#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hbp s LYS 4 N 0.00 2.02 0.10 1.64 -2.85 -1.26 -5.01 119.74 114.38 2hbp s LYS 4 Ca 0.00 -1.57 -0.31 0.00 -1.00 0.00 0.00 55.97 53.09 2hbp s LYS 4 Cb 0.00 -2.54 -0.09 0.00 -2.06 0.00 0.00 37.83 33.14 2hbp s LYS 4 CO 0.00 -1.13 1.71 0.45 0.10 0.00 0.00 175.35 176.48 2hbp s SER 5 N -4.74 6.53 0.42 0.03 0.15 -1.26 -4.60 113.70 110.22 2hbp s SER 5 Ca 0.64 2.60 0.05 0.00 0.70 0.00 0.00 55.95 59.94 2hbp s SER 5 Cb -0.05 -2.57 -0.02 0.00 -1.71 0.00 0.00 66.02 61.68 2hbp s SER 5 CO 0.41 -0.93 0.16 -2.11 1.20 0.00 0.00 173.24 171.98 2hbp n ARG 6 N 5.52 0.55 -3.20 5.44 1.85 0.74 -4.61 116.66 122.94 2hbp n ARG 6 Ca 0.16 -3.57 -0.44 0.00 -1.00 0.00 0.00 57.85 53.01 2hbp n ARG 6 Cb 0.39 2.03 -0.07 0.00 -1.05 0.00 0.00 32.46 33.76 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 5.01 0.05 2.89 1.98 -1.26 0.19 118.68 127.54 2hbp s LEU 7 Ca 0.23 -0.90 -0.15 0.00 -2.89 0.00 0.00 54.13 50.42 2hbp s LEU 7 Cb 0.01 -2.43 -0.06 0.00 0.66 0.00 0.00 46.19 44.38 2hbp s LEU 7 CO 0.16 -0.82 0.46 0.26 -1.89 0.00 0.00 176.35 174.52 2hbp s TRP 8 N 2.46 3.70 -0.02 5.38 0.52 0.16 -4.89 118.94 126.25 2hbp s TRP 8 Ca 0.14 1.02 0.02 0.00 0.02 0.00 0.00 56.10 57.30 2hbp s TRP 8 Cb -0.19 -2.32 0.00 0.00 -1.15 0.00 0.00 33.47 29.81 2hbp s TRP 8 CO 0.12 0.57 -0.08 0.08 0.02 0.00 0.00 176.95 177.66 2hbp s VAL 9 N -1.21 0.72 0.59 4.03 1.01 -1.26 -1.23 120.40 123.05 2hbp s VAL 9 Ca 0.29 -0.34 -0.17 0.00 0.00 0.00 0.00 61.98 61.76 2hbp s VAL 9 Cb -0.16 -0.63 -0.03 0.00 0.00 0.00 0.00 36.38 35.55 2hbp s VAL 9 CO 0.16 0.22 1.08 -0.62 0.00 0.00 0.00 175.10 175.95 2hbp s ASP 10 N 0.11 5.63 0.47 3.32 2.15 -0.62 -1.68 116.67 126.05 2hbp s ASP 10 Ca -0.02 1.95 0.18 0.00 0.43 0.00 0.00 52.55 55.09 2hbp s ASP 10 Cb -0.07 -2.55 1.14 0.00 -0.30 0.00 0.00 42.92 41.14 2hbp s ASP 10 CO 0.00 -1.27 2.02 -0.09 -0.17 0.00 0.00 175.17 175.66 2hbp h ARG 11 N 0.58 0.00 -0.01 4.34 1.12 -1.67 0.13 114.38 118.86 2hbp h ARG 11 Ca -0.48 0.00 0.00 0.00 -1.11 0.00 0.00 59.98 58.39 2hbp h ARG 11 Cb 1.24 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 31.20 2hbp h ARG 11 CO 0.56 0.16 -0.45 0.43 -3.11 0.00 0.00 179.97 177.56 2hbp n SER 12 N -4.16 1.11 0.00 -3.80 7.64 -1.26 -4.93 113.62 108.22 2hbp n SER 12 Ca -0.02 -0.88 0.00 0.00 1.01 0.00 0.00 58.87 58.97 2hbp n SER 12 Cb 0.23 0.34 0.00 0.00 -1.01 0.00 0.00 64.21 63.77 2hbp n SER 12 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2hbp n GLY 13 N 1.41 0.49 0.16 0.23 0.00 0.44 -4.97 105.19 102.94 2hbp n GLY 13 Ca 0.09 -0.92 -0.13 0.00 0.00 0.00 0.00 46.02 45.07 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 1.32 -3.88 2.61 2.02 -1.92 -3.45 112.91 109.60 2hbp h THR 14 Ca 0.00 -1.25 -0.26 0.00 0.77 0.00 0.00 66.41 65.67 2hbp h THR 14 Cb 0.07 1.70 -0.25 0.00 -1.74 0.00 0.00 68.15 67.93 2hbp h THR 14 CO 0.00 0.38 -0.73 0.72 0.37 0.00 0.00 175.52 176.26 2hbp s PHE 15 N -4.46 0.33 -0.04 3.16 -0.71 -1.26 -5.02 117.98 109.98 2hbp s PHE 15 Ca -0.14 -0.23 0.01 0.00 -1.04 0.00 0.00 56.93 55.54 2hbp s PHE 15 Cb 0.06 -0.21 0.02 0.00 -1.21 0.00 0.00 43.02 41.68 2hbp s PHE 15 CO 0.77 -0.05 -0.06 0.15 -1.34 0.00 0.00 175.22 174.68 2hbp s LYS 16 N -0.62 0.95 0.03 1.99 1.02 -1.26 -1.59 119.74 120.26 2hbp s LYS 16 Ca -0.04 -0.18 -0.04 0.00 0.02 0.00 0.00 55.97 55.73 2hbp s LYS 16 Cb -0.04 -0.90 -0.01 0.00 -0.52 0.00 0.00 37.83 36.35 2hbp s LYS 16 CO -0.00 -0.03 0.06 0.14 -0.92 0.00 0.00 175.35 174.60 2hbp s VAL 17 N 0.74 0.12 -0.10 3.17 -7.23 -0.36 -4.95 120.40 111.80 2hbp s VAL 17 Ca -0.11 -1.00 -0.20 0.00 -1.81 0.00 0.00 61.98 58.86 2hbp s VAL 17 Cb -0.14 -0.66 -0.04 0.00 0.56 0.00 0.00 36.38 36.10 2hbp s VAL 17 CO 0.01 -0.55 0.54 1.51 -0.31 0.00 0.00 175.10 176.30 2hbp s ASP 18 N -1.83 6.78 -0.13 4.85 1.47 -1.24 0.40 116.67 126.97 2hbp s ASP 18 Ca -0.09 0.93 -0.32 0.00 1.18 0.00 0.00 52.55 54.25 2hbp s ASP 18 Cb -0.04 -2.32 0.13 0.00 -0.34 0.00 0.00 42.92 40.34 2hbp s ASP 18 CO -0.03 -0.02 1.06 0.00 0.68 0.00 0.00 175.17 176.87 2hbp s ALA 19 N 0.59 -1.96 -0.03 2.11 0.00 0.13 -3.89 121.76 118.71 2hbp s ALA 19 Ca 0.29 1.41 0.06 0.00 0.00 0.00 0.00 51.96 53.73 2hbp s ALA 19 Cb -0.16 -0.14 -0.02 0.00 0.00 0.00 0.00 23.12 22.80 2hbp s ALA 19 CO 0.13 -0.55 -0.21 -2.00 0.00 0.00 0.00 175.76 173.13 2hbp s GLU 20 N -2.32 2.25 0.10 0.00 -6.30 -0.14 -0.19 118.70 112.10 2hbp s GLU 20 Ca 0.06 -0.85 -0.31 0.00 -2.50 0.00 0.00 54.97 51.37 2hbp s GLU 20 Cb -0.01 -2.18 -0.07 0.00 0.00 0.00 0.00 34.13 31.87 2hbp s GLU 20 CO -0.05 0.58 1.27 0.12 0.02 0.00 0.00 175.26 177.20 2hbp s PHE 21 N -0.68 3.36 -0.10 5.30 5.36 -1.26 -0.65 117.98 129.31 2hbp s PHE 21 Ca 0.11 1.18 -0.05 0.00 -0.96 0.00 0.00 56.93 57.21 2hbp s PHE 21 Cb -0.10 -3.52 -0.05 0.00 -0.34 0.00 0.00 43.02 39.01 2hbp s PHE 21 CO 0.00 -1.69 -0.13 -0.89 -1.46 0.00 0.00 175.22 171.04 2hbp n ILE 22 N 3.74 0.57 -3.56 3.12 5.41 -0.43 -4.94 119.36 123.27 2hbp n ILE 22 Ca 0.09 -0.15 -0.13 0.00 1.00 0.00 0.00 62.75 63.56 2hbp n ILE 22 Cb 0.45 -1.62 -0.06 0.00 -0.71 0.00 0.00 39.64 37.70 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 -5.18 -0.38 -0.07 7.39 0.00 -1.23 -5.02 107.32 102.83 2hbp s GLY 23 Ca -0.15 1.84 0.05 0.00 0.00 0.00 0.00 44.72 46.46 2hbp s GLY 23 CO 0.18 1.11 -0.22 0.00 0.00 0.00 0.00 173.10 174.17 2hbp s ALA 25 N -0.09 -0.35 0.00 0.00 0.00 -0.29 -4.97 121.76 116.05 2hbp s ALA 25 Ca -0.05 0.38 0.00 0.00 0.00 0.00 0.00 51.96 52.30 2hbp s ALA 25 Cb -0.14 -0.22 0.00 0.00 0.00 0.00 0.00 23.12 22.75 2hbp s ALA 25 CO 0.04 -0.07 0.00 1.63 0.00 0.00 0.00 175.76 177.36 2hbp n LYS 26 N 2.95 0.00 -0.12 0.00 4.76 -1.26 -0.68 118.16 123.81 2hbp n LYS 26 Ca -0.13 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.31 2hbp n LYS 26 Cb 0.59 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.78 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 0.00 0.31 3.59 0.72 0.00 -1.26 -5.11 105.19 103.43 2hbp n GLY 27 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 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 0.00 2.08 -0.18 1.61 1.02 0.15 0.19 119.74 124.60 2hbp s LYS 28 Ca 0.00 -1.55 -0.02 0.00 0.02 0.00 0.00 55.97 54.41 2hbp s LYS 28 Cb 0.00 -2.02 -0.01 0.00 -0.52 0.00 0.00 37.83 35.28 2hbp s LYS 28 CO 0.00 0.34 -0.08 0.42 -0.92 0.00 0.00 175.35 175.11 2hbp s ILE 29 N -2.40 3.25 0.02 2.17 1.09 0.13 -1.14 121.20 124.31 2hbp s ILE 29 Ca 0.31 -0.56 -0.30 0.00 -1.10 0.00 0.00 60.65 59.01 2hbp s ILE 29 Cb -0.06 -2.43 -0.04 0.00 -1.06 0.00 0.00 42.46 38.88 2hbp s ILE 29 CO 0.18 0.47 0.96 -1.00 -0.10 0.00 0.00 174.94 175.46 2hbp s HIS 30 N 0.97 3.68 -0.01 3.97 3.76 0.15 -1.17 115.29 126.65 2hbp s HIS 30 Ca -0.01 1.70 0.04 0.00 -0.15 0.00 0.00 55.06 56.64 2hbp s HIS 30 Cb -0.15 -3.09 -0.01 0.00 1.11 0.00 0.00 32.58 30.44 2hbp s HIS 30 CO -0.00 0.04 -0.13 -0.51 -0.85 0.00 0.00 174.74 173.28 2hbp s LEU 31 N 0.81 2.04 -0.32 0.89 1.43 0.11 -1.31 118.68 122.34 2hbp s LEU 31 Ca 0.50 -0.25 -0.04 0.00 -1.03 0.00 0.00 54.13 53.31 2hbp s LEU 31 Cb -0.21 -0.65 0.04 0.00 0.03 0.00 0.00 46.19 45.39 2hbp s LEU 31 CO 0.28 0.15 0.05 -2.28 0.23 0.00 0.00 176.35 174.78 2hbp s HIS 32 N -0.35 3.24 1.03 0.29 5.65 0.18 0.18 115.29 125.51 2hbp s HIS 32 Ca 0.05 -1.59 -0.13 0.00 0.25 0.00 0.00 55.06 53.64 2hbp s HIS 32 Cb -0.05 -2.19 0.20 0.00 -1.18 0.00 0.00 32.58 29.36 2hbp s HIS 32 CO -0.00 -0.75 1.09 0.15 -0.65 0.00 0.00 174.74 174.58 2hbp s LYS 33 N 1.34 0.20 0.50 2.88 1.02 0.16 -0.97 119.74 124.87 2hbp s LYS 33 Ca -0.03 0.44 0.29 0.00 0.02 0.00 0.00 55.97 56.70 2hbp s LYS 33 Cb -0.19 -1.72 1.00 0.00 -0.52 0.00 0.00 37.83 36.40 2hbp s LYS 33 CO 0.01 -2.87 1.85 0.00 -0.92 0.00 0.00 175.35 173.42 2hbp h ALA 34 N -1.99 0.99 0.00 5.17 0.00 -1.87 -1.22 119.26 120.35 2hbp h ALA 34 Ca -0.55 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.33 2hbp h ALA 34 Cb 1.33 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.12 2hbp h ALA 34 CO 0.56 0.04 0.00 0.09 0.00 0.00 0.00 179.25 179.94 2hbp n ASN 35 N -3.13 0.00 0.00 0.00 4.13 -1.26 -4.88 115.26 110.13 2hbp n ASN 35 Ca 0.02 0.16 0.00 0.00 1.68 0.00 0.00 54.58 56.44 2hbp n ASN 35 Cb 0.39 -0.39 0.00 0.00 -1.54 0.00 0.00 39.78 38.25 2hbp n ASN 35 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2hbp n GLY 36 N 1.37 0.73 3.74 7.41 0.00 -0.46 -5.04 105.19 112.94 2hbp n GLY 36 Ca 0.11 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.72 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 -2.88 3.79 -0.31 1.61 1.01 -1.26 -4.75 120.40 117.61 2hbp s VAL 37 Ca 0.00 1.59 -0.12 0.00 0.00 0.00 0.00 61.98 63.45 2hbp s VAL 37 Cb 0.00 -4.01 -0.03 0.00 0.00 0.00 0.00 36.38 32.34 2hbp s VAL 37 CO 0.00 0.30 0.21 -0.75 0.00 0.00 0.00 175.10 174.86 2hbp s LYS 38 N -0.58 3.66 0.44 2.72 2.20 -1.26 0.36 119.74 127.28 2hbp s LYS 38 Ca 0.48 -0.52 0.06 0.00 -0.36 0.00 0.00 55.97 55.62 2hbp s LYS 38 Cb -0.30 -3.73 -0.06 0.00 -1.51 0.00 0.00 37.83 32.23 2hbp s LYS 38 CO 0.36 -0.34 0.02 0.96 -0.36 0.00 0.00 175.35 175.99 2hbp s ILE 39 N 1.73 1.81 -0.24 5.43 -4.36 0.13 -4.97 121.20 120.73 2hbp s ILE 39 Ca 0.06 -1.98 -0.03 0.00 -0.26 0.00 0.00 60.65 58.44 2hbp s ILE 39 Cb -0.17 -2.79 0.13 0.00 1.25 0.00 0.00 42.46 40.88 2hbp s ILE 39 CO 0.10 0.00 0.37 0.00 0.24 0.00 0.00 174.94 175.65 2hbp s ALA 40 N -2.75 -1.05 -0.14 2.27 0.00 -1.26 0.09 121.76 118.92 2hbp s ALA 40 Ca 0.28 0.91 -0.02 0.00 0.00 0.00 0.00 51.96 53.14 2hbp s ALA 40 Cb 0.08 -1.63 -0.02 0.00 0.00 0.00 0.00 23.12 21.55 2hbp s ALA 40 CO 0.15 -1.22 -0.09 0.14 0.00 0.00 0.00 175.76 174.73 2hbp s VAL 41 N 2.54 3.38 0.20 0.00 -7.23 -0.32 -4.86 120.40 114.11 2hbp s VAL 41 Ca 0.12 -0.54 -0.32 0.00 -1.81 0.00 0.00 61.98 59.43 2hbp s VAL 41 Cb -0.15 -2.45 -0.11 0.00 0.56 0.00 0.00 36.38 34.23 2hbp s VAL 41 CO -0.15 0.51 1.66 0.00 -0.31 0.00 0.00 175.10 176.80 2hbp s ALA 42 N 0.42 3.87 0.58 1.32 0.00 -1.26 0.19 121.76 126.87 2hbp s ALA 42 Ca -0.08 1.52 0.28 0.00 0.00 0.00 0.00 51.96 53.69 2hbp s ALA 42 Cb -0.15 -3.67 1.56 0.00 0.00 0.00 0.00 23.12 20.86 2hbp s ALA 42 CO 0.04 -0.88 2.01 0.00 0.00 0.00 0.00 175.76 176.93 2hbp h ALA 43 N 6.57 2.01 0.00 0.00 0.00 -0.57 -1.36 119.26 125.92 2hbp h ALA 43 Ca -0.43 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.47 2hbp h ALA 43 Cb 1.20 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.02 2hbp h ALA 43 CO 0.93 -0.49 0.00 -0.40 0.00 0.00 0.00 179.25 179.29 2hbp n ASP 44 N -3.83 0.10 -1.69 0.00 5.75 -1.26 -2.31 116.55 113.31 2hbp n ASP 44 Ca 0.05 0.52 0.08 0.00 -0.01 0.00 0.00 54.79 55.43 2hbp n ASP 44 Cb 0.48 -0.54 0.37 0.00 -1.03 0.00 0.00 41.12 40.41 2hbp n ASP 44 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 2hbp n LYS 45 N -1.60 4.28 -3.00 0.11 4.01 -0.51 -4.93 118.16 116.51 2hbp n LYS 45 Ca 0.05 -3.02 -0.15 0.00 -0.51 0.00 0.00 58.31 54.68 2hbp n LYS 45 Cb 0.26 -2.08 -0.02 0.00 -0.51 0.00 0.00 35.03 32.68 2hbp n LYS 45 CO 0.00 0.00 0.00 1.28 -1.11 0.00 0.00 177.40 177.57 2hbp n LEU 46 N 0.75 0.00 -4.88 -0.35 4.77 -0.98 -4.04 117.00 112.27 2hbp n LEU 46 Ca 0.26 -1.51 -0.35 0.00 -0.03 0.00 0.00 56.01 54.39 2hbp n LEU 46 Cb 1.05 0.08 -0.05 0.00 -2.33 0.00 0.00 43.42 42.16 2hbp n LEU 46 CO 0.28 -0.32 -0.05 -0.55 -1.33 0.00 0.00 177.39 175.42 2hbp s SER 47 N -2.49 6.52 0.61 -1.43 0.15 -0.68 -3.01 113.70 113.36 2hbp s SER 47 Ca 0.07 0.60 0.33 0.00 0.70 0.00 0.00 55.95 57.65 2hbp s SER 47 Cb -0.01 -2.11 1.95 0.00 -1.71 0.00 0.00 66.02 64.15 2hbp s SER 47 CO 0.05 0.27 2.28 -0.55 1.20 0.00 0.00 173.24 176.49 2hbp h ASN 48 N 4.14 0.00 -0.22 5.45 7.08 -1.87 0.26 115.58 130.42 2hbp h ASN 48 Ca -0.51 0.00 -0.01 0.00 -3.08 0.00 0.00 56.30 52.70 2hbp h ASN 48 Cb 1.20 0.00 -0.01 0.00 -2.08 0.00 0.00 38.32 37.43 2hbp h ASN 48 CO 0.65 0.00 0.10 -0.33 -2.08 0.00 0.00 177.43 175.77 2hbp h GLU 49 N 0.00 0.33 -0.63 4.14 4.39 -1.93 0.14 114.58 121.01 2hbp h GLU 49 Ca -0.00 -0.05 -0.06 0.00 0.34 0.00 0.00 59.36 59.59 2hbp h GLU 49 Cb 0.00 -0.06 -0.03 0.00 -0.10 0.00 0.00 28.75 28.57 2hbp h GLU 49 CO 0.00 0.36 0.15 -0.44 -1.16 0.00 0.00 179.01 177.92 2hbp h ASP 50 N 0.22 0.93 -0.19 1.42 5.19 -0.86 -0.70 116.42 122.44 2hbp h ASP 50 Ca 0.08 -0.18 -0.17 0.00 -0.62 0.00 0.00 57.03 56.14 2hbp h ASP 50 Cb 0.14 -0.25 -0.00 0.00 0.18 0.00 0.00 39.33 39.40 2hbp h ASP 50 CO -0.01 0.90 -0.49 -0.07 -3.12 0.00 0.00 179.24 176.46 2hbp h LEU 51 N 0.95 0.83 -1.36 1.55 -0.00 -1.06 -1.02 115.31 115.20 2hbp h LEU 51 Ca 0.20 -0.42 -0.06 0.00 -0.00 0.00 0.00 57.88 57.60 2hbp h LEU 51 Cb 0.34 -0.24 -0.01 0.00 -0.00 0.00 0.00 40.66 40.75 2hbp h LEU 51 CO 0.00 1.18 -0.29 0.00 -0.00 0.00 0.00 178.44 179.33 2hbp h ALA 52 N 0.84 1.24 -0.00 1.53 0.00 -0.41 -0.46 119.26 122.00 2hbp h ALA 52 Ca 0.03 -0.26 -0.00 0.00 0.00 0.00 0.00 54.91 54.67 2hbp h ALA 52 Cb 1.06 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.81 2hbp h ALA 52 CO 0.10 0.36 -0.00 -0.92 0.00 0.00 0.00 179.25 178.79 2hbp h TYR 53 N 0.00 0.01 -0.07 0.00 3.20 -0.88 -2.95 116.97 116.28 2hbp h TYR 53 Ca -0.00 -0.00 -0.12 0.00 3.14 0.00 0.00 58.73 61.74 2hbp h TYR 53 Cb 0.62 -0.00 -0.01 0.00 1.54 0.00 0.00 36.73 38.88 2hbp h TYR 53 CO 0.00 0.71 -0.52 -0.24 -1.64 0.00 0.00 178.16 176.47 2hbp h VAL 54 N -0.70 1.36 0.00 1.81 3.04 -0.93 0.21 116.25 121.04 2hbp h VAL 54 Ca -0.00 -1.78 -0.03 0.00 -1.01 0.00 0.00 66.70 63.88 2hbp h VAL 54 Cb 0.71 1.88 -0.00 0.00 -2.01 0.00 0.00 31.29 31.86 2hbp h VAL 54 CO 0.00 0.52 -0.15 1.05 -1.01 0.00 0.00 177.57 177.99 2hbp h GLU 55 N 0.15 0.00 -0.19 4.17 4.11 -1.21 -0.82 114.58 120.78 2hbp h GLU 55 Ca 0.00 0.00 -0.20 0.00 0.07 0.00 0.00 59.36 59.23 2hbp h GLU 55 Cb 0.96 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.22 2hbp h GLU 55 CO 0.08 0.15 -0.68 -0.22 0.07 0.00 0.00 179.01 178.41 2hbp h LYS 56 N 0.00 0.79 -0.43 1.06 3.64 -0.81 0.51 116.57 121.33 2hbp h LYS 56 Ca -0.00 -0.60 -0.02 0.00 -1.27 0.00 0.00 60.65 58.75 2hbp h LYS 56 Cb 0.54 0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 32.45 2hbp h LYS 56 CO 0.02 1.22 0.18 0.82 -2.27 0.00 0.00 179.45 179.42 2hbp h ILE 57 N 0.54 1.20 0.09 2.00 2.04 -0.72 -3.31 117.51 119.34 2hbp h ILE 57 Ca -0.03 -0.60 -0.19 0.00 1.00 0.00 0.00 64.86 65.04 2hbp h ILE 57 Cb 1.31 0.79 0.02 0.00 -0.74 0.00 0.00 36.82 38.19 2hbp h ILE 57 CO 0.14 0.22 -0.79 0.71 0.00 0.00 0.00 178.15 178.44 2hbp h THR 58 N 0.56 1.46 0.00 -0.27 1.35 -1.14 -3.48 112.91 111.39 2hbp h THR 58 Ca 0.14 -2.37 0.00 0.00 -0.55 0.00 0.00 66.41 63.63 2hbp h THR 58 Cb 0.18 2.95 0.00 0.00 -1.73 0.00 0.00 68.15 69.55 2hbp h THR 58 CO -0.01 0.68 0.00 0.61 -0.25 0.00 0.00 175.52 176.55 2hbp n GLY 59 N 1.44 0.88 0.00 5.82 0.00 0.14 -5.09 105.19 108.37 2hbp n GLY 59 Ca -0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.89 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 -0.91 -1.41 -4.45 1.61 3.72 -1.01 -5.02 117.46 110.00 2hbp n PHE 60 Ca 0.00 0.00 -0.22 0.00 -0.05 0.00 0.00 57.45 57.18 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 -0.82 1.42 -0.40 4.37 0.15 -1.26 -4.42 113.70 112.74 2hbp s SER 61 Ca 0.00 -0.23 0.06 0.00 0.70 0.00 0.00 55.95 56.48 2hbp s SER 61 Cb 0.00 -0.55 0.63 0.00 -1.71 0.00 0.00 66.02 64.39 2hbp s SER 61 CO 0.00 0.04 1.79 0.18 1.20 0.00 0.00 173.24 176.44 2hbp n LEU 62 N 3.62 5.98 -0.27 3.45 4.77 -1.26 -4.63 117.00 128.66 2hbp n LEU 62 Ca -0.21 -3.64 0.04 0.00 -0.03 0.00 0.00 56.01 52.16 2hbp n LEU 62 Cb 0.52 -0.78 0.13 0.00 -2.33 0.00 0.00 43.42 40.97 2hbp n LEU 62 CO 0.25 1.10 0.76 -0.08 -1.33 0.00 0.00 177.39 178.09 2hbp h GLU 63 N 1.07 0.04 0.00 3.23 4.57 -1.95 0.33 114.58 121.87 2hbp h GLU 63 Ca 0.51 -0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.68 2hbp h GLU 63 Cb 2.51 -0.01 0.00 0.00 -0.16 0.00 0.00 28.75 31.09 2hbp h GLU 63 CO 0.89 0.03 0.00 1.57 -1.18 0.00 0.00 179.01 180.32 2hbp h LYS 64 N 0.04 0.00 -0.01 1.92 2.10 -2.03 -1.15 116.57 117.44 2hbp h LYS 64 Ca 0.40 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.05 2hbp h LYS 64 Cb 0.67 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.00 2hbp h LYS 64 CO -0.75 0.00 -0.46 1.19 -2.00 0.00 0.00 179.45 177.42 2hbp n PHE 65 N -2.69 0.00 -2.45 0.07 3.72 0.10 -4.87 117.46 111.34 2hbp n PHE 65 Ca -0.00 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 56.98 2hbp n PHE 65 Cb 0.17 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.68 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 -2.40 3.34 -0.52 -1.08 1.02 -0.43 -4.62 119.74 115.04 2hbp s LYS 66 Ca 0.18 0.34 -0.27 0.00 0.02 0.00 0.00 55.97 56.25 2hbp s LYS 66 Cb 0.17 -4.11 0.03 0.00 -0.52 0.00 0.00 37.83 33.41 2hbp s LYS 66 CO 0.55 -1.90 1.04 0.00 -0.92 0.00 0.00 175.35 174.12 2hbp s ALA 67 N 5.80 3.14 -2.65 5.17 0.00 -1.26 -4.93 121.76 127.02 2hbp s ALA 67 Ca 0.49 -0.85 0.27 0.00 0.00 0.00 0.00 51.96 51.86 2hbp s ALA 67 Cb -0.10 -3.82 0.80 0.00 0.00 0.00 0.00 23.12 20.00 2hbp s ALA 67 CO 0.24 -2.34 1.60 0.09 0.00 0.00 0.00 175.76 175.35