#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jn7 s SER 2 N 0.00 1.69 -0.45 1.61 0.01 -1.26 -5.01 113.70 110.29 1jn7 s SER 2 Ca 0.00 -0.21 0.04 0.00 1.31 0.00 0.00 55.95 57.09 1jn7 s SER 2 Cb 0.00 -0.25 0.67 0.00 0.21 0.00 0.00 66.02 66.64 1jn7 s SER 2 CO 0.00 -0.27 1.92 0.00 0.41 0.00 0.00 173.24 175.30 1jn7 n ALA 3 N 5.25 5.61 -2.62 1.44 0.00 -1.26 -4.98 120.51 123.95 1jn7 n ALA 3 Ca -0.05 -2.91 -0.06 0.00 0.00 0.00 0.00 53.44 50.43 1jn7 n ALA 3 Cb 0.49 -1.45 -0.05 0.00 0.00 0.00 0.00 19.45 18.45 1jn7 n ALA 3 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1jn7 n ALA 4 N -1.15 -3.59 0.00 0.00 0.00 -1.26 -5.04 120.51 109.47 1jn7 n ALA 4 Ca 0.60 2.37 0.00 0.00 0.00 0.00 0.00 53.44 56.41 1jn7 n ALA 4 Cb 1.67 -4.65 0.00 0.00 0.00 0.00 0.00 19.45 16.47 1jn7 n ALA 4 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 1jn7 n GLU 5 N 1.77 0.00 -3.36 0.00 0.28 -1.26 -5.17 120.64 112.90 1jn7 n GLU 5 Ca -0.41 0.00 -0.35 0.00 -0.16 0.00 0.00 57.16 56.24 1jn7 n GLU 5 Cb 0.64 0.00 -0.06 0.00 1.43 0.00 0.00 31.44 33.45 1jn7 n GLU 5 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 1jn7 s VAL 6 N 0.00 4.86 -0.37 3.84 0.11 -1.26 -5.03 120.40 122.55 1jn7 s VAL 6 Ca 0.00 0.77 -0.05 0.00 -2.93 0.00 0.00 61.98 59.77 1jn7 s VAL 6 Cb 0.00 -3.71 0.21 0.00 -1.53 0.00 0.00 36.38 31.35 1jn7 s VAL 6 CO 0.00 0.18 1.05 0.80 -3.33 0.00 0.00 175.10 173.80 1jn7 n MET 7 N 0.61 0.17 0.00 1.54 0.00 -1.26 -5.03 117.12 113.15 1jn7 n MET 7 Ca -0.04 -0.97 0.00 0.00 0.00 0.00 0.00 57.70 56.68 1jn7 n MET 7 Cb 0.52 -0.11 0.00 0.00 0.00 0.00 0.00 33.22 33.63 1jn7 n MET 7 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 175.97 177.14 1jn7 n LYS 8 N 2.63 0.00 -2.72 2.12 4.81 -1.26 -5.04 118.16 118.70 1jn7 n LYS 8 Ca 0.12 0.00 -0.05 0.00 -0.87 0.00 0.00 58.31 57.51 1jn7 n LYS 8 Cb 0.64 0.00 0.07 0.00 0.02 0.00 0.00 35.03 35.75 1jn7 n LYS 8 CO 0.00 0.00 0.00 1.63 1.17 0.00 0.00 177.40 180.20 1jn7 n LYS 9 N -0.48 1.34 -3.69 1.64 4.01 -1.26 -4.76 118.16 114.96 1jn7 n LYS 9 Ca 0.00 -2.73 -0.11 0.00 -0.51 0.00 0.00 58.31 54.95 1jn7 n LYS 9 Cb 0.00 -0.85 -0.10 0.00 -0.51 0.00 0.00 35.03 33.57 1jn7 n LYS 9 CO 0.00 0.00 0.00 -0.47 -1.11 0.00 0.00 177.40 175.82 1jn7 s TYR 10 N -2.15 -0.63 -0.17 2.13 6.14 -1.26 0.14 117.35 121.54 1jn7 s TYR 10 Ca 0.23 1.41 -0.20 0.00 0.64 0.00 0.00 57.07 59.16 1jn7 s TYR 10 Cb 0.41 0.28 -0.03 0.00 0.42 0.00 0.00 41.96 43.03 1jn7 s TYR 10 CO -0.03 -0.33 0.57 0.00 0.64 0.00 0.00 175.55 176.40 1jn7 n SER 12 N 4.55 2.60 0.00 0.00 2.88 -1.26 -2.47 113.62 119.92 1jn7 n SER 12 Ca -0.04 -2.32 0.00 0.00 -1.33 0.00 0.00 58.87 55.19 1jn7 n SER 12 Cb 0.50 -0.56 0.00 0.00 -0.75 0.00 0.00 64.21 63.40 1jn7 n SER 12 CO 0.00 0.00 0.00 0.41 -1.23 0.00 0.00 175.04 174.22 1jn7 n THR 13 N 0.20 0.00 0.81 2.46 -1.04 -1.26 -4.81 114.28 110.63 1jn7 n THR 13 Ca 0.10 0.00 0.11 0.00 -2.04 0.00 0.00 64.05 62.21 1jn7 n THR 13 Cb 0.58 -0.21 0.10 0.00 -1.82 0.00 0.00 70.33 68.98 1jn7 n THR 13 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1jn7 n ASP 15 N 1.22 -4.26 -4.57 0.00 9.92 -1.03 -4.98 116.55 112.84 1jn7 n ASP 15 Ca 0.13 -0.78 -0.24 0.00 -0.53 0.00 0.00 54.79 53.37 1jn7 n ASP 15 Cb 0.54 -3.94 -0.09 0.00 -0.64 0.00 0.00 41.12 36.99 1jn7 n ASP 15 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 1jn7 s ILE 16 N -3.37 2.74 0.20 0.53 -1.09 -1.22 -4.97 121.20 114.02 1jn7 s ILE 16 Ca 0.55 -2.13 0.04 0.00 -2.23 0.00 0.00 60.65 56.88 1jn7 s ILE 16 Cb -0.28 -2.62 -0.05 0.00 -1.58 0.00 0.00 42.46 37.93 1jn7 s ILE 16 CO 0.83 -0.31 -0.03 -0.55 -1.23 0.00 0.00 174.94 173.64 1jn7 s SER 17 N -3.62 1.80 -0.01 3.58 0.15 -1.26 -0.72 113.70 113.61 1jn7 s SER 17 Ca 0.32 -1.15 -0.01 0.00 0.70 0.00 0.00 55.95 55.81 1jn7 s SER 17 Cb -0.03 0.01 0.01 0.00 -1.71 0.00 0.00 66.02 64.29 1jn7 s SER 17 CO 0.18 -0.46 0.03 -0.36 1.20 0.00 0.00 173.24 173.83 1jn7 s PHE 18 N -3.40 -0.03 -1.79 3.44 0.08 0.36 -4.91 117.98 111.73 1jn7 s PHE 18 Ca 0.25 0.10 0.13 0.00 0.12 0.00 0.00 56.93 57.52 1jn7 s PHE 18 Cb 0.05 -0.03 0.40 0.00 -0.57 0.00 0.00 43.02 42.87 1jn7 s PHE 18 CO 0.06 -0.03 1.31 -1.71 -0.10 0.00 0.00 175.22 174.75 1jn7 n ASN 19 N 3.28 2.57 -3.67 1.36 2.85 -1.26 -4.71 115.26 115.69 1jn7 n ASN 19 Ca -0.15 -2.08 -0.08 0.00 -0.11 0.00 0.00 54.58 52.16 1jn7 n ASN 19 Cb 0.58 -0.34 -0.09 0.00 1.24 0.00 0.00 39.78 41.17 1jn7 n ASN 19 CO 0.00 0.00 0.00 -0.31 -2.11 0.00 0.00 177.26 174.84 1jn7 s TYR 20 N -1.50 -0.87 0.54 1.20 2.02 -1.26 -5.02 117.35 112.46 1jn7 s TYR 20 Ca 0.30 1.71 0.31 0.00 -0.37 0.00 0.00 57.07 59.02 1jn7 s TYR 20 Cb 0.17 0.45 1.48 0.00 -0.40 0.00 0.00 41.96 43.65 1jn7 s TYR 20 CO 0.19 -0.46 1.90 0.28 -1.57 0.00 0.00 175.55 175.88 1jn7 h VAL 21 N 5.56 0.56 -0.41 0.71 2.07 -1.87 0.37 116.25 123.25 1jn7 h VAL 21 Ca -0.28 0.00 -0.07 0.00 0.82 0.00 0.00 66.70 67.16 1jn7 h VAL 21 Cb 1.17 0.57 -0.02 0.00 -1.52 0.00 0.00 31.29 31.49 1jn7 h VAL 21 CO 0.20 0.00 -0.05 0.11 0.02 0.00 0.00 177.57 177.85 1jn7 h LYS 22 N 0.00 0.69 -0.33 1.57 1.79 -1.95 -1.63 116.57 116.71 1jn7 h LYS 22 Ca 0.41 -0.19 -0.18 0.00 -2.18 0.00 0.00 60.65 58.51 1jn7 h LYS 22 Cb 1.65 -0.08 -0.00 0.00 -1.58 0.00 0.00 32.23 32.22 1jn7 h LYS 22 CO -0.00 0.74 -0.49 1.15 -1.08 0.00 0.00 179.45 179.77 1jn7 h THR 23 N 0.64 1.27 0.00 -0.16 2.02 -0.68 -1.00 112.91 115.00 1jn7 h THR 23 Ca 0.12 -1.67 -0.05 0.00 0.77 0.00 0.00 66.41 65.58 1jn7 h THR 23 Cb 0.48 1.53 -0.01 0.00 -1.74 0.00 0.00 68.15 68.41 1jn7 h THR 23 CO 0.02 0.55 -0.23 0.22 0.37 0.00 0.00 175.52 176.45 1jn7 h TYR 24 N 0.71 0.00 -0.02 3.16 3.20 -1.20 -0.82 116.97 122.00 1jn7 h TYR 24 Ca 0.03 0.00 -0.20 0.00 3.14 0.00 0.00 58.73 61.71 1jn7 h TYR 24 Cb 1.10 0.00 0.01 0.00 1.54 0.00 0.00 36.73 39.38 1jn7 h TYR 24 CO 0.07 0.23 -0.75 -0.07 -1.64 0.00 0.00 178.16 176.00 1jn7 h LEU 25 N 0.00 0.70 -1.57 2.82 3.38 -1.07 -3.00 115.31 116.56 1jn7 h LEU 25 Ca -0.00 -0.73 -0.04 0.00 0.09 0.00 0.00 57.88 57.19 1jn7 h LEU 25 Cb 0.42 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.95 1jn7 h LEU 25 CO 0.03 1.33 -0.17 0.00 0.09 0.00 0.00 178.44 179.73 1jn7 h ALA 26 N 0.38 1.65 -0.30 1.53 0.00 -0.71 -0.46 119.26 121.34 1jn7 h ALA 26 Ca -0.09 -0.18 -0.15 0.00 0.00 0.00 0.00 54.91 54.49 1jn7 h ALA 26 Cb 1.43 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 19.18 1jn7 h ALA 26 CO 0.15 0.26 -0.41 1.25 0.00 0.00 0.00 179.25 180.50 1jn7 h HIS 27 N 0.06 0.99 -0.05 0.00 -0.00 -1.15 0.21 115.15 115.21 1jn7 h HIS 27 Ca 0.01 -0.33 -0.19 0.00 -0.00 0.00 0.00 60.37 59.87 1jn7 h HIS 27 Cb 0.34 -0.20 -0.01 0.00 -0.00 0.00 0.00 27.41 27.54 1jn7 h HIS 27 CO 0.00 1.12 -0.77 -0.22 -0.00 0.00 0.00 177.93 178.06 1jn7 h LYS 28 N 0.58 0.34 0.00 5.26 1.63 -1.33 1.11 116.57 124.15 1jn7 h LYS 28 Ca 0.03 -0.30 0.00 0.00 -0.85 0.00 0.00 60.65 59.54 1jn7 h LYS 28 Cb 1.01 0.07 0.00 0.00 -0.60 0.00 0.00 32.23 32.71 1jn7 h LYS 28 CO 0.10 0.96 -0.36 0.94 -3.45 0.00 0.00 179.45 177.63 1jn7 n GLN 29 N -3.79 0.24 -0.04 1.90 -0.06 -0.21 -3.11 117.38 112.30 1jn7 n GLN 29 Ca -0.04 0.12 -0.09 0.00 -2.00 0.00 0.00 57.00 54.98 1jn7 n GLN 29 Cb 0.73 -1.70 -0.03 0.00 -4.06 0.00 0.00 30.24 25.19 1jn7 n GLN 29 CO 0.00 0.00 0.00 0.34 -0.20 0.00 0.00 177.06 177.20 1jn7 n PHE 30 N -2.06 0.00 0.00 3.69 7.35 0.73 -4.42 117.46 122.75 1jn7 n PHE 30 Ca 0.04 0.00 -0.11 0.00 -0.76 0.00 0.00 57.45 56.62 1jn7 n PHE 30 Cb 0.42 -0.30 -0.09 0.00 0.35 0.00 0.00 39.48 39.86 1jn7 n PHE 30 CO 0.00 0.00 0.00 -0.92 -0.76 0.00 0.00 176.76 175.08 1jn7 h TYR 31 N -0.31 -0.10 -1.03 -5.13 3.20 0.11 -3.27 116.97 110.45 1jn7 h TYR 31 Ca -0.21 -0.00 -0.58 0.00 3.14 0.00 0.00 58.73 61.08 1jn7 h TYR 31 Cb 1.15 0.03 -0.23 0.00 1.54 0.00 0.00 36.73 39.22 1jn7 h TYR 31 CO -0.03 0.46 0.73 0.72 -1.64 0.00 0.00 178.16 178.40 1jn7 n HIS 32 N -4.82 2.55 -2.61 -3.82 8.25 -0.77 -4.00 115.22 110.01 1jn7 n HIS 32 Ca -0.08 -2.51 -0.02 0.00 -0.26 0.00 0.00 57.72 54.85 1jn7 n HIS 32 Cb 0.30 -1.27 0.04 0.00 1.12 0.00 0.00 29.99 30.17 1jn7 n HIS 32 CO 0.00 0.00 0.00 1.17 0.64 0.00 0.00 176.34 178.15 1jn7 n LYS 33 N -0.31 0.49 -1.43 -0.41 0.00 -1.20 -4.72 118.16 110.57 1jn7 n LYS 33 Ca 0.51 -0.69 -0.01 0.00 0.00 0.00 0.00 58.31 58.12 1jn7 n LYS 33 Cb 0.56 0.08 0.02 0.00 0.00 0.00 0.00 35.03 35.69 1jn7 n LYS 33 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.40 175.69 1jn7 n ASN 34 N -0.56 -0.38 -2.79 3.14 5.15 -1.23 -4.62 115.26 113.96 1jn7 n ASN 34 Ca -0.13 -1.09 -0.05 0.00 -0.60 0.00 0.00 54.58 52.72 1jn7 n ASN 34 Cb 0.67 0.16 0.01 0.00 -0.53 0.00 0.00 39.78 40.08 1jn7 n ASN 34 CO 0.00 0.00 0.00 1.17 1.40 0.00 0.00 177.26 179.83 1jn7 n LYS 35 N -0.30 -2.90 0.00 1.20 3.00 -1.26 -5.02 118.16 112.88 1jn7 n LYS 35 Ca -0.06 2.43 0.08 0.00 -0.00 0.00 0.00 58.31 60.76 1jn7 n LYS 35 Cb 0.53 -5.55 0.48 0.00 0.00 0.00 0.00 35.03 30.48 1jn7 n LYS 35 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.40 177.05