#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fc7 s SER 2 N 0.00 1.81 -0.08 1.61 0.15 -1.26 -5.13 113.70 110.81 2fc7 s SER 2 Ca 0.00 -0.29 -0.21 0.00 0.70 0.00 0.00 55.95 56.16 2fc7 s SER 2 Cb 0.00 -0.36 -0.04 0.00 -1.71 0.00 0.00 66.02 63.91 2fc7 s SER 2 CO 0.00 0.15 0.58 -0.44 1.20 0.00 0.00 173.24 174.74 2fc7 s SER 3 N -0.12 6.86 0.00 5.45 0.01 -1.26 -5.02 113.70 119.62 2fc7 s SER 3 Ca 0.01 1.03 0.00 0.00 1.31 0.00 0.00 55.95 58.29 2fc7 s SER 3 Cb -0.08 -2.35 0.00 0.00 0.21 0.00 0.00 66.02 63.80 2fc7 s SER 3 CO 0.01 -0.02 0.00 0.61 0.41 0.00 0.00 173.24 174.24 2fc7 n GLY 4 N 3.04 5.44 3.55 3.44 0.00 -1.26 -5.08 105.19 114.32 2fc7 n GLY 4 Ca -0.05 -0.87 -0.41 0.00 0.00 0.00 0.00 46.02 44.69 2fc7 n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2fc7 s SER 5 N 1.11 6.18 -0.17 1.61 0.15 -1.26 -4.76 113.70 116.56 2fc7 s SER 5 Ca 0.00 -0.56 0.13 0.00 0.70 0.00 0.00 55.95 56.22 2fc7 s SER 5 Cb 0.00 -2.56 -0.19 0.00 -1.71 0.00 0.00 66.02 61.55 2fc7 s SER 5 CO 0.00 -1.81 0.02 -1.54 1.20 0.00 0.00 173.24 171.11 2fc7 n SER 6 N 9.41 1.13 -0.91 5.45 3.41 -1.26 -5.08 113.62 125.77 2fc7 n SER 6 Ca 0.07 -0.02 0.00 0.00 -0.26 0.00 0.00 58.87 58.67 2fc7 n SER 6 Cb 0.49 0.73 0.00 0.00 -0.26 0.00 0.00 64.21 65.17 2fc7 n SER 6 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2fc7 n GLY 7 N 2.05 2.23 3.29 5.00 0.00 -1.26 -5.16 105.19 111.34 2fc7 n GLY 7 Ca -0.28 -1.04 -0.33 0.00 0.00 0.00 0.00 46.02 44.37 2fc7 n GLY 7 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2fc7 s GLN 8 N -1.74 3.23 0.43 1.61 -2.07 -1.26 -5.12 119.66 114.73 2fc7 s GLN 8 Ca 0.00 -0.76 -0.11 0.00 -1.82 0.00 0.00 55.36 52.67 2fc7 s GLN 8 Cb 0.00 -2.53 -0.06 0.00 -1.09 0.00 0.00 33.01 29.33 2fc7 s GLN 8 CO 0.00 0.13 0.80 -1.14 -1.32 0.00 0.00 175.29 173.76 2fc7 s GLN 9 N 0.51 3.77 -0.83 9.60 2.00 -1.26 -5.03 119.66 128.42 2fc7 s GLN 9 Ca -0.11 0.50 -0.09 0.00 -2.00 0.00 0.00 55.36 53.65 2fc7 s GLN 9 Cb -0.16 -2.36 0.21 0.00 0.80 0.00 0.00 33.01 31.51 2fc7 s GLN 9 CO 0.04 -0.09 0.74 -1.64 -0.50 0.00 0.00 175.29 173.85 2fc7 s MET 10 N -3.99 3.41 -0.19 1.67 -1.94 -1.26 -4.99 119.30 112.02 2fc7 s MET 10 Ca 0.52 -2.68 -0.29 0.00 -1.71 0.00 0.00 55.69 51.53 2fc7 s MET 10 Cb -0.10 -4.23 0.12 0.00 2.01 0.00 0.00 34.83 32.62 2fc7 s MET 10 CO 0.33 -1.25 0.97 -1.14 -0.01 0.00 0.00 175.02 173.92 2fc7 s GLN 11 N -0.27 0.62 -0.39 2.03 0.74 -1.26 -5.13 119.66 115.99 2fc7 s GLN 11 Ca 0.21 0.30 0.02 0.00 0.05 0.00 0.00 55.36 55.94 2fc7 s GLN 11 Cb -0.12 0.29 0.12 0.00 1.10 0.00 0.00 33.01 34.40 2fc7 s GLN 11 CO -0.08 -0.16 0.16 0.00 -0.55 0.00 0.00 175.29 174.66 2fc7 s ALA 12 N -0.70 2.35 0.55 1.58 0.00 -1.26 -5.12 121.76 119.17 2fc7 s ALA 12 Ca -0.01 -2.44 -0.17 0.00 0.00 0.00 0.00 51.96 49.33 2fc7 s ALA 12 Cb -0.02 -1.88 -0.05 0.00 0.00 0.00 0.00 23.12 21.17 2fc7 s ALA 12 CO 0.00 -1.86 1.05 -1.83 0.00 0.00 0.00 175.76 173.12 2fc7 s GLU 13 N 0.72 3.50 0.09 0.00 -1.05 -1.26 -5.07 118.70 115.63 2fc7 s GLU 13 Ca 0.14 1.28 -0.08 0.00 -0.15 0.00 0.00 54.97 56.16 2fc7 s GLU 13 Cb -0.21 -2.05 -0.01 0.00 -0.44 0.00 0.00 34.13 31.42 2fc7 s GLU 13 CO -0.09 -0.67 0.17 0.45 0.95 0.00 0.00 175.26 176.07 2fc7 s SER 14 N -2.46 0.15 0.00 0.83 0.15 -1.26 -5.10 113.70 106.01 2fc7 s SER 14 Ca 0.65 -0.70 0.00 0.00 0.70 0.00 0.00 55.95 56.60 2fc7 s SER 14 Cb -0.16 0.33 0.00 0.00 -1.71 0.00 0.00 66.02 64.48 2fc7 s SER 14 CO 0.30 -0.73 0.00 0.61 1.20 0.00 0.00 173.24 174.63 2fc7 n GLY 15 N -0.06 -1.71 3.39 9.45 0.00 -1.26 -5.14 105.19 109.86 2fc7 n GLY 15 Ca -0.14 -0.80 -0.16 0.00 0.00 0.00 0.00 46.02 44.92 2fc7 n GLY 15 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2fc7 s PHE 16 N 0.00 1.28 -0.09 1.61 0.40 -1.26 -5.11 117.98 114.81 2fc7 s PHE 16 Ca 0.00 -1.40 -0.03 0.00 -0.60 0.00 0.00 56.93 54.89 2fc7 s PHE 16 Cb 0.00 -0.35 -0.04 0.00 0.51 0.00 0.00 43.02 43.14 2fc7 s PHE 16 CO 0.00 -0.97 0.04 0.08 0.70 0.00 0.00 175.22 175.07 2fc7 s VAL 17 N -3.38 4.66 -0.38 -0.44 1.01 -1.26 -4.93 120.40 115.68 2fc7 s VAL 17 Ca 0.35 -0.13 0.00 0.00 0.00 0.00 0.00 61.98 62.20 2fc7 s VAL 17 Cb 0.01 -2.99 0.11 0.00 0.00 0.00 0.00 36.38 33.51 2fc7 s VAL 17 CO 0.21 0.60 0.13 0.00 0.00 0.00 0.00 175.10 176.04 2fc7 s GLN 18 N -0.97 1.76 -0.33 2.72 -2.07 -1.26 0.06 119.66 119.56 2fc7 s GLN 18 Ca 0.14 -1.86 -0.29 0.00 -1.82 0.00 0.00 55.36 51.53 2fc7 s GLN 18 Cb -0.12 -3.41 0.02 0.00 -1.09 0.00 0.00 33.01 28.41 2fc7 s GLN 18 CO 0.03 -1.01 1.13 -1.01 -1.32 0.00 0.00 175.29 173.11 2fc7 s HIS 19 N 1.01 3.02 -0.02 9.60 3.76 0.72 -4.96 115.29 128.42 2fc7 s HIS 19 Ca 0.10 1.08 -0.15 0.00 -0.15 0.00 0.00 55.06 55.94 2fc7 s HIS 19 Cb -0.21 -3.81 -0.05 0.00 1.11 0.00 0.00 32.58 29.61 2fc7 s HIS 19 CO -0.06 -1.01 0.41 0.08 -0.85 0.00 0.00 174.74 173.31 2fc7 s VAL 20 N 3.87 5.06 0.00 -0.90 1.01 -1.26 -2.13 120.40 126.05 2fc7 s VAL 20 Ca 0.48 0.83 0.00 0.00 0.00 0.00 0.00 61.98 63.29 2fc7 s VAL 20 Cb -0.12 -3.71 0.00 0.00 0.00 0.00 0.00 36.38 32.54 2fc7 s VAL 20 CO 0.19 0.55 0.00 0.61 0.00 0.00 0.00 175.10 176.44 2fc7 n GLY 21 N 2.02 2.94 3.68 4.51 0.00 -1.26 -5.02 105.19 112.06 2fc7 n GLY 21 Ca -0.13 -0.22 -0.39 0.00 0.00 0.00 0.00 46.02 45.27 2fc7 n GLY 21 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2fc7 s PHE 22 N -2.20 3.44 -0.02 1.61 0.40 -1.26 -5.06 117.98 114.88 2fc7 s PHE 22 Ca 0.00 0.93 0.07 0.00 -0.60 0.00 0.00 56.93 57.33 2fc7 s PHE 22 Cb 0.00 -2.72 -0.02 0.00 0.51 0.00 0.00 43.02 40.80 2fc7 s PHE 22 CO 0.00 -0.04 -0.23 0.21 0.70 0.00 0.00 175.22 175.85 2fc7 s LYS 23 N 1.40 1.97 0.29 0.44 2.20 -1.26 -2.62 119.74 122.16 2fc7 s LYS 23 Ca 0.28 -0.84 -0.30 0.00 -0.36 0.00 0.00 55.97 54.76 2fc7 s LYS 23 Cb -0.16 -1.87 -0.11 0.00 -1.51 0.00 0.00 37.83 34.19 2fc7 s LYS 23 CO 0.11 0.48 1.49 0.00 -0.36 0.00 0.00 175.35 177.07 2fc7 n ASP 25 N 1.89 0.63 -0.05 0.00 9.92 -0.90 -2.40 116.55 125.64 2fc7 n ASP 25 Ca 0.06 -0.09 -0.00 0.00 -0.53 0.00 0.00 54.79 54.23 2fc7 n ASP 25 Cb 0.39 0.40 -0.00 0.00 -0.64 0.00 0.00 41.12 41.27 2fc7 n ASP 25 CO 0.00 0.00 0.00 -1.13 0.13 0.00 0.00 177.20 176.20 2fc7 h ASN 26 N 0.00 0.00 0.00 -2.24 -1.24 -1.91 -3.43 115.58 106.76 2fc7 h ASN 26 Ca 0.00 0.00 -0.43 0.00 0.71 0.00 0.00 56.30 56.58 2fc7 h ASN 26 Cb 0.68 0.00 -0.07 0.00 0.73 0.00 0.00 38.32 39.66 2fc7 h ASN 26 CO 0.00 0.47 -2.49 0.00 -1.29 0.00 0.00 177.43 174.12 2fc7 n GLY 28 N 1.57 1.87 3.67 0.00 0.00 -1.01 -5.04 105.19 106.25 2fc7 n GLY 28 Ca -0.51 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.09 2fc7 n GLY 28 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2fc7 s ILE 29 N -2.00 4.29 -0.17 -0.61 2.07 -1.26 -4.67 121.20 118.85 2fc7 s ILE 29 Ca 0.00 1.59 -0.14 0.00 -1.41 0.00 0.00 60.65 60.69 2fc7 s ILE 29 Cb 0.00 -4.03 0.05 0.00 0.13 0.00 0.00 42.46 38.61 2fc7 s ILE 29 CO 0.00 -0.07 0.44 -0.70 -1.91 0.00 0.00 174.94 172.70 2fc7 s GLU 30 N 2.83 0.49 0.79 3.50 2.12 -1.26 -2.07 118.70 125.10 2fc7 s GLU 30 Ca 0.55 0.66 -0.11 0.00 0.36 0.00 0.00 54.97 56.43 2fc7 s GLU 30 Cb -0.23 0.20 0.07 0.00 0.26 0.00 0.00 34.13 34.43 2fc7 s GLU 30 CO 0.18 -0.08 1.09 -1.25 -0.54 0.00 0.00 175.26 174.66 2fc7 s PRO 31 N 0.48 2.12 -0.24 4.30 0.04 -1.26 -5.10 135.00 135.34 2fc7 s PRO 31 Ca -0.02 1.12 -0.25 0.00 0.04 0.00 0.00 61.00 61.89 2fc7 s PRO 31 Cb -0.04 -1.88 -0.00 0.00 0.04 0.00 0.00 34.50 32.61 2fc7 s PRO 31 CO -0.02 -1.73 0.85 0.42 0.04 0.00 0.00 177.00 176.56 2fc7 s ILE 32 N -2.91 4.82 0.10 0.56 1.01 -0.90 -4.86 121.20 119.01 2fc7 s ILE 32 Ca 0.61 1.62 0.03 0.00 0.00 0.00 0.00 60.65 62.91 2fc7 s ILE 32 Cb -0.17 -4.14 -0.04 0.00 0.01 0.00 0.00 42.46 38.12 2fc7 s ILE 32 CO 0.56 -0.08 0.13 0.00 0.00 0.00 0.00 174.94 175.55 2fc7 s GLN 33 N 2.85 3.04 3.81 2.79 0.00 -1.26 -0.20 119.66 130.69 2fc7 s GLN 33 Ca 0.36 -0.67 0.00 0.00 -0.00 0.00 0.00 55.36 55.05 2fc7 s GLN 33 Cb -0.15 -2.79 0.00 0.00 0.00 0.00 0.00 33.01 30.06 2fc7 s GLN 33 CO 0.07 0.55 0.00 0.41 0.00 0.00 0.00 175.29 176.33 2fc7 n GLY 34 N 0.18 1.52 3.43 2.60 0.00 0.11 -4.68 105.19 108.36 2fc7 n GLY 34 Ca -0.08 -0.79 -0.34 0.00 0.00 0.00 0.00 46.02 44.82 2fc7 n GLY 34 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2fc7 s VAL 35 N 0.00 3.67 -0.50 1.61 1.01 -1.26 -4.55 120.40 120.38 2fc7 s VAL 35 Ca 0.00 -0.42 -0.17 0.00 0.00 0.00 0.00 61.98 61.39 2fc7 s VAL 35 Cb 0.00 -2.62 0.08 0.00 0.00 0.00 0.00 36.38 33.84 2fc7 s VAL 35 CO 0.00 0.47 0.51 -0.60 0.00 0.00 0.00 175.10 175.48 2fc7 s ARG 36 N 0.69 3.03 -0.68 2.72 3.52 0.11 -2.54 118.95 125.80 2fc7 s ARG 36 Ca -0.02 -1.26 -0.26 0.00 -0.13 0.00 0.00 55.73 54.05 2fc7 s ARG 36 Cb -0.15 -4.16 -0.00 0.00 -1.56 0.00 0.00 34.95 29.08 2fc7 s ARG 36 CO 0.02 -1.18 1.66 -1.58 -0.81 0.00 0.00 175.30 173.41 2fc7 s TRP 37 N 2.04 1.90 -0.24 5.12 0.52 0.10 -1.27 118.94 127.11 2fc7 s TRP 37 Ca 0.08 0.45 -0.16 0.00 0.02 0.00 0.00 56.10 56.49 2fc7 s TRP 37 Cb -0.23 -4.29 -0.04 0.00 -1.15 0.00 0.00 33.47 27.76 2fc7 s TRP 37 CO 0.08 -2.19 0.41 -1.58 0.02 0.00 0.00 176.95 173.68 2fc7 s HIS 38 N 7.89 3.30 0.49 -1.98 5.65 0.13 -0.26 115.29 130.51 2fc7 s HIS 38 Ca 0.56 0.53 -0.23 0.00 0.25 0.00 0.00 55.06 56.17 2fc7 s HIS 38 Cb -0.10 -2.58 -0.08 0.00 -1.18 0.00 0.00 32.58 28.63 2fc7 s HIS 38 CO 0.17 -0.16 1.09 0.00 -0.65 0.00 0.00 174.74 175.19 2fc7 n GLN 40 N -0.33 0.63 0.29 0.00 6.02 -0.03 -4.60 117.38 119.35 2fc7 n GLN 40 Ca 0.10 0.16 -0.16 0.00 -0.01 0.00 0.00 57.00 57.09 2fc7 n GLN 40 Cb 0.42 -1.50 -0.08 0.00 1.02 0.00 0.00 30.24 30.09 2fc7 n GLN 40 CO 0.00 0.00 0.00 0.22 -1.01 0.00 0.00 177.06 176.27 2fc7 h ASP 41 N -0.08 -0.59 -2.47 1.08 1.82 -1.93 -3.44 116.42 110.81 2fc7 h ASP 41 Ca -0.58 -0.02 -0.58 0.00 -0.39 0.00 0.00 57.03 55.46 2fc7 h ASP 41 Cb 1.85 0.15 0.19 0.00 0.68 0.00 0.00 39.33 42.21 2fc7 h ASP 41 CO -0.12 -0.35 -0.93 0.00 -1.61 0.00 0.00 179.24 176.23 2fc7 s PRO 43 N -1.76 0.93 0.00 0.00 0.04 -1.26 -4.78 135.00 128.17 2fc7 s PRO 43 Ca 0.59 0.70 0.15 0.00 0.04 0.00 0.00 61.00 62.48 2fc7 s PRO 43 Cb -0.41 -1.78 0.75 0.00 0.04 0.00 0.00 34.50 33.11 2fc7 s PRO 43 CO 0.64 -2.43 1.40 -0.35 0.04 0.00 0.00 177.00 176.30 2fc7 n PRO 44 N -4.00 0.22 -0.08 0.56 -0.04 -1.26 -1.50 135.00 128.91 2fc7 n PRO 44 Ca 0.06 0.14 -0.09 0.00 -0.04 0.00 0.00 63.50 63.57 2fc7 n PRO 44 Cb 0.56 -1.50 -0.11 0.00 -0.04 0.00 0.00 33.50 32.41 2fc7 n PRO 44 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 2fc7 n GLU 45 N -1.27 1.26 -0.85 0.54 -0.00 -1.26 -4.50 120.64 114.56 2fc7 n GLU 45 Ca 0.07 0.02 -0.06 0.00 -0.00 0.00 0.00 57.16 57.20 2fc7 n GLU 45 Cb 0.11 -1.39 0.22 0.00 -0.00 0.00 0.00 31.44 30.39 2fc7 n GLU 45 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.13 177.01 2fc7 n MET 46 N -2.69 2.40 -1.71 3.44 1.56 -1.08 -5.02 117.12 114.02 2fc7 n MET 46 Ca -0.27 -3.07 -0.43 0.00 -0.27 0.00 0.00 57.70 53.65 2fc7 n MET 46 Cb 0.96 -1.95 -0.02 0.00 2.15 0.00 0.00 33.22 34.35 2fc7 n MET 46 CO 0.00 0.00 0.00 -1.13 -0.73 0.00 0.00 175.97 174.11 2fc7 n SER 47 N -0.87 3.42 -4.89 6.12 3.41 -0.56 -4.62 113.62 115.62 2fc7 n SER 47 Ca 0.37 1.13 -0.21 0.00 -0.26 0.00 0.00 58.87 59.91 2fc7 n SER 47 Cb 1.18 -1.52 -0.03 0.00 -0.26 0.00 0.00 64.21 63.58 2fc7 n SER 47 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2fc7 s LEU 48 N -0.00 3.76 -0.06 1.04 1.43 -1.26 -4.98 118.68 118.61 2fc7 s LEU 48 Ca 0.68 -0.36 -0.02 0.00 -1.03 0.00 0.00 54.13 53.40 2fc7 s LEU 48 Cb -0.57 -2.41 0.04 0.00 0.03 0.00 0.00 46.19 43.28 2fc7 s LEU 48 CO 0.46 -0.33 0.12 -1.81 0.23 0.00 0.00 176.35 175.03 2fc7 s ASP 49 N -4.03 0.26 -0.06 2.29 1.01 -1.26 -2.22 116.67 112.66 2fc7 s ASP 49 Ca 0.41 0.24 0.05 0.00 0.71 0.00 0.00 52.55 53.97 2fc7 s ASP 49 Cb -0.07 0.14 -0.01 0.00 1.01 0.00 0.00 42.92 43.99 2fc7 s ASP 49 CO 0.28 -0.18 -0.23 -0.36 0.21 0.00 0.00 175.17 174.89 2fc7 s PHE 50 N 1.54 2.25 0.41 4.23 0.40 0.64 -2.12 117.98 125.34 2fc7 s PHE 50 Ca -0.05 -0.71 -0.24 0.00 -0.60 0.00 0.00 56.93 55.33 2fc7 s PHE 50 Cb -0.12 -1.49 -0.09 0.00 0.51 0.00 0.00 43.02 41.83 2fc7 s PHE 50 CO -0.05 -0.24 1.08 0.00 0.70 0.00 0.00 175.22 176.71 2fc7 n ASP 52 N -0.13 0.15 -0.08 0.00 2.03 -1.05 0.23 116.55 117.70 2fc7 n ASP 52 Ca 0.05 1.06 -0.11 0.00 0.52 0.00 0.00 54.79 56.32 2fc7 n ASP 52 Cb 0.49 -0.52 -0.04 0.00 -0.72 0.00 0.00 41.12 40.33 2fc7 n ASP 52 CO 0.00 0.00 0.00 0.28 -1.92 0.00 0.00 177.20 175.56 2fc7 h SER 53 N 0.00 0.38 -0.52 1.67 0.02 -1.90 -2.71 113.55 110.49 2fc7 h SER 53 Ca 0.69 -0.23 -0.13 0.00 -0.84 0.00 0.00 61.79 61.28 2fc7 h SER 53 Cb 2.25 -0.10 -0.08 0.00 0.14 0.00 0.00 62.40 64.61 2fc7 h SER 53 CO -0.34 0.51 0.16 0.00 -1.14 0.00 0.00 176.83 176.02 2fc7 h SER 55 N 2.17 0.68 -0.45 0.00 4.64 -0.79 -2.85 113.55 116.94 2fc7 h SER 55 Ca 0.16 -0.34 0.00 0.00 -0.47 0.00 0.00 61.79 61.13 2fc7 h SER 55 Cb 1.85 -0.19 0.00 0.00 -0.31 0.00 0.00 62.40 63.75 2fc7 h SER 55 CO 0.51 1.06 0.00 -0.90 -0.87 0.00 0.00 176.83 176.64 2fc7 n ASP 56 N -3.98 3.48 -4.91 4.97 5.68 -1.26 -4.93 116.55 115.60 2fc7 n ASP 56 Ca -0.03 -2.31 -0.27 0.00 -0.50 0.00 0.00 54.79 51.67 2fc7 n ASP 56 Cb 0.58 -0.48 -0.02 0.00 -1.14 0.00 0.00 41.12 40.06 2fc7 n ASP 56 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2fc7 s LEU 58 N -4.08 2.50 -0.05 0.00 2.96 -1.26 -5.09 118.68 113.66 2fc7 s LEU 58 Ca 0.45 -0.67 0.03 0.00 -0.22 0.00 0.00 54.13 53.71 2fc7 s LEU 58 Cb -0.10 -1.56 0.01 0.00 0.50 0.00 0.00 46.19 45.03 2fc7 s LEU 58 CO 0.35 -0.03 -0.13 -2.28 -1.32 0.00 0.00 176.35 172.94 2fc7 s HIS 59 N 1.32 1.45 -0.16 5.38 2.46 -1.26 -5.08 115.29 119.41 2fc7 s HIS 59 Ca 0.04 -0.47 0.00 0.00 0.47 0.00 0.00 55.06 55.11 2fc7 s HIS 59 Cb -0.14 -1.03 0.03 0.00 -0.13 0.00 0.00 32.58 31.31 2fc7 s HIS 59 CO -0.09 -0.21 -0.13 -1.21 -2.47 0.00 0.00 174.74 170.63 2fc7 s GLU 60 N 0.36 2.23 0.25 2.88 2.02 -1.26 -4.08 118.70 121.10 2fc7 s GLU 60 Ca -0.09 -0.62 0.00 0.00 0.02 0.00 0.00 54.97 54.28 2fc7 s GLU 60 Cb -0.13 -2.18 -0.00 0.00 0.10 0.00 0.00 34.13 31.92 2fc7 s GLU 60 CO 0.03 -0.28 0.01 0.25 0.02 0.00 0.00 175.26 175.28 2fc7 n THR 61 N 4.75 0.00 -0.31 3.63 -2.24 0.34 -4.95 114.28 115.51 2fc7 n THR 61 Ca -0.16 -1.22 0.15 0.00 -2.27 0.00 0.00 64.05 60.54 2fc7 n THR 61 Cb 0.49 0.27 0.33 0.00 -2.10 0.00 0.00 70.33 69.31 2fc7 n THR 61 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 2fc7 h ASP 62 N 0.64 0.12 0.00 3.42 3.32 -2.04 -3.25 116.42 118.64 2fc7 h ASP 62 Ca -0.21 0.19 -0.23 0.00 0.02 0.00 0.00 57.03 56.81 2fc7 h ASP 62 Cb 0.65 0.23 -0.03 0.00 0.22 0.00 0.00 39.33 40.40 2fc7 h ASP 62 CO 0.35 -0.14 -1.66 -0.38 -1.72 0.00 0.00 179.24 175.69 2fc7 n ILE 63 N -5.18 1.10 -1.73 0.35 5.41 -1.26 -5.01 119.36 113.04 2fc7 n ILE 63 Ca 0.23 -0.13 -0.38 0.00 1.00 0.00 0.00 62.75 63.48 2fc7 n ILE 63 Cb 0.74 -1.83 0.06 0.00 -0.71 0.00 0.00 39.64 37.89 2fc7 n ILE 63 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 176.55 178.12 2fc7 n HIS 64 N -3.89 2.02 -4.11 1.39 -0.00 -1.23 -4.96 115.22 104.44 2fc7 n HIS 64 Ca -0.29 0.42 -0.15 0.00 0.46 0.00 0.00 57.72 58.17 2fc7 n HIS 64 Cb 0.64 -2.30 -0.05 0.00 -0.12 0.00 0.00 29.99 28.17 2fc7 n HIS 64 CO 0.00 0.00 0.00 0.15 0.46 0.00 0.00 176.34 176.95 2fc7 s LYS 65 N -3.18 1.82 0.13 1.57 -0.14 -1.26 -0.50 119.74 118.19 2fc7 s LYS 65 Ca 0.79 -1.75 -0.09 0.00 -1.36 0.00 0.00 55.97 53.57 2fc7 s LYS 65 Cb -0.39 0.42 -0.07 0.00 -1.68 0.00 0.00 37.83 36.11 2fc7 s LYS 65 CO 0.43 -0.74 1.36 1.05 -0.76 0.00 0.00 175.35 176.70 2fc7 h GLU 66 N 2.15 0.67 -0.30 1.68 4.11 -1.96 -3.14 114.58 117.80 2fc7 h GLU 66 Ca -0.28 -0.53 -0.03 0.00 0.07 0.00 0.00 59.36 58.59 2fc7 h GLU 66 Cb 1.24 0.10 -0.02 0.00 0.50 0.00 0.00 28.75 30.58 2fc7 h GLU 66 CO 0.39 1.15 0.04 -0.44 0.07 0.00 0.00 179.01 180.22 2fc7 h ASP 67 N 0.47 0.40 -2.81 3.06 3.32 -1.97 -3.44 116.42 115.45 2fc7 h ASP 67 Ca -0.04 -0.05 -0.58 0.00 0.02 0.00 0.00 57.03 56.38 2fc7 h ASP 67 Cb 1.34 -0.10 0.18 0.00 0.22 0.00 0.00 39.33 40.96 2fc7 h ASP 67 CO 0.14 0.43 -0.56 1.41 -1.72 0.00 0.00 179.24 178.94 2fc7 n HIS 68 N -4.34 -1.21 -3.62 4.55 8.25 -1.19 -4.99 115.22 112.68 2fc7 n HIS 68 Ca 0.01 0.42 -0.20 0.00 -0.26 0.00 0.00 57.72 57.69 2fc7 n HIS 68 Cb 0.19 -1.89 -0.02 0.00 1.12 0.00 0.00 29.99 29.40 2fc7 n HIS 68 CO 0.00 0.00 0.00 -0.65 0.64 0.00 0.00 176.34 176.33 2fc7 s GLN 69 N -2.00 2.95 0.09 -0.41 -1.52 -1.26 -4.96 119.66 112.55 2fc7 s GLN 69 Ca 0.65 -1.13 0.08 0.00 -1.95 0.00 0.00 55.36 53.01 2fc7 s GLN 69 Cb -0.43 -2.67 -0.03 0.00 -0.22 0.00 0.00 33.01 29.65 2fc7 s GLN 69 CO 0.58 0.08 -0.21 -0.51 -0.25 0.00 0.00 175.29 174.97 2fc7 s LEU 70 N -4.10 2.27 -0.27 2.90 1.43 -1.26 -0.85 118.68 118.80 2fc7 s LEU 70 Ca 0.43 -0.65 -0.02 0.00 -1.03 0.00 0.00 54.13 52.87 2fc7 s LEU 70 Cb -0.08 -0.94 0.04 0.00 0.03 0.00 0.00 46.19 45.24 2fc7 s LEU 70 CO 0.29 0.10 -0.04 -0.70 0.23 0.00 0.00 176.35 176.23 2fc7 s GLU 71 N -1.73 2.67 -0.60 1.70 2.12 0.33 -4.82 118.70 118.37 2fc7 s GLU 71 Ca 0.07 -1.09 -0.27 0.00 0.36 0.00 0.00 54.97 54.04 2fc7 s GLU 71 Cb -0.10 -3.06 -0.02 0.00 0.26 0.00 0.00 34.13 31.21 2fc7 s GLU 71 CO 0.04 -0.49 1.86 -1.25 -0.54 0.00 0.00 175.26 174.88 2fc7 s PRO 72 N 1.29 2.65 -0.68 4.30 0.04 -1.26 0.22 135.00 141.56 2fc7 s PRO 72 Ca -0.02 0.64 -0.19 0.00 0.04 0.00 0.00 61.00 61.47 2fc7 s PRO 72 Cb -0.18 -4.38 0.11 0.00 0.04 0.00 0.00 34.50 30.09 2fc7 s PRO 72 CO -0.03 -2.70 0.84 0.42 0.04 0.00 0.00 177.00 175.56 2fc7 s ILE 73 N 9.01 4.74 0.03 0.56 1.01 -0.40 -4.89 121.20 131.25 2fc7 s ILE 73 Ca 0.68 -1.03 -0.27 0.00 0.00 0.00 0.00 60.65 60.03 2fc7 s ILE 73 Cb -0.13 -4.58 -0.17 0.00 0.01 0.00 0.00 42.46 37.59 2fc7 s ILE 73 CO 0.21 -1.26 1.31 1.88 0.00 0.00 0.00 174.94 177.08 2fc7 h TYR 74 N 9.14 -0.59 -2.44 3.97 -1.99 -1.87 0.32 116.97 123.51 2fc7 h TYR 74 Ca -0.20 -0.01 -0.56 0.00 2.00 0.00 0.00 58.73 59.95 2fc7 h TYR 74 Cb 1.07 0.19 -0.09 0.00 2.00 0.00 0.00 36.73 39.90 2fc7 h TYR 74 CO 0.93 -0.27 -0.62 1.03 -0.00 0.00 0.00 178.16 179.23 2fc7 s ARG 75 N -5.03 2.47 0.41 4.88 1.81 -1.26 -4.47 118.95 117.76 2fc7 s ARG 75 Ca -0.15 -1.23 -0.25 0.00 -1.72 0.00 0.00 55.73 52.38 2fc7 s ARG 75 Cb 0.02 -2.31 -0.08 0.00 -0.45 0.00 0.00 34.95 32.13 2fc7 s ARG 75 CO 0.54 0.40 1.19 -1.54 -0.68 0.00 0.00 175.30 175.21 2fc7 s SER 76 N -3.45 6.44 0.04 0.23 1.04 -1.26 -5.00 113.70 111.75 2fc7 s SER 76 Ca 0.30 2.38 0.03 0.00 0.48 0.00 0.00 55.95 59.14 2fc7 s SER 76 Cb -0.08 -2.62 -0.04 0.00 0.10 0.00 0.00 66.02 63.39 2fc7 s SER 76 CO 0.20 -0.73 0.01 -0.94 0.98 0.00 0.00 173.24 172.76 2fc7 s SER 77 N -1.11 5.14 0.00 7.02 1.04 -1.26 -4.97 113.70 119.55 2fc7 s SER 77 Ca 0.58 -0.07 0.00 0.00 0.48 0.00 0.00 55.95 56.94 2fc7 s SER 77 Cb -0.31 -1.31 0.00 0.00 0.10 0.00 0.00 66.02 64.50 2fc7 s SER 77 CO 0.39 0.23 0.00 0.61 0.98 0.00 0.00 173.24 175.45 2fc7 n GLY 78 N 0.99 0.38 3.62 7.32 0.00 -1.26 -5.08 105.19 111.17 2fc7 n GLY 78 Ca -0.12 -0.47 -0.43 0.00 0.00 0.00 0.00 46.02 45.00 2fc7 n GLY 78 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2fc7 s PRO 79 N 0.00 3.66 0.08 1.61 0.04 -1.26 -4.99 135.00 134.15 2fc7 s PRO 79 Ca 0.00 1.53 0.02 0.00 0.04 0.00 0.00 61.00 62.60 2fc7 s PRO 79 Cb 0.00 -4.07 -0.04 0.00 0.04 0.00 0.00 34.50 30.43 2fc7 s PRO 79 CO 0.00 -1.46 -0.07 0.45 0.04 0.00 0.00 177.00 175.96 2fc7 s SER 80 N 4.65 1.11 -0.14 6.66 0.15 -1.26 -5.15 113.70 119.72 2fc7 s SER 80 Ca 0.72 -0.87 -0.06 0.00 0.70 0.00 0.00 55.95 56.44 2fc7 s SER 80 Cb -0.23 0.07 -0.04 0.00 -1.71 0.00 0.00 66.02 64.11 2fc7 s SER 80 CO 0.31 -0.38 0.07 -0.94 1.20 0.00 0.00 173.24 173.50 2fc7 s SER 81 N -2.62 5.79 0.00 5.45 1.04 -1.26 -5.30 113.70 116.80 2fc7 s SER 81 Ca 0.06 0.23 0.00 0.00 0.48 0.00 0.00 55.95 56.72 2fc7 s SER 81 Cb 0.01 -1.87 0.00 0.00 0.10 0.00 0.00 66.02 64.26 2fc7 s SER 81 CO -0.03 0.31 0.00 0.61 0.98 0.00 0.00 173.24 175.11