#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fjc n HIS 2 N 0.00 -1.26 -0.28 0.66 -0.00 -1.26 -5.16 115.22 107.92 1fjc n HIS 2 Ca 0.00 -1.14 -0.30 0.00 -0.00 0.00 0.00 57.72 56.27 1fjc n HIS 2 Cb 0.00 0.37 0.29 0.00 -0.00 0.00 0.00 29.99 30.65 1fjc n HIS 2 CO 0.00 0.00 0.00 1.41 -0.00 0.00 0.00 176.34 177.75 1fjc s MET 3 N -2.28 -3.02 0.34 -0.41 0.00 -1.26 -4.99 119.30 107.68 1fjc s MET 3 Ca 0.13 0.24 0.00 0.00 0.00 0.00 0.00 55.69 56.06 1fjc s MET 3 Cb -0.01 -1.36 0.00 0.00 0.00 0.00 0.00 34.83 33.46 1fjc s MET 3 CO 0.09 -4.96 0.00 -0.11 0.00 0.00 0.00 175.02 170.04 1fjc n LEU 4 N -5.71 -2.30 -4.51 4.11 7.94 -1.26 -5.03 117.00 110.24 1fjc n LEU 4 Ca 0.11 0.63 -0.27 0.00 -1.11 0.00 0.00 56.01 55.38 1fjc n LEU 4 Cb 0.59 2.26 -0.17 0.00 0.53 0.00 0.00 43.42 46.63 1fjc n LEU 4 CO 0.44 -0.17 2.01 -0.62 -1.11 0.00 0.00 177.39 177.94 1fjc n GLU 5 N -3.30 0.15 -0.08 1.96 1.02 -1.26 -4.71 120.64 114.41 1fjc n GLU 5 Ca 0.00 -0.12 -0.08 0.00 -0.02 0.00 0.00 57.16 56.94 1fjc n GLU 5 Cb 0.00 -1.67 -0.01 0.00 -0.02 0.00 0.00 31.44 29.74 1fjc n GLU 5 CO 0.00 0.00 0.00 -0.44 1.18 0.00 0.00 177.13 177.87 1fjc h ASP 6 N 12.10 0.23 -0.10 1.62 5.19 -2.04 -1.68 116.42 131.74 1fjc h ASP 6 Ca -0.01 0.01 -0.04 0.00 -0.62 0.00 0.00 57.03 56.38 1fjc h ASP 6 Cb 1.17 -0.03 -0.02 0.00 0.18 0.00 0.00 39.33 40.63 1fjc h ASP 6 CO 1.45 0.17 0.05 -0.81 -3.12 0.00 0.00 179.24 176.98 1fjc n PRO 7 N -4.95 1.32 0.00 3.56 -0.04 -1.26 -4.06 135.00 129.56 1fjc n PRO 7 Ca -0.01 -0.39 0.12 0.00 -0.04 0.00 0.00 63.50 63.18 1fjc n PRO 7 Cb 0.07 -1.36 0.53 0.00 -0.04 0.00 0.00 33.50 32.70 1fjc n PRO 7 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1fjc n THR 9 N -1.49 0.00 -2.36 0.00 -2.24 -1.26 -4.99 114.28 101.95 1fjc n THR 9 Ca 0.06 0.00 -0.03 0.00 -2.27 0.00 0.00 64.05 61.82 1fjc n THR 9 Cb 0.28 0.00 -0.00 0.00 -2.10 0.00 0.00 70.33 68.51 1fjc n THR 9 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1fjc n SER 10 N 0.00 -1.54 -0.10 3.42 7.64 -1.26 -4.75 113.62 117.03 1fjc n SER 10 Ca 0.00 0.40 -0.21 0.00 1.01 0.00 0.00 58.87 60.07 1fjc n SER 10 Cb 0.00 -1.46 -0.11 0.00 -1.01 0.00 0.00 64.21 61.64 1fjc n SER 10 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1fjc n LYS 11 N -2.44 0.56 -0.08 1.43 5.02 -1.26 -3.98 118.16 117.41 1fjc n LYS 11 Ca -0.03 0.55 0.03 0.00 -2.02 0.00 0.00 58.31 56.84 1fjc n LYS 11 Cb 0.48 -1.73 0.08 0.00 -0.02 0.00 0.00 35.03 33.85 1fjc n LYS 11 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1fjc n LYS 12 N -4.44 1.37 -0.08 1.97 4.76 -1.26 -3.48 118.16 117.01 1fjc n LYS 12 Ca -0.32 -0.58 -0.12 0.00 -2.87 0.00 0.00 58.31 54.43 1fjc n LYS 12 Cb 0.66 -1.13 -0.15 0.00 -1.84 0.00 0.00 35.03 32.57 1fjc n LYS 12 CO 0.00 0.00 0.00 0.28 -1.37 0.00 0.00 177.40 176.31 1fjc n VAL 13 N -0.03 1.49 0.04 -0.18 0.31 -1.26 -4.15 118.33 114.55 1fjc n VAL 13 Ca 0.06 -0.78 -0.14 0.00 -0.01 0.00 0.00 64.34 63.47 1fjc n VAL 13 Cb 0.14 -0.86 -0.03 0.00 -0.91 0.00 0.00 33.84 32.17 1fjc n VAL 13 CO 0.00 0.00 0.00 -0.09 -1.32 0.00 0.00 176.83 175.42 1fjc h ARG 14 N 0.01 0.51 0.00 5.55 2.43 -1.68 -2.88 114.38 118.32 1fjc h ARG 14 Ca -0.48 -0.47 0.00 0.00 -0.81 0.00 0.00 59.98 58.21 1fjc h ARG 14 Cb 2.12 0.12 0.00 0.00 -0.42 0.00 0.00 29.97 31.78 1fjc h ARG 14 CO 0.03 1.11 0.00 0.00 -1.51 0.00 0.00 179.97 179.59 1fjc n ALA 15 N -2.55 1.42 0.51 2.80 0.00 -1.11 -1.62 120.51 119.97 1fjc n ALA 15 Ca -0.06 -0.03 0.08 0.00 0.00 0.00 0.00 53.44 53.42 1fjc n ALA 15 Cb 0.78 -1.14 0.21 0.00 0.00 0.00 0.00 19.45 19.29 1fjc n ALA 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1fjc n ALA 16 N -1.49 2.43 0.49 0.00 0.00 -1.09 -3.57 120.51 117.28 1fjc n ALA 16 Ca 0.02 -0.82 0.05 0.00 0.00 0.00 0.00 53.44 52.70 1fjc n ALA 16 Cb 0.10 -0.96 -0.07 0.00 0.00 0.00 0.00 19.45 18.52 1fjc n ALA 16 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1fjc n ARG 17 N 0.87 2.99 -3.65 0.00 5.12 -0.64 -2.51 116.66 118.85 1fjc n ARG 17 Ca 0.16 -0.01 -0.13 0.00 -1.93 0.00 0.00 57.85 55.94 1fjc n ARG 17 Cb 0.40 -1.06 -0.06 0.00 -1.16 0.00 0.00 32.46 30.58 1fjc n ARG 17 CO 0.00 0.00 0.00 0.99 -1.93 0.00 0.00 177.63 176.69 1fjc s THR 18 N -2.14 0.05 0.29 0.55 2.01 -1.23 0.25 115.64 115.42 1fjc s THR 18 Ca 0.04 -0.42 -0.06 0.00 0.31 0.00 0.00 61.69 61.56 1fjc s THR 18 Cb 0.09 -0.94 0.03 0.00 0.01 0.00 0.00 72.50 71.68 1fjc s THR 18 CO 0.47 -0.23 0.50 0.00 -0.69 0.00 0.00 174.62 174.67 1fjc n LEU 19 N 0.55 0.00 -3.94 4.42 -0.00 0.37 -4.46 117.00 113.94 1fjc n LEU 19 Ca -0.19 -2.15 -0.28 0.00 -0.00 0.00 0.00 56.01 53.39 1fjc n LEU 19 Cb 0.60 2.47 -0.17 0.00 -0.00 0.00 0.00 43.42 46.32 1fjc n LEU 19 CO 0.20 -0.59 -0.45 -0.22 -0.00 0.00 0.00 177.39 176.33 1fjc s LEU 20 N 0.00 1.38 -0.10 1.47 2.96 0.72 0.57 118.68 125.67 1fjc s LEU 20 Ca 0.18 -0.39 -0.30 0.00 -0.22 0.00 0.00 54.13 53.41 1fjc s LEU 20 Cb -0.02 -0.95 -0.02 0.00 0.50 0.00 0.00 46.19 45.70 1fjc s LEU 20 CO 0.13 -0.10 1.07 0.00 -1.32 0.00 0.00 176.35 176.13 1fjc s ALA 21 N 1.63 3.46 0.45 5.97 0.00 0.77 -0.19 121.76 133.85 1fjc s ALA 21 Ca 0.05 0.43 0.03 0.00 0.00 0.00 0.00 51.96 52.47 1fjc s ALA 21 Cb -0.13 -3.47 -0.03 0.00 0.00 0.00 0.00 23.12 19.48 1fjc s ALA 21 CO -0.09 -0.70 0.03 0.21 0.00 0.00 0.00 175.76 175.21 1fjc s LYS 22 N 2.21 2.04 -0.59 0.00 2.36 0.04 0.19 119.74 125.99 1fjc s LYS 22 Ca 0.50 -2.25 0.00 0.00 -2.55 0.00 0.00 55.97 51.67 1fjc s LYS 22 Cb -0.20 -1.31 0.00 0.00 -1.05 0.00 0.00 37.83 35.27 1fjc s LYS 22 CO 0.18 -0.30 0.00 -1.71 1.55 0.00 0.00 175.35 175.07 1fjc n ASN 23 N -1.16 -5.70 -3.71 1.43 5.15 -0.17 0.17 115.26 111.27 1fjc n ASN 23 Ca -0.12 0.14 0.00 0.00 -0.60 0.00 0.00 54.58 54.00 1fjc n ASN 23 Cb 0.67 -3.69 0.00 0.00 -0.53 0.00 0.00 39.78 36.23 1fjc n ASN 23 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 1fjc n LEU 24 N -0.63 0.00 -4.29 1.20 7.99 0.05 -4.59 117.00 116.73 1fjc n LEU 24 Ca -0.06 0.00 -0.15 0.00 -0.01 0.00 0.00 56.01 55.79 1fjc n LEU 24 Cb 0.52 0.00 -0.10 0.00 -0.11 0.00 0.00 43.42 43.73 1fjc n LEU 24 CO 0.08 -0.59 -0.38 -0.55 -1.51 0.00 0.00 177.39 174.45 1fjc s SER 25 N -2.09 1.85 0.21 -1.43 0.15 -1.26 -4.69 113.70 106.44 1fjc s SER 25 Ca 0.00 -1.09 0.21 0.00 0.70 0.00 0.00 55.95 55.77 1fjc s SER 25 Cb 0.00 -0.01 0.90 0.00 -1.71 0.00 0.00 66.02 65.20 1fjc s SER 25 CO 0.00 -0.39 1.65 0.49 1.20 0.00 0.00 173.24 176.19 1fjc n PHE 26 N -0.29 0.64 -0.13 3.44 3.01 -1.26 -3.35 117.46 119.51 1fjc n PHE 26 Ca -0.08 0.25 -0.26 0.00 1.01 0.00 0.00 57.45 58.37 1fjc n PHE 26 Cb 0.62 -0.91 -0.11 0.00 -0.01 0.00 0.00 39.48 39.07 1fjc n PHE 26 CO 0.00 0.00 0.00 -1.71 1.01 0.00 0.00 176.76 176.06 1fjc n ASN 27 N -2.08 1.96 -4.11 4.37 5.15 -1.26 -4.98 115.26 114.31 1fjc n ASN 27 Ca 0.02 0.21 -0.36 0.00 -0.60 0.00 0.00 54.58 53.85 1fjc n ASN 27 Cb 0.21 -0.72 0.09 0.00 -0.53 0.00 0.00 39.78 38.83 1fjc n ASN 27 CO 0.00 0.00 0.00 -0.38 1.40 0.00 0.00 177.26 178.28 1fjc n ILE 28 N -3.97 0.00 -3.64 -1.44 5.41 -1.21 -5.01 119.36 109.50 1fjc n ILE 28 Ca -0.50 -0.13 -0.03 0.00 1.00 0.00 0.00 62.75 63.09 1fjc n ILE 28 Cb 0.91 -0.25 0.02 0.00 -0.71 0.00 0.00 39.64 39.60 1fjc n ILE 28 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 176.55 176.90 1fjc n THR 29 N -3.89 0.00 -0.20 1.39 -2.24 -1.26 -4.87 114.28 103.21 1fjc n THR 29 Ca -0.01 -0.47 0.23 0.00 -2.27 0.00 0.00 64.05 61.53 1fjc n THR 29 Cb 0.70 0.55 0.61 0.00 -2.10 0.00 0.00 70.33 70.10 1fjc n THR 29 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 1fjc h GLU 30 N 0.00 0.20 0.84 -0.78 4.81 -1.92 0.06 114.58 117.79 1fjc h GLU 30 Ca -0.19 -0.01 -0.04 0.00 -0.13 0.00 0.00 59.36 58.99 1fjc h GLU 30 Cb 0.78 -0.04 0.01 0.00 0.63 0.00 0.00 28.75 30.12 1fjc h GLU 30 CO 0.25 0.13 -0.40 -0.44 -0.73 0.00 0.00 179.01 177.82 1fjc h ASP 31 N 0.21 -0.96 -0.43 1.04 3.32 -1.97 1.31 116.42 118.93 1fjc h ASP 31 Ca 0.44 0.03 0.02 0.00 0.02 0.00 0.00 57.03 57.54 1fjc h ASP 31 Cb 1.40 0.25 -0.02 0.00 0.22 0.00 0.00 39.33 41.18 1fjc h ASP 31 CO -0.10 -0.68 0.29 -0.33 -1.72 0.00 0.00 179.24 176.70 1fjc h GLU 32 N -1.14 0.49 -0.10 3.56 3.07 -1.61 0.31 114.58 119.17 1fjc h GLU 32 Ca -0.12 -0.03 -0.15 0.00 -0.50 0.00 0.00 59.36 58.56 1fjc h GLU 32 Cb 0.87 -0.11 -0.01 0.00 -0.84 0.00 0.00 28.75 28.66 1fjc h GLU 32 CO 0.19 0.33 -0.61 -0.07 -1.40 0.00 0.00 179.01 177.45 1fjc h LEU 33 N 0.51 0.38 -0.73 1.33 -0.00 -0.52 0.18 115.31 116.46 1fjc h LEU 33 Ca 0.17 -0.22 -0.08 0.00 -0.00 0.00 0.00 57.88 57.75 1fjc h LEU 33 Cb 0.05 -0.11 -0.01 0.00 -0.00 0.00 0.00 40.66 40.59 1fjc h LEU 33 CO -0.04 0.89 -0.40 0.50 -0.00 0.00 0.00 178.44 179.39 1fjc h LYS 34 N 0.25 0.00 0.03 1.13 3.11 0.39 0.53 116.57 122.00 1fjc h LYS 34 Ca -0.01 0.00 -0.24 0.00 -2.81 0.00 0.00 60.65 57.59 1fjc h LYS 34 Cb 1.13 0.00 -0.03 0.00 -1.00 0.00 0.00 32.23 32.33 1fjc h LYS 34 CO 0.10 0.40 -1.20 1.49 -2.81 0.00 0.00 179.45 177.43 1fjc h GLU 35 N 0.00 0.06 0.16 1.90 4.57 -0.04 -2.54 114.58 118.69 1fjc h GLU 35 Ca -0.00 -0.09 -0.29 0.00 -1.18 0.00 0.00 59.36 57.79 1fjc h GLU 35 Cb 1.01 0.04 0.01 0.00 -0.16 0.00 0.00 28.75 29.65 1fjc h GLU 35 CO 0.05 0.95 -1.42 0.28 -1.18 0.00 0.00 179.01 177.69 1fjc h VAL 36 N 0.02 1.12 -1.35 0.32 2.07 -0.45 -3.34 116.25 114.64 1fjc h VAL 36 Ca -0.10 -2.50 -0.70 0.00 0.82 0.00 0.00 66.70 64.22 1fjc h VAL 36 Cb 1.86 2.86 -0.30 0.00 -1.52 0.00 0.00 31.29 34.20 1fjc h VAL 36 CO 0.13 0.77 0.80 0.49 0.02 0.00 0.00 177.57 179.78 1fjc n PHE 37 N -3.83 3.13 0.18 1.57 3.72 0.18 -4.68 117.46 117.73 1fjc n PHE 37 Ca -0.22 -2.75 0.10 0.00 -0.05 0.00 0.00 57.45 54.54 1fjc n PHE 37 Cb 0.97 -1.26 0.56 0.00 -0.94 0.00 0.00 39.48 38.81 1fjc n PHE 37 CO 0.00 0.00 0.00 1.49 -0.05 0.00 0.00 176.76 178.20 1fjc h GLU 38 N 2.37 0.00 -0.70 -1.08 4.22 -1.58 0.12 114.58 117.93 1fjc h GLU 38 Ca 0.57 0.00 0.00 0.00 0.08 0.00 0.00 59.36 60.01 1fjc h GLU 38 Cb 0.58 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.83 1fjc h GLU 38 CO 1.47 0.00 0.00 -3.47 -2.18 0.00 0.00 179.01 174.83 1fjc n ASP 39 N -2.26 4.01 -4.68 1.04 -0.08 -1.26 -4.91 116.55 108.41 1fjc n ASP 39 Ca -0.01 -2.56 -0.24 0.00 -1.51 0.00 0.00 54.79 50.47 1fjc n ASP 39 Cb 0.15 -0.59 -0.08 0.00 2.34 0.00 0.00 41.12 42.93 1fjc n ASP 39 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1fjc s ALA 40 N -2.09 3.36 0.04 -1.67 0.00 0.41 -4.28 121.76 117.53 1fjc s ALA 40 Ca 0.36 -1.98 -0.15 0.00 0.00 0.00 0.00 51.96 50.19 1fjc s ALA 40 Cb 0.27 -0.44 -0.35 0.00 0.00 0.00 0.00 23.12 22.61 1fjc s ALA 40 CO 0.12 -0.00 1.02 -0.07 0.00 0.00 0.00 175.76 176.83 1fjc h LEU 41 N 1.66 0.82 -7.55 0.00 3.38 -0.04 -3.46 115.31 110.13 1fjc h LEU 41 Ca -0.43 -0.87 0.08 0.00 0.09 0.00 0.00 57.88 56.75 1fjc h LEU 41 Cb 1.25 -0.27 -0.09 0.00 0.09 0.00 0.00 40.66 41.65 1fjc h LEU 41 CO 0.67 1.68 0.33 -1.61 0.09 0.00 0.00 178.44 179.60 1fjc s GLU 42 N -2.65 1.39 0.02 1.13 2.02 -1.07 -5.01 118.70 114.52 1fjc s GLU 42 Ca -0.09 -0.69 -0.03 0.00 0.02 0.00 0.00 54.97 54.19 1fjc s GLU 42 Cb 0.04 0.52 -0.01 0.00 0.10 0.00 0.00 34.13 34.78 1fjc s GLU 42 CO 0.94 -0.63 0.03 0.42 0.02 0.00 0.00 175.26 176.05 1fjc s ILE 43 N -3.60 0.11 0.30 -1.63 1.01 -1.26 -0.35 121.20 115.77 1fjc s ILE 43 Ca 0.08 -0.87 0.03 0.00 0.00 0.00 0.00 60.65 59.90 1fjc s ILE 43 Cb -0.03 -0.37 -0.06 0.00 0.01 0.00 0.00 42.46 42.01 1fjc s ILE 43 CO -0.01 -0.48 0.06 -0.60 0.00 0.00 0.00 174.94 173.91 1fjc s ARG 44 N -1.55 1.57 0.34 2.79 3.52 0.55 -4.89 118.95 121.29 1fjc s ARG 44 Ca -0.15 -1.86 0.09 0.00 -0.13 0.00 0.00 55.73 53.68 1fjc s ARG 44 Cb -0.08 -0.73 -0.05 0.00 -1.56 0.00 0.00 34.95 32.53 1fjc s ARG 44 CO -0.01 -0.19 0.08 -1.17 -0.81 0.00 0.00 175.30 173.20 1fjc s LEU 45 N -3.44 3.14 -0.24 -0.88 2.96 -1.26 0.38 118.68 119.35 1fjc s LEU 45 Ca 0.36 -0.87 -0.15 0.00 -0.22 0.00 0.00 54.13 53.25 1fjc s LEU 45 Cb 0.08 -1.57 0.07 0.00 0.50 0.00 0.00 46.19 45.27 1fjc s LEU 45 CO 0.14 -0.27 0.59 -0.69 -1.32 0.00 0.00 176.35 174.80 1fjc s VAL 46 N -2.47 -0.01 0.00 1.68 1.01 0.82 -4.59 120.40 116.84 1fjc s VAL 46 Ca 0.36 0.03 0.00 0.00 0.00 0.00 0.00 61.98 62.37 1fjc s VAL 46 Cb -0.01 -0.85 0.00 0.00 0.00 0.00 0.00 36.38 35.52 1fjc s VAL 46 CO 0.21 0.01 0.00 -1.54 0.00 0.00 0.00 175.10 173.78 1fjc n SER 47 N 3.93 1.87 -0.38 3.32 3.41 -1.26 -0.19 113.62 124.32 1fjc n SER 47 Ca -0.19 -0.09 0.00 0.00 -0.26 0.00 0.00 58.87 58.33 1fjc n SER 47 Cb 0.57 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.52 1fjc n SER 47 CO 0.00 0.00 0.00 1.67 -0.16 0.00 0.00 175.04 176.55 1fjc n GLN 48 N 0.00 3.68 0.00 4.33 7.27 -0.06 -4.68 117.38 127.92 1fjc n GLN 48 Ca 0.00 0.00 0.12 0.00 0.07 0.00 0.00 57.00 57.19 1fjc n GLN 48 Cb 0.00 0.00 0.58 0.00 2.41 0.00 0.00 30.24 33.23 1fjc n GLN 48 CO 0.00 0.00 0.00 -0.25 0.07 0.00 0.00 177.06 176.88 1fjc n ASP 49 N 0.00 0.00 0.00 1.69 9.92 -1.26 -4.44 116.55 122.46 1fjc n ASP 49 Ca 0.00 0.16 0.00 0.00 -0.53 0.00 0.00 54.79 54.42 1fjc n ASP 49 Cb 0.00 -0.37 0.00 0.00 -0.64 0.00 0.00 41.12 40.11 1fjc n ASP 49 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1fjc n GLY 50 N 0.87 -0.09 3.65 0.44 0.00 -1.26 -5.15 105.19 103.64 1fjc n GLY 50 Ca 0.09 0.04 0.03 0.00 0.00 0.00 0.00 46.02 46.18 1fjc n GLY 50 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1fjc s LYS 51 N 0.00 0.03 0.02 1.61 2.20 -1.26 -5.12 119.74 117.21 1fjc s LYS 51 Ca 0.00 0.04 -0.38 0.00 -0.36 0.00 0.00 55.97 55.27 1fjc s LYS 51 Cb 0.00 0.01 -0.19 0.00 -1.51 0.00 0.00 37.83 36.13 1fjc s LYS 51 CO 0.00 -0.01 1.00 0.45 -0.36 0.00 0.00 175.35 176.43 1fjc n SER 52 N 3.00 -0.11 0.00 1.43 2.88 -1.26 -0.89 113.62 118.67 1fjc n SER 52 Ca -0.17 1.13 0.00 0.00 -1.33 0.00 0.00 58.87 58.50 1fjc n SER 52 Cb 0.56 -0.90 0.00 0.00 -0.75 0.00 0.00 64.21 63.12 1fjc n SER 52 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 1fjc n LYS 53 N 1.42 4.28 -0.32 -1.46 4.81 -1.26 -4.62 118.16 121.02 1fjc n LYS 53 Ca 0.19 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.63 1fjc n LYS 53 Cb 0.09 -0.67 0.00 0.00 0.02 0.00 0.00 35.03 34.47 1fjc n LYS 53 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1fjc n GLY 54 N 1.50 1.61 3.63 3.14 0.00 -1.24 -4.65 105.19 109.18 1fjc n GLY 54 Ca 0.00 -0.16 -0.24 0.00 0.00 0.00 0.00 46.02 45.62 1fjc n GLY 54 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1fjc s ILE 55 N -2.00 3.41 0.01 -0.61 -1.09 0.73 -0.77 121.20 120.88 1fjc s ILE 55 Ca 0.00 -1.80 -0.28 0.00 -2.23 0.00 0.00 60.65 56.34 1fjc s ILE 55 Cb 0.00 -2.78 0.10 0.00 -1.58 0.00 0.00 42.46 38.20 1fjc s ILE 55 CO 0.00 -0.28 0.86 0.00 -1.23 0.00 0.00 174.94 174.29 1fjc s ALA 56 N -2.10 -1.80 -0.03 9.38 0.00 0.51 0.28 121.76 128.00 1fjc s ALA 56 Ca 0.29 0.98 0.00 0.00 0.00 0.00 0.00 51.96 53.23 1fjc s ALA 56 Cb -0.07 0.43 -0.04 0.00 0.00 0.00 0.00 23.12 23.44 1fjc s ALA 56 CO 0.19 -0.68 0.01 0.71 0.00 0.00 0.00 175.76 175.98 1fjc s TYR 57 N -3.11 3.13 -0.10 0.00 2.02 0.16 0.27 117.35 119.72 1fjc s TYR 57 Ca 0.04 0.13 -0.02 0.00 -0.37 0.00 0.00 57.07 56.86 1fjc s TYR 57 Cb -0.01 -1.72 0.03 0.00 -0.40 0.00 0.00 41.96 39.87 1fjc s TYR 57 CO -0.09 0.48 0.00 0.42 -1.57 0.00 0.00 175.55 174.79 1fjc s ILE 58 N -1.04 0.45 -0.11 2.71 -1.09 0.19 0.21 121.20 122.52 1fjc s ILE 58 Ca 0.18 -0.05 -0.04 0.00 -2.23 0.00 0.00 60.65 58.52 1fjc s ILE 58 Cb -0.12 -0.67 -0.04 0.00 -1.58 0.00 0.00 42.46 40.06 1fjc s ILE 58 CO 0.08 0.17 0.04 -1.61 -1.23 0.00 0.00 174.94 172.39 1fjc s GLU 59 N 1.93 3.26 0.46 2.79 0.41 0.53 0.14 118.70 128.22 1fjc s GLU 59 Ca 0.04 -0.34 0.05 0.00 -0.41 0.00 0.00 54.97 54.30 1fjc s GLU 59 Cb -0.13 -2.95 -0.04 0.00 -1.78 0.00 0.00 34.13 29.23 1fjc s GLU 59 CO -0.06 0.64 0.06 -0.06 -0.49 0.00 0.00 175.26 175.35 1fjc s PHE 60 N -0.68 2.21 -0.44 1.61 0.40 0.70 0.63 117.98 122.41 1fjc s PHE 60 Ca 0.11 -0.78 0.23 0.00 -0.60 0.00 0.00 56.93 55.89 1fjc s PHE 60 Cb -0.12 -1.75 0.34 0.00 0.51 0.00 0.00 43.02 42.00 1fjc s PHE 60 CO 0.02 0.25 1.60 -0.22 0.70 0.00 0.00 175.22 177.57 1fjc h LYS 61 N 1.48 0.00 -1.92 0.44 3.64 -1.83 -3.41 116.57 114.97 1fjc h LYS 61 Ca -0.43 0.00 0.27 0.00 -1.27 0.00 0.00 60.65 59.22 1fjc h LYS 61 Cb 1.28 0.00 -0.09 0.00 -0.41 0.00 0.00 32.23 33.01 1fjc h LYS 61 CO 0.75 0.00 0.73 -1.54 -2.27 0.00 0.00 179.45 177.12 1fjc s SER 62 N -6.14 -0.06 0.32 4.20 1.04 -1.26 -4.99 113.70 106.80 1fjc s SER 62 Ca 0.07 -0.29 0.01 0.00 0.48 0.00 0.00 55.95 56.22 1fjc s SER 62 Cb 0.05 0.28 0.56 0.00 0.10 0.00 0.00 66.02 67.01 1fjc s SER 62 CO 0.67 -0.53 1.96 -0.08 0.98 0.00 0.00 173.24 176.24 1fjc h GLU 63 N 2.00 0.95 -0.98 4.02 4.81 -1.77 -0.49 114.58 123.12 1fjc h GLU 63 Ca -0.27 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 58.90 1fjc h GLU 63 Cb 1.21 -0.22 -0.05 0.00 0.63 0.00 0.00 28.75 30.32 1fjc h GLU 63 CO 0.29 0.63 0.62 0.00 -0.73 0.00 0.00 179.01 179.83 1fjc h ALA 64 N 1.53 1.25 0.36 2.92 0.00 -1.95 2.07 119.26 125.44 1fjc h ALA 64 Ca 0.32 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 55.12 1fjc h ALA 64 Cb 0.04 -0.40 0.00 0.00 0.00 0.00 0.00 17.79 17.43 1fjc h ALA 64 CO -0.09 0.67 -0.17 -0.44 0.00 0.00 0.00 179.25 179.21 1fjc h ASP 65 N 1.34 -0.41 -0.47 0.00 5.19 -1.60 1.42 116.42 121.90 1fjc h ASP 65 Ca 0.36 -0.13 0.05 0.00 -0.62 0.00 0.00 57.03 56.70 1fjc h ASP 65 Cb -0.11 0.11 -0.03 0.00 0.18 0.00 0.00 39.33 39.48 1fjc h ASP 65 CO -0.07 0.04 0.31 0.00 -3.12 0.00 0.00 179.24 176.40 1fjc h ALA 66 N -0.73 1.91 0.00 3.45 0.00 -0.95 -0.05 119.26 122.89 1fjc h ALA 66 Ca -0.05 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.84 1fjc h ALA 66 Cb 0.51 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.20 1fjc h ALA 66 CO 0.08 0.01 -0.00 1.49 0.00 0.00 0.00 179.25 180.83 1fjc h GLU 67 N 0.41 -0.00 -0.95 0.00 4.57 0.35 -0.12 114.58 118.84 1fjc h GLU 67 Ca 0.20 0.00 0.21 0.00 -1.18 0.00 0.00 59.36 58.60 1fjc h GLU 67 Cb 0.28 0.00 -0.08 0.00 -0.16 0.00 0.00 28.75 28.79 1fjc h GLU 67 CO -0.05 0.92 0.62 -0.22 -1.18 0.00 0.00 179.01 179.10 1fjc h LYS 68 N -0.98 0.43 0.04 1.92 3.11 0.23 0.99 116.57 122.32 1fjc h LYS 68 Ca -0.00 -0.03 -0.00 0.00 -2.81 0.00 0.00 60.65 57.81 1fjc h LYS 68 Cb 0.92 -0.10 0.00 0.00 -1.00 0.00 0.00 32.23 32.06 1fjc h LYS 68 CO 0.00 0.29 -0.02 -0.91 -2.81 0.00 0.00 179.45 176.00 1fjc h ASN 69 N 0.45 -0.05 -0.81 4.20 -0.26 -1.05 -0.09 115.58 117.98 1fjc h ASN 69 Ca 0.51 -0.61 0.23 0.00 -0.56 0.00 0.00 56.30 55.87 1fjc h ASN 69 Cb 1.21 0.01 -0.03 0.00 -1.06 0.00 0.00 38.32 38.45 1fjc h ASN 69 CO -0.22 0.70 0.69 0.25 -1.06 0.00 0.00 177.43 177.79 1fjc h LEU 70 N -0.92 0.00 0.03 1.61 7.12 0.13 2.36 115.31 125.64 1fjc h LEU 70 Ca -0.01 0.00 -0.27 0.00 0.13 0.00 0.00 57.88 57.73 1fjc h LEU 70 Cb 0.65 0.00 -0.03 0.00 -0.53 0.00 0.00 40.66 40.75 1fjc h LEU 70 CO 0.01 0.00 -1.49 1.21 -0.13 0.00 0.00 178.44 178.04 1fjc n GLU 71 N -3.94 0.61 -0.97 1.25 2.13 0.23 -3.22 120.64 116.74 1fjc n GLU 71 Ca 0.17 0.49 -0.04 0.00 0.66 0.00 0.00 57.16 58.43 1fjc n GLU 71 Cb 0.97 -1.73 0.30 0.00 0.27 0.00 0.00 31.44 31.25 1fjc n GLU 71 CO 0.00 0.00 0.00 -1.91 -0.41 0.00 0.00 177.13 174.81 1fjc n GLU 72 N -4.20 3.61 0.00 5.31 2.13 -0.05 -4.48 120.64 122.96 1fjc n GLU 72 Ca -0.33 -3.09 0.00 0.00 0.66 0.00 0.00 57.16 54.40 1fjc n GLU 72 Cb 0.78 -2.17 0.00 0.00 0.27 0.00 0.00 31.44 30.32 1fjc n GLU 72 CO 0.00 0.00 0.00 1.17 -0.41 0.00 0.00 177.13 177.89 1fjc n LYS 73 N -0.22 0.00 -1.50 5.31 3.00 0.79 -4.90 118.16 120.64 1fjc n LYS 73 Ca 0.39 0.00 -0.26 0.00 -0.00 0.00 0.00 58.31 58.44 1fjc n LYS 73 Cb 1.33 -0.44 -0.21 0.00 0.00 0.00 0.00 35.03 35.71 1fjc n LYS 73 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.40 178.34 1fjc n GLN 74 N -1.27 0.03 0.00 1.64 -0.06 -0.95 -0.23 117.38 116.55 1fjc n GLN 74 Ca 0.00 -0.04 0.00 0.00 -2.00 0.00 0.00 57.00 54.96 1fjc n GLN 74 Cb 0.00 -1.24 0.00 0.00 -4.06 0.00 0.00 30.24 24.94 1fjc n GLN 74 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1fjc n GLY 75 N 5.76 2.99 2.94 1.69 0.00 0.22 -4.92 105.19 113.87 1fjc n GLY 75 Ca 0.66 -0.77 0.00 0.00 0.00 0.00 0.00 46.02 45.91 1fjc n GLY 75 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fjc n ALA 76 N 0.00 -1.56 -1.56 4.61 0.00 0.69 0.27 120.51 122.96 1fjc n ALA 76 Ca 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 53.44 53.29 1fjc n ALA 76 Cb 0.00 -0.46 -0.08 0.00 0.00 0.00 0.00 19.45 18.91 1fjc n ALA 76 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1fjc n GLU 77 N 1.71 0.56 -4.33 0.00 1.02 -1.25 -3.87 120.64 114.47 1fjc n GLU 77 Ca 0.00 -0.76 -0.19 0.00 -0.02 0.00 0.00 57.16 56.19 1fjc n GLU 77 Cb 0.28 -3.55 -0.09 0.00 -0.02 0.00 0.00 31.44 28.07 1fjc n GLU 77 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1fjc s ILE 78 N 13.98 0.24 -1.18 -3.67 1.01 0.13 -4.82 121.20 126.89 1fjc s ILE 78 Ca 0.95 -2.00 -0.15 0.00 0.00 0.00 0.00 60.65 59.46 1fjc s ILE 78 Cb -0.17 -2.49 0.14 0.00 0.01 0.00 0.00 42.46 39.95 1fjc s ILE 78 CO 0.12 0.00 0.38 -0.67 0.00 0.00 0.00 174.94 174.77 1fjc n ASP 79 N -1.07 -1.66 -3.08 3.58 2.03 -1.26 0.26 116.55 115.35 1fjc n ASP 79 Ca 0.02 -0.57 -0.23 0.00 0.52 0.00 0.00 54.79 54.53 1fjc n ASP 79 Cb 0.64 -1.48 0.03 0.00 -0.72 0.00 0.00 41.12 39.59 1fjc n ASP 79 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1fjc n GLY 80 N -0.87 -0.52 0.00 0.27 0.00 -1.26 -4.87 105.19 97.94 1fjc n GLY 80 Ca 0.07 0.13 0.00 0.00 0.00 0.00 0.00 46.02 46.22 1fjc n GLY 80 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1fjc n ARG 81 N -4.02 0.00 -4.02 1.61 1.85 0.73 -5.17 116.66 107.65 1fjc n ARG 81 Ca -0.10 0.00 -0.10 0.00 -1.00 0.00 0.00 57.85 56.65 1fjc n ARG 81 Cb 0.61 0.00 -0.11 0.00 -1.05 0.00 0.00 32.46 31.91 1fjc n ARG 81 CO 0.00 0.00 0.00 -1.12 -0.01 0.00 0.00 177.63 176.50 1fjc s SER 82 N 2.00 0.47 -0.20 2.89 0.01 -1.26 0.19 113.70 117.80 1fjc s SER 82 Ca 0.00 -0.57 -0.07 0.00 1.31 0.00 0.00 55.95 56.61 1fjc s SER 82 Cb 0.00 0.09 -0.04 0.00 0.21 0.00 0.00 66.02 66.28 1fjc s SER 82 CO 0.00 -0.30 0.07 -0.69 0.41 0.00 0.00 173.24 172.72 1fjc s VAL 83 N -1.72 4.71 0.56 3.43 1.01 0.77 -4.47 120.40 124.68 1fjc s VAL 83 Ca -0.11 -0.06 -0.16 0.00 0.00 0.00 0.00 61.98 61.65 1fjc s VAL 83 Cb -0.08 -3.14 -0.06 0.00 0.00 0.00 0.00 36.38 33.10 1fjc s VAL 83 CO -0.01 0.43 1.02 -0.44 0.00 0.00 0.00 175.10 176.09 1fjc s SER 84 N 0.67 6.19 -0.14 3.32 0.01 0.44 0.73 113.70 124.92 1fjc s SER 84 Ca 0.03 1.69 0.01 0.00 1.31 0.00 0.00 55.95 58.99 1fjc s SER 84 Cb -0.13 -2.52 0.02 0.00 0.21 0.00 0.00 66.02 63.60 1fjc s SER 84 CO 0.02 -0.89 -0.14 -0.76 0.41 0.00 0.00 173.24 171.88 1fjc s LEU 85 N -4.31 1.68 -0.30 2.44 1.43 -1.26 -0.78 118.68 117.57 1fjc s LEU 85 Ca 0.61 -0.47 0.00 0.00 -1.03 0.00 0.00 54.13 53.24 1fjc s LEU 85 Cb -0.13 -1.16 0.06 0.00 0.03 0.00 0.00 46.19 45.00 1fjc s LEU 85 CO 0.35 -0.05 -0.01 -0.31 0.23 0.00 0.00 176.35 176.56 1fjc s TYR 86 N 1.41 3.35 -0.85 0.29 1.51 0.73 -4.87 117.35 118.92 1fjc s TYR 86 Ca 0.03 -2.19 0.06 0.00 -1.01 0.00 0.00 57.07 53.96 1fjc s TYR 86 Cb -0.13 -2.24 0.30 0.00 -0.11 0.00 0.00 41.96 39.77 1fjc s TYR 86 CO -0.09 -0.86 1.19 0.66 -1.11 0.00 0.00 175.55 175.33 1fjc n TYR 87 N 4.52 0.14 -1.89 2.71 4.02 -1.26 0.26 117.16 125.66 1fjc n TYR 87 Ca -0.11 0.07 -0.03 0.00 -0.01 0.00 0.00 57.90 57.82 1fjc n TYR 87 Cb 0.43 -0.62 -0.00 0.00 -0.02 0.00 0.00 39.34 39.13 1fjc n TYR 87 CO 0.00 0.00 0.00 -2.37 -1.01 0.00 0.00 176.86 173.48 1fjc n THR 88 N -1.65 -0.13 0.00 -0.72 5.66 -1.26 -3.95 114.28 112.23 1fjc n THR 88 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 1fjc n THR 88 Cb 0.03 -0.87 0.00 0.00 -1.55 0.00 0.00 70.33 67.95 1fjc n THR 88 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1fjc n GLY 89 N -1.29 1.11 2.71 1.09 0.00 -1.26 -2.69 105.19 104.87 1fjc n GLY 89 Ca -0.04 0.33 -0.06 0.00 0.00 0.00 0.00 46.02 46.25 1fjc n GLY 89 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1fjc n GLU 90 N 0.00 1.31 0.00 1.61 1.02 -1.26 -4.67 120.64 118.65 1fjc n GLU 90 Ca 0.00 -3.21 0.00 0.00 -0.02 0.00 0.00 57.16 53.93 1fjc n GLU 90 Cb 0.00 -1.25 0.00 0.00 -0.02 0.00 0.00 31.44 30.17 1fjc n GLU 90 CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 1fjc n LYS 91 N -0.26 1.90 -1.35 3.49 4.81 -1.09 -4.59 118.16 121.07 1fjc n LYS 91 Ca 0.07 0.00 -0.38 0.00 -0.87 0.00 0.00 58.31 57.13 1fjc n LYS 91 Cb 0.82 -0.83 0.03 0.00 0.02 0.00 0.00 35.03 35.07 1fjc n LYS 91 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1fjc n GLY 92 N 1.88 -2.20 0.85 3.14 0.00 -1.24 -3.74 105.19 103.89 1fjc n GLY 92 Ca 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 46.02 45.79 1fjc n GLY 92 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1fjc n GLY 93 N 2.07 0.74 3.60 -0.02 0.00 -1.00 -2.73 105.19 107.85 1fjc n GLY 93 Ca 0.10 -0.40 -0.43 0.00 0.00 0.00 0.00 46.02 45.29 1fjc n GLY 93 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1fjc s THR 94 N -2.52 3.46 0.15 2.61 -1.32 -1.24 -4.90 115.64 111.88 1fjc s THR 94 Ca 0.00 0.47 -0.30 0.00 -1.21 0.00 0.00 61.69 60.65 1fjc s THR 94 Cb 0.00 -3.62 -0.17 0.00 -1.51 0.00 0.00 72.50 67.20 1fjc s THR 94 CO 0.00 -0.39 0.64 -2.11 -2.21 0.00 0.00 174.62 170.54 1fjc n ARG 95 N 8.43 0.00 0.00 7.08 1.85 -1.26 -5.21 116.66 127.55 1fjc n ARG 95 Ca 0.23 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 57.08 1fjc n ARG 95 Cb 0.47 -1.10 0.00 0.00 -1.05 0.00 0.00 32.46 30.78 1fjc n ARG 95 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03