#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hbp n LYS 4 N 0.00 -3.51 -1.68 1.97 4.76 -1.26 -4.86 118.16 113.58 2hbp n LYS 4 Ca 0.00 2.72 -0.49 0.00 -2.87 0.00 0.00 58.31 57.68 2hbp n LYS 4 Cb 0.00 -3.53 -0.05 0.00 -1.84 0.00 0.00 35.03 29.62 2hbp n LYS 4 CO 0.00 0.00 0.00 -1.13 -1.37 0.00 0.00 177.40 174.90 2hbp n SER 5 N 1.25 3.19 -3.94 4.39 3.41 -1.26 -4.77 113.62 115.89 2hbp n SER 5 Ca -0.07 1.02 -0.25 0.00 -0.26 0.00 0.00 58.87 59.30 2hbp n SER 5 Cb 0.11 -1.36 -0.06 0.00 -0.26 0.00 0.00 64.21 62.64 2hbp n SER 5 CO 0.00 0.00 0.00 -2.11 -0.16 0.00 0.00 175.04 172.77 2hbp n ARG 6 N 5.50 0.72 -2.94 4.33 1.85 0.17 -4.38 116.66 121.90 2hbp n ARG 6 Ca 0.21 -3.22 -0.43 0.00 -1.00 0.00 0.00 57.85 53.41 2hbp n ARG 6 Cb 0.27 1.40 -0.05 0.00 -1.05 0.00 0.00 32.46 33.04 2hbp n ARG 6 CO 0.00 0.00 0.00 -1.17 -0.01 0.00 0.00 177.63 176.45 2hbp s LEU 7 N 0.00 4.37 -0.02 2.89 1.98 -1.26 0.34 118.68 126.98 2hbp s LEU 7 Ca 0.12 -0.53 -0.13 0.00 -2.89 0.00 0.00 54.13 50.69 2hbp s LEU 7 Cb 0.01 -2.71 -0.05 0.00 0.66 0.00 0.00 46.19 44.10 2hbp s LEU 7 CO 0.08 -1.13 0.36 0.26 -1.89 0.00 0.00 176.35 174.04 2hbp s TRP 8 N 3.55 3.70 0.01 5.38 0.52 0.18 -4.89 118.94 127.38 2hbp s TRP 8 Ca 0.26 0.91 0.04 0.00 0.02 0.00 0.00 56.10 57.33 2hbp s TRP 8 Cb -0.15 -2.23 -0.01 0.00 -1.15 0.00 0.00 33.47 29.93 2hbp s TRP 8 CO 0.17 0.65 -0.14 0.08 0.02 0.00 0.00 176.95 177.73 2hbp s VAL 9 N -1.02 1.08 0.70 4.03 1.01 -1.26 -1.13 120.40 123.81 2hbp s VAL 9 Ca 0.22 -0.72 -0.13 0.00 0.00 0.00 0.00 61.98 61.35 2hbp s VAL 9 Cb -0.16 -0.93 0.02 0.00 0.00 0.00 0.00 36.38 35.31 2hbp s VAL 9 CO 0.12 0.20 1.09 -0.62 0.00 0.00 0.00 175.10 175.89 2hbp s ASP 10 N -0.60 4.93 0.26 3.32 -1.08 -0.21 -0.66 116.67 122.63 2hbp s ASP 10 Ca 0.04 1.88 0.14 0.00 -0.52 0.00 0.00 52.55 54.09 2hbp s ASP 10 Cb -0.06 -2.53 0.07 0.00 -1.46 0.00 0.00 42.92 38.94 2hbp s ASP 10 CO 0.00 -1.75 1.44 -0.09 0.52 0.00 0.00 175.17 175.30 2hbp h ARG 11 N -0.48 0.00 -0.54 4.34 9.65 0.42 -2.30 114.38 125.47 2hbp h ARG 11 Ca -0.45 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.43 2hbp h ARG 11 Cb 1.23 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.81 2hbp h ARG 11 CO 0.53 0.57 0.00 -1.13 2.80 0.00 0.00 179.97 182.74 2hbp n SER 12 N -3.27 3.66 -1.06 -3.80 3.41 -1.26 -4.94 113.62 106.37 2hbp n SER 12 Ca 0.02 -2.00 -0.09 0.00 -0.26 0.00 0.00 58.87 56.54 2hbp n SER 12 Cb 0.75 -0.36 -0.01 0.00 -0.26 0.00 0.00 64.21 64.34 2hbp n SER 12 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2hbp n GLY 13 N 1.58 0.01 0.28 5.00 0.00 -0.87 -4.94 105.19 106.26 2hbp n GLY 13 Ca 0.22 -0.50 -0.12 0.00 0.00 0.00 0.00 46.02 45.62 2hbp n GLY 13 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2hbp h THR 14 N 0.00 1.27 -2.92 2.61 2.02 -1.92 -3.46 112.91 110.50 2hbp h THR 14 Ca -0.22 -1.39 -0.11 0.00 0.77 0.00 0.00 66.41 65.46 2hbp h THR 14 Cb 1.15 1.14 -0.20 0.00 -1.74 0.00 0.00 68.15 68.50 2hbp h THR 14 CO 0.26 0.48 -0.22 0.72 0.37 0.00 0.00 175.52 177.13 2hbp s PHE 15 N -4.66 -0.23 -0.04 3.16 -0.12 -1.26 -5.00 117.98 109.83 2hbp s PHE 15 Ca -0.11 0.35 0.02 0.00 -0.05 0.00 0.00 56.93 57.14 2hbp s PHE 15 Cb 0.12 0.13 0.01 0.00 -0.63 0.00 0.00 43.02 42.66 2hbp s PHE 15 CO 0.87 -0.42 -0.08 0.15 -0.05 0.00 0.00 175.22 175.69 2hbp s LYS 16 N -1.37 1.05 -0.05 1.99 1.02 -1.26 -1.05 119.74 120.09 2hbp s LYS 16 Ca -0.13 -0.24 -0.10 0.00 0.02 0.00 0.00 55.97 55.52 2hbp s LYS 16 Cb -0.04 -0.97 0.02 0.00 -0.52 0.00 0.00 37.83 36.32 2hbp s LYS 16 CO 0.05 0.02 0.24 0.14 -0.92 0.00 0.00 175.35 174.87 2hbp s VAL 17 N 0.57 0.04 -0.40 3.17 -7.23 -0.28 -4.95 120.40 111.31 2hbp s VAL 17 Ca -0.09 -0.32 -0.19 0.00 -1.81 0.00 0.00 61.98 59.57 2hbp s VAL 17 Cb -0.12 -0.45 0.01 0.00 0.56 0.00 0.00 36.38 36.38 2hbp s VAL 17 CO 0.01 -0.18 0.55 1.51 -0.31 0.00 0.00 175.10 176.68 2hbp s ASP 18 N -0.69 6.30 0.26 4.85 -4.77 -1.24 0.47 116.67 121.84 2hbp s ASP 18 Ca -0.08 -0.27 -0.21 0.00 -3.30 0.00 0.00 52.55 48.68 2hbp s ASP 18 Cb -0.04 -2.28 0.03 0.00 -1.09 0.00 0.00 42.92 39.54 2hbp s ASP 18 CO 0.02 -0.61 0.72 0.00 0.70 0.00 0.00 175.17 175.99 2hbp s ALA 19 N 2.50 -1.28 -0.01 2.11 0.00 0.15 -1.67 121.76 123.55 2hbp s ALA 19 Ca 0.19 -0.20 0.06 0.00 0.00 0.00 0.00 51.96 52.00 2hbp s ALA 19 Cb -0.15 0.84 -0.01 0.00 0.00 0.00 0.00 23.12 23.80 2hbp s ALA 19 CO 0.15 -1.01 -0.18 -2.00 0.00 0.00 0.00 175.76 172.72 2hbp s GLU 20 N -3.87 1.48 0.05 0.00 -6.30 0.50 0.42 118.70 110.97 2hbp s GLU 20 Ca 0.10 -0.65 -0.31 0.00 -2.50 0.00 0.00 54.97 51.62 2hbp s GLU 20 Cb -0.05 -1.43 -0.06 0.00 0.00 0.00 0.00 34.13 32.59 2hbp s GLU 20 CO 0.05 0.39 1.32 0.12 0.02 0.00 0.00 175.26 177.16 2hbp s PHE 21 N -0.42 3.17 -0.18 5.30 5.36 -1.26 0.34 117.98 130.29 2hbp s PHE 21 Ca 0.07 1.03 -0.06 0.00 -0.96 0.00 0.00 56.93 57.01 2hbp s PHE 21 Cb -0.07 -3.58 -0.09 0.00 -0.34 0.00 0.00 43.02 38.94 2hbp s PHE 21 CO -0.01 -2.00 -0.21 -0.89 -1.46 0.00 0.00 175.22 170.66 2hbp n ILE 22 N 4.23 0.99 -3.65 3.12 5.41 0.58 -4.90 119.36 125.14 2hbp n ILE 22 Ca 0.11 -0.29 -0.14 0.00 1.00 0.00 0.00 62.75 63.44 2hbp n ILE 22 Cb 0.44 -1.55 -0.06 0.00 -0.71 0.00 0.00 39.64 37.76 2hbp n ILE 22 CO 0.00 0.00 0.00 -0.83 0.00 0.00 0.00 176.55 175.72 2hbp s GLY 23 N -5.43 -0.31 -0.10 7.39 0.00 -1.16 -5.03 107.32 102.68 2hbp s GLY 23 Ca -0.25 0.46 0.01 0.00 0.00 0.00 0.00 44.72 44.94 2hbp s GLY 23 CO 0.34 0.19 -0.11 0.00 0.00 0.00 0.00 173.10 173.52 2hbp s ALA 25 N -0.11 2.30 -1.82 0.00 0.00 -0.02 -4.82 121.76 117.30 2hbp s ALA 25 Ca -0.01 -2.29 0.00 0.00 0.00 0.00 0.00 51.96 49.66 2hbp s ALA 25 Cb -0.14 -1.84 0.00 0.00 0.00 0.00 0.00 23.12 21.14 2hbp s ALA 25 CO 0.03 -1.77 0.00 1.63 0.00 0.00 0.00 175.76 175.65 2hbp n LYS 26 N 4.25 -1.57 0.00 0.00 4.76 -1.26 -0.31 118.16 124.04 2hbp n LYS 26 Ca 0.03 1.02 0.00 0.00 -2.87 0.00 0.00 58.31 56.48 2hbp n LYS 26 Cb 0.40 -5.47 0.00 0.00 -1.84 0.00 0.00 35.03 28.11 2hbp n LYS 26 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2hbp n GLY 27 N -0.57 0.98 3.94 0.72 0.00 -1.26 -5.07 105.19 103.92 2hbp n GLY 27 Ca -0.20 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.58 2hbp n GLY 27 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2hbp s LYS 28 N -0.32 3.47 -0.25 1.61 1.02 0.58 -0.57 119.74 125.27 2hbp s LYS 28 Ca 0.00 -0.32 -0.03 0.00 0.02 0.00 0.00 55.97 55.64 2hbp s LYS 28 Cb 0.00 -2.64 0.02 0.00 -0.52 0.00 0.00 37.83 34.68 2hbp s LYS 28 CO 0.00 0.11 -0.04 0.42 -0.92 0.00 0.00 175.35 174.92 2hbp s ILE 29 N -2.35 3.09 -0.29 2.17 -1.09 0.35 -0.84 121.20 122.25 2hbp s ILE 29 Ca 0.41 -0.91 -0.23 0.00 -2.23 0.00 0.00 60.65 57.69 2hbp s ILE 29 Cb -0.10 -2.55 -0.00 0.00 -1.58 0.00 0.00 42.46 38.23 2hbp s ILE 29 CO 0.37 0.21 0.74 -1.00 -1.23 0.00 0.00 174.94 174.03 2hbp s HIS 30 N 1.37 3.23 -0.02 3.97 3.76 0.82 -1.50 115.29 126.92 2hbp s HIS 30 Ca 0.01 0.80 0.08 0.00 -0.15 0.00 0.00 55.06 55.80 2hbp s HIS 30 Cb -0.16 -3.11 -0.02 0.00 1.11 0.00 0.00 32.58 30.40 2hbp s HIS 30 CO -0.03 -0.50 -0.26 -0.51 -0.85 0.00 0.00 174.74 172.59 2hbp s LEU 31 N 2.82 2.05 -0.41 0.89 1.43 -0.36 -0.31 118.68 124.79 2hbp s LEU 31 Ca 0.30 -0.47 -0.16 0.00 -1.03 0.00 0.00 54.13 52.78 2hbp s LEU 31 Cb -0.15 -1.34 0.02 0.00 0.03 0.00 0.00 46.19 44.75 2hbp s LEU 31 CO 0.11 0.32 0.33 -2.28 0.23 0.00 0.00 176.35 175.06 2hbp s HIS 32 N -0.58 3.22 0.71 0.29 5.65 0.15 -0.33 115.29 124.40 2hbp s HIS 32 Ca 0.09 -0.54 -0.15 0.00 0.25 0.00 0.00 55.06 54.71 2hbp s HIS 32 Cb -0.10 -2.67 0.03 0.00 -1.18 0.00 0.00 32.58 28.66 2hbp s HIS 32 CO -0.01 -0.62 1.15 0.15 -0.65 0.00 0.00 174.74 174.77 2hbp s LYS 33 N 1.79 2.39 0.35 2.88 -0.14 0.28 -0.37 119.74 126.93 2hbp s LYS 33 Ca 0.07 1.55 0.24 0.00 -1.36 0.00 0.00 55.97 56.47 2hbp s LYS 33 Cb -0.19 -1.88 1.29 0.00 -1.68 0.00 0.00 37.83 35.37 2hbp s LYS 33 CO 0.11 -1.60 1.75 0.00 -0.76 0.00 0.00 175.35 174.85 2hbp h ALA 34 N -0.27 1.00 -0.48 5.17 0.00 -1.62 -0.10 119.26 122.97 2hbp h ALA 34 Ca -0.47 0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.37 2hbp h ALA 34 Cb 1.27 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 19.02 2hbp h ALA 34 CO 0.51 0.00 0.06 -1.71 0.00 0.00 0.00 179.25 178.12 2hbp n ASN 35 N -2.36 4.58 0.00 0.00 2.85 -1.26 -4.92 115.26 114.15 2hbp n ASN 35 Ca -0.01 -3.11 0.00 0.00 -0.11 0.00 0.00 54.58 51.35 2hbp n ASN 35 Cb 0.07 -0.65 0.00 0.00 1.24 0.00 0.00 39.78 40.44 2hbp n ASN 35 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2hbp n GLY 36 N -0.14 2.72 3.75 8.20 0.00 -0.05 -5.01 105.19 114.66 2hbp n GLY 36 Ca 0.29 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.98 2hbp n GLY 36 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2hbp s VAL 37 N -2.05 2.86 -0.12 1.61 1.01 -1.25 -4.69 120.40 117.76 2hbp s VAL 37 Ca 0.00 0.40 0.02 0.00 0.00 0.00 0.00 61.98 62.41 2hbp s VAL 37 Cb 0.00 -2.93 0.01 0.00 0.00 0.00 0.00 36.38 33.46 2hbp s VAL 37 CO 0.00 -0.24 -0.18 -0.75 0.00 0.00 0.00 175.10 173.92 2hbp s LYS 38 N -4.03 2.57 0.47 2.72 2.20 -1.26 0.10 119.74 122.51 2hbp s LYS 38 Ca 0.70 -0.69 0.03 0.00 -0.36 0.00 0.00 55.97 55.64 2hbp s LYS 38 Cb -0.24 -2.12 -0.03 0.00 -1.51 0.00 0.00 37.83 33.94 2hbp s LYS 38 CO 0.43 -0.03 0.03 0.96 -0.36 0.00 0.00 175.35 176.39 2hbp s ILE 39 N 0.87 1.14 -0.17 5.43 -4.36 0.55 -4.97 121.20 119.69 2hbp s ILE 39 Ca -0.08 -2.00 -0.05 0.00 -0.26 0.00 0.00 60.65 58.27 2hbp s ILE 39 Cb -0.15 -2.33 0.08 0.00 1.25 0.00 0.00 42.46 41.31 2hbp s ILE 39 CO -0.01 0.00 0.30 0.00 0.24 0.00 0.00 174.94 175.47 2hbp s ALA 40 N -2.95 -0.69 0.35 2.27 0.00 -1.26 -1.22 121.76 118.26 2hbp s ALA 40 Ca 0.14 0.91 0.09 0.00 0.00 0.00 0.00 51.96 53.10 2hbp s ALA 40 Cb 0.03 -1.22 -0.06 0.00 0.00 0.00 0.00 23.12 21.87 2hbp s ALA 40 CO 0.08 -0.85 -0.03 0.14 0.00 0.00 0.00 175.76 175.09 2hbp s VAL 41 N 2.46 2.39 -0.13 0.00 -7.23 -0.56 -4.95 120.40 112.37 2hbp s VAL 41 Ca 0.04 -2.08 -0.11 0.00 -1.81 0.00 0.00 61.98 58.02 2hbp s VAL 41 Cb -0.13 -2.74 -0.05 0.00 0.56 0.00 0.00 36.38 34.02 2hbp s VAL 41 CO -0.11 -0.18 0.24 0.00 -0.31 0.00 0.00 175.10 174.74 2hbp s ALA 42 N -2.58 3.71 -1.20 1.32 0.00 -1.26 0.13 121.76 121.88 2hbp s ALA 42 Ca 0.34 -0.51 0.11 0.00 0.00 0.00 0.00 51.96 51.90 2hbp s ALA 42 Cb 0.02 -2.23 0.51 0.00 0.00 0.00 0.00 23.12 21.42 2hbp s ALA 42 CO 0.18 0.32 1.30 0.00 0.00 0.00 0.00 175.76 177.56 2hbp n ALA 43 N 2.83 1.58 0.16 0.00 0.00 0.26 -3.34 120.51 122.00 2hbp n ALA 43 Ca -0.15 -0.04 0.02 0.00 0.00 0.00 0.00 53.44 53.26 2hbp n ALA 43 Cb 0.53 -1.18 0.24 0.00 0.00 0.00 0.00 19.45 19.04 2hbp n ALA 43 CO 0.00 0.00 0.00 0.38 0.00 0.00 0.00 177.50 177.88 2hbp h ASP 44 N 0.00 0.00 -0.41 0.00 2.03 -1.82 -2.43 116.42 113.79 2hbp h ASP 44 Ca 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 2hbp h ASP 44 Cb 0.15 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.65 2hbp h ASP 44 CO 0.00 0.51 0.00 2.29 -1.03 0.00 0.00 179.24 181.01 2hbp n LYS 45 N -3.71 3.21 -2.38 4.15 0.00 -1.21 -4.74 118.16 113.47 2hbp n LYS 45 Ca -0.01 -2.61 -0.29 0.00 -0.00 0.00 0.00 58.31 55.41 2hbp n LYS 45 Cb 0.56 -1.68 0.00 0.00 -0.00 0.00 0.00 35.03 33.91 2hbp n LYS 45 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.40 176.23 2hbp s LEU 46 N -1.95 3.50 0.17 -5.58 2.96 -0.92 0.94 118.68 117.81 2hbp s LEU 46 Ca 0.39 1.11 -0.30 0.00 -0.22 0.00 0.00 54.13 55.10 2hbp s LEU 46 Cb 0.27 -4.09 -0.08 0.00 0.50 0.00 0.00 46.19 42.79 2hbp s LEU 46 CO 0.16 -0.67 1.26 -0.44 -1.32 0.00 0.00 176.35 175.33 2hbp s SER 47 N -4.09 6.99 0.51 3.68 0.01 0.16 -4.07 113.70 116.89 2hbp s SER 47 Ca 0.50 2.29 0.19 0.00 1.31 0.00 0.00 55.95 60.24 2hbp s SER 47 Cb -0.11 -2.60 1.29 0.00 0.21 0.00 0.00 66.02 64.81 2hbp s SER 47 CO 0.47 -0.46 2.07 0.78 0.41 0.00 0.00 173.24 176.51 2hbp h ASN 48 N 5.55 0.04 -0.24 2.44 2.35 -1.90 0.97 115.58 124.79 2hbp h ASN 48 Ca -0.44 0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 55.27 2hbp h ASN 48 Cb 1.21 -0.01 -0.01 0.00 0.05 0.00 0.00 38.32 39.57 2hbp h ASN 48 CO 0.77 0.03 0.01 -0.33 -1.65 0.00 0.00 177.43 176.26 2hbp h GLU 49 N 0.05 0.41 -0.81 0.81 3.07 -1.97 0.79 114.58 116.93 2hbp h GLU 49 Ca 0.13 -0.12 0.02 0.00 -0.50 0.00 0.00 59.36 58.88 2hbp h GLU 49 Cb 0.46 -0.04 -0.04 0.00 -0.84 0.00 0.00 28.75 28.28 2hbp h GLU 49 CO -0.01 0.57 0.53 -0.44 -1.40 0.00 0.00 179.01 178.27 2hbp h ASP 50 N 0.20 0.90 -0.24 1.42 5.19 -1.23 -1.17 116.42 121.48 2hbp h ASP 50 Ca 0.07 -0.02 -0.07 0.00 -0.62 0.00 0.00 57.03 56.39 2hbp h ASP 50 Cb 0.38 -0.22 -0.01 0.00 0.18 0.00 0.00 39.33 39.66 2hbp h ASP 50 CO 0.01 0.64 -0.12 -0.07 -3.12 0.00 0.00 179.24 176.58 2hbp h LEU 51 N 1.06 0.52 -2.03 1.55 -0.00 -0.75 -0.72 115.31 114.94 2hbp h LEU 51 Ca 0.31 -0.41 -0.01 0.00 -0.00 0.00 0.00 57.88 57.76 2hbp h LEU 51 Cb -0.06 -0.14 -0.00 0.00 -0.00 0.00 0.00 40.66 40.45 2hbp h LEU 51 CO -0.08 0.82 -0.05 0.00 -0.00 0.00 0.00 178.44 179.13 2hbp h ALA 52 N 0.72 1.76 0.06 1.53 0.00 -0.37 0.33 119.26 123.28 2hbp h ALA 52 Ca 0.05 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 2hbp h ALA 52 Cb 0.62 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.40 2hbp h ALA 52 CO 0.04 0.06 -0.03 -0.92 0.00 0.00 0.00 179.25 178.40 2hbp h TYR 53 N 0.00 -0.07 -0.11 0.00 3.20 -0.98 -3.02 116.97 115.98 2hbp h TYR 53 Ca -0.00 -0.00 -0.14 0.00 3.14 0.00 0.00 58.73 61.73 2hbp h TYR 53 Cb 0.10 0.02 -0.01 0.00 1.54 0.00 0.00 36.73 38.38 2hbp h TYR 53 CO 0.00 0.53 -0.53 -0.24 -1.64 0.00 0.00 178.16 176.28 2hbp h VAL 54 N -0.77 1.35 0.00 1.81 3.04 -0.25 -0.38 116.25 121.05 2hbp h VAL 54 Ca -0.01 -1.80 -0.04 0.00 -1.01 0.00 0.00 66.70 63.85 2hbp h VAL 54 Cb 0.63 1.84 -0.01 0.00 -2.01 0.00 0.00 31.29 31.75 2hbp h VAL 54 CO 0.01 0.54 -0.18 1.05 -1.01 0.00 0.00 177.57 177.98 2hbp h GLU 55 N 0.25 0.00 -0.13 4.17 4.11 -0.53 -0.81 114.58 121.64 2hbp h GLU 55 Ca 0.01 0.00 -0.06 0.00 0.07 0.00 0.00 59.36 59.37 2hbp h GLU 55 Cb 1.01 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.26 2hbp h GLU 55 CO 0.09 0.18 -0.17 -0.22 0.07 0.00 0.00 179.01 178.96 2hbp h LYS 56 N 0.00 0.35 -0.71 1.06 3.11 -0.98 0.13 116.57 119.54 2hbp h LYS 56 Ca -0.00 -0.20 0.07 0.00 -2.81 0.00 0.00 60.65 57.71 2hbp h LYS 56 Cb 0.50 0.01 -0.06 0.00 -1.00 0.00 0.00 32.23 31.68 2hbp h LYS 56 CO 0.02 0.76 0.39 0.82 -2.81 0.00 0.00 179.45 178.63 2hbp h ILE 57 N -0.05 0.94 0.13 2.00 2.04 -0.59 -3.15 117.51 118.82 2hbp h ILE 57 Ca 0.02 -0.24 -0.18 0.00 1.00 0.00 0.00 64.86 65.46 2hbp h ILE 57 Cb 0.71 0.18 0.02 0.00 -0.74 0.00 0.00 36.82 37.00 2hbp h ILE 57 CO 0.04 0.13 -0.79 0.71 0.00 0.00 0.00 178.15 178.24 2hbp h THR 58 N 0.69 1.51 0.00 -0.27 1.35 -1.15 -3.48 112.91 111.56 2hbp h THR 58 Ca 0.33 -2.52 0.00 0.00 -0.55 0.00 0.00 66.41 63.67 2hbp h THR 58 Cb 0.24 3.19 0.00 0.00 -1.73 0.00 0.00 68.15 69.86 2hbp h THR 58 CO -0.21 0.71 0.00 0.61 -0.25 0.00 0.00 175.52 176.38 2hbp n GLY 59 N 1.67 1.66 0.00 5.82 0.00 0.43 -5.09 105.19 109.68 2hbp n GLY 59 Ca -0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.88 2hbp n GLY 59 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2hbp n PHE 60 N -0.63 -3.07 -4.08 1.61 3.72 -1.04 -4.96 117.46 109.01 2hbp n PHE 60 Ca 0.00 0.00 -0.18 0.00 -0.05 0.00 0.00 57.45 57.22 2hbp n PHE 60 Cb 0.00 0.00 -0.16 0.00 -0.94 0.00 0.00 39.48 38.38 2hbp n PHE 60 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 2hbp s SER 61 N -1.00 0.70 -0.28 4.37 0.15 -1.26 -4.45 113.70 111.94 2hbp s SER 61 Ca 0.00 -0.09 0.12 0.00 0.70 0.00 0.00 55.95 56.68 2hbp s SER 61 Cb 0.00 -0.34 0.67 0.00 -1.71 0.00 0.00 66.02 64.64 2hbp s SER 61 CO 0.00 -0.06 1.66 0.18 1.20 0.00 0.00 173.24 176.22 2hbp n LEU 62 N 4.01 5.24 -0.35 3.45 4.77 -1.26 -4.48 117.00 128.39 2hbp n LEU 62 Ca -0.26 -3.23 0.10 0.00 -0.03 0.00 0.00 56.01 52.59 2hbp n LEU 62 Cb 0.51 -0.68 0.29 0.00 -2.33 0.00 0.00 43.42 41.21 2hbp n LEU 62 CO 0.23 0.83 1.22 -0.08 -1.33 0.00 0.00 177.39 178.26 2hbp h GLU 63 N 2.31 0.85 0.00 3.23 4.81 -1.95 0.28 114.58 124.12 2hbp h GLU 63 Ca 0.17 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.35 2hbp h GLU 63 Cb 2.00 -0.19 0.00 0.00 0.63 0.00 0.00 28.75 31.18 2hbp h GLU 63 CO 0.54 0.56 0.00 0.36 -0.73 0.00 0.00 179.01 179.75 2hbp n LYS 64 N -4.66 0.20 0.00 1.92 2.85 -1.26 -1.25 118.16 115.96 2hbp n LYS 64 Ca 0.20 0.15 0.06 0.00 -1.05 0.00 0.00 58.31 57.68 2hbp n LYS 64 Cb 0.45 -1.50 0.03 0.00 -0.65 0.00 0.00 35.03 33.36 2hbp n LYS 64 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 177.40 178.54 2hbp n PHE 65 N -1.30 0.00 -2.43 5.58 3.72 0.94 -4.97 117.46 119.00 2hbp n PHE 65 Ca 0.07 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 57.05 2hbp n PHE 65 Cb 0.13 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.64 2hbp n PHE 65 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 2hbp s LYS 66 N -1.31 4.37 -0.37 -1.08 1.02 -0.38 -4.64 119.74 117.34 2hbp s LYS 66 Ca 0.13 1.72 -0.16 0.00 0.02 0.00 0.00 55.97 57.68 2hbp s LYS 66 Cb 0.10 -3.51 -0.00 0.00 -0.52 0.00 0.00 37.83 33.90 2hbp s LYS 66 CO 0.23 -0.41 0.37 0.00 -0.92 0.00 0.00 175.35 174.62 2hbp s ALA 67 N 1.96 3.48 0.00 5.17 0.00 -1.26 -5.04 121.76 126.06 2hbp s ALA 67 Ca 0.57 -1.33 0.00 0.00 0.00 0.00 0.00 51.96 51.20 2hbp s ALA 67 Cb -0.26 -2.88 0.00 0.00 0.00 0.00 0.00 23.12 19.98 2hbp s ALA 67 CO 0.24 -1.23 0.00 -1.71 0.00 0.00 0.00 175.76 173.06