#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 5.99 0.64 3.17 1.04 -1.26 -5.06 113.70 118.22 1ri0 s SER 2 Ca 0.00 -3.40 -0.05 0.00 0.48 0.00 0.00 55.95 52.97 1ri0 s SER 2 Cb 0.00 -1.95 0.04 0.00 0.10 0.00 0.00 66.02 64.21 1ri0 s SER 2 CO 0.00 -0.27 0.94 0.00 0.98 0.00 0.00 173.24 174.89 1ri0 s ARG 3 N -0.89 2.51 0.34 4.02 1.70 -1.26 -5.04 118.95 120.34 1ri0 s ARG 3 Ca 0.24 -0.22 -0.28 0.00 -0.47 0.00 0.00 55.73 55.01 1ri0 s ARG 3 Cb -0.11 -2.24 -0.09 0.00 -0.57 0.00 0.00 34.95 31.93 1ri0 s ARG 3 CO -0.09 -0.98 1.21 -1.12 -1.08 0.00 0.00 175.30 173.24 1ri0 s SER 4 N -4.43 6.81 0.24 -2.89 0.01 -1.26 -5.04 113.70 107.15 1ri0 s SER 4 Ca 0.57 2.47 0.10 0.00 1.31 0.00 0.00 55.95 60.40 1ri0 s SER 4 Cb -0.11 -2.63 -0.04 0.00 0.21 0.00 0.00 66.02 63.45 1ri0 s SER 4 CO 0.44 -0.49 -0.06 0.54 0.41 0.00 0.00 173.24 174.09 1ri0 s ASN 5 N -0.80 4.32 0.70 2.44 4.22 -1.26 -5.14 114.94 119.43 1ri0 s ASN 5 Ca 0.50 -0.67 0.03 0.00 -2.14 0.00 0.00 52.86 50.58 1ri0 s ASN 5 Cb -0.35 -0.73 0.13 0.00 1.28 0.00 0.00 41.25 41.58 1ri0 s ASN 5 CO 0.45 0.04 0.96 -2.11 -2.04 0.00 0.00 177.10 174.40 1ri0 n ARG 6 N -0.56 0.07 0.00 3.55 1.85 -1.26 -5.12 116.66 115.19 1ri0 n ARG 6 Ca -0.08 -2.88 0.00 0.00 -1.00 0.00 0.00 57.85 53.89 1ri0 n ARG 6 Cb 0.58 -0.56 0.00 0.00 -1.05 0.00 0.00 32.46 31.43 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 -2.72 0.00 -0.07 2.89 0.00 -1.26 -4.85 117.38 111.37 1ri0 n GLN 7 Ca 0.17 0.00 0.02 0.00 0.00 0.00 0.00 57.00 57.19 1ri0 n GLN 7 Cb 0.60 0.00 0.06 0.00 0.00 0.00 0.00 30.24 30.90 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 1.32 -1.67 2.61 -0.00 -1.26 -4.90 118.16 114.27 1ri0 n LYS 8 Ca 0.00 -0.45 -0.45 0.00 -0.00 0.00 0.00 58.31 57.41 1ri0 n LYS 8 Cb 0.00 -1.15 -0.02 0.00 -0.00 0.00 0.00 35.03 33.86 1ri0 n LYS 8 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79 1ri0 n GLU 9 N -0.12 1.98 -3.87 -1.58 1.02 -1.26 -4.99 120.64 111.83 1ri0 n GLU 9 Ca 0.04 0.70 -0.09 0.00 -0.02 0.00 0.00 57.16 57.79 1ri0 n GLU 9 Cb 0.13 -2.33 -0.07 0.00 -0.02 0.00 0.00 31.44 29.15 1ri0 n GLU 9 CO 0.00 0.00 0.00 1.52 1.18 0.00 0.00 177.13 179.83 1ri0 s TYR 10 N -0.22 0.19 0.10 -0.32 -0.85 -1.26 -5.07 117.35 109.92 1ri0 s TYR 10 Ca 0.67 -0.59 -0.12 0.00 -0.52 0.00 0.00 57.07 56.51 1ri0 s TYR 10 Cb -0.65 -0.02 0.01 0.00 0.38 0.00 0.00 41.96 41.68 1ri0 s TYR 10 CO 0.52 -0.62 0.27 0.15 -1.52 0.00 0.00 175.55 174.35 1ri0 s LYS 11 N -3.89 0.92 0.04 -3.49 -0.14 -1.26 -5.06 119.74 106.86 1ri0 s LYS 11 Ca 0.09 -0.85 -0.38 0.00 -1.36 0.00 0.00 55.97 53.46 1ri0 s LYS 11 Cb 0.04 0.39 -0.18 0.00 -1.68 0.00 0.00 37.83 36.40 1ri0 s LYS 11 CO -0.08 -0.32 1.18 0.00 -0.76 0.00 0.00 175.35 175.37 1ri0 n GLY 13 N 1.95 0.80 3.85 0.00 0.00 -1.26 -5.06 105.19 105.47 1ri0 n GLY 13 Ca 0.19 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.89 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 -2.27 6.75 -0.01 1.61 -1.08 0.72 -4.92 116.67 117.47 1ri0 s ASP 14 Ca 0.00 1.22 0.08 0.00 -0.52 0.00 0.00 52.55 53.33 1ri0 s ASP 14 Cb 0.00 -2.35 -0.02 0.00 -1.46 0.00 0.00 42.92 39.09 1ri0 s ASP 14 CO 0.00 -0.19 -0.25 -0.22 0.52 0.00 0.00 175.17 175.04 1ri0 s LEU 15 N -2.97 2.16 0.30 -1.34 1.98 -1.26 -0.87 118.68 116.68 1ri0 s LEU 15 Ca 0.53 -0.46 -0.19 0.00 -2.89 0.00 0.00 54.13 51.13 1ri0 s LEU 15 Cb -0.10 -1.36 0.06 0.00 0.66 0.00 0.00 46.19 45.44 1ri0 s LEU 15 CO 0.18 0.31 0.86 0.68 -1.89 0.00 0.00 176.35 176.49 1ri0 s VAL 16 N -0.66 0.00 -0.39 1.68 -7.23 -1.01 -4.99 120.40 107.79 1ri0 s VAL 16 Ca 0.11 -0.86 -0.19 0.00 -1.81 0.00 0.00 61.98 59.22 1ri0 s VAL 16 Cb -0.10 -2.69 0.01 0.00 0.56 0.00 0.00 36.38 34.16 1ri0 s VAL 16 CO -0.00 0.00 0.58 -0.36 -0.31 0.00 0.00 175.10 175.01 1ri0 s PHE 17 N -2.57 3.13 -0.15 2.82 0.08 -0.96 -1.89 117.98 118.45 1ri0 s PHE 17 Ca 0.16 0.06 -0.06 0.00 0.12 0.00 0.00 56.93 57.21 1ri0 s PHE 17 Cb -0.04 -3.13 -0.04 0.00 -0.57 0.00 0.00 43.02 39.24 1ri0 s PHE 17 CO 0.08 -0.70 0.04 0.00 -0.10 0.00 0.00 175.22 174.54 1ri0 s ALA 18 N 2.59 3.36 -0.03 5.36 0.00 0.32 -0.28 121.76 133.09 1ri0 s ALA 18 Ca 0.21 -0.76 0.04 0.00 0.00 0.00 0.00 51.96 51.45 1ri0 s ALA 18 Cb -0.15 -1.78 -0.03 0.00 0.00 0.00 0.00 23.12 21.17 1ri0 s ALA 18 CO 0.16 0.31 -0.14 0.21 0.00 0.00 0.00 175.76 176.30 1ri0 s LYS 19 N -0.02 2.42 0.16 0.00 2.20 0.70 -1.17 119.74 124.03 1ri0 s LYS 19 Ca 0.05 -0.75 0.07 0.00 -0.36 0.00 0.00 55.97 54.98 1ri0 s LYS 19 Cb -0.12 -2.35 -0.04 0.00 -1.51 0.00 0.00 37.83 33.80 1ri0 s LYS 19 CO 0.01 0.61 -0.15 1.41 -0.36 0.00 0.00 175.35 176.87 1ri0 s MET 20 N -0.95 1.18 -0.05 4.03 1.75 -1.01 -4.80 119.30 119.45 1ri0 s MET 20 Ca 0.13 -1.40 -0.33 0.00 -1.25 0.00 0.00 55.69 52.84 1ri0 s MET 20 Cb -0.11 -1.07 -0.11 0.00 2.84 0.00 0.00 34.83 36.39 1ri0 s MET 20 CO 0.02 0.20 1.91 1.17 -0.65 0.00 0.00 175.02 177.67 1ri0 n LYS 21 N 0.17 2.40 0.00 4.11 3.00 -1.26 0.47 118.16 127.04 1ri0 n LYS 21 Ca -0.12 0.88 0.00 0.00 -0.00 0.00 0.00 58.31 59.07 1ri0 n LYS 21 Cb 0.58 -2.76 0.00 0.00 0.00 0.00 0.00 35.03 32.85 1ri0 n LYS 21 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1ri0 n GLY 22 N 4.44 2.89 3.54 3.14 0.00 -1.26 -4.99 105.19 112.95 1ri0 n GLY 22 Ca 0.22 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.90 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 -1.83 3.11 0.65 1.61 5.04 0.18 -5.10 117.35 121.00 1ri0 s TYR 23 Ca 0.00 -0.18 -0.13 0.00 -2.44 0.00 0.00 57.07 54.32 1ri0 s TYR 23 Cb 0.00 -2.02 -0.01 0.00 0.35 0.00 0.00 41.96 40.27 1ri0 s TYR 23 CO 0.00 0.00 1.05 -1.25 -1.34 0.00 0.00 175.55 174.02 1ri0 s PRO 24 N 0.47 3.14 -0.49 4.97 0.04 -1.26 -2.40 135.00 139.47 1ri0 s PRO 24 Ca -0.01 1.04 -0.45 0.00 0.04 0.00 0.00 61.00 61.62 1ri0 s PRO 24 Cb -0.14 -2.01 -0.19 0.00 0.04 0.00 0.00 34.50 32.20 1ri0 s PRO 24 CO 0.02 -0.94 1.64 0.72 0.04 0.00 0.00 177.00 178.48 1ri0 n HIS 25 N -2.64 1.62 -4.25 0.56 8.25 -1.26 -4.66 115.22 112.83 1ri0 n HIS 25 Ca 0.08 1.06 -0.18 0.00 -0.26 0.00 0.00 57.72 58.42 1ri0 n HIS 25 Cb 0.53 -2.18 -0.11 0.00 1.12 0.00 0.00 29.99 29.36 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 3.38 1.42 -0.57 4.41 -0.11 -0.32 -4.58 118.94 122.58 1ri0 s TRP 26 Ca 1.04 -0.56 -0.28 0.00 1.22 0.00 0.00 56.10 57.53 1ri0 s TRP 26 Cb -1.46 -0.74 0.01 0.00 -1.50 0.00 0.00 33.47 29.78 1ri0 s TRP 26 CO 0.77 0.16 1.51 -1.25 -4.62 0.00 0.00 176.95 173.52 1ri0 s PRO 27 N -2.76 3.18 0.12 5.86 0.04 -1.26 -0.53 135.00 139.65 1ri0 s PRO 27 Ca 0.10 0.49 0.11 0.00 0.04 0.00 0.00 61.00 61.74 1ri0 s PRO 27 Cb -0.04 -4.18 -0.04 0.00 0.04 0.00 0.00 34.50 30.28 1ri0 s PRO 27 CO 0.03 -2.09 -0.26 0.00 0.04 0.00 0.00 177.00 174.72 1ri0 s ALA 28 N 6.62 2.39 0.30 8.56 0.00 -0.79 -2.22 121.76 136.63 1ri0 s ALA 28 Ca 0.55 -1.45 0.03 0.00 0.00 0.00 0.00 51.96 51.10 1ri0 s ALA 28 Cb -0.12 -0.41 -0.03 0.00 0.00 0.00 0.00 23.12 22.57 1ri0 s ALA 28 CO 0.24 0.54 0.46 0.50 0.00 0.00 0.00 175.76 177.50 1ri0 s ARG 29 N -2.00 3.39 0.27 0.00 3.52 0.18 -2.42 118.95 121.89 1ri0 s ARG 29 Ca 0.14 -0.62 -0.27 0.00 -0.13 0.00 0.00 55.73 54.86 1ri0 s ARG 29 Cb -0.10 -2.78 -0.09 0.00 -1.56 0.00 0.00 34.95 30.42 1ri0 s ARG 29 CO 0.06 0.24 0.90 -1.50 -0.81 0.00 0.00 175.30 174.19 1ri0 s ILE 30 N -2.16 4.22 -0.03 4.11 -1.16 -0.05 -0.21 121.20 125.92 1ri0 s ILE 30 Ca 0.38 1.84 -0.19 0.00 -0.51 0.00 0.00 60.65 62.18 1ri0 s ILE 30 Cb -0.09 -4.11 0.04 0.00 0.61 0.00 0.00 42.46 38.90 1ri0 s ILE 30 CO 0.32 0.31 0.40 -1.81 -2.81 0.00 0.00 174.94 171.36 1ri0 s ASP 31 N -1.42 -0.32 0.04 4.50 1.11 0.11 -4.13 116.67 116.56 1ri0 s ASP 31 Ca 0.45 0.28 0.01 0.00 0.18 0.00 0.00 52.55 53.47 1ri0 s ASP 31 Cb -0.21 0.40 -0.04 0.00 1.07 0.00 0.00 42.92 44.14 1ri0 s ASP 31 CO 0.26 -0.46 0.10 -0.70 1.18 0.00 0.00 175.17 175.55 1ri0 s GLU 32 N -1.19 3.05 0.09 8.23 2.12 -1.26 -0.58 118.70 129.17 1ri0 s GLU 32 Ca -0.12 -0.56 -0.30 0.00 0.36 0.00 0.00 54.97 54.35 1ri0 s GLU 32 Cb -0.04 -2.84 -0.06 0.00 0.26 0.00 0.00 34.13 31.45 1ri0 s GLU 32 CO 0.05 0.61 1.21 0.00 -0.54 0.00 0.00 175.26 176.59 1ri0 s MET 33 N -2.11 4.44 0.93 4.30 0.23 -1.26 -4.78 119.30 121.05 1ri0 s MET 33 Ca 0.27 1.81 -0.13 0.00 -1.03 0.00 0.00 55.69 56.61 1ri0 s MET 33 Cb -0.12 -3.32 0.15 0.00 -1.53 0.00 0.00 34.83 30.01 1ri0 s MET 33 CO 0.19 -0.22 1.15 -1.25 -2.03 0.00 0.00 175.02 172.85 1ri0 s PRO 34 N 0.75 1.01 -0.16 3.16 0.04 -1.26 -4.89 135.00 133.66 1ri0 s PRO 34 Ca 0.58 0.24 0.14 0.00 0.04 0.00 0.00 61.00 62.00 1ri0 s PRO 34 Cb -0.31 -1.83 0.40 0.00 0.04 0.00 0.00 34.50 32.81 1ri0 s PRO 34 CO 0.31 -2.27 1.20 -0.85 0.04 0.00 0.00 177.00 175.42 1ri0 n GLU 35 N -3.81 1.22 -0.01 4.56 0.28 -1.25 -4.07 120.64 117.56 1ri0 n GLU 35 Ca 0.07 -2.95 -0.04 0.00 -0.16 0.00 0.00 57.16 54.09 1ri0 n GLU 35 Cb 0.59 -1.27 -0.01 0.00 1.43 0.00 0.00 31.44 32.18 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 -0.81 2.04 -0.14 -1.84 0.00 -1.26 -4.73 120.51 113.77 1ri0 n ALA 36 Ca 0.16 -0.34 -0.09 0.00 0.00 0.00 0.00 53.44 53.18 1ri0 n ALA 36 Cb 0.77 0.14 -0.00 0.00 0.00 0.00 0.00 19.45 20.36 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 -0.48 0.55 -2.46 0.00 0.00 -2.02 -3.45 119.26 111.39 1ri0 h ALA 37 Ca 0.00 -0.13 -0.46 0.00 0.00 0.00 0.00 54.91 54.32 1ri0 h ALA 37 Cb 0.40 -0.17 -0.13 0.00 0.00 0.00 0.00 17.79 17.89 1ri0 h ALA 37 CO 0.00 0.13 -0.52 0.14 0.00 0.00 0.00 179.25 179.00 1ri0 s VAL 38 N -5.62 0.21 -0.30 0.00 -7.23 -1.26 -5.13 120.40 101.07 1ri0 s VAL 38 Ca -0.13 -2.00 -0.10 0.00 -1.81 0.00 0.00 61.98 57.94 1ri0 s VAL 38 Cb 0.10 -2.47 -0.02 0.00 0.56 0.00 0.00 36.38 34.56 1ri0 s VAL 38 CO 0.75 0.00 0.17 -0.54 -0.31 0.00 0.00 175.10 175.17 1ri0 s LYS 39 N -3.65 3.57 0.23 4.82 1.02 -1.26 -3.96 119.74 120.50 1ri0 s LYS 39 Ca 0.35 -0.57 -0.28 0.00 0.02 0.00 0.00 55.97 55.50 1ri0 s LYS 39 Cb 0.03 -3.61 -0.17 0.00 -0.52 0.00 0.00 37.83 33.57 1ri0 s LYS 39 CO 0.21 -0.33 0.55 0.45 -0.92 0.00 0.00 175.35 175.31 1ri0 n SER 40 N 5.02 -1.05 -2.42 2.83 2.88 -1.26 -4.97 113.62 114.65 1ri0 n SER 40 Ca -0.14 1.11 -0.05 0.00 -1.33 0.00 0.00 58.87 58.46 1ri0 n SER 40 Cb 0.50 -0.99 -0.01 0.00 -0.75 0.00 0.00 64.21 62.97 1ri0 n SER 40 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 1ri0 n THR 41 N -0.05 0.00 -3.36 2.46 -2.24 -1.26 -5.14 114.28 104.70 1ri0 n THR 41 Ca 0.17 -0.38 -0.33 0.00 -2.27 0.00 0.00 64.05 61.24 1ri0 n THR 41 Cb 0.27 0.07 -0.06 0.00 -2.10 0.00 0.00 70.33 68.51 1ri0 n THR 41 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ri0 s ALA 42 N -2.14 3.53 -0.34 6.98 0.00 -1.26 -4.54 121.76 124.00 1ri0 s ALA 42 Ca 0.00 -0.18 -0.27 0.00 0.00 0.00 0.00 51.96 51.50 1ri0 s ALA 42 Cb -0.00 -2.51 0.04 0.00 0.00 0.00 0.00 23.12 20.65 1ri0 s ALA 42 CO 0.00 0.47 0.49 0.27 0.00 0.00 0.00 175.76 176.98 1ri0 n ASN 43 N 0.08 -5.99 -3.54 0.00 6.94 -1.26 -4.99 115.26 106.49 1ri0 n ASN 43 Ca -0.01 0.07 -0.01 0.00 -0.02 0.00 0.00 54.58 54.61 1ri0 n ASN 43 Cb 0.52 -1.99 -0.04 0.00 -2.36 0.00 0.00 39.78 35.91 1ri0 n ASN 43 CO 0.00 0.00 0.00 -0.54 -1.03 0.00 0.00 177.26 175.69 1ri0 s LYS 44 N -2.09 0.54 -0.11 -3.83 -0.14 -1.26 -5.05 119.74 107.80 1ri0 s LYS 44 Ca 0.28 1.30 0.03 0.00 -1.36 0.00 0.00 55.97 56.21 1ri0 s LYS 44 Cb -0.03 0.72 0.01 0.00 -1.68 0.00 0.00 37.83 36.84 1ri0 s LYS 44 CO 0.66 -0.30 -0.20 -0.47 -0.76 0.00 0.00 175.35 174.27 1ri0 s TYR 45 N 2.85 2.36 0.08 3.18 5.04 -0.74 -4.72 117.35 125.39 1ri0 s TYR 45 Ca 0.00 -1.06 -0.30 0.00 -2.44 0.00 0.00 57.07 53.27 1ri0 s TYR 45 Cb -0.13 -1.62 -0.05 0.00 0.35 0.00 0.00 41.96 40.52 1ri0 s TYR 45 CO -0.19 -0.48 0.96 -1.14 -1.34 0.00 0.00 175.55 173.37 1ri0 s GLN 46 N 0.65 4.65 -0.04 4.97 0.74 0.25 -1.01 119.66 129.88 1ri0 s GLN 46 Ca -0.12 1.43 0.06 0.00 0.05 0.00 0.00 55.36 56.77 1ri0 s GLN 46 Cb -0.16 -3.40 -0.01 0.00 1.10 0.00 0.00 33.01 30.54 1ri0 s GLN 46 CO 0.03 0.14 -0.22 0.54 -0.55 0.00 0.00 175.29 175.23 1ri0 s VAL 47 N 0.27 1.81 -0.45 1.34 0.11 -0.52 0.06 120.40 123.02 1ri0 s VAL 47 Ca 0.48 -0.94 -0.05 0.00 -2.93 0.00 0.00 61.98 58.53 1ri0 s VAL 47 Cb -0.23 -1.53 0.12 0.00 -1.53 0.00 0.00 36.38 33.21 1ri0 s VAL 47 CO 0.29 0.51 0.28 0.12 -3.33 0.00 0.00 175.10 172.97 1ri0 s PHE 48 N -0.20 3.52 -0.04 1.54 2.19 0.70 -0.21 117.98 125.48 1ri0 s PHE 48 Ca -0.01 -2.24 -0.30 0.00 0.33 0.00 0.00 56.93 54.72 1ri0 s PHE 48 Cb -0.12 -3.33 -0.04 0.00 -1.31 0.00 0.00 43.02 38.22 1ri0 s PHE 48 CO 0.02 -0.97 1.27 -0.06 1.83 0.00 0.00 175.22 177.31 1ri0 s PHE 49 N 1.13 3.05 -0.12 10.12 0.40 0.11 0.47 117.98 133.13 1ri0 s PHE 49 Ca 0.08 1.06 -0.17 0.00 -0.60 0.00 0.00 56.93 57.30 1ri0 s PHE 49 Cb -0.24 -3.51 -0.16 0.00 0.51 0.00 0.00 43.02 39.63 1ri0 s PHE 49 CO -0.03 -1.74 0.45 0.74 0.70 0.00 0.00 175.22 175.35 1ri0 h PHE 50 N 7.65 0.00 -0.95 0.36 0.04 -1.71 0.11 116.94 122.44 1ri0 h PHE 50 Ca -0.35 0.00 0.13 0.00 2.80 0.00 0.00 57.97 60.55 1ri0 h PHE 50 Cb 1.16 0.00 -0.14 0.00 2.20 0.00 0.00 35.95 39.17 1ri0 h PHE 50 CO 0.74 0.60 -0.44 0.41 -0.60 0.00 0.00 178.31 179.03 1ri0 n GLY 51 N 1.68 -2.14 0.10 -1.45 0.00 -1.26 0.35 105.19 102.48 1ri0 n GLY 51 Ca -0.06 1.09 -0.02 0.00 0.00 0.00 0.00 46.02 47.03 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 1.06 -2.30 2.61 1.35 -1.87 -3.46 112.91 110.30 1ri0 h THR 52 Ca 0.27 -2.58 -0.13 0.00 -0.55 0.00 0.00 66.41 63.42 1ri0 h THR 52 Cb 0.51 2.49 0.04 0.00 -1.73 0.00 0.00 68.15 69.45 1ri0 h THR 52 CO -0.93 0.60 -0.21 1.57 -0.25 0.00 0.00 175.52 176.30 1ri0 n HIS 53 N -3.19 -0.83 -4.13 4.73 -0.00 0.16 -5.04 115.22 106.91 1ri0 n HIS 53 Ca -0.02 0.27 -0.09 0.00 0.46 0.00 0.00 57.72 58.35 1ri0 n HIS 53 Cb 0.84 -2.25 -0.10 0.00 -0.12 0.00 0.00 29.99 28.36 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 -5.25 0.76 0.43 1.57 2.02 -0.16 -4.98 118.70 113.10 1ri0 s GLU 54 Ca 0.16 -1.31 0.01 0.00 0.02 0.00 0.00 54.97 53.85 1ri0 s GLU 54 Cb -0.07 0.09 -0.00 0.00 0.10 0.00 0.00 34.13 34.24 1ri0 s GLU 54 CO 0.20 -0.12 0.64 0.99 0.02 0.00 0.00 175.26 176.98 1ri0 s THR 55 N -3.86 4.02 0.39 3.63 2.01 -1.26 0.05 115.64 120.62 1ri0 s THR 55 Ca 0.13 -0.58 -0.15 0.00 0.31 0.00 0.00 61.69 61.40 1ri0 s THR 55 Cb 0.07 -3.47 0.06 0.00 0.01 0.00 0.00 72.50 69.17 1ri0 s THR 55 CO -0.05 -0.31 0.79 0.00 -0.69 0.00 0.00 174.62 174.36 1ri0 n ALA 56 N -2.00 -1.76 -3.92 7.40 0.00 0.71 -4.88 120.51 116.06 1ri0 n ALA 56 Ca 0.01 -1.27 -0.33 0.00 0.00 0.00 0.00 53.44 51.85 1ri0 n ALA 56 Cb 0.58 1.01 -0.15 0.00 0.00 0.00 0.00 19.45 20.89 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 -2.19 3.27 0.38 0.00 -0.71 -1.26 -1.44 117.98 116.02 1ri0 s PHE 57 Ca 0.16 -2.17 0.06 0.00 -1.04 0.00 0.00 56.93 53.94 1ri0 s PHE 57 Cb -0.05 -2.01 -0.02 0.00 -1.21 0.00 0.00 43.02 39.73 1ri0 s PHE 57 CO 0.12 -0.85 0.23 -0.51 -1.34 0.00 0.00 175.22 172.86 1ri0 s LEU 58 N 1.15 1.87 0.00 -1.99 1.43 -0.18 -4.97 118.68 115.99 1ri0 s LEU 58 Ca -0.07 -1.77 0.00 0.00 -1.03 0.00 0.00 54.13 51.26 1ri0 s LEU 58 Cb -0.20 0.31 0.00 0.00 0.03 0.00 0.00 46.19 46.33 1ri0 s LEU 58 CO -0.04 -1.04 0.00 0.61 0.23 0.00 0.00 176.35 176.11 1ri0 n GLY 59 N -0.78 6.83 0.19 -3.19 0.00 -1.26 -1.79 105.19 105.18 1ri0 n GLY 59 Ca 0.02 -1.89 -0.18 0.00 0.00 0.00 0.00 46.02 43.97 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 0.63 -0.45 1.61 0.13 -1.96 -3.17 132.00 128.79 1ri0 h PRO 60 Ca 0.00 -0.61 0.02 0.00 -0.87 0.00 0.00 66.00 64.54 1ri0 h PRO 60 Cb 0.00 0.16 -0.03 0.00 0.13 0.00 0.00 31.00 31.26 1ri0 h PRO 60 CO 0.00 1.22 0.26 0.87 -0.23 0.00 0.00 178.00 180.12 1ri0 h LYS 61 N 0.27 0.51 0.00 0.86 1.79 -2.00 0.23 116.57 118.23 1ri0 h LYS 61 Ca -0.09 -0.03 0.00 0.00 -2.18 0.00 0.00 60.65 58.35 1ri0 h LYS 61 Cb 1.47 -0.12 0.00 0.00 -1.58 0.00 0.00 32.23 32.00 1ri0 h LYS 61 CO 0.16 0.34 0.03 -0.44 -1.08 0.00 0.00 179.45 178.46 1ri0 h ASP 62 N 0.53 0.00 -3.30 0.86 3.32 -1.87 -3.39 116.42 112.57 1ri0 h ASP 62 Ca 0.18 0.00 -0.67 0.00 0.02 0.00 0.00 57.03 56.57 1ri0 h ASP 62 Cb 0.02 0.00 -0.16 0.00 0.22 0.00 0.00 39.33 39.42 1ri0 h ASP 62 CO -0.09 0.00 -0.62 -0.22 -1.72 0.00 0.00 179.24 176.59 1ri0 s LEU 63 N -4.82 3.58 0.03 1.55 2.96 0.79 -0.21 118.68 122.56 1ri0 s LEU 63 Ca -0.03 0.10 0.04 0.00 -0.22 0.00 0.00 54.13 54.03 1ri0 s LEU 63 Cb 0.07 -1.84 -0.02 0.00 0.50 0.00 0.00 46.19 44.91 1ri0 s LEU 63 CO 0.23 0.32 -0.13 -0.36 -1.32 0.00 0.00 176.35 175.10 1ri0 s PHE 64 N -0.55 1.14 0.60 5.38 0.40 0.62 -4.88 117.98 120.70 1ri0 s PHE 64 Ca 0.09 -0.31 -0.15 0.00 -0.60 0.00 0.00 56.93 55.96 1ri0 s PHE 64 Cb -0.12 -0.69 -0.03 0.00 0.51 0.00 0.00 43.02 42.69 1ri0 s PHE 64 CO 0.02 0.01 1.05 -1.25 0.70 0.00 0.00 175.22 175.76 1ri0 s PRO 65 N -0.90 3.32 0.08 0.24 0.04 -1.26 -2.26 135.00 134.25 1ri0 s PRO 65 Ca 0.02 1.13 -0.09 0.00 0.04 0.00 0.00 61.00 62.10 1ri0 s PRO 65 Cb -0.07 -2.04 -0.23 0.00 0.04 0.00 0.00 34.50 32.21 1ri0 s PRO 65 CO 0.01 -0.81 1.17 -0.92 0.04 0.00 0.00 177.00 176.49 1ri0 h TYR 66 N 0.27 0.76 -0.20 0.56 3.20 -1.97 -2.30 116.97 117.29 1ri0 h TYR 66 Ca -0.46 -0.48 0.05 0.00 3.14 0.00 0.00 58.73 60.97 1ri0 h TYR 66 Cb 1.21 -0.06 -0.05 0.00 1.54 0.00 0.00 36.73 39.38 1ri0 h TYR 66 CO 0.60 1.33 -0.09 0.93 -1.64 0.00 0.00 178.16 179.29 1ri0 h GLU 67 N 0.21 -0.06 -0.20 1.82 5.08 -1.97 1.30 114.58 120.76 1ri0 h GLU 67 Ca -0.14 0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 58.17 1ri0 h GLU 67 Cb 1.84 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 31.09 1ri0 h GLU 67 CO 0.21 -0.04 -0.08 1.49 -1.00 0.00 0.00 179.01 179.59 1ri0 h GLU 68 N -0.06 0.41 -0.13 2.33 4.22 -1.98 -0.42 114.58 118.95 1ri0 h GLU 68 Ca 0.11 -0.17 0.02 0.00 0.08 0.00 0.00 59.36 59.40 1ri0 h GLU 68 Cb 0.23 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.44 1ri0 h GLU 68 CO -0.25 0.69 0.01 0.66 -2.18 0.00 0.00 179.01 177.94 1ri0 h SER 69 N 0.12 -0.02 0.64 1.04 4.64 -0.98 0.59 113.55 119.57 1ri0 h SER 69 Ca 0.05 0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.39 1ri0 h SER 69 Cb 0.55 0.04 0.00 0.00 -0.31 0.00 0.00 62.40 62.68 1ri0 h SER 69 CO 0.03 0.01 0.00 0.07 -0.87 0.00 0.00 176.83 176.06 1ri0 h LYS 70 N 0.06 0.00 -0.25 4.77 2.10 0.17 0.69 116.57 124.11 1ri0 h LYS 70 Ca 0.06 0.00 -0.10 0.00 -2.00 0.00 0.00 60.65 58.61 1ri0 h LYS 70 Cb 0.06 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 31.39 1ri0 h LYS 70 CO -0.09 0.00 -0.23 1.49 -2.00 0.00 0.00 179.45 178.61 1ri0 h GLU 71 N 0.00 0.59 0.00 0.07 4.81 0.87 -3.41 114.58 117.51 1ri0 h GLU 71 Ca 0.00 -0.31 0.00 0.00 -0.13 0.00 0.00 59.36 58.92 1ri0 h GLU 71 Cb 0.32 0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.71 1ri0 h GLU 71 CO 0.00 0.90 -0.03 0.36 -0.73 0.00 0.00 179.01 179.52 1ri0 n LYS 72 N -4.36 0.01 0.00 1.92 2.85 -0.84 -5.08 118.16 112.66 1ri0 n LYS 72 Ca -0.04 0.01 0.00 0.00 -1.05 0.00 0.00 58.31 57.22 1ri0 n LYS 72 Cb 0.43 -0.36 0.00 0.00 -0.65 0.00 0.00 35.03 34.45 1ri0 n LYS 72 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 177.40 178.54 1ri0 n PHE 73 N -2.56 0.00 -1.03 5.58 3.01 0.23 -5.00 117.46 117.68 1ri0 n PHE 73 Ca -0.00 0.00 -0.01 0.00 1.01 0.00 0.00 57.45 58.45 1ri0 n PHE 73 Cb 0.01 0.00 -0.00 0.00 -0.01 0.00 0.00 39.48 39.48 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 1.88 0.35 3.10 1.37 0.00 -0.37 -3.86 105.19 107.66 1ri0 n GLY 74 Ca 0.00 -0.06 -0.36 0.00 0.00 0.00 0.00 46.02 45.60 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 -1.17 2.31 1.03 1.61 1.02 -1.26 -4.87 119.74 118.41 1ri0 s LYS 75 Ca 0.00 -2.23 -0.16 0.00 0.02 0.00 0.00 55.97 53.60 1ri0 s LYS 75 Cb 0.00 -3.66 0.21 0.00 -0.52 0.00 0.00 37.83 33.86 1ri0 s LYS 75 CO 0.00 -1.13 1.19 -1.25 -0.92 0.00 0.00 175.35 173.24 1ri0 s PRO 76 N 0.45 0.18 0.17 -1.68 0.04 -1.26 -4.93 135.00 127.97 1ri0 s PRO 76 Ca 0.13 -0.06 -0.33 0.00 0.04 0.00 0.00 61.00 60.79 1ri0 s PRO 76 Cb -0.22 -1.76 -0.15 0.00 0.04 0.00 0.00 34.50 32.41 1ri0 s PRO 76 CO -0.04 -2.78 1.22 0.09 0.04 0.00 0.00 177.00 175.54 1ri0 n ASN 77 N -4.10 1.58 -4.47 6.66 3.02 -1.26 -4.85 115.26 111.84 1ri0 n ASN 77 Ca 0.12 1.14 -0.43 0.00 -0.03 0.00 0.00 54.58 55.37 1ri0 n ASN 77 Cb 0.59 -1.24 -0.03 0.00 -0.61 0.00 0.00 39.78 38.49 1ri0 n ASN 77 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1ri0 s LYS 78 N -0.25 3.55 0.32 3.52 -0.14 -1.26 -4.86 119.74 120.62 1ri0 s LYS 78 Ca 0.74 -1.56 0.05 0.00 -1.36 0.00 0.00 55.97 53.84 1ri0 s LYS 78 Cb -0.84 -4.94 0.05 0.00 -1.68 0.00 0.00 37.83 30.43 1ri0 s LYS 78 CO 0.51 -1.86 0.42 0.54 -0.76 0.00 0.00 175.35 174.20 1ri0 n ARG 79 N 7.09 0.81 -0.10 1.68 5.12 -1.26 -4.97 116.66 125.04 1ri0 n ARG 79 Ca 0.23 -1.77 -0.12 0.00 -1.93 0.00 0.00 57.85 54.26 1ri0 n ARG 79 Cb 0.49 -0.09 -0.04 0.00 -1.16 0.00 0.00 32.46 31.66 1ri0 n ARG 79 CO 0.00 0.00 0.00 -0.22 -1.93 0.00 0.00 177.63 175.48 1ri0 h LYS 80 N 0.00 0.59 0.00 5.56 3.64 -2.01 -2.37 116.57 121.99 1ri0 h LYS 80 Ca -0.16 -0.26 0.00 0.00 -1.27 0.00 0.00 60.65 58.96 1ri0 h LYS 80 Cb 0.70 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.50 1ri0 h LYS 80 CO 0.23 0.84 0.00 0.41 -2.27 0.00 0.00 179.45 178.65 1ri0 n GLY 81 N -0.02 -1.13 0.09 5.01 0.00 -1.26 -2.52 105.19 105.36 1ri0 n GLY 81 Ca -0.03 -0.08 -0.18 0.00 0.00 0.00 0.00 46.02 45.73 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 0.20 0.27 1.61 3.04 -1.77 -0.49 116.94 119.80 1ri0 h PHE 82 Ca 0.00 -0.15 -0.01 0.00 3.98 0.00 0.00 57.97 61.79 1ri0 h PHE 82 Cb 0.30 -0.01 0.00 0.00 2.56 0.00 0.00 35.95 38.81 1ri0 h PHE 82 CO 0.00 1.23 -0.13 1.03 -2.02 0.00 0.00 178.31 178.41 1ri0 h SER 83 N -0.75 -0.31 0.41 0.41 0.87 -1.41 0.64 113.55 113.41 1ri0 h SER 83 Ca -0.13 -0.19 -0.09 0.00 -1.23 0.00 0.00 61.79 60.14 1ri0 h SER 83 Cb 1.31 0.08 -0.01 0.00 -0.44 0.00 0.00 62.40 63.34 1ri0 h SER 83 CO 0.02 0.06 -0.43 1.05 -0.53 0.00 0.00 176.83 176.99 1ri0 h GLU 84 N -0.72 0.03 0.48 2.24 4.11 -1.67 -2.12 114.58 116.94 1ri0 h GLU 84 Ca -0.04 -0.01 -0.02 0.00 0.07 0.00 0.00 59.36 59.36 1ri0 h GLU 84 Cb 0.49 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.74 1ri0 h GLU 84 CO 0.06 0.45 -0.23 0.78 0.07 0.00 0.00 179.01 180.14 1ri0 h GLY 85 N 1.28 -0.68 1.69 1.06 0.00 -1.00 1.07 103.07 106.50 1ri0 h GLY 85 Ca -0.00 0.25 0.04 0.00 0.00 0.00 0.00 47.33 47.62 1ri0 h GLY 85 CO 0.06 -0.25 0.12 -2.00 0.00 0.00 0.00 176.54 174.47 1ri0 h LEU 86 N -0.98 0.00 0.00 3.11 7.12 -0.86 0.62 115.31 124.32 1ri0 h LEU 86 Ca -0.07 0.00 -0.05 0.00 0.13 0.00 0.00 57.88 57.89 1ri0 h LEU 86 Cb 0.59 0.00 -0.01 0.00 -0.53 0.00 0.00 40.66 40.71 1ri0 h LEU 86 CO 0.11 0.00 -0.80 -0.25 -0.13 0.00 0.00 178.44 177.37 1ri0 h TRP 87 N 0.00 0.00 0.00 1.25 2.91 -1.17 -1.58 115.95 117.36 1ri0 h TRP 87 Ca 0.06 0.00 -0.04 0.00 1.13 0.00 0.00 58.89 60.04 1ri0 h TRP 87 Cb 0.30 0.00 -0.01 0.00 -0.51 0.00 0.00 29.16 28.94 1ri0 h TRP 87 CO 0.00 0.19 -0.20 0.93 -1.03 0.00 0.00 178.44 178.33 1ri0 h GLU 88 N 0.00 0.00 0.00 2.65 4.39 0.69 1.44 114.58 123.76 1ri0 h GLU 88 Ca -0.04 0.00 -0.40 0.00 0.34 0.00 0.00 59.36 59.27 1ri0 h GLU 88 Cb 1.18 0.00 -0.07 0.00 -0.10 0.00 0.00 28.75 29.76 1ri0 h GLU 88 CO 0.02 0.20 -2.47 1.51 -1.16 0.00 0.00 179.01 177.12 1ri0 n ILE 89 N -3.36 1.50 0.11 3.13 0.00 -0.67 -2.95 119.36 117.14 1ri0 n ILE 89 Ca 0.00 -0.55 -0.02 0.00 0.00 0.00 0.00 62.75 62.19 1ri0 n ILE 89 Cb 0.43 -1.48 0.03 0.00 0.00 0.00 0.00 39.64 38.62 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 -0.11 0.00 -1.96 9.51 5.08 -1.29 -3.34 114.58 122.46 1ri0 h GLU 90 Ca -0.59 0.00 -0.50 0.00 -1.00 0.00 0.00 59.36 57.27 1ri0 h GLU 90 Cb 1.87 0.00 -0.41 0.00 0.50 0.00 0.00 28.75 30.72 1ri0 h GLU 90 CO -0.12 0.71 -1.04 0.09 -1.00 0.00 0.00 179.01 177.65 1ri0 n ASN 91 N -3.41 2.00 -4.72 1.42 3.02 0.49 -5.02 115.26 109.03 1ri0 n ASN 91 Ca 0.00 -3.19 -0.33 0.00 -0.03 0.00 0.00 54.58 51.04 1ri0 n ASN 91 Cb 0.77 -0.59 0.10 0.00 -0.61 0.00 0.00 39.78 39.45 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 -2.81 4.08 0.49 6.41 2.20 -1.15 -4.48 114.94 119.68 1ri0 s ASN 92 Ca 0.41 2.20 0.28 0.00 -0.94 0.00 0.00 52.86 54.82 1ri0 s ASN 92 Cb 0.34 -2.57 0.87 0.00 -2.00 0.00 0.00 41.25 37.89 1ri0 s ASN 92 CO -0.09 -2.33 1.80 1.55 -2.94 0.00 0.00 177.10 175.09 1ri0 h PRO 93 N -0.70 0.00 -2.69 3.55 0.13 -1.92 -3.38 132.00 126.98 1ri0 h PRO 93 Ca -0.46 0.00 -0.57 0.00 -0.87 0.00 0.00 66.00 64.10 1ri0 h PRO 93 Cb 1.27 0.00 -0.39 0.00 0.13 0.00 0.00 31.00 32.01 1ri0 h PRO 93 CO 0.49 0.01 -0.82 -0.08 -0.23 0.00 0.00 178.00 177.37 1ri0 s THR 94 N -3.45 0.26 0.04 1.56 -1.32 -1.26 -5.12 115.64 106.34 1ri0 s THR 94 Ca 0.04 -1.62 -0.12 0.00 -1.21 0.00 0.00 61.69 58.78 1ri0 s THR 94 Cb 0.07 -1.20 -0.06 0.00 -1.51 0.00 0.00 72.50 69.80 1ri0 s THR 94 CO 0.61 -0.92 0.39 0.54 -2.21 0.00 0.00 174.62 173.02 1ri0 s VAL 95 N 1.19 5.09 -0.11 5.08 0.11 -1.26 -4.98 120.40 125.52 1ri0 s VAL 95 Ca 0.16 0.59 0.01 0.00 -2.93 0.00 0.00 61.98 59.82 1ri0 s VAL 95 Cb -0.22 -3.66 -0.07 0.00 -1.53 0.00 0.00 36.38 30.90 1ri0 s VAL 95 CO -0.06 0.43 -0.09 2.29 -3.33 0.00 0.00 175.10 174.33 1ri0 n LYS 96 N 1.34 0.39 -0.61 1.54 2.85 -1.26 -5.03 118.16 117.38 1ri0 n LYS 96 Ca -0.11 0.06 -0.29 0.00 -1.05 0.00 0.00 58.31 56.92 1ri0 n LYS 96 Cb 0.52 -1.22 0.23 0.00 -0.65 0.00 0.00 35.03 33.91 1ri0 n LYS 96 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1ri0 s ALA 97 N -2.22 0.06 -0.14 0.58 0.00 -1.26 -5.05 121.76 113.72 1ri0 s ALA 97 Ca -0.14 0.04 -0.12 0.00 0.00 0.00 0.00 51.96 51.74 1ri0 s ALA 97 Cb 0.04 -3.29 0.04 0.00 0.00 0.00 0.00 23.12 19.90 1ri0 s ALA 97 CO 0.26 -3.54 0.38 -1.12 0.00 0.00 0.00 175.76 171.74 1ri0 s SER 98 N -2.59 -0.40 0.00 0.00 0.01 -1.26 -5.08 113.70 104.37 1ri0 s SER 98 Ca 0.68 0.77 0.00 0.00 1.31 0.00 0.00 55.95 58.71 1ri0 s SER 98 Cb -0.24 0.76 0.00 0.00 0.21 0.00 0.00 66.02 66.75 1ri0 s SER 98 CO 0.63 -0.14 0.00 0.61 0.41 0.00 0.00 173.24 174.75 1ri0 n GLY 99 N 3.10 0.77 0.19 3.44 0.00 -1.26 -5.32 105.19 106.10 1ri0 n GLY 99 Ca -0.15 -0.64 0.02 0.00 0.00 0.00 0.00 46.02 45.26 1ri0 n GLY 99 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60