#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2d2p s SER 2 N 0.00 -0.16 0.00 0.41 0.15 -1.26 -4.82 113.70 108.02 2d2p s SER 2 Ca 0.00 -0.30 0.00 0.00 0.70 0.00 0.00 55.95 56.35 2d2p s SER 2 Cb 0.00 0.42 0.00 0.00 -1.71 0.00 0.00 66.02 64.73 2d2p s SER 2 CO 0.00 -0.76 0.00 -0.67 1.20 0.00 0.00 173.24 173.01 2d2p n ASP 3 N 0.07 0.00 -1.86 5.45 2.03 -1.26 -5.00 116.55 115.98 2d2p n ASP 3 Ca -0.17 0.00 -0.03 0.00 0.52 0.00 0.00 54.79 55.11 2d2p n ASP 3 Cb 0.62 0.00 0.03 0.00 -0.72 0.00 0.00 41.12 41.05 2d2p n ASP 3 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2d2p n GLY 4 N 0.39 1.26 4.95 0.27 0.00 -1.26 -5.05 105.19 105.76 2d2p n GLY 4 Ca 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 46.02 45.75 2d2p n GLY 4 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2d2p n ILE 5 N -0.57 0.00 0.23 -0.61 5.41 -1.26 -4.40 119.36 118.16 2d2p n ILE 5 Ca -0.17 0.00 0.08 0.00 1.00 0.00 0.00 62.75 63.66 2d2p n ILE 5 Cb 0.83 0.00 0.62 0.00 -0.71 0.00 0.00 39.64 40.38 2d2p n ILE 5 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 176.55 176.70 2d2p h PHE 6 N 0.00 0.06 0.00 1.39 3.57 -1.98 -1.05 116.94 118.93 2d2p h PHE 6 Ca 0.00 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 2d2p h PHE 6 Cb 0.00 -0.02 0.00 0.00 2.79 0.00 0.00 35.95 38.72 2d2p h PHE 6 CO 0.00 0.04 0.00 0.25 -2.23 0.00 0.00 178.31 176.37 2d2p n THR 7 N -4.53 1.34 -0.06 4.41 -2.24 -1.26 -1.09 114.28 110.85 2d2p n THR 7 Ca -0.02 0.43 -0.07 0.00 -2.27 0.00 0.00 64.05 62.12 2d2p n THR 7 Cb 0.09 -1.34 -0.08 0.00 -2.10 0.00 0.00 70.33 66.90 2d2p n THR 7 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 2d2p n ASP 8 N -1.75 2.57 0.27 3.42 2.03 -0.48 -4.28 116.55 118.33 2d2p n ASP 8 Ca 0.01 -0.03 0.12 0.00 0.52 0.00 0.00 54.79 55.41 2d2p n ASP 8 Cb 0.09 0.39 0.79 0.00 -0.72 0.00 0.00 41.12 41.67 2d2p n ASP 8 CO 0.00 0.00 0.00 -1.28 -1.92 0.00 0.00 177.20 174.00 2d2p h SER 9 N 0.00 0.00 -0.58 1.67 0.87 -1.07 -0.49 113.55 113.95 2d2p h SER 9 Ca -0.30 0.00 -0.10 0.00 -1.23 0.00 0.00 61.79 60.16 2d2p h SER 9 Cb 1.59 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 63.53 2d2p h SER 9 CO -0.01 0.00 -0.04 0.22 -0.53 0.00 0.00 176.83 176.48 2d2p h TYR 10 N 0.00 1.16 -0.49 2.24 5.03 -1.32 -2.06 116.97 121.53 2d2p h TYR 10 Ca 0.01 -0.21 -0.08 0.00 2.58 0.00 0.00 58.73 61.03 2d2p h TYR 10 Cb 0.03 -0.30 -0.02 0.00 1.55 0.00 0.00 36.73 37.99 2d2p h TYR 10 CO 0.00 1.04 -0.00 0.77 -1.32 0.00 0.00 178.16 178.65 2d2p h SER 11 N 0.95 0.78 -0.85 -2.11 0.02 -1.32 -0.29 113.55 110.73 2d2p h SER 11 Ca 0.16 -0.19 -0.02 0.00 -0.84 0.00 0.00 61.79 60.90 2d2p h SER 11 Cb 0.60 -0.21 -0.04 0.00 0.14 0.00 0.00 62.40 62.89 2d2p h SER 11 CO 0.04 0.85 0.45 0.03 -1.14 0.00 0.00 176.83 177.05 2d2p h ARG 12 N 0.76 1.21 -0.16 3.45 3.08 -1.20 -2.89 114.38 118.62 2d2p h ARG 12 Ca 0.15 -0.15 -0.13 0.00 0.07 0.00 0.00 59.98 59.91 2d2p h ARG 12 Cb 0.46 -0.23 -0.01 0.00 0.08 0.00 0.00 29.97 30.27 2d2p h ARG 12 CO 0.02 0.90 -0.48 1.88 -1.07 0.00 0.00 179.97 181.22 2d2p h TYR 13 N 1.21 0.51 0.00 3.04 -1.99 -1.04 -3.11 116.97 115.58 2d2p h TYR 13 Ca 0.30 -0.16 0.00 0.00 2.00 0.00 0.00 58.73 60.87 2d2p h TYR 13 Cb 0.06 -0.10 0.00 0.00 2.00 0.00 0.00 36.73 38.69 2d2p h TYR 13 CO 0.01 0.82 0.00 0.00 -0.00 0.00 0.00 178.16 178.99 2d2p h ARG 14 N 0.33 0.00 0.05 4.88 3.08 -0.84 -1.67 114.38 120.21 2d2p h ARG 14 Ca 0.02 0.00 -0.23 0.00 0.07 0.00 0.00 59.98 59.84 2d2p h ARG 14 Cb 0.96 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.01 2d2p h ARG 14 CO 0.08 0.00 -1.03 0.87 -1.07 0.00 0.00 179.97 178.83 2d2p h LYS 15 N 0.00 0.23 -0.29 0.04 1.57 -1.48 -3.33 116.57 113.32 2d2p h LYS 15 Ca 0.00 -0.31 -0.12 0.00 -1.87 0.00 0.00 60.65 58.34 2d2p h LYS 15 Cb 0.10 0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.50 2d2p h LYS 15 CO 0.00 1.08 -0.32 1.96 -0.57 0.00 0.00 179.45 181.59 2d2p h GLN 16 N 0.10 0.62 -0.33 3.15 1.08 -1.43 -2.86 115.11 115.45 2d2p h GLN 16 Ca -0.08 -0.28 -0.12 0.00 -1.45 0.00 0.00 58.65 56.73 2d2p h GLN 16 Cb 1.71 -0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 29.11 2d2p h GLN 16 CO 0.16 0.86 -0.28 0.00 -0.95 0.00 0.00 178.83 178.63 2d2p h MET 17 N 0.53 0.67 -0.30 1.46 -0.00 -1.69 -2.47 114.93 113.12 2d2p h MET 17 Ca 0.06 -0.29 -0.02 0.00 -0.00 0.00 0.00 59.70 59.45 2d2p h MET 17 Cb 0.82 -0.02 -0.02 0.00 -0.00 0.00 0.00 31.60 32.38 2d2p h MET 17 CO 0.07 0.88 0.09 0.00 -0.00 0.00 0.00 176.91 177.95 2d2p h ALA 18 N 1.11 1.60 -0.20 -3.00 0.00 -1.64 -1.91 119.26 115.24 2d2p h ALA 18 Ca 0.07 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 54.84 2d2p h ALA 18 Cb 0.77 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 2d2p h ALA 18 CO 0.06 0.31 -0.04 0.28 0.00 0.00 0.00 179.25 179.86 2d2p h VAL 19 N 0.43 1.28 -0.96 0.00 2.07 -1.27 -2.31 116.25 115.48 2d2p h VAL 19 Ca 0.10 -0.99 0.04 0.00 0.82 0.00 0.00 66.70 66.67 2d2p h VAL 19 Cb 0.13 1.53 -0.06 0.00 -1.52 0.00 0.00 31.29 31.38 2d2p h VAL 19 CO -0.01 0.30 0.63 0.11 0.02 0.00 0.00 177.57 178.62 2d2p h LYS 20 N 0.10 1.16 -0.24 1.57 1.79 -0.99 -0.97 116.57 118.99 2d2p h LYS 20 Ca 0.05 -0.07 -0.05 0.00 -2.18 0.00 0.00 60.65 58.40 2d2p h LYS 20 Cb 0.47 -0.26 -0.01 0.00 -1.58 0.00 0.00 32.23 30.84 2d2p h LYS 20 CO 0.02 0.77 -0.06 0.87 -1.08 0.00 0.00 179.45 179.97 2d2p h LYS 21 N 1.20 0.38 -0.12 3.15 1.57 -1.36 -1.05 116.57 120.34 2d2p h LYS 21 Ca 0.39 -0.08 -0.16 0.00 -1.87 0.00 0.00 60.65 58.93 2d2p h LYS 21 Cb 0.03 -0.05 0.01 0.00 0.08 0.00 0.00 32.23 32.30 2d2p h LYS 21 CO -0.13 0.46 -0.54 -0.92 -0.57 0.00 0.00 179.45 177.74 2d2p h TYR 22 N 0.36 0.77 -0.73 -1.35 3.20 -0.63 -1.56 116.97 117.04 2d2p h TYR 22 Ca 0.08 -0.34 0.09 0.00 3.14 0.00 0.00 58.73 61.70 2d2p h TYR 22 Cb 0.34 -0.12 -0.07 0.00 1.54 0.00 0.00 36.73 38.42 2d2p h TYR 22 CO 0.01 1.12 0.38 -0.07 -1.64 0.00 0.00 178.16 177.97 2d2p h LEU 23 N 0.20 0.52 -1.36 2.82 -0.00 -1.07 -1.45 115.31 114.97 2d2p h LEU 23 Ca -0.04 0.05 -0.03 0.00 -0.00 0.00 0.00 57.88 57.87 2d2p h LEU 23 Cb 1.18 -0.04 -0.02 0.00 -0.00 0.00 0.00 40.66 41.78 2d2p h LEU 23 CO 0.11 0.31 0.07 0.00 -0.00 0.00 0.00 178.44 178.93 2d2p h ALA 24 N 1.42 1.49 -0.12 1.53 0.00 -1.19 -2.41 119.26 119.99 2d2p h ALA 24 Ca 0.35 -0.15 -0.07 0.00 0.00 0.00 0.00 54.91 55.05 2d2p h ALA 24 Cb 0.34 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 2d2p h ALA 24 CO -0.25 0.38 -0.24 0.00 0.00 0.00 0.00 179.25 179.14 2d2p h ALA 25 N 1.59 1.38 0.07 0.00 0.00 -0.22 -0.66 119.26 121.42 2d2p h ALA 25 Ca 0.12 -0.28 -0.28 0.00 0.00 0.00 0.00 54.91 54.47 2d2p h ALA 25 Cb 0.21 -0.08 0.02 0.00 0.00 0.00 0.00 17.79 17.94 2d2p h ALA 25 CO -0.00 0.43 -1.15 -0.39 0.00 0.00 0.00 179.25 178.14 2d2p h VAL 26 N 0.19 1.32 -0.42 0.00 -1.51 -1.10 -3.13 116.25 111.60 2d2p h VAL 26 Ca 0.03 -2.45 0.02 0.00 -1.23 0.00 0.00 66.70 63.07 2d2p h VAL 26 Cb 0.53 2.59 -0.02 0.00 -2.13 0.00 0.00 31.29 32.26 2d2p h VAL 26 CO 0.04 0.74 0.28 -0.07 -1.23 0.00 0.00 177.57 177.33 2d2p h LEU 27 N 0.28 0.43 -1.70 4.19 4.07 -1.33 -1.48 115.31 119.78 2d2p h LEU 27 Ca -0.15 -0.01 0.04 0.00 0.08 0.00 0.00 57.88 57.84 2d2p h LEU 27 Cb 1.81 -0.10 -0.02 0.00 1.08 0.00 0.00 40.66 43.42 2d2p h LEU 27 CO 0.21 0.31 0.27 1.23 -1.08 0.00 0.00 178.44 179.39 2d2p h GLY 28 N 0.51 0.45 1.31 0.83 0.00 -1.06 -2.02 103.07 103.09 2d2p h GLY 28 Ca 0.16 -0.15 -0.09 0.00 0.00 0.00 0.00 47.33 47.25 2d2p h GLY 28 CO -0.04 0.13 -0.07 0.50 0.00 0.00 0.00 176.54 177.06 2d2p h LYS 29 N 0.39 0.82 -0.10 4.80 1.79 -1.23 -2.97 116.57 120.08 2d2p h LYS 29 Ca 0.17 -0.26 -0.14 0.00 -2.18 0.00 0.00 60.65 58.24 2d2p h LYS 29 Cb 0.19 -0.08 -0.01 0.00 -1.58 0.00 0.00 32.23 30.76 2d2p h LYS 29 CO -0.04 0.87 -0.55 0.00 -1.08 0.00 0.00 179.45 178.65 2d2p h ARG 30 N 0.75 0.30 -0.00 3.15 -0.00 -1.40 -2.89 114.38 114.28 2d2p h ARG 30 Ca 0.13 -0.19 0.00 0.00 -0.50 0.00 0.00 59.98 59.43 2d2p h ARG 30 Cb 0.55 0.02 -0.00 0.00 0.00 0.00 0.00 29.97 30.55 2d2p h ARG 30 CO 0.03 0.77 0.00 -0.92 0.00 0.00 0.00 179.97 179.86 2d2p h TYR 31 N 0.23 0.00 0.19 3.04 3.20 -1.23 -1.14 116.97 121.27 2d2p h TYR 31 Ca 0.00 0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.86 2d2p h TYR 31 Cb 1.04 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.31 2d2p h TYR 31 CO 0.02 0.00 -0.09 0.87 -1.64 0.00 0.00 178.16 177.32 2d2p h LYS 32 N 0.00 -0.25 -0.52 1.82 1.57 -1.43 -3.27 116.57 114.50 2d2p h LYS 32 Ca 0.00 0.02 0.08 0.00 -1.87 0.00 0.00 60.65 58.88 2d2p h LYS 32 Cb 0.01 0.06 -0.06 0.00 0.08 0.00 0.00 32.23 32.31 2d2p h LYS 32 CO -0.00 0.12 0.15 1.96 -0.57 0.00 0.00 179.45 181.11 2d2p h GLN 33 N -0.68 0.30 0.00 3.15 4.20 -1.37 0.59 115.11 121.30 2d2p h GLN 33 Ca -0.03 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.67 2d2p h GLN 33 Cb 0.48 -0.07 0.00 0.00 0.30 0.00 0.00 27.48 28.20 2d2p h GLN 33 CO 0.04 0.20 0.00 0.54 -0.67 0.00 0.00 178.83 178.94 2d2p n ARG 34 N -5.05 0.08 -0.06 1.46 5.12 -0.47 -2.00 116.66 115.74 2d2p n ARG 34 Ca 0.06 0.54 -0.08 0.00 -1.93 0.00 0.00 57.85 56.45 2d2p n ARG 34 Cb 0.23 -1.73 -0.06 0.00 -1.16 0.00 0.00 32.46 29.74 2d2p n ARG 34 CO 0.00 0.00 0.00 0.28 -1.93 0.00 0.00 177.63 175.98 2d2p n VAL 35 N -1.89 0.67 0.30 1.55 0.31 -0.55 -4.52 118.33 114.20 2d2p n VAL 35 Ca -0.00 -0.28 0.18 0.00 -0.01 0.00 0.00 64.34 64.23 2d2p n VAL 35 Cb 0.04 -0.89 0.92 0.00 -0.91 0.00 0.00 33.84 32.99 2d2p n VAL 35 CO 0.00 0.00 0.00 0.11 -1.32 0.00 0.00 176.83 175.62 2d2p h LYS 36 N 0.00 0.00 0.00 5.55 1.79 -0.80 -1.47 116.57 121.64 2d2p h LYS 36 Ca -0.26 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.21 2d2p h LYS 36 Cb 1.43 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 32.08 2d2p h LYS 36 CO -0.03 0.00 0.00 -1.71 -1.08 0.00 0.00 179.45 176.63 2d2p n ASN 37 N -2.84 0.00 0.00 0.86 5.15 -0.85 -5.07 115.26 112.51 2d2p n ASN 37 Ca -0.01 0.24 0.00 0.00 -0.60 0.00 0.00 54.58 54.20 2d2p n ASN 37 Cb 0.13 -0.37 0.00 0.00 -0.53 0.00 0.00 39.78 39.01 2d2p n ASN 37 CO 0.00 0.00 0.00 0.29 1.40 0.00 0.00 177.26 178.95