#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3bbx h LYS 2 N 0.00 0.00 -4.36 0.03 3.11 -1.87 -3.31 116.57 110.16 3bbx h LYS 2 Ca 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.84 3bbx h LYS 2 Cb 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 31.23 3bbx h LYS 2 CO 0.00 0.36 -0.71 0.28 -2.81 0.00 0.00 179.45 176.57 3bbx n VAL 3 N -3.58 -9.82 0.55 2.00 0.31 -1.26 0.15 118.33 106.67 3bbx n VAL 3 Ca -0.00 2.39 0.11 0.00 -0.01 0.00 0.00 64.34 66.82 3bbx n VAL 3 Cb 0.48 -4.59 0.02 0.00 -0.91 0.00 0.00 33.84 28.84 3bbx n VAL 3 CO 0.00 0.00 0.00 -1.14 -1.32 0.00 0.00 176.83 174.37 3bbx n ARG 4 N 1.88 0.30 0.00 5.55 0.63 -1.26 -2.30 116.66 121.47 3bbx n ARG 4 Ca 0.00 -0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.93 3bbx n ARG 4 Cb 0.00 -1.60 0.00 0.00 0.45 0.00 0.00 32.46 31.31 3bbx n ARG 4 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 3bbx n ALA 5 N -1.84 0.00 -3.55 5.13 0.00 -1.26 -4.58 120.51 114.42 3bbx n ALA 5 Ca 0.02 0.00 -0.27 0.00 0.00 0.00 0.00 53.44 53.19 3bbx n ALA 5 Cb 0.44 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.79 3bbx n ALA 5 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 3bbx n SER 6 N -1.46 1.41 0.00 0.00 7.64 -1.26 -4.53 113.62 115.42 3bbx n SER 6 Ca 0.00 -2.86 0.00 0.00 1.01 0.00 0.00 58.87 57.02 3bbx n SER 6 Cb 0.00 -0.65 0.00 0.00 -1.01 0.00 0.00 64.21 62.55 3bbx n SER 6 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 3bbx n VAL 7 N 2.06 0.00 -1.99 0.44 0.31 -1.26 -5.16 118.33 112.74 3bbx n VAL 7 Ca 0.25 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.58 3bbx n VAL 7 Cb 0.43 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.36 3bbx n VAL 7 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 3bbx n LYS 8 N 0.00 0.61 -0.00 5.55 5.02 -1.26 -4.89 118.16 123.18 3bbx n LYS 8 Ca 0.00 0.00 -0.00 0.00 -2.02 0.00 0.00 58.31 56.29 3bbx n LYS 8 Cb 0.00 0.00 -0.00 0.00 -0.02 0.00 0.00 35.03 35.01 3bbx n LYS 8 CO 0.00 0.00 0.00 0.87 -0.52 0.00 0.00 177.40 177.75 3bbx h LYS 9 N 0.00 -0.03 -2.89 1.97 6.56 -1.78 -3.41 116.57 117.00 3bbx h LYS 9 Ca 0.00 0.00 0.30 0.00 -1.06 0.00 0.00 60.65 59.90 3bbx h LYS 9 Cb 0.00 0.01 -0.14 0.00 -0.57 0.00 0.00 32.23 31.53 3bbx h LYS 9 CO 0.00 -0.02 -0.90 -0.11 -2.06 0.00 0.00 179.45 176.36 3bbx n LEU 10 N -2.94 -0.80 0.00 2.94 7.94 -1.26 -4.64 117.00 118.24 3bbx n LEU 10 Ca -0.00 1.84 0.00 0.00 -1.11 0.00 0.00 56.01 56.74 3bbx n LEU 10 Cb 0.01 -3.37 0.00 0.00 0.53 0.00 0.00 43.42 40.60 3bbx n LEU 10 CO 0.01 -2.23 0.00 0.00 -1.11 0.00 0.00 177.39 174.06 3bbx n ARG 12 N -1.14 0.07 -0.03 0.00 3.00 -1.26 -4.75 116.66 112.55 3bbx n ARG 12 Ca 0.00 0.03 -0.00 0.00 -0.01 0.00 0.00 57.85 57.87 3bbx n ARG 12 Cb 0.00 -0.61 0.01 0.00 0.00 0.00 0.00 32.46 31.86 3bbx n ARG 12 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.63 177.72 3bbx n ASN 13 N -3.45 1.91 -4.55 0.55 5.03 -1.26 -4.80 115.26 108.69 3bbx n ASN 13 Ca -0.03 -2.04 -0.34 0.00 0.87 0.00 0.00 54.58 53.04 3bbx n ASN 13 Cb 0.24 -0.51 -0.11 0.00 -1.02 0.00 0.00 39.78 38.38 3bbx n ASN 13 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 3bbx s LYS 15 N 0.05 3.31 -0.11 0.00 3.01 -0.85 -4.88 119.74 120.28 3bbx s LYS 15 Ca 0.01 -0.19 -0.03 0.00 -1.01 0.00 0.00 55.97 54.75 3bbx s LYS 15 Cb -0.13 -2.51 -0.01 0.00 -1.01 0.00 0.00 37.83 34.17 3bbx s LYS 15 CO 0.02 -0.17 -0.05 0.82 0.51 0.00 0.00 175.35 176.48 3bbx h ILE 16 N 0.39 0.00 -2.91 2.17 5.03 -1.84 -3.31 117.51 117.04 3bbx h ILE 16 Ca -0.47 -0.93 0.00 0.00 -0.12 0.00 0.00 64.86 63.34 3bbx h ILE 16 Cb 1.23 0.00 0.00 0.00 -3.03 0.00 0.00 36.82 35.02 3bbx h ILE 16 CO 0.60 0.00 -0.74 0.52 -0.68 0.00 0.00 178.15 177.86 3bbx n VAL 17 N -4.54 -3.28 -1.15 1.67 0.31 -1.26 -3.92 118.33 106.16 3bbx n VAL 17 Ca -0.02 1.50 0.03 0.00 -0.01 0.00 0.00 64.34 65.83 3bbx n VAL 17 Cb 0.08 -2.23 0.04 0.00 -0.91 0.00 0.00 33.84 30.82 3bbx n VAL 17 CO 0.00 0.00 0.00 2.29 -1.32 0.00 0.00 176.83 177.80 3bbx n LYS 18 N -1.68 0.94 0.25 5.55 -0.00 -1.26 -4.59 118.16 117.38 3bbx n LYS 18 Ca 0.00 -1.46 0.12 0.00 -0.00 0.00 0.00 58.31 56.97 3bbx n LYS 18 Cb 0.20 -0.89 0.64 0.00 -0.00 0.00 0.00 35.03 34.98 3bbx n LYS 18 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 177.40 177.47 3bbx h ARG 19 N 0.00 0.00 0.00 -1.58 0.11 -1.94 -3.29 114.38 107.68 3bbx h ARG 19 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 3bbx h ARG 19 Cb 1.03 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.11 3bbx h ARG 19 CO 0.00 0.00 0.00 -0.40 0.10 0.00 0.00 179.97 179.67 3bbx n ASP 20 N -2.51 0.00 0.00 0.08 3.85 -1.26 -4.98 116.55 111.74 3bbx n ASP 20 Ca -0.02 -0.70 0.00 0.00 -0.71 0.00 0.00 54.79 53.36 3bbx n ASP 20 Cb 0.30 0.00 0.00 0.00 -1.35 0.00 0.00 41.12 40.07 3bbx n ASP 20 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3bbx n GLY 21 N 0.00 0.88 1.47 6.12 0.00 -1.24 -5.05 105.19 107.37 3bbx n GLY 21 Ca 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.86 3bbx n GLY 21 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3bbx n VAL 22 N 0.00 0.00 -0.35 1.61 0.24 -1.26 -4.74 118.33 113.84 3bbx n VAL 22 Ca 0.00 -0.04 0.23 0.00 -2.04 0.00 0.00 64.34 62.49 3bbx n VAL 22 Cb 0.00 -0.17 0.47 0.00 -1.47 0.00 0.00 33.84 32.67 3bbx n VAL 22 CO 0.00 0.00 0.00 0.16 -2.14 0.00 0.00 176.83 174.85 3bbx h ILE 23 N 3.27 0.39 -2.03 1.34 3.07 -1.80 -3.42 117.51 118.33 3bbx h ILE 23 Ca -0.01 -0.14 0.14 0.00 1.55 0.00 0.00 64.86 66.41 3bbx h ILE 23 Cb 0.53 -0.03 -0.08 0.00 -0.27 0.00 0.00 36.82 36.97 3bbx h ILE 23 CO 0.60 0.07 -0.51 -1.14 -1.05 0.00 0.00 178.15 176.13 3bbx n ARG 24 N -4.89 -1.36 -0.44 0.16 0.63 -0.71 -4.44 116.66 105.61 3bbx n ARG 24 Ca 0.30 1.11 0.00 0.00 -0.92 0.00 0.00 57.85 58.33 3bbx n ARG 24 Cb 0.93 -1.89 0.00 0.00 0.45 0.00 0.00 32.46 31.95 3bbx n ARG 24 CO 0.00 0.00 0.00 0.28 -2.51 0.00 0.00 177.63 175.40 3bbx n VAL 25 N -3.49 0.00 -1.56 5.15 0.31 0.35 -4.26 118.33 114.83 3bbx n VAL 25 Ca -0.04 0.00 -0.59 0.00 -0.01 0.00 0.00 64.34 63.70 3bbx n VAL 25 Cb 0.32 0.24 -0.08 0.00 -0.91 0.00 0.00 33.84 33.40 3bbx n VAL 25 CO 0.00 0.00 0.00 2.30 -1.32 0.00 0.00 176.83 177.81 3bbx n ILE 26 N 0.00 0.01 -3.67 2.52 -5.35 -1.25 -4.53 119.36 107.09 3bbx n ILE 26 Ca 0.00 -0.00 -0.10 0.00 -0.27 0.00 0.00 62.75 62.38 3bbx n ILE 26 Cb 0.57 -0.24 -0.09 0.00 -1.74 0.00 0.00 39.64 38.15 3bbx n ILE 26 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3bbx h SER 28 N 6.52 0.00 0.00 0.00 4.64 -1.93 -3.03 113.55 119.74 3bbx h SER 28 Ca -0.32 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.00 3bbx h SER 28 Cb 1.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 3bbx h SER 28 CO 0.20 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 176.16 3bbx n ALA 29 N -1.89 0.00 -2.82 5.18 0.00 -1.26 -4.89 120.51 114.83 3bbx n ALA 29 Ca -0.01 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.21 3bbx n ALA 29 Cb 0.42 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 19.72 3bbx n ALA 29 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 3bbx s GLU 30 N 0.00 1.12 0.41 0.00 -1.05 -1.15 -5.00 118.70 113.03 3bbx s GLU 30 Ca 0.00 -0.42 0.29 0.00 -0.15 0.00 0.00 54.97 54.69 3bbx s GLU 30 Cb 0.00 -1.04 1.26 0.00 -0.44 0.00 0.00 34.13 33.91 3bbx s GLU 30 CO 0.00 0.20 1.86 -1.00 0.95 0.00 0.00 175.26 177.28 3bbx h PRO 31 N 6.12 0.00 -0.50 -4.83 0.13 -1.90 -3.29 132.00 127.73 3bbx h PRO 31 Ca -0.33 0.00 0.04 0.00 -0.87 0.00 0.00 66.00 64.84 3bbx h PRO 31 Cb 1.17 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.24 3bbx h PRO 31 CO 0.49 0.00 -0.29 1.17 -0.23 0.00 0.00 178.00 179.13 3bbx n LYS 32 N -2.63 -0.22 -3.12 0.86 3.00 -1.26 -2.58 118.16 112.22 3bbx n LYS 32 Ca 0.01 1.06 -0.45 0.00 -0.00 0.00 0.00 58.31 58.93 3bbx n LYS 32 Cb 0.23 -1.57 -0.03 0.00 0.00 0.00 0.00 35.03 33.66 3bbx n LYS 32 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.40 174.02 3bbx s HIS 33 N -4.47 3.29 -0.08 5.64 -3.43 -1.24 -2.52 115.29 112.47 3bbx s HIS 33 Ca -0.06 -1.44 -0.00 0.00 -0.80 0.00 0.00 55.06 52.76 3bbx s HIS 33 Cb 0.05 -4.04 -0.05 0.00 -1.43 0.00 0.00 32.58 27.12 3bbx s HIS 33 CO 0.31 -1.26 -0.08 1.17 -2.00 0.00 0.00 174.74 172.88 3bbx n LYS 34 N 5.64 0.20 -3.65 -0.38 4.81 -1.06 -3.90 118.16 119.80 3bbx n LYS 34 Ca 0.09 0.05 -0.25 0.00 -0.87 0.00 0.00 58.31 57.34 3bbx n LYS 34 Cb 0.46 -1.09 0.02 0.00 0.02 0.00 0.00 35.03 34.44 3bbx n LYS 34 CO 0.00 0.00 0.00 1.04 1.17 0.00 0.00 177.40 179.61 3bbx n GLN 35 N -2.86 -1.23 -3.21 1.64 6.02 -0.94 0.13 117.38 116.93 3bbx n GLN 35 Ca -0.15 0.73 -0.45 0.00 -0.01 0.00 0.00 57.00 57.12 3bbx n GLN 35 Cb 0.64 -3.56 -0.05 0.00 1.02 0.00 0.00 30.24 28.29 3bbx n GLN 35 CO 0.00 0.00 0.00 0.50 -1.01 0.00 0.00 177.06 176.55 3bbx s ARG 36 N -5.19 3.02 -1.21 -1.09 3.52 0.39 -1.73 118.95 116.66 3bbx s ARG 36 Ca 0.21 -1.44 -0.18 0.00 -0.13 0.00 0.00 55.73 54.19 3bbx s ARG 36 Cb -0.09 -4.26 -0.02 0.00 -1.56 0.00 0.00 34.95 29.03 3bbx s ARG 36 CO 0.87 -1.41 1.99 0.00 -0.81 0.00 0.00 175.30 175.93 3bbx n GLN 37 N 5.85 2.43 0.00 5.12 10.64 -1.21 -4.31 117.38 135.90 3bbx n GLN 37 Ca -0.11 -2.58 0.00 0.00 -1.83 0.00 0.00 57.00 52.48 3bbx n GLN 37 Cb 0.42 -3.33 0.00 0.00 -0.86 0.00 0.00 30.24 26.47 3bbx n GLN 37 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64