATOM 0 HB2 MET B 23 6.031 -6.960 10.489 1.00 63.45 H new ATOM 0 HB3 MET B 23 4.299 -6.872 10.235 1.00 63.45 H new ATOM 0 HG2 MET B 23 3.956 -8.776 11.787 1.00 20.30 H new ATOM 0 HG3 MET B 23 5.688 -8.920 12.015 1.00 20.30 H new ATOM 0 HE1 MET B 23 2.992 -5.490 13.545 1.00 4.01 H new ATOM 0 HE2 MET B 23 3.767 -5.192 11.971 1.00 4.01 H new ATOM 0 HE3 MET B 23 2.667 -6.577 12.173 1.00 4.01 H new ATOM 2178 N SER B 24 6.591 -7.425 7.571 1.00 22.44 N ATOM 2179 CA SER B 24 6.921 -6.916 6.242 1.00 11.45 C ATOM 2180 C SER B 24 6.787 -8.065 5.240 1.00 52.11 C ATOM 2181 O SER B 24 7.581 -9.009 5.279 1.00 20.14 O ATOM 2182 CB SER B 24 8.354 -6.335 6.215 1.00 44.31 C ATOM 2183 OG SER B 24 8.680 -5.837 4.928 1.00 53.42 O ATOM 0 H SER B 24 7.390 -7.475 8.203 1.00 22.44 H new ATOM 0 HA SER B 24 6.237 -6.109 5.977 1.00 11.45 H new ATOM 0 HB2 SER B 24 8.439 -5.535 6.950 1.00 44.31 H new ATOM 0 HB3 SER B 24 9.068 -7.107 6.501 1.00 44.31 H new ATOM 0 HG SER B 24 7.863 -5.756 4.392 1.00 53.42 H new ATOM 2189 N VAL B 25 5.747 -7.998 4.392 1.00 12.25 N ATOM 2190 CA VAL B 25 5.445 -9.050 3.412 1.00 2.33 C ATOM 2191 C VAL B 25 6.610 -9.215 2.417 1.00 73.31 C ATOM 2192 O VAL B 25 7.024 -10.335 2.153 1.00 50.51 O ATOM 2193 CB VAL B 25 4.088 -8.761 2.658 1.00 14.24 C ATOM 2194 CG1 VAL B 25 3.772 -9.831 1.583 1.00 3.40 C ATOM 2195 CG2 VAL B 25 2.916 -8.631 3.668 1.00 62.31 C ATOM 0 H VAL B 25 5.095 -7.214 4.368 1.00 12.25 H new ATOM 0 HA VAL B 25 5.324 -9.989 3.953 1.00 2.33 H new ATOM 0 HB VAL B 25 4.208 -7.812 2.136 1.00 14.24 H new ATOM 0 HG11 VAL B 25 2.829 -9.587 1.093 1.00 3.40 H new ATOM 0 HG12 VAL B 25 4.572 -9.850 0.842 1.00 3.40 H new ATOM 0 HG13 VAL B 25 3.693 -10.810 2.056 1.00 3.40 H new ATOM 0 HG21 VAL B 25 1.990 -8.432 3.128 1.00 62.31 H new ATOM 0 HG22 VAL B 25 2.816 -9.559 4.230 1.00 62.31 H new ATOM 0 HG23 VAL B 25 3.118 -7.810 4.356 1.00 62.31 H new ATOM 2205 N THR B 26 7.158 -8.081 1.932 1.00 30.50 N ATOM 2206 CA THR B 26 8.268 -8.066 0.957 1.00 52.31 C ATOM 2207 C THR B 26 9.555 -8.708 1.536 1.00 22.42 C ATOM 2208 O THR B 26 10.139 -9.593 0.902 1.00 2.34 O ATOM 2209 CB THR B 26 8.561 -6.608 0.474 1.00 33.32 C ATOM 2210 OG1 THR B 26 7.352 -6.008 -0.020 1.00 70.31 O ATOM 2211 CG2 THR B 26 9.638 -6.549 -0.629 1.00 31.21 C ATOM 0 H THR B 26 6.843 -7.150 2.206 1.00 30.50 H new ATOM 0 HA THR B 26 7.954 -8.665 0.102 1.00 52.31 H new ATOM 0 HB THR B 26 8.941 -6.060 1.336 1.00 33.32 H new ATOM 0 HG1 THR B 26 7.528 -5.078 -0.273 1.00 70.31 H new ATOM 0 HG21 THR B 26 9.799 -5.512 -0.925 1.00 31.21 H new ATOM 0 HG22 THR B 26 10.570 -6.968 -0.250 1.00 31.21 H new ATOM 0 HG23 THR B 26 9.306 -7.125 -1.493 1.00 31.21 H new ATOM 2219 N ILE B 27 9.971 -8.271 2.753 1.00 70.21 N ATOM 2220 CA ILE B 27 11.173 -8.811 3.435 1.00 45.01 C ATOM 2221 C ILE B 27 10.987 -10.311 3.737 1.00 14.32 C ATOM 2222 O ILE B 27 11.909 -11.104 3.534 1.00 50.33 O ATOM 2223 CB ILE B 27 11.502 -8.015 4.761 1.00 42.12 C ATOM 2224 CG1 ILE B 27 11.855 -6.531 4.428 1.00 0.20 C ATOM 2225 CG2 ILE B 27 12.638 -8.686 5.584 1.00 34.33 C ATOM 2226 CD1 ILE B 27 12.106 -5.643 5.638 1.00 72.50 C ATOM 0 H ILE B 27 9.489 -7.544 3.282 1.00 70.21 H new ATOM 0 HA ILE B 27 12.020 -8.687 2.761 1.00 45.01 H new ATOM 0 HB ILE B 27 10.608 -8.034 5.385 1.00 42.12 H new ATOM 0 HG12 ILE B 27 12.743 -6.517 3.796 1.00 0.20 H new ATOM 0 HG13 ILE B 27 11.041 -6.102 3.844 1.00 0.20 H new ATOM 0 HG21 ILE B 27 12.828 -8.103 6.485 1.00 34.33 H new ATOM 0 HG22 ILE B 27 12.338 -9.696 5.862 1.00 34.33 H new ATOM 0 HG23 ILE B 27 13.546 -8.730 4.982 1.00 34.33 H new ATOM 0 HD11 ILE B 27 12.343 -4.633 5.305 1.00 72.50 H new ATOM 0 HD12 ILE B 27 11.213 -5.619 6.263 1.00 72.50 H new ATOM 0 HD13 ILE B 27 12.941 -6.041 6.214 1.00 72.50 H new ATOM 2238 N LYS B 28 9.765 -10.684 4.176 1.00 54.30 N ATOM 2239 CA LYS B 28 9.406 -12.083 4.454 1.00 71.14 C ATOM 2240 C LYS B 28 9.506 -12.925 3.176 1.00 73.24 C ATOM 2241 O LYS B 28 10.002 -14.040 3.214 1.00 33.03 O ATOM 2242 CB LYS B 28 7.978 -12.185 5.048 1.00 32.30 C ATOM 2243 CG LYS B 28 7.550 -13.617 5.460 1.00 0.43 C ATOM 2244 CD LYS B 28 6.110 -13.684 6.010 1.00 10.52 C ATOM 2245 CE LYS B 28 5.045 -13.265 4.976 1.00 50.53 C ATOM 2246 NZ LYS B 28 5.019 -14.168 3.792 1.00 3.42 N ATOM 0 H LYS B 28 9.006 -10.024 4.345 1.00 54.30 H new ATOM 0 HA LYS B 28 10.111 -12.470 5.190 1.00 71.14 H new ATOM 0 HB2 LYS B 28 7.915 -11.536 5.921 1.00 32.30 H new ATOM 0 HB3 LYS B 28 7.266 -11.804 4.316 1.00 32.30 H new ATOM 0 HG2 LYS B 28 7.634 -14.277 4.597 1.00 0.43 H new ATOM 0 HG3 LYS B 28 8.239 -13.992 6.216 1.00 0.43 H new ATOM 0 HD2 LYS B 28 5.902 -14.701 6.344 1.00 10.52 H new ATOM 0 HD3 LYS B 28 6.032 -13.039 6.885 1.00 10.52 H new ATOM 0 HE2 LYS B 28 4.063 -13.263 5.450 1.00 50.53 H new ATOM 0 HE3 LYS B 28 5.243 -12.245 4.647 1.00 50.53 H new ATOM 0 HZ1 LYS B 28 4.374 -13.781 3.074 1.00 3.42 H new ATOM 0 HZ2 LYS B 28 5.976 -14.244 3.392 1.00 3.42 H new ATOM 0 HZ3 LYS B 28 4.689 -15.111 4.082 1.00 3.42 H new ATOM 2260 N ASN B 29 9.068 -12.355 2.038 1.00 35.33 N ATOM 2261 CA ASN B 29 9.113 -13.043 0.737 1.00 32.55 C ATOM 2262 C ASN B 29 10.557 -13.207 0.246 1.00 42.31 C ATOM 2263 O ASN B 29 10.844 -14.162 -0.468 1.00 5.20 O ATOM 2264 CB ASN B 29 8.253 -12.308 -0.331 1.00 73.24 C ATOM 2265 CG ASN B 29 6.739 -12.357 -0.071 1.00 25.53 C ATOM 2266 OD1 ASN B 29 6.013 -11.428 -0.421 1.00 15.04 O ATOM 2267 ND2 ASN B 29 6.241 -13.436 0.523 1.00 14.30 N ATOM 0 H ASN B 29 8.677 -11.414 1.995 1.00 35.33 H new ATOM 0 HA ASN B 29 8.686 -14.035 0.884 1.00 32.55 H new ATOM 0 HB2 ASN B 29 8.568 -11.265 -0.378 1.00 73.24 H new ATOM 0 HB3 ASN B 29 8.456 -12.747 -1.308 1.00 73.24 H new ATOM 0 HD21 ASN B 29 5.238 -13.505 0.697 1.00 14.30 H new ATOM 0 HD22 ASN B 29 6.861 -14.195 0.805 1.00 14.30 H new ATOM 2274 N MET B 30 11.454 -12.264 0.627 1.00 11.43 N ATOM 2275 CA MET B 30 12.905 -12.354 0.334 1.00 53.51 C ATOM 2276 C MET B 30 13.541 -13.508 1.136 1.00 52.32 C ATOM 2277 O MET B 30 14.403 -14.235 0.626 1.00 20.13 O ATOM 2278 CB MET B 30 13.629 -11.011 0.663 1.00 4.31 C ATOM 2279 CG MET B 30 13.220 -9.816 -0.213 1.00 75.50 C ATOM 2280 SD MET B 30 14.069 -8.292 0.266 1.00 40.41 S ATOM 2281 CE MET B 30 13.445 -7.124 -0.947 1.00 41.21 C ATOM 0 H MET B 30 11.193 -11.424 1.143 1.00 11.43 H new ATOM 0 HA MET B 30 13.022 -12.553 -0.731 1.00 53.51 H new ATOM 0 HB2 MET B 30 13.437 -10.759 1.706 1.00 4.31 H new ATOM 0 HB3 MET B 30 14.704 -11.162 0.564 1.00 4.31 H new ATOM 0 HG2 MET B 30 13.442 -10.040 -1.256 1.00 75.50 H new ATOM 0 HG3 MET B 30 12.143 -9.667 -0.141 1.00 75.50 H new ATOM 0 HE1 MET B 30 14.282 -6.628 -1.439 1.00 41.21 H new ATOM 0 HE2 MET B 30 12.850 -7.654 -1.690 1.00 41.21 H new ATOM 0 HE3 MET B 30 12.824 -6.379 -0.449 1.00 41.21 H new ATOM 2291 N ILE B 31 13.089 -13.652 2.397 1.00 21.03 N ATOM 2292 CA ILE B 31 13.506 -14.736 3.303 1.00 74.21 C ATOM 2293 C ILE B 31 13.068 -16.104 2.726 1.00 24.32 C ATOM 2294 O ILE B 31 13.899 -16.988 2.522 1.00 51.34 O ATOM 2295 CB ILE B 31 12.890 -14.503 4.744 1.00 43.04 C ATOM 2296 CG1 ILE B 31 13.477 -13.199 5.383 1.00 42.45 C ATOM 2297 CG2 ILE B 31 13.088 -15.721 5.678 1.00 52.42 C ATOM 2298 CD1 ILE B 31 12.827 -12.760 6.692 1.00 11.33 C ATOM 0 H ILE B 31 12.417 -13.011 2.818 1.00 21.03 H new ATOM 0 HA ILE B 31 14.592 -14.735 3.392 1.00 74.21 H new ATOM 0 HB ILE B 31 11.814 -14.380 4.621 1.00 43.04 H new ATOM 0 HG12 ILE B 31 14.542 -13.349 5.559 1.00 42.45 H new ATOM 0 HG13 ILE B 31 13.384 -12.388 4.661 1.00 42.45 H new ATOM 0 HG21 ILE B 31 12.647 -15.508 6.652 1.00 52.42 H new ATOM 0 HG22 ILE B 31 12.603 -16.595 5.244 1.00 52.42 H new ATOM 0 HG23 ILE B 31 14.153 -15.919 5.797 1.00 52.42 H new ATOM 0 HD11 ILE B 31 13.307 -11.849 7.049 1.00 11.33 H new ATOM 0 HD12 ILE B 31 11.766 -12.571 6.526 1.00 11.33 H new ATOM 0 HD13 ILE B 31 12.943 -13.547 7.437 1.00 11.33 H new ATOM 2310 N GLU B 32 11.765 -16.212 2.401 1.00 75.33 N ATOM 2311 CA GLU B 32 11.133 -17.441 1.862 1.00 43.20 C ATOM 2312 C GLU B 32 11.694 -17.799 0.473 1.00 63.23 C ATOM 2313 O GLU B 32 11.733 -18.980 0.102 1.00 52.04 O ATOM 2314 CB GLU B 32 9.588 -17.253 1.777 1.00 23.33 C ATOM 2315 CG GLU B 32 8.897 -16.993 3.136 1.00 12.31 C ATOM 2316 CD GLU B 32 7.423 -16.568 2.997 1.00 74.53 C ATOM 2317 OE1 GLU B 32 6.511 -17.325 3.390 1.00 22.34 O ATOM 2318 OE2 GLU B 32 7.173 -15.463 2.472 1.00 51.23 O ATOM 0 H GLU B 32 11.109 -15.438 2.506 1.00 75.33 H new ATOM 0 HA GLU B 32 11.363 -18.262 2.541 1.00 43.20 H new ATOM 0 HB2 GLU B 32 9.373 -16.419 1.109 1.00 23.33 H new ATOM 0 HB3 GLU B 32 9.151 -18.144 1.326 1.00 23.33 H new ATOM 0 HG2 GLU B 32 8.952 -17.897 3.743 1.00 12.31 H new ATOM 0 HG3 GLU B 32 9.443 -16.216 3.671 1.00 12.31 H new ATOM 2325 N ASP B 33 12.131 -16.764 -0.268 1.00 23.52 N ATOM 2326 CA ASP B 33 12.689 -16.909 -1.628 1.00 20.30 C ATOM 2327 C ASP B 33 13.981 -17.735 -1.605 1.00 5.24 C ATOM 2328 O ASP B 33 14.181 -18.626 -2.434 1.00 12.15 O ATOM 2329 CB ASP B 33 12.964 -15.512 -2.232 1.00 32.53 C ATOM 2330 CG ASP B 33 13.425 -15.559 -3.691 1.00 22.50 C ATOM 2331 OD1 ASP B 33 12.561 -15.632 -4.584 1.00 73.41 O ATOM 2332 OD2 ASP B 33 14.642 -15.511 -3.951 1.00 22.22 O ATOM 0 H ASP B 33 12.107 -15.799 0.060 1.00 23.52 H new ATOM 0 HA ASP B 33 11.961 -17.434 -2.246 1.00 20.30 H new ATOM 0 HB2 ASP B 33 12.057 -14.911 -2.165 1.00 32.53 H new ATOM 0 HB3 ASP B 33 13.725 -15.010 -1.635 1.00 32.53 H new ATOM 2337 N ILE B 34 14.831 -17.429 -0.615 1.00 44.33 N ATOM 2338 CA ILE B 34 16.124 -18.106 -0.393 1.00 52.24 C ATOM 2339 C ILE B 34 15.921 -19.298 0.586 1.00 21.31 C ATOM 2340 O ILE B 34 16.878 -19.951 1.014 1.00 71.52 O ATOM 2341 CB ILE B 34 17.180 -17.059 0.167 1.00 63.55 C ATOM 2342 CG1 ILE B 34 17.164 -15.754 -0.702 1.00 24.35 C ATOM 2343 CG2 ILE B 34 18.616 -17.645 0.232 1.00 3.32 C ATOM 2344 CD1 ILE B 34 18.082 -14.635 -0.217 1.00 4.14 C ATOM 0 H ILE B 34 14.640 -16.694 0.066 1.00 44.33 H new ATOM 0 HA ILE B 34 16.510 -18.503 -1.332 1.00 52.24 H new ATOM 0 HB ILE B 34 16.884 -16.818 1.188 1.00 63.55 H new ATOM 0 HG12 ILE B 34 17.444 -16.014 -1.723 1.00 24.35 H new ATOM 0 HG13 ILE B 34 16.143 -15.374 -0.738 1.00 24.35 H new ATOM 0 HG21 ILE B 34 19.300 -16.890 0.621 1.00 3.32 H new ATOM 0 HG22 ILE B 34 18.624 -18.515 0.888 1.00 3.32 H new ATOM 0 HG23 ILE B 34 18.934 -17.941 -0.768 1.00 3.32 H new ATOM 0 HD11 ILE B 34 17.997 -13.779 -0.886 1.00 4.14 H new ATOM 0 HD12 ILE B 34 17.793 -14.338 0.791 1.00 4.14 H new ATOM 0 HD13 ILE B 34 19.113 -14.988 -0.209 1.00 4.14 H new ATOM 2356 N GLY B 35 14.649 -19.620 0.889 1.00 20.50 N ATOM 2357 CA GLY B 35 14.311 -20.627 1.891 1.00 25.20 C ATOM 2358 C GLY B 35 14.202 -19.982 3.261 1.00 61.11 C ATOM 2359 O GLY B 35 13.113 -19.918 3.851 1.00 13.31 O ATOM 0 H GLY B 35 13.838 -19.188 0.445 1.00 20.50 H new ATOM 0 HA2 GLY B 35 13.368 -21.108 1.631 1.00 25.20 H new ATOM 0 HA3 GLY B 35 15.073 -21.406 1.907 1.00 25.20 H new ATOM 2363 N GLU B 36 15.349 -19.487 3.746 1.00 62.25 N ATOM 2364 CA GLU B 36 15.424 -18.595 4.909 1.00 24.24 C ATOM 2365 C GLU B 36 16.733 -17.789 4.836 1.00 62.23 C ATOM 2366 O GLU B 36 17.730 -18.271 4.281 1.00 34.22 O ATOM 2367 CB GLU B 36 15.323 -19.382 6.244 1.00 23.54 C ATOM 2368 CG GLU B 36 15.119 -18.477 7.477 1.00 44.45 C ATOM 2369 CD GLU B 36 14.993 -19.258 8.790 1.00 43.53 C ATOM 2370 OE1 GLU B 36 15.925 -19.223 9.617 1.00 72.41 O ATOM 2371 OE2 GLU B 36 13.961 -19.932 8.997 1.00 32.20 O ATOM 0 H GLU B 36 16.259 -19.697 3.337 1.00 62.25 H new ATOM 0 HA GLU B 36 14.575 -17.912 4.886 1.00 24.24 H new ATOM 0 HB2 GLU B 36 14.494 -20.087 6.179 1.00 23.54 H new ATOM 0 HB3 GLU B 36 16.231 -19.969 6.380 1.00 23.54 H new ATOM 0 HG2 GLU B 36 15.958 -17.785 7.553 1.00 44.45 H new ATOM 0 HG3 GLU B 36 14.221 -17.876 7.333 1.00 44.45 H new ATOM 2378 N SER B 37 16.722 -16.557 5.369 1.00 60.41 N ATOM 2379 CA SER B 37 17.887 -15.660 5.363 1.00 31.45 C ATOM 2380 C SER B 37 17.962 -14.868 6.682 1.00 23.02 C ATOM 2381 O SER B 37 17.361 -13.797 6.819 1.00 13.32 O ATOM 2382 CB SER B 37 17.822 -14.721 4.137 1.00 52.23 C ATOM 2383 OG SER B 37 17.936 -15.443 2.923 1.00 72.31 O ATOM 0 H SER B 37 15.900 -16.154 5.818 1.00 60.41 H new ATOM 0 HA SER B 37 18.798 -16.253 5.285 1.00 31.45 H new ATOM 0 HB2 SER B 37 16.881 -14.172 4.148 1.00 52.23 H new ATOM 0 HB3 SER B 37 18.622 -13.984 4.199 1.00 52.23 H new ATOM 0 HG SER B 37 18.786 -15.221 2.489 1.00 72.31 H new ATOM 2389 N ASP B 38 18.663 -15.458 7.663 1.00 5.22 N ATOM 2390 CA ASP B 38 18.961 -14.825 8.966 1.00 61.12 C ATOM 2391 C ASP B 38 20.049 -13.747 8.782 1.00 50.22 C ATOM 2392 O ASP B 38 20.111 -12.757 9.522 1.00 51.52 O ATOM 2393 CB ASP B 38 19.427 -15.923 9.966 1.00 73.12 C ATOM 2394 CG ASP B 38 19.576 -15.442 11.419 1.00 73.04 C ATOM 2395 OD1 ASP B 38 20.671 -14.997 11.815 1.00 32.42 O ATOM 2396 OD2 ASP B 38 18.599 -15.542 12.182 1.00 12.31 O ATOM 0 H ASP B 38 19.045 -16.400 7.577 1.00 5.22 H new ATOM 0 HA ASP B 38 18.068 -14.342 9.364 1.00 61.12 H new ATOM 0 HB2 ASP B 38 18.713 -16.746 9.941 1.00 73.12 H new ATOM 0 HB3 ASP B 38 20.384 -16.321 9.629 1.00 73.12 H new ATOM 2401 N SER B 39 20.886 -13.974 7.754 1.00 75.44 N ATOM 2402 CA SER B 39 21.995 -13.102 7.342 1.00 34.30 C ATOM 2403 C SER B 39 21.514 -11.683 6.895 1.00 3.20 C ATOM 2404 O SER B 39 20.328 -11.516 6.572 1.00 45.12 O ATOM 2405 CB SER B 39 22.747 -13.828 6.199 1.00 21.34 C ATOM 2406 OG SER B 39 21.869 -14.185 5.139 1.00 23.51 O ATOM 0 H SER B 39 20.803 -14.803 7.166 1.00 75.44 H new ATOM 0 HA SER B 39 22.654 -12.925 8.192 1.00 34.30 H new ATOM 0 HB2 SER B 39 23.538 -13.183 5.816 1.00 21.34 H new ATOM 0 HB3 SER B 39 23.228 -14.724 6.591 1.00 21.34 H new ATOM 0 HG SER B 39 22.375 -14.639 4.434 1.00 23.51 H new ATOM 2412 N PRO B 40 22.436 -10.641 6.884 1.00 35.02 N ATOM 2413 CA PRO B 40 22.088 -9.233 6.540 1.00 75.12 C ATOM 2414 C PRO B 40 21.285 -9.063 5.229 1.00 44.42 C ATOM 2415 O PRO B 40 21.800 -9.301 4.134 1.00 30.14 O ATOM 2416 CB PRO B 40 23.471 -8.503 6.464 1.00 63.15 C ATOM 2417 CG PRO B 40 24.502 -9.600 6.470 1.00 32.02 C ATOM 2418 CD PRO B 40 23.878 -10.728 7.259 1.00 31.02 C ATOM 0 HA PRO B 40 21.415 -8.818 7.290 1.00 75.12 H new ATOM 0 HB2 PRO B 40 23.547 -7.897 5.561 1.00 63.15 H new ATOM 0 HB3 PRO B 40 23.608 -7.831 7.311 1.00 63.15 H new ATOM 0 HG2 PRO B 40 24.745 -9.917 5.456 1.00 32.02 H new ATOM 0 HG3 PRO B 40 25.431 -9.264 6.931 1.00 32.02 H new ATOM 0 HD2 PRO B 40 24.307 -11.694 6.991 1.00 31.02 H new ATOM 0 HD3 PRO B 40 24.025 -10.600 8.331 1.00 31.02 H new ATOM 2426 N ILE B 41 20.008 -8.679 5.373 1.00 4.34 N ATOM 2427 CA ILE B 41 19.133 -8.329 4.247 1.00 31.22 C ATOM 2428 C ILE B 41 19.267 -6.816 3.962 1.00 55.00 C ATOM 2429 O ILE B 41 18.882 -6.001 4.813 1.00 13.12 O ATOM 2430 CB ILE B 41 17.627 -8.699 4.548 1.00 4.14 C ATOM 2431 CG1 ILE B 41 17.471 -10.224 4.835 1.00 0.05 C ATOM 2432 CG2 ILE B 41 16.674 -8.253 3.403 1.00 14.14 C ATOM 2433 CD1 ILE B 41 17.910 -11.132 3.698 1.00 74.33 C ATOM 0 H ILE B 41 19.551 -8.602 6.282 1.00 4.34 H new ATOM 0 HA ILE B 41 19.439 -8.902 3.372 1.00 31.22 H new ATOM 0 HB ILE B 41 17.337 -8.149 5.443 1.00 4.14 H new ATOM 0 HG12 ILE B 41 18.049 -10.473 5.725 1.00 0.05 H new ATOM 0 HG13 ILE B 41 16.426 -10.432 5.065 1.00 0.05 H new ATOM 0 HG21 ILE B 41 15.650 -8.528 3.654 1.00 14.14 H new ATOM 0 HG22 ILE B 41 16.739 -7.172 3.276 1.00 14.14 H new ATOM 0 HG23 ILE B 41 16.965 -8.745 2.475 1.00 14.14 H new ATOM 0 HD11 ILE B 41 17.766 -12.173 3.987 1.00 74.33 H new ATOM 0 HD12 ILE B 41 17.316 -10.916 2.810 1.00 74.33 H new ATOM 0 HD13 ILE B 41 18.964 -10.959 3.480 1.00 74.33 H new ATOM 2445 N PRO B 42 19.857 -6.409 2.792 1.00 23.23 N ATOM 2446 CA PRO B 42 19.981 -4.994 2.412 1.00 1.40 C ATOM 2447 C PRO B 42 18.681 -4.468 1.766 1.00 61.54 C ATOM 2448 O PRO B 42 18.126 -5.099 0.853 1.00 32.23 O ATOM 2449 CB PRO B 42 21.186 -4.984 1.412 1.00 54.33 C ATOM 2450 CG PRO B 42 21.618 -6.428 1.267 1.00 65.22 C ATOM 2451 CD PRO B 42 20.457 -7.269 1.748 1.00 72.32 C ATOM 0 HA PRO B 42 20.149 -4.337 3.265 1.00 1.40 H new ATOM 0 HB2 PRO B 42 20.891 -4.566 0.449 1.00 54.33 H new ATOM 0 HB3 PRO B 42 22.002 -4.368 1.790 1.00 54.33 H new ATOM 0 HG2 PRO B 42 21.862 -6.659 0.230 1.00 65.22 H new ATOM 0 HG3 PRO B 42 22.513 -6.627 1.857 1.00 65.22 H new ATOM 0 HD2 PRO B 42 19.752 -7.486 0.945 1.00 72.32 H new ATOM 0 HD3 PRO B 42 20.787 -8.227 2.150 1.00 72.32 H new ATOM 2459 N LEU B 43 18.190 -3.323 2.268 1.00 41.03 N ATOM 2460 CA LEU B 43 17.073 -2.575 1.672 1.00 52.30 C ATOM 2461 C LEU B 43 17.648 -1.296 1.014 1.00 12.03 C ATOM 2462 O LEU B 43 17.759 -0.254 1.676 1.00 52.05 O ATOM 2463 CB LEU B 43 15.979 -2.223 2.737 1.00 14.03 C ATOM 2464 CG LEU B 43 15.224 -3.414 3.441 1.00 42.21 C ATOM 2465 CD1 LEU B 43 14.667 -4.427 2.420 1.00 20.52 C ATOM 2466 CD2 LEU B 43 16.098 -4.098 4.513 1.00 71.20 C ATOM 0 H LEU B 43 18.563 -2.886 3.111 1.00 41.03 H new ATOM 0 HA LEU B 43 16.580 -3.192 0.920 1.00 52.30 H new ATOM 0 HB2 LEU B 43 16.450 -1.620 3.513 1.00 14.03 H new ATOM 0 HB3 LEU B 43 15.232 -1.593 2.254 1.00 14.03 H new ATOM 0 HG LEU B 43 14.367 -2.983 3.959 1.00 42.21 H new ATOM 0 HD11 LEU B 43 14.154 -5.231 2.948 1.00 20.52 H new ATOM 0 HD12 LEU B 43 13.965 -3.924 1.755 1.00 20.52 H new ATOM 0 HD13 LEU B 43 15.487 -4.842 1.835 1.00 20.52 H new ATOM 0 HD21 LEU B 43 15.539 -4.913 4.973 1.00 71.20 H new ATOM 0 HD22 LEU B 43 17.001 -4.495 4.048 1.00 71.20 H new ATOM 0 HD23 LEU B 43 16.373 -3.370 5.277 1.00 71.20 H new ATOM 2478 N PRO B 44 18.063 -1.361 -0.299 1.00 33.44 N ATOM 2479 CA PRO B 44 18.761 -0.237 -0.981 1.00 4.04 C ATOM 2480 C PRO B 44 17.820 0.924 -1.370 1.00 23.45 C ATOM 2481 O PRO B 44 18.289 2.001 -1.751 1.00 21.44 O ATOM 2482 CB PRO B 44 19.370 -0.921 -2.228 1.00 62.55 C ATOM 2483 CG PRO B 44 18.408 -2.029 -2.556 1.00 12.31 C ATOM 2484 CD PRO B 44 17.892 -2.530 -1.218 1.00 52.34 C ATOM 0 HA PRO B 44 19.497 0.242 -0.336 1.00 4.04 H new ATOM 0 HB2 PRO B 44 19.467 -0.221 -3.058 1.00 62.55 H new ATOM 0 HB3 PRO B 44 20.367 -1.309 -2.021 1.00 62.55 H new ATOM 0 HG2 PRO B 44 17.591 -1.667 -3.181 1.00 12.31 H new ATOM 0 HG3 PRO B 44 18.903 -2.827 -3.109 1.00 12.31 H new ATOM 0 HD2 PRO B 44 16.848 -2.836 -1.283 1.00 52.34 H new ATOM 0 HD3 PRO B 44 18.457 -3.395 -0.872 1.00 52.34 H new ATOM 2492 N ASN B 45 16.502 0.686 -1.278 1.00 3.31 N ATOM 2493 CA ASN B 45 15.475 1.696 -1.577 1.00 52.40 C ATOM 2494 C ASN B 45 15.305 2.663 -0.388 1.00 45.52 C ATOM 2495 O ASN B 45 15.486 3.880 -0.530 1.00 43.44 O ATOM 2496 CB ASN B 45 14.138 0.993 -1.927 1.00 2.22 C ATOM 2497 CG ASN B 45 12.970 1.958 -2.189 1.00 3.35 C ATOM 2498 OD1 ASN B 45 12.211 2.304 -1.281 1.00 23.23 O ATOM 2499 ND2 ASN B 45 12.815 2.392 -3.432 1.00 15.15 N ATOM 0 H ASN B 45 16.118 -0.215 -0.993 1.00 3.31 H new ATOM 0 HA ASN B 45 15.791 2.286 -2.438 1.00 52.40 H new ATOM 0 HB2 ASN B 45 14.287 0.372 -2.810 1.00 2.22 H new ATOM 0 HB3 ASN B 45 13.867 0.325 -1.110 1.00 2.22 H new ATOM 0 HD21 ASN B 45 12.052 3.030 -3.658 1.00 15.15 H new ATOM 0 HD22 ASN B 45 13.459 2.088 -4.162 1.00 15.15 H new ATOM 2506 N VAL B 46 14.987 2.099 0.788 1.00 1.42 N ATOM 2507 CA VAL B 46 14.630 2.887 1.983 1.00 54.23 C ATOM 2508 C VAL B 46 15.888 3.233 2.825 1.00 14.54 C ATOM 2509 O VAL B 46 16.753 2.379 3.069 1.00 25.13 O ATOM 2510 CB VAL B 46 13.543 2.127 2.841 1.00 3.35 C ATOM 2511 CG1 VAL B 46 14.049 0.765 3.360 1.00 72.13 C ATOM 2512 CG2 VAL B 46 13.016 3.006 3.995 1.00 20.40 C ATOM 0 H VAL B 46 14.969 1.090 0.939 1.00 1.42 H new ATOM 0 HA VAL B 46 14.196 3.832 1.655 1.00 54.23 H new ATOM 0 HB VAL B 46 12.708 1.919 2.172 1.00 3.35 H new ATOM 0 HG11 VAL B 46 13.264 0.284 3.943 1.00 72.13 H new ATOM 0 HG12 VAL B 46 14.315 0.130 2.515 1.00 72.13 H new ATOM 0 HG13 VAL B 46 14.926 0.918 3.989 1.00 72.13 H new ATOM 0 HG21 VAL B 46 12.270 2.451 4.564 1.00 20.40 H new ATOM 0 HG22 VAL B 46 13.843 3.280 4.651 1.00 20.40 H new ATOM 0 HG23 VAL B 46 12.563 3.909 3.587 1.00 20.40 H new ATOM 2522 N THR B 47 15.979 4.505 3.245 1.00 5.42 N ATOM 2523 CA THR B 47 17.095 5.035 4.055 1.00 73.13 C ATOM 2524 C THR B 47 16.941 4.645 5.535 1.00 64.13 C ATOM 2525 O THR B 47 15.920 4.075 5.927 1.00 74.30 O ATOM 2526 CB THR B 47 17.170 6.590 3.917 1.00 42.54 C ATOM 2527 OG1 THR B 47 15.903 7.164 4.289 1.00 30.34 O ATOM 2528 CG2 THR B 47 17.534 7.018 2.479 1.00 3.12 C ATOM 0 H THR B 47 15.271 5.207 3.030 1.00 5.42 H new ATOM 0 HA THR B 47 18.021 4.596 3.682 1.00 73.13 H new ATOM 0 HB THR B 47 17.955 6.952 4.581 1.00 42.54 H new ATOM 0 HG1 THR B 47 15.948 8.139 4.205 1.00 30.34 H new ATOM 0 HG21 THR B 47 17.577 8.106 2.423 1.00 3.12 H new ATOM 0 HG22 THR B 47 18.505 6.603 2.211 1.00 3.12 H new ATOM 0 HG23 THR B 47 16.777 6.648 1.787 1.00 3.12 H new ATOM 2536 N SER B 48 17.959 4.983 6.345 1.00 21.20 N ATOM 2537 CA SER B 48 18.045 4.578 7.756 1.00 63.21 C ATOM 2538 C SER B 48 16.958 5.223 8.617 1.00 1.43 C ATOM 2539 O SER B 48 16.311 4.538 9.393 1.00 43.32 O ATOM 2540 CB SER B 48 19.429 4.938 8.319 1.00 12.45 C ATOM 2541 OG SER B 48 19.679 6.327 8.216 1.00 70.32 O ATOM 0 H SER B 48 18.750 5.548 6.036 1.00 21.20 H new ATOM 0 HA SER B 48 17.893 3.499 7.791 1.00 63.21 H new ATOM 0 HB2 SER B 48 19.490 4.631 9.363 1.00 12.45 H new ATOM 0 HB3 SER B 48 20.199 4.386 7.779 1.00 12.45 H new ATOM 0 HG SER B 48 20.635 6.477 8.060 1.00 70.32 H new ATOM 2547 N THR B 49 16.769 6.543 8.451 1.00 42.41 N ATOM 2548 CA THR B 49 15.831 7.341 9.259 1.00 23.14 C ATOM 2549 C THR B 49 14.389 6.820 9.130 1.00 41.03 C ATOM 2550 O THR B 49 13.663 6.694 10.124 1.00 33.44 O ATOM 2551 CB THR B 49 15.894 8.841 8.831 1.00 31.13 C ATOM 2552 OG1 THR B 49 15.620 8.946 7.420 1.00 34.44 O ATOM 2553 CG2 THR B 49 17.271 9.470 9.132 1.00 54.01 C ATOM 0 H THR B 49 17.266 7.090 7.748 1.00 42.41 H new ATOM 0 HA THR B 49 16.130 7.248 10.303 1.00 23.14 H new ATOM 0 HB THR B 49 15.146 9.384 9.408 1.00 31.13 H new ATOM 0 HG1 THR B 49 15.657 9.887 7.149 1.00 34.44 H new ATOM 0 HG21 THR B 49 17.271 10.514 8.818 1.00 54.01 H new ATOM 0 HG22 THR B 49 17.471 9.413 10.202 1.00 54.01 H new ATOM 0 HG23 THR B 49 18.045 8.928 8.589 1.00 54.01 H new ATOM 2561 N ILE B 50 14.006 6.505 7.889 1.00 21.34 N ATOM 2562 CA ILE B 50 12.663 6.036 7.561 1.00 3.14 C ATOM 2563 C ILE B 50 12.486 4.568 7.999 1.00 51.43 C ATOM 2564 O ILE B 50 11.522 4.253 8.694 1.00 4.25 O ATOM 2565 CB ILE B 50 12.378 6.212 6.023 1.00 45.33 C ATOM 2566 CG1 ILE B 50 12.610 7.697 5.584 1.00 34.12 C ATOM 2567 CG2 ILE B 50 10.951 5.747 5.648 1.00 14.22 C ATOM 2568 CD1 ILE B 50 11.727 8.721 6.284 1.00 43.32 C ATOM 0 H ILE B 50 14.625 6.570 7.081 1.00 21.34 H new ATOM 0 HA ILE B 50 11.937 6.640 8.106 1.00 3.14 H new ATOM 0 HB ILE B 50 13.081 5.577 5.484 1.00 45.33 H new ATOM 0 HG12 ILE B 50 13.653 7.955 5.766 1.00 34.12 H new ATOM 0 HG13 ILE B 50 12.445 7.772 4.509 1.00 34.12 H new ATOM 0 HG21 ILE B 50 10.793 5.884 4.578 1.00 14.22 H new ATOM 0 HG22 ILE B 50 10.834 4.693 5.900 1.00 14.22 H new ATOM 0 HG23 ILE B 50 10.219 6.336 6.201 1.00 14.22 H new ATOM 0 HD11 ILE B 50 11.962 9.719 5.913 1.00 43.32 H new ATOM 0 HD12 ILE B 50 10.680 8.496 6.083 1.00 43.32 H new ATOM 0 HD13 ILE B 50 11.906 8.682 7.358 1.00 43.32 H new ATOM 2580 N LEU B 51 13.471 3.707 7.647 1.00 34.22 N ATOM 2581 CA LEU B 51 13.432 2.255 7.950 1.00 11.10 C ATOM 2582 C LEU B 51 13.399 2.004 9.473 1.00 43.02 C ATOM 2583 O LEU B 51 12.675 1.131 9.935 1.00 51.53 O ATOM 2584 CB LEU B 51 14.650 1.520 7.312 1.00 73.53 C ATOM 2585 CG LEU B 51 14.692 -0.041 7.476 1.00 41.42 C ATOM 2586 CD1 LEU B 51 13.463 -0.723 6.839 1.00 11.20 C ATOM 2587 CD2 LEU B 51 16.004 -0.630 6.919 1.00 34.23 C ATOM 0 H LEU B 51 14.311 3.997 7.147 1.00 34.22 H new ATOM 0 HA LEU B 51 12.516 1.854 7.516 1.00 11.10 H new ATOM 0 HB2 LEU B 51 14.668 1.752 6.247 1.00 73.53 H new ATOM 0 HB3 LEU B 51 15.562 1.933 7.744 1.00 73.53 H new ATOM 0 HG LEU B 51 14.658 -0.248 8.546 1.00 41.42 H new ATOM 0 HD11 LEU B 51 13.534 -1.802 6.976 1.00 11.20 H new ATOM 0 HD12 LEU B 51 12.555 -0.355 7.316 1.00 11.20 H new ATOM 0 HD13 LEU B 51 13.431 -0.494 5.774 1.00 11.20 H new ATOM 0 HD21 LEU B 51 16.001 -1.712 7.048 1.00 34.23 H new ATOM 0 HD22 LEU B 51 16.089 -0.391 5.859 1.00 34.23 H new ATOM 0 HD23 LEU B 51 16.851 -0.203 7.456 1.00 34.23 H new ATOM 2599 N GLU B 52 14.171 2.811 10.230 1.00 13.05 N ATOM 2600 CA GLU B 52 14.258 2.733 11.705 1.00 74.12 C ATOM 2601 C GLU B 52 12.872 2.908 12.335 1.00 30.41 C ATOM 2602 O GLU B 52 12.439 2.086 13.144 1.00 4.11 O ATOM 2603 CB GLU B 52 15.217 3.827 12.236 1.00 65.30 C ATOM 2604 CG GLU B 52 15.367 3.878 13.773 1.00 20.10 C ATOM 2605 CD GLU B 52 16.362 4.948 14.239 1.00 15.11 C ATOM 2606 OE1 GLU B 52 16.033 6.148 14.149 1.00 14.13 O ATOM 2607 OE2 GLU B 52 17.470 4.608 14.703 1.00 40.53 O ATOM 0 H GLU B 52 14.758 3.543 9.831 1.00 13.05 H new ATOM 0 HA GLU B 52 14.645 1.751 11.978 1.00 74.12 H new ATOM 0 HB2 GLU B 52 16.202 3.670 11.796 1.00 65.30 H new ATOM 0 HB3 GLU B 52 14.864 4.798 11.889 1.00 65.30 H new ATOM 0 HG2 GLU B 52 14.393 4.074 14.222 1.00 20.10 H new ATOM 0 HG3 GLU B 52 15.694 2.903 14.134 1.00 20.10 H new ATOM 2614 N LYS B 53 12.194 3.992 11.917 1.00 5.44 N ATOM 2615 CA LYS B 53 10.845 4.333 12.383 1.00 15.45 C ATOM 2616 C LYS B 53 9.824 3.241 12.008 1.00 30.12 C ATOM 2617 O LYS B 53 9.015 2.841 12.844 1.00 14.50 O ATOM 2618 CB LYS B 53 10.405 5.724 11.825 1.00 34.31 C ATOM 2619 CG LYS B 53 10.796 6.932 12.714 1.00 72.42 C ATOM 2620 CD LYS B 53 10.199 8.264 12.198 1.00 53.21 C ATOM 2621 CE LYS B 53 10.820 8.726 10.874 1.00 74.13 C ATOM 2622 NZ LYS B 53 12.280 8.967 11.016 1.00 4.21 N ATOM 0 H LYS B 53 12.572 4.657 11.243 1.00 5.44 H new ATOM 0 HA LYS B 53 10.874 4.393 13.471 1.00 15.45 H new ATOM 0 HB2 LYS B 53 10.845 5.860 10.837 1.00 34.31 H new ATOM 0 HB3 LYS B 53 9.323 5.722 11.694 1.00 34.31 H new ATOM 0 HG2 LYS B 53 10.454 6.755 13.734 1.00 72.42 H new ATOM 0 HG3 LYS B 53 11.882 7.015 12.752 1.00 72.42 H new ATOM 0 HD2 LYS B 53 9.123 8.147 12.067 1.00 53.21 H new ATOM 0 HD3 LYS B 53 10.346 9.038 12.951 1.00 53.21 H new ATOM 0 HE2 LYS B 53 10.647 7.972 10.106 1.00 74.13 H new ATOM 0 HE3 LYS B 53 10.329 9.640 10.539 1.00 74.13 H new ATOM 0 HZ1 LYS B 53 12.582 9.687 10.328 1.00 4.21 H new ATOM 0 HZ2 LYS B 53 12.485 9.301 11.979 1.00 4.21 H new ATOM 0 HZ3 LYS B 53 12.797 8.082 10.840 1.00 4.21 H new ATOM 2636 N VAL B 54 9.888 2.759 10.754 1.00 64.00 N ATOM 2637 CA VAL B 54 8.942 1.760 10.226 1.00 72.54 C ATOM 2638 C VAL B 54 9.079 0.413 10.978 1.00 25.41 C ATOM 2639 O VAL B 54 8.070 -0.214 11.299 1.00 14.13 O ATOM 2640 CB VAL B 54 9.132 1.587 8.668 1.00 34.32 C ATOM 2641 CG1 VAL B 54 8.281 0.431 8.099 1.00 33.32 C ATOM 2642 CG2 VAL B 54 8.795 2.909 7.930 1.00 14.34 C ATOM 0 H VAL B 54 10.595 3.050 10.079 1.00 64.00 H new ATOM 0 HA VAL B 54 7.927 2.120 10.396 1.00 72.54 H new ATOM 0 HB VAL B 54 10.179 1.336 8.500 1.00 34.32 H new ATOM 0 HG11 VAL B 54 8.446 0.352 7.024 1.00 33.32 H new ATOM 0 HG12 VAL B 54 8.569 -0.504 8.580 1.00 33.32 H new ATOM 0 HG13 VAL B 54 7.226 0.627 8.290 1.00 33.32 H new ATOM 0 HG21 VAL B 54 8.931 2.772 6.857 1.00 14.34 H new ATOM 0 HG22 VAL B 54 7.760 3.185 8.132 1.00 14.34 H new ATOM 0 HG23 VAL B 54 9.457 3.701 8.281 1.00 14.34 H new ATOM 2652 N LEU B 55 10.327 0.006 11.296 1.00 74.13 N ATOM 2653 CA LEU B 55 10.606 -1.255 12.028 1.00 53.23 C ATOM 2654 C LEU B 55 10.216 -1.141 13.511 1.00 10.40 C ATOM 2655 O LEU B 55 9.758 -2.117 14.114 1.00 50.41 O ATOM 2656 CB LEU B 55 12.104 -1.654 11.912 1.00 74.23 C ATOM 2657 CG LEU B 55 12.614 -2.010 10.486 1.00 72.12 C ATOM 2658 CD1 LEU B 55 14.121 -2.344 10.509 1.00 2.32 C ATOM 2659 CD2 LEU B 55 11.788 -3.154 9.860 1.00 23.01 C ATOM 0 H LEU B 55 11.165 0.535 11.056 1.00 74.13 H new ATOM 0 HA LEU B 55 9.998 -2.032 11.566 1.00 53.23 H new ATOM 0 HB2 LEU B 55 12.708 -0.832 12.296 1.00 74.23 H new ATOM 0 HB3 LEU B 55 12.281 -2.510 12.563 1.00 74.23 H new ATOM 0 HG LEU B 55 12.478 -1.133 9.853 1.00 72.12 H new ATOM 0 HD11 LEU B 55 14.455 -2.590 9.501 1.00 2.32 H new ATOM 0 HD12 LEU B 55 14.679 -1.483 10.876 1.00 2.32 H new ATOM 0 HD13 LEU B 55 14.295 -3.196 11.166 1.00 2.32 H new ATOM 0 HD21 LEU B 55 12.171 -3.377 8.864 1.00 23.01 H new ATOM 0 HD22 LEU B 55 11.865 -4.043 10.486 1.00 23.01 H new ATOM 0 HD23 LEU B 55 10.744 -2.851 9.787 1.00 23.01 H new ATOM 2671 N ASP B 56 10.422 0.060 14.083 1.00 50.31 N ATOM 2672 CA ASP B 56 10.113 0.346 15.497 1.00 13.34 C ATOM 2673 C ASP B 56 8.586 0.431 15.701 1.00 31.20 C ATOM 2674 O ASP B 56 8.067 0.041 16.756 1.00 1.52 O ATOM 2675 CB ASP B 56 10.825 1.659 15.936 1.00 52.42 C ATOM 2676 CG ASP B 56 10.718 1.969 17.441 1.00 73.13 C ATOM 2677 OD1 ASP B 56 10.338 3.095 17.811 1.00 51.51 O ATOM 2678 OD2 ASP B 56 11.031 1.086 18.265 1.00 24.14 O ATOM 0 H ASP B 56 10.807 0.859 13.579 1.00 50.31 H new ATOM 0 HA ASP B 56 10.485 -0.465 16.123 1.00 13.34 H new ATOM 0 HB2 ASP B 56 11.879 1.594 15.665 1.00 52.42 H new ATOM 0 HB3 ASP B 56 10.402 2.492 15.375 1.00 52.42 H new ATOM 2683 N TYR B 57 7.878 0.914 14.660 1.00 33.34 N ATOM 2684 CA TYR B 57 6.410 0.972 14.649 1.00 63.43 C ATOM 2685 C TYR B 57 5.836 -0.441 14.514 1.00 35.45 C ATOM 2686 O TYR B 57 4.905 -0.809 15.237 1.00 0.45 O ATOM 2687 CB TYR B 57 5.894 1.871 13.491 1.00 72.04 C ATOM 2688 CG TYR B 57 4.360 2.035 13.464 1.00 13.11 C ATOM 2689 CD1 TYR B 57 3.543 1.169 12.717 1.00 72.24 C ATOM 2690 CD2 TYR B 57 3.734 3.031 14.216 1.00 2.22 C ATOM 2691 CE1 TYR B 57 2.172 1.294 12.728 1.00 54.44 C ATOM 2692 CE2 TYR B 57 2.363 3.164 14.219 1.00 74.42 C ATOM 2693 CZ TYR B 57 1.586 2.294 13.483 1.00 21.25 C ATOM 2694 OH TYR B 57 0.218 2.410 13.519 1.00 62.25 O ATOM 0 H TYR B 57 8.310 1.273 13.808 1.00 33.34 H new ATOM 0 HA TYR B 57 6.077 1.410 15.590 1.00 63.43 H new ATOM 0 HB2 TYR B 57 6.354 2.856 13.576 1.00 72.04 H new ATOM 0 HB3 TYR B 57 6.221 1.447 12.542 1.00 72.04 H new ATOM 0 HD1 TYR B 57 3.999 0.391 12.123 1.00 72.24 H new ATOM 0 HD2 TYR B 57 4.335 3.708 14.805 1.00 2.22 H new ATOM 0 HE1 TYR B 57 1.559 0.617 12.152 1.00 54.44 H new ATOM 0 HE2 TYR B 57 1.897 3.948 14.797 1.00 74.42 H new ATOM 0 HH TYR B 57 -0.031 3.162 14.096 1.00 62.25 H new ATOM 2704 N CYS B 58 6.396 -1.215 13.557 1.00 0.41 N ATOM 2705 CA CYS B 58 5.991 -2.610 13.309 1.00 42.20 C ATOM 2706 C CYS B 58 6.259 -3.480 14.539 1.00 73.13 C ATOM 2707 O CYS B 58 5.527 -4.433 14.789 1.00 64.51 O ATOM 2708 CB CYS B 58 6.712 -3.173 12.072 1.00 53.13 C ATOM 2709 SG CYS B 58 6.247 -2.347 10.536 1.00 35.41 S ATOM 0 H CYS B 58 7.139 -0.888 12.939 1.00 0.41 H new ATOM 0 HA CYS B 58 4.919 -2.624 13.113 1.00 42.20 H new ATOM 0 HB2 CYS B 58 7.789 -3.081 12.214 1.00 53.13 H new ATOM 0 HB3 CYS B 58 6.492 -4.237 11.985 1.00 53.13 H new ATOM 0 HG CYS B 58 6.887 -1.220 10.439 1.00 35.41 H new ATOM 2715 N ARG B 59 7.316 -3.130 15.301 1.00 45.33 N ATOM 2716 CA ARG B 59 7.630 -3.785 16.575 1.00 25.31 C ATOM 2717 C ARG B 59 6.534 -3.501 17.603 1.00 31.42 C ATOM 2718 O ARG B 59 6.068 -4.426 18.256 1.00 74.25 O ATOM 2719 CB ARG B 59 9.023 -3.360 17.108 1.00 0.21 C ATOM 2720 CG ARG B 59 9.332 -3.830 18.561 1.00 24.11 C ATOM 2721 CD ARG B 59 10.821 -3.727 18.913 1.00 1.41 C ATOM 2722 NE ARG B 59 11.391 -2.406 18.599 1.00 21.44 N ATOM 2723 CZ ARG B 59 12.702 -2.161 18.436 1.00 73.51 C ATOM 2724 NH1 ARG B 59 13.607 -3.134 18.560 1.00 23.40 N ATOM 2725 NH2 ARG B 59 13.098 -0.947 18.143 1.00 34.23 N ATOM 0 H ARG B 59 7.969 -2.389 15.047 1.00 45.33 H new ATOM 0 HA ARG B 59 7.669 -4.860 16.400 1.00 25.31 H new ATOM 0 HB2 ARG B 59 9.789 -3.756 16.441 1.00 0.21 H new ATOM 0 HB3 ARG B 59 9.097 -2.273 17.068 1.00 0.21 H new ATOM 0 HG2 ARG B 59 8.755 -3.229 19.263 1.00 24.11 H new ATOM 0 HG3 ARG B 59 9.005 -4.863 18.682 1.00 24.11 H new ATOM 0 HD2 ARG B 59 10.954 -3.932 19.975 1.00 1.41 H new ATOM 0 HD3 ARG B 59 11.372 -4.494 18.369 1.00 1.41 H new ATOM 0 HE ARG B 59 10.746 -1.623 18.498 1.00 21.44 H new ATOM 0 HH11 ARG B 59 13.308 -4.083 18.782 1.00 23.40 H new ATOM 0 HH12 ARG B 59 14.598 -2.928 18.433 1.00 23.40 H new ATOM 0 HH21 ARG B 59 12.413 -0.198 18.041 1.00 34.23 H new ATOM 0 HH22 ARG B 59 14.091 -0.751 18.017 1.00 34.23 H new ATOM 2739 N HIS B 60 6.103 -2.228 17.710 1.00 42.31 N ATOM 2740 CA HIS B 60 5.033 -1.834 18.652 1.00 3.35 C ATOM 2741 C HIS B 60 3.693 -2.499 18.269 1.00 21.11 C ATOM 2742 O HIS B 60 2.907 -2.890 19.143 1.00 70.51 O ATOM 2743 CB HIS B 60 4.886 -0.288 18.716 1.00 0.13 C ATOM 2744 CG HIS B 60 3.854 0.163 19.722 1.00 71.22 C ATOM 2745 ND1 HIS B 60 2.712 0.858 19.386 1.00 55.45 N ATOM 2746 CD2 HIS B 60 3.780 -0.042 21.064 1.00 52.13 C ATOM 2747 CE1 HIS B 60 1.983 1.044 20.467 1.00 11.02 C ATOM 2748 NE2 HIS B 60 2.608 0.506 21.496 1.00 71.03 N ATOM 0 H HIS B 60 6.477 -1.456 17.158 1.00 42.31 H new ATOM 0 HA HIS B 60 5.314 -2.184 19.645 1.00 3.35 H new ATOM 0 HB2 HIS B 60 5.850 0.153 18.969 1.00 0.13 H new ATOM 0 HB3 HIS B 60 4.613 0.087 17.730 1.00 0.13 H new ATOM 0 HD1 HIS B 60 2.470 1.178 18.448 1.00 55.45 H new ATOM 0 HD2 HIS B 60 4.514 -0.546 21.675 1.00 52.13 H new ATOM 0 HE1 HIS B 60 1.031 1.553 20.504 1.00 11.02 H new ATOM 2757 N HIS B 61 3.469 -2.642 16.954 1.00 43.34 N ATOM 2758 CA HIS B 61 2.268 -3.284 16.396 1.00 33.34 C ATOM 2759 C HIS B 61 2.396 -4.829 16.464 1.00 10.31 C ATOM 2760 O HIS B 61 1.420 -5.551 16.270 1.00 50.12 O ATOM 2761 CB HIS B 61 2.040 -2.810 14.934 1.00 33.31 C ATOM 2762 CG HIS B 61 0.658 -3.105 14.398 1.00 22.13 C ATOM 2763 ND1 HIS B 61 0.256 -4.360 13.986 1.00 74.53 N ATOM 2764 CD2 HIS B 61 -0.415 -2.299 14.219 1.00 63.10 C ATOM 2765 CE1 HIS B 61 -0.998 -4.309 13.587 1.00 63.42 C ATOM 2766 NE2 HIS B 61 -1.425 -3.074 13.723 1.00 14.23 N ATOM 0 H HIS B 61 4.121 -2.313 16.242 1.00 43.34 H new ATOM 0 HA HIS B 61 1.403 -2.991 16.992 1.00 33.34 H new ATOM 0 HB2 HIS B 61 2.217 -1.736 14.880 1.00 33.31 H new ATOM 0 HB3 HIS B 61 2.778 -3.288 14.289 1.00 33.31 H new ATOM 0 HD1 HIS B 61 0.840 -5.197 13.990 1.00 74.53 H new ATOM 0 HD2 HIS B 61 -0.464 -1.241 14.429 1.00 63.10 H new ATOM 0 HE1 HIS B 61 -1.577 -5.140 13.212 1.00 63.42 H new ATOM 2775 N HIS B 62 3.625 -5.324 16.687 1.00 0.52 N ATOM 2776 CA HIS B 62 3.890 -6.756 16.931 1.00 14.43 C ATOM 2777 C HIS B 62 3.606 -7.089 18.404 1.00 72.22 C ATOM 2778 O HIS B 62 3.117 -8.182 18.716 1.00 4.34 O ATOM 2779 CB HIS B 62 5.357 -7.093 16.564 1.00 41.13 C ATOM 2780 CG HIS B 62 5.712 -8.548 16.646 1.00 61.01 C ATOM 2781 ND1 HIS B 62 5.604 -9.407 15.576 1.00 32.40 N ATOM 2782 CD2 HIS B 62 6.199 -9.289 17.669 1.00 64.10 C ATOM 2783 CE1 HIS B 62 6.001 -10.604 15.943 1.00 52.53 C ATOM 2784 NE2 HIS B 62 6.366 -10.558 17.203 1.00 51.32 N ATOM 0 H HIS B 62 4.464 -4.744 16.704 1.00 0.52 H new ATOM 0 HA HIS B 62 3.234 -7.359 16.304 1.00 14.43 H new ATOM 0 HB2 HIS B 62 5.552 -6.743 15.550 1.00 41.13 H new ATOM 0 HB3 HIS B 62 6.019 -6.535 17.226 1.00 41.13 H new ATOM 0 HD2 HIS B 62 6.415 -8.939 18.668 1.00 64.10 H new ATOM 0 HE1 HIS B 62 6.023 -11.481 15.313 1.00 52.53 H new ATOM 0 HE2 HIS B 62 6.718 -11.346 17.746 1.00 51.32 H new ATOM 2793 N GLN B 63 3.931 -6.132 19.299 1.00 73.43 N ATOM 2794 CA GLN B 63 3.668 -6.260 20.742 1.00 25.31 C ATOM 2795 C GLN B 63 2.154 -6.163 21.002 1.00 40.42 C ATOM 2796 O GLN B 63 1.621 -6.806 21.906 1.00 52.13 O ATOM 2797 CB GLN B 63 4.419 -5.165 21.558 1.00 11.20 C ATOM 2798 CG GLN B 63 5.945 -5.045 21.302 1.00 10.35 C ATOM 2799 CD GLN B 63 6.711 -6.369 21.394 1.00 63.44 C ATOM 2800 OE1 GLN B 63 6.888 -7.082 20.400 1.00 52.31 O ATOM 2801 NE2 GLN B 63 7.183 -6.702 22.586 1.00 61.31 N ATOM 0 H GLN B 63 4.381 -5.254 19.040 1.00 73.43 H new ATOM 0 HA GLN B 63 4.036 -7.232 21.070 1.00 25.31 H new ATOM 0 HB2 GLN B 63 3.959 -4.201 21.342 1.00 11.20 H new ATOM 0 HB3 GLN B 63 4.264 -5.362 22.619 1.00 11.20 H new ATOM 0 HG2 GLN B 63 6.102 -4.617 20.312 1.00 10.35 H new ATOM 0 HG3 GLN B 63 6.367 -4.345 22.022 1.00 10.35 H new ATOM 0 HE21 GLN B 63 7.020 -6.092 23.387 1.00 61.31 H new ATOM 0 HE22 GLN B 63 7.709 -7.568 22.702 1.00 61.31 H new ATOM 2810 N HIS B 64 1.476 -5.332 20.189 1.00 12.21 N ATOM 2811 CA HIS B 64 0.018 -5.127 20.249 1.00 22.21 C ATOM 2812 C HIS B 64 -0.552 -5.290 18.824 1.00 31.14 C ATOM 2813 O HIS B 64 -0.541 -4.330 18.052 1.00 21.21 O ATOM 2814 CB HIS B 64 -0.310 -3.720 20.822 1.00 43.55 C ATOM 2815 CG HIS B 64 0.322 -3.438 22.163 1.00 4.44 C ATOM 2816 ND1 HIS B 64 -0.255 -3.806 23.353 1.00 54.35 N ATOM 2817 CD2 HIS B 64 1.497 -2.844 22.493 1.00 12.22 C ATOM 2818 CE1 HIS B 64 0.529 -3.458 24.348 1.00 61.43 C ATOM 2819 NE2 HIS B 64 1.599 -2.873 23.854 1.00 61.33 N ATOM 0 H HIS B 64 1.931 -4.778 19.464 1.00 12.21 H new ATOM 0 HA HIS B 64 -0.438 -5.863 20.912 1.00 22.21 H new ATOM 0 HB2 HIS B 64 0.021 -2.964 20.110 1.00 43.55 H new ATOM 0 HB3 HIS B 64 -1.392 -3.620 20.914 1.00 43.55 H new ATOM 0 HD2 HIS B 64 2.218 -2.426 21.806 1.00 12.22 H new ATOM 0 HE1 HIS B 64 0.329 -3.624 25.396 1.00 61.43 H new ATOM 0 HE2 HIS B 64 2.377 -2.502 24.399 1.00 61.33 H new ATOM 2828 N PRO B 65 -1.009 -6.529 18.424 1.00 72.41 N ATOM 2829 CA PRO B 65 -1.529 -6.805 17.045 1.00 61.41 C ATOM 2830 C PRO B 65 -2.800 -6.001 16.688 1.00 3.44 C ATOM 2831 O PRO B 65 -3.215 -5.984 15.526 1.00 30.30 O ATOM 2832 CB PRO B 65 -1.799 -8.337 17.060 1.00 1.20 C ATOM 2833 CG PRO B 65 -1.965 -8.679 18.513 1.00 21.35 C ATOM 2834 CD PRO B 65 -1.027 -7.758 19.261 1.00 0.31 C ATOM 0 HA PRO B 65 -0.817 -6.497 16.279 1.00 61.41 H new ATOM 0 HB2 PRO B 65 -2.693 -8.587 16.489 1.00 1.20 H new ATOM 0 HB3 PRO B 65 -0.972 -8.890 16.615 1.00 1.20 H new ATOM 0 HG2 PRO B 65 -2.996 -8.532 18.834 1.00 21.35 H new ATOM 0 HG3 PRO B 65 -1.719 -9.724 18.700 1.00 21.35 H new ATOM 0 HD2 PRO B 65 -1.386 -7.552 20.269 1.00 0.31 H new ATOM 0 HD3 PRO B 65 -0.032 -8.192 19.359 1.00 0.31 H new ATOM 2842 N GLY B 66 -3.409 -5.363 17.700 1.00 14.14 N ATOM 2843 CA GLY B 66 -4.536 -4.446 17.510 1.00 41.51 C ATOM 2844 C GLY B 66 -4.486 -3.282 18.497 1.00 45.32 C ATOM 2845 O GLY B 66 -4.744 -2.132 18.126 1.00 4.32 O ATOM 0 H GLY B 66 -3.130 -5.471 18.675 1.00 14.14 H new ATOM 0 HA2 GLY B 66 -4.524 -4.060 16.491 1.00 41.51 H new ATOM 0 HA3 GLY B 66 -5.473 -4.989 17.634 1.00 41.51 H new ATOM 2849 N GLY B 67 -4.139 -3.591 19.759 1.00 51.23 N ATOM 2850 CA GLY B 67 -4.098 -2.606 20.844 1.00 71.45 C ATOM 2851 C GLY B 67 -5.428 -2.516 21.591 1.00 2.53 C ATOM 2852 O GLY B 67 -6.493 -2.471 20.963 1.00 33.22 O ATOM 0 H GLY B 67 -3.880 -4.533 20.051 1.00 51.23 H new ATOM 0 HA2 GLY B 67 -3.307 -2.872 21.545 1.00 71.45 H new ATOM 0 HA3 GLY B 67 -3.846 -1.628 20.435 1.00 71.45 H new ATOM 2856 N SER B 68 -5.363 -2.470 22.932 1.00 43.01 N ATOM 2857 CA SER B 68 -6.553 -2.375 23.809 1.00 65.11 C ATOM 2858 C SER B 68 -7.145 -0.940 23.822 1.00 43.14 C ATOM 2859 O SER B 68 -8.194 -0.702 24.436 1.00 72.23 O ATOM 2860 CB SER B 68 -6.176 -2.806 25.245 1.00 23.02 C ATOM 2861 OG SER B 68 -5.602 -4.110 25.264 1.00 32.02 O ATOM 0 H SER B 68 -4.482 -2.497 23.445 1.00 43.01 H new ATOM 0 HA SER B 68 -7.318 -3.043 23.413 1.00 65.11 H new ATOM 0 HB2 SER B 68 -5.471 -2.090 25.668 1.00 23.02 H new ATOM 0 HB3 SER B 68 -7.064 -2.789 25.876 1.00 23.02 H new ATOM 0 HG SER B 68 -5.373 -4.353 26.185 1.00 32.02 H new ATOM 2867 N GLY B 69 -6.441 0.000 23.161 1.00 13.43 N ATOM 2868 CA GLY B 69 -6.887 1.379 23.031 1.00 72.43 C ATOM 2869 C GLY B 69 -8.136 1.519 22.168 1.00 44.41 C ATOM 2870 O GLY B 69 -8.045 1.413 20.941 1.00 33.20 O ATOM 0 H GLY B 69 -5.548 -0.188 22.706 1.00 13.43 H new ATOM 0 HA2 GLY B 69 -7.089 1.785 24.022 1.00 72.43 H new ATOM 0 HA3 GLY B 69 -6.084 1.976 22.599 1.00 72.43 H new ATOM 2874 N LEU B 70 -9.299 1.720 22.822 1.00 45.50 N ATOM 2875 CA LEU B 70 -10.587 2.009 22.147 1.00 12.12 C ATOM 2876 C LEU B 70 -10.535 3.389 21.431 1.00 20.25 C ATOM 2877 O LEU B 70 -10.894 4.420 22.013 1.00 12.13 O ATOM 2878 CB LEU B 70 -11.807 1.880 23.140 1.00 2.13 C ATOM 2879 CG LEU B 70 -11.557 2.142 24.682 1.00 14.25 C ATOM 2880 CD1 LEU B 70 -11.048 3.564 24.981 1.00 14.21 C ATOM 2881 CD2 LEU B 70 -12.828 1.839 25.500 1.00 33.13 C ATOM 0 H LEU B 70 -9.374 1.687 23.839 1.00 45.50 H new ATOM 0 HA LEU B 70 -10.747 1.255 21.376 1.00 12.12 H new ATOM 0 HB2 LEU B 70 -12.580 2.573 22.807 1.00 2.13 H new ATOM 0 HB3 LEU B 70 -12.214 0.874 23.036 1.00 2.13 H new ATOM 0 HG LEU B 70 -10.764 1.458 24.985 1.00 14.25 H new ATOM 0 HD11 LEU B 70 -10.897 3.678 26.054 1.00 14.21 H new ATOM 0 HD12 LEU B 70 -10.104 3.729 24.462 1.00 14.21 H new ATOM 0 HD13 LEU B 70 -11.783 4.293 24.638 1.00 14.21 H new ATOM 0 HD21 LEU B 70 -12.634 2.026 26.556 1.00 33.13 H new ATOM 0 HD22 LEU B 70 -13.641 2.482 25.161 1.00 33.13 H new ATOM 0 HD23 LEU B 70 -13.109 0.795 25.362 1.00 33.13 H new ATOM 2893 N ASP B 71 -10.004 3.371 20.177 1.00 31.11 N ATOM 2894 CA ASP B 71 -9.711 4.586 19.354 1.00 31.45 C ATOM 2895 C ASP B 71 -8.587 5.442 20.015 1.00 50.11 C ATOM 2896 O ASP B 71 -8.218 6.520 19.538 1.00 33.33 O ATOM 2897 CB ASP B 71 -11.018 5.409 19.097 1.00 21.14 C ATOM 2898 CG ASP B 71 -10.833 6.651 18.198 1.00 41.52 C ATOM 2899 OD1 ASP B 71 -10.918 7.795 18.697 1.00 20.35 O ATOM 2900 OD2 ASP B 71 -10.582 6.487 16.986 1.00 63.22 O ATOM 0 H ASP B 71 -9.763 2.502 19.700 1.00 31.11 H new ATOM 0 HA ASP B 71 -9.338 4.270 18.380 1.00 31.45 H new ATOM 0 HB2 ASP B 71 -11.760 4.754 18.640 1.00 21.14 H new ATOM 0 HB3 ASP B 71 -11.424 5.729 20.057 1.00 21.14 H new ATOM 2905 N ASP B 72 -7.987 4.889 21.079 1.00 40.32 N ATOM 2906 CA ASP B 72 -7.012 5.578 21.923 1.00 44.33 C ATOM 2907 C ASP B 72 -5.622 5.301 21.363 1.00 14.53 C ATOM 2908 O ASP B 72 -5.026 4.245 21.618 1.00 24.43 O ATOM 2909 CB ASP B 72 -7.153 5.106 23.401 1.00 23.31 C ATOM 2910 CG ASP B 72 -6.072 5.660 24.362 1.00 52.22 C ATOM 2911 OD1 ASP B 72 -6.016 6.888 24.567 1.00 52.12 O ATOM 2912 OD2 ASP B 72 -5.292 4.866 24.938 1.00 44.02 O ATOM 0 H ASP B 72 -8.172 3.932 21.379 1.00 40.32 H new ATOM 0 HA ASP B 72 -7.186 6.654 21.919 1.00 44.33 H new ATOM 0 HB2 ASP B 72 -8.135 5.402 23.771 1.00 23.31 H new ATOM 0 HB3 ASP B 72 -7.118 4.017 23.425 1.00 23.31 H new ATOM 2917 N ILE B 73 -5.177 6.228 20.514 1.00 4.44 N ATOM 2918 CA ILE B 73 -3.863 6.187 19.875 1.00 51.12 C ATOM 2919 C ILE B 73 -2.773 6.499 20.928 1.00 71.32 C ATOM 2920 O ILE B 73 -2.824 7.578 21.534 1.00 64.12 O ATOM 2921 CB ILE B 73 -3.786 7.231 18.695 1.00 44.04 C ATOM 2922 CG1 ILE B 73 -4.925 6.983 17.651 1.00 70.13 C ATOM 2923 CG2 ILE B 73 -2.393 7.211 18.010 1.00 64.30 C ATOM 2924 CD1 ILE B 73 -4.982 8.005 16.520 1.00 71.43 C ATOM 0 H ILE B 73 -5.730 7.042 20.247 1.00 4.44 H new ATOM 0 HA ILE B 73 -3.700 5.191 19.462 1.00 51.12 H new ATOM 0 HB ILE B 73 -3.930 8.223 19.124 1.00 44.04 H new ATOM 0 HG12 ILE B 73 -4.795 5.990 17.220 1.00 70.13 H new ATOM 0 HG13 ILE B 73 -5.883 6.982 18.171 1.00 70.13 H new ATOM 0 HG21 ILE B 73 -2.375 7.942 17.202 1.00 64.30 H new ATOM 0 HG22 ILE B 73 -1.624 7.459 18.742 1.00 64.30 H new ATOM 0 HG23 ILE B 73 -2.201 6.217 17.605 1.00 64.30 H new ATOM 0 HD11 ILE B 73 -5.800 7.755 15.845 1.00 71.43 H new ATOM 0 HD12 ILE B 73 -5.145 8.999 16.936 1.00 71.43 H new ATOM 0 HD13 ILE B 73 -4.041 7.992 15.970 1.00 71.43 H new ATOM 2936 N PRO B 74 -1.798 5.560 21.187 1.00 12.11 N ATOM 2937 CA PRO B 74 -0.687 5.801 22.143 1.00 31.01 C ATOM 2938 C PRO B 74 0.203 7.000 21.714 1.00 24.53 C ATOM 2939 O PRO B 74 0.339 7.255 20.509 1.00 2.01 O ATOM 2940 CB PRO B 74 0.100 4.456 22.146 1.00 1.34 C ATOM 2941 CG PRO B 74 -0.873 3.442 21.609 1.00 23.13 C ATOM 2942 CD PRO B 74 -1.705 4.194 20.592 1.00 4.53 C ATOM 0 HA PRO B 74 -1.044 6.075 23.136 1.00 31.01 H new ATOM 0 HB2 PRO B 74 0.992 4.518 21.522 1.00 1.34 H new ATOM 0 HB3 PRO B 74 0.431 4.193 23.151 1.00 1.34 H new ATOM 0 HG2 PRO B 74 -0.353 2.602 21.149 1.00 23.13 H new ATOM 0 HG3 PRO B 74 -1.497 3.034 22.405 1.00 23.13 H new ATOM 0 HD2 PRO B 74 -1.228 4.211 19.612 1.00 4.53 H new ATOM 0 HD3 PRO B 74 -2.688 3.742 20.460 1.00 4.53 H new ATOM 2950 N PRO B 75 0.797 7.764 22.698 1.00 41.33 N ATOM 2951 CA PRO B 75 1.612 8.980 22.417 1.00 52.31 C ATOM 2952 C PRO B 75 2.726 8.756 21.376 1.00 53.21 C ATOM 2953 O PRO B 75 3.028 9.660 20.586 1.00 24.12 O ATOM 2954 CB PRO B 75 2.206 9.343 23.800 1.00 32.03 C ATOM 2955 CG PRO B 75 1.224 8.785 24.786 1.00 33.14 C ATOM 2956 CD PRO B 75 0.706 7.507 24.163 1.00 64.24 C ATOM 0 HA PRO B 75 1.004 9.770 21.976 1.00 52.31 H new ATOM 0 HB2 PRO B 75 3.196 8.906 23.934 1.00 32.03 H new ATOM 0 HB3 PRO B 75 2.315 10.421 23.915 1.00 32.03 H new ATOM 0 HG2 PRO B 75 1.701 8.588 25.746 1.00 33.14 H new ATOM 0 HG3 PRO B 75 0.412 9.488 24.972 1.00 33.14 H new ATOM 0 HD2 PRO B 75 1.307 6.647 24.456 1.00 64.24 H new ATOM 0 HD3 PRO B 75 -0.319 7.299 24.470 1.00 64.24 H new ATOM 2964 N TYR B 76 3.318 7.541 21.381 1.00 20.21 N ATOM 2965 CA TYR B 76 4.328 7.136 20.389 1.00 53.04 C ATOM 2966 C TYR B 76 3.771 7.255 18.966 1.00 13.14 C ATOM 2967 O TYR B 76 4.338 7.952 18.131 1.00 31.22 O ATOM 2968 CB TYR B 76 4.819 5.674 20.644 1.00 15.34 C ATOM 2969 CG TYR B 76 5.634 5.066 19.471 1.00 4.23 C ATOM 2970 CD1 TYR B 76 6.858 5.622 19.090 1.00 20.21 C ATOM 2971 CD2 TYR B 76 5.151 3.980 18.725 1.00 73.45 C ATOM 2972 CE1 TYR B 76 7.563 5.132 18.011 1.00 34.31 C ATOM 2973 CE2 TYR B 76 5.861 3.479 17.650 1.00 11.52 C ATOM 2974 CZ TYR B 76 7.066 4.061 17.295 1.00 24.10 C ATOM 2975 OH TYR B 76 7.768 3.587 16.211 1.00 72.31 O ATOM 0 H TYR B 76 3.108 6.820 22.071 1.00 20.21 H new ATOM 0 HA TYR B 76 5.178 7.810 20.495 1.00 53.04 H new ATOM 0 HB2 TYR B 76 5.433 5.660 21.545 1.00 15.34 H new ATOM 0 HB3 TYR B 76 3.954 5.040 20.838 1.00 15.34 H new ATOM 0 HD1 TYR B 76 7.260 6.452 19.652 1.00 20.21 H new ATOM 0 HD2 TYR B 76 4.208 3.528 18.995 1.00 73.45 H new ATOM 0 HE1 TYR B 76 8.501 5.585 17.727 1.00 34.31 H new ATOM 0 HE2 TYR B 76 5.478 2.638 17.090 1.00 11.52 H new ATOM 0 HH TYR B 76 8.691 3.394 16.478 1.00 72.31 H new ATOM 2985 N ASP B 77 2.646 6.576 18.735 1.00 23.33 N ATOM 2986 CA ASP B 77 2.058 6.384 17.399 1.00 51.34 C ATOM 2987 C ASP B 77 1.481 7.704 16.857 1.00 5.23 C ATOM 2988 O ASP B 77 1.425 7.915 15.638 1.00 20.13 O ATOM 2989 CB ASP B 77 0.967 5.281 17.465 1.00 62.20 C ATOM 2990 CG ASP B 77 1.485 3.960 18.077 1.00 10.42 C ATOM 2991 OD1 ASP B 77 1.637 2.946 17.357 1.00 42.35 O ATOM 2992 OD2 ASP B 77 1.773 3.941 19.293 1.00 53.51 O ATOM 0 H ASP B 77 2.106 6.135 19.480 1.00 23.33 H new ATOM 0 HA ASP B 77 2.840 6.064 16.710 1.00 51.34 H new ATOM 0 HB2 ASP B 77 0.126 5.644 18.055 1.00 62.20 H new ATOM 0 HB3 ASP B 77 0.592 5.088 16.460 1.00 62.20 H new ATOM 2997 N ARG B 78 1.058 8.586 17.783 1.00 44.13 N ATOM 2998 CA ARG B 78 0.531 9.918 17.453 1.00 64.52 C ATOM 2999 C ARG B 78 1.665 10.848 16.976 1.00 61.01 C ATOM 3000 O ARG B 78 1.575 11.468 15.911 1.00 60.14 O ATOM 3001 CB ARG B 78 -0.191 10.524 18.689 1.00 5.41 C ATOM 3002 CG ARG B 78 -0.866 11.891 18.421 1.00 2.10 C ATOM 3003 CD ARG B 78 -1.564 12.472 19.661 1.00 70.42 C ATOM 3004 NE ARG B 78 -2.223 13.757 19.365 1.00 3.24 N ATOM 3005 CZ ARG B 78 -2.323 14.799 20.207 1.00 64.44 C ATOM 3006 NH1 ARG B 78 -1.809 14.749 21.440 1.00 12.12 N ATOM 3007 NH2 ARG B 78 -2.940 15.899 19.802 1.00 11.05 N ATOM 0 H ARG B 78 1.074 8.391 18.784 1.00 44.13 H new ATOM 0 HA ARG B 78 -0.189 9.819 16.641 1.00 64.52 H new ATOM 0 HB2 ARG B 78 -0.947 9.820 19.036 1.00 5.41 H new ATOM 0 HB3 ARG B 78 0.531 10.640 19.497 1.00 5.41 H new ATOM 0 HG2 ARG B 78 -0.114 12.598 18.070 1.00 2.10 H new ATOM 0 HG3 ARG B 78 -1.596 11.778 17.620 1.00 2.10 H new ATOM 0 HD2 ARG B 78 -2.303 11.760 20.029 1.00 70.42 H new ATOM 0 HD3 ARG B 78 -0.833 12.613 20.457 1.00 70.42 H new ATOM 0 HE ARG B 78 -2.639 13.864 18.440 1.00 3.24 H new ATOM 0 HH11 ARG B 78 -1.329 13.907 21.759 1.00 12.12 H new ATOM 0 HH12 ARG B 78 -1.897 15.552 22.062 1.00 12.12 H new ATOM 0 HH21 ARG B 78 -3.332 15.947 18.861 1.00 11.05 H new ATOM 0 HH22 ARG B 78 -3.023 16.698 20.431 1.00 11.05 H new ATOM 3021 N ASP B 79 2.744 10.923 17.780 1.00 53.03 N ATOM 3022 CA ASP B 79 3.932 11.749 17.470 1.00 2.32 C ATOM 3023 C ASP B 79 4.745 11.154 16.306 1.00 52.41 C ATOM 3024 O ASP B 79 5.508 11.872 15.653 1.00 1.22 O ATOM 3025 CB ASP B 79 4.821 11.939 18.732 1.00 44.40 C ATOM 3026 CG ASP B 79 4.213 12.917 19.759 1.00 54.32 C ATOM 3027 OD1 ASP B 79 3.740 12.491 20.830 1.00 74.32 O ATOM 3028 OD2 ASP B 79 4.193 14.137 19.488 1.00 22.40 O ATOM 0 H ASP B 79 2.818 10.415 18.661 1.00 53.03 H new ATOM 0 HA ASP B 79 3.578 12.730 17.154 1.00 2.32 H new ATOM 0 HB2 ASP B 79 4.976 10.971 19.209 1.00 44.40 H new ATOM 0 HB3 ASP B 79 5.801 12.305 18.427 1.00 44.40 H new ATOM 3033 N PHE B 80 4.580 9.839 16.077 1.00 3.12 N ATOM 3034 CA PHE B 80 5.175 9.121 14.935 1.00 62.01 C ATOM 3035 C PHE B 80 4.690 9.743 13.611 1.00 11.13 C ATOM 3036 O PHE B 80 5.482 9.993 12.694 1.00 12.10 O ATOM 3037 CB PHE B 80 4.780 7.616 15.008 1.00 52.52 C ATOM 3038 CG PHE B 80 5.368 6.759 13.903 1.00 24.31 C ATOM 3039 CD1 PHE B 80 4.704 6.596 12.684 1.00 10.23 C ATOM 3040 CD2 PHE B 80 6.595 6.139 14.073 1.00 2.43 C ATOM 3041 CE1 PHE B 80 5.256 5.844 11.680 1.00 60.52 C ATOM 3042 CE2 PHE B 80 7.138 5.384 13.071 1.00 51.05 C ATOM 3043 CZ PHE B 80 6.476 5.236 11.870 1.00 3.41 C ATOM 0 H PHE B 80 4.024 9.238 16.686 1.00 3.12 H new ATOM 0 HA PHE B 80 6.261 9.205 14.977 1.00 62.01 H new ATOM 0 HB2 PHE B 80 5.099 7.216 15.970 1.00 52.52 H new ATOM 0 HB3 PHE B 80 3.693 7.536 14.974 1.00 52.52 H new ATOM 0 HD1 PHE B 80 3.745 7.068 12.531 1.00 10.23 H new ATOM 0 HD2 PHE B 80 7.128 6.253 15.006 1.00 2.43 H new ATOM 0 HE1 PHE B 80 4.735 5.729 10.741 1.00 60.52 H new ATOM 0 HE2 PHE B 80 8.092 4.900 13.221 1.00 51.05 H new ATOM 0 HZ PHE B 80 6.914 4.644 11.080 1.00 3.41 H new ATOM 3053 N CYS B 81 3.371 9.981 13.553 1.00 4.34 N ATOM 3054 CA CYS B 81 2.698 10.548 12.380 1.00 45.15 C ATOM 3055 C CYS B 81 3.060 12.036 12.181 1.00 3.33 C ATOM 3056 O CYS B 81 2.875 12.579 11.085 1.00 42.02 O ATOM 3057 CB CYS B 81 1.181 10.361 12.540 1.00 43.23 C ATOM 3058 SG CYS B 81 0.673 8.630 12.728 1.00 14.03 S ATOM 0 H CYS B 81 2.738 9.783 14.328 1.00 4.34 H new ATOM 0 HA CYS B 81 3.037 10.023 11.487 1.00 45.15 H new ATOM 0 HB2 CYS B 81 0.844 10.925 13.410 1.00 43.23 H new ATOM 0 HB3 CYS B 81 0.678 10.785 11.671 1.00 43.23 H new ATOM 0 HG CYS B 81 0.950 8.225 13.932 1.00 14.03 H new ATOM 3064 N LYS B 82 3.580 12.687 13.248 1.00 42.21 N ATOM 3065 CA LYS B 82 4.022 14.092 13.195 1.00 74.43 C ATOM 3066 C LYS B 82 5.414 14.199 12.555 1.00 73.45 C ATOM 3067 O LYS B 82 6.427 14.361 13.235 1.00 44.05 O ATOM 3068 CB LYS B 82 4.016 14.736 14.601 1.00 53.14 C ATOM 3069 CG LYS B 82 2.637 14.758 15.284 1.00 20.12 C ATOM 3070 CD LYS B 82 2.678 15.513 16.631 1.00 32.33 C ATOM 3071 CE LYS B 82 1.323 15.527 17.342 1.00 64.34 C ATOM 3072 NZ LYS B 82 1.360 16.371 18.564 1.00 64.33 N ATOM 0 H LYS B 82 3.703 12.252 14.163 1.00 42.21 H new ATOM 0 HA LYS B 82 3.314 14.641 12.574 1.00 74.43 H new ATOM 0 HB2 LYS B 82 4.715 14.195 15.238 1.00 53.14 H new ATOM 0 HB3 LYS B 82 4.385 15.759 14.521 1.00 53.14 H new ATOM 0 HG2 LYS B 82 1.911 15.232 14.623 1.00 20.12 H new ATOM 0 HG3 LYS B 82 2.297 13.736 15.450 1.00 20.12 H new ATOM 0 HD2 LYS B 82 3.420 15.048 17.281 1.00 32.33 H new ATOM 0 HD3 LYS B 82 3.004 16.539 16.458 1.00 32.33 H new ATOM 0 HE2 LYS B 82 0.558 15.902 16.662 1.00 64.34 H new ATOM 0 HE3 LYS B 82 1.040 14.509 17.610 1.00 64.34 H new ATOM 0 HZ1 LYS B 82 0.427 16.359 19.022 1.00 64.33 H new ATOM 0 HZ2 LYS B 82 2.074 15.998 19.222 1.00 64.33 H new ATOM 0 HZ3 LYS B 82 1.606 17.348 18.304 1.00 64.33 H new ATOM 3086 N VAL B 83 5.447 14.056 11.239 1.00 31.22 N ATOM 3087 CA VAL B 83 6.662 14.213 10.419 1.00 12.23 C ATOM 3088 C VAL B 83 6.399 15.282 9.343 1.00 21.44 C ATOM 3089 O VAL B 83 5.266 15.776 9.227 1.00 21.33 O ATOM 3090 CB VAL B 83 7.075 12.839 9.761 1.00 43.14 C ATOM 3091 CG1 VAL B 83 7.599 11.832 10.819 1.00 12.41 C ATOM 3092 CG2 VAL B 83 5.904 12.229 8.954 1.00 54.32 C ATOM 0 H VAL B 83 4.619 13.823 10.690 1.00 31.22 H new ATOM 0 HA VAL B 83 7.491 14.532 11.051 1.00 12.23 H new ATOM 0 HB VAL B 83 7.891 13.046 9.069 1.00 43.14 H new ATOM 0 HG11 VAL B 83 7.873 10.898 10.328 1.00 12.41 H new ATOM 0 HG12 VAL B 83 8.473 12.250 11.318 1.00 12.41 H new ATOM 0 HG13 VAL B 83 6.819 11.639 11.555 1.00 12.41 H new ATOM 0 HG21 VAL B 83 6.220 11.283 8.513 1.00 54.32 H new ATOM 0 HG22 VAL B 83 5.057 12.055 9.617 1.00 54.32 H new ATOM 0 HG23 VAL B 83 5.610 12.918 8.162 1.00 54.32 H new ATOM 3102 N ASP B 84 7.437 15.651 8.566 1.00 13.23 N ATOM 3103 CA ASP B 84 7.284 16.587 7.424 1.00 54.11 C ATOM 3104 C ASP B 84 6.414 15.940 6.338 1.00 64.42 C ATOM 3105 O ASP B 84 6.292 14.718 6.300 1.00 24.50 O ATOM 3106 CB ASP B 84 8.661 16.975 6.826 1.00 71.22 C ATOM 3107 CG ASP B 84 9.625 17.571 7.863 1.00 10.24 C ATOM 3108 OD1 ASP B 84 9.643 18.806 8.046 1.00 73.30 O ATOM 3109 OD2 ASP B 84 10.361 16.803 8.516 1.00 4.44 O ATOM 0 H ASP B 84 8.391 15.318 8.705 1.00 13.23 H new ATOM 0 HA ASP B 84 6.804 17.494 7.791 1.00 54.11 H new ATOM 0 HB2 ASP B 84 9.118 16.092 6.380 1.00 71.22 H new ATOM 0 HB3 ASP B 84 8.511 17.696 6.023 1.00 71.22 H new ATOM 3114 N GLN B 85 5.801 16.758 5.473 1.00 74.15 N ATOM 3115 CA GLN B 85 4.944 16.257 4.378 1.00 1.13 C ATOM 3116 C GLN B 85 5.736 15.355 3.368 1.00 54.32 C ATOM 3117 O GLN B 85 5.197 14.315 2.956 1.00 44.40 O ATOM 3118 CB GLN B 85 4.210 17.420 3.653 1.00 60.45 C ATOM 3119 CG GLN B 85 3.167 16.985 2.598 1.00 55.14 C ATOM 3120 CD GLN B 85 2.040 16.123 3.185 1.00 33.13 C ATOM 3121 OE1 GLN B 85 1.020 16.638 3.644 1.00 62.00 O ATOM 3122 NE2 GLN B 85 2.206 14.811 3.161 1.00 72.44 N ATOM 0 H GLN B 85 5.880 17.774 5.506 1.00 74.15 H new ATOM 0 HA GLN B 85 4.185 15.623 4.836 1.00 1.13 H new ATOM 0 HB2 GLN B 85 3.711 18.036 4.401 1.00 60.45 H new ATOM 0 HB3 GLN B 85 4.954 18.050 3.166 1.00 60.45 H new ATOM 0 HG2 GLN B 85 2.734 17.872 2.136 1.00 55.14 H new ATOM 0 HG3 GLN B 85 3.669 16.427 1.808 1.00 55.14 H new ATOM 0 HE21 GLN B 85 3.062 14.412 2.775 1.00 72.44 H new ATOM 0 HE22 GLN B 85 1.478 14.198 3.529 1.00 72.44 H new ATOM 3131 N PRO B 86 7.011 15.719 2.932 1.00 44.41 N ATOM 3132 CA PRO B 86 7.873 14.785 2.162 1.00 64.04 C ATOM 3133 C PRO B 86 8.171 13.489 2.942 1.00 24.02 C ATOM 3134 O PRO B 86 8.072 12.401 2.388 1.00 24.40 O ATOM 3135 CB PRO B 86 9.173 15.608 1.894 1.00 33.55 C ATOM 3136 CG PRO B 86 9.138 16.722 2.895 1.00 74.21 C ATOM 3137 CD PRO B 86 7.676 17.055 3.068 1.00 20.14 C ATOM 0 HA PRO B 86 7.393 14.446 1.244 1.00 64.04 H new ATOM 0 HB2 PRO B 86 10.063 14.992 2.020 1.00 33.55 H new ATOM 0 HB3 PRO B 86 9.193 15.993 0.875 1.00 33.55 H new ATOM 0 HG2 PRO B 86 9.586 16.416 3.840 1.00 74.21 H new ATOM 0 HG3 PRO B 86 9.699 17.587 2.541 1.00 74.21 H new ATOM 0 HD2 PRO B 86 7.477 17.509 4.039 1.00 20.14 H new ATOM 0 HD3 PRO B 86 7.329 17.758 2.311 1.00 20.14 H new ATOM 3145 N THR B 87 8.496 13.642 4.243 1.00 54.12 N ATOM 3146 CA THR B 87 8.849 12.528 5.140 1.00 33.13 C ATOM 3147 C THR B 87 7.639 11.589 5.376 1.00 63.23 C ATOM 3148 O THR B 87 7.804 10.391 5.604 1.00 35.30 O ATOM 3149 CB THR B 87 9.382 13.086 6.497 1.00 54.53 C ATOM 3150 OG1 THR B 87 10.363 14.106 6.240 1.00 13.34 O ATOM 3151 CG2 THR B 87 10.002 11.986 7.385 1.00 1.31 C ATOM 0 H THR B 87 8.520 14.553 4.702 1.00 54.12 H new ATOM 0 HA THR B 87 9.634 11.941 4.663 1.00 33.13 H new ATOM 0 HB THR B 87 8.531 13.500 7.039 1.00 54.53 H new ATOM 0 HG1 THR B 87 10.698 14.459 7.090 1.00 13.34 H new ATOM 0 HG21 THR B 87 10.357 12.427 8.316 1.00 1.31 H new ATOM 0 HG22 THR B 87 9.249 11.229 7.606 1.00 1.31 H new ATOM 0 HG23 THR B 87 10.838 11.524 6.861 1.00 1.31 H new ATOM 3159 N LEU B 88 6.428 12.168 5.308 1.00 14.44 N ATOM 3160 CA LEU B 88 5.158 11.446 5.469 1.00 15.54 C ATOM 3161 C LEU B 88 4.974 10.498 4.277 1.00 1.53 C ATOM 3162 O LEU B 88 4.607 9.331 4.448 1.00 54.41 O ATOM 3163 CB LEU B 88 3.991 12.479 5.597 1.00 2.53 C ATOM 3164 CG LEU B 88 2.613 11.972 6.165 1.00 2.13 C ATOM 3165 CD1 LEU B 88 1.752 13.156 6.656 1.00 73.44 C ATOM 3166 CD2 LEU B 88 1.816 11.138 5.137 1.00 23.24 C ATOM 0 H LEU B 88 6.304 13.166 5.137 1.00 14.44 H new ATOM 0 HA LEU B 88 5.160 10.843 6.377 1.00 15.54 H new ATOM 0 HB2 LEU B 88 4.335 13.294 6.234 1.00 2.53 H new ATOM 0 HB3 LEU B 88 3.809 12.902 4.609 1.00 2.53 H new ATOM 0 HG LEU B 88 2.848 11.320 7.006 1.00 2.13 H new ATOM 0 HD11 LEU B 88 0.805 12.781 7.044 1.00 73.44 H new ATOM 0 HD12 LEU B 88 2.282 13.689 7.446 1.00 73.44 H new ATOM 0 HD13 LEU B 88 1.560 13.835 5.826 1.00 73.44 H new ATOM 0 HD21 LEU B 88 0.875 10.815 5.582 1.00 23.24 H new ATOM 0 HD22 LEU B 88 1.611 11.746 4.256 1.00 23.24 H new ATOM 0 HD23 LEU B 88 2.399 10.264 4.847 1.00 23.24 H new ATOM 3178 N PHE B 89 5.243 11.025 3.066 1.00 45.41 N ATOM 3179 CA PHE B 89 5.203 10.238 1.829 1.00 51.44 C ATOM 3180 C PHE B 89 6.341 9.209 1.792 1.00 65.13 C ATOM 3181 O PHE B 89 6.170 8.156 1.209 1.00 64.44 O ATOM 3182 CB PHE B 89 5.211 11.158 0.577 1.00 54.03 C ATOM 3183 CG PHE B 89 3.943 12.012 0.390 1.00 5.21 C ATOM 3184 CD1 PHE B 89 2.762 11.754 1.105 1.00 5.32 C ATOM 3185 CD2 PHE B 89 3.929 13.073 -0.517 1.00 43.04 C ATOM 3186 CE1 PHE B 89 1.636 12.525 0.919 1.00 74.23 C ATOM 3187 CE2 PHE B 89 2.799 13.840 -0.696 1.00 3.44 C ATOM 3188 CZ PHE B 89 1.654 13.569 0.019 1.00 55.14 C ATOM 0 H PHE B 89 5.492 12.004 2.924 1.00 45.41 H new ATOM 0 HA PHE B 89 4.265 9.683 1.813 1.00 51.44 H new ATOM 0 HB2 PHE B 89 6.073 11.822 0.638 1.00 54.03 H new ATOM 0 HB3 PHE B 89 5.348 10.539 -0.310 1.00 54.03 H new ATOM 0 HD1 PHE B 89 2.736 10.938 1.812 1.00 5.32 H new ATOM 0 HD2 PHE B 89 4.818 13.296 -1.088 1.00 43.04 H new ATOM 0 HE1 PHE B 89 0.738 12.311 1.479 1.00 74.23 H new ATOM 0 HE2 PHE B 89 2.811 14.658 -1.401 1.00 3.44 H new ATOM 0 HZ PHE B 89 0.771 14.174 -0.125 1.00 55.14 H new ATOM 3198 N GLU B 90 7.487 9.523 2.431 1.00 21.33 N ATOM 3199 CA GLU B 90 8.609 8.568 2.584 1.00 64.41 C ATOM 3200 C GLU B 90 8.177 7.333 3.400 1.00 3.45 C ATOM 3201 O GLU B 90 8.573 6.213 3.076 1.00 51.11 O ATOM 3202 CB GLU B 90 9.823 9.248 3.266 1.00 1.33 C ATOM 3203 CG GLU B 90 10.566 10.285 2.405 1.00 55.34 C ATOM 3204 CD GLU B 90 11.250 9.671 1.170 1.00 31.15 C ATOM 3205 OE1 GLU B 90 12.300 9.014 1.332 1.00 72.24 O ATOM 3206 OE2 GLU B 90 10.748 9.838 0.035 1.00 2.33 O ATOM 0 H GLU B 90 7.662 10.435 2.852 1.00 21.33 H new ATOM 0 HA GLU B 90 8.902 8.242 1.586 1.00 64.41 H new ATOM 0 HB2 GLU B 90 9.480 9.736 4.178 1.00 1.33 H new ATOM 0 HB3 GLU B 90 10.531 8.475 3.565 1.00 1.33 H new ATOM 0 HG2 GLU B 90 9.860 11.049 2.079 1.00 55.34 H new ATOM 0 HG3 GLU B 90 11.317 10.785 3.017 1.00 55.34 H new ATOM 3213 N LEU B 91 7.376 7.564 4.465 1.00 43.33 N ATOM 3214 CA LEU B 91 6.808 6.478 5.286 1.00 10.32 C ATOM 3215 C LEU B 91 5.810 5.638 4.451 1.00 62.35 C ATOM 3216 O LEU B 91 5.829 4.404 4.513 1.00 25.13 O ATOM 3217 CB LEU B 91 6.122 7.051 6.562 1.00 64.22 C ATOM 3218 CG LEU B 91 7.044 7.814 7.574 1.00 72.15 C ATOM 3219 CD1 LEU B 91 6.222 8.403 8.742 1.00 10.01 C ATOM 3220 CD2 LEU B 91 8.178 6.909 8.100 1.00 44.42 C ATOM 0 H LEU B 91 7.109 8.499 4.774 1.00 43.33 H new ATOM 0 HA LEU B 91 7.620 5.826 5.607 1.00 10.32 H new ATOM 0 HB2 LEU B 91 5.329 7.729 6.247 1.00 64.22 H new ATOM 0 HB3 LEU B 91 5.645 6.226 7.091 1.00 64.22 H new ATOM 0 HG LEU B 91 7.505 8.641 7.035 1.00 72.15 H new ATOM 0 HD11 LEU B 91 6.888 8.926 9.428 1.00 10.01 H new ATOM 0 HD12 LEU B 91 5.482 9.101 8.351 1.00 10.01 H new ATOM 0 HD13 LEU B 91 5.715 7.597 9.273 1.00 10.01 H new ATOM 0 HD21 LEU B 91 8.797 7.471 8.799 1.00 44.42 H new ATOM 0 HD22 LEU B 91 7.748 6.046 8.609 1.00 44.42 H new ATOM 0 HD23 LEU B 91 8.790 6.570 7.264 1.00 44.42 H new ATOM 3232 N ILE B 92 4.964 6.333 3.651 1.00 51.01 N ATOM 3233 CA ILE B 92 4.008 5.694 2.718 1.00 34.25 C ATOM 3234 C ILE B 92 4.756 4.829 1.677 1.00 43.33 C ATOM 3235 O ILE B 92 4.344 3.704 1.399 1.00 11.44 O ATOM 3236 CB ILE B 92 3.105 6.775 1.981 1.00 33.13 C ATOM 3237 CG1 ILE B 92 2.195 7.532 3.006 1.00 4.34 C ATOM 3238 CG2 ILE B 92 2.256 6.153 0.840 1.00 14.14 C ATOM 3239 CD1 ILE B 92 1.257 8.575 2.404 1.00 42.05 C ATOM 0 H ILE B 92 4.927 7.352 3.636 1.00 51.01 H new ATOM 0 HA ILE B 92 3.355 5.051 3.308 1.00 34.25 H new ATOM 0 HB ILE B 92 3.780 7.495 1.519 1.00 33.13 H new ATOM 0 HG12 ILE B 92 1.596 6.798 3.546 1.00 4.34 H new ATOM 0 HG13 ILE B 92 2.834 8.023 3.740 1.00 4.34 H new ATOM 0 HG21 ILE B 92 1.656 6.931 0.367 1.00 14.14 H new ATOM 0 HG22 ILE B 92 2.917 5.703 0.099 1.00 14.14 H new ATOM 0 HG23 ILE B 92 1.598 5.388 1.252 1.00 14.14 H new ATOM 0 HD11 ILE B 92 0.672 9.040 3.198 1.00 42.05 H new ATOM 0 HD12 ILE B 92 1.842 9.338 1.890 1.00 42.05 H new ATOM 0 HD13 ILE B 92 0.585 8.093 1.693 1.00 42.05 H new ATOM 3251 N LEU B 93 5.879 5.362 1.154 1.00 10.03 N ATOM 3252 CA LEU B 93 6.697 4.696 0.117 1.00 22.53 C ATOM 3253 C LEU B 93 7.498 3.523 0.708 1.00 42.13 C ATOM 3254 O LEU B 93 7.806 2.569 -0.008 1.00 24.45 O ATOM 3255 CB LEU B 93 7.650 5.712 -0.574 1.00 75.20 C ATOM 3256 CG LEU B 93 6.962 6.804 -1.456 1.00 30.24 C ATOM 3257 CD1 LEU B 93 7.980 7.858 -1.924 1.00 53.55 C ATOM 3258 CD2 LEU B 93 6.208 6.176 -2.651 1.00 21.11 C ATOM 0 H LEU B 93 6.246 6.270 1.439 1.00 10.03 H new ATOM 0 HA LEU B 93 6.016 4.296 -0.634 1.00 22.53 H new ATOM 0 HB2 LEU B 93 8.237 6.212 0.197 1.00 75.20 H new ATOM 0 HB3 LEU B 93 8.350 5.157 -1.198 1.00 75.20 H new ATOM 0 HG LEU B 93 6.221 7.310 -0.837 1.00 30.24 H new ATOM 0 HD11 LEU B 93 7.475 8.605 -2.536 1.00 53.55 H new ATOM 0 HD12 LEU B 93 8.428 8.342 -1.056 1.00 53.55 H new ATOM 0 HD13 LEU B 93 8.760 7.375 -2.513 1.00 53.55 H new ATOM 0 HD21 LEU B 93 5.742 6.964 -3.242 1.00 21.11 H new ATOM 0 HD22 LEU B 93 6.910 5.622 -3.274 1.00 21.11 H new ATOM 0 HD23 LEU B 93 5.439 5.498 -2.280 1.00 21.11 H new ATOM 3270 N ALA B 94 7.821 3.606 2.013 1.00 32.22 N ATOM 3271 CA ALA B 94 8.503 2.522 2.737 1.00 52.13 C ATOM 3272 C ALA B 94 7.553 1.332 2.904 1.00 75.44 C ATOM 3273 O ALA B 94 7.928 0.195 2.645 1.00 73.41 O ATOM 3274 CB ALA B 94 9.005 3.017 4.099 1.00 12.31 C ATOM 0 H ALA B 94 7.617 4.422 2.590 1.00 32.22 H new ATOM 0 HA ALA B 94 9.369 2.198 2.159 1.00 52.13 H new ATOM 0 HB1 ALA B 94 9.507 2.202 4.620 1.00 12.31 H new ATOM 0 HB2 ALA B 94 9.706 3.839 3.952 1.00 12.31 H new ATOM 0 HB3 ALA B 94 8.160 3.363 4.695 1.00 12.31 H new ATOM 3280 N ALA B 95 6.308 1.626 3.309 1.00 25.31 N ATOM 3281 CA ALA B 95 5.241 0.619 3.469 1.00 71.21 C ATOM 3282 C ALA B 95 4.764 0.081 2.104 1.00 43.02 C ATOM 3283 O ALA B 95 4.265 -1.037 2.020 1.00 51.44 O ATOM 3284 CB ALA B 95 4.073 1.213 4.252 1.00 31.14 C ATOM 0 H ALA B 95 6.009 2.574 3.537 1.00 25.31 H new ATOM 0 HA ALA B 95 5.650 -0.222 4.028 1.00 71.21 H new ATOM 0 HB1 ALA B 95 3.291 0.462 4.365 1.00 31.14 H new ATOM 0 HB2 ALA B 95 4.418 1.528 5.237 1.00 31.14 H new ATOM 0 HB3 ALA B 95 3.675 2.074 3.714 1.00 31.14 H new ATOM 3290 N ASN B 96 4.889 0.922 1.068 1.00 11.22 N ATOM 3291 CA ASN B 96 4.567 0.577 -0.338 1.00 42.12 C ATOM 3292 C ASN B 96 5.614 -0.433 -0.874 1.00 5.14 C ATOM 3293 O ASN B 96 5.272 -1.400 -1.564 1.00 14.33 O ATOM 3294 CB ASN B 96 4.569 1.898 -1.177 1.00 23.34 C ATOM 3295 CG ASN B 96 3.990 1.818 -2.598 1.00 54.41 C ATOM 3296 OD1 ASN B 96 3.979 0.779 -3.245 1.00 4.30 O ATOM 3297 ND2 ASN B 96 3.517 2.952 -3.100 1.00 62.52 N ATOM 0 H ASN B 96 5.222 1.880 1.178 1.00 11.22 H new ATOM 0 HA ASN B 96 3.585 0.110 -0.411 1.00 42.12 H new ATOM 0 HB2 ASN B 96 4.009 2.652 -0.624 1.00 23.34 H new ATOM 0 HB3 ASN B 96 5.597 2.253 -1.249 1.00 23.34 H new ATOM 0 HD21 ASN B 96 3.133 2.971 -4.045 1.00 62.52 H new ATOM 0 HD22 ASN B 96 3.537 3.805 -2.541 1.00 62.52 H new ATOM 3304 N TYR B 97 6.889 -0.174 -0.525 1.00 21.31 N ATOM 3305 CA TYR B 97 8.048 -1.017 -0.901 1.00 3.43 C ATOM 3306 C TYR B 97 8.097 -2.319 -0.074 1.00 71.21 C ATOM 3307 O TYR B 97 8.514 -3.358 -0.582 1.00 14.41 O ATOM 3308 CB TYR B 97 9.365 -0.191 -0.715 1.00 62.20 C ATOM 3309 CG TYR B 97 10.689 -0.980 -0.817 1.00 72.44 C ATOM 3310 CD1 TYR B 97 11.567 -1.068 0.273 1.00 21.04 C ATOM 3311 CD2 TYR B 97 11.061 -1.633 -1.999 1.00 21.45 C ATOM 3312 CE1 TYR B 97 12.753 -1.774 0.191 1.00 23.25 C ATOM 3313 CE2 TYR B 97 12.249 -2.343 -2.083 1.00 5.14 C ATOM 3314 CZ TYR B 97 13.091 -2.411 -0.987 1.00 12.14 C ATOM 3315 OH TYR B 97 14.275 -3.112 -1.070 1.00 63.33 O ATOM 0 H TYR B 97 7.150 0.638 0.034 1.00 21.31 H new ATOM 0 HA TYR B 97 7.944 -1.308 -1.946 1.00 3.43 H new ATOM 0 HB2 TYR B 97 9.380 0.601 -1.464 1.00 62.20 H new ATOM 0 HB3 TYR B 97 9.330 0.293 0.261 1.00 62.20 H new ATOM 0 HD1 TYR B 97 11.311 -0.573 1.198 1.00 21.04 H new ATOM 0 HD2 TYR B 97 10.411 -1.583 -2.860 1.00 21.45 H new ATOM 0 HE1 TYR B 97 13.412 -1.827 1.045 1.00 23.25 H new ATOM 0 HE2 TYR B 97 12.517 -2.842 -3.002 1.00 5.14 H new ATOM 0 HH TYR B 97 14.363 -3.501 -1.965 1.00 63.33 H new ATOM 3325 N LEU B 98 7.686 -2.246 1.202 1.00 24.34 N ATOM 3326 CA LEU B 98 7.804 -3.378 2.155 1.00 24.52 C ATOM 3327 C LEU B 98 6.466 -4.131 2.346 1.00 45.15 C ATOM 3328 O LEU B 98 6.438 -5.166 3.038 1.00 43.41 O ATOM 3329 CB LEU B 98 8.349 -2.863 3.516 1.00 72.33 C ATOM 3330 CG LEU B 98 9.795 -2.273 3.499 1.00 4.55 C ATOM 3331 CD1 LEU B 98 10.210 -1.743 4.888 1.00 13.43 C ATOM 3332 CD2 LEU B 98 10.802 -3.306 2.970 1.00 64.01 C ATOM 0 H LEU B 98 7.264 -1.410 1.607 1.00 24.34 H new ATOM 0 HA LEU B 98 8.506 -4.097 1.732 1.00 24.52 H new ATOM 0 HB2 LEU B 98 7.670 -2.096 3.889 1.00 72.33 H new ATOM 0 HB3 LEU B 98 8.323 -3.687 4.230 1.00 72.33 H new ATOM 0 HG LEU B 98 9.797 -1.423 2.817 1.00 4.55 H new ATOM 0 HD11 LEU B 98 11.222 -1.341 4.836 1.00 13.43 H new ATOM 0 HD12 LEU B 98 9.522 -0.956 5.198 1.00 13.43 H new ATOM 0 HD13 LEU B 98 10.180 -2.557 5.612 1.00 13.43 H new ATOM 0 HD21 LEU B 98 11.802 -2.872 2.968 1.00 64.01 H new ATOM 0 HD22 LEU B 98 10.791 -4.187 3.612 1.00 64.01 H new ATOM 0 HD23 LEU B 98 10.529 -3.593 1.955 1.00 64.01 H new ATOM 3344 N ASP B 99 5.385 -3.612 1.719 1.00 62.01 N ATOM 3345 CA ASP B 99 4.005 -4.171 1.796 1.00 4.01 C ATOM 3346 C ASP B 99 3.499 -4.301 3.251 1.00 54.23 C ATOM 3347 O ASP B 99 2.669 -5.168 3.566 1.00 13.30 O ATOM 3348 CB ASP B 99 3.893 -5.527 1.043 1.00 34.44 C ATOM 3349 CG ASP B 99 3.992 -5.418 -0.482 1.00 33.51 C ATOM 3350 OD1 ASP B 99 3.313 -4.554 -1.065 1.00 74.01 O ATOM 3351 OD2 ASP B 99 4.711 -6.231 -1.119 1.00 45.05 O ATOM 0 H ASP B 99 5.443 -2.778 1.134 1.00 62.01 H new ATOM 0 HA ASP B 99 3.355 -3.453 1.295 1.00 4.01 H new ATOM 0 HB2 ASP B 99 4.680 -6.192 1.399 1.00 34.44 H new ATOM 0 HB3 ASP B 99 2.942 -5.993 1.300 1.00 34.44 H new ATOM 3356 N ILE B 100 3.984 -3.403 4.127 1.00 4.20 N ATOM 3357 CA ILE B 100 3.569 -3.367 5.538 1.00 21.04 C ATOM 3358 C ILE B 100 2.203 -2.679 5.644 1.00 42.51 C ATOM 3359 O ILE B 100 2.112 -1.445 5.666 1.00 12.32 O ATOM 3360 CB ILE B 100 4.639 -2.658 6.454 1.00 21.43 C ATOM 3361 CG1 ILE B 100 6.004 -3.398 6.332 1.00 75.52 C ATOM 3362 CG2 ILE B 100 4.166 -2.583 7.930 1.00 41.14 C ATOM 3363 CD1 ILE B 100 7.142 -2.824 7.163 1.00 23.33 C ATOM 0 H ILE B 100 4.668 -2.689 3.879 1.00 4.20 H new ATOM 0 HA ILE B 100 3.487 -4.392 5.900 1.00 21.04 H new ATOM 0 HB ILE B 100 4.764 -1.631 6.112 1.00 21.43 H new ATOM 0 HG12 ILE B 100 5.859 -4.440 6.619 1.00 75.52 H new ATOM 0 HG13 ILE B 100 6.306 -3.395 5.285 1.00 75.52 H new ATOM 0 HG21 ILE B 100 4.928 -2.088 8.532 1.00 41.14 H new ATOM 0 HG22 ILE B 100 3.236 -2.017 7.986 1.00 41.14 H new ATOM 0 HG23 ILE B 100 4.001 -3.591 8.311 1.00 41.14 H new ATOM 0 HD11 ILE B 100 8.044 -3.415 7.002 1.00 23.33 H new ATOM 0 HD12 ILE B 100 7.326 -1.792 6.864 1.00 23.33 H new ATOM 0 HD13 ILE B 100 6.872 -2.853 8.219 1.00 23.33 H new ATOM 3375 N LYS B 101 1.149 -3.509 5.645 1.00 50.23 N ATOM 3376 CA LYS B 101 -0.246 -3.067 5.757 1.00 50.52 C ATOM 3377 C LYS B 101 -0.515 -2.217 7.039 1.00 63.54 C ATOM 3378 O LYS B 101 -1.240 -1.239 6.920 1.00 63.14 O ATOM 3379 CB LYS B 101 -1.214 -4.279 5.677 1.00 10.32 C ATOM 3380 CG LYS B 101 -1.189 -5.032 4.325 1.00 63.41 C ATOM 3381 CD LYS B 101 -2.136 -6.255 4.290 1.00 5.25 C ATOM 3382 CE LYS B 101 -3.597 -5.899 4.634 1.00 22.25 C ATOM 3383 NZ LYS B 101 -4.151 -4.841 3.747 1.00 72.41 N ATOM 0 H LYS B 101 1.245 -4.521 5.567 1.00 50.23 H new ATOM 0 HA LYS B 101 -0.436 -2.410 4.909 1.00 50.52 H new ATOM 0 HB2 LYS B 101 -0.965 -4.980 6.474 1.00 10.32 H new ATOM 0 HB3 LYS B 101 -2.229 -3.930 5.865 1.00 10.32 H new ATOM 0 HG2 LYS B 101 -1.467 -4.343 3.528 1.00 63.41 H new ATOM 0 HG3 LYS B 101 -0.171 -5.363 4.120 1.00 63.41 H new ATOM 0 HD2 LYS B 101 -2.102 -6.705 3.298 1.00 5.25 H new ATOM 0 HD3 LYS B 101 -1.776 -7.006 4.993 1.00 5.25 H new ATOM 0 HE2 LYS B 101 -4.214 -6.794 4.555 1.00 22.25 H new ATOM 0 HE3 LYS B 101 -3.652 -5.565 5.670 1.00 22.25 H new ATOM 0 HZ1 LYS B 101 -5.142 -5.062 3.520 1.00 72.41 H new ATOM 0 HZ2 LYS B 101 -4.103 -3.922 4.231 1.00 72.41 H new ATOM 0 HZ3 LYS B 101 -3.596 -4.799 2.869 1.00 72.41 H new ATOM 3397 N PRO B 102 0.015 -2.579 8.284 1.00 35.30 N ATOM 3398 CA PRO B 102 -0.105 -1.710 9.494 1.00 25.33 C ATOM 3399 C PRO B 102 0.309 -0.240 9.254 1.00 23.03 C ATOM 3400 O PRO B 102 -0.461 0.681 9.528 1.00 53.40 O ATOM 3401 CB PRO B 102 0.835 -2.398 10.515 1.00 31.33 C ATOM 3402 CG PRO B 102 0.779 -3.849 10.148 1.00 41.52 C ATOM 3403 CD PRO B 102 0.673 -3.880 8.638 1.00 32.44 C ATOM 0 HA PRO B 102 -1.140 -1.629 9.825 1.00 25.33 H new ATOM 0 HB2 PRO B 102 1.851 -2.009 10.446 1.00 31.33 H new ATOM 0 HB3 PRO B 102 0.499 -2.233 11.539 1.00 31.33 H new ATOM 0 HG2 PRO B 102 1.670 -4.375 10.490 1.00 41.52 H new ATOM 0 HG3 PRO B 102 -0.077 -4.338 10.612 1.00 41.52 H new ATOM 0 HD2 PRO B 102 1.655 -3.969 8.172 1.00 32.44 H new ATOM 0 HD3 PRO B 102 0.081 -4.730 8.298 1.00 32.44 H new ATOM 3411 N LEU B 103 1.512 -0.049 8.695 1.00 25.45 N ATOM 3412 CA LEU B 103 2.112 1.287 8.507 1.00 54.35 C ATOM 3413 C LEU B 103 1.416 2.016 7.343 1.00 24.53 C ATOM 3414 O LEU B 103 1.145 3.213 7.434 1.00 72.30 O ATOM 3415 CB LEU B 103 3.657 1.140 8.272 1.00 4.53 C ATOM 3416 CG LEU B 103 4.563 2.418 8.455 1.00 30.11 C ATOM 3417 CD1 LEU B 103 4.521 3.395 7.263 1.00 63.50 C ATOM 3418 CD2 LEU B 103 4.217 3.143 9.762 1.00 52.32 C ATOM 0 H LEU B 103 2.099 -0.813 8.360 1.00 25.45 H new ATOM 0 HA LEU B 103 1.967 1.891 9.403 1.00 54.35 H new ATOM 0 HB2 LEU B 103 4.025 0.371 8.951 1.00 4.53 H new ATOM 0 HB3 LEU B 103 3.806 0.769 7.258 1.00 4.53 H new ATOM 0 HG LEU B 103 5.588 2.051 8.501 1.00 30.11 H new ATOM 0 HD11 LEU B 103 5.170 4.246 7.467 1.00 63.50 H new ATOM 0 HD12 LEU B 103 4.864 2.885 6.363 1.00 63.50 H new ATOM 0 HD13 LEU B 103 3.499 3.745 7.115 1.00 63.50 H new ATOM 0 HD21 LEU B 103 4.853 4.022 9.870 1.00 52.32 H new ATOM 0 HD22 LEU B 103 3.172 3.452 9.741 1.00 52.32 H new ATOM 0 HD23 LEU B 103 4.380 2.471 10.605 1.00 52.32 H new ATOM 3430 N LEU B 104 1.126 1.267 6.261 1.00 75.24 N ATOM 3431 CA LEU B 104 0.480 1.799 5.042 1.00 23.00 C ATOM 3432 C LEU B 104 -0.913 2.352 5.369 1.00 42.21 C ATOM 3433 O LEU B 104 -1.259 3.474 4.970 1.00 24.02 O ATOM 3434 CB LEU B 104 0.362 0.680 3.973 1.00 53.21 C ATOM 3435 CG LEU B 104 -0.226 1.104 2.589 1.00 5.23 C ATOM 3436 CD1 LEU B 104 0.739 2.048 1.840 1.00 35.41 C ATOM 3437 CD2 LEU B 104 -0.587 -0.139 1.748 1.00 21.40 C ATOM 0 H LEU B 104 1.334 0.270 6.207 1.00 75.24 H new ATOM 0 HA LEU B 104 1.095 2.609 4.650 1.00 23.00 H new ATOM 0 HB2 LEU B 104 1.353 0.258 3.809 1.00 53.21 H new ATOM 0 HB3 LEU B 104 -0.260 -0.117 4.379 1.00 53.21 H new ATOM 0 HG LEU B 104 -1.146 1.662 2.762 1.00 5.23 H new ATOM 0 HD11 LEU B 104 0.304 2.327 0.880 1.00 35.41 H new ATOM 0 HD12 LEU B 104 0.907 2.945 2.436 1.00 35.41 H new ATOM 0 HD13 LEU B 104 1.689 1.540 1.674 1.00 35.41 H new ATOM 0 HD21 LEU B 104 -0.995 0.177 0.788 1.00 21.40 H new ATOM 0 HD22 LEU B 104 0.308 -0.739 1.582 1.00 21.40 H new ATOM 0 HD23 LEU B 104 -1.329 -0.735 2.279 1.00 21.40 H new ATOM 3449 N ASP B 105 -1.686 1.540 6.118 1.00 42.14 N ATOM 3450 CA ASP B 105 -3.066 1.857 6.510 1.00 43.12 C ATOM 3451 C ASP B 105 -3.115 3.158 7.308 1.00 22.30 C ATOM 3452 O ASP B 105 -3.810 4.087 6.921 1.00 64.05 O ATOM 3453 CB ASP B 105 -3.665 0.687 7.331 1.00 62.11 C ATOM 3454 CG ASP B 105 -5.102 0.940 7.824 1.00 70.12 C ATOM 3455 OD1 ASP B 105 -6.055 0.723 7.040 1.00 3.13 O ATOM 3456 OD2 ASP B 105 -5.287 1.355 8.994 1.00 24.22 O ATOM 0 H ASP B 105 -1.363 0.638 6.469 1.00 42.14 H new ATOM 0 HA ASP B 105 -3.663 1.993 5.609 1.00 43.12 H new ATOM 0 HB2 ASP B 105 -3.655 -0.215 6.719 1.00 62.11 H new ATOM 0 HB3 ASP B 105 -3.025 0.495 8.192 1.00 62.11 H new ATOM 3461 N VAL B 106 -2.290 3.228 8.360 1.00 40.03 N ATOM 3462 CA VAL B 106 -2.286 4.344 9.317 1.00 25.43 C ATOM 3463 C VAL B 106 -1.777 5.659 8.683 1.00 51.12 C ATOM 3464 O VAL B 106 -2.468 6.672 8.756 1.00 3.20 O ATOM 3465 CB VAL B 106 -1.435 3.948 10.581 1.00 75.15 C ATOM 3466 CG1 VAL B 106 -1.220 5.134 11.551 1.00 11.30 C ATOM 3467 CG2 VAL B 106 -2.095 2.752 11.316 1.00 3.43 C ATOM 0 H VAL B 106 -1.601 2.507 8.574 1.00 40.03 H new ATOM 0 HA VAL B 106 -3.315 4.534 9.623 1.00 25.43 H new ATOM 0 HB VAL B 106 -0.448 3.653 10.225 1.00 75.15 H new ATOM 0 HG11 VAL B 106 -0.627 4.804 12.404 1.00 11.30 H new ATOM 0 HG12 VAL B 106 -0.695 5.937 11.033 1.00 11.30 H new ATOM 0 HG13 VAL B 106 -2.186 5.498 11.900 1.00 11.30 H new ATOM 0 HG21 VAL B 106 -1.498 2.487 12.188 1.00 3.43 H new ATOM 0 HG22 VAL B 106 -3.100 3.030 11.635 1.00 3.43 H new ATOM 0 HG23 VAL B 106 -2.152 1.897 10.642 1.00 3.43 H new ATOM 3477 N THR B 107 -0.601 5.616 8.026 1.00 25.51 N ATOM 3478 CA THR B 107 0.086 6.834 7.526 1.00 23.44 C ATOM 3479 C THR B 107 -0.686 7.501 6.354 1.00 22.53 C ATOM 3480 O THR B 107 -0.800 8.739 6.300 1.00 2.43 O ATOM 3481 CB THR B 107 1.562 6.503 7.115 1.00 25.10 C ATOM 3482 OG1 THR B 107 2.226 5.853 8.215 1.00 13.41 O ATOM 3483 CG2 THR B 107 2.366 7.756 6.723 1.00 64.34 C ATOM 0 H THR B 107 -0.102 4.749 7.826 1.00 25.51 H new ATOM 0 HA THR B 107 0.107 7.557 8.342 1.00 23.44 H new ATOM 0 HB THR B 107 1.515 5.853 6.241 1.00 25.10 H new ATOM 0 HG1 THR B 107 2.024 4.894 8.199 1.00 13.41 H new ATOM 0 HG21 THR B 107 3.380 7.466 6.448 1.00 64.34 H new ATOM 0 HG22 THR B 107 1.886 8.246 5.876 1.00 64.34 H new ATOM 0 HG23 THR B 107 2.402 8.444 7.567 1.00 64.34 H new ATOM 3491 N CYS B 108 -1.238 6.674 5.441 1.00 22.43 N ATOM 3492 CA CYS B 108 -2.059 7.168 4.310 1.00 64.32 C ATOM 3493 C CYS B 108 -3.430 7.688 4.805 1.00 14.32 C ATOM 3494 O CYS B 108 -4.019 8.594 4.207 1.00 61.41 O ATOM 3495 CB CYS B 108 -2.260 6.057 3.260 1.00 23.32 C ATOM 3496 SG CYS B 108 -0.722 5.403 2.569 1.00 62.03 S ATOM 0 H CYS B 108 -1.131 5.660 5.463 1.00 22.43 H new ATOM 0 HA CYS B 108 -1.525 7.997 3.846 1.00 64.32 H new ATOM 0 HB2 CYS B 108 -2.817 5.239 3.716 1.00 23.32 H new ATOM 0 HB3 CYS B 108 -2.873 6.447 2.448 1.00 23.32 H new ATOM 0 HG CYS B 108 -0.247 4.486 3.359 1.00 62.03 H new ATOM 3502 N LYS B 109 -3.930 7.084 5.896 1.00 61.21 N ATOM 3503 CA LYS B 109 -5.198 7.475 6.534 1.00 71.12 C ATOM 3504 C LYS B 109 -5.026 8.785 7.319 1.00 35.25 C ATOM 3505 O LYS B 109 -5.957 9.568 7.408 1.00 1.54 O ATOM 3506 CB LYS B 109 -5.668 6.330 7.453 1.00 63.44 C ATOM 3507 CG LYS B 109 -7.098 6.435 8.033 1.00 63.01 C ATOM 3508 CD LYS B 109 -7.525 5.110 8.724 1.00 30.00 C ATOM 3509 CE LYS B 109 -7.546 3.916 7.744 1.00 5.24 C ATOM 3510 NZ LYS B 109 -7.827 2.629 8.427 1.00 14.11 N ATOM 0 H LYS B 109 -3.463 6.306 6.363 1.00 61.21 H new ATOM 0 HA LYS B 109 -5.956 7.652 5.770 1.00 71.12 H new ATOM 0 HB2 LYS B 109 -5.597 5.397 6.894 1.00 63.44 H new ATOM 0 HB3 LYS B 109 -4.969 6.256 8.286 1.00 63.44 H new ATOM 0 HG2 LYS B 109 -7.142 7.253 8.752 1.00 63.01 H new ATOM 0 HG3 LYS B 109 -7.800 6.674 7.234 1.00 63.01 H new ATOM 0 HD2 LYS B 109 -6.839 4.893 9.543 1.00 30.00 H new ATOM 0 HD3 LYS B 109 -8.515 5.234 9.162 1.00 30.00 H new ATOM 0 HE2 LYS B 109 -8.302 4.091 6.979 1.00 5.24 H new ATOM 0 HE3 LYS B 109 -6.585 3.851 7.234 1.00 5.24 H new ATOM 0 HZ1 LYS B 109 -8.147 1.928 7.729 1.00 14.11 H new ATOM 0 HZ2 LYS B 109 -6.962 2.286 8.891 1.00 14.11 H new ATOM 0 HZ3 LYS B 109 -8.570 2.770 9.141 1.00 14.11 H new ATOM 3524 N THR B 110 -3.813 9.005 7.871 1.00 4.21 N ATOM 3525 CA THR B 110 -3.478 10.214 8.637 1.00 51.43 C ATOM 3526 C THR B 110 -3.420 11.443 7.713 1.00 61.53 C ATOM 3527 O THR B 110 -4.006 12.479 8.033 1.00 24.44 O ATOM 3528 CB THR B 110 -2.126 10.046 9.416 1.00 51.52 C ATOM 3529 OG1 THR B 110 -2.242 8.962 10.359 1.00 52.31 O ATOM 3530 CG2 THR B 110 -1.706 11.329 10.166 1.00 32.24 C ATOM 0 H THR B 110 -3.040 8.344 7.795 1.00 4.21 H new ATOM 0 HA THR B 110 -4.268 10.368 9.372 1.00 51.43 H new ATOM 0 HB THR B 110 -1.355 9.832 8.676 1.00 51.52 H new ATOM 0 HG1 THR B 110 -2.312 8.113 9.875 1.00 52.31 H new ATOM 0 HG21 THR B 110 -0.764 11.154 10.687 1.00 32.24 H new ATOM 0 HG22 THR B 110 -1.580 12.143 9.452 1.00 32.24 H new ATOM 0 HG23 THR B 110 -2.476 11.596 10.889 1.00 32.24 H new ATOM 3538 N VAL B 111 -2.741 11.310 6.548 1.00 3.23 N ATOM 3539 CA VAL B 111 -2.648 12.408 5.556 1.00 60.43 C ATOM 3540 C VAL B 111 -4.051 12.741 4.999 1.00 33.31 C ATOM 3541 O VAL B 111 -4.349 13.900 4.676 1.00 34.41 O ATOM 3542 CB VAL B 111 -1.618 12.094 4.399 1.00 23.41 C ATOM 3543 CG1 VAL B 111 -2.137 11.059 3.380 1.00 75.35 C ATOM 3544 CG2 VAL B 111 -1.118 13.383 3.704 1.00 12.04 C ATOM 0 H VAL B 111 -2.252 10.458 6.273 1.00 3.23 H new ATOM 0 HA VAL B 111 -2.261 13.288 6.070 1.00 60.43 H new ATOM 0 HB VAL B 111 -0.761 11.629 4.886 1.00 23.41 H new ATOM 0 HG11 VAL B 111 -1.380 10.891 2.614 1.00 75.35 H new ATOM 0 HG12 VAL B 111 -2.350 10.120 3.891 1.00 75.35 H new ATOM 0 HG13 VAL B 111 -3.048 11.433 2.913 1.00 75.35 H new ATOM 0 HG21 VAL B 111 -0.412 13.121 2.916 1.00 12.04 H new ATOM 0 HG22 VAL B 111 -1.965 13.915 3.271 1.00 12.04 H new ATOM 0 HG23 VAL B 111 -0.624 14.022 4.435 1.00 12.04 H new ATOM 3554 N ALA B 112 -4.907 11.697 4.919 1.00 31.14 N ATOM 3555 CA ALA B 112 -6.324 11.848 4.587 1.00 52.44 C ATOM 3556 C ALA B 112 -7.058 12.639 5.690 1.00 73.31 C ATOM 3557 O ALA B 112 -7.757 13.590 5.391 1.00 52.14 O ATOM 3558 CB ALA B 112 -6.968 10.477 4.368 1.00 70.44 C ATOM 0 H ALA B 112 -4.626 10.731 5.084 1.00 31.14 H new ATOM 0 HA ALA B 112 -6.408 12.413 3.659 1.00 52.44 H new ATOM 0 HB1 ALA B 112 -8.022 10.605 4.122 1.00 70.44 H new ATOM 0 HB2 ALA B 112 -6.464 9.965 3.549 1.00 70.44 H new ATOM 0 HB3 ALA B 112 -6.878 9.883 5.277 1.00 70.44 H new ATOM 3564 N ASN B 113 -6.832 12.274 6.970 1.00 13.14 N ATOM 3565 CA ASN B 113 -7.477 12.943 8.132 1.00 23.04 C ATOM 3566 C ASN B 113 -7.120 14.441 8.185 1.00 11.40 C ATOM 3567 O ASN B 113 -7.952 15.261 8.582 1.00 33.23 O ATOM 3568 CB ASN B 113 -7.081 12.269 9.485 1.00 62.10 C ATOM 3569 CG ASN B 113 -7.554 10.819 9.644 1.00 41.12 C ATOM 3570 OD1 ASN B 113 -8.591 10.419 9.111 1.00 11.22 O ATOM 3571 ND2 ASN B 113 -6.792 10.021 10.385 1.00 34.14 N ATOM 0 H ASN B 113 -6.204 11.514 7.231 1.00 13.14 H new ATOM 0 HA ASN B 113 -8.553 12.836 7.992 1.00 23.04 H new ATOM 0 HB2 ASN B 113 -5.996 12.295 9.584 1.00 62.10 H new ATOM 0 HB3 ASN B 113 -7.490 12.862 10.303 1.00 62.10 H new ATOM 0 HD21 ASN B 113 -7.060 9.047 10.526 1.00 34.14 H new ATOM 0 HD22 ASN B 113 -5.940 10.383 10.813 1.00 34.14 H new ATOM 3578 N MET B 114 -5.877 14.782 7.768 1.00 13.43 N ATOM 3579 CA MET B 114 -5.370 16.167 7.796 1.00 1.54 C ATOM 3580 C MET B 114 -6.123 17.051 6.786 1.00 2.21 C ATOM 3581 O MET B 114 -6.496 18.188 7.105 1.00 74.54 O ATOM 3582 CB MET B 114 -3.841 16.226 7.522 1.00 63.21 C ATOM 3583 CG MET B 114 -2.968 15.451 8.527 1.00 71.54 C ATOM 3584 SD MET B 114 -1.209 15.869 8.406 1.00 22.55 S ATOM 3585 CE MET B 114 -0.897 15.779 6.639 1.00 75.35 C ATOM 0 H MET B 114 -5.204 14.106 7.406 1.00 13.43 H new ATOM 0 HA MET B 114 -5.548 16.552 8.800 1.00 1.54 H new ATOM 0 HB2 MET B 114 -3.651 15.835 6.522 1.00 63.21 H new ATOM 0 HB3 MET B 114 -3.528 17.270 7.521 1.00 63.21 H new ATOM 0 HG2 MET B 114 -3.317 15.659 9.539 1.00 71.54 H new ATOM 0 HG3 MET B 114 -3.094 14.381 8.360 1.00 71.54 H new ATOM 0 HE1 MET B 114 0.090 15.350 6.465 1.00 75.35 H new ATOM 0 HE2 MET B 114 -1.654 15.152 6.167 1.00 75.35 H new ATOM 0 HE3 MET B 114 -0.937 16.781 6.211 1.00 75.35 H new ATOM 3595 N ILE B 115 -6.344 16.525 5.561 1.00 23.53 N ATOM 3596 CA ILE B 115 -7.061 17.267 4.502 1.00 4.21 C ATOM 3597 C ILE B 115 -8.577 17.291 4.791 1.00 62.23 C ATOM 3598 O ILE B 115 -9.267 18.244 4.417 1.00 53.03 O ATOM 3599 CB ILE B 115 -6.784 16.692 3.053 1.00 13.51 C ATOM 3600 CG1 ILE B 115 -7.370 15.258 2.882 1.00 61.13 C ATOM 3601 CG2 ILE B 115 -5.268 16.707 2.740 1.00 30.34 C ATOM 3602 CD1 ILE B 115 -7.270 14.674 1.488 1.00 12.25 C ATOM 0 H ILE B 115 -6.037 15.593 5.282 1.00 23.53 H new ATOM 0 HA ILE B 115 -6.674 18.286 4.516 1.00 4.21 H new ATOM 0 HB ILE B 115 -7.291 17.340 2.338 1.00 13.51 H new ATOM 0 HG12 ILE B 115 -6.857 14.590 3.574 1.00 61.13 H new ATOM 0 HG13 ILE B 115 -8.420 15.276 3.175 1.00 61.13 H new ATOM 0 HG21 ILE B 115 -5.099 16.308 1.740 1.00 30.34 H new ATOM 0 HG22 ILE B 115 -4.896 17.730 2.790 1.00 30.34 H new ATOM 0 HG23 ILE B 115 -4.740 16.093 3.470 1.00 30.34 H new ATOM 0 HD11 ILE B 115 -7.706 13.675 1.480 1.00 12.25 H new ATOM 0 HD12 ILE B 115 -7.809 15.311 0.787 1.00 12.25 H new ATOM 0 HD13 ILE B 115 -6.222 14.615 1.193 1.00 12.25 H new ATOM 3614 N ARG B 116 -9.076 16.240 5.473 1.00 4.42 N ATOM 3615 CA ARG B 116 -10.491 16.133 5.861 1.00 74.00 C ATOM 3616 C ARG B 116 -10.766 17.024 7.086 1.00 4.21 C ATOM 3617 O ARG B 116 -10.592 16.602 8.237 1.00 65.02 O ATOM 3618 CB ARG B 116 -10.877 14.651 6.142 1.00 13.21 C ATOM 3619 CG ARG B 116 -10.758 13.701 4.924 1.00 52.11 C ATOM 3620 CD ARG B 116 -11.792 13.980 3.822 1.00 70.20 C ATOM 3621 NE ARG B 116 -13.162 13.651 4.259 1.00 20.40 N ATOM 3622 CZ ARG B 116 -13.766 12.459 4.075 1.00 24.34 C ATOM 3623 NH1 ARG B 116 -13.135 11.448 3.462 1.00 20.05 N ATOM 3624 NH2 ARG B 116 -15.008 12.288 4.488 1.00 4.04 N ATOM 0 H ARG B 116 -8.509 15.445 5.768 1.00 4.42 H new ATOM 0 HA ARG B 116 -11.111 16.481 5.035 1.00 74.00 H new ATOM 0 HB2 ARG B 116 -10.242 14.272 6.943 1.00 13.21 H new ATOM 0 HB3 ARG B 116 -11.903 14.622 6.508 1.00 13.21 H new ATOM 0 HG2 ARG B 116 -9.757 13.789 4.502 1.00 52.11 H new ATOM 0 HG3 ARG B 116 -10.871 12.672 5.264 1.00 52.11 H new ATOM 0 HD2 ARG B 116 -11.744 15.031 3.537 1.00 70.20 H new ATOM 0 HD3 ARG B 116 -11.544 13.397 2.935 1.00 70.20 H new ATOM 0 HE ARG B 116 -13.693 14.380 4.736 1.00 20.40 H new ATOM 0 HH11 ARG B 116 -12.180 11.572 3.125 1.00 20.05 H new ATOM 0 HH12 ARG B 116 -13.609 10.554 3.333 1.00 20.05 H new ATOM 0 HH21 ARG B 116 -15.504 13.054 4.943 1.00 4.04 H new ATOM 0 HH22 ARG B 116 -15.471 11.390 4.352 1.00 4.04 H new ATOM 3638 N GLY B 117 -11.128 18.284 6.813 1.00 50.44 N ATOM 3639 CA GLY B 117 -11.532 19.242 7.839 1.00 22.55 C ATOM 3640 C GLY B 117 -12.799 19.982 7.411 1.00 64.10 C ATOM 3641 O GLY B 117 -13.907 19.499 7.703 1.00 74.22 O ATOM 3642 OXT GLY B 117 -12.695 21.023 6.732 1.00 37.27 O ATOM 0 H GLY B 117 -11.147 18.665 5.867 1.00 50.44 H new ATOM 0 HA2 GLY B 117 -11.708 18.723 8.781 1.00 22.55 H new ATOM 0 HA3 GLY B 117 -10.728 19.957 8.014 1.00 22.55 H new TER 3646 GLY B 117