#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1zll n GLU 2 N 0.00 0.00 0.05 2.12 2.13 -1.26 -4.36 120.64 119.32 1zll n GLU 2 Ca 0.00 0.00 -0.15 0.00 0.66 0.00 0.00 57.16 57.67 1zll n GLU 2 Cb 0.00 -1.16 -0.06 0.00 0.27 0.00 0.00 31.44 30.49 1zll n GLU 2 CO 0.00 0.00 0.00 0.87 -0.41 0.00 0.00 177.13 177.59 1zll h LYS 3 N 0.00 0.52 0.04 5.31 1.57 -2.05 -2.70 116.57 119.25 1zll h LYS 3 Ca 0.00 -0.54 -0.00 0.00 -1.87 0.00 0.00 60.65 58.24 1zll h LYS 3 Cb 0.00 0.15 0.00 0.00 0.08 0.00 0.00 32.23 32.46 1zll h LYS 3 CO 0.00 1.17 -0.02 0.28 -0.57 0.00 0.00 179.45 180.31 1zll h VAL 4 N 0.30 1.07 -0.57 0.50 2.07 -2.00 -2.72 116.25 114.90 1zll h VAL 4 Ca -0.09 -1.63 0.16 0.00 0.82 0.00 0.00 66.70 65.96 1zll h VAL 4 Cb 1.59 1.95 -0.02 0.00 -1.52 0.00 0.00 31.29 33.29 1zll h VAL 4 CO 0.17 0.34 0.55 -0.61 0.02 0.00 0.00 177.57 178.04 1zll h GLN 5 N -0.94 0.00 0.08 1.57 -0.00 -1.91 0.51 115.11 114.42 1zll h GLN 5 Ca -0.01 0.00 -0.26 0.00 -0.00 0.00 0.00 58.65 58.39 1zll h GLN 5 Cb 0.60 0.00 0.00 0.00 0.00 0.00 0.00 27.48 28.08 1zll h GLN 5 CO 0.01 0.00 -1.13 -0.92 0.00 0.00 0.00 178.83 176.79 1zll h TYR 6 N 0.00 0.52 0.07 3.99 3.20 -1.48 -2.48 116.97 120.79 1zll h TYR 6 Ca 0.27 -0.34 -0.13 0.00 3.14 0.00 0.00 58.73 61.67 1zll h TYR 6 Cb 1.37 -0.03 0.01 0.00 1.54 0.00 0.00 36.73 39.61 1zll h TYR 6 CO 0.00 1.22 -0.62 -0.07 -1.64 0.00 0.00 178.16 177.06 1zll h LEU 7 N 0.12 0.23 -1.07 2.82 3.38 0.19 -2.24 115.31 118.74 1zll h LEU 7 Ca -0.11 -0.92 -0.04 0.00 0.09 0.00 0.00 57.88 56.90 1zll h LEU 7 Cb 1.83 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 42.47 1zll h LEU 7 CO 0.19 1.28 0.20 0.74 0.09 0.00 0.00 178.44 180.94 1zll h THR 8 N -0.66 1.22 -0.01 0.22 2.02 -0.83 -1.89 112.91 112.98 1zll h THR 8 Ca -0.13 -0.72 -0.14 0.00 0.77 0.00 0.00 66.41 66.19 1zll h THR 8 Cb 1.38 0.56 -0.02 0.00 -1.74 0.00 0.00 68.15 68.33 1zll h THR 8 CO 0.05 0.28 -0.66 -0.09 0.37 0.00 0.00 175.52 175.47 1zll h ARG 9 N 0.85 0.03 -0.11 6.66 2.43 -1.52 -2.46 114.38 120.25 1zll h ARG 9 Ca 0.20 -0.02 -0.09 0.00 -0.81 0.00 0.00 59.98 59.26 1zll h ARG 9 Cb 0.21 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.76 1zll h ARG 9 CO -0.01 0.68 -0.32 0.77 -1.51 0.00 0.00 179.97 179.57 1zll h SER 10 N 0.02 0.21 0.12 -3.80 0.02 -0.72 -2.43 113.55 106.97 1zll h SER 10 Ca -0.01 -0.07 -0.01 0.00 -0.84 0.00 0.00 61.79 60.86 1zll h SER 10 Cb 1.18 -0.06 0.00 0.00 0.14 0.00 0.00 62.40 63.66 1zll h SER 10 CO 0.09 0.53 -0.06 0.00 -1.14 0.00 0.00 176.83 176.25 1zll h ALA 11 N 1.49 -0.21 -0.43 3.77 0.00 -1.16 -2.41 119.26 120.31 1zll h ALA 11 Ca 0.02 -0.04 0.12 0.00 0.00 0.00 0.00 54.91 55.02 1zll h ALA 11 Cb 0.67 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.51 1zll h ALA 11 CO 0.05 -0.20 0.73 0.82 0.00 0.00 0.00 179.25 180.65 1zll h ILE 12 N -0.77 0.12 0.22 0.00 2.04 -1.53 0.96 117.51 118.55 1zll h ILE 12 Ca -0.02 0.00 -0.34 0.00 1.00 0.00 0.00 64.86 65.51 1zll h ILE 12 Cb 0.13 0.37 0.02 0.00 -0.74 0.00 0.00 36.82 36.60 1zll h ILE 12 CO 0.03 0.00 -1.57 -0.09 0.00 0.00 0.00 178.15 176.52 1zll h ARG 13 N 0.00 0.46 -0.02 2.37 9.65 -1.45 -3.17 114.38 122.22 1zll h ARG 13 Ca 0.20 -0.78 0.00 0.00 -1.10 0.00 0.00 59.98 58.30 1zll h ARG 13 Cb 1.65 0.29 0.00 0.00 -1.39 0.00 0.00 29.97 30.52 1zll h ARG 13 CO -0.00 1.37 -0.14 2.89 2.80 0.00 0.00 179.97 186.89 1zll n ARG 14 N -3.65 1.50 -0.15 0.20 -4.01 0.19 -3.92 116.66 106.82 1zll n ARG 14 Ca -0.19 -1.03 0.07 0.00 -1.04 0.00 0.00 57.85 55.65 1zll n ARG 14 Cb 1.09 -1.48 0.15 0.00 -3.04 0.00 0.00 32.46 29.18 1zll n ARG 14 CO 0.00 0.00 0.00 0.00 -3.04 0.00 0.00 177.63 174.59 1zll n ALA 15 N 0.15 2.28 1.14 2.89 0.00 0.28 -4.43 120.51 122.82 1zll n ALA 15 Ca 0.15 -1.02 0.07 0.00 0.00 0.00 0.00 53.44 52.64 1zll n ALA 15 Cb 0.42 -0.49 0.44 0.00 0.00 0.00 0.00 19.45 19.82 1zll n ALA 15 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1zll n SER 16 N 0.70 0.00 -1.58 0.00 7.64 -1.20 -2.18 113.62 117.00 1zll n SER 16 Ca 0.12 -0.67 -0.13 0.00 1.01 0.00 0.00 58.87 59.20 1zll n SER 16 Cb 0.42 0.00 0.18 0.00 -1.01 0.00 0.00 64.21 63.80 1zll n SER 16 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 1zll n THR 17 N -0.91 2.81 -4.15 0.44 -2.24 -1.26 -4.97 114.28 104.00 1zll n THR 17 Ca 0.11 -2.56 -0.10 0.00 -2.27 0.00 0.00 64.05 59.23 1zll n THR 17 Cb 0.05 -0.43 -0.10 0.00 -2.10 0.00 0.00 70.33 67.75 1zll n THR 17 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1zll s ILE 18 N -3.38 0.17 -0.45 2.28 1.01 -0.93 -5.12 121.20 114.78 1zll s ILE 18 Ca 0.50 -1.90 0.05 0.00 0.00 0.00 0.00 60.65 59.29 1zll s ILE 18 Cb 0.44 -1.98 0.18 0.00 0.01 0.00 0.00 42.46 41.10 1zll s ILE 18 CO 0.03 -0.54 0.49 -1.61 0.00 0.00 0.00 174.94 173.31 1zll s GLU 19 N -4.02 0.94 -0.03 2.79 2.02 -1.26 -5.10 118.70 114.03 1zll s GLU 19 Ca 0.22 -1.57 -0.14 0.00 0.02 0.00 0.00 54.97 53.50 1zll s GLU 19 Cb 0.07 -0.81 0.02 0.00 0.10 0.00 0.00 34.13 33.51 1zll s GLU 19 CO 0.00 -1.34 0.30 -1.64 0.02 0.00 0.00 175.26 172.60 1zll s MET 20 N 0.53 0.60 0.00 1.61 -1.94 -1.26 -5.02 119.30 113.82 1zll s MET 20 Ca 0.30 -0.09 0.00 0.00 -1.71 0.00 0.00 55.69 54.19 1zll s MET 20 Cb 0.00 0.27 0.00 0.00 2.01 0.00 0.00 34.83 37.11 1zll s MET 20 CO -0.12 -0.15 0.84 -0.35 -0.01 0.00 0.00 175.02 175.23 1zll n PRO 21 N 1.59 0.59 0.00 2.03 -0.04 -1.26 -4.84 135.00 133.07 1zll n PRO 21 Ca -0.20 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.26 1zll n PRO 21 Cb 0.56 -1.20 0.00 0.00 -0.04 0.00 0.00 33.50 32.82 1zll n PRO 21 CO 0.00 0.00 0.00 0.94 -0.04 0.00 0.00 175.50 176.40 1zll n GLN 22 N 1.13 0.00 -0.24 0.54 -0.06 -1.26 -3.91 117.38 113.57 1zll n GLN 22 Ca 0.00 0.00 0.24 0.00 -2.00 0.00 0.00 57.00 55.24 1zll n GLN 22 Cb 0.30 0.00 0.44 0.00 -4.06 0.00 0.00 30.24 26.91 1zll n GLN 22 CO 0.00 0.00 0.00 1.04 -0.20 0.00 0.00 177.06 177.90 1zll n GLN 23 N 0.00 -0.04 -0.01 3.69 6.02 -1.26 0.22 117.38 125.99 1zll n GLN 23 Ca 0.00 1.01 -0.09 0.00 -0.01 0.00 0.00 57.00 57.91 1zll n GLN 23 Cb 0.00 -1.82 0.06 0.00 1.02 0.00 0.00 30.24 29.50 1zll n GLN 23 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1zll h ALA 24 N 1.46 0.74 0.39 -1.58 0.00 -1.93 -1.38 119.26 116.95 1zll h ALA 24 Ca 0.63 -0.48 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 1zll h ALA 24 Cb 1.67 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 19.34 1zll h ALA 24 CO -0.56 0.67 -0.37 -0.09 0.00 0.00 0.00 179.25 178.91 1zll h ARG 25 N 0.47 -0.74 0.47 0.00 2.43 0.23 0.24 114.38 117.48 1zll h ARG 25 Ca 0.02 0.05 -0.02 0.00 -0.81 0.00 0.00 59.98 59.22 1zll h ARG 25 Cb 1.02 0.17 0.00 0.00 -0.42 0.00 0.00 29.97 30.74 1zll h ARG 25 CO 0.09 -0.50 -0.22 1.96 -1.51 0.00 0.00 179.97 179.79 1zll h GLN 26 N -0.77 -0.61 -0.93 0.20 7.50 -1.50 -2.50 115.11 116.51 1zll h GLN 26 Ca -0.03 0.04 0.13 0.00 0.50 0.00 0.00 58.65 59.29 1zll h GLN 26 Cb 0.69 0.14 -0.07 0.00 0.05 0.00 0.00 27.48 28.28 1zll h GLN 26 CO -0.05 -0.33 0.59 0.87 -1.50 0.00 0.00 178.83 178.42 1zll h LYS 27 N -0.81 0.81 -0.02 1.46 1.57 -1.22 -2.67 116.57 115.69 1zll h LYS 27 Ca -0.06 -0.05 -0.00 0.00 -1.87 0.00 0.00 60.65 58.66 1zll h LYS 27 Cb 0.56 -0.18 -0.00 0.00 0.08 0.00 0.00 32.23 32.69 1zll h LYS 27 CO 0.11 0.54 -0.00 -0.07 -0.57 0.00 0.00 179.45 179.45 1zll h LEU 28 N 0.83 0.03 -0.20 2.94 3.38 -0.41 0.11 115.31 121.99 1zll h LEU 28 Ca 0.46 -0.37 0.04 0.00 0.09 0.00 0.00 57.88 58.09 1zll h LEU 28 Cb 0.57 -0.01 -0.04 0.00 0.09 0.00 0.00 40.66 41.28 1zll h LEU 28 CO -0.22 0.40 -0.04 1.56 0.09 0.00 0.00 178.44 180.23 1zll h GLN 29 N -0.33 0.02 0.46 1.13 4.20 -1.12 0.65 115.11 120.12 1zll h GLN 29 Ca 0.00 -0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.69 1zll h GLN 29 Cb 0.38 -0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.16 1zll h GLN 29 CO 0.00 0.01 -0.22 -0.91 -0.67 0.00 0.00 178.83 177.04 1zll h ASN 30 N 0.02 -0.52 -0.98 1.46 2.35 -1.55 -2.62 115.58 113.74 1zll h ASN 30 Ca 0.10 0.01 0.22 0.00 -0.55 0.00 0.00 56.30 56.07 1zll h ASN 30 Cb 0.14 0.13 -0.09 0.00 0.05 0.00 0.00 38.32 38.55 1zll h ASN 30 CO -0.19 -0.09 0.63 -0.07 -1.65 0.00 0.00 177.43 176.05 1zll h LEU 31 N -1.16 0.54 0.63 1.61 -0.00 -0.77 -2.49 115.31 113.67 1zll h LEU 31 Ca -0.06 0.07 -0.03 0.00 -0.00 0.00 0.00 57.88 57.86 1zll h LEU 31 Cb 0.48 -0.02 0.01 0.00 -0.00 0.00 0.00 40.66 41.13 1zll h LEU 31 CO 0.10 0.17 -0.30 0.15 -0.00 0.00 0.00 178.44 178.57 1zll h PHE 32 N 0.51 -0.78 -0.75 1.13 3.57 0.32 0.10 116.94 121.05 1zll h PHE 32 Ca 0.55 -0.02 0.09 0.00 3.53 0.00 0.00 57.97 62.12 1zll h PHE 32 Cb 1.20 0.26 -0.11 0.00 2.79 0.00 0.00 35.95 40.08 1zll h PHE 32 CO -0.00 -0.49 -0.51 0.82 -2.23 0.00 0.00 178.31 175.90 1zll h ILE 33 N -0.95 0.03 -0.98 1.41 2.04 -1.06 0.77 117.51 118.77 1zll h ILE 33 Ca -0.09 0.00 0.11 0.00 1.00 0.00 0.00 64.86 65.88 1zll h ILE 33 Cb 0.64 0.03 -0.08 0.00 -0.74 0.00 0.00 36.82 36.67 1zll h ILE 33 CO 0.14 0.00 0.61 -0.55 0.00 0.00 0.00 178.15 178.36 1zll h ASN 34 N -0.15 0.92 -0.48 1.72 7.08 -1.47 0.24 115.58 123.42 1zll h ASN 34 Ca 0.18 0.04 -0.02 0.00 -3.08 0.00 0.00 56.30 53.42 1zll h ASN 34 Cb 0.52 -0.14 -0.03 0.00 -2.08 0.00 0.00 38.32 36.59 1zll h ASN 34 CO -0.80 0.51 0.25 0.15 -2.08 0.00 0.00 177.43 175.46 1zll h PHE 35 N 1.00 0.71 0.11 4.14 3.04 0.24 -2.68 116.94 123.49 1zll h PHE 35 Ca 0.47 -0.02 -0.01 0.00 3.98 0.00 0.00 57.97 62.40 1zll h PHE 35 Cb 0.41 -0.23 0.00 0.00 2.56 0.00 0.00 35.95 38.70 1zll h PHE 35 CO -0.01 0.52 -0.05 0.00 -2.02 0.00 0.00 178.31 176.75 1zll h LEU 37 N -0.33 -0.57 -1.03 0.00 3.38 -1.02 0.27 115.31 116.02 1zll h LEU 37 Ca -0.01 0.14 -0.06 0.00 0.09 0.00 0.00 57.88 58.04 1zll h LEU 37 Cb 0.27 0.33 -0.02 0.00 0.09 0.00 0.00 40.66 41.32 1zll h LEU 37 CO 0.02 -0.20 0.04 0.40 0.09 0.00 0.00 178.44 178.80 1zll h ILE 38 N -0.08 1.23 -0.03 1.22 2.04 -1.33 -2.00 117.51 118.56 1zll h ILE 38 Ca 0.20 -0.89 -0.00 0.00 1.00 0.00 0.00 64.86 65.17 1zll h ILE 38 Cb 0.39 0.83 -0.00 0.00 -0.74 0.00 0.00 36.82 37.29 1zll h ILE 38 CO -0.47 0.32 0.01 0.25 0.00 0.00 0.00 178.15 178.26 1zll h LEU 39 N 0.70 0.04 -1.57 1.44 5.85 0.15 -2.19 115.31 119.73 1zll h LEU 39 Ca 0.15 -0.22 -0.01 0.00 0.84 0.00 0.00 57.88 58.64 1zll h LEU 39 Cb 0.37 -0.01 -0.02 0.00 0.37 0.00 0.00 40.66 41.37 1zll h LEU 39 CO 0.01 0.25 0.17 0.40 -0.34 0.00 0.00 178.44 178.93 1zll h ILE 40 N -0.16 1.11 0.15 4.05 2.04 -0.43 -1.66 117.51 122.60 1zll h ILE 40 Ca 0.01 -0.31 -0.01 0.00 1.00 0.00 0.00 64.86 65.56 1zll h ILE 40 Cb 0.22 0.67 0.00 0.00 -0.74 0.00 0.00 36.82 36.97 1zll h ILE 40 CO -0.00 0.13 -0.07 0.00 0.00 0.00 0.00 178.15 178.20 1zll h LEU 42 N -0.25 0.00 0.26 0.00 4.07 -1.36 -1.43 115.31 116.60 1zll h LEU 42 Ca -0.02 0.00 -0.01 0.00 0.08 0.00 0.00 57.88 57.93 1zll h LEU 42 Cb 0.15 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.90 1zll h LEU 42 CO 0.03 0.00 -0.12 -0.07 -1.08 0.00 0.00 178.44 177.20 1zll h LEU 43 N 0.00 -0.29 -0.99 1.67 3.38 -0.98 -2.30 115.31 115.80 1zll h LEU 43 Ca 0.54 0.01 0.30 0.00 0.09 0.00 0.00 57.88 58.82 1zll h LEU 43 Cb 2.48 0.08 -0.15 0.00 0.09 0.00 0.00 40.66 43.16 1zll h LEU 43 CO -0.01 -0.12 0.52 -0.07 0.09 0.00 0.00 178.44 178.86 1zll h LEU 44 N -0.54 0.46 -0.51 1.67 3.38 -0.47 0.53 115.31 119.83 1zll h LEU 44 Ca -0.04 0.19 -0.01 0.00 0.09 0.00 0.00 57.88 58.11 1zll h LEU 44 Cb 0.27 0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.14 1zll h LEU 44 CO 0.06 -0.11 0.29 0.40 0.09 0.00 0.00 178.44 179.16 1zll h ILE 45 N 0.33 1.17 0.45 1.22 2.04 -1.39 -1.72 117.51 119.61 1zll h ILE 45 Ca 0.70 -0.40 -0.01 0.00 1.00 0.00 0.00 64.86 66.15 1zll h ILE 45 Cb 1.55 0.51 -0.02 0.00 -0.74 0.00 0.00 36.82 38.12 1zll h ILE 45 CO -0.60 0.17 -0.49 0.00 0.00 0.00 0.00 178.15 177.24 1zll h ILE 47 N -0.95 0.34 0.15 0.00 2.04 -1.25 -0.60 117.51 117.25 1zll h ILE 47 Ca -0.05 -0.01 0.01 0.00 1.00 0.00 0.00 64.86 65.82 1zll h ILE 47 Cb 0.84 0.32 -0.03 0.00 -0.74 0.00 0.00 36.82 37.22 1zll h ILE 47 CO -0.08 0.00 -0.24 0.40 0.00 0.00 0.00 178.15 178.23 1zll h ILE 48 N 0.01 0.47 -0.60 -0.67 2.04 -0.73 -0.51 117.51 117.53 1zll h ILE 48 Ca 0.33 0.00 0.17 0.00 1.00 0.00 0.00 64.86 66.36 1zll h ILE 48 Cb 0.52 0.47 -0.02 0.00 -0.74 0.00 0.00 36.82 37.04 1zll h ILE 48 CO -0.68 0.00 0.61 0.58 0.00 0.00 0.00 178.15 178.66 1zll h VAL 49 N -0.46 0.33 0.12 1.67 2.07 0.45 0.16 116.25 120.58 1zll h VAL 49 Ca 0.02 0.00 -0.28 0.00 0.82 0.00 0.00 66.70 67.26 1zll h VAL 49 Cb 0.47 0.52 -0.00 0.00 -1.52 0.00 0.00 31.29 30.76 1zll h VAL 49 CO -0.11 0.00 -1.32 0.24 0.02 0.00 0.00 177.57 176.39 1zll h MET 50 N 0.00 0.25 -0.06 1.57 2.86 -0.35 -3.28 114.93 115.92 1zll h MET 50 Ca 0.29 -0.44 -0.11 0.00 -2.06 0.00 0.00 59.70 57.38 1zll h MET 50 Cb 1.50 0.16 -0.01 0.00 0.06 0.00 0.00 31.60 33.31 1zll h MET 50 CO -0.00 1.17 -0.47 -0.07 1.06 0.00 0.00 176.91 178.60 1zll h LEU 51 N 0.07 0.15 0.00 1.22 3.38 -0.09 -3.52 115.31 116.52 1zll h LEU 51 Ca -0.16 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 57.74 1zll h LEU 51 Cb 1.98 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 42.69 1zll h LEU 51 CO 0.19 0.60 0.00 0.18 0.09 0.00 0.00 178.44 179.50