#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 -0.45 0.45 7.83 1.04 -1.26 -5.11 113.70 116.21 1ri0 s SER 2 Ca 0.00 0.01 -0.17 0.00 0.48 0.00 0.00 55.95 56.27 1ri0 s SER 2 Cb 0.00 0.47 -0.14 0.00 0.10 0.00 0.00 66.02 66.45 1ri0 s SER 2 CO 0.00 -0.76 -0.08 -2.11 0.98 0.00 0.00 173.24 171.27 1ri0 n ARG 3 N -0.27 0.00 -4.17 4.02 0.00 -1.26 -4.97 116.66 110.01 1ri0 n ARG 3 Ca -0.12 0.00 -0.23 0.00 -0.00 0.00 0.00 57.85 57.50 1ri0 n ARG 3 Cb 0.63 -0.94 -0.07 0.00 -0.00 0.00 0.00 32.46 32.09 1ri0 n ARG 3 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08 1ri0 s SER 4 N -0.94 4.65 1.09 2.89 0.15 -1.26 -5.04 113.70 115.24 1ri0 s SER 4 Ca 0.54 -0.73 -0.18 0.00 0.70 0.00 0.00 55.95 56.28 1ri0 s SER 4 Cb -0.49 -0.78 0.26 0.00 -1.71 0.00 0.00 66.02 63.30 1ri0 s SER 4 CO 0.61 -0.20 1.25 0.54 1.20 0.00 0.00 173.24 176.64 1ri0 s ASN 5 N -3.79 1.93 0.87 5.45 4.22 -1.26 -4.60 114.94 117.77 1ri0 s ASN 5 Ca 0.36 0.33 -0.08 0.00 -2.14 0.00 0.00 52.86 51.32 1ri0 s ASN 5 Cb -0.04 -0.38 0.19 0.00 1.28 0.00 0.00 41.25 42.30 1ri0 s ASN 5 CO 0.22 -3.47 1.18 -2.11 -2.04 0.00 0.00 177.10 170.88 1ri0 n ARG 6 N -4.27 -0.72 -0.02 3.55 0.00 -1.26 -5.04 116.66 108.89 1ri0 n ARG 6 Ca 0.16 -2.43 -0.04 0.00 -0.00 0.00 0.00 57.85 55.54 1ri0 n ARG 6 Cb 0.59 -1.03 -0.02 0.00 -0.00 0.00 0.00 32.46 32.00 1ri0 n ARG 6 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1ri0 n GLN 7 N -3.36 0.12 0.00 2.89 0.00 -1.26 -4.96 117.38 110.80 1ri0 n GLN 7 Ca 0.17 0.04 0.00 0.00 0.00 0.00 0.00 57.00 57.20 1ri0 n GLN 7 Cb 0.59 -0.94 0.00 0.00 0.00 0.00 0.00 30.24 29.89 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 -2.86 0.00 -5.21 2.61 -0.00 -1.26 -5.10 118.16 106.35 1ri0 n LYS 8 Ca -0.09 0.00 -0.31 0.00 -0.00 0.00 0.00 58.31 57.91 1ri0 n LYS 8 Cb 0.58 -0.45 -0.16 0.00 -0.00 0.00 0.00 35.03 35.01 1ri0 n LYS 8 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.40 175.57 1ri0 s GLU 9 N -1.00 2.09 -0.28 -1.58 -1.05 -1.26 -5.11 118.70 110.51 1ri0 s GLU 9 Ca 0.00 -0.94 -0.01 0.00 -0.15 0.00 0.00 54.97 53.87 1ri0 s GLU 9 Cb 0.00 -2.06 0.04 0.00 -0.44 0.00 0.00 34.13 31.67 1ri0 s GLU 9 CO 0.00 0.56 -0.03 1.52 0.95 0.00 0.00 175.26 178.26 1ri0 s TYR 10 N -0.65 3.20 0.51 4.83 1.13 -1.26 -4.76 117.35 120.35 1ri0 s TYR 10 Ca 0.10 -1.82 0.01 0.00 -1.41 0.00 0.00 57.07 53.95 1ri0 s TYR 10 Cb -0.10 -2.07 -0.00 0.00 -1.10 0.00 0.00 41.96 38.68 1ri0 s TYR 10 CO -0.00 -0.79 0.02 0.36 -2.51 0.00 0.00 175.55 172.63 1ri0 n LYS 11 N 4.62 0.70 -1.47 -3.49 2.85 -1.26 -4.99 118.16 115.12 1ri0 n LYS 11 Ca -0.14 -3.81 -0.52 0.00 -1.05 0.00 0.00 58.31 52.79 1ri0 n LYS 11 Cb 0.44 1.17 -0.05 0.00 -0.65 0.00 0.00 35.03 35.94 1ri0 n LYS 11 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1ri0 n GLY 13 N 1.80 0.62 3.63 0.00 0.00 -1.25 -5.05 105.19 104.94 1ri0 n GLY 13 Ca 0.18 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.85 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 -2.88 5.74 -0.05 1.61 2.15 -0.22 -4.85 116.67 118.16 1ri0 s ASP 14 Ca 0.00 0.07 -0.08 0.00 0.43 0.00 0.00 52.55 52.97 1ri0 s ASP 14 Cb 0.00 -2.00 -0.05 0.00 -0.30 0.00 0.00 42.92 40.57 1ri0 s ASP 14 CO 0.00 0.12 0.23 -0.22 -0.17 0.00 0.00 175.17 175.13 1ri0 s LEU 15 N 0.69 4.40 0.40 -1.34 1.98 -1.26 -0.90 118.68 122.64 1ri0 s LEU 15 Ca 0.05 0.58 -0.15 0.00 -2.89 0.00 0.00 54.13 51.72 1ri0 s LEU 15 Cb -0.13 -2.38 0.06 0.00 0.66 0.00 0.00 46.19 44.40 1ri0 s LEU 15 CO 0.02 0.34 0.80 0.68 -1.89 0.00 0.00 176.35 176.29 1ri0 s VAL 16 N -1.14 0.00 -0.46 1.68 -7.23 -0.87 -4.86 120.40 107.52 1ri0 s VAL 16 Ca 0.21 -1.00 -0.21 0.00 -1.81 0.00 0.00 61.98 59.16 1ri0 s VAL 16 Cb -0.13 -2.97 0.03 0.00 0.56 0.00 0.00 36.38 33.87 1ri0 s VAL 16 CO 0.10 0.00 0.71 -0.36 -0.31 0.00 0.00 175.10 175.24 1ri0 s PHE 17 N -2.15 3.01 -0.15 2.82 0.40 -0.91 -1.90 117.98 119.11 1ri0 s PHE 17 Ca 0.16 -0.07 -0.01 0.00 -0.60 0.00 0.00 56.93 56.41 1ri0 s PHE 17 Cb -0.05 -3.53 -0.01 0.00 0.51 0.00 0.00 43.02 39.93 1ri0 s PHE 17 CO 0.12 -0.98 -0.11 0.00 0.70 0.00 0.00 175.22 174.95 1ri0 s ALA 18 N 3.03 2.69 0.30 5.36 0.00 0.46 -0.75 121.76 132.85 1ri0 s ALA 18 Ca 0.24 -0.93 0.08 0.00 0.00 0.00 0.00 51.96 51.35 1ri0 s ALA 18 Cb -0.14 -1.32 -0.03 0.00 0.00 0.00 0.00 23.12 21.62 1ri0 s ALA 18 CO 0.19 0.13 0.19 -1.59 0.00 0.00 0.00 175.76 174.68 1ri0 s LYS 19 N 0.53 2.64 0.19 0.00 -2.85 -0.47 -1.72 119.74 118.06 1ri0 s LYS 19 Ca -0.07 -1.30 0.03 0.00 -1.00 0.00 0.00 55.97 53.63 1ri0 s LYS 19 Cb -0.15 -2.39 -0.05 0.00 -2.06 0.00 0.00 37.83 33.18 1ri0 s LYS 19 CO 0.04 0.22 -0.03 1.41 0.10 0.00 0.00 175.35 177.08 1ri0 s MET 20 N -3.88 1.19 -0.09 1.78 1.75 -0.99 -4.85 119.30 114.21 1ri0 s MET 20 Ca 0.37 -1.57 -0.32 0.00 -1.25 0.00 0.00 55.69 52.91 1ri0 s MET 20 Cb -0.06 -0.52 -0.10 0.00 2.84 0.00 0.00 34.83 36.99 1ri0 s MET 20 CO 0.24 -0.05 1.98 1.17 -0.65 0.00 0.00 175.02 177.70 1ri0 n LYS 21 N -0.30 2.25 0.00 4.11 3.00 -1.26 0.45 118.16 126.41 1ri0 n LYS 21 Ca -0.07 0.79 0.00 0.00 -0.00 0.00 0.00 58.31 59.03 1ri0 n LYS 21 Cb 0.63 -2.80 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 4.79 3.05 3.72 3.14 0.00 -1.26 -4.99 105.19 113.63 1ri0 n GLY 22 Ca 0.24 0.00 -0.35 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 -1.67 3.34 0.64 1.61 5.04 0.17 -5.10 117.35 121.38 1ri0 s TYR 23 Ca 0.00 0.24 -0.13 0.00 -2.44 0.00 0.00 57.07 54.74 1ri0 s TYR 23 Cb 0.00 -1.99 -0.02 0.00 0.35 0.00 0.00 41.96 40.30 1ri0 s TYR 23 CO 0.00 0.38 1.05 -1.25 -1.34 0.00 0.00 175.55 174.39 1ri0 s PRO 24 N -0.24 3.17 -0.46 4.97 0.04 -1.26 -2.35 135.00 138.87 1ri0 s PRO 24 Ca 0.09 1.06 -0.43 0.00 0.04 0.00 0.00 61.00 61.76 1ri0 s PRO 24 Cb -0.12 -2.02 -0.18 0.00 0.04 0.00 0.00 34.50 32.23 1ri0 s PRO 24 CO 0.01 -0.92 2.07 0.72 0.04 0.00 0.00 177.00 178.92 1ri0 n HIS 25 N -2.57 1.35 -4.39 0.56 8.25 -1.26 -4.53 115.22 112.62 1ri0 n HIS 25 Ca 0.08 0.71 -0.24 0.00 -0.26 0.00 0.00 57.72 58.01 1ri0 n HIS 25 Cb 0.53 -2.33 -0.09 0.00 1.12 0.00 0.00 29.99 29.22 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 5.79 2.45 -0.60 4.41 -0.00 -0.70 -4.63 118.94 125.67 1ri0 s TRP 26 Ca 1.15 -0.29 -0.27 0.00 -0.00 0.00 0.00 56.10 56.69 1ri0 s TRP 26 Cb -1.37 -1.10 0.01 0.00 -0.00 0.00 0.00 33.47 31.01 1ri0 s TRP 26 CO 0.65 0.64 1.51 -1.25 -0.00 0.00 0.00 176.95 178.50 1ri0 s PRO 27 N -3.39 3.12 0.15 5.86 0.04 -1.26 -0.41 135.00 139.11 1ri0 s PRO 27 Ca 0.29 0.41 0.10 0.00 0.04 0.00 0.00 61.00 61.83 1ri0 s PRO 27 Cb -0.06 -4.20 -0.04 0.00 0.04 0.00 0.00 34.50 30.24 1ri0 s PRO 27 CO 0.16 -2.16 -0.23 0.00 0.04 0.00 0.00 177.00 174.80 1ri0 s ALA 28 N 6.76 2.23 -0.12 8.56 0.00 -0.80 -1.95 121.76 136.44 1ri0 s ALA 28 Ca 0.54 -1.47 -0.04 0.00 0.00 0.00 0.00 51.96 50.99 1ri0 s ALA 28 Cb -0.11 -0.30 -0.04 0.00 0.00 0.00 0.00 23.12 22.67 1ri0 s ALA 28 CO 0.22 0.42 0.04 0.50 0.00 0.00 0.00 175.76 176.94 1ri0 s ARG 29 N -2.31 3.33 0.41 0.00 3.00 0.69 -2.06 118.95 122.01 1ri0 s ARG 29 Ca 0.14 -0.35 -0.26 0.00 -1.00 0.00 0.00 55.73 54.26 1ri0 s ARG 29 Cb -0.09 -2.96 -0.09 0.00 0.00 0.00 0.00 34.95 31.81 1ri0 s ARG 29 CO 0.07 0.60 1.37 -1.50 0.00 0.00 0.00 175.30 175.84 1ri0 s ILE 30 N -0.56 2.35 -0.03 4.11 -1.16 -0.08 -0.36 121.20 125.46 1ri0 s ILE 30 Ca 0.10 0.32 -0.16 0.00 -0.51 0.00 0.00 60.65 60.40 1ri0 s ILE 30 Cb -0.12 -3.19 0.03 0.00 0.61 0.00 0.00 42.46 39.79 1ri0 s ILE 30 CO 0.02 0.05 0.34 -1.81 -2.81 0.00 0.00 174.94 170.74 1ri0 s ASP 31 N -0.55 -0.25 -0.03 4.50 1.11 0.15 -3.77 116.67 117.83 1ri0 s ASP 31 Ca 0.57 0.21 0.00 0.00 0.18 0.00 0.00 52.55 53.51 1ri0 s ASP 31 Cb -0.41 0.38 -0.03 0.00 1.07 0.00 0.00 42.92 43.92 1ri0 s ASP 31 CO 0.54 -0.42 0.00 -1.83 1.18 0.00 0.00 175.17 174.63 1ri0 s GLU 32 N -1.15 2.85 -0.18 8.23 -1.05 -1.26 -0.82 118.70 125.32 1ri0 s GLU 32 Ca -0.12 -0.54 -0.29 0.00 -0.15 0.00 0.00 54.97 53.87 1ri0 s GLU 32 Cb -0.05 -2.71 -0.02 0.00 -0.44 0.00 0.00 34.13 30.91 1ri0 s GLU 32 CO 0.04 0.65 1.41 0.00 0.95 0.00 0.00 175.26 178.32 1ri0 s MET 33 N -1.31 4.08 1.02 -4.83 0.23 -1.26 -4.85 119.30 112.37 1ri0 s MET 33 Ca 0.17 1.68 -0.16 0.00 -1.03 0.00 0.00 55.69 56.35 1ri0 s MET 33 Cb -0.11 -3.88 0.20 0.00 -1.53 0.00 0.00 34.83 29.51 1ri0 s MET 33 CO 0.07 -0.93 1.19 -1.25 -2.03 0.00 0.00 175.02 172.07 1ri0 s PRO 34 N 3.96 0.26 -0.22 3.16 0.04 -1.26 -5.01 135.00 135.93 1ri0 s PRO 34 Ca 0.62 -0.04 0.17 0.00 0.04 0.00 0.00 61.00 61.79 1ri0 s PRO 34 Cb -0.23 -1.77 0.47 0.00 0.04 0.00 0.00 34.50 33.01 1ri0 s PRO 34 CO 0.22 -2.73 1.16 -0.85 0.04 0.00 0.00 177.00 174.84 1ri0 n GLU 35 N -4.07 1.97 -0.04 4.56 0.28 -1.26 -4.56 120.64 117.52 1ri0 n GLU 35 Ca 0.11 -3.41 -0.06 0.00 -0.16 0.00 0.00 57.16 53.65 1ri0 n GLU 35 Cb 0.59 -1.52 -0.02 0.00 1.43 0.00 0.00 31.44 31.92 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 -0.51 1.57 -0.20 -1.84 0.00 -1.26 -4.67 120.51 113.61 1ri0 n ALA 36 Ca 0.20 -0.51 -0.07 0.00 0.00 0.00 0.00 53.44 53.06 1ri0 n ALA 36 Cb 0.90 0.10 0.03 0.00 0.00 0.00 0.00 19.45 20.48 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 -0.70 0.72 -2.69 0.00 0.00 -2.03 -3.45 119.26 111.11 1ri0 h ALA 37 Ca 0.00 -0.05 -0.21 0.00 0.00 0.00 0.00 54.91 54.64 1ri0 h ALA 37 Cb 0.61 -0.23 -0.13 0.00 0.00 0.00 0.00 17.79 18.04 1ri0 h ALA 37 CO 0.00 0.18 -0.46 0.54 0.00 0.00 0.00 179.25 179.50 1ri0 s VAL 38 N -6.07 0.00 -0.33 0.00 0.11 -1.26 -5.13 120.40 107.72 1ri0 s VAL 38 Ca -0.13 -1.83 -0.07 0.00 -2.93 0.00 0.00 61.98 57.02 1ri0 s VAL 38 Cb 0.13 -2.43 0.03 0.00 -1.53 0.00 0.00 36.38 32.57 1ri0 s VAL 38 CO 0.75 0.00 0.10 -0.54 -3.33 0.00 0.00 175.10 172.08 1ri0 s LYS 39 N -4.01 2.75 0.49 1.54 1.02 -1.26 -4.08 119.74 116.18 1ri0 s LYS 39 Ca 0.35 -1.09 0.02 0.00 0.02 0.00 0.00 55.97 55.27 1ri0 s LYS 39 Cb 0.04 -3.44 -0.02 0.00 -0.52 0.00 0.00 37.83 33.90 1ri0 s LYS 39 CO 0.13 -0.60 0.02 0.45 -0.92 0.00 0.00 175.35 174.43 1ri0 s SER 40 N 1.43 3.92 0.53 2.83 0.15 -1.26 -5.13 113.70 116.17 1ri0 s SER 40 Ca -0.00 -1.63 0.01 0.00 0.70 0.00 0.00 55.95 55.02 1ri0 s SER 40 Cb -0.19 0.43 0.00 0.00 -1.71 0.00 0.00 66.02 64.56 1ri0 s SER 40 CO 0.03 -0.83 0.04 0.42 1.20 0.00 0.00 173.24 174.10 1ri0 s THR 41 N -2.91 1.07 -0.19 6.45 -4.23 -1.26 -5.02 115.64 109.55 1ri0 s THR 41 Ca 0.11 -1.95 -0.13 0.00 -1.18 0.00 0.00 61.69 58.54 1ri0 s THR 41 Cb 0.03 -2.02 -0.05 0.00 1.34 0.00 0.00 72.50 71.80 1ri0 s THR 41 CO 0.06 0.00 0.28 0.00 -0.54 0.00 0.00 174.62 174.42 1ri0 s ALA 42 N -2.90 3.59 0.00 3.99 0.00 -1.26 -4.60 121.76 120.58 1ri0 s ALA 42 Ca 0.04 -0.58 0.00 0.00 0.00 0.00 0.00 51.96 51.42 1ri0 s ALA 42 Cb -0.00 -2.43 0.00 0.00 0.00 0.00 0.00 23.12 20.69 1ri0 s ALA 42 CO 0.02 -0.07 0.00 0.27 0.00 0.00 0.00 175.76 175.98 1ri0 n ASN 43 N 3.97 0.00 -4.82 0.00 0.23 -1.26 -5.15 115.26 108.24 1ri0 n ASN 43 Ca -0.12 0.00 -0.30 0.00 -0.53 0.00 0.00 54.58 53.63 1ri0 n ASN 43 Cb 0.52 0.00 -0.05 0.00 -2.08 0.00 0.00 39.78 38.17 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 0.00 2.22 0.07 -3.83 -2.85 -1.26 -5.07 119.74 109.02 1ri0 s LYS 44 Ca 0.00 -2.22 0.04 0.00 -1.00 0.00 0.00 55.97 52.79 1ri0 s LYS 44 Cb 0.00 -1.78 -0.03 0.00 -2.06 0.00 0.00 37.83 33.96 1ri0 s LYS 44 CO 0.00 -0.45 -0.11 -0.47 0.10 0.00 0.00 175.35 174.42 1ri0 s TYR 45 N -2.82 1.04 -0.13 1.78 5.04 -0.47 -4.89 117.35 116.90 1ri0 s TYR 45 Ca 0.19 -0.54 -0.12 0.00 -2.44 0.00 0.00 57.07 54.16 1ri0 s TYR 45 Cb 0.00 -0.58 -0.05 0.00 0.35 0.00 0.00 41.96 41.68 1ri0 s TYR 45 CO 0.11 0.01 0.26 -1.14 -1.34 0.00 0.00 175.55 173.45 1ri0 s GLN 46 N -2.09 4.00 -0.07 4.97 0.74 -0.00 -0.93 119.66 126.27 1ri0 s GLN 46 Ca -0.01 0.07 0.03 0.00 0.05 0.00 0.00 55.36 55.50 1ri0 s GLN 46 Cb -0.07 -3.33 0.01 0.00 1.10 0.00 0.00 33.01 30.71 1ri0 s GLN 46 CO 0.01 0.45 -0.16 0.08 -0.55 0.00 0.00 175.29 175.12 1ri0 s VAL 47 N -0.18 1.43 -0.50 1.34 1.01 -0.80 0.29 120.40 123.00 1ri0 s VAL 47 Ca 0.17 -0.66 -0.08 0.00 0.00 0.00 0.00 61.98 61.40 1ri0 s VAL 47 Cb -0.13 -1.27 0.13 0.00 0.00 0.00 0.00 36.38 35.11 1ri0 s VAL 47 CO 0.05 0.42 0.36 0.12 0.00 0.00 0.00 175.10 176.05 1ri0 s PHE 48 N 0.48 3.47 -0.01 5.22 5.36 0.51 -1.85 117.98 131.16 1ri0 s PHE 48 Ca -0.14 -2.05 -0.30 0.00 -0.96 0.00 0.00 56.93 53.48 1ri0 s PHE 48 Cb -0.16 -3.45 -0.05 0.00 -0.34 0.00 0.00 43.02 39.02 1ri0 s PHE 48 CO 0.05 -0.98 1.33 -0.06 -1.46 0.00 0.00 175.22 174.10 1ri0 s PHE 49 N 1.12 2.99 -0.16 10.12 0.40 0.20 -0.22 117.98 132.42 1ri0 s PHE 49 Ca 0.08 0.96 -0.15 0.00 -0.60 0.00 0.00 56.93 57.23 1ri0 s PHE 49 Cb -0.24 -3.58 -0.11 0.00 0.51 0.00 0.00 43.02 39.60 1ri0 s PHE 49 CO -0.02 -2.05 0.05 0.74 0.70 0.00 0.00 175.22 174.65 1ri0 h PHE 50 N 7.65 0.00 -1.29 0.36 -1.00 -1.65 0.18 116.94 121.20 1ri0 h PHE 50 Ca -0.37 0.00 0.46 0.00 2.81 0.00 0.00 57.97 60.87 1ri0 h PHE 50 Cb 1.17 0.00 -0.15 0.00 3.61 0.00 0.00 35.95 40.59 1ri0 h PHE 50 CO 0.74 0.65 0.81 0.41 -1.61 0.00 0.00 178.31 179.31 1ri0 n GLY 51 N 1.56 -0.81 0.05 -1.45 0.00 -1.23 0.72 105.19 104.03 1ri0 n GLY 51 Ca -0.17 0.76 -0.02 0.00 0.00 0.00 0.00 46.02 46.59 1ri0 n GLY 51 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1ri0 n THR 52 N -4.80 0.72 -2.57 2.61 -2.24 -1.26 -4.62 114.28 102.13 1ri0 n THR 52 Ca 0.39 -0.59 -0.07 0.00 -2.27 0.00 0.00 64.05 61.52 1ri0 n THR 52 Cb 1.49 -0.34 0.01 0.00 -2.10 0.00 0.00 70.33 69.40 1ri0 n THR 52 CO 0.00 0.00 0.00 1.57 -0.57 0.00 0.00 175.07 176.07 1ri0 n HIS 53 N -2.43 -0.64 -4.38 4.78 -0.00 0.22 -5.04 115.22 107.74 1ri0 n HIS 53 Ca -0.18 0.19 -0.19 0.00 0.46 0.00 0.00 57.72 57.99 1ri0 n HIS 53 Cb 0.83 -2.05 -0.10 0.00 -0.12 0.00 0.00 29.99 28.55 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 -5.00 1.42 -0.06 1.57 2.02 0.19 -4.96 118.70 113.88 1ri0 s GLU 54 Ca 0.11 -1.69 0.06 0.00 0.02 0.00 0.00 54.97 53.47 1ri0 s GLU 54 Cb -0.05 -1.01 -0.01 0.00 0.10 0.00 0.00 34.13 33.16 1ri0 s GLU 54 CO 0.14 0.05 -0.25 0.99 0.02 0.00 0.00 175.26 176.21 1ri0 s THR 55 N -3.10 2.04 0.20 3.63 2.01 -1.26 0.59 115.64 119.75 1ri0 s THR 55 Ca 0.27 -1.06 -0.04 0.00 0.31 0.00 0.00 61.69 61.16 1ri0 s THR 55 Cb 0.03 -1.73 -0.03 0.00 0.01 0.00 0.00 72.50 70.78 1ri0 s THR 55 CO 0.09 0.57 0.20 0.00 -0.69 0.00 0.00 174.62 174.79 1ri0 s ALA 56 N -0.19 0.78 -0.30 7.40 0.00 -0.77 -5.00 121.76 123.70 1ri0 s ALA 56 Ca -0.03 -1.46 -0.18 0.00 0.00 0.00 0.00 51.96 50.29 1ri0 s ALA 56 Cb -0.14 1.24 -0.02 0.00 0.00 0.00 0.00 23.12 24.21 1ri0 s ALA 56 CO 0.03 -0.64 0.52 -0.59 0.00 0.00 0.00 175.76 175.08 1ri0 s PHE 57 N -4.11 3.23 0.33 0.00 -0.71 -1.26 -1.90 117.98 113.55 1ri0 s PHE 57 Ca 0.33 0.46 0.02 0.00 -1.04 0.00 0.00 56.93 56.70 1ri0 s PHE 57 Cb 0.05 -2.81 -0.01 0.00 -1.21 0.00 0.00 43.02 39.04 1ri0 s PHE 57 CO 0.10 -0.38 0.37 -0.51 -1.34 0.00 0.00 175.22 173.45 1ri0 s LEU 58 N 2.35 1.34 0.00 -1.99 1.43 -0.11 -4.97 118.68 116.73 1ri0 s LEU 58 Ca 0.20 -1.59 0.00 0.00 -1.03 0.00 0.00 54.13 51.71 1ri0 s LEU 58 Cb -0.15 1.01 0.00 0.00 0.03 0.00 0.00 46.19 47.07 1ri0 s LEU 58 CO 0.11 -1.17 0.00 0.61 0.23 0.00 0.00 176.35 176.13 1ri0 n GLY 59 N -0.57 4.95 0.19 -3.19 0.00 -1.26 -1.36 105.19 103.95 1ri0 n GLY 59 Ca 0.04 -1.84 0.14 0.00 0.00 0.00 0.00 46.02 44.36 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 -0.03 1.61 0.13 -1.97 -2.85 132.00 128.89 1ri0 h PRO 60 Ca 0.00 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 65.01 1ri0 h PRO 60 Cb 0.00 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.12 1ri0 h PRO 60 CO 0.00 0.00 -0.53 1.57 -0.23 0.00 0.00 178.00 178.81 1ri0 h LYS 61 N 0.00 0.09 -0.02 0.86 2.10 -2.02 -2.18 116.57 115.41 1ri0 h LYS 61 Ca 0.00 -0.06 0.00 0.00 -2.00 0.00 0.00 60.65 58.59 1ri0 h LYS 61 Cb 0.66 0.01 0.00 0.00 -0.90 0.00 0.00 32.23 32.00 1ri0 h LYS 61 CO 0.00 0.61 -0.02 -0.25 -2.00 0.00 0.00 179.45 177.78 1ri0 n ASP 62 N -3.91 1.91 -4.57 7.07 9.92 -1.09 -4.84 116.55 121.04 1ri0 n ASP 62 Ca -0.02 -1.61 -0.34 0.00 -0.53 0.00 0.00 54.79 52.29 1ri0 n ASP 62 Cb 0.55 0.02 -0.11 0.00 -0.64 0.00 0.00 41.12 40.94 1ri0 n ASP 62 CO 0.00 0.00 0.00 -0.22 0.13 0.00 0.00 177.20 177.11 1ri0 s LEU 63 N -2.04 3.30 -0.00 0.64 1.98 -0.82 -1.37 118.68 120.36 1ri0 s LEU 63 Ca 0.34 -0.03 0.03 0.00 -2.89 0.00 0.00 54.13 51.58 1ri0 s LEU 63 Cb 0.21 -1.76 -0.01 0.00 0.66 0.00 0.00 46.19 45.29 1ri0 s LEU 63 CO 0.34 0.28 -0.09 0.12 -1.89 0.00 0.00 176.35 175.11 1ri0 s PHE 64 N -0.33 0.84 0.92 5.38 5.36 0.07 -4.86 117.98 125.36 1ri0 s PHE 64 Ca 0.05 -0.17 -0.12 0.00 -0.96 0.00 0.00 56.93 55.73 1ri0 s PHE 64 Cb -0.12 -0.54 0.14 0.00 -0.34 0.00 0.00 43.02 42.16 1ri0 s PHE 64 CO 0.02 -0.01 1.14 -1.25 -1.46 0.00 0.00 175.22 173.66 1ri0 s PRO 65 N -0.28 1.09 -0.04 10.12 0.04 -1.26 -2.14 135.00 142.53 1ri0 s PRO 65 Ca 0.03 0.27 -0.16 0.00 0.04 0.00 0.00 61.00 61.18 1ri0 s PRO 65 Cb -0.04 -1.84 -0.32 0.00 0.04 0.00 0.00 34.50 32.35 1ri0 s PRO 65 CO -0.00 -2.23 0.80 -0.92 0.04 0.00 0.00 177.00 174.69 1ri0 h TYR 66 N -1.52 0.69 -0.34 0.56 3.20 -1.98 -2.91 116.97 114.67 1ri0 h TYR 66 Ca -0.50 -0.51 0.07 0.00 3.14 0.00 0.00 58.73 60.93 1ri0 h TYR 66 Cb 1.33 -0.03 -0.07 0.00 1.54 0.00 0.00 36.73 39.50 1ri0 h TYR 66 CO 0.22 1.53 -0.14 0.93 -1.64 0.00 0.00 178.16 179.05 1ri0 h GLU 67 N -0.10 -0.07 -0.17 1.82 5.08 -1.97 1.03 114.58 120.20 1ri0 h GLU 67 Ca -0.26 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.02 1ri0 h GLU 67 Cb 1.93 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 31.18 1ri0 h GLU 67 CO 0.17 -0.05 -0.26 0.93 -1.00 0.00 0.00 179.01 178.81 1ri0 h GLU 68 N -0.07 0.31 0.14 2.33 5.08 -1.98 -0.27 114.58 120.11 1ri0 h GLU 68 Ca 0.17 -0.11 -0.01 0.00 -1.00 0.00 0.00 59.36 58.42 1ri0 h GLU 68 Cb 0.34 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.56 1ri0 h GLU 68 CO -0.40 0.56 -0.06 0.66 -1.00 0.00 0.00 179.01 178.77 1ri0 h SER 69 N 0.28 -0.15 0.51 1.42 4.64 -0.74 -2.37 113.55 117.13 1ri0 h SER 69 Ca 0.04 -0.29 0.00 0.00 -0.47 0.00 0.00 61.79 61.07 1ri0 h SER 69 Cb 0.61 0.04 0.00 0.00 -0.31 0.00 0.00 62.40 62.74 1ri0 h SER 69 CO 0.04 0.23 0.00 2.29 -0.87 0.00 0.00 176.83 178.52 1ri0 n LYS 70 N -5.00 0.07 -0.01 4.77 2.85 0.34 0.11 118.16 121.29 1ri0 n LYS 70 Ca -0.09 0.35 -0.17 0.00 -1.05 0.00 0.00 58.31 57.35 1ri0 n LYS 70 Cb 0.23 -1.64 -0.11 0.00 -0.65 0.00 0.00 35.03 32.85 1ri0 n LYS 70 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 177.40 178.28 1ri0 h GLU 71 N 0.00 0.31 0.00 -1.58 4.39 -0.60 -3.43 114.58 113.67 1ri0 h GLU 71 Ca 0.00 -0.34 0.00 0.00 0.34 0.00 0.00 59.36 59.36 1ri0 h GLU 71 Cb 0.25 0.10 0.00 0.00 -0.10 0.00 0.00 28.75 29.00 1ri0 h GLU 71 CO 0.00 1.04 -0.02 0.36 -1.16 0.00 0.00 179.01 179.23 1ri0 n LYS 72 N -4.32 0.01 0.00 2.33 2.85 -0.93 -5.08 118.16 113.01 1ri0 n LYS 72 Ca -0.10 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.16 1ri0 n LYS 72 Cb 0.62 -0.36 0.00 0.00 -0.65 0.00 0.00 35.03 34.63 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 -2.54 0.00 -1.79 5.58 3.01 0.12 -5.03 117.46 116.81 1ri0 n PHE 73 Ca -0.00 0.00 -0.10 0.00 1.01 0.00 0.00 57.45 58.36 1ri0 n PHE 73 Cb 0.01 0.00 -0.02 0.00 -0.01 0.00 0.00 39.48 39.46 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 1.91 0.48 2.66 1.37 0.00 -0.39 -4.00 105.19 107.22 1ri0 n GLY 74 Ca 0.00 -0.53 -0.29 0.00 0.00 0.00 0.00 46.02 45.19 1ri0 n GLY 74 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ri0 s LYS 75 N -3.75 0.89 1.02 1.61 0.00 -1.26 -4.85 119.74 113.40 1ri0 s LYS 75 Ca 0.00 -1.48 -0.16 0.00 0.00 0.00 0.00 55.97 54.33 1ri0 s LYS 75 Cb 0.00 -1.96 0.20 0.00 0.00 0.00 0.00 37.83 36.07 1ri0 s LYS 75 CO 0.00 -1.10 1.19 -1.25 0.00 0.00 0.00 175.35 174.18 1ri0 s PRO 76 N 1.01 0.25 0.26 1.78 0.04 -1.26 -4.94 135.00 132.14 1ri0 s PRO 76 Ca 0.15 -0.04 -0.29 0.00 0.04 0.00 0.00 61.00 60.86 1ri0 s PRO 76 Cb -0.21 -1.77 -0.14 0.00 0.04 0.00 0.00 34.50 32.42 1ri0 s PRO 76 CO -0.10 -2.73 1.02 0.09 0.04 0.00 0.00 177.00 175.32 1ri0 n ASN 77 N -4.07 1.21 -4.45 6.66 3.02 -1.26 -4.86 115.26 111.52 1ri0 n ASN 77 Ca 0.11 1.17 -0.44 0.00 -0.03 0.00 0.00 54.58 55.39 1ri0 n ASN 77 Cb 0.59 -1.26 -0.02 0.00 -0.61 0.00 0.00 39.78 38.48 1ri0 n ASN 77 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 1ri0 s LYS 78 N -1.30 3.67 0.34 3.52 2.47 -1.26 -4.86 119.74 122.32 1ri0 s LYS 78 Ca 0.61 -1.90 0.06 0.00 -1.56 0.00 0.00 55.97 53.18 1ri0 s LYS 78 Cb -0.74 -4.92 0.06 0.00 -1.46 0.00 0.00 37.83 30.77 1ri0 s LYS 78 CO 0.58 -1.75 0.47 0.54 0.16 0.00 0.00 175.35 175.35 1ri0 n ARG 79 N 6.33 0.77 -0.05 4.03 5.12 -1.26 -4.97 116.66 126.63 1ri0 n ARG 79 Ca 0.25 -1.85 -0.13 0.00 -1.93 0.00 0.00 57.85 54.20 1ri0 n ARG 79 Cb 0.48 -0.13 -0.07 0.00 -1.16 0.00 0.00 32.46 31.58 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 0.29 0.00 5.56 1.57 -2.01 -2.54 116.57 119.44 1ri0 h LYS 80 Ca -0.16 -0.14 0.00 0.00 -1.87 0.00 0.00 60.65 58.48 1ri0 h LYS 80 Cb 0.74 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.04 1ri0 h LYS 80 CO 0.23 0.65 0.00 0.41 -0.57 0.00 0.00 179.45 180.17 1ri0 n GLY 81 N 0.08 -1.05 0.12 3.86 0.00 -1.26 -2.59 105.19 104.35 1ri0 n GLY 81 Ca -0.06 -0.08 -0.21 0.00 0.00 0.00 0.00 46.02 45.67 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 0.50 0.32 1.61 3.04 -1.80 -1.10 116.94 119.51 1ri0 h PHE 82 Ca 0.00 -0.37 -0.02 0.00 3.98 0.00 0.00 57.97 61.57 1ri0 h PHE 82 Cb 0.26 -0.02 0.00 0.00 2.56 0.00 0.00 35.95 38.75 1ri0 h PHE 82 CO 0.00 1.43 -0.15 1.03 -2.02 0.00 0.00 178.31 178.60 1ri0 h SER 83 N -0.34 -0.37 0.59 0.41 0.87 -1.34 0.11 113.55 113.49 1ri0 h SER 83 Ca -0.22 -0.18 -0.05 0.00 -1.23 0.00 0.00 61.79 60.11 1ri0 h SER 83 Cb 1.71 0.09 -0.01 0.00 -0.44 0.00 0.00 62.40 63.75 1ri0 h SER 83 CO 0.11 0.07 -0.24 1.05 -0.53 0.00 0.00 176.83 177.29 1ri0 h GLU 84 N -0.91 0.00 0.26 2.24 4.11 -1.68 -1.98 114.58 116.61 1ri0 h GLU 84 Ca -0.04 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.37 1ri0 h GLU 84 Cb 0.52 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.77 1ri0 h GLU 84 CO 0.07 0.24 -0.13 0.78 0.07 0.00 0.00 179.01 180.05 1ri0 h GLY 85 N 1.42 -0.37 1.57 1.06 0.00 -1.16 0.55 103.07 106.15 1ri0 h GLY 85 Ca -0.00 0.14 0.05 0.00 0.00 0.00 0.00 47.33 47.52 1ri0 h GLY 85 CO 0.03 -0.13 0.16 -2.00 0.00 0.00 0.00 176.54 174.60 1ri0 h LEU 86 N -0.98 0.00 0.00 3.11 7.12 -0.75 0.63 115.31 124.44 1ri0 h LEU 86 Ca -0.04 0.00 -0.09 0.00 0.13 0.00 0.00 57.88 57.88 1ri0 h LEU 86 Cb 0.46 0.00 -0.02 0.00 -0.53 0.00 0.00 40.66 40.58 1ri0 h LEU 86 CO 0.06 0.00 -1.00 -0.25 -0.13 0.00 0.00 178.44 177.12 1ri0 h TRP 87 N 0.00 0.00 0.00 1.25 2.91 -1.33 -1.84 115.95 116.94 1ri0 h TRP 87 Ca 0.09 0.00 -0.04 0.00 1.13 0.00 0.00 58.89 60.07 1ri0 h TRP 87 Cb 0.41 0.00 -0.01 0.00 -0.51 0.00 0.00 29.16 29.05 1ri0 h TRP 87 CO 0.00 0.35 -0.17 0.93 -1.03 0.00 0.00 178.44 178.52 1ri0 h GLU 88 N 0.00 0.00 0.01 2.65 4.39 0.57 1.40 114.58 123.60 1ri0 h GLU 88 Ca -0.07 0.00 -0.40 0.00 0.34 0.00 0.00 59.36 59.23 1ri0 h GLU 88 Cb 1.33 0.00 -0.07 0.00 -0.10 0.00 0.00 28.75 29.92 1ri0 h GLU 88 CO 0.03 0.17 -2.46 1.51 -1.16 0.00 0.00 179.01 177.11 1ri0 n ILE 89 N -3.43 1.51 0.15 3.13 0.00 -0.64 -3.09 119.36 117.00 1ri0 n ILE 89 Ca -0.00 -0.54 0.02 0.00 0.00 0.00 0.00 62.75 62.22 1ri0 n ILE 89 Cb 0.36 -1.51 0.18 0.00 0.00 0.00 0.00 39.64 38.67 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 -0.16 0.00 -2.09 9.51 4.39 -1.30 -3.32 114.58 121.61 1ri0 h GLU 90 Ca -0.59 0.00 -0.52 0.00 0.34 0.00 0.00 59.36 58.59 1ri0 h GLU 90 Cb 1.86 0.00 -0.41 0.00 -0.10 0.00 0.00 28.75 30.10 1ri0 h GLU 90 CO -0.14 0.53 -1.02 0.09 -1.16 0.00 0.00 179.01 177.32 1ri0 n ASN 91 N -3.51 1.92 -4.62 1.42 3.02 0.48 -5.01 115.26 108.97 1ri0 n ASN 91 Ca 0.00 -3.20 -0.43 0.00 -0.03 0.00 0.00 54.58 50.93 1ri0 n ASN 91 Cb 0.63 -0.61 -0.03 0.00 -0.61 0.00 0.00 39.78 39.17 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 -2.65 5.96 0.00 6.41 4.22 -1.18 -4.52 114.94 123.18 1ri0 s ASN 92 Ca 0.42 1.77 0.24 0.00 -2.14 0.00 0.00 52.86 53.15 1ri0 s ASN 92 Cb 0.31 -2.52 1.41 0.00 1.28 0.00 0.00 41.25 41.72 1ri0 s ASN 92 CO -0.10 -1.58 1.79 -0.81 -2.04 0.00 0.00 177.10 174.37 1ri0 n PRO 93 N 8.20 0.71 -3.61 3.55 -0.04 -1.26 -4.17 135.00 138.39 1ri0 n PRO 93 Ca 0.24 0.01 -0.29 0.00 -0.04 0.00 0.00 63.50 63.41 1ri0 n PRO 93 Cb 0.45 -1.50 -0.12 0.00 -0.04 0.00 0.00 33.50 32.29 1ri0 n PRO 93 CO 0.00 0.00 0.00 -0.08 -0.04 0.00 0.00 175.50 175.38 1ri0 s THR 94 N -2.05 0.94 0.86 0.52 -1.32 -1.26 -5.12 115.64 108.21 1ri0 s THR 94 Ca 0.35 -2.34 -0.15 0.00 -1.21 0.00 0.00 61.69 58.35 1ri0 s THR 94 Cb 0.16 -1.66 0.21 0.00 -1.51 0.00 0.00 72.50 69.70 1ri0 s THR 94 CO 0.28 -0.96 0.97 0.55 -2.21 0.00 0.00 174.62 173.25 1ri0 n VAL 95 N 3.60 0.00 0.00 5.08 3.14 -1.26 -4.98 118.33 123.91 1ri0 n VAL 95 Ca 0.12 -0.60 0.00 0.00 -2.96 0.00 0.00 64.34 60.90 1ri0 n VAL 95 Cb 0.36 -1.42 0.00 0.00 -1.06 0.00 0.00 33.84 31.72 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 -3.64 0.00 -1.70 1.45 -0.00 -1.26 -5.10 118.16 107.91 1ri0 n LYS 96 Ca 0.13 0.00 -0.42 0.00 -0.00 0.00 0.00 58.31 58.01 1ri0 n LYS 96 Cb 0.46 0.00 -0.03 0.00 -0.00 0.00 0.00 35.03 35.46 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 -1.19 3.43 0.45 0.58 0.00 -1.26 -4.95 121.76 118.81 1ri0 s ALA 97 Ca 0.00 1.17 -0.18 0.00 0.00 0.00 0.00 51.96 52.95 1ri0 s ALA 97 Cb 0.00 -3.88 -0.09 0.00 0.00 0.00 0.00 23.12 19.15 1ri0 s ALA 97 CO 0.00 -1.78 0.93 -1.12 0.00 0.00 0.00 175.76 173.79 1ri0 s SER 98 N 4.99 6.79 -0.08 0.00 0.01 -1.26 -5.08 113.70 119.08 1ri0 s SER 98 Ca 0.89 1.57 -0.08 0.00 1.31 0.00 0.00 55.95 59.63 1ri0 s SER 98 Cb -0.40 -2.50 0.02 0.00 0.21 0.00 0.00 66.02 63.36 1ri0 s SER 98 CO 0.39 -0.42 0.23 -0.83 0.41 0.00 0.00 173.24 173.02 1ri0 s GLY 99 N -2.56 -0.16 0.00 3.44 0.00 -1.26 -5.24 107.32 101.54 1ri0 s GLY 99 Ca 0.59 0.57 0.24 0.00 0.00 0.00 0.00 44.72 46.13 1ri0 s GLY 99 CO 0.21 0.47 1.29 2.98 0.00 0.00 0.00 173.10 178.05