#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fic n LEU 5 N 0.00 -4.64 0.00 -3.43 7.99 -1.26 -5.02 117.00 110.64 3fic n LEU 5 Ca 0.00 1.61 0.00 0.00 -0.01 0.00 0.00 56.01 57.61 3fic n LEU 5 Cb 0.00 -2.29 0.00 0.00 -0.11 0.00 0.00 43.42 41.02 3fic n LEU 5 CO 0.00 -1.73 0.19 2.29 -1.51 0.00 0.00 177.39 176.63 3fic n LYS 6 N 1.04 0.00 0.00 3.23 0.00 -1.26 -4.71 118.16 116.47 3fic n LYS 6 Ca -0.02 -0.45 0.00 0.00 -0.00 0.00 0.00 58.31 57.84 3fic n LYS 6 Cb 0.03 -0.76 0.00 0.00 -0.00 0.00 0.00 35.03 34.30 3fic n LYS 6 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.40 179.03 3fic n LYS 7 N -0.07 2.34 0.00 -1.58 4.01 -1.26 -5.09 118.16 116.52 3fic n LYS 7 Ca 0.00 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.80 3fic n LYS 7 Cb 0.18 -0.81 0.00 0.00 -0.51 0.00 0.00 35.03 33.90 3fic n LYS 7 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 3fic n GLY 8 N 1.63 6.21 0.12 0.72 0.00 -1.26 -5.08 105.19 107.53 3fic n GLY 8 Ca 0.00 -1.68 0.00 0.00 0.00 0.00 0.00 46.02 44.34 3fic n GLY 8 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3fic n VAL 9 N 0.00 0.00 0.00 1.61 0.31 -1.26 -4.90 118.33 114.09 3fic n VAL 9 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 3fic n VAL 9 Cb 0.00 0.29 0.00 0.00 -0.91 0.00 0.00 33.84 33.22 3fic n VAL 9 CO 0.00 0.00 0.00 2.22 -1.32 0.00 0.00 176.83 177.73 3fic n PHE 10 N 0.00 0.00 -1.87 3.52 -1.74 -1.26 -4.54 117.46 111.57 3fic n PHE 10 Ca 0.00 0.00 -0.36 0.00 -0.56 0.00 0.00 57.45 56.53 3fic n PHE 10 Cb 0.52 -0.21 -0.03 0.00 1.52 0.00 0.00 39.48 41.28 3fic n PHE 10 CO 0.00 0.00 0.00 0.54 -0.56 0.00 0.00 176.76 176.74 3fic s VAL 11 N 0.00 3.23 0.23 1.97 0.11 -1.26 -4.74 120.40 119.94 3fic s VAL 11 Ca 0.00 0.10 -0.15 0.00 -2.93 0.00 0.00 61.98 59.00 3fic s VAL 11 Cb 0.00 -3.61 -0.11 0.00 -1.53 0.00 0.00 36.38 31.13 3fic s VAL 11 CO 0.00 -0.59 0.12 0.47 -3.33 0.00 0.00 175.10 171.77 3fic n ASP 12 N 14.04 -1.65 0.08 3.54 10.43 -1.26 -4.90 116.55 136.83 3fic n ASP 12 Ca 0.27 0.58 -0.18 0.00 2.57 0.00 0.00 54.79 58.04 3fic n ASP 12 Cb 0.53 -0.59 -0.10 0.00 1.84 0.00 0.00 41.12 42.80 3fic n ASP 12 CO 0.00 0.00 0.00 0.44 -1.07 0.00 0.00 177.20 176.57 3fic h ASP 13 N 0.32 0.69 0.00 -2.24 3.32 -2.02 -3.26 116.42 113.23 3fic h ASP 13 Ca -0.23 -0.61 0.00 0.00 0.02 0.00 0.00 57.03 56.21 3fic h ASP 13 Cb 0.95 -0.22 0.00 0.00 0.22 0.00 0.00 39.33 40.29 3fic h ASP 13 CO 0.32 1.42 0.00 0.00 -1.72 0.00 0.00 179.24 179.27 3fic n HIS 14 N -3.74 0.00 0.00 4.55 1.44 -1.26 -1.07 115.22 115.13 3fic n HIS 14 Ca -0.10 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.61 3fic n HIS 14 Cb 0.92 0.00 0.00 0.00 0.12 0.00 0.00 29.99 31.03 3fic n HIS 14 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 3fic n LEU 15 N -0.64 0.33 -0.26 2.39 7.99 -1.23 -3.85 117.00 121.73 3fic n LEU 15 Ca 0.01 0.03 0.06 0.00 -0.01 0.00 0.00 56.01 56.09 3fic n LEU 15 Cb 0.00 -0.16 0.16 0.00 -0.11 0.00 0.00 43.42 43.32 3fic n LEU 15 CO 0.01 -0.16 0.82 -0.07 -1.51 0.00 0.00 177.39 176.47 3fic h LEU 16 N 0.00 -0.38 -0.74 2.23 4.07 -1.67 1.00 115.31 119.82 3fic h LEU 16 Ca 0.00 0.20 0.12 0.00 0.08 0.00 0.00 57.88 58.29 3fic h LEU 16 Cb 0.00 0.36 -0.13 0.00 1.08 0.00 0.00 40.66 41.97 3fic h LEU 16 CO 0.00 -0.19 -0.36 -0.08 -1.08 0.00 0.00 178.44 176.73 3fic h GLU 17 N 0.09 -0.10 0.00 1.13 4.81 -1.34 5.93 114.58 125.10 3fic h GLU 17 Ca 0.43 0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.66 3fic h GLU 17 Cb 0.75 0.02 0.00 0.00 0.63 0.00 0.00 28.75 30.16 3fic h GLU 17 CO -0.69 -0.07 0.00 -0.22 -0.73 0.00 0.00 179.01 177.30 3fic h LYS 18 N -0.10 0.00 0.12 1.92 1.63 0.06 -2.35 116.57 117.85 3fic h LYS 18 Ca 0.27 0.00 -0.37 0.00 -0.85 0.00 0.00 60.65 59.71 3fic h LYS 18 Cb 0.57 0.00 -0.02 0.00 -0.60 0.00 0.00 32.23 32.18 3fic h LYS 18 CO -0.80 0.00 -2.02 0.28 -3.45 0.00 0.00 179.45 173.46 3fic n VAL 19 N -2.37 1.77 -0.09 2.00 0.31 0.29 -3.42 118.33 116.82 3fic n VAL 19 Ca 0.05 -0.65 -0.12 0.00 -0.01 0.00 0.00 64.34 63.61 3fic n VAL 19 Cb 0.41 -1.72 -0.04 0.00 -0.91 0.00 0.00 33.84 31.58 3fic n VAL 19 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 3fic h LEU 20 N 0.06 0.52 -1.59 7.52 3.38 1.17 0.12 115.31 126.49 3fic h LEU 20 Ca -0.43 -0.38 -0.05 0.00 0.09 0.00 0.00 57.88 57.11 3fic h LEU 20 Cb 2.02 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 42.63 3fic h LEU 20 CO 0.08 0.78 -0.22 1.05 0.09 0.00 0.00 178.44 180.22 3fic h GLU 21 N 0.25 0.00 0.00 1.13 4.11 -1.56 0.28 114.58 118.79 3fic h GLU 21 Ca 0.06 0.00 -0.11 0.00 0.07 0.00 0.00 59.36 59.38 3fic h GLU 21 Cb 0.56 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.80 3fic h GLU 21 CO 0.03 0.22 -0.53 1.25 0.07 0.00 0.00 179.01 180.04 3fic h LEU 22 N 0.00 0.00 -1.92 3.06 7.12 -1.49 -2.54 115.31 119.55 3fic h LEU 22 Ca -0.00 0.00 0.00 0.00 0.13 0.00 0.00 57.88 58.01 3fic h LEU 22 Cb 0.41 0.00 0.00 0.00 -0.53 0.00 0.00 40.66 40.54 3fic h LEU 22 CO 0.03 0.53 0.12 -1.13 -0.13 0.00 0.00 178.44 177.86 3fic h ASN 23 N 0.00 0.00 -1.06 1.25 -1.24 0.23 -2.92 115.58 111.85 3fic h ASN 23 Ca -0.01 0.00 -0.27 0.00 0.71 0.00 0.00 56.30 56.74 3fic h ASN 23 Cb 1.15 0.00 -0.00 0.00 0.73 0.00 0.00 38.32 40.20 3fic h ASN 23 CO 0.07 0.00 0.88 0.00 -1.29 0.00 0.00 177.43 177.09 3fic s ALA 24 N -3.80 1.28 0.00 1.57 0.00 -0.96 -2.83 121.76 117.03 3fic s ALA 24 Ca -0.03 -0.49 0.00 0.00 0.00 0.00 0.00 51.96 51.44 3fic s ALA 24 Cb 0.08 -4.46 0.00 0.00 0.00 0.00 0.00 23.12 18.75 3fic s ALA 24 CO 0.26 -5.05 0.00 1.63 0.00 0.00 0.00 175.76 172.60 3fic n LYS 25 N 8.94 0.00 -2.35 0.00 5.02 -1.26 -4.32 118.16 124.18 3fic n LYS 25 Ca 0.40 0.00 -0.04 0.00 -2.02 0.00 0.00 58.31 56.65 3fic n LYS 25 Cb 0.49 -3.53 -0.03 0.00 -0.02 0.00 0.00 35.03 31.94 3fic n LYS 25 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3fic n GLY 26 N -2.00 -4.97 0.00 0.72 0.00 -1.10 -5.09 105.19 92.76 3fic n GLY 26 Ca 0.00 1.24 0.00 0.00 0.00 0.00 0.00 46.02 47.26 3fic n GLY 26 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3fic n GLU 27 N 1.42 0.00 0.00 1.61 4.71 -1.24 -5.08 120.64 122.06 3fic n GLU 27 Ca -0.31 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 56.84 3fic n GLU 27 Cb 0.47 0.00 0.00 0.00 -1.01 0.00 0.00 31.44 30.90 3fic n GLU 27 CO 0.00 0.00 0.00 1.63 0.09 0.00 0.00 177.13 178.85 3fic n LYS 28 N 0.00 3.05 0.00 3.49 4.76 -1.26 -5.07 118.16 123.13 3fic n LYS 28 Ca 0.00 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 3fic n LYS 28 Cb 0.00 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.19 3fic n LYS 28 CO 0.00 0.00 0.00 2.89 -1.37 0.00 0.00 177.40 178.92 3fic n ARG 29 N 0.00 0.00 -1.01 1.97 -4.01 -1.26 -4.99 116.66 107.36 3fic n ARG 29 Ca 0.00 0.00 -0.46 0.00 -1.04 0.00 0.00 57.85 56.35 3fic n ARG 29 Cb 0.00 0.00 -0.09 0.00 -3.04 0.00 0.00 32.46 29.33 3fic n ARG 29 CO 0.00 0.00 0.00 -0.11 -3.04 0.00 0.00 177.63 174.48 3fic n LEU 30 N -1.05 0.63 -3.66 2.89 0.00 -1.26 -4.70 117.00 109.85 3fic n LEU 30 Ca 0.00 0.58 -0.10 0.00 0.00 0.00 0.00 56.01 56.49 3fic n LEU 30 Cb 0.00 -0.68 -0.11 0.00 0.00 0.00 0.00 43.42 42.64 3fic n LEU 30 CO 0.00 -0.59 -0.04 -0.51 0.00 0.00 0.00 177.39 176.25 3fic s ILE 31 N 4.10 -0.55 0.36 1.96 2.07 -1.25 -5.09 121.20 122.80 3fic s ILE 31 Ca 0.88 0.21 0.03 0.00 -1.41 0.00 0.00 60.65 60.36 3fic s ILE 31 Cb -1.13 -0.58 -0.02 0.00 0.13 0.00 0.00 42.46 40.86 3fic s ILE 31 CO 0.52 0.09 0.53 -0.54 -1.91 0.00 0.00 174.94 173.63 3fic s LYS 32 N 2.52 3.26 0.08 3.50 1.02 -1.26 -2.57 119.74 126.28 3fic s LYS 32 Ca -0.01 -0.62 -0.27 0.00 0.02 0.00 0.00 55.97 55.09 3fic s LYS 32 Cb -0.12 -2.71 0.09 0.00 -0.52 0.00 0.00 37.83 34.57 3fic s LYS 32 CO -0.11 0.05 1.12 -0.08 -0.92 0.00 0.00 175.35 175.41 3fic s THR 33 N -2.30 0.00 -0.06 2.17 -1.32 -1.08 -4.96 115.64 108.09 3fic s THR 33 Ca 0.43 -0.45 0.09 0.00 -1.21 0.00 0.00 61.69 60.55 3fic s THR 33 Cb -0.10 -2.08 0.14 0.00 -1.51 0.00 0.00 72.50 68.95 3fic s THR 33 CO 0.34 0.00 1.03 0.79 -2.21 0.00 0.00 174.62 174.57 3fic n TRP 34 N -0.51 0.00 -1.14 9.09 8.01 -1.26 -2.40 117.44 129.23 3fic n TRP 34 Ca -0.07 -0.63 -0.22 0.00 -1.31 0.00 0.00 57.50 55.27 3fic n TRP 34 Cb 0.62 -0.09 0.02 0.00 -2.01 0.00 0.00 31.31 29.84 3fic n TRP 34 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.69 175.55 3fic n SER 35 N -0.84 6.65 0.00 -0.99 3.41 -1.26 -4.50 113.62 116.10 3fic n SER 35 Ca 0.08 -3.21 0.00 0.00 -0.26 0.00 0.00 58.87 55.47 3fic n SER 35 Cb 0.52 -1.10 0.00 0.00 -0.26 0.00 0.00 64.21 63.37 3fic n SER 35 CO 0.00 0.00 0.00 -2.11 -0.16 0.00 0.00 175.04 172.77 3fic n ARG 36 N 0.32 0.00 0.00 4.33 1.85 -1.26 0.62 116.66 122.51 3fic n ARG 36 Ca 0.40 0.28 0.12 0.00 -1.00 0.00 0.00 57.85 57.65 3fic n ARG 36 Cb 0.57 -1.55 0.21 0.00 -1.05 0.00 0.00 32.46 30.64 3fic n ARG 36 CO 0.00 0.00 0.00 2.89 -0.01 0.00 0.00 177.63 180.51 3fic n ARG 37 N -1.26 0.67 -2.80 2.89 1.85 -1.26 -0.94 116.66 115.81 3fic n ARG 37 Ca 0.00 -0.46 -0.22 0.00 -1.00 0.00 0.00 57.85 56.17 3fic n ARG 37 Cb 0.05 -1.49 0.09 0.00 -1.05 0.00 0.00 32.46 30.07 3fic n ARG 37 CO 0.00 0.00 0.00 -1.54 -0.01 0.00 0.00 177.63 176.08 3fic s SER 38 N -2.65 4.61 0.32 2.89 1.04 0.20 -4.92 113.70 115.19 3fic s SER 38 Ca 0.19 -0.65 0.07 0.00 0.48 0.00 0.00 55.95 56.03 3fic s SER 38 Cb 0.18 0.26 -0.02 0.00 0.10 0.00 0.00 66.02 66.54 3fic s SER 38 CO 0.61 -1.70 0.41 -0.89 0.98 0.00 0.00 173.24 172.65 3fic s THR 39 N -2.95 4.11 -0.08 2.02 2.01 -1.26 -3.13 115.64 116.36 3fic s THR 39 Ca 0.65 -1.09 -0.23 0.00 0.31 0.00 0.00 61.69 61.34 3fic s THR 39 Cb -0.05 -3.41 -0.04 0.00 0.01 0.00 0.00 72.50 69.01 3fic s THR 39 CO 0.42 -0.19 0.68 -0.63 -0.69 0.00 0.00 174.62 174.21 3fic s ILE 40 N -2.18 5.06 -0.15 1.82 1.01 -0.42 -4.83 121.20 121.52 3fic s ILE 40 Ca 0.42 1.39 -0.10 0.00 0.00 0.00 0.00 60.65 62.36 3fic s ILE 40 Cb -0.09 -4.01 -0.05 0.00 0.01 0.00 0.00 42.46 38.32 3fic s ILE 40 CO 0.30 0.25 0.19 -0.69 0.00 0.00 0.00 174.94 174.99 3fic s VAL 41 N 0.83 5.39 0.35 2.92 1.01 -1.26 -4.53 120.40 125.11 3fic s VAL 41 Ca 0.36 0.33 -0.27 0.00 0.00 0.00 0.00 61.98 62.40 3fic s VAL 41 Cb -0.17 -3.50 -0.12 0.00 0.00 0.00 0.00 36.38 32.58 3fic s VAL 41 CO 0.17 0.50 1.16 -2.65 0.00 0.00 0.00 175.10 174.28 3fic n PRO 42 N 2.90 1.76 -0.33 2.72 -0.02 -1.26 -1.33 135.00 139.45 3fic n PRO 42 Ca -0.16 0.62 0.00 0.00 -2.02 0.00 0.00 63.50 61.94 3fic n PRO 42 Cb 0.53 -2.15 0.00 0.00 -0.02 0.00 0.00 33.50 31.86 3fic n PRO 42 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 3fic n GLU 43 N 0.47 0.00 -0.16 -0.52 2.13 -1.26 -4.88 120.64 116.42 3fic n GLU 43 Ca 0.07 0.00 0.02 0.00 0.66 0.00 0.00 57.16 57.91 3fic n GLU 43 Cb 0.36 -1.46 0.09 0.00 0.27 0.00 0.00 31.44 30.69 3fic n GLU 43 CO 0.00 0.00 0.00 -1.33 -0.41 0.00 0.00 177.13 175.39 3fic n MET 44 N -2.00 1.71 -2.35 5.31 2.81 -0.44 -4.89 117.12 117.28 3fic n MET 44 Ca 0.00 -0.67 -0.34 0.00 -1.81 0.00 0.00 57.70 54.87 3fic n MET 44 Cb 0.00 -1.49 -0.01 0.00 -0.71 0.00 0.00 33.22 31.01 3fic n MET 44 CO 0.00 0.00 0.00 0.14 1.51 0.00 0.00 175.97 177.62 3fic s VAL 45 N -1.53 3.51 0.00 2.03 -7.23 -1.26 -3.00 120.40 112.93 3fic s VAL 45 Ca 0.12 0.91 0.00 0.00 -1.81 0.00 0.00 61.98 61.20 3fic s VAL 45 Cb 0.08 -3.36 0.00 0.00 0.56 0.00 0.00 36.38 33.66 3fic s VAL 45 CO 0.05 -0.23 0.00 0.61 -0.31 0.00 0.00 175.10 175.21 3fic n GLY 46 N -0.16 2.65 3.05 2.32 0.00 -0.64 -4.92 105.19 107.48 3fic n GLY 46 Ca 0.10 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.69 3fic n GLY 46 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3fic n HIS 47 N -2.00 3.01 -1.65 1.61 -0.00 -1.16 -4.92 115.22 110.11 3fic n HIS 47 Ca 0.00 -2.87 -0.53 0.00 -0.00 0.00 0.00 57.72 54.33 3fic n HIS 47 Cb 0.00 -1.54 -0.06 0.00 -0.00 0.00 0.00 29.99 28.38 3fic n HIS 47 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 176.34 176.59 3fic n THR 48 N 2.19 0.39 -3.81 1.59 -2.24 -1.26 -4.61 114.28 106.54 3fic n THR 48 Ca 0.30 -0.11 -0.36 0.00 -2.27 0.00 0.00 64.05 61.60 3fic n THR 48 Cb 0.35 -1.56 -0.12 0.00 -2.10 0.00 0.00 70.33 66.90 3fic n THR 48 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 3fic s ILE 49 N 4.50 3.24 0.04 2.28 1.09 0.14 -3.85 121.20 128.64 3fic s ILE 49 Ca 0.98 -1.87 -0.30 0.00 -1.10 0.00 0.00 60.65 58.37 3fic s ILE 49 Cb -0.88 -3.13 -0.09 0.00 -1.06 0.00 0.00 42.46 37.30 3fic s ILE 49 CO 0.57 -0.54 1.96 0.00 -0.10 0.00 0.00 174.94 176.83 3fic s ALA 50 N 1.17 3.59 0.06 9.38 0.00 -1.06 -3.80 121.76 131.11 3fic s ALA 50 Ca 0.05 1.33 0.02 0.00 0.00 0.00 0.00 51.96 53.36 3fic s ALA 50 Cb -0.22 -3.84 -0.04 0.00 0.00 0.00 0.00 23.12 19.02 3fic s ALA 50 CO -0.03 -1.55 0.09 0.08 0.00 0.00 0.00 175.76 174.35 3fic s VAL 51 N 4.34 4.68 0.41 0.00 1.01 -0.51 -2.64 120.40 127.68 3fic s VAL 51 Ca 0.88 -0.64 -0.10 0.00 0.00 0.00 0.00 61.98 62.12 3fic s VAL 51 Cb -0.43 -3.23 -0.06 0.00 0.00 0.00 0.00 36.38 32.66 3fic s VAL 51 CO 0.41 0.18 0.77 -0.47 0.00 0.00 0.00 175.10 175.99 3fic s TYR 52 N -1.36 3.48 0.00 5.22 5.04 -1.01 0.78 117.35 129.50 3fic s TYR 52 Ca 0.29 1.03 0.00 0.00 -2.44 0.00 0.00 57.07 55.94 3fic s TYR 52 Cb -0.12 -2.43 0.00 0.00 0.35 0.00 0.00 41.96 39.76 3fic s TYR 52 CO 0.21 -0.13 0.03 0.27 -1.34 0.00 0.00 175.55 174.59 3fic n ASN 53 N -1.40 0.06 0.00 4.32 6.94 -1.09 -4.80 115.26 119.30 3fic n ASN 53 Ca 0.02 -0.40 0.00 0.00 -0.02 0.00 0.00 54.58 54.19 3fic n ASN 53 Cb 0.54 0.11 0.00 0.00 -2.36 0.00 0.00 39.78 38.07 3fic n ASN 53 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3fic n GLY 54 N 0.11 2.02 0.65 4.83 0.00 -1.26 -4.80 105.19 106.74 3fic n GLY 54 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.96 3fic n GLY 54 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 3fic n LYS 55 N -0.04 0.23 -1.25 1.61 3.00 -1.26 -5.13 118.16 115.31 3fic n LYS 55 Ca 0.00 0.09 0.00 0.00 -0.00 0.00 0.00 58.31 58.40 3fic n LYS 55 Cb 0.00 -0.89 0.00 0.00 0.00 0.00 0.00 35.03 34.14 3fic n LYS 55 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 3fic n GLN 56 N -3.82 0.00 -3.72 1.64 10.64 -1.26 -5.14 117.38 115.72 3fic n GLN 56 Ca -0.09 0.00 -0.38 0.00 -1.83 0.00 0.00 57.00 54.70 3fic n GLN 56 Cb 0.31 0.00 -0.12 0.00 -0.86 0.00 0.00 30.24 29.57 3fic n GLN 56 CO 0.00 0.00 0.00 -1.01 -1.83 0.00 0.00 177.06 174.22 3fic s HIS 57 N -6.73 3.16 -0.38 2.61 3.76 -1.25 -2.66 115.29 113.80 3fic s HIS 57 Ca 0.00 -0.83 -0.29 0.00 -0.15 0.00 0.00 55.06 53.79 3fic s HIS 57 Cb 0.00 -2.30 0.00 0.00 1.11 0.00 0.00 32.58 31.40 3fic s HIS 57 CO 0.00 -0.54 1.47 0.14 -0.85 0.00 0.00 174.74 174.97 3fic s VAL 58 N 1.54 3.84 -0.96 -0.90 -7.23 0.23 -4.63 120.40 112.30 3fic s VAL 58 Ca 0.03 0.87 -0.26 0.00 -1.81 0.00 0.00 61.98 60.82 3fic s VAL 58 Cb -0.17 -4.09 -0.20 0.00 0.56 0.00 0.00 36.38 32.48 3fic s VAL 58 CO 0.04 -0.66 1.97 -0.81 -0.31 0.00 0.00 175.10 175.33 3fic n PRO 59 N 8.06 0.72 -3.29 4.82 -0.04 -1.26 -1.43 135.00 142.58 3fic n PRO 59 Ca 0.17 -1.90 -0.39 0.00 -0.04 0.00 0.00 63.50 61.35 3fic n PRO 59 Cb 0.48 -3.61 -0.07 0.00 -0.04 0.00 0.00 33.50 30.25 3fic n PRO 59 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 3fic s VAL 60 N 12.95 5.13 1.22 0.52 0.11 -1.25 -4.88 120.40 134.22 3fic s VAL 60 Ca 0.74 0.87 -0.19 0.00 -2.93 0.00 0.00 61.98 60.46 3fic s VAL 60 Cb 0.01 -3.80 0.29 0.00 -1.53 0.00 0.00 36.38 31.34 3fic s VAL 60 CO 0.19 0.20 1.08 -0.47 -3.33 0.00 0.00 175.10 172.76 3fic s TYR 61 N 1.57 0.46 -0.20 1.54 5.04 -1.26 0.25 117.35 124.75 3fic s TYR 61 Ca 0.22 0.56 -0.08 0.00 -2.44 0.00 0.00 57.07 55.33 3fic s TYR 61 Cb -0.15 -3.35 0.08 0.00 0.35 0.00 0.00 41.96 38.89 3fic s TYR 61 CO 0.09 -3.98 0.44 -1.50 -1.34 0.00 0.00 175.55 169.26 3fic s ILE 62 N -2.88 -0.45 0.01 3.14 1.10 -1.26 -4.63 121.20 116.23 3fic s ILE 62 Ca 0.70 0.13 -0.03 0.00 -0.51 0.00 0.00 60.65 60.94 3fic s ILE 62 Cb -0.11 -0.69 -0.01 0.00 0.15 0.00 0.00 42.46 41.80 3fic s ILE 62 CO 0.57 0.05 0.04 0.28 -2.11 0.00 0.00 174.94 173.77 3fic s THR 63 N 2.22 0.09 0.16 4.00 -1.32 -1.26 -1.62 115.64 117.92 3fic s THR 63 Ca -0.05 -0.78 0.10 0.00 -1.21 0.00 0.00 61.69 59.75 3fic s THR 63 Cb -0.11 -0.32 0.16 0.00 -1.51 0.00 0.00 72.50 70.72 3fic s THR 63 CO -0.13 -0.43 0.69 -1.84 -2.21 0.00 0.00 174.62 170.70 3fic n GLU 64 N 1.60 -0.02 -0.31 7.08 0.28 -1.26 0.15 120.64 128.16 3fic n GLU 64 Ca -0.23 0.59 0.16 0.00 -0.16 0.00 0.00 57.16 57.53 3fic n GLU 64 Cb 0.55 -1.08 0.35 0.00 1.43 0.00 0.00 31.44 32.70 3fic n GLU 64 CO 0.00 0.00 0.00 -0.91 -0.16 0.00 0.00 177.13 176.06 3fic h ASN 65 N 0.00 0.22 -3.63 -1.84 4.21 -2.05 -3.33 115.58 109.16 3fic h ASN 65 Ca 0.37 0.19 -0.65 0.00 1.21 0.00 0.00 56.30 57.42 3fic h ASN 65 Cb 1.01 0.20 -0.22 0.00 -1.12 0.00 0.00 38.32 38.19 3fic h ASN 65 CO -0.32 -0.12 -0.62 0.00 -1.29 0.00 0.00 177.43 175.08 3fic s MET 66 N -5.84 3.67 0.04 0.81 0.23 0.40 -4.93 119.30 113.68 3fic s MET 66 Ca -0.11 -0.47 0.00 0.00 -1.03 0.00 0.00 55.69 54.08 3fic s MET 66 Cb 0.27 -3.32 0.00 0.00 -1.53 0.00 0.00 34.83 30.25 3fic s MET 66 CO 0.78 -0.16 0.00 0.28 -2.03 0.00 0.00 175.02 173.89 3fic n VAL 67 N 4.84 0.00 0.01 5.16 0.31 -1.25 -4.44 118.33 122.96 3fic n VAL 67 Ca -0.16 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.17 3fic n VAL 67 Cb 0.51 -0.03 0.00 0.00 -0.91 0.00 0.00 33.84 33.42 3fic n VAL 67 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3fic n GLY 68 N 0.25 -0.00 3.99 2.92 0.00 -1.26 -3.02 105.19 108.06 3fic n GLY 68 Ca 0.00 -0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 3fic n GLY 68 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3fic s HIS 69 N -2.00 1.73 -0.01 1.61 4.02 -1.26 -4.85 115.29 114.53 3fic s HIS 69 Ca 0.00 -0.27 0.01 0.00 1.02 0.00 0.00 55.06 55.83 3fic s HIS 69 Cb 0.00 -2.92 -0.04 0.00 -1.02 0.00 0.00 32.58 28.60 3fic s HIS 69 CO 0.00 -1.58 0.00 0.15 1.02 0.00 0.00 174.74 174.33 3fic s LYS 70 N -5.07 2.80 0.23 1.40 -0.14 -1.26 -1.30 119.74 116.40 3fic s LYS 70 Ca 0.65 -0.59 0.17 0.00 -1.36 0.00 0.00 55.97 54.84 3fic s LYS 70 Cb -0.06 -2.68 0.88 0.00 -1.68 0.00 0.00 37.83 34.29 3fic s LYS 70 CO 0.43 0.63 1.52 1.28 -0.76 0.00 0.00 175.35 178.45 3fic n LEU 71 N 1.47 0.43 -0.03 3.17 4.77 -1.18 -1.48 117.00 124.15 3fic n LEU 71 Ca -0.15 0.69 -0.15 0.00 -0.03 0.00 0.00 56.01 56.37 3fic n LEU 71 Cb 0.53 -0.72 -0.10 0.00 -2.33 0.00 0.00 43.42 40.80 3fic n LEU 71 CO 0.33 -0.78 0.45 1.23 -1.33 0.00 0.00 177.39 177.28 3fic h GLY 72 N 0.36 0.32 -0.15 -0.72 0.00 -1.31 -2.99 103.07 98.58 3fic h GLY 72 Ca 0.00 -0.46 0.27 0.00 0.00 0.00 0.00 47.33 47.15 3fic h GLY 72 CO 0.00 0.41 0.69 0.83 0.00 0.00 0.00 176.54 178.46 3fic h GLU 73 N -0.23 0.33 0.00 4.80 5.08 -1.50 0.87 114.58 123.93 3fic h GLU 73 Ca -0.02 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 3fic h GLU 73 Cb 0.94 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.12 3fic h GLU 73 CO 0.06 0.22 0.00 1.19 -1.00 0.00 0.00 179.01 179.47 3fic n PHE 74 N -4.56 0.14 -4.23 4.33 3.72 -1.14 -4.68 117.46 111.04 3fic n PHE 74 Ca 0.25 0.04 -0.34 0.00 -0.05 0.00 0.00 57.45 57.35 3fic n PHE 74 Cb 0.92 -0.57 -0.12 0.00 -0.94 0.00 0.00 39.48 38.77 3fic n PHE 74 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3fic s ALA 75 N -3.02 2.99 -0.17 4.37 0.00 0.30 -5.03 121.76 121.20 3fic s ALA 75 Ca 0.12 -0.92 -0.26 0.00 0.00 0.00 0.00 51.96 50.90 3fic s ALA 75 Cb 0.17 -1.65 -0.01 0.00 0.00 0.00 0.00 23.12 21.62 3fic s ALA 75 CO 0.50 0.00 0.88 -1.25 0.00 0.00 0.00 175.76 175.90 3fic s PRO 76 N 0.73 4.31 -0.05 0.00 0.04 -1.26 -4.90 135.00 133.87 3fic s PRO 76 Ca -0.01 1.11 -0.25 0.00 0.04 0.00 0.00 61.00 61.89 3fic s PRO 76 Cb -0.14 -3.58 -0.23 0.00 0.04 0.00 0.00 34.50 30.59 3fic s PRO 76 CO 0.02 -0.36 1.04 1.79 0.04 0.00 0.00 177.00 179.53 3fic h THR 77 N 5.21 1.54 -1.69 1.26 1.35 -1.90 -3.47 112.91 115.21 3fic h THR 77 Ca -0.28 -1.87 -0.44 0.00 -0.55 0.00 0.00 66.41 63.26 3fic h THR 77 Cb 1.13 2.72 0.04 0.00 -1.73 0.00 0.00 68.15 70.30 3fic h THR 77 CO 0.86 0.51 -0.13 -0.13 -0.25 0.00 0.00 175.52 176.37 3fic s ARG 78 N -3.21 2.54 0.02 4.72 0.52 -1.26 -4.95 118.95 117.33 3fic s ARG 78 Ca -0.16 -1.17 0.07 0.00 -0.52 0.00 0.00 55.73 53.95 3fic s ARG 78 Cb 0.01 -2.62 -0.03 0.00 0.52 0.00 0.00 34.95 32.83 3fic s ARG 78 CO 0.73 -0.62 -0.19 0.99 0.02 0.00 0.00 175.30 176.23 3fic s THR 79 N -2.60 2.69 0.00 0.02 2.01 -1.26 -4.79 115.64 111.70 3fic s THR 79 Ca 0.58 -1.13 0.00 0.00 0.31 0.00 0.00 61.69 61.45 3fic s THR 79 Cb -0.09 -2.09 0.00 0.00 0.01 0.00 0.00 72.50 70.33 3fic s THR 79 CO 0.37 0.41 0.00 0.00 -0.69 0.00 0.00 174.62 174.70 3fic n TYR 80 N 1.79 0.00 -2.37 4.92 9.36 -1.26 -5.13 117.16 124.47 3fic n TYR 80 Ca -0.16 0.00 -0.17 0.00 3.32 0.00 0.00 57.90 60.89 3fic n TYR 80 Cb 0.52 -0.33 0.09 0.00 -0.63 0.00 0.00 39.34 38.99 3fic n TYR 80 CO 0.00 0.00 0.00 0.54 0.22 0.00 0.00 176.86 177.62 3fic n ARG 81 N -0.18 -0.03 0.00 2.98 5.12 -1.26 -5.27 116.66 118.01 3fic n ARG 81 Ca 0.00 -1.81 0.00 0.00 -1.93 0.00 0.00 57.85 54.11 3fic n ARG 81 Cb 0.07 -0.53 0.00 0.00 -1.16 0.00 0.00 32.46 30.84 3fic n ARG 81 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11