#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vs6 h LYS 2 N 0.00 1.05 -4.64 0.03 3.11 -1.88 -3.29 116.57 110.95 1vs6 h LYS 2 Ca 0.00 -0.14 0.00 0.00 -2.81 0.00 0.00 60.65 57.70 1vs6 h LYS 2 Cb 0.00 -0.20 -0.01 0.00 -1.00 0.00 0.00 32.23 31.03 1vs6 h LYS 2 CO 0.00 0.80 -0.83 0.28 -2.81 0.00 0.00 179.45 176.89 1vs6 n VAL 3 N -4.33-10.82 0.87 2.00 0.31 -1.26 0.11 118.33 105.20 1vs6 n VAL 3 Ca 0.07 2.54 0.13 0.00 -0.01 0.00 0.00 64.34 67.07 1vs6 n VAL 3 Cb 0.13 -5.24 0.39 0.00 -0.91 0.00 0.00 33.84 28.21 1vs6 n VAL 3 CO 0.00 0.00 0.00 -1.14 -1.32 0.00 0.00 176.83 174.37 1vs6 n ARG 4 N 1.89 0.09 0.00 5.55 0.63 -1.26 -3.13 116.66 120.43 1vs6 n ARG 4 Ca -0.02 0.05 0.00 0.00 -0.92 0.00 0.00 57.85 56.95 1vs6 n ARG 4 Cb 0.04 -1.58 0.00 0.00 0.45 0.00 0.00 32.46 31.37 1vs6 n ARG 4 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1vs6 n ALA 5 N -1.60 0.00 -3.30 5.13 0.00 -1.26 -4.71 120.51 114.77 1vs6 n ALA 5 Ca 0.06 0.00 -0.25 0.00 0.00 0.00 0.00 53.44 53.24 1vs6 n ALA 5 Cb 0.37 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.74 1vs6 n ALA 5 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1vs6 n SER 6 N -1.76 1.32 -0.80 0.00 7.64 -1.26 -4.63 113.62 114.13 1vs6 n SER 6 Ca 0.00 -2.92 0.00 0.00 1.01 0.00 0.00 58.87 56.96 1vs6 n SER 6 Cb 0.00 -0.65 0.00 0.00 -1.01 0.00 0.00 64.21 62.55 1vs6 n SER 6 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 1vs6 n VAL 7 N 1.35 0.00 -2.21 0.44 0.31 -1.26 -5.15 118.33 111.82 1vs6 n VAL 7 Ca 0.24 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.57 1vs6 n VAL 7 Cb 0.48 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.41 1vs6 n VAL 7 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 1vs6 n LYS 8 N 0.00 1.60 0.40 5.55 5.02 -1.26 -4.91 118.16 124.55 1vs6 n LYS 8 Ca 0.00 0.00 -0.16 0.00 -2.02 0.00 0.00 58.31 56.13 1vs6 n LYS 8 Cb 0.00 0.00 -0.07 0.00 -0.02 0.00 0.00 35.03 34.94 1vs6 n LYS 8 CO 0.00 0.00 0.00 0.87 -0.52 0.00 0.00 177.40 177.75 1vs6 h LYS 9 N 0.00 -0.98 -2.69 1.97 6.56 -1.81 -3.41 116.57 116.22 1vs6 h LYS 9 Ca 0.00 0.07 0.00 0.00 -1.06 0.00 0.00 60.65 59.66 1vs6 h LYS 9 Cb 0.00 0.22 0.00 0.00 -0.57 0.00 0.00 32.23 31.88 1vs6 h LYS 9 CO 0.00 -0.65 -0.64 -0.11 -2.06 0.00 0.00 179.45 175.98 1vs6 n LEU 10 N -5.03 -3.46 -1.03 2.94 7.94 -1.26 -4.26 117.00 112.85 1vs6 n LEU 10 Ca -0.13 2.17 0.13 0.00 -1.11 0.00 0.00 56.01 57.07 1vs6 n LEU 10 Cb 0.40 -1.80 -0.07 0.00 0.53 0.00 0.00 43.42 42.49 1vs6 n LEU 10 CO 0.30 -0.06 -0.44 0.00 -1.11 0.00 0.00 177.39 176.08 1vs6 h ARG 12 N -1.01 0.00 -1.84 0.00 -0.00 -1.99 -3.36 114.38 106.18 1vs6 h ARG 12 Ca -0.13 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.35 1vs6 h ARG 12 Cb 0.98 0.00 0.00 0.00 0.00 0.00 0.00 29.97 30.95 1vs6 h ARG 12 CO 0.05 0.69 0.00 0.09 0.00 0.00 0.00 179.97 180.80 1vs6 n ASN 13 N -4.59 3.16 -4.11 7.04 5.03 -1.26 -4.76 115.26 115.78 1vs6 n ASN 13 Ca -0.15 -1.79 -0.26 0.00 0.87 0.00 0.00 54.58 53.26 1vs6 n ASN 13 Cb 0.43 -0.65 -0.16 0.00 -1.02 0.00 0.00 39.78 38.38 1vs6 n ASN 13 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1vs6 s LYS 15 N 0.27 2.96 -0.19 0.00 3.01 -1.13 -4.90 119.74 119.77 1vs6 s LYS 15 Ca -0.09 -0.25 -0.17 0.00 -1.01 0.00 0.00 55.97 54.44 1vs6 s LYS 15 Cb -0.13 -2.41 -0.14 0.00 -1.01 0.00 0.00 37.83 34.14 1vs6 s LYS 15 CO 0.03 -0.52 0.04 -0.89 0.51 0.00 0.00 175.35 174.53 1vs6 n ILE 16 N -2.35 1.50 -1.07 2.17 -0.00 -1.26 -4.14 119.36 114.21 1vs6 n ILE 16 Ca 0.03 0.02 0.01 0.00 -0.00 0.00 0.00 62.75 62.82 1vs6 n ILE 16 Cb 0.58 -2.14 -0.01 0.00 -0.00 0.00 0.00 39.64 38.07 1vs6 n ILE 16 CO 0.00 0.00 0.00 0.52 -0.00 0.00 0.00 176.55 177.07 1vs6 n VAL 17 N -4.47 -1.86 -2.26 1.39 0.31 -1.26 -4.20 118.33 105.99 1vs6 n VAL 17 Ca -0.26 0.96 0.02 0.00 -0.01 0.00 0.00 64.34 65.04 1vs6 n VAL 17 Cb 0.58 -1.59 0.01 0.00 -0.91 0.00 0.00 33.84 31.92 1vs6 n VAL 17 CO 0.00 0.00 0.00 2.29 -1.32 0.00 0.00 176.83 177.80 1vs6 n LYS 18 N -2.40 0.00 0.00 5.55 -0.00 -1.26 -4.57 118.16 115.47 1vs6 n LYS 18 Ca -0.01 -1.47 0.01 0.00 -0.00 0.00 0.00 58.31 56.85 1vs6 n LYS 18 Cb 0.35 -0.17 0.06 0.00 -0.00 0.00 0.00 35.03 35.27 1vs6 n LYS 18 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.40 180.29 1vs6 n ARG 19 N 0.26 0.00 0.00 -1.58 1.85 -1.26 -3.92 116.66 112.01 1vs6 n ARG 19 Ca 0.02 0.45 0.00 0.00 -1.00 0.00 0.00 57.85 57.31 1vs6 n ARG 19 Cb 0.92 -1.50 0.00 0.00 -1.05 0.00 0.00 32.46 30.83 1vs6 n ARG 19 CO 0.00 0.00 0.00 -0.40 -0.01 0.00 0.00 177.63 177.22 1vs6 n ASP 20 N -1.49 0.00 0.00 2.89 3.85 -1.26 -4.98 116.55 115.56 1vs6 n ASP 20 Ca 0.01 -0.40 0.00 0.00 -0.71 0.00 0.00 54.79 53.69 1vs6 n ASP 20 Cb 0.03 0.00 0.00 0.00 -1.35 0.00 0.00 41.12 39.80 1vs6 n ASP 20 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1vs6 n GLY 21 N 0.00 1.96 3.32 6.12 0.00 -1.25 -5.05 105.19 110.29 1vs6 n GLY 21 Ca 0.00 0.00 -0.52 0.00 0.00 0.00 0.00 46.02 45.50 1vs6 n GLY 21 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1vs6 n VAL 22 N -0.35 0.00 -0.20 1.61 0.24 -1.26 -4.79 118.33 113.58 1vs6 n VAL 22 Ca 0.00 0.00 -0.01 0.00 -2.04 0.00 0.00 64.34 62.29 1vs6 n VAL 22 Cb 0.00 -0.50 0.10 0.00 -1.47 0.00 0.00 33.84 31.97 1vs6 n VAL 22 CO 0.00 0.00 0.00 0.16 -2.14 0.00 0.00 176.83 174.85 1vs6 h ILE 23 N 7.34 0.84 -2.39 1.34 3.07 -1.77 -3.41 117.51 122.53 1vs6 h ILE 23 Ca -0.08 -0.16 0.20 0.00 1.55 0.00 0.00 64.86 66.37 1vs6 h ILE 23 Cb 1.37 0.32 -0.10 0.00 -0.27 0.00 0.00 36.82 38.14 1vs6 h ILE 23 CO 1.20 0.09 -0.64 -1.14 -1.05 0.00 0.00 178.15 176.61 1vs6 n ARG 24 N -4.93 -1.83 -1.15 0.16 0.63 -1.07 -4.42 116.66 104.05 1vs6 n ARG 24 Ca 0.08 1.45 -0.01 0.00 -0.92 0.00 0.00 57.85 58.45 1vs6 n ARG 24 Cb 0.23 -2.38 -0.02 0.00 0.45 0.00 0.00 32.46 30.74 1vs6 n ARG 24 CO 0.00 0.00 0.00 0.28 -2.51 0.00 0.00 177.63 175.40 1vs6 n VAL 25 N -3.58 0.00 -1.68 5.15 0.31 -1.05 -4.36 118.33 113.12 1vs6 n VAL 25 Ca -0.04 -0.44 -0.57 0.00 -0.01 0.00 0.00 64.34 63.27 1vs6 n VAL 25 Cb 0.48 0.69 -0.07 0.00 -0.91 0.00 0.00 33.84 34.02 1vs6 n VAL 25 CO 0.00 0.00 0.00 2.30 -1.32 0.00 0.00 176.83 177.81 1vs6 n ILE 26 N 0.22 0.21 -3.72 2.52 -5.35 -1.24 -4.44 119.36 107.56 1vs6 n ILE 26 Ca -0.09 -0.04 -0.13 0.00 -0.27 0.00 0.00 62.75 62.22 1vs6 n ILE 26 Cb 0.89 -1.04 -0.10 0.00 -1.74 0.00 0.00 39.64 37.64 1vs6 n ILE 26 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1vs6 h SER 28 N 5.61 0.00 0.00 0.00 4.64 -1.93 -3.25 113.55 118.62 1vs6 h SER 28 Ca -0.28 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.04 1vs6 h SER 28 Cb 1.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 1vs6 h SER 28 CO 0.23 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 176.19 1vs6 n ALA 29 N -2.33 0.00 -3.15 5.18 0.00 -1.26 -4.84 120.51 114.10 1vs6 n ALA 29 Ca 0.03 0.00 -0.24 0.00 0.00 0.00 0.00 53.44 53.22 1vs6 n ALA 29 Cb 0.37 0.00 -0.16 0.00 0.00 0.00 0.00 19.45 19.66 1vs6 n ALA 29 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 1vs6 s GLU 30 N 0.00 1.54 0.14 0.00 -1.05 -1.23 -5.00 118.70 113.10 1vs6 s GLU 30 Ca 0.00 -0.46 0.18 0.00 -0.15 0.00 0.00 54.97 54.54 1vs6 s GLU 30 Cb 0.00 -1.33 0.77 0.00 -0.44 0.00 0.00 34.13 33.13 1vs6 s GLU 30 CO 0.00 0.13 1.55 -0.35 0.95 0.00 0.00 175.26 177.54 1vs6 n PRO 31 N 3.44 0.10 -0.12 -4.83 -0.04 -1.26 -3.74 135.00 128.55 1vs6 n PRO 31 Ca -0.20 0.37 -0.03 0.00 -0.04 0.00 0.00 63.50 63.60 1vs6 n PRO 31 Cb 0.53 -1.70 -0.03 0.00 -0.04 0.00 0.00 33.50 32.26 1vs6 n PRO 31 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 1vs6 n LYS 32 N -1.88 -0.13 -2.94 0.54 3.00 -1.26 -3.12 118.16 112.37 1vs6 n LYS 32 Ca 0.02 0.86 -0.43 0.00 -0.00 0.00 0.00 58.31 58.76 1vs6 n LYS 32 Cb 0.17 -1.27 -0.05 0.00 0.00 0.00 0.00 35.03 33.88 1vs6 n LYS 32 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.40 174.02 1vs6 s HIS 33 N -3.96 2.84 0.00 5.64 -3.43 -1.24 -0.96 115.29 114.17 1vs6 s HIS 33 Ca -0.03 -0.38 0.00 0.00 -0.80 0.00 0.00 55.06 53.84 1vs6 s HIS 33 Cb 0.03 -4.00 0.00 0.00 -1.43 0.00 0.00 32.58 27.18 1vs6 s HIS 33 CO 0.18 -1.36 0.17 1.17 -2.00 0.00 0.00 174.74 172.90 1vs6 n LYS 34 N 7.13 0.53 -2.71 -0.38 4.81 -1.18 -3.69 118.16 122.66 1vs6 n LYS 34 Ca -0.03 -0.17 -0.17 0.00 -0.87 0.00 0.00 58.31 57.07 1vs6 n LYS 34 Cb 0.46 -0.60 -0.03 0.00 0.02 0.00 0.00 35.03 34.88 1vs6 n LYS 34 CO 0.00 0.00 0.00 1.04 1.17 0.00 0.00 177.40 179.61 1vs6 n GLN 35 N -0.12 -1.02 -2.10 1.64 3.00 -1.23 -2.52 117.38 115.04 1vs6 n GLN 35 Ca 0.00 0.06 -0.30 0.00 -0.01 0.00 0.00 57.00 56.75 1vs6 n GLN 35 Cb 0.10 -2.18 -0.05 0.00 0.00 0.00 0.00 30.24 28.12 1vs6 n GLN 35 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.06 177.56 1vs6 s ARG 36 N -3.68 2.66 -1.37 -1.09 6.06 0.30 -2.59 118.95 119.25 1vs6 s ARG 36 Ca 0.33 -0.22 -0.13 0.00 -2.50 0.00 0.00 55.73 53.21 1vs6 s ARG 36 Cb -0.20 -4.97 0.10 0.00 0.06 0.00 0.00 34.95 29.94 1vs6 s ARG 36 CO 0.41 -3.16 2.00 0.00 -2.50 0.00 0.00 175.30 172.06 1vs6 n GLN 37 N 8.92 3.19 0.00 5.12 10.64 -1.18 -4.24 117.38 139.82 1vs6 n GLN 37 Ca 0.36 -3.07 0.00 0.00 -1.83 0.00 0.00 57.00 52.46 1vs6 n GLN 37 Cb 0.48 -3.17 0.00 0.00 -0.86 0.00 0.00 30.24 26.69 1vs6 n GLN 37 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64