#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ri0 s SER 2 N 0.00 -0.17 0.65 6.12 1.04 -1.26 -5.17 113.70 114.92 1ri0 s SER 2 Ca 0.00 0.05 -0.10 0.00 0.48 0.00 0.00 55.95 56.38 1ri0 s SER 2 Cb 0.00 0.16 -0.00 0.00 0.10 0.00 0.00 66.02 66.28 1ri0 s SER 2 CO 0.00 -0.25 1.03 0.00 0.98 0.00 0.00 173.24 175.00 1ri0 s ARG 3 N -2.15 3.09 0.14 4.02 1.70 -1.26 -5.08 118.95 119.42 1ri0 s ARG 3 Ca 0.08 0.44 0.03 0.00 -0.47 0.00 0.00 55.73 55.81 1ri0 s ARG 3 Cb -0.01 -2.10 -0.04 0.00 -0.57 0.00 0.00 34.95 32.24 1ri0 s ARG 3 CO -0.05 -0.82 0.19 -1.54 -1.08 0.00 0.00 175.30 172.01 1ri0 s SER 4 N -4.29 5.92 0.52 -2.89 1.04 -1.26 -5.09 113.70 107.64 1ri0 s SER 4 Ca 0.56 0.04 -0.19 0.00 0.48 0.00 0.00 55.95 56.84 1ri0 s SER 4 Cb -0.11 -1.68 -0.07 0.00 0.10 0.00 0.00 66.02 64.26 1ri0 s SER 4 CO 0.51 0.09 1.06 0.54 0.98 0.00 0.00 173.24 176.42 1ri0 s ASN 5 N -3.00 6.09 0.61 7.02 4.22 -1.26 -5.06 114.94 123.56 1ri0 s ASN 5 Ca 0.33 1.98 0.09 0.00 -2.14 0.00 0.00 52.86 53.12 1ri0 s ASN 5 Cb -0.11 -2.56 0.10 0.00 1.28 0.00 0.00 41.25 39.96 1ri0 s ASN 5 CO 0.26 -0.96 0.84 -2.11 -2.04 0.00 0.00 177.10 173.09 1ri0 n ARG 6 N -1.22 0.55 0.00 3.55 1.85 -1.26 -5.13 116.66 115.00 1ri0 n ARG 6 Ca 0.10 -3.20 0.00 0.00 -1.00 0.00 0.00 57.85 53.74 1ri0 n ARG 6 Cb 0.52 -0.28 0.00 0.00 -1.05 0.00 0.00 32.46 31.66 1ri0 n ARG 6 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1ri0 n GLN 7 N -2.34 0.00 -0.10 2.89 0.00 -1.26 -4.83 117.38 111.74 1ri0 n GLN 7 Ca 0.17 0.00 0.01 0.00 0.00 0.00 0.00 57.00 57.18 1ri0 n GLN 7 Cb 0.62 0.00 0.05 0.00 0.00 0.00 0.00 30.24 30.91 1ri0 n GLN 7 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.06 177.42 1ri0 n LYS 8 N 0.00 1.43 -1.66 2.61 -0.00 -1.26 -4.90 118.16 114.37 1ri0 n LYS 8 Ca 0.00 -0.42 -0.46 0.00 -0.00 0.00 0.00 58.31 57.43 1ri0 n LYS 8 Cb 0.00 -1.39 -0.03 0.00 -0.00 0.00 0.00 35.03 33.61 1ri0 n LYS 8 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.40 175.49 1ri0 n GLU 9 N -0.03 2.02 -3.93 -1.58 2.13 -1.26 -4.98 120.64 113.02 1ri0 n GLU 9 Ca 0.04 0.72 -0.09 0.00 0.66 0.00 0.00 57.16 58.49 1ri0 n GLU 9 Cb 0.26 -2.42 -0.07 0.00 0.27 0.00 0.00 31.44 29.47 1ri0 n GLU 9 CO 0.00 0.00 0.00 1.52 -0.41 0.00 0.00 177.13 178.24 1ri0 s TYR 10 N 0.35 0.32 0.17 4.31 -0.85 -1.26 -5.07 117.35 115.32 1ri0 s TYR 10 Ca 0.73 -0.71 -0.12 0.00 -0.52 0.00 0.00 57.07 56.45 1ri0 s TYR 10 Cb -0.68 -0.08 0.00 0.00 0.38 0.00 0.00 41.96 41.59 1ri0 s TYR 10 CO 0.45 -0.64 0.36 0.15 -1.52 0.00 0.00 175.55 174.34 1ri0 s LYS 11 N -3.93 1.22 -0.44 -3.49 -0.14 -1.26 -5.04 119.74 106.66 1ri0 s LYS 11 Ca 0.13 -1.07 -0.45 0.00 -1.36 0.00 0.00 55.97 53.21 1ri0 s LYS 11 Cb 0.04 0.42 -0.19 0.00 -1.68 0.00 0.00 37.83 36.42 1ri0 s LYS 11 CO -0.04 -0.47 1.67 0.00 -0.76 0.00 0.00 175.35 175.75 1ri0 n GLY 13 N 4.23 0.88 3.67 0.00 0.00 -1.26 -5.07 105.19 107.65 1ri0 n GLY 13 Ca 0.31 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.90 1ri0 n GLY 13 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1ri0 s ASP 14 N -1.85 7.12 -0.08 1.61 2.15 0.15 -4.90 116.67 120.87 1ri0 s ASP 14 Ca 0.00 1.54 -0.06 0.00 0.43 0.00 0.00 52.55 54.46 1ri0 s ASP 14 Cb 0.00 -2.55 -0.04 0.00 -0.30 0.00 0.00 42.92 40.03 1ri0 s ASP 14 CO 0.00 -0.59 0.16 -0.76 -0.17 0.00 0.00 175.17 173.81 1ri0 s LEU 15 N 2.67 4.38 0.27 -1.34 2.01 -1.26 -1.17 118.68 124.24 1ri0 s LEU 15 Ca 0.49 0.44 -0.20 0.00 0.01 0.00 0.00 54.13 54.87 1ri0 s LEU 15 Cb -0.19 -2.26 0.06 0.00 0.01 0.00 0.00 46.19 43.82 1ri0 s LEU 15 CO 0.14 0.36 0.90 0.68 1.01 0.00 0.00 176.35 179.44 1ri0 s VAL 16 N -1.13 0.00 -0.45 -1.59 -7.23 -1.01 -4.97 120.40 104.03 1ri0 s VAL 16 Ca 0.19 -0.80 -0.20 0.00 -1.81 0.00 0.00 61.98 59.37 1ri0 s VAL 16 Cb -0.12 -2.71 0.03 0.00 0.56 0.00 0.00 36.38 34.14 1ri0 s VAL 16 CO 0.09 0.00 0.60 -0.36 -0.31 0.00 0.00 175.10 175.12 1ri0 s PHE 17 N -2.50 3.08 -0.16 2.82 0.08 -0.95 -1.76 117.98 118.59 1ri0 s PHE 17 Ca 0.17 -0.19 -0.04 0.00 0.12 0.00 0.00 56.93 57.00 1ri0 s PHE 17 Cb -0.04 -3.29 -0.02 0.00 -0.57 0.00 0.00 43.02 39.10 1ri0 s PHE 17 CO 0.08 -0.86 -0.04 0.00 -0.10 0.00 0.00 175.22 174.29 1ri0 s ALA 18 N 2.67 2.96 0.28 5.36 0.00 0.17 -1.47 121.76 131.73 1ri0 s ALA 18 Ca 0.19 -0.87 0.08 0.00 0.00 0.00 0.00 51.96 51.36 1ri0 s ALA 18 Cb -0.15 -1.56 -0.04 0.00 0.00 0.00 0.00 23.12 21.37 1ri0 s ALA 18 CO 0.17 0.14 0.18 -1.59 0.00 0.00 0.00 175.76 174.66 1ri0 s LYS 19 N 0.50 2.74 0.18 0.00 -2.85 -0.83 -1.04 119.74 118.45 1ri0 s LYS 19 Ca -0.04 -1.20 0.04 0.00 -1.00 0.00 0.00 55.97 53.77 1ri0 s LYS 19 Cb -0.14 -2.45 -0.05 0.00 -2.06 0.00 0.00 37.83 33.13 1ri0 s LYS 19 CO 0.03 0.30 -0.05 1.41 0.10 0.00 0.00 175.35 177.14 1ri0 s MET 20 N -3.85 1.16 -0.05 1.78 1.75 -0.97 -4.90 119.30 114.22 1ri0 s MET 20 Ca 0.35 -1.54 -0.31 0.00 -1.25 0.00 0.00 55.69 52.94 1ri0 s MET 20 Cb -0.07 -0.54 -0.09 0.00 2.84 0.00 0.00 34.83 36.97 1ri0 s MET 20 CO 0.24 -0.03 2.00 1.17 -0.65 0.00 0.00 175.02 177.76 1ri0 n LYS 21 N -0.28 2.49 0.00 4.11 4.81 -1.26 0.31 118.16 128.34 1ri0 n LYS 21 Ca -0.08 0.88 0.00 0.00 -0.87 0.00 0.00 58.31 58.24 1ri0 n LYS 21 Cb 0.62 -2.93 0.00 0.00 0.02 0.00 0.00 35.03 32.74 1ri0 n LYS 21 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1ri0 n GLY 22 N 4.78 2.67 3.55 3.14 0.00 -1.26 -5.00 105.19 113.07 1ri0 n GLY 22 Ca 0.23 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.91 1ri0 n GLY 22 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1ri0 s TYR 23 N -2.10 3.00 0.61 1.61 5.04 0.15 -5.11 117.35 120.55 1ri0 s TYR 23 Ca 0.00 -0.11 -0.15 0.00 -2.44 0.00 0.00 57.07 54.37 1ri0 s TYR 23 Cb 0.00 -1.83 -0.03 0.00 0.35 0.00 0.00 41.96 40.45 1ri0 s TYR 23 CO 0.00 0.18 1.05 -1.25 -1.34 0.00 0.00 175.55 174.19 1ri0 s PRO 24 N -0.29 3.29 -0.48 4.97 0.04 -1.26 -2.30 135.00 138.96 1ri0 s PRO 24 Ca 0.05 1.12 -0.45 0.00 0.04 0.00 0.00 61.00 61.76 1ri0 s PRO 24 Cb -0.13 -2.03 -0.19 0.00 0.04 0.00 0.00 34.50 32.19 1ri0 s PRO 24 CO 0.02 -0.83 1.76 0.72 0.04 0.00 0.00 177.00 178.72 1ri0 n HIS 25 N -2.24 1.63 -4.42 0.56 8.25 -1.26 -4.53 115.22 113.21 1ri0 n HIS 25 Ca 0.08 0.99 -0.24 0.00 -0.26 0.00 0.00 57.72 58.29 1ri0 n HIS 25 Cb 0.53 -2.27 -0.11 0.00 1.12 0.00 0.00 29.99 29.26 1ri0 n HIS 25 CO 0.00 0.00 0.00 -0.46 0.64 0.00 0.00 176.34 176.52 1ri0 s TRP 26 N 3.89 2.17 -0.58 4.41 -0.00 -0.21 -4.59 118.94 124.03 1ri0 s TRP 26 Ca 1.08 -0.38 -0.27 0.00 -0.00 0.00 0.00 56.10 56.53 1ri0 s TRP 26 Cb -1.45 -1.02 0.01 0.00 -0.00 0.00 0.00 33.47 31.01 1ri0 s TRP 26 CO 0.76 0.55 1.51 -1.25 -0.00 0.00 0.00 176.95 178.52 1ri0 s PRO 27 N -3.09 3.15 0.13 5.86 0.04 -1.26 0.45 135.00 140.27 1ri0 s PRO 27 Ca 0.24 0.45 0.09 0.00 0.04 0.00 0.00 61.00 61.82 1ri0 s PRO 27 Cb -0.06 -4.19 -0.04 0.00 0.04 0.00 0.00 34.50 30.25 1ri0 s PRO 27 CO 0.11 -2.12 -0.22 0.00 0.04 0.00 0.00 177.00 174.81 1ri0 s ALA 28 N 6.68 1.99 0.08 8.56 0.00 -0.72 -2.16 121.76 136.19 1ri0 s ALA 28 Ca 0.55 -1.36 0.03 0.00 0.00 0.00 0.00 51.96 51.17 1ri0 s ALA 28 Cb -0.11 -0.26 -0.04 0.00 0.00 0.00 0.00 23.12 22.71 1ri0 s ALA 28 CO 0.23 0.37 0.11 -0.98 0.00 0.00 0.00 175.76 175.49 1ri0 s ARG 29 N -2.17 3.01 0.47 0.00 1.70 0.89 -2.41 118.95 120.43 1ri0 s ARG 29 Ca 0.11 -0.65 -0.22 0.00 -0.47 0.00 0.00 55.73 54.50 1ri0 s ARG 29 Cb -0.09 -2.79 -0.08 0.00 -0.57 0.00 0.00 34.95 31.42 1ri0 s ARG 29 CO 0.05 0.57 1.10 -1.50 -1.08 0.00 0.00 175.30 174.44 1ri0 s ILE 30 N -1.44 3.45 -0.11 4.99 -1.16 -0.32 -0.77 121.20 125.83 1ri0 s ILE 30 Ca 0.31 1.00 -0.29 0.00 -0.51 0.00 0.00 60.65 61.15 1ri0 s ILE 30 Cb -0.12 -3.47 0.08 0.00 0.61 0.00 0.00 42.46 39.56 1ri0 s ILE 30 CO 0.23 -0.09 0.72 -1.81 -2.81 0.00 0.00 174.94 171.18 1ri0 s ASP 31 N -1.65 -0.65 0.45 4.50 1.11 0.16 -4.05 116.67 116.53 1ri0 s ASP 31 Ca 0.65 0.86 0.08 0.00 0.18 0.00 0.00 52.55 54.32 1ri0 s ASP 31 Cb -0.23 0.74 0.01 0.00 1.07 0.00 0.00 42.92 44.51 1ri0 s ASP 31 CO 0.27 -0.50 0.49 -1.83 1.18 0.00 0.00 175.17 174.79 1ri0 s GLU 32 N -0.80 2.57 0.13 8.23 -1.05 -1.26 -0.07 118.70 126.45 1ri0 s GLU 32 Ca -0.07 -1.51 -0.30 0.00 -0.15 0.00 0.00 54.97 52.94 1ri0 s GLU 32 Cb -0.01 -2.50 -0.07 0.00 -0.44 0.00 0.00 34.13 31.10 1ri0 s GLU 32 CO 0.07 -0.35 1.21 0.00 0.95 0.00 0.00 175.26 177.14 1ri0 s MET 33 N -4.28 4.46 0.99 -4.83 0.23 -1.26 -4.73 119.30 109.87 1ri0 s MET 33 Ca 0.51 1.84 -0.15 0.00 -1.03 0.00 0.00 55.69 56.86 1ri0 s MET 33 Cb -0.06 -3.28 0.19 0.00 -1.53 0.00 0.00 34.83 30.15 1ri0 s MET 33 CO 0.30 -0.18 1.18 -1.25 -2.03 0.00 0.00 175.02 173.04 1ri0 s PRO 34 N 0.39 0.44 0.00 3.16 0.04 -1.26 -5.01 135.00 132.76 1ri0 s PRO 34 Ca 0.56 0.04 0.01 0.00 0.04 0.00 0.00 61.00 61.65 1ri0 s PRO 34 Cb -0.32 -1.78 0.02 0.00 0.04 0.00 0.00 34.50 32.46 1ri0 s PRO 34 CO 0.33 -2.62 0.76 -0.85 0.04 0.00 0.00 177.00 174.66 1ri0 n GLU 35 N -4.01 0.00 0.00 4.56 0.28 -1.25 -4.32 120.64 115.90 1ri0 n GLU 35 Ca 0.10 -0.55 0.00 0.00 -0.16 0.00 0.00 57.16 56.55 1ri0 n GLU 35 Cb 0.59 -0.18 0.00 0.00 1.43 0.00 0.00 31.44 33.29 1ri0 n GLU 35 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1ri0 n ALA 36 N 0.02 -0.07 0.38 -1.84 0.00 -1.26 -4.37 120.51 113.38 1ri0 n ALA 36 Ca -0.01 0.00 -0.18 0.00 0.00 0.00 0.00 53.44 53.25 1ri0 n ALA 36 Cb 0.62 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.98 1ri0 n ALA 36 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ri0 h ALA 37 N -2.00 -0.95 -3.25 0.00 0.00 -2.05 -3.44 119.26 107.56 1ri0 h ALA 37 Ca 0.00 -0.21 -0.28 0.00 0.00 0.00 0.00 54.91 54.42 1ri0 h ALA 37 Cb 0.00 0.37 -0.22 0.00 0.00 0.00 0.00 17.79 17.94 1ri0 h ALA 37 CO 0.00 -1.02 -0.74 0.14 0.00 0.00 0.00 179.25 177.64 1ri0 s VAL 38 N -5.92 0.51 -1.07 0.00 -7.23 -1.26 -5.09 120.40 100.34 1ri0 s VAL 38 Ca -0.18 -0.96 -0.08 0.00 -1.81 0.00 0.00 61.98 58.95 1ri0 s VAL 38 Cb 0.03 -0.56 0.27 0.00 0.56 0.00 0.00 36.38 36.68 1ri0 s VAL 38 CO 0.60 -0.32 1.05 -1.59 -0.31 0.00 0.00 175.10 174.53 1ri0 s LYS 39 N -1.39 4.05 -0.48 4.82 -2.85 -1.26 -3.82 119.74 118.81 1ri0 s LYS 39 Ca -0.09 -3.20 -0.01 0.00 -1.00 0.00 0.00 55.97 51.68 1ri0 s LYS 39 Cb -0.09 -4.47 0.13 0.00 -2.06 0.00 0.00 37.83 31.34 1ri0 s LYS 39 CO 0.00 -1.25 0.26 0.45 0.10 0.00 0.00 175.35 174.92 1ri0 s SER 40 N 1.15 5.04 -0.18 0.03 0.15 -1.26 -5.07 113.70 113.56 1ri0 s SER 40 Ca 0.30 -2.44 -0.29 0.00 0.70 0.00 0.00 55.95 54.21 1ri0 s SER 40 Cb -0.10 -1.78 -0.00 0.00 -1.71 0.00 0.00 66.02 62.43 1ri0 s SER 40 CO -0.09 -0.42 1.12 0.42 1.20 0.00 0.00 173.24 175.47 1ri0 s THR 41 N 0.53 4.53 0.10 6.45 -4.23 -1.26 -4.87 115.64 116.89 1ri0 s THR 41 Ca 0.13 1.84 0.03 0.00 -1.18 0.00 0.00 61.69 62.50 1ri0 s THR 41 Cb -0.22 -4.18 -0.04 0.00 1.34 0.00 0.00 72.50 69.40 1ri0 s THR 41 CO -0.04 -0.13 0.12 0.00 -0.54 0.00 0.00 174.62 174.03 1ri0 s ALA 42 N 3.06 3.63 -0.75 3.99 0.00 -1.26 -5.00 121.76 125.43 1ri0 s ALA 42 Ca 0.49 -1.04 -0.06 0.00 0.00 0.00 0.00 51.96 51.36 1ri0 s ALA 42 Cb -0.18 -1.48 -0.01 0.00 0.00 0.00 0.00 23.12 21.44 1ri0 s ALA 42 CO 0.12 0.70 2.88 0.27 0.00 0.00 0.00 175.76 179.72 1ri0 n ASN 43 N 0.22 6.96 -3.13 0.00 0.23 -1.26 -4.83 115.26 113.45 1ri0 n ASN 43 Ca -0.08 -2.95 -0.12 0.00 -0.53 0.00 0.00 54.58 50.90 1ri0 n ASN 43 Cb 0.52 -1.35 -0.01 0.00 -2.08 0.00 0.00 39.78 36.86 1ri0 n ASN 43 CO 0.00 0.00 0.00 -1.59 -0.93 0.00 0.00 177.26 174.74 1ri0 s LYS 44 N -0.47 2.05 -0.18 -3.83 0.00 -1.26 -5.13 119.74 110.92 1ri0 s LYS 44 Ca 0.61 -1.58 -0.04 0.00 0.00 0.00 0.00 55.97 54.96 1ri0 s LYS 44 Cb 0.29 0.53 -0.02 0.00 0.00 0.00 0.00 37.83 38.63 1ri0 s LYS 44 CO -0.12 -0.91 -0.04 -0.47 0.00 0.00 0.00 175.35 173.82 1ri0 s TYR 45 N -2.76 2.99 -0.45 1.78 5.04 -0.78 -4.86 117.35 118.32 1ri0 s TYR 45 Ca 0.23 -0.48 -0.28 0.00 -2.44 0.00 0.00 57.07 54.10 1ri0 s TYR 45 Cb -0.03 -2.01 0.00 0.00 0.35 0.00 0.00 41.96 40.28 1ri0 s TYR 45 CO 0.16 -0.20 1.51 -1.14 -1.34 0.00 0.00 175.55 174.54 1ri0 s GLN 46 N 0.73 3.40 -0.02 4.97 -0.44 0.90 -1.44 119.66 127.76 1ri0 s GLN 46 Ca -0.02 0.88 -0.13 0.00 -2.50 0.00 0.00 55.36 53.59 1ri0 s GLN 46 Cb -0.14 -4.10 -0.05 0.00 -1.64 0.00 0.00 33.01 27.07 1ri0 s GLN 46 CO 0.02 -1.79 0.37 0.54 0.50 0.00 0.00 175.29 174.93 1ri0 s VAL 47 N 6.09 5.10 -0.37 1.34 0.11 0.24 0.37 120.40 133.29 1ri0 s VAL 47 Ca 0.63 0.74 0.03 0.00 -2.93 0.00 0.00 61.98 60.45 1ri0 s VAL 47 Cb -0.14 -3.66 0.11 0.00 -1.53 0.00 0.00 36.38 31.15 1ri0 s VAL 47 CO 0.30 0.58 0.09 0.12 -3.33 0.00 0.00 175.10 172.87 1ri0 s PHE 48 N -1.08 3.38 -0.03 1.54 2.19 0.05 -0.69 117.98 123.34 1ri0 s PHE 48 Ca 0.22 -2.86 -0.30 0.00 0.33 0.00 0.00 56.93 54.32 1ri0 s PHE 48 Cb -0.16 -2.73 -0.04 0.00 -1.31 0.00 0.00 43.02 38.78 1ri0 s PHE 48 CO 0.12 -0.91 1.21 -0.06 1.83 0.00 0.00 175.22 177.42 1ri0 s PHE 49 N 0.80 3.21 -0.16 10.12 0.40 0.11 -0.08 117.98 132.38 1ri0 s PHE 49 Ca 0.12 1.21 -0.15 0.00 -0.60 0.00 0.00 56.93 57.51 1ri0 s PHE 49 Cb -0.20 -3.43 -0.11 0.00 0.51 0.00 0.00 43.02 39.78 1ri0 s PHE 49 CO -0.09 -1.37 0.10 0.74 0.70 0.00 0.00 175.22 175.30 1ri0 h PHE 50 N 7.37 0.00 -0.96 0.36 0.04 -1.68 -0.23 116.94 121.83 1ri0 h PHE 50 Ca -0.36 0.00 0.17 0.00 2.80 0.00 0.00 57.97 60.58 1ri0 h PHE 50 Cb 1.17 0.00 -0.17 0.00 2.20 0.00 0.00 35.95 39.16 1ri0 h PHE 50 CO 0.72 0.68 -0.32 0.41 -0.60 0.00 0.00 178.31 179.20 1ri0 n GLY 51 N 1.56 -1.83 0.11 -1.45 0.00 -1.24 0.76 105.19 103.09 1ri0 n GLY 51 Ca -0.16 1.06 -0.01 0.00 0.00 0.00 0.00 46.02 46.91 1ri0 n GLY 51 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1ri0 h THR 52 N 0.00 0.85 -2.20 2.61 1.35 -1.83 -3.45 112.91 110.25 1ri0 h THR 52 Ca 0.39 -2.34 -0.12 0.00 -0.55 0.00 0.00 66.41 63.78 1ri0 h THR 52 Cb 0.63 2.34 0.03 0.00 -1.73 0.00 0.00 68.15 69.42 1ri0 h THR 52 CO -0.97 0.48 -0.20 1.57 -0.25 0.00 0.00 175.52 176.16 1ri0 n HIS 53 N -3.10 -0.77 -4.27 4.73 -0.00 0.23 -5.05 115.22 106.99 1ri0 n HIS 53 Ca -0.04 0.26 -0.15 0.00 0.46 0.00 0.00 57.72 58.25 1ri0 n HIS 53 Cb 0.83 -2.15 -0.10 0.00 -0.12 0.00 0.00 29.99 28.44 1ri0 n HIS 53 CO 0.00 0.00 0.00 -1.21 0.46 0.00 0.00 176.34 175.59 1ri0 s GLU 54 N -5.22 1.17 0.27 1.57 0.41 -0.19 -4.98 118.70 111.73 1ri0 s GLU 54 Ca 0.15 -1.56 0.07 0.00 -0.41 0.00 0.00 54.97 53.22 1ri0 s GLU 54 Cb -0.07 -0.42 -0.03 0.00 -1.78 0.00 0.00 34.13 31.83 1ri0 s GLU 54 CO 0.18 -0.09 0.23 0.99 -0.49 0.00 0.00 175.26 176.08 1ri0 s THR 55 N -3.54 4.23 0.31 3.63 2.01 -1.26 0.06 115.64 121.09 1ri0 s THR 55 Ca 0.24 -1.38 -0.17 0.00 0.31 0.00 0.00 61.69 60.69 1ri0 s THR 55 Cb 0.05 -3.36 0.06 0.00 0.01 0.00 0.00 72.50 69.27 1ri0 s THR 55 CO 0.05 -0.30 0.86 0.00 -0.69 0.00 0.00 174.62 174.53 1ri0 n ALA 56 N -1.24 -2.06 -3.98 7.40 0.00 0.13 -4.90 120.51 115.86 1ri0 n ALA 56 Ca -0.06 -1.15 -0.31 0.00 0.00 0.00 0.00 53.44 51.91 1ri0 n ALA 56 Cb 0.58 0.83 -0.15 0.00 0.00 0.00 0.00 19.45 20.72 1ri0 n ALA 56 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 1ri0 s PHE 57 N -2.28 3.14 0.44 0.00 -0.71 -1.26 -0.60 117.98 116.73 1ri0 s PHE 57 Ca 0.18 -2.48 0.03 0.00 -1.04 0.00 0.00 56.93 53.62 1ri0 s PHE 57 Cb -0.04 -2.32 -0.02 0.00 -1.21 0.00 0.00 43.02 39.43 1ri0 s PHE 57 CO 0.09 -0.90 0.09 -0.51 -1.34 0.00 0.00 175.22 172.66 1ri0 s LEU 58 N 1.13 2.09 0.00 -1.99 1.43 -0.52 -4.92 118.68 115.90 1ri0 s LEU 58 Ca 0.04 -1.68 0.00 0.00 -1.03 0.00 0.00 54.13 51.46 1ri0 s LEU 58 Cb -0.19 -0.30 0.00 0.00 0.03 0.00 0.00 46.19 45.73 1ri0 s LEU 58 CO -0.09 -0.92 0.00 0.61 0.23 0.00 0.00 176.35 176.18 1ri0 n GLY 59 N -1.03 6.84 0.16 -3.19 0.00 -1.26 -1.87 105.19 104.84 1ri0 n GLY 59 Ca -0.10 -1.93 0.03 0.00 0.00 0.00 0.00 46.02 44.02 1ri0 n GLY 59 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ri0 h PRO 60 N 0.00 0.00 0.00 1.61 0.13 -1.98 -2.70 132.00 129.06 1ri0 h PRO 60 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1ri0 h PRO 60 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 1ri0 h PRO 60 CO 0.00 0.50 0.00 -0.22 -0.23 0.00 0.00 178.00 178.05 1ri0 h LYS 61 N 0.00 0.00 -0.38 0.86 1.63 -2.02 -2.16 116.57 114.50 1ri0 h LYS 61 Ca -0.00 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.80 1ri0 h LYS 61 Cb 1.13 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.76 1ri0 h LYS 61 CO 0.06 0.00 0.00 -0.25 -3.45 0.00 0.00 179.45 175.81 1ri0 n ASP 62 N -2.57 3.31 -3.98 4.20 8.00 -1.04 -4.87 116.55 119.60 1ri0 n ASP 62 Ca 0.03 -1.95 -0.26 0.00 0.71 0.00 0.00 54.79 53.33 1ri0 n ASP 62 Cb 0.35 -0.24 -0.17 0.00 -0.02 0.00 0.00 41.12 41.04 1ri0 n ASP 62 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1ri0 s LEU 63 N -1.33 1.49 0.04 0.64 1.43 -0.81 -1.96 118.68 118.18 1ri0 s LEU 63 Ca 0.35 -0.31 0.07 0.00 -1.03 0.00 0.00 54.13 53.22 1ri0 s LEU 63 Cb 0.20 -0.84 -0.02 0.00 0.03 0.00 0.00 46.19 45.56 1ri0 s LEU 63 CO 0.28 -0.02 -0.20 0.12 0.23 0.00 0.00 176.35 176.76 1ri0 s PHE 64 N 1.05 1.78 0.85 0.29 5.36 -0.54 -4.83 117.98 121.94 1ri0 s PHE 64 Ca -0.07 -0.37 -0.12 0.00 -0.96 0.00 0.00 56.93 55.41 1ri0 s PHE 64 Cb -0.15 -1.06 0.10 0.00 -0.34 0.00 0.00 43.02 41.57 1ri0 s PHE 64 CO -0.01 0.08 1.12 -1.25 -1.46 0.00 0.00 175.22 173.70 1ri0 s PRO 65 N -1.13 1.62 0.03 10.12 0.04 -1.26 -2.23 135.00 142.19 1ri0 s PRO 65 Ca 0.07 0.47 -0.15 0.00 0.04 0.00 0.00 61.00 61.43 1ri0 s PRO 65 Cb -0.09 -1.88 -0.35 0.00 0.04 0.00 0.00 34.50 32.23 1ri0 s PRO 65 CO 0.02 -1.91 1.02 -0.92 0.04 0.00 0.00 177.00 175.25 1ri0 h TYR 66 N -1.29 0.98 -0.30 0.56 3.20 -1.96 -1.15 116.97 117.01 1ri0 h TYR 66 Ca -0.49 -0.70 0.07 0.00 3.14 0.00 0.00 58.73 60.75 1ri0 h TYR 66 Cb 1.30 -0.04 -0.07 0.00 1.54 0.00 0.00 36.73 39.46 1ri0 h TYR 66 CO 0.38 1.55 -0.15 0.93 -1.64 0.00 0.00 178.16 179.22 1ri0 h GLU 67 N 0.16 -0.11 -0.02 1.82 4.39 -1.96 1.55 114.58 120.40 1ri0 h GLU 67 Ca -0.25 0.01 -0.05 0.00 0.34 0.00 0.00 59.36 59.41 1ri0 h GLU 67 Cb 2.14 0.02 0.00 0.00 -0.10 0.00 0.00 28.75 30.82 1ri0 h GLU 67 CO 0.27 -0.07 -0.20 0.93 -1.16 0.00 0.00 179.01 178.78 1ri0 h GLU 68 N -0.11 0.17 -0.60 2.33 4.39 -1.98 -0.99 114.58 117.79 1ri0 h GLU 68 Ca 0.16 -0.16 0.09 0.00 0.34 0.00 0.00 59.36 59.79 1ri0 h GLU 68 Cb 0.35 0.04 -0.07 0.00 -0.10 0.00 0.00 28.75 28.96 1ri0 h GLU 68 CO -0.37 0.86 0.22 0.77 -1.16 0.00 0.00 179.01 179.32 1ri0 h SER 69 N -0.46 0.20 1.41 1.42 0.02 -0.89 0.38 113.55 115.63 1ri0 h SER 69 Ca -0.02 0.08 -0.00 0.00 -0.84 0.00 0.00 61.79 61.01 1ri0 h SER 69 Cb 0.91 0.07 -0.00 0.00 0.14 0.00 0.00 62.40 63.52 1ri0 h SER 69 CO 0.04 0.12 -0.01 0.07 -1.14 0.00 0.00 176.83 175.91 1ri0 h LYS 70 N 0.39 0.00 -0.51 3.45 2.10 0.22 1.05 116.57 123.27 1ri0 h LYS 70 Ca 0.30 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.95 1ri0 h LYS 70 Cb 0.38 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 31.69 1ri0 h LYS 70 CO -0.31 0.01 0.32 1.49 -2.00 0.00 0.00 179.45 178.96 1ri0 h GLU 71 N 0.00 0.68 0.00 0.07 4.81 0.12 -3.38 114.58 116.88 1ri0 h GLU 71 Ca -0.00 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.18 1ri0 h GLU 71 Cb 0.72 -0.15 0.00 0.00 0.63 0.00 0.00 28.75 29.95 1ri0 h GLU 71 CO 0.00 0.48 -0.28 1.17 -0.73 0.00 0.00 179.01 179.65 1ri0 n LYS 72 N -4.70 0.15 0.00 1.92 3.00 -0.92 -5.07 118.16 112.54 1ri0 n LYS 72 Ca 0.02 0.06 0.00 0.00 -0.00 0.00 0.00 58.31 58.39 1ri0 n LYS 72 Cb 0.04 -0.71 0.00 0.00 0.00 0.00 0.00 35.03 34.36 1ri0 n LYS 72 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.40 178.59 1ri0 n PHE 73 N -3.10 0.00 -0.99 5.64 3.01 0.62 -5.00 117.46 117.64 1ri0 n PHE 73 Ca -0.04 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.42 1ri0 n PHE 73 Cb 0.15 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.62 1ri0 n PHE 73 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1ri0 n GLY 74 N 2.13 0.26 3.07 1.37 0.00 0.33 -4.03 105.19 108.32 1ri0 n GLY 74 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 1ri0 n GLY 74 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ri0 s LYS 75 N -1.00 2.16 1.01 1.61 1.02 -1.26 -4.83 119.74 118.46 1ri0 s LYS 75 Ca 0.00 -2.23 -0.16 0.00 0.02 0.00 0.00 55.97 53.61 1ri0 s LYS 75 Cb 0.00 -3.56 0.20 0.00 -0.52 0.00 0.00 37.83 33.95 1ri0 s LYS 75 CO 0.00 -1.10 1.19 -1.25 -0.92 0.00 0.00 175.35 173.26 1ri0 s PRO 76 N 0.42 0.27 0.02 -1.68 0.04 -1.26 -4.91 135.00 127.89 1ri0 s PRO 76 Ca 0.13 -0.04 -0.37 0.00 0.04 0.00 0.00 61.00 60.77 1ri0 s PRO 76 Cb -0.22 -1.77 -0.16 0.00 0.04 0.00 0.00 34.50 32.40 1ri0 s PRO 76 CO -0.04 -2.72 1.49 0.09 0.04 0.00 0.00 177.00 175.86 1ri0 n ASN 77 N -4.07 2.13 -4.57 6.66 5.03 -1.26 -4.81 115.26 114.37 1ri0 n ASN 77 Ca 0.11 1.10 -0.40 0.00 0.87 0.00 0.00 54.58 56.26 1ri0 n ASN 77 Cb 0.59 -1.23 -0.02 0.00 -1.02 0.00 0.00 39.78 38.10 1ri0 n ASN 77 CO 0.00 0.00 0.00 -0.54 -1.83 0.00 0.00 177.26 174.89 1ri0 s LYS 78 N 1.37 3.60 0.29 3.52 3.01 -1.26 -4.82 119.74 125.44 1ri0 s LYS 78 Ca 0.87 -1.35 0.05 0.00 -1.01 0.00 0.00 55.97 54.52 1ri0 s LYS 78 Cb -0.92 -5.39 0.05 0.00 -1.01 0.00 0.00 37.83 30.56 1ri0 s LYS 78 CO 0.49 -2.38 0.38 0.54 0.51 0.00 0.00 175.35 174.89 1ri0 n ARG 79 N 8.70 0.83 0.10 1.68 5.12 -1.26 -4.97 116.66 126.85 1ri0 n ARG 79 Ca 0.39 -1.58 -0.13 0.00 -1.93 0.00 0.00 57.85 54.60 1ri0 n ARG 79 Cb 0.49 -0.09 -0.08 0.00 -1.16 0.00 0.00 32.46 31.62 1ri0 n ARG 79 CO 0.00 0.00 0.00 0.87 -1.93 0.00 0.00 177.63 176.57 1ri0 h LYS 80 N 0.00 -0.27 0.00 5.56 1.79 -2.01 -2.69 116.57 118.96 1ri0 h LYS 80 Ca -0.14 0.02 0.00 0.00 -2.18 0.00 0.00 60.65 58.35 1ri0 h LYS 80 Cb 0.63 0.06 0.00 0.00 -1.58 0.00 0.00 32.23 31.34 1ri0 h LYS 80 CO 0.20 0.10 0.00 0.41 -1.08 0.00 0.00 179.45 179.08 1ri0 n GLY 81 N -0.03 -0.75 0.09 3.86 0.00 -1.26 -2.59 105.19 104.51 1ri0 n GLY 81 Ca -0.09 -0.07 -0.17 0.00 0.00 0.00 0.00 46.02 45.69 1ri0 n GLY 81 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1ri0 h PHE 82 N 0.00 0.14 0.27 1.61 3.04 -1.80 -1.94 116.94 118.24 1ri0 h PHE 82 Ca 0.00 -0.10 -0.01 0.00 3.98 0.00 0.00 57.97 61.84 1ri0 h PHE 82 Cb 0.13 -0.01 0.00 0.00 2.56 0.00 0.00 35.95 38.64 1ri0 h PHE 82 CO 0.00 1.17 -0.13 1.03 -2.02 0.00 0.00 178.31 178.36 1ri0 h SER 83 N -0.83 -0.30 0.48 0.41 0.87 -1.30 -1.64 113.55 111.24 1ri0 h SER 83 Ca -0.10 -0.22 0.00 0.00 -1.23 0.00 0.00 61.79 60.24 1ri0 h SER 83 Cb 1.22 0.08 0.00 0.00 -0.44 0.00 0.00 62.40 63.26 1ri0 h SER 83 CO 0.00 0.11 0.00 -1.84 -0.53 0.00 0.00 176.83 174.58 1ri0 n GLU 84 N -5.07 0.04 -0.03 2.24 0.28 -1.07 -2.12 120.64 114.91 1ri0 n GLU 84 Ca -0.09 0.22 -0.01 0.00 -0.16 0.00 0.00 57.16 57.13 1ri0 n GLU 84 Cb 0.26 -1.50 -0.00 0.00 1.43 0.00 0.00 31.44 31.63 1ri0 n GLU 84 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 177.13 177.75 1ri0 h GLY 85 N 2.58 0.00 1.82 -1.84 0.00 -1.10 -0.19 103.07 104.34 1ri0 h GLY 85 Ca 0.00 0.00 0.02 0.00 0.00 0.00 0.00 47.33 47.35 1ri0 h GLY 85 CO 0.00 0.00 0.08 0.17 0.00 0.00 0.00 176.54 176.79 1ri0 h LEU 86 N -0.59 0.00 0.00 3.11 -0.00 -1.32 0.44 115.31 116.96 1ri0 h LEU 86 Ca 0.00 0.00 -0.23 0.00 -0.00 0.00 0.00 57.88 57.65 1ri0 h LEU 86 Cb 0.06 0.00 -0.04 0.00 -0.00 0.00 0.00 40.66 40.68 1ri0 h LEU 86 CO 0.00 0.00 -1.34 -0.25 -0.00 0.00 0.00 178.44 176.85 1ri0 h TRP 87 N 0.00 0.00 0.00 0.17 2.91 -1.55 -0.48 115.95 117.00 1ri0 h TRP 87 Ca 0.02 0.00 -0.03 0.00 1.13 0.00 0.00 58.89 60.02 1ri0 h TRP 87 Cb 0.18 0.00 -0.00 0.00 -0.51 0.00 0.00 29.16 28.82 1ri0 h TRP 87 CO 0.00 0.89 -0.14 0.93 -1.03 0.00 0.00 178.44 179.09 1ri0 h GLU 88 N 0.00 0.00 0.00 2.65 4.39 0.18 1.13 114.58 122.93 1ri0 h GLU 88 Ca -0.16 0.00 -0.42 0.00 0.34 0.00 0.00 59.36 59.13 1ri0 h GLU 88 Cb 1.81 0.00 -0.07 0.00 -0.10 0.00 0.00 28.75 30.40 1ri0 h GLU 88 CO 0.09 0.14 -2.50 1.51 -1.16 0.00 0.00 179.01 177.09 1ri0 n ILE 89 N -3.51 1.49 0.20 3.13 0.00 -0.69 -3.25 119.36 116.74 1ri0 n ILE 89 Ca -0.01 -0.50 0.07 0.00 0.00 0.00 0.00 62.75 62.31 1ri0 n ILE 89 Cb 0.29 -1.58 0.42 0.00 0.00 0.00 0.00 39.64 38.77 1ri0 n ILE 89 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 176.55 176.22 1ri0 h GLU 90 N -0.36 0.00 -2.09 9.51 4.39 -1.02 -3.27 114.58 121.74 1ri0 h GLU 90 Ca -0.62 0.00 -0.53 0.00 0.34 0.00 0.00 59.36 58.55 1ri0 h GLU 90 Cb 1.79 0.00 -0.41 0.00 -0.10 0.00 0.00 28.75 30.03 1ri0 h GLU 90 CO -0.21 0.32 -1.01 0.09 -1.16 0.00 0.00 179.01 177.04 1ri0 n ASN 91 N -3.64 1.91 -4.78 1.42 3.02 0.39 -5.02 115.26 108.55 1ri0 n ASN 91 Ca -0.01 -3.18 -0.32 0.00 -0.03 0.00 0.00 54.58 51.04 1ri0 n ASN 91 Cb 0.43 -0.61 0.05 0.00 -0.61 0.00 0.00 39.78 39.05 1ri0 n ASN 91 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1ri0 s ASN 92 N -2.58 5.09 0.12 6.41 4.22 -1.20 -4.58 114.94 122.42 1ri0 s ASN 92 Ca 0.42 1.89 -0.08 0.00 -2.14 0.00 0.00 52.86 52.94 1ri0 s ASN 92 Cb 0.30 -2.54 -0.12 0.00 1.28 0.00 0.00 41.25 40.17 1ri0 s ASN 92 CO -0.10 -1.64 1.29 1.55 -2.04 0.00 0.00 177.10 176.16 1ri0 h PRO 93 N -0.27 0.58 -3.49 3.55 0.13 -1.94 -3.38 132.00 127.17 1ri0 h PRO 93 Ca -0.46 -0.56 -0.68 0.00 -0.87 0.00 0.00 66.00 63.43 1ri0 h PRO 93 Cb 1.23 0.14 -0.37 0.00 0.13 0.00 0.00 31.00 32.14 1ri0 h PRO 93 CO 0.54 1.18 -0.40 0.99 -0.23 0.00 0.00 178.00 180.09 1ri0 s THR 94 N -3.45 3.54 0.33 1.56 2.01 -1.26 -5.07 115.64 113.30 1ri0 s THR 94 Ca -0.08 -3.15 0.01 0.00 0.31 0.00 0.00 61.69 58.78 1ri0 s THR 94 Cb 0.08 -3.32 0.06 0.00 0.01 0.00 0.00 72.50 69.34 1ri0 s THR 94 CO 0.89 -0.89 0.45 0.55 -0.69 0.00 0.00 174.62 174.94 1ri0 n VAL 95 N 3.26 0.00 0.00 3.82 3.14 -1.26 -5.01 118.33 122.28 1ri0 n VAL 95 Ca 0.09 -0.79 0.00 0.00 -2.96 0.00 0.00 64.34 60.68 1ri0 n VAL 95 Cb 0.37 -1.06 0.00 0.00 -1.06 0.00 0.00 33.84 32.09 1ri0 n VAL 95 CO 0.00 0.00 0.00 2.29 -6.46 0.00 0.00 176.83 172.66 1ri0 n LYS 96 N -1.81 0.00 -3.76 1.45 -0.00 -1.26 -5.04 118.16 107.74 1ri0 n LYS 96 Ca 0.08 0.00 -0.33 0.00 -0.00 0.00 0.00 58.31 58.06 1ri0 n LYS 96 Cb 0.28 0.00 -0.09 0.00 -0.00 0.00 0.00 35.03 35.22 1ri0 n LYS 96 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1ri0 s ALA 97 N -0.99 3.98 0.08 0.58 0.00 -1.26 -4.80 121.76 119.34 1ri0 s ALA 97 Ca 0.00 -3.76 0.00 0.00 0.00 0.00 0.00 51.96 48.20 1ri0 s ALA 97 Cb 0.00 -2.52 0.00 0.00 0.00 0.00 0.00 23.12 20.60 1ri0 s ALA 97 CO 0.00 -2.12 0.00 0.45 0.00 0.00 0.00 175.76 174.09 1ri0 n SER 98 N 2.33 0.75 -0.06 0.00 2.88 -1.26 -5.15 113.62 113.11 1ri0 n SER 98 Ca 0.19 0.11 0.00 0.00 -1.33 0.00 0.00 58.87 57.84 1ri0 n SER 98 Cb 0.36 -0.21 0.00 0.00 -0.75 0.00 0.00 64.21 63.61 1ri0 n SER 98 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1ri0 n GLY 99 N 3.41 0.66 0.48 0.46 0.00 -1.26 -5.29 105.19 103.65 1ri0 n GLY 99 Ca 0.00 -1.03 0.14 0.00 0.00 0.00 0.00 46.02 45.13 1ri0 n GLY 99 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30