#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1i8y s ASP 3 N 10.55 6.42 0.48 0.00 2.15 -1.26 -4.84 116.67 130.18 1i8y s ASP 3 Ca 1.12 -0.09 0.00 0.00 0.43 0.00 0.00 52.55 54.01 1i8y s ASP 3 Cb -0.61 -2.46 0.00 0.00 -0.30 0.00 0.00 42.92 39.54 1i8y s ASP 3 CO 0.36 -1.21 0.00 0.00 -0.17 0.00 0.00 175.17 174.15 1i8y n ALA 4 N 7.54 0.00 -2.33 3.66 0.00 -1.26 -1.04 120.51 127.08 1i8y n ALA 4 Ca 0.05 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 53.18 1i8y n ALA 4 Cb 0.48 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.94 1i8y n ALA 4 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1i8y n ALA 5 N 7.33 5.52 -0.03 0.00 0.00 -1.26 -4.81 120.51 127.26 1i8y n ALA 5 Ca 0.00 -4.29 -0.11 0.00 0.00 0.00 0.00 53.44 49.05 1i8y n ALA 5 Cb 0.00 -1.02 -0.04 0.00 0.00 0.00 0.00 19.45 18.38 1i8y n ALA 5 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1i8y h THR 6 N 2.41 1.08 -5.16 0.00 2.02 -1.41 -3.48 112.91 108.38 1i8y h THR 6 Ca 0.38 -0.21 -0.08 0.00 0.77 0.00 0.00 66.41 67.26 1i8y h THR 6 Cb 0.62 0.93 0.00 0.00 -1.74 0.00 0.00 68.15 67.96 1i8y h THR 6 CO 1.03 0.08 -0.80 0.00 0.37 0.00 0.00 175.52 176.20 1i8y n ILE 7 N -4.94 -1.89 -1.34 3.11 3.06 -1.26 -4.76 119.36 111.35 1i8y n ILE 7 Ca -0.04 0.29 -0.40 0.00 -2.50 0.00 0.00 62.75 60.10 1i8y n ILE 7 Cb 0.06 -2.37 0.01 0.00 0.54 0.00 0.00 39.64 37.89 1i8y n ILE 7 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 1i8y n PRO 9 N 0.98 -1.15 -2.50 0.00 -0.04 -1.26 -3.56 135.00 127.47 1i8y n PRO 9 Ca 0.10 -0.60 -0.20 0.00 -0.04 0.00 0.00 63.50 62.77 1i8y n PRO 9 Cb 0.45 -0.48 -0.00 0.00 -0.04 0.00 0.00 33.50 33.42 1i8y n PRO 9 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1i8y n ASP 10 N -3.46 -5.54 -3.70 3.54 -0.08 -1.26 -1.84 116.55 104.21 1i8y n ASP 10 Ca 0.05 -0.02 -0.27 0.00 -1.51 0.00 0.00 54.79 53.04 1i8y n ASP 10 Cb 0.19 -4.61 0.04 0.00 2.34 0.00 0.00 41.12 39.08 1i8y n ASP 10 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1i8y n GLY 11 N -1.04 -0.52 3.57 0.27 0.00 -1.26 -4.70 105.19 101.51 1i8y n GLY 11 Ca -0.21 0.20 -0.27 0.00 0.00 0.00 0.00 46.02 45.75 1i8y n GLY 11 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1i8y s THR 12 N -3.27 3.17 0.20 2.61 -4.23 -0.77 -4.40 115.64 108.96 1i8y s THR 12 Ca 0.60 -1.67 0.09 0.00 -1.18 0.00 0.00 61.69 59.53 1i8y s THR 12 Cb -0.29 -2.57 -0.04 0.00 1.34 0.00 0.00 72.50 70.94 1i8y s THR 12 CO 0.73 -0.11 -0.08 0.28 -0.54 0.00 0.00 174.62 174.90 1i8y s THR 13 N -1.71 3.22 -0.08 3.99 -1.32 -1.17 -3.46 115.64 115.10 1i8y s THR 13 Ca 0.25 -1.74 0.02 0.00 -1.21 0.00 0.00 61.69 59.00 1i8y s THR 13 Cb -0.09 -2.63 -0.02 0.00 -1.51 0.00 0.00 72.50 68.25 1i8y s THR 13 CO 0.15 -0.18 -0.13 0.00 -2.21 0.00 0.00 174.62 172.26 1i8y s SER 15 N -0.36 -0.07 0.22 0.00 1.04 -1.23 -4.96 113.70 108.34 1i8y s SER 15 Ca 0.04 -0.25 -0.26 0.00 0.48 0.00 0.00 55.95 55.96 1i8y s SER 15 Cb -0.12 0.34 -0.09 0.00 0.10 0.00 0.00 66.02 66.25 1i8y s SER 15 CO 0.02 -0.60 0.84 -0.22 0.98 0.00 0.00 173.24 174.26 1i8y s LEU 16 N -2.09 4.53 0.23 2.42 2.96 -1.26 -3.75 118.68 121.72 1i8y s LEU 16 Ca -0.05 1.72 -0.05 0.00 -0.22 0.00 0.00 54.13 55.53 1i8y s LEU 16 Cb -0.01 -3.54 -0.05 0.00 0.50 0.00 0.00 46.19 43.09 1i8y s LEU 16 CO -0.04 0.12 0.49 -0.55 -1.32 0.00 0.00 176.35 175.06 1i8y s SER 17 N -1.31 6.48 0.55 3.68 0.15 0.65 -4.89 113.70 119.01 1i8y s SER 17 Ca 0.41 0.68 0.28 0.00 0.70 0.00 0.00 55.95 58.01 1i8y s SER 17 Cb -0.22 -2.13 1.45 0.00 -1.71 0.00 0.00 66.02 63.41 1i8y s SER 17 CO 0.26 -0.10 1.96 -0.65 1.20 0.00 0.00 173.24 175.92 1i8y h PRO 18 N 2.12 0.00 0.00 5.44 0.11 -1.97 0.12 132.00 137.81 1i8y h PRO 18 Ca -0.47 0.00 -0.14 0.00 0.11 0.00 0.00 66.00 65.50 1i8y h PRO 18 Cb 1.18 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.27 1i8y h PRO 18 CO 0.68 0.00 -1.16 1.88 -0.21 0.00 0.00 178.00 179.19 1i8y h TYR 19 N 0.00 0.00 0.00 0.65 0.05 -2.04 -3.48 116.97 112.15 1i8y h TYR 19 Ca 0.27 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.05 1i8y h TYR 19 Cb 1.14 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.88 1i8y h TYR 19 CO 0.00 0.51 0.00 0.41 -1.05 0.00 0.00 178.16 178.03 1i8y n GLY 20 N 1.34 0.68 3.01 3.88 0.00 0.40 -5.15 105.19 109.35 1i8y n GLY 20 Ca -0.06 -0.42 -0.17 0.00 0.00 0.00 0.00 46.02 45.37 1i8y n GLY 20 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1i8y s VAL 21 N -0.48 0.62 -0.18 1.61 1.01 -1.25 -4.86 120.40 116.86 1i8y s VAL 21 Ca 0.00 -0.42 -0.01 0.00 0.00 0.00 0.00 61.98 61.55 1i8y s VAL 21 Cb 0.00 -0.53 -0.00 0.00 0.00 0.00 0.00 36.38 35.84 1i8y s VAL 21 CO 0.00 0.12 -0.12 0.26 0.00 0.00 0.00 175.10 175.36 1i8y s TRP 22 N -0.31 2.85 0.02 5.22 0.52 -1.26 -0.25 118.94 125.74 1i8y s TRP 22 Ca 0.02 -1.04 -0.11 0.00 0.02 0.00 0.00 56.10 54.99 1i8y s TRP 22 Cb -0.04 -1.97 0.01 0.00 -1.15 0.00 0.00 33.47 30.32 1i8y s TRP 22 CO -0.00 -0.51 0.22 1.52 0.02 0.00 0.00 176.95 178.20 1i8y s TYR 23 N 1.06 -0.02 -0.09 -1.98 1.13 -1.25 -5.00 117.35 111.21 1i8y s TYR 23 Ca -0.00 -0.11 0.02 0.00 -1.41 0.00 0.00 57.07 55.57 1i8y s TYR 23 Cb -0.15 0.01 -0.02 0.00 -1.10 0.00 0.00 41.96 40.71 1i8y s TYR 23 CO -0.03 -0.41 -0.15 0.00 -2.51 0.00 0.00 175.55 172.45 1i8y s SER 25 N -0.09 -0.10 -1.02 0.00 0.01 -1.15 -4.86 113.70 106.50 1i8y s SER 25 Ca -0.03 0.13 -0.21 0.00 1.31 0.00 0.00 55.95 57.15 1i8y s SER 25 Cb -0.14 0.29 0.07 0.00 0.21 0.00 0.00 66.02 66.45 1i8y s SER 25 CO 0.04 -0.18 1.38 -2.16 0.41 0.00 0.00 173.24 172.73 1i8y s PRO 26 N -0.47 3.62 -0.38 12.44 0.04 -1.26 -3.07 135.00 145.93 1i8y s PRO 26 Ca -0.06 -1.36 0.06 0.00 0.04 0.00 0.00 61.00 59.68 1i8y s PRO 26 Cb -0.04 -5.25 0.52 0.00 0.04 0.00 0.00 34.50 29.77 1i8y s PRO 26 CO 0.01 -2.09 1.59 1.19 0.04 0.00 0.00 177.00 177.74 1i8y n PHE 27 N 8.20 1.99 1.06 0.56 3.01 -1.26 -5.04 117.46 125.97 1i8y n PHE 27 Ca 0.32 -1.96 0.12 0.00 1.01 0.00 0.00 57.45 56.94 1i8y n PHE 27 Cb 0.50 -0.70 0.15 0.00 -0.01 0.00 0.00 39.48 39.42 1i8y n PHE 27 CO 0.00 0.00 0.00 0.45 1.01 0.00 0.00 176.76 178.22