#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fin n LYS 3 N 0.00 -0.15 -1.62 0.54 5.02 -1.26 -4.64 118.16 116.04 3fin n LYS 3 Ca 0.00 0.39 -0.45 0.00 -2.02 0.00 0.00 58.31 56.23 3fin n LYS 3 Cb 0.00 -0.48 -0.02 0.00 -0.02 0.00 0.00 35.03 34.52 3fin n LYS 3 CO 0.00 0.00 0.00 -1.33 -0.52 0.00 0.00 177.40 175.55 3fin n MET 4 N 0.94 1.60 -3.26 1.97 2.81 -1.26 -4.94 117.12 114.98 3fin n MET 4 Ca 0.00 0.56 -0.36 0.00 -1.81 0.00 0.00 57.70 56.10 3fin n MET 4 Cb 0.23 -2.04 -0.06 0.00 -0.71 0.00 0.00 33.22 30.65 3fin n MET 4 CO 0.00 0.00 0.00 0.15 1.51 0.00 0.00 175.97 177.63 3fin s LYS 5 N -1.31 4.09 0.37 0.03 1.02 -1.26 -4.84 119.74 117.83 3fin s LYS 5 Ca 0.61 0.64 -0.25 0.00 0.02 0.00 0.00 55.97 56.99 3fin s LYS 5 Cb -0.68 -2.92 -0.09 0.00 -0.52 0.00 0.00 37.83 33.61 3fin s LYS 5 CO 0.58 0.45 1.03 0.95 -0.92 0.00 0.00 175.35 177.44 3fin s THR 6 N -1.47 3.81 -0.95 2.17 -4.23 -1.26 -4.95 115.64 108.75 3fin s THR 6 Ca 0.39 1.45 -0.22 0.00 -1.18 0.00 0.00 61.69 62.13 3fin s THR 6 Cb -0.16 -3.78 0.07 0.00 1.34 0.00 0.00 72.50 69.97 3fin s THR 6 CO 0.20 0.07 1.31 -2.28 -0.54 0.00 0.00 174.62 173.38 3fin s HIS 7 N -1.60 2.68 0.08 3.99 2.46 -0.81 -4.92 115.29 117.17 3fin s HIS 7 Ca 0.55 -0.90 -0.15 0.00 0.47 0.00 0.00 55.06 55.03 3fin s HIS 7 Cb -0.22 -4.55 -0.03 0.00 -0.13 0.00 0.00 32.58 27.64 3fin s HIS 7 CO 0.28 -1.81 1.13 1.63 -2.47 0.00 0.00 174.74 173.49 3fin n LYS 8 N 8.22 -0.21 -0.37 2.88 4.76 -1.26 -1.27 118.16 130.92 3fin n LYS 8 Ca 0.25 1.11 0.01 0.00 -2.87 0.00 0.00 58.31 56.81 3fin n LYS 8 Cb 0.50 -1.65 0.06 0.00 -1.84 0.00 0.00 35.03 32.11 3fin n LYS 8 CO 0.00 0.00 0.00 0.78 -1.37 0.00 0.00 177.40 176.81 3fin h GLY 9 N 0.00 0.24 0.61 0.72 0.00 -1.98 1.14 103.07 103.80 3fin h GLY 9 Ca 0.08 0.47 0.06 0.00 0.00 0.00 0.00 47.33 47.94 3fin h GLY 9 CO -0.46 -0.25 0.26 0.00 0.00 0.00 0.00 176.54 176.10 3fin h ALA 10 N 1.52 0.73 -0.79 3.60 0.00 -1.59 -0.09 119.26 122.63 3fin h ALA 10 Ca 0.38 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.32 3fin h ALA 10 Cb 0.63 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.34 3fin h ALA 10 CO -0.98 -0.10 0.45 -0.22 0.00 0.00 0.00 179.25 178.40 3fin h LYS 11 N 0.50 1.09 0.00 0.00 3.64 0.16 -1.58 116.57 120.37 3fin h LYS 11 Ca 0.26 -0.11 0.00 0.00 -1.27 0.00 0.00 60.65 59.53 3fin h LYS 11 Cb 0.22 -0.22 0.00 0.00 -0.41 0.00 0.00 32.23 31.82 3fin h LYS 11 CO -0.21 0.78 0.00 1.63 -2.27 0.00 0.00 179.45 179.38 3fin n LYS 12 N -4.36 0.18 0.00 1.90 5.02 0.21 -3.59 118.16 117.52 3fin n LYS 12 Ca 0.08 0.46 0.00 0.00 -2.02 0.00 0.00 58.31 56.84 3fin n LYS 12 Cb 0.08 -1.87 0.00 0.00 -0.02 0.00 0.00 35.03 33.22 3fin n LYS 12 CO 0.00 0.00 0.00 2.89 -0.52 0.00 0.00 177.40 179.77 3fin n ARG 13 N -2.21 0.74 -3.81 1.97 1.85 -0.69 -5.05 116.66 109.45 3fin n ARG 13 Ca 0.01 -0.75 -0.13 0.00 -1.00 0.00 0.00 57.85 55.98 3fin n ARG 13 Cb 0.19 -0.81 -0.13 0.00 -1.05 0.00 0.00 32.46 30.65 3fin n ARG 13 CO 0.00 0.00 0.00 0.08 -0.01 0.00 0.00 177.63 177.70 3fin s VAL 14 N -0.34 -0.01 -0.17 8.89 1.01 -0.68 -4.55 120.40 124.55 3fin s VAL 14 Ca 0.00 0.04 -0.03 0.00 0.00 0.00 0.00 61.98 61.99 3fin s VAL 14 Cb 0.00 -0.19 -0.02 0.00 0.00 0.00 0.00 36.38 36.18 3fin s VAL 14 CO 0.00 0.02 -0.06 -0.75 0.00 0.00 0.00 175.10 174.31 3fin s LYS 15 N 0.30 3.52 -0.30 2.72 2.20 -0.41 -4.73 119.74 123.04 3fin s LYS 15 Ca -0.02 -0.59 -0.13 0.00 -0.36 0.00 0.00 55.97 54.87 3fin s LYS 15 Cb -0.03 -2.88 -0.04 0.00 -1.51 0.00 0.00 37.83 33.37 3fin s LYS 15 CO -0.01 0.10 0.28 -1.50 -0.36 0.00 0.00 175.35 173.86 3fin s ILE 16 N 0.71 5.24 0.00 5.43 2.07 -1.26 -1.46 121.20 131.94 3fin s ILE 16 Ca -0.03 0.21 0.00 0.00 -1.41 0.00 0.00 60.65 59.42 3fin s ILE 16 Cb -0.15 -3.65 0.00 0.00 0.13 0.00 0.00 42.46 38.79 3fin s ILE 16 CO 0.02 0.13 0.00 0.35 -1.91 0.00 0.00 174.94 173.53 3fin n THR 17 N 5.12 0.00 -0.01 4.00 -2.24 -0.38 -4.70 114.28 116.07 3fin n THR 17 Ca -0.11 0.00 -0.04 0.00 -2.27 0.00 0.00 64.05 61.63 3fin n THR 17 Cb 0.51 0.00 -0.01 0.00 -2.10 0.00 0.00 70.33 68.73 3fin n THR 17 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3fin n ALA 18 N -3.00 2.02 0.00 6.98 0.00 -1.26 -4.59 120.51 120.66 3fin n ALA 18 Ca 0.00 -0.36 0.00 0.00 0.00 0.00 0.00 53.44 53.08 3fin n ALA 18 Cb 0.00 0.14 0.00 0.00 0.00 0.00 0.00 19.45 19.59 3fin n ALA 18 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3fin n SER 19 N -3.89 0.00 0.00 0.00 3.41 -1.26 -4.68 113.62 107.21 3fin n SER 19 Ca -0.06 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.55 3fin n SER 19 Cb 0.23 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.18 3fin n SER 19 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3fin n GLY 20 N -0.76 1.33 3.87 5.00 0.00 -1.26 -5.09 105.19 108.27 3fin n GLY 20 Ca 0.00 -0.25 -0.37 0.00 0.00 0.00 0.00 46.02 45.40 3fin n GLY 20 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3fin s LYS 21 N -1.34 3.57 -0.21 1.61 1.02 -1.26 -4.95 119.74 118.17 3fin s LYS 21 Ca 0.00 -0.01 -0.16 0.00 0.02 0.00 0.00 55.97 55.82 3fin s LYS 21 Cb 0.00 -3.20 -0.04 0.00 -0.52 0.00 0.00 37.83 34.07 3fin s LYS 21 CO 0.00 0.74 0.39 0.08 -0.92 0.00 0.00 175.35 175.64 3fin s VAL 22 N -0.99 5.20 -0.05 3.17 1.01 -1.26 -1.25 120.40 126.23 3fin s VAL 22 Ca 0.17 0.68 0.03 0.00 0.00 0.00 0.00 61.98 62.85 3fin s VAL 22 Cb -0.13 -3.72 0.01 0.00 0.00 0.00 0.00 36.38 32.54 3fin s VAL 22 CO 0.06 0.24 -0.11 -0.69 0.00 0.00 0.00 175.10 174.59 3fin s VAL 23 N 1.44 1.03 0.29 2.92 1.01 -0.53 -2.17 120.40 124.39 3fin s VAL 23 Ca 0.18 -0.46 0.03 0.00 0.00 0.00 0.00 61.98 61.74 3fin s VAL 23 Cb -0.15 -0.92 -0.03 0.00 0.00 0.00 0.00 36.38 35.28 3fin s VAL 23 CO 0.08 0.32 0.26 0.00 0.00 0.00 0.00 175.10 175.76 3fin s ALA 24 N 0.41 1.47 1.00 5.51 0.00 -0.90 -1.28 121.76 127.96 3fin s ALA 24 Ca -0.08 -1.87 0.00 0.00 0.00 0.00 0.00 51.96 50.01 3fin s ALA 24 Cb -0.12 1.40 0.00 0.00 0.00 0.00 0.00 23.12 24.40 3fin s ALA 24 CO 0.02 -0.66 0.00 -1.33 0.00 0.00 0.00 175.76 173.79 3fin n MET 25 N -0.51 -0.22 -3.98 0.00 2.81 -1.26 -0.89 117.12 113.07 3fin n MET 25 Ca 0.05 0.00 -0.35 0.00 -1.81 0.00 0.00 57.70 55.59 3fin n MET 25 Cb 0.63 0.00 -0.14 0.00 -0.71 0.00 0.00 33.22 33.00 3fin n MET 25 CO 0.00 0.00 0.00 0.15 1.51 0.00 0.00 175.97 177.63 3fin s LYS 26 N -1.75 3.31 0.49 0.03 -0.14 -1.26 -4.55 119.74 115.87 3fin s LYS 26 Ca 0.00 -0.66 -0.21 0.00 -1.36 0.00 0.00 55.97 53.74 3fin s LYS 26 Cb 0.00 -2.92 -0.07 0.00 -1.68 0.00 0.00 37.83 33.16 3fin s LYS 26 CO 0.00 -0.18 1.10 0.95 -0.76 0.00 0.00 175.35 176.46 3fin s THR 27 N 1.39 3.39 0.00 2.17 -4.23 -1.26 -3.95 115.64 113.15 3fin s THR 27 Ca 0.05 0.94 0.00 0.00 -1.18 0.00 0.00 61.69 61.49 3fin s THR 27 Cb -0.14 -3.42 0.00 0.00 1.34 0.00 0.00 72.50 70.28 3fin s THR 27 CO -0.05 -0.12 0.00 0.61 -0.54 0.00 0.00 174.62 174.53 3fin n GLY 28 N 0.16 3.43 0.10 3.99 0.00 -1.26 -4.88 105.19 106.73 3fin n GLY 28 Ca 0.09 -1.01 0.03 0.00 0.00 0.00 0.00 46.02 45.12 3fin n GLY 28 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 3fin n LYS 29 N 0.00 0.62 -0.31 1.61 4.81 -1.25 -4.64 118.16 118.99 3fin n LYS 29 Ca 0.00 0.19 -0.05 0.00 -0.87 0.00 0.00 58.31 57.58 3fin n LYS 29 Cb 0.00 -1.80 -0.04 0.00 0.02 0.00 0.00 35.03 33.20 3fin n LYS 29 CO 0.00 0.00 0.00 -2.13 1.17 0.00 0.00 177.40 176.44 3fin n ARG 30 N -2.83 0.00 -3.85 1.64 3.00 -1.26 0.46 116.66 113.83 3fin n ARG 30 Ca -0.08 0.00 -0.32 0.00 -0.00 0.00 0.00 57.85 57.45 3fin n ARG 30 Cb 0.78 -0.22 0.01 0.00 0.00 0.00 0.00 32.46 33.02 3fin n ARG 30 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.63 178.35 3fin n HIS 31 N 1.28 -1.51 0.00 -0.14 8.25 -1.26 -4.18 115.22 117.65 3fin n HIS 31 Ca 0.14 0.40 0.00 0.00 -0.26 0.00 0.00 57.72 58.00 3fin n HIS 31 Cb 0.03 -2.43 0.00 0.00 1.12 0.00 0.00 29.99 28.71 3fin n HIS 31 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 3fin n LEU 32 N -3.46 0.00 0.00 2.41 4.32 1.65 -4.46 117.00 117.46 3fin n LEU 32 Ca -0.20 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.79 3fin n LEU 32 Cb 0.56 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.36 3fin n LEU 32 CO 0.61 0.00 0.00 -3.20 -1.22 0.00 0.00 177.39 173.58 3fin n ASN 33 N 0.09 0.00 -0.06 -1.43 2.85 -1.26 -4.36 115.26 111.09 3fin n ASN 33 Ca 0.00 0.00 -0.07 0.00 -0.11 0.00 0.00 54.58 54.40 3fin n ASN 33 Cb 0.00 -0.85 -0.15 0.00 1.24 0.00 0.00 39.78 40.02 3fin n ASN 33 CO 0.00 0.00 0.00 1.87 -2.11 0.00 0.00 177.26 177.02 3fin n TRP 34 N -1.96 0.40 -1.98 1.20 -0.00 -1.26 -5.07 117.44 108.77 3fin n TRP 34 Ca 0.00 0.14 0.00 0.00 -0.00 0.00 0.00 57.50 57.64 3fin n TRP 34 Cb 0.00 -1.03 0.00 0.00 -0.00 0.00 0.00 31.31 30.28 3fin n TRP 34 CO 0.00 0.00 0.00 1.04 -0.00 0.00 0.00 177.69 178.73 3fin n GLN 35 N -2.81 0.00 -0.52 5.87 6.02 -1.26 -4.98 117.38 119.70 3fin n GLN 35 Ca -0.24 0.00 -0.10 0.00 -0.01 0.00 0.00 57.00 56.66 3fin n GLN 35 Cb 1.05 0.00 -0.07 0.00 1.02 0.00 0.00 30.24 32.24 3fin n GLN 35 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 3fin n LYS 36 N 0.00 0.00 0.00 -1.09 5.02 -1.26 -4.86 118.16 115.97 3fin n LYS 36 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 3fin n LYS 36 Cb 0.00 -0.40 0.00 0.00 -0.02 0.00 0.00 35.03 34.61 3fin n LYS 36 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 3fin n SER 37 N 2.44 0.00 0.00 4.39 3.41 -1.26 -5.00 113.62 117.60 3fin n SER 37 Ca 0.23 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.84 3fin n SER 37 Cb 0.04 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.99 3fin n SER 37 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3fin n GLY 38 N 0.00 -0.05 3.16 5.00 0.00 -1.26 -4.82 105.19 107.22 3fin n GLY 38 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3fin n GLY 38 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 3fin n LYS 39 N 0.00 -1.18 -0.05 1.61 4.81 -1.26 -4.75 118.16 117.33 3fin n LYS 39 Ca 0.00 0.30 -0.18 0.00 -0.87 0.00 0.00 58.31 57.55 3fin n LYS 39 Cb 0.00 -4.55 -0.13 0.00 0.02 0.00 0.00 35.03 30.37 3fin n LYS 39 CO 0.00 0.00 0.00 1.49 1.17 0.00 0.00 177.40 180.06 3fin h GLU 40 N 0.24 0.08 -0.91 1.64 4.22 -1.98 -3.32 114.58 114.54 3fin h GLU 40 Ca 0.00 -0.14 0.36 0.00 0.08 0.00 0.00 59.36 59.66 3fin h GLU 40 Cb 0.59 0.05 -0.17 0.00 0.50 0.00 0.00 28.75 29.73 3fin h GLU 40 CO 0.00 1.07 0.40 0.44 -2.18 0.00 0.00 179.01 178.74 3fin n ILE 41 N -4.37 -0.38 0.06 2.32 -5.35 -1.26 0.16 119.36 110.53 3fin n ILE 41 Ca -0.20 1.88 -0.15 0.00 -0.27 0.00 0.00 62.75 64.02 3fin n ILE 41 Cb 0.66 -3.00 -0.09 0.00 -1.74 0.00 0.00 39.64 35.47 3fin n ILE 41 CO 0.00 0.00 0.00 -0.09 -1.76 0.00 0.00 176.55 174.70 3fin h ARG 42 N 0.00 -0.63 -3.59 6.28 2.43 -1.96 -3.22 114.38 113.69 3fin h ARG 42 Ca 0.73 0.04 -0.06 0.00 -0.81 0.00 0.00 59.98 59.88 3fin h ARG 42 Cb 1.88 0.14 0.00 0.00 -0.42 0.00 0.00 29.97 31.57 3fin h ARG 42 CO -0.73 -0.42 1.07 1.04 -1.51 0.00 0.00 179.97 179.42 3fin n GLN 43 N -5.46 0.39 -3.49 0.20 6.02 0.12 -4.62 117.38 110.54 3fin n GLN 43 Ca -0.07 -0.54 -0.27 0.00 -0.01 0.00 0.00 57.00 56.11 3fin n GLN 43 Cb 0.39 -1.94 -0.10 0.00 1.02 0.00 0.00 30.24 29.61 3fin n GLN 43 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.06 176.20 3fin s LYS 44 N 4.11 1.19 0.00 -1.09 3.01 -1.22 -5.05 119.74 120.69 3fin s LYS 44 Ca 0.08 -2.34 0.00 0.00 -1.01 0.00 0.00 55.97 52.70 3fin s LYS 44 Cb 0.03 -1.79 0.00 0.00 -1.01 0.00 0.00 37.83 35.06 3fin s LYS 44 CO -0.01 -1.37 0.00 0.41 0.51 0.00 0.00 175.35 174.90 3fin n GLY 45 N 2.68 0.92 3.79 -3.33 0.00 -1.26 -4.90 105.19 103.08 3fin n GLY 45 Ca 0.28 -0.08 -0.25 0.00 0.00 0.00 0.00 46.02 45.97 3fin n GLY 45 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3fin s ARG 46 N 4.04 2.26 0.15 1.61 0.52 -1.26 -4.01 118.95 122.26 3fin s ARG 46 Ca 0.00 -1.89 -0.17 0.00 -0.52 0.00 0.00 55.73 53.15 3fin s ARG 46 Cb 0.00 -2.01 0.04 0.00 0.52 0.00 0.00 34.95 33.49 3fin s ARG 46 CO 0.00 -0.24 0.44 -1.59 0.02 0.00 0.00 175.30 173.93 3fin s LYS 47 N -4.00 1.16 -0.24 3.54 0.00 -0.07 -4.97 119.74 115.17 3fin s LYS 47 Ca 0.38 -0.74 -0.17 0.00 0.00 0.00 0.00 55.97 55.44 3fin s LYS 47 Cb 0.02 0.49 -0.03 0.00 0.00 0.00 0.00 37.83 38.30 3fin s LYS 47 CO 0.21 -0.47 0.47 -0.59 0.00 0.00 0.00 175.35 174.97 3fin s PHE 48 N -3.82 3.30 -0.86 1.78 -0.71 -1.26 -2.13 117.98 114.29 3fin s PHE 48 Ca 0.05 0.62 -0.19 0.00 -1.04 0.00 0.00 56.93 56.36 3fin s PHE 48 Cb 0.01 -2.65 0.12 0.00 -1.21 0.00 0.00 43.02 39.29 3fin s PHE 48 CO -0.10 -0.18 1.06 0.08 -1.34 0.00 0.00 175.22 174.74 3fin s VAL 49 N 1.94 4.68 0.92 -2.49 1.01 -0.92 -5.04 120.40 120.49 3fin s VAL 49 Ca 0.20 -1.34 -0.10 0.00 0.00 0.00 0.00 61.98 60.74 3fin s VAL 49 Cb -0.15 -4.74 0.15 0.00 0.00 0.00 0.00 36.38 31.64 3fin s VAL 49 CO 0.09 -1.46 1.13 -0.22 0.00 0.00 0.00 175.10 174.64 3fin s LEU 50 N 2.88 2.70 0.00 3.92 2.96 -1.26 -3.10 118.68 126.78 3fin s LEU 50 Ca 0.29 2.09 0.00 0.00 -0.22 0.00 0.00 54.13 56.29 3fin s LEU 50 Cb -0.08 -4.47 0.00 0.00 0.50 0.00 0.00 46.19 42.14 3fin s LEU 50 CO -0.05 -3.08 0.00 0.00 -1.32 0.00 0.00 176.35 171.90 3fin n ALA 51 N -4.21 0.00 1.22 5.97 0.00 -1.26 -3.94 120.51 118.28 3fin n ALA 51 Ca 0.11 0.00 0.14 0.00 0.00 0.00 0.00 53.44 53.69 3fin n ALA 51 Cb 0.52 0.00 0.57 0.00 0.00 0.00 0.00 19.45 20.54 3fin n ALA 51 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3fin n LYS 52 N 0.00 0.33 0.08 0.00 4.01 -1.25 -3.77 118.16 117.55 3fin n LYS 52 Ca 0.00 -0.10 -0.15 0.00 -0.51 0.00 0.00 58.31 57.56 3fin n LYS 52 Cb 0.00 -1.50 -0.14 0.00 -0.51 0.00 0.00 35.03 32.88 3fin n LYS 52 CO 0.00 0.00 0.00 -1.00 -1.11 0.00 0.00 177.40 175.29 3fin h PRO 53 N 0.23 0.22 -1.05 1.97 0.13 -1.66 -1.05 132.00 130.79 3fin h PRO 53 Ca 0.00 -0.37 0.27 0.00 -0.87 0.00 0.00 66.00 65.03 3fin h PRO 53 Cb 0.42 0.14 -0.10 0.00 0.13 0.00 0.00 31.00 31.58 3fin h PRO 53 CO 0.00 1.11 0.66 1.05 -0.23 0.00 0.00 178.00 180.60 3fin h GLU 54 N 0.06 0.40 0.00 0.86 4.11 -1.87 1.68 114.58 119.81 3fin h GLU 54 Ca -0.17 -0.02 -0.05 0.00 0.07 0.00 0.00 59.36 59.18 3fin h GLU 54 Cb 1.97 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 31.12 3fin h GLU 54 CO 0.17 0.26 -0.30 0.00 0.07 0.00 0.00 179.01 179.21 3fin h ALA 55 N 1.65 0.06 -0.54 1.06 0.00 -1.74 -3.17 119.26 116.57 3fin h ALA 55 Ca 0.62 -0.65 0.06 0.00 0.00 0.00 0.00 54.91 54.94 3fin h ALA 55 Cb 1.53 0.18 -0.09 0.00 0.00 0.00 0.00 17.79 19.41 3fin h ALA 55 CO -0.35 0.17 -0.57 1.49 0.00 0.00 0.00 179.25 180.00 3fin h GLU 56 N -1.00 -0.30 -0.58 0.00 4.57 0.51 -1.62 114.58 116.16 3fin h GLU 56 Ca -0.08 0.02 0.11 0.00 -1.18 0.00 0.00 59.36 58.23 3fin h GLU 56 Cb 1.03 0.07 -0.11 0.00 -0.16 0.00 0.00 28.75 29.58 3fin h GLU 56 CO -0.05 -0.20 -0.23 0.00 -1.18 0.00 0.00 179.01 177.35 3fin h ARG 57 N -0.31 -0.09 0.00 1.92 3.08 0.22 -1.04 114.38 118.17 3fin h ARG 57 Ca 0.09 0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.15 3fin h ARG 57 Cb 0.55 0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.62 3fin h ARG 57 CO -0.68 -0.06 0.12 -0.89 -1.07 0.00 0.00 179.97 177.39 3fin n ILE 58 N -5.43 1.27 1.19 2.04 2.08 -0.61 -0.22 119.36 119.67 3fin n ILE 58 Ca 0.06 0.43 0.13 0.00 0.56 0.00 0.00 62.75 63.92 3fin n ILE 58 Cb 0.34 -1.43 0.32 0.00 -0.75 0.00 0.00 39.64 38.11 3fin n ILE 58 CO 0.00 0.00 0.00 0.29 0.56 0.00 0.00 176.55 177.40 3fin n LYS 59 N -1.30 0.78 -1.48 0.38 5.02 -0.39 -3.95 118.16 117.22 3fin n LYS 59 Ca 0.00 -0.49 -0.13 0.00 -2.02 0.00 0.00 58.31 55.67 3fin n LYS 59 Cb 0.12 -1.49 0.09 0.00 -0.02 0.00 0.00 35.03 33.73 3fin n LYS 59 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 3fin n LEU 60 N -0.68 4.12 -0.34 -0.35 4.77 0.69 -1.92 117.00 123.28 3fin n LEU 60 Ca 0.11 -4.42 0.19 0.00 -0.03 0.00 0.00 56.01 51.85 3fin n LEU 60 Cb 0.36 -0.42 0.41 0.00 -2.33 0.00 0.00 43.42 41.44 3fin n LEU 60 CO 0.27 1.84 1.17 -0.07 -1.33 0.00 0.00 177.39 179.27 3fin h LEU 61 N 1.73 0.63 0.00 2.23 3.38 -1.69 -1.60 115.31 119.99 3fin h LEU 61 Ca 0.23 0.13 -0.06 0.00 0.09 0.00 0.00 57.88 58.27 3fin h LEU 61 Cb 1.34 0.03 -0.01 0.00 0.09 0.00 0.00 40.66 42.11 3fin h LEU 61 CO 0.48 0.09 -0.79 0.18 0.09 0.00 0.00 178.44 178.50 3fin n LEU 62 N -4.84 1.84 0.31 1.67 4.77 -1.26 -4.23 117.00 115.26 3fin n LEU 62 Ca 0.27 0.55 0.12 0.00 -0.03 0.00 0.00 56.01 56.91 3fin n LEU 62 Cb 0.78 -0.87 0.58 0.00 -2.33 0.00 0.00 43.42 41.57 3fin n LEU 62 CO 0.18 -0.27 1.10 1.55 -1.33 0.00 0.00 177.39 178.62 3fin h PRO 63 N -1.00 0.00 -2.56 3.23 0.13 -1.93 -3.46 132.00 126.41 3fin h PRO 63 Ca -0.10 0.00 0.29 0.00 -0.87 0.00 0.00 66.00 65.33 3fin h PRO 63 Cb 0.76 0.00 -0.09 0.00 0.13 0.00 0.00 31.00 31.81 3fin h PRO 63 CO -0.06 0.00 -0.49 0.66 -0.23 0.00 0.00 178.00 177.89 3fin n TYR 64 N -2.83 -2.78 0.00 1.56 4.02 -0.61 -5.14 117.16 111.39 3fin n TYR 64 Ca -0.00 1.41 0.00 0.00 -0.01 0.00 0.00 57.90 59.29 3fin n TYR 64 Cb 0.59 -2.53 0.00 0.00 -0.02 0.00 0.00 39.34 37.38 3fin n TYR 64 CO 0.00 0.00 0.00 -1.91 -1.01 0.00 0.00 176.86 173.94