#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fvc n VAL 2 N 0.00 0.00 -4.20 6.31 0.31 -1.23 -4.96 118.33 114.56 1fvc n VAL 2 Ca 0.00 0.00 -0.15 0.00 -0.01 0.00 0.00 64.34 64.18 1fvc n VAL 2 Cb 0.00 0.00 -0.11 0.00 -0.91 0.00 0.00 33.84 32.82 1fvc n VAL 2 CO 0.00 0.00 0.00 -1.58 -1.32 0.00 0.00 176.83 173.93 1fvc s GLN 3 N -1.87 0.92 -0.15 5.55 2.00 -0.29 -5.00 119.66 120.83 1fvc s GLN 3 Ca 0.00 -1.24 -0.05 0.00 -2.00 0.00 0.00 55.36 52.07 1fvc s GLN 3 Cb 0.00 -0.62 0.07 0.00 0.80 0.00 0.00 33.01 33.27 1fvc s GLN 3 CO 0.00 0.10 0.31 -0.51 -0.50 0.00 0.00 175.29 174.68 1fvc s LEU 4 N -2.60 -0.40 -0.07 3.68 1.43 -1.26 -2.18 118.68 117.27 1fvc s LEU 4 Ca 0.08 0.68 0.04 0.00 -1.03 0.00 0.00 54.13 53.91 1fvc s LEU 4 Cb -0.02 0.88 -0.00 0.00 0.03 0.00 0.00 46.19 47.08 1fvc s LEU 4 CO 0.01 -0.24 -0.21 -0.69 0.23 0.00 0.00 176.35 175.45 1fvc s VAL 5 N 2.47 1.78 0.29 -1.59 1.01 -0.24 -4.01 120.40 120.10 1fvc s VAL 5 Ca 0.01 -0.88 0.08 0.00 0.00 0.00 0.00 61.98 61.18 1fvc s VAL 5 Cb -0.12 -1.53 -0.03 0.00 0.00 0.00 0.00 36.38 34.69 1fvc s VAL 5 CO -0.10 0.50 0.20 -1.61 0.00 0.00 0.00 175.10 174.09 1fvc s GLU 6 N 0.20 2.75 0.25 2.72 2.02 -1.26 0.08 118.70 125.47 1fvc s GLU 6 Ca -0.11 -1.21 -0.21 0.00 0.02 0.00 0.00 54.97 53.46 1fvc s GLU 6 Cb -0.15 -2.46 0.04 0.00 0.10 0.00 0.00 34.13 31.66 1fvc s GLU 6 CO 0.05 0.28 0.82 -1.54 0.02 0.00 0.00 175.26 174.90 1fvc s SER 7 N -3.87 -0.18 0.00 -0.19 1.04 -1.03 -4.98 113.70 104.49 1fvc s SER 7 Ca 0.35 -0.63 0.00 0.00 0.48 0.00 0.00 55.95 56.15 1fvc s SER 7 Cb -0.07 0.66 0.00 0.00 0.10 0.00 0.00 66.02 66.71 1fvc s SER 7 CO 0.25 -1.24 0.00 0.61 0.98 0.00 0.00 173.24 173.83 1fvc n GLY 8 N -0.49 1.04 4.01 7.32 0.00 -1.26 -1.69 105.19 114.12 1fvc n GLY 8 Ca -0.05 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.77 1fvc n GLY 8 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1fvc s GLY 9 N -1.66 1.84 0.00 -0.02 0.00 -1.26 -4.42 107.32 101.81 1fvc s GLY 9 Ca 0.00 -1.97 0.00 0.00 0.00 0.00 0.00 44.72 42.75 1fvc s GLY 9 CO 0.00 -1.66 0.00 0.61 0.00 0.00 0.00 173.10 172.05 1fvc n GLY 10 N -2.09 -0.39 3.76 0.20 0.00 -0.76 -4.96 105.19 100.94 1fvc n GLY 10 Ca 0.12 -1.26 -0.40 0.00 0.00 0.00 0.00 46.02 44.48 1fvc n GLY 10 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1fvc s LEU 11 N 0.00 4.61 -0.09 0.99 0.20 -1.26 -1.18 118.68 121.95 1fvc s LEU 11 Ca 0.00 1.75 -0.14 0.00 0.69 0.00 0.00 54.13 56.44 1fvc s LEU 11 Cb 0.00 -3.42 0.03 0.00 -0.43 0.00 0.00 46.19 42.38 1fvc s LEU 11 CO 0.00 0.18 0.35 -0.69 -0.29 0.00 0.00 176.35 175.90 1fvc s VAL 12 N -1.09 0.02 0.60 1.68 1.01 -0.29 -4.95 120.40 117.39 1fvc s VAL 12 Ca 0.38 -0.16 -0.12 0.00 0.00 0.00 0.00 61.98 62.08 1fvc s VAL 12 Cb -0.24 -0.55 -0.05 0.00 0.00 0.00 0.00 36.38 35.54 1fvc s VAL 12 CO 0.28 -0.09 1.02 -1.10 0.00 0.00 0.00 175.10 175.22 1fvc s GLN 13 N -0.36 3.64 0.68 2.72 1.11 -1.26 -1.65 119.66 124.54 1fvc s GLN 13 Ca -0.05 0.79 -0.17 0.00 0.01 0.00 0.00 55.36 55.94 1fvc s GLN 13 Cb -0.03 -2.09 -0.04 0.00 -1.01 0.00 0.00 33.01 29.84 1fvc s GLN 13 CO 0.02 -0.53 0.66 -2.30 0.01 0.00 0.00 175.29 173.15 1fvc n PRO 14 N -2.56 0.44 -0.03 2.91 -0.02 -1.26 -1.76 135.00 132.72 1fvc n PRO 14 Ca 0.06 0.19 0.00 0.00 -2.02 0.00 0.00 63.50 61.73 1fvc n PRO 14 Cb 0.54 -1.92 0.00 0.00 -0.02 0.00 0.00 33.50 32.10 1fvc n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1fvc n GLY 15 N 1.52 1.59 3.41 -1.23 0.00 -0.22 -4.92 105.19 105.35 1fvc n GLY 15 Ca 0.11 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.83 1fvc n GLY 15 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1fvc s GLY 16 N -2.00 1.48 0.04 -0.02 0.00 -0.72 -4.16 107.32 101.93 1fvc s GLY 16 Ca 0.00 -0.79 -0.01 0.00 0.00 0.00 0.00 44.72 43.92 1fvc s GLY 16 CO 0.00 0.15 -0.01 -0.45 0.00 0.00 0.00 173.10 172.80 1fvc s SER 17 N -3.32 0.35 0.14 1.64 0.15 -1.26 -1.54 113.70 109.85 1fvc s SER 17 Ca 0.69 -0.74 -0.24 0.00 0.70 0.00 0.00 55.95 56.36 1fvc s SER 17 Cb -0.13 0.17 0.07 0.00 -1.71 0.00 0.00 66.02 64.42 1fvc s SER 17 CO 0.58 -0.48 0.72 -0.22 1.20 0.00 0.00 173.24 175.04 1fvc s LEU 18 N -2.27 -0.44 -0.06 3.45 2.96 -0.04 -4.99 118.68 117.29 1fvc s LEU 18 Ca -0.03 -0.13 0.01 0.00 -0.22 0.00 0.00 54.13 53.76 1fvc s LEU 18 Cb 0.00 2.43 0.02 0.00 0.50 0.00 0.00 46.19 49.14 1fvc s LEU 18 CO -0.06 -0.93 -0.08 -0.60 -1.32 0.00 0.00 176.35 173.36 1fvc s ARG 19 N -3.57 1.24 0.06 1.98 3.52 -1.26 -0.58 118.95 120.34 1fvc s ARG 19 Ca 0.04 -0.23 0.02 0.00 -0.13 0.00 0.00 55.73 55.44 1fvc s ARG 19 Cb -0.02 -1.16 -0.04 0.00 -1.56 0.00 0.00 34.95 32.18 1fvc s ARG 19 CO -0.08 -0.07 0.07 -0.51 -0.81 0.00 0.00 175.30 173.90 1fvc s LEU 20 N 0.97 3.80 0.10 -0.88 1.02 -0.08 -4.39 118.68 119.23 1fvc s LEU 20 Ca -0.10 0.02 0.08 0.00 0.02 0.00 0.00 54.13 54.15 1fvc s LEU 20 Cb -0.15 -2.42 -0.04 0.00 0.02 0.00 0.00 46.19 43.61 1fvc s LEU 20 CO 0.00 0.20 -0.16 -0.44 0.02 0.00 0.00 176.35 175.97 1fvc s SER 21 N -2.22 3.98 -0.32 2.29 0.01 -0.68 -0.69 113.70 116.07 1fvc s SER 21 Ca 0.28 -0.50 -0.01 0.00 1.31 0.00 0.00 55.95 57.03 1fvc s SER 21 Cb -0.12 -0.62 0.10 0.00 0.21 0.00 0.00 66.02 65.59 1fvc s SER 21 CO 0.20 0.19 0.11 0.00 0.41 0.00 0.00 173.24 174.15 1fvc s ALA 23 N 1.55 3.27 0.44 0.00 0.00 0.11 -2.13 121.76 125.01 1fvc s ALA 23 Ca 0.11 -1.35 -0.21 0.00 0.00 0.00 0.00 51.96 50.51 1fvc s ALA 23 Cb -0.18 -3.52 -0.10 0.00 0.00 0.00 0.00 23.12 19.32 1fvc s ALA 23 CO -0.24 -2.12 0.98 0.00 0.00 0.00 0.00 175.76 174.39 1fvc s ALA 24 N 3.30 3.00 -0.17 0.00 0.00 -0.42 -1.08 121.76 126.38 1fvc s ALA 24 Ca 0.25 0.49 -0.15 0.00 0.00 0.00 0.00 51.96 52.55 1fvc s ALA 24 Cb -0.15 -3.19 0.04 0.00 0.00 0.00 0.00 23.12 19.83 1fvc s ALA 24 CO 0.18 -0.03 0.45 0.45 0.00 0.00 0.00 175.76 176.80 1fvc s SER 25 N -2.05 -0.47 0.00 0.00 0.15 -0.93 -4.87 113.70 105.53 1fvc s SER 25 Ca 0.63 0.90 0.00 0.00 0.70 0.00 0.00 55.95 58.18 1fvc s SER 25 Cb -0.13 0.90 0.00 0.00 -1.71 0.00 0.00 66.02 65.09 1fvc s SER 25 CO 0.17 -0.16 0.00 0.61 1.20 0.00 0.00 173.24 175.06 1fvc n GLY 26 N 2.95 0.66 3.82 9.45 0.00 -1.26 -1.14 105.19 119.66 1fvc n GLY 26 Ca -0.14 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.83 1fvc n GLY 26 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1fvc s PHE 27 N -2.54 -0.05 -0.15 1.61 -0.71 -1.26 -4.18 117.98 110.70 1fvc s PHE 27 Ca 0.00 -0.39 -0.06 0.00 -1.04 0.00 0.00 56.93 55.44 1fvc s PHE 27 Cb 0.00 0.71 -0.04 0.00 -1.21 0.00 0.00 43.02 42.48 1fvc s PHE 27 CO 0.00 -1.10 0.07 -0.80 -1.34 0.00 0.00 175.22 172.05 1fvc s ASN 28 N -3.06 5.71 0.38 1.98 0.02 -1.26 -4.98 114.94 113.72 1fvc s ASN 28 Ca 0.15 0.18 0.28 0.00 -1.02 0.00 0.00 52.86 52.44 1fvc s ASN 28 Cb -0.03 -1.88 1.13 0.00 0.02 0.00 0.00 41.25 40.48 1fvc s ASN 28 CO 0.06 0.27 1.82 0.16 0.02 0.00 0.00 177.10 179.43 1fvc h ILE 29 N 4.53 0.00 -0.66 0.60 3.07 -1.91 -3.19 117.51 119.95 1fvc h ILE 29 Ca -0.44 -0.35 0.14 0.00 1.55 0.00 0.00 64.86 65.76 1fvc h ILE 29 Cb 1.18 1.20 -0.12 0.00 -0.27 0.00 0.00 36.82 38.82 1fvc h ILE 29 CO 0.65 0.00 -0.06 0.11 -1.05 0.00 0.00 178.15 177.79 1fvc h LYS 30 N 0.00 0.06 0.01 0.16 6.56 -1.92 -3.19 116.57 118.25 1fvc h LYS 30 Ca 0.00 -0.00 -0.00 0.00 -1.06 0.00 0.00 60.65 59.59 1fvc h LYS 30 Cb 0.44 -0.01 0.00 0.00 -0.57 0.00 0.00 32.23 32.08 1fvc h LYS 30 CO 0.00 0.04 -0.00 -0.44 -2.06 0.00 0.00 179.45 176.99 1fvc h ASP 31 N 0.06 -0.01 -3.44 0.86 3.32 -1.93 -3.18 116.42 112.09 1fvc h ASP 31 Ca 0.34 -0.44 -0.25 0.00 0.02 0.00 0.00 57.03 56.69 1fvc h ASP 31 Cb 0.55 0.00 0.09 0.00 0.22 0.00 0.00 39.33 40.19 1fvc h ASP 31 CO -0.61 0.44 0.20 0.35 -1.72 0.00 0.00 179.24 177.89 1fvc n THR 32 N -4.88 0.00 -4.05 0.35 -2.24 -1.20 -4.81 114.28 97.44 1fvc n THR 32 Ca -0.08 -0.65 -0.30 0.00 -2.27 0.00 0.00 64.05 60.74 1fvc n THR 32 Cb 0.23 -1.56 -0.06 0.00 -2.10 0.00 0.00 70.33 66.84 1fvc n THR 32 CO 0.00 0.00 0.00 -0.31 -0.57 0.00 0.00 175.07 174.19 1fvc s TYR 33 N -2.43 3.18 -0.04 4.78 1.51 -1.26 -4.33 117.35 118.76 1fvc s TYR 33 Ca 0.42 0.07 0.07 0.00 -1.01 0.00 0.00 57.07 56.62 1fvc s TYR 33 Cb -0.01 -1.61 -0.01 0.00 -0.11 0.00 0.00 41.96 40.21 1fvc s TYR 33 CO 0.29 0.52 -0.25 0.42 -1.11 0.00 0.00 175.55 175.42 1fvc s ILE 34 N -1.42 2.04 0.25 2.71 -1.09 -1.00 -2.68 121.20 120.00 1fvc s ILE 34 Ca 0.29 -1.08 0.11 0.00 -2.23 0.00 0.00 60.65 57.74 1fvc s ILE 34 Cb -0.12 -1.71 -0.05 0.00 -1.58 0.00 0.00 42.46 39.00 1fvc s ILE 34 CO 0.22 0.57 -0.19 -1.00 -1.23 0.00 0.00 174.94 173.31 1fvc s HIS 35 N -0.36 2.15 0.05 3.97 3.76 0.43 -2.14 115.29 123.15 1fvc s HIS 35 Ca 0.02 -0.39 0.09 0.00 -0.15 0.00 0.00 55.06 54.64 1fvc s HIS 35 Cb -0.12 -0.96 -0.03 0.00 1.11 0.00 0.00 32.58 32.58 1fvc s HIS 35 CO 0.02 0.60 -0.26 -1.58 -0.85 0.00 0.00 174.74 172.66 1fvc s TRP 36 N -2.47 2.32 -0.10 1.40 0.52 -0.46 -1.70 118.94 118.45 1fvc s TRP 36 Ca 0.27 -0.41 -0.05 0.00 0.02 0.00 0.00 56.10 55.93 1fvc s TRP 36 Cb -0.05 -1.38 0.05 0.00 -1.15 0.00 0.00 33.47 30.94 1fvc s TRP 36 CO 0.12 0.14 0.23 0.08 0.02 0.00 0.00 176.95 177.54 1fvc s VAL 37 N -0.82 -0.08 0.45 4.03 1.01 0.76 -1.52 120.40 124.23 1fvc s VAL 37 Ca 0.12 0.17 0.06 0.00 0.00 0.00 0.00 61.98 62.33 1fvc s VAL 37 Cb -0.10 -0.36 -0.03 0.00 0.00 0.00 0.00 36.38 35.89 1fvc s VAL 37 CO 0.02 0.07 0.22 0.00 0.00 0.00 0.00 175.10 175.41 1fvc s ARG 38 N 1.37 2.25 -0.28 2.72 1.70 -0.23 0.63 118.95 127.12 1fvc s ARG 38 Ca -0.08 -1.91 -0.01 0.00 -0.47 0.00 0.00 55.73 53.26 1fvc s ARG 38 Cb -0.11 -1.99 0.17 0.00 -0.57 0.00 0.00 34.95 32.45 1fvc s ARG 38 CO -0.08 -0.24 0.51 -1.14 -1.08 0.00 0.00 175.30 173.27 1fvc s GLN 39 N -3.99 0.48 0.57 3.89 0.74 -0.69 -0.72 119.66 119.94 1fvc s GLN 39 Ca 0.37 0.78 -0.19 0.00 0.05 0.00 0.00 55.36 56.37 1fvc s GLN 39 Cb 0.02 0.11 -0.05 0.00 1.10 0.00 0.00 33.01 34.19 1fvc s GLN 39 CO 0.21 -0.65 1.18 0.00 -0.55 0.00 0.00 175.29 175.48 1fvc s ALA 40 N 2.72 2.61 0.30 1.58 0.00 -1.26 -1.14 121.76 126.58 1fvc s ALA 40 Ca 0.17 0.94 0.14 0.00 0.00 0.00 0.00 51.96 53.21 1fvc s ALA 40 Cb -0.15 -3.42 1.04 0.00 0.00 0.00 0.00 23.12 20.59 1fvc s ALA 40 CO -0.19 -1.00 1.34 -0.35 0.00 0.00 0.00 175.76 175.56 1fvc n PRO 41 N -1.45 -0.05 -0.04 0.00 -0.04 -1.26 -1.13 135.00 131.02 1fvc n PRO 41 Ca 0.13 1.20 0.07 0.00 -0.04 0.00 0.00 63.50 64.85 1fvc n PRO 41 Cb 0.50 -2.09 0.08 0.00 -0.04 0.00 0.00 33.50 31.95 1fvc n PRO 41 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1fvc n GLY 42 N -1.27 0.45 2.96 0.55 0.00 -1.26 -5.05 105.19 101.58 1fvc n GLY 42 Ca 0.30 -0.39 -0.17 0.00 0.00 0.00 0.00 46.02 45.75 1fvc n GLY 42 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1fvc n LYS 43 N 0.73 0.13 -1.49 1.61 4.01 -0.28 -5.14 118.16 117.74 1fvc n LYS 43 Ca 0.09 -2.11 -0.10 0.00 -0.51 0.00 0.00 58.31 55.68 1fvc n LYS 43 Cb 0.36 -0.47 0.05 0.00 -0.51 0.00 0.00 35.03 34.46 1fvc n LYS 43 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1fvc n GLY 44 N -0.80 0.79 3.85 0.72 0.00 -1.26 -4.73 105.19 103.76 1fvc n GLY 44 Ca 0.13 -2.00 -0.32 0.00 0.00 0.00 0.00 46.02 43.82 1fvc n GLY 44 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1fvc s LEU 45 N 0.00 4.01 -0.14 0.99 1.43 -1.26 -4.22 118.68 119.49 1fvc s LEU 45 Ca 0.29 1.33 -0.05 0.00 -1.03 0.00 0.00 54.13 54.67 1fvc s LEU 45 Cb -0.02 -4.15 0.07 0.00 0.03 0.00 0.00 46.19 42.11 1fvc s LEU 45 CO 0.19 -0.26 0.30 -0.70 0.23 0.00 0.00 176.35 176.11 1fvc s GLU 46 N -3.12 0.20 0.32 1.70 2.12 0.10 -4.98 118.70 115.04 1fvc s GLU 46 Ca 0.55 0.77 -0.29 0.00 0.36 0.00 0.00 54.97 56.37 1fvc s GLU 46 Cb -0.10 0.02 -0.10 0.00 0.26 0.00 0.00 34.13 34.21 1fvc s GLU 46 CO 0.18 -0.26 1.31 -0.46 -0.54 0.00 0.00 175.26 175.49 1fvc s TRP 47 N 2.24 3.07 0.00 5.30 -0.00 -1.26 -1.06 118.94 127.22 1fvc s TRP 47 Ca -0.01 1.40 0.00 0.00 -0.00 0.00 0.00 56.10 57.49 1fvc s TRP 47 Cb -0.12 -3.67 0.00 0.00 -0.00 0.00 0.00 33.47 29.68 1fvc s TRP 47 CO -0.09 -1.85 0.00 1.33 -0.00 0.00 0.00 176.95 176.33 1fvc n VAL 48 N 0.93 0.00 -3.50 5.86 0.24 -0.58 -4.65 118.33 116.64 1fvc n VAL 48 Ca 0.00 0.00 -0.12 0.00 -2.04 0.00 0.00 64.34 62.19 1fvc n VAL 48 Cb 0.42 -0.79 -0.03 0.00 -1.47 0.00 0.00 33.84 31.96 1fvc n VAL 48 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1fvc s ALA 49 N -1.84 -1.77 0.02 2.33 0.00 -1.22 0.08 121.76 119.36 1fvc s ALA 49 Ca 0.00 1.04 -0.03 0.00 0.00 0.00 0.00 51.96 52.98 1fvc s ALA 49 Cb 0.00 0.25 -0.02 0.00 0.00 0.00 0.00 23.12 23.35 1fvc s ALA 49 CO 0.00 -0.57 0.03 -0.98 0.00 0.00 0.00 175.76 174.23 1fvc s ARG 50 N -2.51 0.42 -0.01 0.00 1.70 -0.76 -1.36 118.95 116.43 1fvc s ARG 50 Ca -0.01 -0.65 0.04 0.00 -0.47 0.00 0.00 55.73 54.64 1fvc s ARG 50 Cb -0.01 0.16 -0.01 0.00 -0.57 0.00 0.00 34.95 34.52 1fvc s ARG 50 CO -0.04 -0.09 -0.12 -1.50 -1.08 0.00 0.00 175.30 172.47 1fvc s ILE 51 N -1.86 0.96 -0.46 4.99 2.07 -0.91 -1.15 121.20 124.84 1fvc s ILE 51 Ca -0.12 -0.51 -0.16 0.00 -1.41 0.00 0.00 60.65 58.44 1fvc s ILE 51 Cb -0.06 -0.80 0.05 0.00 0.13 0.00 0.00 42.46 41.78 1fvc s ILE 51 CO -0.02 0.27 0.43 -0.47 -1.91 0.00 0.00 174.94 173.25 1fvc s TYR 52 N -0.25 3.19 -0.81 3.50 5.04 0.13 -2.39 117.35 125.76 1fvc s TYR 52 Ca 0.04 -0.71 0.08 0.00 -2.44 0.00 0.00 57.07 54.03 1fvc s TYR 52 Cb -0.05 -3.12 0.37 0.00 0.35 0.00 0.00 41.96 39.52 1fvc s TYR 52 CO -0.00 -0.80 1.23 -2.30 -1.34 0.00 0.00 175.55 172.34 1fvc n PRO 53 N 5.46 0.04 0.00 4.97 -0.02 -1.26 -1.08 135.00 143.11 1fvc n PRO 53 Ca -0.10 0.49 0.13 0.00 -2.02 0.00 0.00 63.50 61.99 1fvc n PRO 53 Cb 0.45 -1.61 0.33 0.00 -0.02 0.00 0.00 33.50 32.65 1fvc n PRO 53 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1fvc n THR 54 N -1.69 0.00 -1.55 3.45 -2.24 -1.20 -4.39 114.28 106.66 1fvc n THR 54 Ca 0.00 -0.22 0.00 0.00 -2.27 0.00 0.00 64.05 61.57 1fvc n THR 54 Cb 0.04 0.67 0.00 0.00 -2.10 0.00 0.00 70.33 68.94 1fvc n THR 54 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 1fvc n ASN 55 N -0.15 0.00 -0.38 3.42 2.04 -1.12 -5.05 115.26 114.03 1fvc n ASN 55 Ca 0.14 -1.00 -0.05 0.00 -0.44 0.00 0.00 54.58 53.23 1fvc n ASN 55 Cb 0.39 0.00 -0.02 0.00 -2.53 0.00 0.00 39.78 37.62 1fvc n ASN 55 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 1fvc n GLY 56 N 0.00 0.61 3.75 4.83 0.00 -0.24 -5.00 105.19 109.14 1fvc n GLY 56 Ca 0.00 -0.12 -0.41 0.00 0.00 0.00 0.00 46.02 45.49 1fvc n GLY 56 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1fvc s TYR 57 N -1.73 2.87 0.15 1.61 2.02 -1.21 -4.72 117.35 116.33 1fvc s TYR 57 Ca 0.00 0.93 0.06 0.00 -0.37 0.00 0.00 57.07 57.68 1fvc s TYR 57 Cb 0.00 -3.94 -0.04 0.00 -0.40 0.00 0.00 41.96 37.57 1fvc s TYR 57 CO 0.00 -3.10 -0.12 0.95 -1.57 0.00 0.00 175.55 171.71 1fvc s THR 58 N -0.09 1.35 0.02 -0.71 -4.23 -1.26 0.22 115.64 110.94 1fvc s THR 58 Ca 0.61 -2.00 0.01 0.00 -1.18 0.00 0.00 61.69 59.13 1fvc s THR 58 Cb -0.45 -1.80 -0.02 0.00 1.34 0.00 0.00 72.50 71.57 1fvc s THR 58 CO 0.47 -0.62 -0.05 -0.13 -0.54 0.00 0.00 174.62 173.75 1fvc s ARG 59 N -3.42 0.37 -0.01 3.99 3.00 -0.30 -4.96 118.95 117.63 1fvc s ARG 59 Ca 0.16 -0.50 0.02 0.00 0.00 0.00 0.00 55.73 55.42 1fvc s ARG 59 Cb -0.00 -0.16 -0.01 0.00 0.00 0.00 0.00 34.95 34.78 1fvc s ARG 59 CO 0.03 0.03 -0.08 0.71 0.00 0.00 0.00 175.30 175.99 1fvc s TYR 60 N -0.96 0.69 0.18 -0.53 1.51 -1.26 -1.83 117.35 115.15 1fvc s TYR 60 Ca -0.08 -0.13 -0.32 0.00 -1.01 0.00 0.00 57.07 55.53 1fvc s TYR 60 Cb -0.07 -0.44 -0.11 0.00 -0.11 0.00 0.00 41.96 41.23 1fvc s TYR 60 CO -0.00 -0.01 1.70 0.00 -1.11 0.00 0.00 175.55 176.13 1fvc s ALA 61 N -0.19 3.88 -1.53 3.71 0.00 0.11 -4.82 121.76 122.92 1fvc s ALA 61 Ca 0.03 1.52 0.06 0.00 0.00 0.00 0.00 51.96 53.56 1fvc s ALA 61 Cb -0.03 -3.69 0.29 0.00 0.00 0.00 0.00 23.12 19.69 1fvc s ALA 61 CO -0.00 -0.94 0.98 -0.40 0.00 0.00 0.00 175.76 175.40 1fvc n ASP 62 N 4.25 0.00 0.19 0.00 5.75 -1.26 -1.57 116.55 123.92 1fvc n ASP 62 Ca 0.16 0.14 0.08 0.00 -0.01 0.00 0.00 54.79 55.16 1fvc n ASP 62 Cb 0.36 -0.23 0.22 0.00 -1.03 0.00 0.00 41.12 40.44 1fvc n ASP 62 CO 0.00 0.00 0.00 0.77 -0.11 0.00 0.00 177.20 177.86 1fvc h SER 63 N 0.00 0.00 -0.01 -1.12 4.64 -1.96 -3.22 113.55 111.88 1fvc h SER 63 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1fvc h SER 63 Cb 0.04 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.13 1fvc h SER 63 CO 0.00 0.24 -0.04 1.33 -0.87 0.00 0.00 176.83 177.49 1fvc n VAL 64 N -3.21 0.00 -1.99 0.95 0.24 -0.61 -4.92 118.33 108.78 1fvc n VAL 64 Ca 0.02 -0.48 -0.42 0.00 -2.04 0.00 0.00 64.34 61.42 1fvc n VAL 64 Cb 0.57 1.09 -0.03 0.00 -1.47 0.00 0.00 33.84 33.99 1fvc n VAL 64 CO 0.00 0.00 0.00 -0.75 -2.14 0.00 0.00 176.83 173.94 1fvc s LYS 65 N -0.64 4.20 0.00 7.34 2.47 -0.83 -1.45 119.74 130.83 1fvc s LYS 65 Ca 0.05 2.23 0.00 0.00 -1.56 0.00 0.00 55.97 56.69 1fvc s LYS 65 Cb 0.04 -3.74 0.00 0.00 -1.46 0.00 0.00 37.83 32.67 1fvc s LYS 65 CO 0.09 -0.75 0.00 0.41 0.16 0.00 0.00 175.35 175.26 1fvc n GLY 66 N 4.00 2.98 0.10 5.54 0.00 -1.26 -4.85 105.19 111.71 1fvc n GLY 66 Ca 0.16 -0.14 -0.20 0.00 0.00 0.00 0.00 46.02 45.84 1fvc n GLY 66 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1fvc h ARG 67 N 0.00 0.02 -6.31 1.61 3.08 -1.57 -3.48 114.38 107.73 1fvc h ARG 67 Ca 0.00 -0.04 -0.56 0.00 0.07 0.00 0.00 59.98 59.45 1fvc h ARG 67 Cb 0.00 0.02 -0.04 0.00 0.08 0.00 0.00 29.97 30.03 1fvc h ARG 67 CO 0.00 1.02 -0.17 -0.06 -1.07 0.00 0.00 179.97 179.69 1fvc s PHE 68 N -2.35 3.49 -0.02 3.04 0.40 -0.53 -2.78 117.98 119.23 1fvc s PHE 68 Ca -0.26 0.83 0.00 0.00 -0.60 0.00 0.00 56.93 56.90 1fvc s PHE 68 Cb 0.04 -2.21 0.02 0.00 0.51 0.00 0.00 43.02 41.38 1fvc s PHE 68 CO 0.63 0.37 -0.00 0.99 0.70 0.00 0.00 175.22 177.90 1fvc s THR 69 N -1.65 0.17 -0.10 0.64 2.01 -0.28 -4.85 115.64 111.58 1fvc s THR 69 Ca 0.42 0.05 -0.02 0.00 0.31 0.00 0.00 61.69 62.45 1fvc s THR 69 Cb -0.12 -0.24 -0.03 0.00 0.01 0.00 0.00 72.50 72.11 1fvc s THR 69 CO 0.21 0.12 -0.01 -0.51 -0.69 0.00 0.00 174.62 173.74 1fvc s ILE 70 N 0.80 4.18 0.21 1.82 2.07 -1.26 -1.66 121.20 127.36 1fvc s ILE 70 Ca -0.08 -0.29 -0.07 0.00 -1.41 0.00 0.00 60.65 58.80 1fvc s ILE 70 Cb -0.11 -2.76 -0.02 0.00 0.13 0.00 0.00 42.46 39.70 1fvc s ILE 70 CO -0.01 0.58 0.30 -0.94 -1.91 0.00 0.00 174.94 172.96 1fvc s SER 71 N -0.66 0.04 0.03 4.50 1.04 -1.10 -4.98 113.70 112.57 1fvc s SER 71 Ca 0.10 -1.11 -0.14 0.00 0.48 0.00 0.00 55.95 55.29 1fvc s SER 71 Cb -0.12 0.47 0.02 0.00 0.10 0.00 0.00 66.02 66.50 1fvc s SER 71 CO 0.02 -0.97 0.31 0.00 0.98 0.00 0.00 173.24 173.58 1fvc s ALA 72 N -4.07 -0.71 -0.28 5.32 0.00 -1.26 -1.13 121.76 119.64 1fvc s ALA 72 Ca 0.28 0.08 0.02 0.00 0.00 0.00 0.00 51.96 52.34 1fvc s ALA 72 Cb 0.03 0.26 0.08 0.00 0.00 0.00 0.00 23.12 23.50 1fvc s ALA 72 CO 0.08 -0.38 -0.01 0.34 0.00 0.00 0.00 175.76 175.79 1fvc s ASP 73 N -1.90 4.31 0.41 0.00 -1.08 0.30 -4.99 116.67 113.72 1fvc s ASP 73 Ca -0.07 -1.61 0.21 0.00 -0.52 0.00 0.00 52.55 50.56 1fvc s ASP 73 Cb -0.02 -1.37 0.77 0.00 -1.46 0.00 0.00 42.92 40.84 1fvc s ASP 73 CO -0.02 -0.30 1.76 0.71 0.52 0.00 0.00 175.17 177.85 1fvc h THR 74 N 6.65 0.69 -0.04 1.71 1.35 -1.87 -1.85 112.91 119.54 1fvc h THR 74 Ca -0.13 -1.34 -0.09 0.00 -0.55 0.00 0.00 66.41 64.30 1fvc h THR 74 Cb 1.04 1.87 -0.01 0.00 -1.73 0.00 0.00 68.15 69.32 1fvc h THR 74 CO 0.47 0.29 -0.40 0.77 -0.25 0.00 0.00 175.52 176.40 1fvc h SER 75 N 0.00 0.10 0.30 5.36 4.64 -1.94 -2.78 113.55 119.23 1fvc h SER 75 Ca -0.00 -0.04 0.00 0.00 -0.47 0.00 0.00 61.79 61.28 1fvc h SER 75 Cb 0.85 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 62.91 1fvc h SER 75 CO 0.04 0.49 -0.45 0.29 -0.87 0.00 0.00 176.83 176.33 1fvc n LYS 76 N -4.05 0.43 -3.67 4.77 5.02 -1.13 -5.00 118.16 114.53 1fvc n LYS 76 Ca -0.02 -0.27 -0.22 0.00 -2.02 0.00 0.00 58.31 55.78 1fvc n LYS 76 Cb 0.45 -1.49 0.05 0.00 -0.02 0.00 0.00 35.03 34.01 1fvc n LYS 76 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1fvc n ASN 77 N -1.05 -2.63 -3.90 4.39 3.02 -0.88 -4.83 115.26 109.38 1fvc n ASN 77 Ca 0.08 -0.74 -0.12 0.00 -0.03 0.00 0.00 54.58 53.77 1fvc n ASN 77 Cb 0.35 -4.37 -0.14 0.00 -0.61 0.00 0.00 39.78 35.02 1fvc n ASN 77 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1fvc s THR 78 N -3.49 0.09 0.19 3.41 2.01 -0.75 -1.31 115.64 115.79 1fvc s THR 78 Ca 0.19 -0.17 0.09 0.00 0.31 0.00 0.00 61.69 62.11 1fvc s THR 78 Cb -0.09 -0.11 -0.04 0.00 0.01 0.00 0.00 72.50 72.27 1fvc s THR 78 CO 0.79 -0.05 -0.19 0.00 -0.69 0.00 0.00 174.62 174.48 1fvc s ALA 79 N -0.23 2.15 0.01 7.40 0.00 -0.91 -0.54 121.76 129.65 1fvc s ALA 79 Ca -0.02 -1.58 0.02 0.00 0.00 0.00 0.00 51.96 50.38 1fvc s ALA 79 Cb -0.02 -0.20 -0.01 0.00 0.00 0.00 0.00 23.12 22.90 1fvc s ALA 79 CO -0.00 0.24 -0.07 0.71 0.00 0.00 0.00 175.76 176.64 1fvc s TYR 80 N -2.19 0.59 -0.26 0.00 2.02 -0.28 -0.32 117.35 116.90 1fvc s TYR 80 Ca 0.19 -0.23 0.02 0.00 -0.37 0.00 0.00 57.07 56.68 1fvc s TYR 80 Cb -0.05 -0.37 0.06 0.00 -0.40 0.00 0.00 41.96 41.21 1fvc s TYR 80 CO 0.08 -0.03 -0.09 -1.17 -1.57 0.00 0.00 175.55 172.77 1fvc s LEU 81 N -0.63 3.30 -0.24 -1.29 2.96 0.13 -2.70 118.68 120.20 1fvc s LEU 81 Ca -0.02 -1.38 -0.24 0.00 -0.22 0.00 0.00 54.13 52.27 1fvc s LEU 81 Cb -0.05 -1.46 -0.01 0.00 0.50 0.00 0.00 46.19 45.17 1fvc s LEU 81 CO 0.00 -0.21 0.81 -1.58 -1.32 0.00 0.00 176.35 174.05 1fvc s GLN 82 N 1.16 4.19 -0.26 1.98 2.00 -0.66 -0.90 119.66 127.16 1fvc s GLN 82 Ca -0.07 0.92 -0.02 0.00 -2.00 0.00 0.00 55.36 54.19 1fvc s GLN 82 Cb -0.20 -3.64 0.03 0.00 0.80 0.00 0.00 33.01 30.00 1fvc s GLN 82 CO -0.06 -0.50 -0.04 -1.64 -0.50 0.00 0.00 175.29 172.56 1fvc s MET 83 N 2.76 2.74 0.42 1.67 -1.94 0.26 -1.13 119.30 124.08 1fvc s MET 83 Ca 0.34 -1.05 0.07 0.00 -1.71 0.00 0.00 55.69 53.35 1fvc s MET 83 Cb -0.15 -3.05 -0.06 0.00 2.01 0.00 0.00 34.83 33.58 1fvc s MET 83 CO 0.08 -0.46 0.14 -0.80 -0.01 0.00 0.00 175.02 173.97 1fvc s ASN 84 N 1.31 4.30 -1.46 3.03 0.01 -1.12 -0.86 114.94 120.16 1fvc s ASN 84 Ca -0.01 -1.16 -0.07 0.00 -0.71 0.00 0.00 52.86 50.91 1fvc s ASN 84 Cb -0.17 -0.42 0.01 0.00 0.41 0.00 0.00 41.25 41.07 1fvc s ASN 84 CO -0.03 -0.54 0.21 -1.20 -1.51 0.00 0.00 177.10 174.02 1fvc n SER 85 N -1.19 -0.33 -4.75 -1.22 7.64 -0.69 -4.64 113.62 108.44 1fvc n SER 85 Ca -0.02 -1.24 -0.41 0.00 1.01 0.00 0.00 58.87 58.20 1fvc n SER 85 Cb 0.65 -1.85 -0.02 0.00 -1.01 0.00 0.00 64.21 61.99 1fvc n SER 85 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1fvc s LEU 86 N -7.33 4.36 0.30 -3.43 1.43 -0.59 -4.70 118.68 108.73 1fvc s LEU 86 Ca 0.11 2.85 0.11 0.00 -1.03 0.00 0.00 54.13 56.16 1fvc s LEU 86 Cb -0.06 -3.63 -0.05 0.00 0.03 0.00 0.00 46.19 42.48 1fvc s LEU 86 CO 0.98 -0.83 -0.14 -0.13 0.23 0.00 0.00 176.35 176.45 1fvc s ARG 87 N -0.54 1.79 0.45 1.70 1.81 -1.26 -1.06 118.95 121.84 1fvc s ARG 87 Ca 0.61 -1.79 0.19 0.00 -1.72 0.00 0.00 55.73 53.02 1fvc s ARG 87 Cb -0.45 -1.79 1.16 0.00 -0.45 0.00 0.00 34.95 33.41 1fvc s ARG 87 CO 0.47 0.27 1.92 0.00 -0.68 0.00 0.00 175.30 177.28 1fvc h ALA 88 N 2.15 2.26 -1.00 2.13 0.00 -1.96 -1.28 119.26 121.55 1fvc h ALA 88 Ca -0.41 -0.00 0.19 0.00 0.00 0.00 0.00 54.91 54.69 1fvc h ALA 88 Cb 1.26 -0.03 -0.10 0.00 0.00 0.00 0.00 17.79 18.92 1fvc h ALA 88 CO 0.63 -0.48 0.61 0.93 0.00 0.00 0.00 179.25 180.95 1fvc h GLU 89 N 0.31 0.72 0.00 0.00 3.07 -1.95 -2.57 114.58 114.16 1fvc h GLU 89 Ca 0.37 -0.04 0.00 0.00 -0.50 0.00 0.00 59.36 59.19 1fvc h GLU 89 Cb 1.01 -0.16 0.00 0.00 -0.84 0.00 0.00 28.75 28.76 1fvc h GLU 89 CO -0.10 0.48 0.00 -0.25 -1.40 0.00 0.00 179.01 177.74 1fvc n ASP 90 N -4.75 0.00 -4.70 1.42 9.92 -0.48 -4.83 116.55 113.13 1fvc n ASP 90 Ca 0.23 -0.05 -0.42 0.00 -0.53 0.00 0.00 54.79 54.03 1fvc n ASP 90 Cb 0.58 -0.25 -0.03 0.00 -0.64 0.00 0.00 41.12 40.78 1fvc n ASP 90 CO 0.00 0.00 0.00 -0.89 0.13 0.00 0.00 177.20 176.44 1fvc s THR 91 N -2.51 2.51 0.00 -3.53 2.01 -0.97 -4.87 115.64 108.29 1fvc s THR 91 Ca 0.19 0.13 0.00 0.00 0.31 0.00 0.00 61.69 62.32 1fvc s THR 91 Cb 0.12 -3.09 0.00 0.00 0.01 0.00 0.00 72.50 69.55 1fvc s THR 91 CO 0.27 0.00 0.00 0.00 -0.69 0.00 0.00 174.62 174.21 1fvc n ALA 92 N 5.22 0.00 -2.55 7.40 0.00 -0.44 -4.44 120.51 125.70 1fvc n ALA 92 Ca 0.17 0.00 -0.38 0.00 0.00 0.00 0.00 53.44 53.23 1fvc n ALA 92 Cb 0.38 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.77 1fvc n ALA 92 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1fvc s VAL 93 N -2.00 5.03 -0.17 0.00 1.01 -0.29 -1.22 120.40 122.75 1fvc s VAL 93 Ca 0.00 1.01 -0.07 0.00 0.00 0.00 0.00 61.98 62.92 1fvc s VAL 93 Cb 0.00 -3.82 -0.04 0.00 0.00 0.00 0.00 36.38 32.52 1fvc s VAL 93 CO 0.00 0.45 0.06 -0.31 0.00 0.00 0.00 175.10 175.30 1fvc s TYR 94 N -0.26 3.26 -0.06 5.22 1.51 0.73 -1.71 117.35 126.05 1fvc s TYR 94 Ca 0.27 0.11 0.05 0.00 -1.01 0.00 0.00 57.07 56.49 1fvc s TYR 94 Cb -0.17 -2.04 -0.01 0.00 -0.11 0.00 0.00 41.96 39.64 1fvc s TYR 94 CO 0.14 0.22 -0.23 0.71 -1.11 0.00 0.00 175.55 175.28 1fvc s TYR 95 N 0.15 2.27 0.13 2.71 2.02 0.21 -1.10 117.35 123.73 1fvc s TYR 95 Ca 0.05 -0.72 0.06 0.00 -0.37 0.00 0.00 57.07 56.09 1fvc s TYR 95 Cb -0.12 -1.50 -0.04 0.00 -0.40 0.00 0.00 41.96 39.90 1fvc s TYR 95 CO 0.01 -0.24 -0.03 0.00 -1.57 0.00 0.00 175.55 173.72 1fvc s SER 97 N -2.55 0.28 0.35 0.00 1.04 -0.69 -0.16 113.70 111.97 1fvc s SER 97 Ca 0.25 -1.16 0.04 0.00 0.48 0.00 0.00 55.95 55.56 1fvc s SER 97 Cb -0.11 0.63 -0.06 0.00 0.10 0.00 0.00 66.02 66.59 1fvc s SER 97 CO 0.17 -1.24 0.06 0.00 0.98 0.00 0.00 173.24 173.21 1fvc s ARG 98 N -3.51 1.73 0.02 4.02 1.04 -0.49 -0.43 118.95 121.34 1fvc s ARG 98 Ca 0.25 -1.98 -0.06 0.00 -1.04 0.00 0.00 55.73 52.90 1fvc s ARG 98 Cb -0.01 -0.94 -0.05 0.00 -2.04 0.00 0.00 34.95 31.92 1fvc s ARG 98 CO 0.13 -0.21 0.28 -1.58 -0.04 0.00 0.00 175.30 173.89 1fvc s TRP 99 N -3.22 3.57 -2.00 5.89 0.51 -1.09 -3.59 118.94 119.01 1fvc s TRP 99 Ca 0.34 0.58 0.05 0.00 -2.12 0.00 0.00 56.10 54.95 1fvc s TRP 99 Cb 0.08 -2.00 0.32 0.00 -0.81 0.00 0.00 33.47 31.06 1fvc s TRP 99 CO 0.15 0.59 0.81 0.41 -0.51 0.00 0.00 176.95 178.40 1fvc n GLY 100 N 1.00 -0.53 0.32 0.98 0.00 -1.24 -4.37 105.19 101.35 1fvc n GLY 100 Ca -0.10 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 45.89 1fvc n GLY 100 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1fvc n GLY 101 N 0.04 -1.17 0.00 -0.02 0.00 -1.25 -4.86 105.19 97.93 1fvc n GLY 101 Ca 0.04 -0.93 0.00 0.00 0.00 0.00 0.00 46.02 45.13 1fvc n GLY 101 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1fvc n ASP 102 N 0.00 0.00 0.00 1.61 8.00 -1.26 -3.36 116.55 121.54 1fvc n ASP 102 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.50 1fvc n ASP 102 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.10 1fvc n ASP 102 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1fvc n GLY 103 N 0.03 3.11 3.38 0.44 0.00 -1.26 -5.01 105.19 105.88 1fvc n GLY 103 Ca 0.00 -1.08 -0.38 0.00 0.00 0.00 0.00 46.02 44.56 1fvc n GLY 103 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1fvc s PHE 104 N -0.15 3.15 -0.17 1.61 2.19 -1.21 -4.93 117.98 118.47 1fvc s PHE 104 Ca 0.00 -0.82 0.14 0.00 0.33 0.00 0.00 56.93 56.58 1fvc s PHE 104 Cb 0.00 -2.29 0.39 0.00 -1.31 0.00 0.00 43.02 39.81 1fvc s PHE 104 CO 0.00 -0.53 1.20 0.66 1.83 0.00 0.00 175.22 178.38 1fvc n TYR 105 N 4.91 0.00 -3.96 10.12 4.01 -1.26 -3.74 117.16 127.24 1fvc n TYR 105 Ca -0.14 -1.27 -0.27 0.00 -0.16 0.00 0.00 57.90 56.06 1fvc n TYR 105 Cb 0.48 -0.22 -0.04 0.00 -0.31 0.00 0.00 39.34 39.26 1fvc n TYR 105 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1fvc s ALA 106 N -2.70 3.90 -0.69 -0.72 0.00 -1.26 -5.00 121.76 115.30 1fvc s ALA 106 Ca 0.36 -1.02 -0.22 0.00 0.00 0.00 0.00 51.96 51.08 1fvc s ALA 106 Cb 0.35 -1.72 0.08 0.00 0.00 0.00 0.00 23.12 21.83 1fvc s ALA 106 CO -0.07 0.59 0.97 -1.64 0.00 0.00 0.00 175.76 175.62 1fvc s MET 107 N -3.06 3.17 0.07 0.00 -1.94 -1.26 -3.71 119.30 112.58 1fvc s MET 107 Ca 0.34 -0.98 0.12 0.00 -1.71 0.00 0.00 55.69 53.46 1fvc s MET 107 Cb -0.11 -4.33 -0.17 0.00 2.01 0.00 0.00 34.83 32.24 1fvc s MET 107 CO 0.27 -1.80 1.00 0.38 -0.01 0.00 0.00 175.02 174.87 1fvc h ASP 108 N 9.46 0.00 -4.01 3.03 2.03 -1.92 -3.46 116.42 121.56 1fvc h ASP 108 Ca -0.23 0.00 -0.53 0.00 -0.73 0.00 0.00 57.03 55.54 1fvc h ASP 108 Cb 1.07 0.00 -0.31 0.00 -0.83 0.00 0.00 39.33 39.26 1fvc h ASP 108 CO 1.17 0.85 -0.82 -0.31 -1.03 0.00 0.00 179.24 179.10 1fvc s TYR 109 N -2.75 1.50 0.02 4.15 2.02 -1.26 -5.05 117.35 115.98 1fvc s TYR 109 Ca -0.01 -0.38 0.05 0.00 -0.37 0.00 0.00 57.07 56.37 1fvc s TYR 109 Cb 0.09 -1.00 -0.02 0.00 -0.40 0.00 0.00 41.96 40.63 1fvc s TYR 109 CO 0.81 -0.11 -0.16 -1.58 -1.57 0.00 0.00 175.55 172.94 1fvc s TRP 110 N -0.07 1.44 0.32 2.71 0.52 -1.26 -1.40 118.94 121.20 1fvc s TRP 110 Ca -0.00 -0.32 -0.05 0.00 0.02 0.00 0.00 56.10 55.75 1fvc s TRP 110 Cb -0.09 -0.88 0.07 0.00 -1.15 0.00 0.00 33.47 31.41 1fvc s TRP 110 CO 0.01 0.02 0.43 0.41 0.02 0.00 0.00 176.95 177.85 1fvc n GLY 111 N 2.22 -0.87 0.07 0.98 0.00 0.78 -4.67 105.19 103.70 1fvc n GLY 111 Ca -0.16 -1.74 0.12 0.00 0.00 0.00 0.00 46.02 44.24 1fvc n GLY 111 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1fvc n GLN 112 N -1.90 0.27 0.00 1.61 0.00 -1.26 -4.77 117.38 111.33 1fvc n GLN 112 Ca 0.06 0.10 0.00 0.00 0.00 0.00 0.00 57.00 57.16 1fvc n GLN 112 Cb 0.20 -1.69 0.00 0.00 0.00 0.00 0.00 30.24 28.75 1fvc n GLN 112 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1fvc n GLY 113 N 1.34 1.10 3.14 2.61 0.00 -1.25 -5.04 105.19 107.09 1fvc n GLY 113 Ca 0.04 -1.47 -0.26 0.00 0.00 0.00 0.00 46.02 44.33 1fvc n GLY 113 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1fvc s THR 114 N -1.08 1.43 -0.06 2.61 -4.23 -0.26 -4.89 115.64 109.16 1fvc s THR 114 Ca 0.00 -0.72 -0.21 0.00 -1.18 0.00 0.00 61.69 59.58 1fvc s THR 114 Cb 0.00 -1.22 -0.04 0.00 1.34 0.00 0.00 72.50 72.57 1fvc s THR 114 CO 0.00 0.41 0.61 -0.22 -0.54 0.00 0.00 174.62 174.88 1fvc s LEU 115 N 0.00 4.34 -0.15 4.79 2.96 -1.26 -0.19 118.68 129.17 1fvc s LEU 115 Ca -0.03 1.09 0.00 0.00 -0.22 0.00 0.00 54.13 54.97 1fvc s LEU 115 Cb -0.11 -2.93 0.03 0.00 0.50 0.00 0.00 46.19 43.67 1fvc s LEU 115 CO 0.02 -0.01 -0.12 -0.69 -1.32 0.00 0.00 176.35 174.23 1fvc s VAL 116 N 0.39 1.47 -0.26 1.68 1.01 -0.36 -1.83 120.40 122.50 1fvc s VAL 116 Ca 0.32 -0.61 -0.04 0.00 0.00 0.00 0.00 61.98 61.66 1fvc s VAL 116 Cb -0.17 -1.42 0.01 0.00 0.00 0.00 0.00 36.38 34.80 1fvc s VAL 116 CO 0.16 0.40 -0.02 -0.89 0.00 0.00 0.00 175.10 174.75 1fvc s THR 117 N 1.52 3.28 -0.46 3.92 2.01 -0.33 -1.33 115.64 124.26 1fvc s THR 117 Ca 0.04 -0.82 -0.15 0.00 0.31 0.00 0.00 61.69 61.07 1fvc s THR 117 Cb -0.13 -2.64 0.07 0.00 0.01 0.00 0.00 72.50 69.81 1fvc s THR 117 CO -0.10 0.21 0.37 -0.69 -0.69 0.00 0.00 174.62 173.72 1fvc s VAL 118 N 1.40 5.09 0.01 3.82 1.01 -1.26 -1.14 120.40 129.34 1fvc s VAL 118 Ca 0.02 -1.07 0.00 0.00 0.00 0.00 0.00 61.98 60.93 1fvc s VAL 118 Cb -0.16 -4.03 0.00 0.00 0.00 0.00 0.00 36.38 32.19 1fvc s VAL 118 CO -0.02 -0.54 0.00 -0.24 0.00 0.00 0.00 175.10 174.30 1fvc n SER 119 N 5.16 0.01 0.00 3.32 2.88 -0.66 -4.50 113.62 119.83 1fvc n SER 119 Ca -0.12 0.02 0.00 0.00 -1.33 0.00 0.00 58.87 57.44 1fvc n SER 119 Cb 0.44 0.01 0.00 0.00 -0.75 0.00 0.00 64.21 63.90 1fvc n SER 119 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57