#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1sj1 s TRP 2 N 0.00 2.39 -0.01 0.00 0.51 -0.66 -2.04 118.94 119.12 1sj1 s TRP 2 Ca 0.00 -0.33 0.03 0.00 -2.12 0.00 0.00 56.10 53.68 1sj1 s TRP 2 Cb 0.00 -1.26 -0.01 0.00 -0.81 0.00 0.00 33.47 31.40 1sj1 s TRP 2 CO 0.00 0.39 -0.10 0.15 -0.51 0.00 0.00 176.95 176.88 1sj1 s LYS 3 N -2.25 0.87 -0.10 4.98 3.01 -0.17 -0.48 119.74 125.61 1sj1 s LYS 3 Ca 0.17 -0.35 -0.00 0.00 -1.01 0.00 0.00 55.97 54.77 1sj1 s LYS 3 Cb -0.10 -0.83 -0.03 0.00 -1.01 0.00 0.00 37.83 35.87 1sj1 s LYS 3 CO 0.08 0.20 -0.07 0.54 0.51 0.00 0.00 175.35 176.61 1sj1 s VAL 4 N -0.14 3.63 -0.01 3.17 0.11 -1.26 -1.02 120.40 124.87 1sj1 s VAL 4 Ca 0.02 -0.49 0.04 0.00 -2.93 0.00 0.00 61.98 58.62 1sj1 s VAL 4 Cb -0.05 -2.51 -0.01 0.00 -1.53 0.00 0.00 36.38 32.28 1sj1 s VAL 4 CO -0.00 0.56 -0.12 -0.44 -3.33 0.00 0.00 175.10 171.77 1sj1 s SER 5 N -0.36 1.47 -0.21 3.54 0.01 0.21 -4.76 113.70 113.60 1sj1 s SER 5 Ca 0.05 -0.23 0.01 0.00 1.31 0.00 0.00 55.95 57.09 1sj1 s SER 5 Cb -0.12 -0.22 0.03 0.00 0.21 0.00 0.00 66.02 65.91 1sj1 s SER 5 CO 0.02 0.14 -0.15 -0.69 0.41 0.00 0.00 173.24 172.97 1sj1 s VAL 6 N -0.19 2.27 -0.33 3.43 1.01 -1.26 -1.37 120.40 123.95 1sj1 s VAL 6 Ca 0.03 -1.07 -0.29 0.00 0.00 0.00 0.00 61.98 60.65 1sj1 s VAL 6 Cb -0.06 -2.07 -0.01 0.00 0.00 0.00 0.00 36.38 34.25 1sj1 s VAL 6 CO -0.00 0.37 1.54 -0.62 0.00 0.00 0.00 175.10 176.39 1sj1 s ASP 7 N 1.27 6.28 0.38 3.32 -1.08 -0.46 -4.88 116.67 121.50 1sj1 s ASP 7 Ca 0.01 1.18 0.18 0.00 -0.52 0.00 0.00 52.55 53.40 1sj1 s ASP 7 Cb -0.15 -2.53 0.77 0.00 -1.46 0.00 0.00 42.92 39.54 1sj1 s ASP 7 CO -0.10 -1.41 1.79 1.56 0.52 0.00 0.00 175.17 177.53 1sj1 h GLN 8 N 11.05 0.00 -0.00 4.34 1.08 -1.90 -1.30 115.11 128.37 1sj1 h GLN 8 Ca -0.30 0.00 -0.16 0.00 -1.45 0.00 0.00 58.65 56.73 1sj1 h GLN 8 Cb 1.13 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 28.54 1sj1 h GLN 8 CO 1.05 0.36 -0.78 0.22 -0.95 0.00 0.00 178.83 178.73 1sj1 h ASP 9 N 0.00 0.01 0.37 1.46 3.58 -2.00 -3.33 116.42 116.52 1sj1 h ASP 9 Ca -0.00 -0.01 -0.09 0.00 0.42 0.00 0.00 57.03 57.35 1sj1 h ASP 9 Cb 0.78 -0.00 -0.02 0.00 1.72 0.00 0.00 39.33 41.81 1sj1 h ASP 9 CO 0.05 0.78 -1.71 0.35 -2.88 0.00 0.00 179.24 175.84 1sj1 n THR 10 N -3.62 0.58 -1.72 2.25 -2.24 -1.05 -4.89 114.28 103.59 1sj1 n THR 10 Ca -0.01 -0.60 -0.43 0.00 -2.27 0.00 0.00 64.05 60.74 1sj1 n THR 10 Cb 0.75 -0.29 -0.02 0.00 -2.10 0.00 0.00 70.33 68.67 1sj1 n THR 10 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1sj1 n ILE 12 N 2.41 1.00 -3.18 0.00 -5.35 -1.26 -4.98 119.36 108.00 1sj1 n ILE 12 Ca 0.11 -1.00 -0.18 0.00 -0.27 0.00 0.00 62.75 61.41 1sj1 n ILE 12 Cb 0.35 0.50 0.05 0.00 -1.74 0.00 0.00 39.64 38.80 1sj1 n ILE 12 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1sj1 n GLY 13 N 0.64 -0.21 0.29 3.28 0.00 -1.25 -4.93 105.19 103.02 1sj1 n GLY 13 Ca 0.13 -0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.10 1sj1 n GLY 13 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 1sj1 h ASP 14 N -1.75 0.84 0.00 1.61 1.82 -1.94 -3.47 116.42 113.53 1sj1 h ASP 14 Ca -0.43 -0.02 0.00 0.00 -0.39 0.00 0.00 57.03 56.19 1sj1 h ASP 14 Cb 1.28 -0.21 0.00 0.00 0.68 0.00 0.00 39.33 41.09 1sj1 h ASP 14 CO 0.43 0.60 0.00 0.00 -1.61 0.00 0.00 179.24 178.66 1sj1 n ALA 15 N -2.30 0.00 0.26 -0.78 0.00 -1.26 -4.90 120.51 111.53 1sj1 n ALA 15 Ca 0.07 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.64 1sj1 n ALA 15 Cb 0.02 0.00 0.68 0.00 0.00 0.00 0.00 19.45 20.15 1sj1 n ALA 15 CO 0.00 0.00 0.00 0.97 0.00 0.00 0.00 177.50 178.47 1sj1 h ILE 16 N 0.00 0.51 -0.30 0.00 2.10 -1.96 -1.77 117.51 116.08 1sj1 h ILE 16 Ca 0.00 -0.67 -0.06 0.00 1.08 0.00 0.00 64.86 65.22 1sj1 h ILE 16 Cb 0.00 1.45 -0.01 0.00 -1.09 0.00 0.00 36.82 37.17 1sj1 h ILE 16 CO 0.00 0.13 -0.03 0.00 -1.08 0.00 0.00 178.15 177.17 1sj1 h ALA 18 N 0.82 1.44 -0.30 0.00 0.00 -1.68 -0.06 119.26 119.48 1sj1 h ALA 18 Ca 0.08 -0.20 -0.11 0.00 0.00 0.00 0.00 54.91 54.68 1sj1 h ALA 18 Cb 0.50 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 1sj1 h ALA 18 CO 0.02 0.39 -0.26 0.77 0.00 0.00 0.00 179.25 180.18 1sj1 h SER 19 N 0.38 0.75 0.52 0.00 0.02 -1.10 -2.60 113.55 111.51 1sj1 h SER 19 Ca 0.08 -0.46 -0.19 0.00 -0.84 0.00 0.00 61.79 60.38 1sj1 h SER 19 Cb 0.34 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.66 1sj1 h SER 19 CO 0.01 1.05 -0.85 -0.07 -1.14 0.00 0.00 176.83 175.83 1sj1 h LEU 20 N 0.45 0.30 -5.90 5.07 3.38 -1.00 -3.41 115.31 114.19 1sj1 h LEU 20 Ca 0.05 -0.23 -0.47 0.00 0.09 0.00 0.00 57.88 57.32 1sj1 h LEU 20 Cb 0.82 -0.09 -0.32 0.00 0.09 0.00 0.00 40.66 41.16 1sj1 h LEU 20 CO 0.07 1.01 -0.88 0.00 0.09 0.00 0.00 178.44 178.73 1sj1 n PRO 22 N 2.40 0.18 0.23 0.00 -0.04 -0.98 -1.20 135.00 135.59 1sj1 n PRO 22 Ca 0.24 0.36 0.14 0.00 -0.04 0.00 0.00 63.50 64.21 1sj1 n PRO 22 Cb 0.52 -1.81 0.44 0.00 -0.04 0.00 0.00 33.50 32.61 1sj1 n PRO 22 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 1sj1 h ASP 23 N 0.00 0.00 0.00 3.54 3.32 -1.94 -3.35 116.42 117.99 1sj1 h ASP 23 Ca 0.00 0.00 -0.13 0.00 0.02 0.00 0.00 57.03 56.92 1sj1 h ASP 23 Cb 0.41 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.94 1sj1 h ASP 23 CO 0.00 0.00 -1.48 0.52 -1.72 0.00 0.00 179.24 176.56 1sj1 n VAL 24 N -2.98 0.48 -4.85 -1.35 0.31 -0.95 -4.69 118.33 104.31 1sj1 n VAL 24 Ca 0.02 -0.19 -0.33 0.00 -0.01 0.00 0.00 64.34 63.83 1sj1 n VAL 24 Cb 0.40 -0.80 -0.13 0.00 -0.91 0.00 0.00 33.84 32.40 1sj1 n VAL 24 CO 0.00 0.00 0.00 -0.36 -1.32 0.00 0.00 176.83 175.15 1sj1 s PHE 25 N -2.17 2.74 0.17 3.52 0.08 -0.34 -0.02 117.98 121.95 1sj1 s PHE 25 Ca -0.11 -0.18 0.06 0.00 0.12 0.00 0.00 56.93 56.82 1sj1 s PHE 25 Cb 0.03 -1.66 -0.04 0.00 -0.57 0.00 0.00 43.02 40.77 1sj1 s PHE 25 CO 0.20 0.16 -0.12 -1.83 -0.10 0.00 0.00 175.22 173.53 1sj1 s GLU 26 N -0.63 1.16 0.14 0.44 -1.05 -0.70 -4.52 118.70 113.53 1sj1 s GLU 26 Ca 0.09 -1.49 -0.14 0.00 -0.15 0.00 0.00 54.97 53.28 1sj1 s GLU 26 Cb -0.11 -0.84 -0.07 0.00 -0.44 0.00 0.00 34.13 32.67 1sj1 s GLU 26 CO 0.01 0.13 0.54 -1.64 0.95 0.00 0.00 175.26 175.25 1sj1 s MET 27 N -3.62 3.97 0.49 -4.83 -1.94 -1.26 -0.80 119.30 111.30 1sj1 s MET 27 Ca 0.18 0.48 0.04 0.00 -1.71 0.00 0.00 55.69 54.68 1sj1 s MET 27 Cb 0.01 -2.95 0.04 0.00 2.01 0.00 0.00 34.83 33.94 1sj1 s MET 27 CO 0.03 0.49 0.36 0.27 -0.01 0.00 0.00 175.02 176.16 1sj1 n ASN 28 N 0.85 2.60 0.00 3.03 0.23 -0.08 -4.92 115.26 116.96 1sj1 n ASN 28 Ca -0.06 -2.71 0.10 0.00 -0.53 0.00 0.00 54.58 51.38 1sj1 n ASN 28 Cb 0.52 -0.03 0.49 0.00 -2.08 0.00 0.00 39.78 38.68 1sj1 n ASN 28 CO 0.00 0.00 0.00 0.47 -0.93 0.00 0.00 177.26 176.80 1sj1 n ASP 29 N -1.84 0.00 -0.92 0.53 8.00 -1.26 -1.35 116.55 119.72 1sj1 n ASP 29 Ca -0.02 0.08 0.12 0.00 0.71 0.00 0.00 54.79 55.68 1sj1 n ASP 29 Cb 0.56 -0.32 0.23 0.00 -0.02 0.00 0.00 41.12 41.57 1sj1 n ASP 29 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1sj1 n GLU 30 N -1.32 2.23 -1.54 -1.24 4.71 -1.26 -4.96 120.64 117.27 1sj1 n GLU 30 Ca 0.09 -1.82 -0.05 0.00 -0.01 0.00 0.00 57.16 55.37 1sj1 n GLU 30 Cb 0.17 -1.47 -0.01 0.00 -1.01 0.00 0.00 31.44 29.11 1sj1 n GLU 30 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1sj1 n GLY 31 N 1.35 0.50 3.64 0.62 0.00 -0.45 -5.03 105.19 105.82 1sj1 n GLY 31 Ca 0.17 -0.79 -0.25 0.00 0.00 0.00 0.00 46.02 45.14 1sj1 n GLY 31 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1sj1 s LYS 32 N -3.16 2.30 0.50 1.61 -0.14 -1.26 -3.77 119.74 115.81 1sj1 s LYS 32 Ca 0.00 -1.25 -0.11 0.00 -1.36 0.00 0.00 55.97 53.26 1sj1 s LYS 32 Cb 0.00 -2.25 -0.05 0.00 -1.68 0.00 0.00 37.83 33.85 1sj1 s LYS 32 CO 0.00 0.42 0.88 0.00 -0.76 0.00 0.00 175.35 175.89 1sj1 s ALA 33 N -1.93 3.25 0.09 5.17 0.00 -1.26 -0.90 121.76 126.17 1sj1 s ALA 33 Ca 0.28 -0.17 -0.17 0.00 0.00 0.00 0.00 51.96 51.91 1sj1 s ALA 33 Cb -0.08 -2.85 0.03 0.00 0.00 0.00 0.00 23.12 20.22 1sj1 s ALA 33 CO 0.18 -0.30 0.40 1.14 0.00 0.00 0.00 175.76 177.18 1sj1 s GLN 34 N -4.41 0.99 0.23 0.00 -2.07 0.02 -4.79 119.66 109.63 1sj1 s GLN 34 Ca 0.53 -0.57 -0.30 0.00 -1.82 0.00 0.00 55.36 53.20 1sj1 s GLN 34 Cb -0.10 0.44 -0.09 0.00 -1.09 0.00 0.00 33.01 32.17 1sj1 s GLN 34 CO 0.40 -0.37 1.16 -1.25 -1.32 0.00 0.00 175.29 173.91 1sj1 s PRO 35 N -3.23 4.55 0.25 9.60 0.05 -1.26 -1.72 135.00 143.23 1sj1 s PRO 35 Ca -0.01 1.85 0.25 0.00 0.05 0.00 0.00 61.00 63.15 1sj1 s PRO 35 Cb 0.01 -3.21 0.59 0.00 0.05 0.00 0.00 34.50 31.93 1sj1 s PRO 35 CO -0.08 0.03 1.63 0.87 0.05 0.00 0.00 177.00 179.51 1sj1 h LYS 36 N 4.58 0.00 -4.57 4.56 1.57 -0.73 -3.46 116.57 118.52 1sj1 h LYS 36 Ca -0.46 0.00 -0.32 0.00 -1.87 0.00 0.00 60.65 58.01 1sj1 h LYS 36 Cb 1.21 0.00 -0.25 0.00 0.08 0.00 0.00 32.23 33.28 1sj1 h LYS 36 CO 0.71 0.00 -0.75 0.14 -0.57 0.00 0.00 179.45 178.98 1sj1 s VAL 37 N -3.15 0.57 -1.28 0.50 -7.23 -1.26 -5.05 120.40 103.50 1sj1 s VAL 37 Ca 0.09 -0.73 0.24 0.00 -1.81 0.00 0.00 61.98 59.77 1sj1 s VAL 37 Cb 0.11 -0.56 0.01 0.00 0.56 0.00 0.00 36.38 36.50 1sj1 s VAL 37 CO 0.64 -0.13 1.31 -0.62 -0.31 0.00 0.00 175.10 175.99 1sj1 n GLU 38 N 2.11 0.32 -3.73 4.82 4.71 -1.26 -4.79 120.64 122.82 1sj1 n GLU 38 Ca -0.18 -0.21 -0.14 0.00 -0.01 0.00 0.00 57.16 56.61 1sj1 n GLU 38 Cb 0.56 -1.50 -0.08 0.00 -1.01 0.00 0.00 31.44 29.41 1sj1 n GLU 38 CO 0.00 0.00 0.00 0.08 0.09 0.00 0.00 177.13 177.30 1sj1 s VAL 39 N -2.83 0.05 -0.10 2.62 1.01 -1.26 -4.71 120.40 115.17 1sj1 s VAL 39 Ca 0.14 -0.38 -0.01 0.00 0.00 0.00 0.00 61.98 61.73 1sj1 s VAL 39 Cb 0.18 -0.66 0.03 0.00 0.00 0.00 0.00 36.38 35.93 1sj1 s VAL 39 CO 0.68 -0.21 -0.03 -0.63 0.00 0.00 0.00 175.10 174.91 1sj1 s ILE 40 N -1.21 0.71 -0.02 2.22 1.09 0.37 -4.97 121.20 119.39 1sj1 s ILE 40 Ca -0.12 -0.15 0.11 0.00 -1.10 0.00 0.00 60.65 59.39 1sj1 s ILE 40 Cb -0.04 -0.83 -0.17 0.00 -1.06 0.00 0.00 42.46 40.35 1sj1 s ILE 40 CO 0.05 0.27 0.23 -0.62 -0.10 0.00 0.00 174.94 174.76 1sj1 n GLU 41 N 5.04 0.52 -2.07 2.79 1.02 -1.26 -1.66 120.64 125.01 1sj1 n GLU 41 Ca -0.10 -0.09 -0.42 0.00 -0.02 0.00 0.00 57.16 56.53 1sj1 n GLU 41 Cb 0.50 -1.27 -0.03 0.00 -0.02 0.00 0.00 31.44 30.62 1sj1 n GLU 41 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 1sj1 s ASP 42 N -3.38 6.72 0.27 1.62 -1.08 -1.26 -4.91 116.67 114.64 1sj1 s ASP 42 Ca -0.04 2.20 -0.03 0.00 -0.52 0.00 0.00 52.55 54.16 1sj1 s ASP 42 Cb 0.07 -2.54 0.38 0.00 -1.46 0.00 0.00 42.92 39.36 1sj1 s ASP 42 CO 0.46 -0.87 1.90 -0.33 0.52 0.00 0.00 175.17 176.86 1sj1 h GLU 43 N 8.92 1.19 -0.66 4.34 3.07 -1.99 0.20 114.58 129.65 1sj1 h GLU 43 Ca -0.38 -0.07 -0.08 0.00 -0.50 0.00 0.00 59.36 58.32 1sj1 h GLU 43 Cb 1.17 -0.27 -0.03 0.00 -0.84 0.00 0.00 28.75 28.79 1sj1 h GLU 43 CO 0.94 0.79 0.08 1.49 -1.40 0.00 0.00 179.01 180.91 1sj1 h GLU 44 N 1.22 1.10 -0.35 2.33 4.81 -1.99 0.55 114.58 122.25 1sj1 h GLU 44 Ca 0.41 -0.31 -0.11 0.00 -0.13 0.00 0.00 59.36 59.22 1sj1 h GLU 44 Cb 0.06 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 29.31 1sj1 h GLU 44 CO -0.14 1.02 -0.22 -0.07 -0.73 0.00 0.00 179.01 178.88 1sj1 h LEU 45 N 1.02 0.80 -0.23 1.64 3.38 -1.87 -0.91 115.31 119.14 1sj1 h LEU 45 Ca 0.20 -0.43 0.04 0.00 0.09 0.00 0.00 57.88 57.78 1sj1 h LEU 45 Cb 0.47 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.97 1sj1 h LEU 45 CO 0.02 1.05 0.02 0.22 0.09 0.00 0.00 178.44 179.84 1sj1 h TYR 46 N 0.55 0.02 -0.87 1.13 3.20 -0.67 -0.02 116.97 120.32 1sj1 h TYR 46 Ca 0.07 0.02 0.03 0.00 3.14 0.00 0.00 58.73 61.98 1sj1 h TYR 46 Cb 0.77 0.02 -0.05 0.00 1.54 0.00 0.00 36.73 39.02 1sj1 h TYR 46 CO 0.06 -0.01 0.57 -0.91 -1.64 0.00 0.00 178.16 176.23 1sj1 h ASN 47 N 0.10 0.95 0.08 -2.11 2.35 -0.73 -0.68 115.58 115.54 1sj1 h ASN 47 Ca 0.11 -0.02 -0.00 0.00 -0.55 0.00 0.00 56.30 55.84 1sj1 h ASN 47 Cb 0.13 -0.23 0.00 0.00 0.05 0.00 0.00 38.32 38.27 1sj1 h ASN 47 CO -0.17 0.67 -0.04 0.00 -1.65 0.00 0.00 177.43 176.24 1sj1 h ALA 49 N 0.66 0.91 -0.63 0.00 0.00 -0.29 0.30 119.26 120.21 1sj1 h ALA 49 Ca -0.01 0.13 -0.05 0.00 0.00 0.00 0.00 54.91 54.98 1sj1 h ALA 49 Cb 0.21 0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.12 1sj1 h ALA 49 CO 0.02 -0.27 0.20 -0.22 0.00 0.00 0.00 179.25 178.98 1sj1 h LYS 50 N 0.34 0.95 -0.54 0.00 3.11 -1.01 0.36 116.57 119.79 1sj1 h LYS 50 Ca 0.38 -0.18 -0.00 0.00 -2.81 0.00 0.00 60.65 58.03 1sj1 h LYS 50 Cb 0.59 -0.15 -0.03 0.00 -1.00 0.00 0.00 32.23 31.64 1sj1 h LYS 50 CO -0.43 0.81 0.32 1.49 -2.81 0.00 0.00 179.45 178.84 1sj1 h GLU 51 N 0.93 0.73 -0.39 1.90 4.81 0.31 -1.25 114.58 121.61 1sj1 h GLU 51 Ca 0.21 -0.07 -0.04 0.00 -0.13 0.00 0.00 59.36 59.33 1sj1 h GLU 51 Cb 0.25 -0.15 -0.02 0.00 0.63 0.00 0.00 28.75 29.47 1sj1 h GLU 51 CO -0.01 0.53 0.09 0.00 -0.73 0.00 0.00 179.01 178.89 1sj1 h ALA 52 N 1.16 0.52 -0.77 2.92 0.00 -0.71 -1.76 119.26 120.62 1sj1 h ALA 52 Ca 0.19 -0.19 0.08 0.00 0.00 0.00 0.00 54.91 54.99 1sj1 h ALA 52 Cb -0.01 -0.15 -0.07 0.00 0.00 0.00 0.00 17.79 17.56 1sj1 h ALA 52 CO -0.04 0.20 0.44 1.98 0.00 0.00 0.00 179.25 181.83 1sj1 h MET 53 N 0.49 0.75 0.00 0.00 1.85 -0.81 -1.72 114.93 115.49 1sj1 h MET 53 Ca 0.12 -0.04 -0.04 0.00 -0.61 0.00 0.00 59.70 59.13 1sj1 h MET 53 Cb 0.31 -0.17 -0.01 0.00 0.43 0.00 0.00 31.60 32.17 1sj1 h MET 53 CO 0.00 0.49 -0.19 0.93 -0.40 0.00 0.00 176.91 177.74 1sj1 h GLU 54 N 0.77 0.00 0.00 0.39 5.08 -0.85 -3.25 114.58 116.72 1sj1 h GLU 54 Ca 0.36 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.65 1sj1 h GLU 54 Cb 0.28 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.52 1sj1 h GLU 54 CO -0.22 0.19 -1.32 0.00 -1.00 0.00 0.00 179.01 176.66 1sj1 n ALA 55 N -2.20 2.33 -1.69 3.43 0.00 -0.69 -4.93 120.51 116.75 1sj1 n ALA 55 Ca 0.00 -0.41 -0.43 0.00 0.00 0.00 0.00 53.44 52.60 1sj1 n ALA 55 Cb 0.43 -0.98 -0.03 0.00 0.00 0.00 0.00 19.45 18.87 1sj1 n ALA 55 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1sj1 n PRO 57 N 4.77 0.12 -0.03 0.00 -0.04 -1.26 -3.09 135.00 135.48 1sj1 n PRO 57 Ca 0.17 0.27 0.01 0.00 -0.04 0.00 0.00 63.50 63.91 1sj1 n PRO 57 Cb 0.34 -1.70 0.02 0.00 -0.04 0.00 0.00 33.50 32.13 1sj1 n PRO 57 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 1sj1 n VAL 58 N -1.92 0.73 -3.64 0.52 0.24 -1.26 -5.03 118.33 107.97 1sj1 n VAL 58 Ca 0.04 -0.87 -0.21 0.00 -2.04 0.00 0.00 64.34 61.27 1sj1 n VAL 58 Cb 0.27 0.65 0.05 0.00 -1.47 0.00 0.00 33.84 33.34 1sj1 n VAL 58 CO 0.00 0.00 0.00 -1.20 -2.14 0.00 0.00 176.83 173.49 1sj1 n SER 59 N -0.19 -1.72 0.04 -1.34 7.64 -1.18 -4.92 113.62 111.96 1sj1 n SER 59 Ca 0.02 -0.76 0.12 0.00 1.01 0.00 0.00 58.87 59.27 1sj1 n SER 59 Cb 0.22 -4.35 0.30 0.00 -1.01 0.00 0.00 64.21 59.37 1sj1 n SER 59 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1sj1 n ALA 60 N -4.28 2.89 -2.77 -0.43 0.00 -1.26 -4.90 120.51 109.75 1sj1 n ALA 60 Ca -0.27 -0.22 -0.34 0.00 0.00 0.00 0.00 53.44 52.61 1sj1 n ALA 60 Cb 0.66 -1.25 -0.11 0.00 0.00 0.00 0.00 19.45 18.75 1sj1 n ALA 60 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1sj1 s ILE 61 N -3.09 4.06 0.13 0.00 1.01 -1.26 -1.35 121.20 120.70 1sj1 s ILE 61 Ca 0.09 -0.32 0.07 0.00 0.00 0.00 0.00 60.65 60.49 1sj1 s ILE 61 Cb 0.15 -2.73 -0.04 0.00 0.01 0.00 0.00 42.46 39.85 1sj1 s ILE 61 CO 0.67 0.55 -0.15 0.42 0.00 0.00 0.00 174.94 176.43 1sj1 s THR 62 N -0.32 1.45 -0.09 2.92 -4.23 -0.47 -4.90 115.64 109.99 1sj1 s THR 62 Ca 0.06 -1.76 0.01 0.00 -1.18 0.00 0.00 61.69 58.82 1sj1 s THR 62 Cb -0.12 -1.61 0.02 0.00 1.34 0.00 0.00 72.50 72.13 1sj1 s THR 62 CO 0.02 -0.38 -0.12 -0.63 -0.54 0.00 0.00 174.62 172.97 1sj1 s ILE 63 N -2.09 1.19 -0.10 2.99 1.01 -1.26 -0.62 121.20 122.32 1sj1 s ILE 63 Ca 0.10 -0.46 -0.01 0.00 0.00 0.00 0.00 60.65 60.29 1sj1 s ILE 63 Cb -0.05 -1.12 -0.03 0.00 0.01 0.00 0.00 42.46 41.27 1sj1 s ILE 63 CO 0.04 0.38 -0.05 -0.70 0.00 0.00 0.00 174.94 174.60 1sj1 s GLU 64 N 1.06 3.05 -0.04 2.79 2.12 -0.19 -4.94 118.70 122.55 1sj1 s GLU 64 Ca -0.07 -0.53 0.05 0.00 0.36 0.00 0.00 54.97 54.79 1sj1 s GLU 64 Cb -0.15 -2.70 -0.02 0.00 0.26 0.00 0.00 34.13 31.52 1sj1 s GLU 64 CO -0.01 0.54 -0.19 -2.00 -0.54 0.00 0.00 175.26 173.05 1sj1 s GLU 65 N -0.47 2.38 0.00 4.30 2.12 -1.26 -0.99 118.70 124.77 1sj1 s GLU 65 Ca 0.07 -0.80 0.00 0.00 0.36 0.00 0.00 54.97 54.60 1sj1 s GLU 65 Cb -0.12 -2.24 0.00 0.00 0.26 0.00 0.00 34.13 32.03 1sj1 s GLU 65 CO 0.02 0.57 0.39 0.00 -0.54 0.00 0.00 175.26 175.71