#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hpc s VAL 21 N 0.00 2.54 -0.41 -3.33 0.11 -1.26 -4.98 120.40 113.08 3hpc s VAL 21 Ca 0.00 0.48 0.04 0.00 -2.93 0.00 0.00 61.98 59.57 3hpc s VAL 21 Cb 0.00 -3.31 0.17 0.00 -1.53 0.00 0.00 36.38 31.71 3hpc s VAL 21 CO 0.00 0.09 0.42 -0.55 -3.33 0.00 0.00 175.10 171.73 3hpc s SER 22 N 0.13 0.85 -0.08 3.54 0.15 -1.26 -5.14 113.70 111.89 3hpc s SER 22 Ca 0.57 -2.10 0.05 0.00 0.70 0.00 0.00 55.95 55.17 3hpc s SER 22 Cb -0.43 0.45 -0.00 0.00 -1.71 0.00 0.00 66.02 64.33 3hpc s SER 22 CO 0.48 -0.20 -0.24 0.54 1.20 0.00 0.00 173.24 175.03 3hpc s VAL 23 N 0.89 2.01 -0.18 4.45 0.11 -1.26 -5.11 120.40 121.32 3hpc s VAL 23 Ca 0.24 -1.02 -0.26 0.00 -2.93 0.00 0.00 61.98 58.01 3hpc s VAL 23 Cb -0.07 -1.72 -0.01 0.00 -1.53 0.00 0.00 36.38 33.05 3hpc s VAL 23 CO -0.08 0.55 0.89 -1.81 -3.33 0.00 0.00 175.10 171.32 3hpc s ASP 24 N 0.10 7.01 -0.17 3.54 1.01 -1.26 -5.07 116.67 121.83 3hpc s ASP 24 Ca -0.11 1.24 -0.05 0.00 0.71 0.00 0.00 52.55 54.34 3hpc s ASP 24 Cb -0.16 -2.48 -0.03 0.00 1.01 0.00 0.00 42.92 41.26 3hpc s ASP 24 CO 0.06 -0.46 -0.00 -0.76 0.21 0.00 0.00 175.17 174.22 3hpc s LEU 25 N 2.35 3.42 -0.19 1.23 1.43 -1.26 -5.09 118.68 120.58 3hpc s LEU 25 Ca 0.40 -0.07 0.01 0.00 -1.03 0.00 0.00 54.13 53.44 3hpc s LEU 25 Cb -0.16 -1.84 0.03 0.00 0.03 0.00 0.00 46.19 44.24 3hpc s LEU 25 CO 0.12 0.16 -0.18 0.21 0.23 0.00 0.00 176.35 176.89 3hpc s ASN 26 N 0.44 3.30 -0.27 2.29 2.47 -1.26 -5.11 114.94 116.80 3hpc s ASN 26 Ca -0.01 -0.76 -0.03 0.00 0.42 0.00 0.00 52.86 52.48 3hpc s ASN 26 Cb -0.14 -1.45 0.03 0.00 -1.45 0.00 0.00 41.25 38.24 3hpc s ASN 26 CO 0.02 -0.04 -0.00 -0.69 -3.72 0.00 0.00 177.10 172.67 3hpc s VAL 27 N 1.28 3.23 -1.23 -5.21 1.01 -1.26 -4.77 120.40 113.46 3hpc s VAL 27 Ca 0.03 -1.01 -0.17 0.00 0.00 0.00 0.00 61.98 60.83 3hpc s VAL 27 Cb -0.14 -2.70 0.00 0.00 0.00 0.00 0.00 36.38 33.54 3hpc s VAL 27 CO -0.11 0.09 0.67 0.47 0.00 0.00 0.00 175.10 176.21 3hpc n ASP 28 N 4.72 -3.70 -4.75 3.32 8.00 -1.26 -4.88 116.55 118.00 3hpc n ASP 28 Ca -0.15 -1.06 -0.38 0.00 0.71 0.00 0.00 54.79 53.91 3hpc n ASP 28 Cb 0.46 -3.04 0.05 0.00 -0.02 0.00 0.00 41.12 38.57 3hpc n ASP 28 CO 0.00 0.00 0.00 -2.16 -0.39 0.00 0.00 177.20 174.65 3hpc s PRO 29 N -6.35 3.03 0.34 -0.24 0.04 -1.26 -4.93 135.00 125.62 3hpc s PRO 29 Ca 0.34 2.20 0.23 0.00 0.04 0.00 0.00 61.00 63.81 3hpc s PRO 29 Cb -0.14 -2.18 0.23 0.00 0.04 0.00 0.00 34.50 32.46 3hpc s PRO 29 CO 0.89 -1.26 1.40 0.66 0.04 0.00 0.00 177.00 178.73 3hpc h SER 30 N 1.28 0.00 -2.66 6.66 4.64 -1.93 -3.42 113.55 118.12 3hpc h SER 30 Ca -0.51 -0.01 -0.17 0.00 -0.47 0.00 0.00 61.79 60.64 3hpc h SER 30 Cb 1.31 0.00 -0.30 0.00 -0.31 0.00 0.00 62.40 63.09 3hpc h SER 30 CO 0.56 0.00 -0.47 -0.22 -0.87 0.00 0.00 176.83 175.84 3hpc s LEU 31 N -5.79 -0.45 -0.08 5.97 2.96 -1.26 -1.19 118.68 118.84 3hpc s LEU 31 Ca 0.04 0.71 -0.01 0.00 -0.22 0.00 0.00 54.13 54.66 3hpc s LEU 31 Cb 0.07 0.97 0.03 0.00 0.50 0.00 0.00 46.19 47.76 3hpc s LEU 31 CO 0.71 -0.24 -0.04 -1.10 -1.32 0.00 0.00 176.35 174.36 3hpc s GLN 32 N 2.50 1.04 0.03 1.98 -0.21 0.10 -4.95 119.66 120.16 3hpc s GLN 32 Ca 0.01 -0.08 0.04 0.00 0.02 0.00 0.00 55.36 55.34 3hpc s GLN 32 Cb -0.12 -1.22 -0.04 0.00 1.00 0.00 0.00 33.01 32.63 3hpc s GLN 32 CO -0.11 -0.25 -0.05 0.42 -2.12 0.00 0.00 175.29 173.19 3hpc s ILE 33 N 1.69 3.78 0.22 1.08 -1.09 -1.26 -1.22 121.20 124.40 3hpc s ILE 33 Ca 0.02 -0.84 -0.17 0.00 -2.23 0.00 0.00 60.65 57.44 3hpc s ILE 33 Cb -0.13 -2.69 0.02 0.00 -1.58 0.00 0.00 42.46 38.08 3hpc s ILE 33 CO -0.05 0.31 0.54 1.51 -1.23 0.00 0.00 174.94 176.01 3hpc s ASP 34 N -1.69 -0.21 -0.54 3.58 -4.77 -0.25 -4.85 116.67 107.94 3hpc s ASP 34 Ca 0.20 -0.61 0.00 0.00 -3.30 0.00 0.00 52.55 48.83 3hpc s ASP 34 Cb -0.11 0.60 0.14 0.00 -1.09 0.00 0.00 42.92 42.45 3hpc s ASP 34 CO 0.11 -1.11 0.31 -0.63 0.70 0.00 0.00 175.17 174.55 3hpc s ILE 35 N -3.92 3.12 -0.72 2.11 1.01 -1.26 -1.00 121.20 120.54 3hpc s ILE 35 Ca 0.13 -2.95 0.26 0.00 0.00 0.00 0.00 60.65 58.09 3hpc s ILE 35 Cb -0.02 -3.11 0.24 0.00 0.01 0.00 0.00 42.46 39.58 3hpc s ILE 35 CO 0.01 -0.80 1.69 -0.81 0.00 0.00 0.00 174.94 175.03 3hpc n PRO 36 N 3.53 0.26 -3.63 2.79 -0.04 -1.24 -4.87 135.00 131.79 3hpc n PRO 36 Ca 0.05 0.18 -0.16 0.00 -0.04 0.00 0.00 63.50 63.54 3hpc n PRO 36 Cb 0.36 -1.77 -0.07 0.00 -0.04 0.00 0.00 33.50 31.98 3hpc n PRO 36 CO 0.00 0.00 0.00 0.16 -0.04 0.00 0.00 175.50 175.62 3hpc s ASP 37 N -4.42 -0.46 0.04 3.54 -4.77 -1.26 -5.09 116.67 104.25 3hpc s ASP 37 Ca 0.10 0.50 -0.10 0.00 -3.30 0.00 0.00 52.55 49.75 3hpc s ASP 37 Cb 0.13 0.50 0.01 0.00 -1.09 0.00 0.00 42.92 42.46 3hpc s ASP 37 CO 0.62 -0.50 0.21 0.00 0.70 0.00 0.00 175.17 176.19 3hpc s ALA 38 N -1.10 -0.39 -0.04 2.11 0.00 -1.26 -1.59 121.76 119.48 3hpc s ALA 38 Ca -0.11 -0.27 0.04 0.00 0.00 0.00 0.00 51.96 51.62 3hpc s ALA 38 Cb -0.03 0.30 -0.00 0.00 0.00 0.00 0.00 23.12 23.39 3hpc s ALA 38 CO 0.07 -0.38 -0.18 -1.17 0.00 0.00 0.00 175.76 174.10 3hpc s LEU 39 N -2.13 1.93 -0.19 0.00 2.96 -0.34 -4.99 118.68 115.92 3hpc s LEU 39 Ca -0.04 -0.37 0.01 0.00 -0.22 0.00 0.00 54.13 53.51 3hpc s LEU 39 Cb -0.01 -1.00 0.04 0.00 0.50 0.00 0.00 46.19 45.72 3hpc s LEU 39 CO -0.04 0.16 -0.10 -0.94 -1.32 0.00 0.00 176.35 174.10 3hpc s SER 40 N 0.03 3.27 -0.20 3.68 1.04 -1.26 -0.46 113.70 119.80 3hpc s SER 40 Ca -0.04 -0.83 0.02 0.00 0.48 0.00 0.00 55.95 55.58 3hpc s SER 40 Cb -0.12 -1.20 0.03 0.00 0.10 0.00 0.00 66.02 64.84 3hpc s SER 40 CO 0.02 -0.14 -0.16 -1.61 0.98 0.00 0.00 173.24 172.33 3hpc s GLU 41 N 1.43 2.63 -1.56 4.02 2.02 -0.19 -4.59 118.70 122.45 3hpc s GLU 41 Ca -0.00 -0.97 -0.03 0.00 0.02 0.00 0.00 54.97 53.98 3hpc s GLU 41 Cb -0.16 -2.63 0.03 0.00 0.10 0.00 0.00 34.13 31.48 3hpc s GLU 41 CO -0.08 -0.34 0.18 0.54 0.02 0.00 0.00 175.26 175.58 3hpc n ARG 42 N 4.58 -1.50 -0.96 1.61 1.74 -1.26 -1.45 116.66 119.41 3hpc n ARG 42 Ca -0.18 0.17 0.00 0.00 -0.77 0.00 0.00 57.85 57.07 3hpc n ARG 42 Cb 0.47 -3.97 0.00 0.00 -1.02 0.00 0.00 32.46 27.95 3hpc n ARG 42 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 3hpc n ASP 43 N -2.85 -3.56 -4.78 0.55 8.00 -1.26 -5.00 116.55 107.65 3hpc n ASP 43 Ca -0.26 0.00 -0.36 0.00 0.71 0.00 0.00 54.79 54.88 3hpc n ASP 43 Cb 0.66 -1.70 -0.07 0.00 -0.02 0.00 0.00 41.12 39.99 3hpc n ASP 43 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 3hpc s LYS 44 N -0.81 3.98 -0.13 -1.24 -0.14 -0.53 -4.86 119.74 116.01 3hpc s LYS 44 Ca 0.00 -0.14 -0.03 0.00 -1.36 0.00 0.00 55.97 54.44 3hpc s LYS 44 Cb 0.00 -3.35 -0.03 0.00 -1.68 0.00 0.00 37.83 32.77 3hpc s LYS 44 CO 0.00 0.44 -0.02 0.08 -0.76 0.00 0.00 175.35 175.09 3hpc s VAL 45 N -0.06 4.08 -0.25 3.17 1.01 -1.26 -1.03 120.40 126.06 3hpc s VAL 45 Ca 0.11 -0.31 -0.04 0.00 0.00 0.00 0.00 61.98 61.75 3hpc s VAL 45 Cb -0.12 -2.76 0.01 0.00 0.00 0.00 0.00 36.38 33.51 3hpc s VAL 45 CO 0.01 0.53 -0.02 -0.54 0.00 0.00 0.00 175.10 175.08 3hpc s LYS 46 N -0.11 3.13 -0.09 2.72 1.02 0.40 -4.39 119.74 122.41 3hpc s LYS 46 Ca 0.03 -0.80 -0.16 0.00 0.02 0.00 0.00 55.97 55.07 3hpc s LYS 46 Cb -0.13 -3.09 -0.05 0.00 -0.52 0.00 0.00 37.83 34.04 3hpc s LYS 46 CO 0.02 -0.32 0.40 -0.06 -0.92 0.00 0.00 175.35 174.47 3hpc s PHE 47 N 1.43 3.57 -0.25 3.18 0.08 0.74 -1.20 117.98 125.53 3hpc s PHE 47 Ca 0.03 0.84 -0.22 0.00 0.12 0.00 0.00 56.93 57.70 3hpc s PHE 47 Cb -0.16 -2.40 -0.01 0.00 -0.57 0.00 0.00 43.02 39.89 3hpc s PHE 47 CO -0.02 0.36 0.72 0.99 -0.10 0.00 0.00 175.22 177.17 3hpc s THR 48 N -0.02 4.91 -0.28 0.64 2.01 -0.62 -0.78 115.64 121.50 3hpc s THR 48 Ca 0.22 1.31 -0.07 0.00 0.31 0.00 0.00 61.69 63.46 3hpc s THR 48 Cb -0.15 -4.02 -0.01 0.00 0.01 0.00 0.00 72.50 68.33 3hpc s THR 48 CO 0.09 -0.04 0.08 -0.69 -0.69 0.00 0.00 174.62 173.38 3hpc s VAL 49 N 2.68 4.13 -0.14 3.82 1.01 -0.03 -3.72 120.40 128.14 3hpc s VAL 49 Ca 0.30 -0.47 0.00 0.00 0.00 0.00 0.00 61.98 61.81 3hpc s VAL 49 Cb -0.15 -3.04 -0.01 0.00 0.00 0.00 0.00 36.38 33.17 3hpc s VAL 49 CO 0.08 0.18 -0.15 -2.28 0.00 0.00 0.00 175.10 172.94 3hpc s HIS 50 N 1.55 2.78 -0.08 5.22 5.04 -0.17 -1.35 115.29 128.28 3hpc s HIS 50 Ca 0.04 -0.86 0.05 0.00 -1.54 0.00 0.00 55.06 52.75 3hpc s HIS 50 Cb -0.16 -1.86 -0.00 0.00 0.04 0.00 0.00 32.58 30.60 3hpc s HIS 50 CO 0.03 -0.35 -0.23 0.99 -2.34 0.00 0.00 174.74 172.84 3hpc s THR 51 N 0.58 1.96 -0.10 0.89 2.01 -0.04 -1.09 115.64 119.85 3hpc s THR 51 Ca -0.09 -0.98 0.03 0.00 0.31 0.00 0.00 61.69 60.95 3hpc s THR 51 Cb -0.16 -1.68 -0.01 0.00 0.01 0.00 0.00 72.50 70.66 3hpc s THR 51 CO 0.03 0.54 -0.18 -0.54 -0.69 0.00 0.00 174.62 173.78 3hpc s LYS 52 N 0.16 3.05 -0.05 4.92 1.02 -0.36 -1.70 119.74 126.78 3hpc s LYS 52 Ca -0.12 -0.78 -0.13 0.00 0.02 0.00 0.00 55.97 54.96 3hpc s LYS 52 Cb -0.16 -2.43 0.02 0.00 -0.52 0.00 0.00 37.83 34.75 3hpc s LYS 52 CO 0.06 0.28 0.30 -0.08 -0.92 0.00 0.00 175.35 174.99 3hpc s THR 53 N 0.13 0.04 -2.72 2.17 -1.32 -0.05 -0.72 115.64 113.17 3hpc s THR 53 Ca -0.09 -0.32 0.23 0.00 -1.21 0.00 0.00 61.69 60.30 3hpc s THR 53 Cb -0.16 -0.54 0.30 0.00 -1.51 0.00 0.00 72.50 70.59 3hpc s THR 53 CO 0.06 -0.18 1.32 0.35 -2.21 0.00 0.00 174.62 173.96 3hpc n THR 54 N 1.89 0.24 -2.61 5.08 -2.24 -0.33 -4.52 114.28 111.78 3hpc n THR 54 Ca -0.18 -0.62 -0.39 0.00 -2.27 0.00 0.00 64.05 60.59 3hpc n THR 54 Cb 0.57 1.26 -0.05 0.00 -2.10 0.00 0.00 70.33 70.00 3hpc n THR 54 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 3hpc s LEU 55 N -1.74 4.47 0.00 3.22 1.43 -1.25 -4.96 118.68 119.85 3hpc s LEU 55 Ca 0.33 2.07 0.31 0.00 -1.03 0.00 0.00 54.13 55.80 3hpc s LEU 55 Cb 0.21 -3.79 1.59 0.00 0.03 0.00 0.00 46.19 44.24 3hpc s LEU 55 CO 0.30 -0.11 2.07 -0.81 0.23 0.00 0.00 176.35 178.03 3hpc n PRO 56 N 0.94 0.78 0.15 1.29 -0.04 -1.26 -3.18 135.00 133.68 3hpc n PRO 56 Ca 0.00 -0.10 0.13 0.00 -0.04 0.00 0.00 63.50 63.49 3hpc n PRO 56 Cb 0.47 -1.50 0.35 0.00 -0.04 0.00 0.00 33.50 32.78 3hpc n PRO 56 CO 0.00 0.00 0.00 1.79 -0.04 0.00 0.00 175.50 177.25 3hpc h THR 57 N 0.24 0.00 -3.37 0.52 1.35 -1.99 -3.45 112.91 106.21 3hpc h THR 57 Ca 0.00 -0.63 -0.53 0.00 -0.55 0.00 0.00 66.41 64.70 3hpc h THR 57 Cb 0.20 1.61 -0.02 0.00 -1.73 0.00 0.00 68.15 68.20 3hpc h THR 57 CO 0.00 0.00 -0.13 -0.36 -0.25 0.00 0.00 175.52 174.78 3hpc s PHE 58 N -3.17 3.44 -0.04 4.73 0.08 -1.19 -4.99 117.98 116.83 3hpc s PHE 58 Ca 0.09 0.80 0.29 0.00 0.12 0.00 0.00 56.93 58.22 3hpc s PHE 58 Cb 0.10 -2.21 0.98 0.00 -0.57 0.00 0.00 43.02 41.31 3hpc s PHE 58 CO 0.60 0.25 1.84 1.96 -0.10 0.00 0.00 175.22 179.77 3hpc h GLN 59 N 2.32 0.00 -3.53 0.44 1.08 -1.90 -3.45 115.11 110.06 3hpc h GLN 59 Ca -0.47 0.00 -0.04 0.00 -1.45 0.00 0.00 58.65 56.69 3hpc h GLN 59 Cb 1.17 0.00 -0.10 0.00 -0.05 0.00 0.00 27.48 28.51 3hpc h GLN 59 CO 0.69 0.06 -0.08 -1.54 -0.95 0.00 0.00 178.83 177.00 3hpc s SER 60 N -5.94 -0.14 0.15 1.46 1.04 -1.26 -5.07 113.70 103.95 3hpc s SER 60 Ca 0.03 -0.74 0.26 0.00 0.48 0.00 0.00 55.95 55.98 3hpc s SER 60 Cb 0.08 0.57 0.80 0.00 0.10 0.00 0.00 66.02 67.57 3hpc s SER 60 CO 0.60 -1.08 1.72 -2.65 0.98 0.00 0.00 173.24 172.81 3hpc n PRO 61 N -0.34 0.21 -3.67 4.02 -0.02 -1.26 -4.79 135.00 129.15 3hpc n PRO 61 Ca -0.06 0.15 -0.11 0.00 -2.02 0.00 0.00 63.50 61.46 3hpc n PRO 61 Cb 0.62 -1.72 -0.09 0.00 -0.02 0.00 0.00 33.50 32.29 3hpc n PRO 61 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 3hpc s GLU 62 N -3.09 0.60 0.06 -0.52 2.12 -1.26 -0.87 118.70 115.73 3hpc s GLU 62 Ca 0.11 0.91 -0.27 0.00 0.36 0.00 0.00 54.97 56.07 3hpc s GLU 62 Cb 0.14 0.18 0.09 0.00 0.26 0.00 0.00 34.13 34.79 3hpc s GLU 62 CO 0.61 -0.12 0.96 -0.59 -0.54 0.00 0.00 175.26 175.58 3hpc s PHE 63 N 0.97 -0.22 0.03 5.30 -0.71 -0.69 -5.02 117.98 117.64 3hpc s PHE 63 Ca -0.05 0.01 -0.02 0.00 -1.04 0.00 0.00 56.93 55.82 3hpc s PHE 63 Cb -0.05 0.58 -0.02 0.00 -1.21 0.00 0.00 43.02 42.32 3hpc s PHE 63 CO -0.09 -0.64 0.01 -1.12 -1.34 0.00 0.00 175.22 172.04 3hpc s SER 64 N -2.72 0.25 0.12 1.98 0.01 -1.26 -0.86 113.70 111.22 3hpc s SER 64 Ca 0.09 -0.56 -0.00 0.00 1.31 0.00 0.00 55.95 56.79 3hpc s SER 64 Cb -0.01 0.15 -0.04 0.00 0.21 0.00 0.00 66.02 66.33 3hpc s SER 64 CO -0.03 -0.40 0.03 0.68 0.41 0.00 0.00 173.24 173.93 3hpc s VAL 65 N -2.07 0.26 -0.14 3.43 -7.23 -0.46 -4.89 120.40 109.31 3hpc s VAL 65 Ca -0.10 -1.91 -0.06 0.00 -1.81 0.00 0.00 61.98 58.10 3hpc s VAL 65 Cb -0.05 -1.95 -0.04 0.00 0.56 0.00 0.00 36.38 34.90 3hpc s VAL 65 CO -0.03 -0.58 0.08 -0.89 -0.31 0.00 0.00 175.10 173.38 3hpc s THR 66 N -3.93 4.99 0.03 5.32 2.01 -1.26 -0.86 115.64 121.94 3hpc s THR 66 Ca 0.21 0.02 0.02 0.00 0.31 0.00 0.00 61.69 62.24 3hpc s THR 66 Cb 0.07 -3.19 -0.02 0.00 0.01 0.00 0.00 72.50 69.37 3hpc s THR 66 CO -0.00 0.55 -0.06 -0.13 -0.69 0.00 0.00 174.62 174.29 3hpc s ARG 67 N -0.44 0.44 0.29 4.92 1.81 0.04 -4.87 118.95 121.14 3hpc s ARG 67 Ca 0.10 -0.55 0.08 0.00 -1.72 0.00 0.00 55.73 53.63 3hpc s ARG 67 Cb -0.12 -0.24 -0.03 0.00 -0.45 0.00 0.00 34.95 34.11 3hpc s ARG 67 CO 0.02 0.05 0.21 -0.65 -0.68 0.00 0.00 175.30 174.24 3hpc s GLN 68 N -1.12 2.74 0.26 3.54 -0.21 -1.26 -0.18 119.66 123.42 3hpc s GLN 68 Ca -0.07 -1.23 -0.03 0.00 0.02 0.00 0.00 55.36 54.05 3hpc s GLN 68 Cb -0.07 -2.46 0.54 0.00 1.00 0.00 0.00 33.01 32.01 3hpc s GLN 68 CO 0.00 0.25 1.69 1.25 -2.12 0.00 0.00 175.29 176.36 3hpc h HIS 69 N 1.44 0.36 -0.76 0.91 -0.00 -2.00 -0.08 115.15 115.02 3hpc h HIS 69 Ca -0.46 0.04 0.19 0.00 -0.00 0.00 0.00 60.37 60.15 3hpc h HIS 69 Cb 1.25 -0.04 -0.04 0.00 -0.00 0.00 0.00 27.41 28.58 3hpc h HIS 69 CO 0.56 -0.08 0.53 0.93 -0.00 0.00 0.00 177.93 179.87 3hpc h GLU 70 N 0.30 0.16 -0.27 5.26 3.07 -1.96 -0.96 114.58 120.19 3hpc h GLU 70 Ca 0.46 -0.01 -0.17 0.00 -0.50 0.00 0.00 59.36 59.14 3hpc h GLU 70 Cb 0.81 -0.04 0.00 0.00 -0.84 0.00 0.00 28.75 28.68 3hpc h GLU 70 CO -0.52 0.11 -0.48 -0.44 -1.40 0.00 0.00 179.01 176.27 3hpc h ASP 71 N 0.17 0.89 -0.46 1.42 3.32 -1.40 -0.75 116.42 119.60 3hpc h ASP 71 Ca 0.37 -0.53 -0.05 0.00 0.02 0.00 0.00 57.03 56.84 3hpc h ASP 71 Cb 1.22 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 40.49 3hpc h ASP 71 CO -0.06 1.25 0.12 -0.26 -1.72 0.00 0.00 179.24 178.57 3hpc h PHE 72 N 0.55 0.82 -0.43 4.55 0.04 -1.15 -1.68 116.94 119.64 3hpc h PHE 72 Ca 0.01 -0.07 -0.13 0.00 2.80 0.00 0.00 57.97 60.58 3hpc h PHE 72 Cb 1.09 -0.24 -0.01 0.00 2.20 0.00 0.00 35.95 38.98 3hpc h PHE 72 CO 0.08 0.70 -0.25 0.28 -0.60 0.00 0.00 178.31 178.51 3hpc h VAL 73 N 0.77 1.27 -0.23 -0.55 2.07 -1.15 -0.79 116.25 117.64 3hpc h VAL 73 Ca 0.17 -1.40 0.04 0.00 0.82 0.00 0.00 66.70 66.32 3hpc h VAL 73 Cb 0.29 1.21 -0.04 0.00 -1.52 0.00 0.00 31.29 31.23 3hpc h VAL 73 CO -0.00 0.48 0.00 -0.25 0.02 0.00 0.00 177.57 177.82 3hpc h TRP 74 N 0.77 -0.00 0.25 1.57 7.01 -1.04 0.62 115.95 125.13 3hpc h TRP 74 Ca 0.09 0.02 -0.01 0.00 2.11 0.00 0.00 58.89 61.10 3hpc h TRP 74 Cb 0.81 0.04 0.00 0.00 -2.10 0.00 0.00 29.16 27.91 3hpc h TRP 74 CO 0.05 -0.03 -0.12 1.25 -2.79 0.00 0.00 178.44 176.80 3hpc h LEU 75 N 0.08 -0.29 -0.48 0.65 5.85 -1.03 0.69 115.31 120.77 3hpc h LEU 75 Ca 0.11 -0.03 0.05 0.00 0.84 0.00 0.00 57.88 58.85 3hpc h LEU 75 Cb 0.14 0.07 -0.05 0.00 0.37 0.00 0.00 40.66 41.19 3hpc h LEU 75 CO -0.18 -0.16 0.22 -0.74 -0.34 0.00 0.00 178.44 177.23 3hpc h HIS 76 N -0.39 0.39 -0.81 1.25 2.76 -0.91 -1.35 115.15 116.09 3hpc h HIS 76 Ca -0.03 0.02 0.01 0.00 -2.20 0.00 0.00 60.37 58.17 3hpc h HIS 76 Cb 0.30 -0.11 -0.04 0.00 1.55 0.00 0.00 27.41 29.11 3hpc h HIS 76 CO -0.05 0.18 0.53 -0.44 -1.30 0.00 0.00 177.93 176.85 3hpc h ASP 77 N 0.43 0.91 -0.65 3.26 3.32 -0.73 -0.54 116.42 122.43 3hpc h ASP 77 Ca 0.22 -0.02 -0.05 0.00 0.02 0.00 0.00 57.03 57.20 3hpc h ASP 77 Cb 0.16 -0.22 -0.03 0.00 0.22 0.00 0.00 39.33 39.46 3hpc h ASP 77 CO -0.18 0.65 0.21 0.74 -1.72 0.00 0.00 179.24 178.95 3hpc h THR 78 N 1.08 1.25 -0.14 0.35 2.02 -0.37 -0.62 112.91 116.48 3hpc h THR 78 Ca 0.31 -0.85 -0.09 0.00 0.77 0.00 0.00 66.41 66.55 3hpc h THR 78 Cb -0.09 0.50 0.00 0.00 -1.74 0.00 0.00 68.15 66.82 3hpc h THR 78 CO -0.08 0.33 -0.27 -0.07 0.37 0.00 0.00 175.52 175.80 3hpc h LEU 79 N 0.99 0.48 -1.61 2.58 3.38 -0.98 -2.97 115.31 117.18 3hpc h LEU 79 Ca 0.22 -0.56 -0.04 0.00 0.09 0.00 0.00 57.88 57.59 3hpc h LEU 79 Cb 0.28 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 3hpc h LEU 79 CO -0.01 0.95 -0.20 0.71 0.09 0.00 0.00 178.44 179.98 3hpc h THR 80 N 0.03 0.74 -0.00 0.22 1.35 -0.82 -1.98 112.91 112.45 3hpc h THR 80 Ca 0.00 -0.81 0.00 0.00 -0.55 0.00 0.00 66.41 65.06 3hpc h THR 80 Cb 0.86 1.50 0.00 0.00 -1.73 0.00 0.00 68.15 68.78 3hpc h THR 80 CO 0.06 0.19 -0.13 -0.62 -0.25 0.00 0.00 175.52 174.77 3hpc n GLU 81 N -3.73 0.64 -2.60 4.72 1.02 -0.26 -4.75 120.64 115.68 3hpc n GLU 81 Ca -0.01 -0.23 -0.43 0.00 -0.02 0.00 0.00 57.16 56.46 3hpc n GLU 81 Cb 0.31 -1.50 -0.02 0.00 -0.02 0.00 0.00 31.44 30.21 3hpc n GLU 81 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 3hpc s THR 82 N -2.52 4.16 0.38 2.62 2.01 -0.75 -4.90 115.64 116.64 3hpc s THR 82 Ca 0.27 1.14 0.08 0.00 0.31 0.00 0.00 61.69 63.49 3hpc s THR 82 Cb 0.20 -4.64 0.18 0.00 0.01 0.00 0.00 72.50 68.25 3hpc s THR 82 CO 0.49 -1.10 1.94 0.71 -0.69 0.00 0.00 174.62 175.97 3hpc h THR 83 N 6.22 1.16 -0.92 -0.82 1.35 -1.87 -1.36 112.91 116.67 3hpc h THR 83 Ca -0.23 -0.65 0.26 0.00 -0.55 0.00 0.00 66.41 65.23 3hpc h THR 83 Cb 1.06 1.03 -0.14 0.00 -1.73 0.00 0.00 68.15 68.37 3hpc h THR 83 CO 1.14 0.22 0.34 -0.78 -0.25 0.00 0.00 175.52 176.19 3hpc h ASP 84 N 0.33 0.18 -0.03 5.36 3.58 -1.96 -2.51 116.42 121.37 3hpc h ASP 84 Ca 0.07 0.19 0.00 0.00 0.42 0.00 0.00 57.03 57.71 3hpc h ASP 84 Cb 0.28 0.22 0.00 0.00 1.72 0.00 0.00 39.33 41.55 3hpc h ASP 84 CO 0.01 -0.13 0.00 -1.22 -2.88 0.00 0.00 179.24 175.02 3hpc n TYR 85 N -5.16 0.07 0.15 0.28 4.01 -0.51 -4.26 117.16 111.74 3hpc n TYR 85 Ca 0.24 -0.03 0.06 0.00 -0.16 0.00 0.00 57.90 58.01 3hpc n TYR 85 Cb 0.76 -0.05 0.54 0.00 -0.31 0.00 0.00 39.34 40.28 3hpc n TYR 85 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3hpc h ALA 86 N 2.65 1.84 -0.06 -0.72 0.00 -1.60 -0.60 119.26 120.78 3hpc h ALA 86 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 3hpc h ALA 86 Cb 0.27 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.99 3hpc h ALA 86 CO 0.01 0.14 0.00 0.41 0.00 0.00 0.00 179.25 179.81 3hpc n GLY 87 N -1.44 -0.50 3.64 0.00 0.00 -1.26 -4.90 105.19 100.73 3hpc n GLY 87 Ca -0.01 -0.24 -0.25 0.00 0.00 0.00 0.00 46.02 45.52 3hpc n GLY 87 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hpc s LEU 88 N -1.59 3.20 -0.28 0.99 1.43 -0.23 -5.11 118.68 117.08 3hpc s LEU 88 Ca 0.30 -0.52 -0.15 0.00 -1.03 0.00 0.00 54.13 52.73 3hpc s LEU 88 Cb 0.15 -1.81 -0.03 0.00 0.03 0.00 0.00 46.19 44.52 3hpc s LEU 88 CO 0.24 0.06 0.37 -0.63 0.23 0.00 0.00 176.35 176.62 3hpc s ILE 89 N -1.92 5.17 -0.25 -0.59 1.01 -1.26 -5.05 121.20 118.30 3hpc s ILE 89 Ca 0.28 0.48 -0.09 0.00 0.00 0.00 0.00 60.65 61.32 3hpc s ILE 89 Cb -0.08 -3.72 -0.04 0.00 0.01 0.00 0.00 42.46 38.62 3hpc s ILE 89 CO 0.18 0.11 0.13 -0.63 0.00 0.00 0.00 174.94 174.72 3hpc s ILE 90 N 2.07 4.89 0.66 2.92 1.01 -1.26 -5.06 121.20 126.44 3hpc s ILE 90 Ca 0.15 0.02 -0.18 0.00 0.00 0.00 0.00 60.65 60.64 3hpc s ILE 90 Cb -0.16 -3.29 -0.01 0.00 0.01 0.00 0.00 42.46 39.01 3hpc s ILE 90 CO 0.10 0.32 1.26 -0.81 0.00 0.00 0.00 174.94 175.82 3hpc n PRO 91 N 4.69 1.02 -2.06 2.79 -0.04 -1.26 -4.89 135.00 135.24 3hpc n PRO 91 Ca -0.15 0.40 -0.38 0.00 -0.04 0.00 0.00 63.50 63.33 3hpc n PRO 91 Cb 0.52 -2.50 0.01 0.00 -0.04 0.00 0.00 33.50 31.49 3hpc n PRO 91 CO 0.00 0.00 0.00 -1.25 -0.04 0.00 0.00 175.50 174.21 3hpc s PRO 92 N -3.39 3.55 0.51 0.54 0.04 -1.26 -4.97 135.00 130.02 3hpc s PRO 92 Ca 0.82 1.99 -0.23 0.00 0.04 0.00 0.00 61.00 63.61 3hpc s PRO 92 Cb -0.38 -2.39 -0.07 0.00 0.04 0.00 0.00 34.50 31.71 3hpc s PRO 92 CO 0.42 -0.79 1.30 0.00 0.04 0.00 0.00 177.00 177.97 3hpc n ALA 93 N -0.63 1.39 -1.60 8.56 0.00 -1.26 -4.85 120.51 122.12 3hpc n ALA 93 Ca 0.08 0.16 -0.35 0.00 0.00 0.00 0.00 53.44 53.34 3hpc n ALA 93 Cb 0.46 -2.31 0.05 0.00 0.00 0.00 0.00 19.45 17.65 3hpc n ALA 93 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3hpc s PRO 94 N -2.64 2.79 0.53 0.00 0.04 -1.26 -5.01 135.00 129.43 3hpc s PRO 94 Ca 0.68 1.67 -0.11 0.00 0.04 0.00 0.00 61.00 63.27 3hpc s PRO 94 Cb -0.44 -1.92 -0.05 0.00 0.04 0.00 0.00 34.50 32.12 3hpc s PRO 94 CO 0.52 -1.31 0.93 0.95 0.04 0.00 0.00 177.00 178.12 3hpc s THR 95 N -1.90 4.71 0.21 1.26 -4.23 -1.26 -4.98 115.64 109.45 3hpc s THR 95 Ca 0.73 0.81 -0.31 0.00 -1.18 0.00 0.00 61.69 61.74 3hpc s THR 95 Cb -0.27 -3.80 -0.11 0.00 1.34 0.00 0.00 72.50 69.66 3hpc s THR 95 CO 0.37 -0.85 1.61 -0.75 -0.54 0.00 0.00 174.62 174.46 3hpc s LYS 96 N -4.54 4.17 0.30 3.99 2.20 -1.26 -4.93 119.74 119.67 3hpc s LYS 96 Ca 0.54 2.48 -0.29 0.00 -0.36 0.00 0.00 55.97 58.35 3hpc s LYS 96 Cb -0.10 -3.10 -0.13 0.00 -1.51 0.00 0.00 37.83 32.99 3hpc s LYS 96 CO 0.42 -0.64 1.21 -2.30 -0.36 0.00 0.00 175.35 173.67 3hpc n PRO 97 N 3.45 1.80 -3.52 4.03 -0.02 -1.26 -4.97 135.00 134.51 3hpc n PRO 97 Ca 0.13 0.63 -0.25 0.00 -2.02 0.00 0.00 63.50 61.99 3hpc n PRO 97 Cb 0.37 -2.15 -0.14 0.00 -0.02 0.00 0.00 33.50 31.56 3hpc n PRO 97 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 3hpc s ASP 98 N -0.27 2.65 -0.13 2.55 -1.08 -1.26 -4.99 116.67 114.14 3hpc s ASP 98 Ca 0.60 -0.91 0.17 0.00 -0.52 0.00 0.00 52.55 51.89 3hpc s ASP 98 Cb -0.64 -0.06 0.70 0.00 -1.46 0.00 0.00 42.92 41.46 3hpc s ASP 98 CO 0.59 -0.40 1.62 0.49 0.52 0.00 0.00 175.17 177.99 3hpc n PHE 99 N 5.28 1.47 -0.34 -5.34 3.72 -1.26 -4.70 117.46 116.29 3hpc n PHE 99 Ca -0.05 -0.64 0.03 0.00 -0.05 0.00 0.00 57.45 56.74 3hpc n PHE 99 Cb 0.45 -0.27 0.18 0.00 -0.94 0.00 0.00 39.48 38.90 3hpc n PHE 99 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 176.76 176.27 3hpc h ASP 100 N 3.82 0.90 0.63 4.37 5.19 -1.99 -1.85 116.42 127.49 3hpc h ASP 100 Ca 0.00 0.03 -0.03 0.00 -0.62 0.00 0.00 57.03 56.41 3hpc h ASP 100 Cb 1.48 -0.16 0.01 0.00 0.18 0.00 0.00 39.33 40.84 3hpc h ASP 100 CO 0.25 0.54 -0.30 1.23 -3.12 0.00 0.00 179.24 177.85 3hpc h GLY 101 N 1.02 -0.88 1.60 2.75 0.00 -2.00 -1.90 103.07 103.65 3hpc h GLY 101 Ca 0.43 0.33 -0.02 0.00 0.00 0.00 0.00 47.33 48.06 3hpc h GLY 101 CO -0.21 -0.32 0.15 -0.56 0.00 0.00 0.00 176.54 175.60 3hpc h PRO 102 N -0.98 0.53 -0.55 4.80 0.13 -1.91 -2.22 132.00 131.80 3hpc h PRO 102 Ca -0.09 -0.07 -0.01 0.00 -0.87 0.00 0.00 66.00 64.97 3hpc h PRO 102 Cb 0.64 -0.10 -0.03 0.00 0.13 0.00 0.00 31.00 31.65 3hpc h PRO 102 CO 0.14 0.44 0.29 -0.09 -0.23 0.00 0.00 178.00 178.55 3hpc h ARG 103 N 0.53 0.77 -0.59 0.86 9.65 -1.33 0.09 114.38 124.35 3hpc h ARG 103 Ca 0.13 -0.09 -0.09 0.00 -1.10 0.00 0.00 59.98 58.83 3hpc h ARG 103 Cb 0.11 -0.15 -0.02 0.00 -1.39 0.00 0.00 29.97 28.52 3hpc h ARG 103 CO -0.01 0.60 0.01 1.49 2.80 0.00 0.00 179.97 184.86 3hpc h GLU 104 N 0.73 1.03 -0.48 0.20 4.81 -0.93 -1.28 114.58 118.66 3hpc h GLU 104 Ca 0.19 -0.31 -0.10 0.00 -0.13 0.00 0.00 59.36 59.01 3hpc h GLU 104 Cb 0.06 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 29.32 3hpc h GLU 104 CO -0.03 1.00 -0.11 0.87 -0.73 0.00 0.00 179.01 180.01 3hpc h LYS 105 N 0.94 0.89 -0.66 1.92 1.57 -0.88 -2.19 116.57 118.15 3hpc h LYS 105 Ca 0.17 -0.31 0.01 0.00 -1.87 0.00 0.00 60.65 58.65 3hpc h LYS 105 Cb 0.52 -0.07 -0.03 0.00 0.08 0.00 0.00 32.23 32.73 3hpc h LYS 105 CO 0.03 0.95 0.44 0.52 -0.57 0.00 0.00 179.45 180.81 3hpc h MET 106 N 0.80 0.86 0.09 3.15 2.86 -0.67 0.11 114.93 122.14 3hpc h MET 106 Ca 0.13 -0.05 0.01 0.00 -2.06 0.00 0.00 59.70 57.73 3hpc h MET 106 Cb 0.63 -0.19 -0.02 0.00 0.06 0.00 0.00 31.60 32.07 3hpc h MET 106 CO 0.04 0.57 -0.17 1.96 1.06 0.00 0.00 176.91 180.37 3hpc h GLN 107 N 0.89 -0.32 -0.33 1.72 1.08 -1.00 -0.99 115.11 116.16 3hpc h GLN 107 Ca 0.25 0.02 0.00 0.00 -1.45 0.00 0.00 58.65 57.47 3hpc h GLN 107 Cb -0.09 0.07 -0.02 0.00 -0.05 0.00 0.00 27.48 27.40 3hpc h GLN 107 CO -0.06 -0.21 0.22 0.87 -0.95 0.00 0.00 178.83 178.69 3hpc h LYS 108 N -0.33 0.43 -0.25 1.46 1.57 -1.21 -1.83 116.57 116.41 3hpc h LYS 108 Ca 0.03 -0.03 0.06 0.00 -1.87 0.00 0.00 60.65 58.84 3hpc h LYS 108 Cb 0.35 -0.10 -0.07 0.00 0.08 0.00 0.00 32.23 32.50 3hpc h LYS 108 CO -0.10 0.29 -0.18 1.25 -0.57 0.00 0.00 179.45 180.14 3hpc h LEU 109 N 0.44 -0.59 -1.48 2.94 5.85 -0.83 -2.05 115.31 119.60 3hpc h LEU 109 Ca 0.12 0.12 0.09 0.00 0.84 0.00 0.00 57.88 59.05 3hpc h LEU 109 Cb -0.04 0.30 -0.04 0.00 0.37 0.00 0.00 40.66 41.24 3hpc h LEU 109 CO -0.03 -0.22 0.46 1.23 -0.34 0.00 0.00 178.44 179.54 3hpc h GLY 110 N -0.17 0.83 2.00 3.75 0.00 -0.40 0.13 103.07 109.21 3hpc h GLY 110 Ca 0.14 -0.25 -0.03 0.00 0.00 0.00 0.00 47.33 47.19 3hpc h GLY 110 CO -0.35 0.15 -0.16 0.83 0.00 0.00 0.00 176.54 177.01 3hpc h GLU 111 N 0.60 0.00 -0.65 4.80 5.08 -0.69 -3.11 114.58 120.61 3hpc h GLU 111 Ca 0.32 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.68 3hpc h GLU 111 Cb 0.44 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.69 3hpc h GLU 111 CO -0.11 0.16 0.00 0.41 -1.00 0.00 0.00 179.01 178.47 3hpc n GLY 112 N 0.13 2.31 0.23 -3.84 0.00 0.42 -4.56 105.19 99.88 3hpc n GLY 112 Ca 0.00 -0.79 -0.04 0.00 0.00 0.00 0.00 46.02 45.19 3hpc n GLY 112 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3hpc h GLU 113 N 4.39 0.62 0.00 1.61 4.81 -1.44 0.12 114.58 124.69 3hpc h GLU 113 Ca 0.00 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.19 3hpc h GLU 113 Cb 1.00 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 30.24 3hpc h GLU 113 CO 0.00 0.41 0.00 0.78 -0.73 0.00 0.00 179.01 179.47 3hpc h GLY 114 N 0.64 0.00 -0.81 1.92 0.00 -1.86 -3.05 103.07 99.92 3hpc h GLY 114 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.56 3hpc h GLY 114 CO -0.12 0.00 -0.52 1.44 0.00 0.00 0.00 176.54 177.34 3hpc n SER 115 N -2.54 1.80 -4.38 0.19 7.64 0.02 -4.96 113.62 111.39 3hpc n SER 115 Ca -0.01 -1.40 -0.20 0.00 1.01 0.00 0.00 58.87 58.27 3hpc n SER 115 Cb 0.08 0.55 -0.10 0.00 -1.01 0.00 0.00 64.21 63.73 3hpc n SER 115 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3hpc s MET 116 N -2.42 1.43 0.79 1.43 0.00 -1.15 -5.14 119.30 114.24 3hpc s MET 116 Ca 0.16 -1.68 -0.12 0.00 0.00 0.00 0.00 55.69 54.05 3hpc s MET 116 Cb 0.17 -1.12 0.07 0.00 0.00 0.00 0.00 34.83 33.94 3hpc s MET 116 CO 0.58 0.12 1.13 0.95 0.00 0.00 0.00 175.02 177.79 3hpc s THR 117 N -3.00 2.76 0.28 3.16 -4.23 -1.26 -4.81 115.64 108.54 3hpc s THR 117 Ca 0.26 0.28 -0.03 0.00 -1.18 0.00 0.00 61.69 61.02 3hpc s THR 117 Cb 0.01 -2.64 0.27 0.00 1.34 0.00 0.00 72.50 71.48 3hpc s THR 117 CO 0.09 -0.29 1.93 0.11 -0.54 0.00 0.00 174.62 175.92 3hpc h LYS 118 N -1.06 1.15 -0.23 3.99 1.79 -1.99 -0.84 116.57 119.38 3hpc h LYS 118 Ca -0.44 -0.07 -0.01 0.00 -2.18 0.00 0.00 60.65 57.94 3hpc h LYS 118 Cb 1.25 -0.26 -0.01 0.00 -1.58 0.00 0.00 32.23 31.64 3hpc h LYS 118 CO 0.48 0.76 0.10 1.49 -1.08 0.00 0.00 179.45 181.20 3hpc h GLU 119 N 1.18 0.34 -0.41 3.15 4.81 -1.99 -0.80 114.58 120.86 3hpc h GLU 119 Ca 0.36 -0.06 -0.05 0.00 -0.13 0.00 0.00 59.36 59.49 3hpc h GLU 119 Cb -0.02 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.28 3hpc h GLU 119 CO -0.10 0.38 0.08 1.49 -0.73 0.00 0.00 179.01 180.12 3hpc h GLU 120 N 0.23 0.67 -0.06 1.92 4.57 -1.83 -1.38 114.58 118.70 3hpc h GLU 120 Ca 0.08 -0.18 0.01 0.00 -1.18 0.00 0.00 59.36 58.09 3hpc h GLU 120 Cb 0.16 -0.08 -0.01 0.00 -0.16 0.00 0.00 28.75 28.66 3hpc h GLU 120 CO -0.01 0.71 -0.00 0.35 -1.18 0.00 0.00 179.01 178.88 3hpc h PHE 121 N 0.53 -0.01 -0.41 0.92 3.57 -1.09 -1.12 116.94 119.32 3hpc h PHE 121 Ca 0.13 0.00 -0.04 0.00 3.53 0.00 0.00 57.97 61.59 3hpc h PHE 121 Cb 0.36 0.01 -0.02 0.00 2.79 0.00 0.00 35.95 39.09 3hpc h PHE 121 CO 0.02 -0.01 0.09 0.00 -2.23 0.00 0.00 178.31 176.18 3hpc h ALA 122 N 1.05 1.38 -0.29 2.41 0.00 -0.88 0.12 119.26 123.06 3hpc h ALA 122 Ca 0.03 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 54.72 3hpc h ALA 122 Cb 0.03 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 3hpc h ALA 122 CO -0.05 0.44 0.01 -0.22 0.00 0.00 0.00 179.25 179.43 3hpc h LYS 123 N 0.60 0.50 -0.30 0.00 3.64 -1.00 -2.06 116.57 117.96 3hpc h LYS 123 Ca 0.14 -0.15 -0.12 0.00 -1.27 0.00 0.00 60.65 59.24 3hpc h LYS 123 Cb 0.25 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.01 3hpc h LYS 123 CO -0.00 0.64 -0.31 0.52 -2.27 0.00 0.00 179.45 178.03 3hpc h MET 124 N 0.30 0.63 -0.11 1.90 2.86 -0.79 -1.49 114.93 118.23 3hpc h MET 124 Ca 0.08 -0.28 0.01 0.00 -2.06 0.00 0.00 59.70 57.45 3hpc h MET 124 Cb 0.41 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 32.04 3hpc h MET 124 CO 0.01 0.86 0.04 -0.22 1.06 0.00 0.00 176.91 178.66 3hpc h LYS 125 N 0.53 0.09 -0.26 1.72 3.64 -0.68 -0.78 116.57 120.84 3hpc h LYS 125 Ca 0.06 -0.01 -0.07 0.00 -1.27 0.00 0.00 60.65 59.36 3hpc h LYS 125 Cb 0.80 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.58 3hpc h LYS 125 CO 0.07 0.06 -0.16 0.37 -2.27 0.00 0.00 179.45 177.51 3hpc h GLN 126 N 0.09 0.44 -0.27 1.90 4.15 -1.16 -1.32 115.11 118.94 3hpc h GLN 126 Ca 0.05 -0.13 -0.03 0.00 0.77 0.00 0.00 58.65 59.31 3hpc h GLN 126 Cb 0.02 -0.04 -0.01 0.00 0.21 0.00 0.00 27.48 27.66 3hpc h GLN 126 CO -0.04 0.60 0.07 0.93 -1.93 0.00 0.00 178.83 178.46 3hpc h GLU 127 N 0.41 0.43 -0.33 1.69 5.08 -0.89 -1.15 114.58 119.82 3hpc h GLU 127 Ca 0.07 -0.10 -0.07 0.00 -1.00 0.00 0.00 59.36 58.26 3hpc h GLU 127 Cb 0.53 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.70 3hpc h GLU 127 CO 0.03 0.51 -0.09 -0.07 -1.00 0.00 0.00 179.01 178.39 3hpc h LEU 128 N 0.27 0.53 -0.86 1.33 3.38 -0.96 -1.64 115.31 117.37 3hpc h LEU 128 Ca 0.09 -0.13 -0.09 0.00 0.09 0.00 0.00 57.88 57.83 3hpc h LEU 128 Cb 0.27 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.86 3hpc h LEU 128 CO -0.00 0.67 -0.11 -0.33 0.09 0.00 0.00 178.44 178.75 3hpc h GLU 129 N 0.51 0.73 -0.65 1.13 5.08 -0.97 -0.30 114.58 120.12 3hpc h GLU 129 Ca 0.10 -0.24 -0.06 0.00 -1.00 0.00 0.00 59.36 58.16 3hpc h GLU 129 Cb 0.47 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.63 3hpc h GLU 129 CO 0.03 0.82 0.17 0.00 -1.00 0.00 0.00 179.01 179.03 3hpc h ALA 130 N 1.21 1.08 -0.01 3.43 0.00 -0.73 -0.72 119.26 123.51 3hpc h ALA 130 Ca 0.11 -0.22 -0.11 0.00 0.00 0.00 0.00 54.91 54.69 3hpc h ALA 130 Cb 0.57 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 3hpc h ALA 130 CO 0.04 0.62 -0.51 0.93 0.00 0.00 0.00 179.25 180.32 3hpc h GLU 131 N 0.97 0.03 -0.04 0.00 5.08 -0.85 -0.65 114.58 119.12 3hpc h GLU 131 Ca 0.21 -0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.53 3hpc h GLU 131 Cb 0.32 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.57 3hpc h GLU 131 CO -0.00 0.54 -0.04 -0.92 -1.00 0.00 0.00 179.01 177.59 3hpc h TYR 132 N 0.03 0.12 -0.68 4.33 5.03 -0.71 -2.56 116.97 122.54 3hpc h TYR 132 Ca -0.00 -0.04 0.03 0.00 2.58 0.00 0.00 58.73 61.30 3hpc h TYR 132 Cb 0.92 -0.03 -0.04 0.00 1.55 0.00 0.00 36.73 39.14 3hpc h TYR 132 CO 0.00 0.57 0.45 -0.07 -1.32 0.00 0.00 178.16 177.79 3hpc h LEU 133 N -0.36 0.73 -0.50 2.82 3.38 -0.94 -0.95 115.31 119.48 3hpc h LEU 133 Ca 0.01 -0.01 -0.08 0.00 0.09 0.00 0.00 57.88 57.89 3hpc h LEU 133 Cb 0.55 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.11 3hpc h LEU 133 CO 0.01 0.51 0.01 0.00 0.09 0.00 0.00 178.44 179.06 3hpc h ALA 134 N 1.60 0.67 -0.77 1.53 0.00 -1.09 0.02 119.26 121.22 3hpc h ALA 134 Ca 0.27 -0.28 0.03 0.00 0.00 0.00 0.00 54.91 54.93 3hpc h ALA 134 Cb 0.02 -0.19 -0.05 0.00 0.00 0.00 0.00 17.79 17.58 3hpc h ALA 134 CO -0.07 0.47 0.49 0.28 0.00 0.00 0.00 179.25 180.42 3hpc h VAL 135 N 0.74 1.13 -0.14 0.00 2.07 -1.01 -1.73 116.25 117.31 3hpc h VAL 135 Ca 0.14 -0.33 -0.02 0.00 0.82 0.00 0.00 66.70 67.31 3hpc h VAL 135 Cb 0.50 0.07 -0.01 0.00 -1.52 0.00 0.00 31.29 30.34 3hpc h VAL 135 CO 0.02 0.18 0.01 0.15 0.02 0.00 0.00 177.57 177.95 3hpc h PHE 136 N 0.97 0.25 -0.92 1.57 3.04 -0.80 -1.51 116.94 119.53 3hpc h PHE 136 Ca 0.30 -0.04 0.03 0.00 3.98 0.00 0.00 57.97 62.24 3hpc h PHE 136 Cb -0.01 -0.07 -0.05 0.00 2.56 0.00 0.00 35.95 38.38 3hpc h PHE 136 CO -0.03 0.43 0.60 -0.22 -2.02 0.00 0.00 178.31 177.08 3hpc h LYS 137 N -0.01 1.15 -0.38 1.11 3.64 -0.96 -0.72 116.57 120.41 3hpc h LYS 137 Ca 0.04 -0.07 -0.04 0.00 -1.27 0.00 0.00 60.65 59.31 3hpc h LYS 137 Cb 0.33 -0.26 -0.02 0.00 -0.41 0.00 0.00 32.23 31.87 3hpc h LYS 137 CO 0.00 0.76 0.08 -0.22 -2.27 0.00 0.00 179.45 177.81 3hpc h LYS 138 N 1.18 0.61 -0.24 1.90 3.64 -0.96 0.56 116.57 123.25 3hpc h LYS 138 Ca 0.36 -0.15 -0.09 0.00 -1.27 0.00 0.00 60.65 59.50 3hpc h LYS 138 Cb -0.03 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 31.70 3hpc h LYS 138 CO -0.11 0.65 -0.24 0.00 -2.27 0.00 0.00 179.45 177.48 3hpc h THR 139 N 0.46 1.26 0.56 1.00 1.03 -0.83 -2.15 112.91 114.24 3hpc h THR 139 Ca 0.12 -1.23 -0.03 0.00 -0.01 0.00 0.00 66.41 65.26 3hpc h THR 139 Cb 0.32 1.34 0.01 0.00 -1.07 0.00 0.00 68.15 68.75 3hpc h THR 139 CO 0.00 0.39 -0.27 0.58 -0.01 0.00 0.00 175.52 176.21 3hpc h VAL 140 N 0.40 0.40 -0.99 0.00 2.07 -0.69 -1.61 116.25 115.83 3hpc h VAL 140 Ca 0.06 -0.21 0.12 0.00 0.82 0.00 0.00 66.70 67.49 3hpc h VAL 140 Cb 0.64 0.48 -0.08 0.00 -1.52 0.00 0.00 31.29 30.81 3hpc h VAL 140 CO 0.05 0.03 0.63 0.28 0.02 0.00 0.00 177.57 178.57 3hpc h SER 141 N -0.90 0.90 0.31 0.57 0.02 -0.76 0.83 113.55 114.52 3hpc h SER 141 Ca -0.08 0.05 -0.02 0.00 -0.84 0.00 0.00 61.79 60.90 3hpc h SER 141 Cb 0.63 -0.13 0.00 0.00 0.14 0.00 0.00 62.40 63.04 3hpc h SER 141 CO 0.13 0.47 -0.15 0.28 -1.14 0.00 0.00 176.83 176.42 3hpc h SER 142 N 0.96 -0.35 -0.97 3.07 0.02 -1.24 0.35 113.55 115.40 3hpc h SER 142 Ca 0.49 -0.09 0.14 0.00 -0.84 0.00 0.00 61.79 61.49 3hpc h SER 142 Cb 0.51 0.09 -0.09 0.00 0.14 0.00 0.00 62.40 63.05 3hpc h SER 142 CO -0.26 -0.12 0.59 0.45 -1.14 0.00 0.00 176.83 176.35 3hpc h HIS 143 N -0.57 1.06 -0.10 3.45 3.86 -0.97 -2.10 115.15 119.77 3hpc h HIS 143 Ca -0.04 0.03 -0.03 0.00 -1.16 0.00 0.00 60.37 59.17 3hpc h HIS 143 Cb 0.42 -0.33 -0.00 0.00 1.06 0.00 0.00 27.41 28.56 3hpc h HIS 143 CO -0.01 0.35 -0.05 1.49 0.86 0.00 0.00 177.93 180.57 3hpc h GLU 144 N 0.87 0.21 -0.82 2.45 4.81 -0.36 -3.06 114.58 118.68 3hpc h GLU 144 Ca 0.51 -0.09 0.09 0.00 -0.13 0.00 0.00 59.36 59.73 3hpc h GLU 144 Cb 0.61 -0.00 -0.07 0.00 0.63 0.00 0.00 28.75 29.92 3hpc h GLU 144 CO -0.31 0.57 0.47 0.28 -0.73 0.00 0.00 179.01 179.29 3hpc h VAL 145 N -0.16 0.93 -0.46 0.32 2.07 -0.06 -0.51 116.25 118.38 3hpc h VAL 145 Ca 0.02 -0.28 0.08 0.00 0.82 0.00 0.00 66.70 67.34 3hpc h VAL 145 Cb 0.51 0.05 -0.07 0.00 -1.52 0.00 0.00 31.29 30.27 3hpc h VAL 145 CO 0.02 0.15 0.08 0.15 0.02 0.00 0.00 177.57 177.98 3hpc h PHE 146 N 0.81 0.12 -0.44 1.57 3.57 -1.37 0.15 116.94 121.36 3hpc h PHE 146 Ca 0.39 0.03 -0.14 0.00 3.53 0.00 0.00 57.97 61.77 3hpc h PHE 146 Cb 0.32 0.02 -0.01 0.00 2.79 0.00 0.00 35.95 39.06 3hpc h PHE 146 CO -0.06 -0.01 -0.29 -0.07 -2.23 0.00 0.00 178.31 175.65 3hpc h LEU 147 N 0.21 1.00 -0.68 0.59 3.38 -1.26 -1.91 115.31 116.64 3hpc h LEU 147 Ca 0.23 -0.41 -0.12 0.00 0.09 0.00 0.00 57.88 57.67 3hpc h LEU 147 Cb 0.30 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.76 3hpc h LEU 147 CO -0.31 1.21 -0.23 1.56 0.09 0.00 0.00 178.44 180.76 3hpc h GLN 148 N 0.81 0.78 -0.82 1.13 4.20 -0.63 -0.51 115.11 120.07 3hpc h GLN 148 Ca 0.09 -0.32 0.01 0.00 0.06 0.00 0.00 58.65 58.49 3hpc h GLN 148 Cb 0.87 -0.03 -0.04 0.00 0.30 0.00 0.00 27.48 28.58 3hpc h GLN 148 CO 0.08 0.93 0.53 0.00 -0.67 0.00 0.00 178.83 179.70 3hpc h ARG 149 N 0.68 1.08 -0.61 1.46 3.08 -0.54 -2.41 114.38 117.13 3hpc h ARG 149 Ca 0.09 -0.07 -0.03 0.00 0.07 0.00 0.00 59.98 60.04 3hpc h ARG 149 Cb 0.74 -0.24 -0.03 0.00 0.08 0.00 0.00 29.97 30.53 3hpc h ARG 149 CO 0.06 0.73 0.27 -0.07 -1.07 0.00 0.00 179.97 179.89 3hpc h LEU 150 N 1.11 0.81 -1.76 3.04 3.38 -1.05 -3.00 115.31 117.83 3hpc h LEU 150 Ca 0.30 -0.15 -0.03 0.00 0.09 0.00 0.00 57.88 58.09 3hpc h LEU 150 Cb -0.11 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 40.43 3hpc h LEU 150 CO -0.06 0.74 -0.15 0.77 0.09 0.00 0.00 178.44 179.82 3hpc h SER 151 N 0.84 0.00 0.23 -0.43 4.64 -0.63 -2.16 113.55 116.04 3hpc h SER 151 Ca 0.21 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.53 3hpc h SER 151 Cb 0.16 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.25 3hpc h SER 151 CO -0.02 0.15 -0.27 -1.54 -0.87 0.00 0.00 176.83 174.28 3hpc n SER 152 N -4.14 1.05 -4.71 4.97 3.41 -0.95 -4.73 113.62 108.52 3hpc n SER 152 Ca -0.02 -0.90 -0.40 0.00 -0.26 0.00 0.00 58.87 57.28 3hpc n SER 152 Cb 0.23 0.15 -0.04 0.00 -0.26 0.00 0.00 64.21 64.29 3hpc n SER 152 CO 0.00 0.00 0.00 -2.28 -0.16 0.00 0.00 175.04 172.60 3hpc s HIS 153 N -2.51 3.59 -0.08 7.33 5.04 -0.83 -4.94 115.29 122.89 3hpc s HIS 153 Ca 0.24 1.36 0.30 0.00 -1.54 0.00 0.00 55.06 55.43 3hpc s HIS 153 Cb 0.19 -2.89 1.28 0.00 0.04 0.00 0.00 32.58 31.20 3hpc s HIS 153 CO 0.53 0.05 1.90 -1.00 -2.34 0.00 0.00 174.74 173.88 3hpc h PRO 154 N 6.79 0.00 0.00 2.88 0.13 -1.89 -1.50 132.00 138.41 3hpc h PRO 154 Ca -0.41 0.00 -0.30 0.00 -0.87 0.00 0.00 66.00 64.42 3hpc h PRO 154 Cb 1.20 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.29 3hpc h PRO 154 CO 0.76 0.00 -1.96 0.28 -0.23 0.00 0.00 178.00 176.85 3hpc n VAL 155 N -2.77 1.35 0.17 1.56 0.31 -1.26 -4.58 118.33 113.11 3hpc n VAL 155 Ca 0.01 -0.20 0.04 0.00 -0.01 0.00 0.00 64.34 64.17 3hpc n VAL 155 Cb 0.26 -1.93 0.43 0.00 -0.91 0.00 0.00 33.84 31.69 3hpc n VAL 155 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 3hpc h LEU 156 N -0.86 0.10 -2.10 7.52 3.38 -1.83 -1.25 115.31 120.28 3hpc h LEU 156 Ca -0.45 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.50 3hpc h LEU 156 Cb 1.36 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 42.08 3hpc h LEU 156 CO -0.27 0.30 0.00 0.77 0.09 0.00 0.00 178.44 179.33 3hpc h SER 157 N 0.10 0.00 0.05 -0.43 4.64 -1.09 -1.91 113.55 114.92 3hpc h SER 157 Ca 0.02 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.34 3hpc h SER 157 Cb 0.39 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.48 3hpc h SER 157 CO 0.03 0.00 -0.24 0.29 -0.87 0.00 0.00 176.83 176.04 3hpc n LYS 158 N -2.74 1.40 -2.18 4.77 5.02 -0.47 -4.84 118.16 119.12 3hpc n LYS 158 Ca -0.02 -1.03 -0.42 0.00 -2.02 0.00 0.00 58.31 54.83 3hpc n LYS 158 Cb 0.10 -1.48 -0.03 0.00 -0.02 0.00 0.00 35.03 33.60 3hpc n LYS 158 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 3hpc s ASP 159 N -2.31 6.84 0.34 4.39 2.15 -0.72 -4.90 116.67 122.46 3hpc s ASP 159 Ca 0.25 2.38 0.01 0.00 0.43 0.00 0.00 52.55 55.63 3hpc s ASP 159 Cb 0.19 -2.60 0.59 0.00 -0.30 0.00 0.00 42.92 40.80 3hpc s ASP 159 CO 0.46 -0.60 2.00 -0.09 -0.17 0.00 0.00 175.17 176.77 3hpc h ARG 160 N 6.05 0.90 -0.35 4.34 1.12 -1.93 -0.71 114.38 123.80 3hpc h ARG 160 Ca -0.44 -0.05 -0.12 0.00 -1.11 0.00 0.00 59.98 58.26 3hpc h ARG 160 Cb 1.21 -0.20 -0.01 0.00 -0.01 0.00 0.00 29.97 30.96 3hpc h ARG 160 CO 0.82 0.60 -0.26 -0.91 -3.11 0.00 0.00 179.97 177.10 3hpc h ASN 161 N 0.93 0.74 -0.50 -3.80 2.35 -1.97 -0.84 115.58 112.49 3hpc h ASN 161 Ca 0.26 -0.28 -0.01 0.00 -0.55 0.00 0.00 56.30 55.72 3hpc h ASN 161 Cb -0.09 -0.20 -0.02 0.00 0.05 0.00 0.00 38.32 38.06 3hpc h ASN 161 CO -0.06 0.97 0.28 0.15 -1.65 0.00 0.00 177.43 177.12 3hpc h PHE 162 N 0.62 0.69 -0.36 1.19 3.57 -1.73 0.00 116.94 120.92 3hpc h PHE 162 Ca 0.08 -0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.59 3hpc h PHE 162 Cb 0.77 -0.22 -0.03 0.00 2.79 0.00 0.00 35.95 39.26 3hpc h PHE 162 CO 0.04 0.50 0.19 0.45 -2.23 0.00 0.00 178.31 177.26 3hpc h HIS 163 N 0.67 0.34 -0.53 0.41 3.86 -0.79 -1.49 115.15 117.62 3hpc h HIS 163 Ca 0.18 0.01 0.01 0.00 -1.16 0.00 0.00 60.37 59.41 3hpc h HIS 163 Cb 0.04 -0.10 -0.03 0.00 1.06 0.00 0.00 27.41 28.38 3hpc h HIS 163 CO -0.02 0.19 0.35 0.28 0.86 0.00 0.00 177.93 179.59 3hpc h VAL 164 N 0.38 1.14 -0.96 2.45 2.07 -0.93 -1.00 116.25 119.41 3hpc h VAL 164 Ca 0.15 -0.25 0.11 0.00 0.82 0.00 0.00 66.70 67.53 3hpc h VAL 164 Cb 0.05 0.36 -0.08 0.00 -1.52 0.00 0.00 31.29 30.09 3hpc h VAL 164 CO -0.10 0.13 0.59 0.15 0.02 0.00 0.00 177.57 178.37 3hpc h PHE 165 N 0.72 1.07 0.02 1.57 3.57 -0.51 -0.86 116.94 122.51 3hpc h PHE 165 Ca 0.19 0.03 -0.20 0.00 3.53 0.00 0.00 57.97 61.52 3hpc h PHE 165 Cb -0.08 -0.34 -0.01 0.00 2.79 0.00 0.00 35.95 38.31 3hpc h PHE 165 CO -0.04 0.43 -0.93 -0.07 -2.23 0.00 0.00 178.31 175.47 3hpc h LEU 166 N 0.95 0.19 0.00 0.59 3.38 -0.77 -3.41 115.31 116.24 3hpc h LEU 166 Ca 0.47 -0.16 -0.18 0.00 0.09 0.00 0.00 57.88 58.10 3hpc h LEU 166 Cb 0.45 -0.06 -0.03 0.00 0.09 0.00 0.00 40.66 41.11 3hpc h LEU 166 CO -0.26 1.01 -1.67 -0.62 0.09 0.00 0.00 178.44 176.99 3hpc n GLU 167 N -3.58 2.34 -2.65 1.13 1.02 -0.43 -4.45 120.64 114.02 3hpc n GLU 167 Ca -0.03 -0.01 -0.43 0.00 -0.02 0.00 0.00 57.16 56.67 3hpc n GLU 167 Cb 0.85 -1.25 -0.03 0.00 -0.02 0.00 0.00 31.44 30.99 3hpc n GLU 167 CO 0.00 0.00 0.00 -0.47 1.18 0.00 0.00 177.13 177.84 3hpc s TYR 168 N -2.25 2.80 -1.34 -0.32 5.04 -0.36 -4.92 117.35 115.99 3hpc s TYR 168 Ca -0.05 0.56 -0.06 0.00 -2.44 0.00 0.00 57.07 55.07 3hpc s TYR 168 Cb 0.03 -4.35 0.06 0.00 0.35 0.00 0.00 41.96 38.05 3hpc s TYR 168 CO 0.40 -1.30 2.57 -3.47 -1.34 0.00 0.00 175.55 172.41 3hpc n ASP 169 N 7.80 8.12 -4.18 4.32 2.03 -1.26 -4.82 116.55 128.56 3hpc n ASP 169 Ca 0.10 -3.00 -0.11 0.00 0.52 0.00 0.00 54.79 52.30 3hpc n ASP 169 Cb 0.49 -1.40 -0.10 0.00 -0.72 0.00 0.00 41.12 39.38 3hpc n ASP 169 CO 0.00 0.00 0.00 -1.10 -1.92 0.00 0.00 177.20 174.18 3hpc s GLN 170 N -0.34 1.05 -0.66 -0.67 -1.52 -1.26 -5.01 119.66 111.25 3hpc s GLN 170 Ca 0.58 -1.52 -0.27 0.00 -1.95 0.00 0.00 55.36 52.20 3hpc s GLN 170 Cb 0.19 0.16 0.02 0.00 -0.22 0.00 0.00 33.01 33.16 3hpc s GLN 170 CO -0.09 -0.28 1.35 0.34 -0.25 0.00 0.00 175.29 176.36 3hpc s ASP 171 N -3.11 6.12 0.53 5.90 -1.08 -1.26 -4.90 116.67 118.87 3hpc s ASP 171 Ca 0.29 -0.12 0.26 0.00 -0.52 0.00 0.00 52.55 52.46 3hpc s ASP 171 Cb 0.07 -2.55 1.40 0.00 -1.46 0.00 0.00 42.92 40.38 3hpc s ASP 171 CO 0.05 -1.80 1.98 -0.07 0.52 0.00 0.00 175.17 175.86 3hpc h LEU 172 N 13.17 0.01 -0.06 -1.34 3.38 -1.91 -3.20 115.31 125.37 3hpc h LEU 172 Ca -0.27 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.67 3hpc h LEU 172 Cb 1.07 -0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.82 3hpc h LEU 172 CO 1.24 0.00 -0.09 0.77 0.09 0.00 0.00 178.44 180.44 3hpc h SER 173 N 0.01 0.18 -0.00 -0.43 4.64 -1.98 -3.51 113.55 112.46 3hpc h SER 173 Ca 0.28 -0.54 0.00 0.00 -0.47 0.00 0.00 61.79 61.05 3hpc h SER 173 Cb 1.10 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 63.14 3hpc h SER 173 CO -0.00 0.69 0.00 1.33 -0.87 0.00 0.00 176.83 177.98