#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1qjx s ALA 2 N 0.00 2.13 -1.24 4.61 0.00 -1.26 0.98 121.76 126.98 1qjx s ALA 2 Ca 0.00 -1.43 -0.09 0.00 0.00 0.00 0.00 51.96 50.44 1qjx s ALA 2 Cb 0.00 -1.44 0.20 0.00 0.00 0.00 0.00 23.12 21.88 1qjx s ALA 2 CO 0.00 -1.11 1.77 0.94 0.00 0.00 0.00 175.76 177.36 1qjx n GLN 3 N 4.61 3.78 -1.99 0.00 0.00 -1.14 -4.91 117.38 117.72 1qjx n GLN 3 Ca -0.13 -3.75 -0.43 0.00 -0.00 0.00 0.00 57.00 52.69 1qjx n GLN 3 Cb 0.44 -2.85 -0.03 0.00 0.00 0.00 0.00 30.24 27.81 1qjx n GLN 3 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.06 177.14 1qjx s VAL 4 N -0.19 3.49 0.34 1.69 1.01 -1.25 -3.73 120.40 121.77 1qjx s VAL 4 Ca 0.38 0.53 0.07 0.00 0.00 0.00 0.00 61.98 62.96 1qjx s VAL 4 Cb 0.08 -3.59 -0.02 0.00 0.00 0.00 0.00 36.38 32.85 1qjx s VAL 4 CO 0.02 -0.32 0.37 -0.44 0.00 0.00 0.00 175.10 174.73 1qjx s SER 5 N 5.53 5.56 -0.07 3.32 0.01 -0.54 -4.93 113.70 122.57 1qjx s SER 5 Ca 0.79 -0.38 -0.08 0.00 1.31 0.00 0.00 55.95 57.59 1qjx s SER 5 Cb -0.25 -1.06 0.02 0.00 0.21 0.00 0.00 66.02 64.94 1qjx s SER 5 CO 0.33 -0.40 0.22 -0.60 0.41 0.00 0.00 173.24 173.20 1qjx s ARG 6 N -4.07 0.30 0.00 12.44 3.52 -1.26 -1.94 118.95 127.93 1qjx s ARG 6 Ca 0.43 0.23 0.00 0.00 -0.13 0.00 0.00 55.73 56.26 1qjx s ARG 6 Cb -0.07 0.14 0.00 0.00 -1.56 0.00 0.00 34.95 33.46 1qjx s ARG 6 CO 0.28 -0.04 0.00 0.94 -0.81 0.00 0.00 175.30 175.67 1qjx n GLN 7 N 2.77 0.00 -5.22 5.12 7.27 -1.26 -4.94 117.38 121.12 1qjx n GLN 7 Ca -0.14 0.00 -0.30 0.00 0.07 0.00 0.00 57.00 56.63 1qjx n GLN 7 Cb 0.58 -0.02 -0.16 0.00 2.41 0.00 0.00 30.24 33.05 1qjx n GLN 7 CO 0.00 0.00 0.00 0.45 0.07 0.00 0.00 177.06 177.58 1qjx s SER 23 N 0.00 2.92 -0.74 1.69 0.15 -1.26 -4.88 113.70 111.59 1qjx s SER 23 Ca 0.00 -0.47 -0.11 0.00 0.70 0.00 0.00 55.95 56.07 1qjx s SER 23 Cb 0.00 -0.61 0.19 0.00 -1.71 0.00 0.00 66.02 63.89 1qjx s SER 23 CO 0.00 0.26 0.64 -0.22 1.20 0.00 0.00 173.24 175.12 1qjx s LEU 24 N -0.31 6.27 0.12 3.45 2.96 -1.26 -5.06 118.68 124.85 1qjx s LEU 24 Ca 0.02 -2.63 -0.27 0.00 -0.22 0.00 0.00 54.13 51.02 1qjx s LEU 24 Cb -0.12 -2.11 -0.07 0.00 0.50 0.00 0.00 46.19 44.40 1qjx s LEU 24 CO 0.02 -0.55 0.84 0.20 -1.32 0.00 0.00 176.35 175.54 1qjx s ASN 25 N 1.90 7.39 -0.10 3.68 0.01 -1.26 -4.40 114.94 122.16 1qjx s ASN 25 Ca 0.16 1.65 -0.02 0.00 -0.71 0.00 0.00 52.86 53.94 1qjx s ASN 25 Cb -0.15 -2.52 -0.03 0.00 0.41 0.00 0.00 41.25 38.95 1qjx s ASN 25 CO -0.06 0.06 -0.02 -0.47 -1.51 0.00 0.00 177.10 175.10 1qjx s TYR 26 N -0.46 3.10 -0.58 2.20 5.04 -0.82 -4.93 117.35 120.90 1qjx s TYR 26 Ca 0.40 0.09 0.04 0.00 -2.44 0.00 0.00 57.07 55.16 1qjx s TYR 26 Cb -0.23 -1.81 0.16 0.00 0.35 0.00 0.00 41.96 40.44 1qjx s TYR 26 CO 0.27 0.36 0.39 -0.06 -1.34 0.00 0.00 175.55 175.17 1qjx s PHE 27 N -0.65 2.71 -1.37 4.97 0.08 -1.26 -1.47 117.98 120.98 1qjx s PHE 27 Ca 0.10 -2.94 -0.16 0.00 0.12 0.00 0.00 56.93 54.06 1qjx s PHE 27 Cb -0.12 -2.18 0.06 0.00 -0.57 0.00 0.00 43.02 40.22 1qjx s PHE 27 CO 0.02 -0.67 1.97 -1.71 -0.10 0.00 0.00 175.22 174.73 1qjx n ASN 28 N 2.55 4.44 -4.74 1.36 4.05 -1.24 -4.86 115.26 116.81 1qjx n ASN 28 Ca 0.19 -2.89 -0.41 0.00 0.45 0.00 0.00 54.58 51.92 1qjx n ASN 28 Cb 0.37 -1.69 -0.05 0.00 1.23 0.00 0.00 39.78 39.65 1qjx n ASN 28 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 177.26 173.58 1qjx s ILE 29 N 3.46 3.94 -0.34 -1.44 1.01 -1.24 -2.89 121.20 123.71 1qjx s ILE 29 Ca 0.50 1.77 -0.00 0.00 0.00 0.00 0.00 60.65 62.91 1qjx s ILE 29 Cb 0.09 -4.13 0.08 0.00 0.01 0.00 0.00 42.46 38.51 1qjx s ILE 29 CO -0.01 0.34 0.06 0.21 0.00 0.00 0.00 174.94 175.55 1qjx s ASN 30 N -0.46 4.92 0.54 3.58 2.47 0.27 -4.98 114.94 121.28 1qjx s ASN 30 Ca 0.46 -1.73 0.32 0.00 0.42 0.00 0.00 52.86 52.33 1qjx s ASN 30 Cb -0.28 -1.71 1.26 0.00 -1.45 0.00 0.00 41.25 39.07 1qjx s ASN 30 CO 0.35 -0.37 1.95 1.88 -3.72 0.00 0.00 177.10 177.18 1qjx h TYR 31 N 7.89 0.00 -1.98 0.43 0.05 -1.96 -3.21 116.97 118.19 1qjx h TYR 31 Ca -0.14 0.00 -0.61 0.00 0.05 0.00 0.00 58.73 58.02 1qjx h TYR 31 Cb 1.04 0.00 -0.13 0.00 1.01 0.00 0.00 36.73 38.65 1qjx h TYR 31 CO 0.56 0.02 -0.69 -0.06 -1.05 0.00 0.00 178.16 176.94 1qjx s PHE 32 N -3.63 2.40 -0.64 4.88 0.08 -1.26 -4.99 117.98 114.82 1qjx s PHE 32 Ca 0.02 -0.47 0.08 0.00 0.12 0.00 0.00 56.93 56.68 1qjx s PHE 32 Cb 0.09 -1.33 0.47 0.00 -0.57 0.00 0.00 43.02 41.67 1qjx s PHE 32 CO 0.56 0.60 1.22 1.63 -0.10 0.00 0.00 175.22 179.12 1qjx n LYS 33 N -0.78 3.18 -4.90 0.44 5.02 -1.26 -4.85 118.16 115.00 1qjx n LYS 33 Ca -0.05 -1.79 -0.29 0.00 -2.02 0.00 0.00 58.31 54.17 1qjx n LYS 33 Cb 0.63 -1.91 -0.15 0.00 -0.02 0.00 0.00 35.03 33.58 1qjx n LYS 33 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1qjx s ASP 34 N -0.47 2.85 0.35 4.39 1.01 -1.26 -5.02 116.67 118.52 1qjx s ASP 34 Ca 0.31 -0.52 0.09 0.00 0.71 0.00 0.00 52.55 53.14 1qjx s ASP 34 Cb 0.23 -0.27 0.66 0.00 1.01 0.00 0.00 42.92 44.55 1qjx s ASP 34 CO 0.10 0.24 1.82 0.00 0.21 0.00 0.00 175.17 177.54 1qjx h ALA 35 N 5.02 1.35 0.00 5.23 0.00 -2.00 -2.68 119.26 126.18 1qjx h ALA 35 Ca -0.44 -0.31 -0.02 0.00 0.00 0.00 0.00 54.91 54.14 1qjx h ALA 35 Cb 1.14 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.85 1qjx h ALA 35 CO 0.45 0.46 -0.12 0.00 0.00 0.00 0.00 179.25 180.04 1qjx h ALA 36 N 1.55 1.54 0.00 0.00 0.00 -1.98 -2.83 119.26 117.54 1qjx h ALA 36 Ca 0.02 -0.11 -0.05 0.00 0.00 0.00 0.00 54.91 54.78 1qjx h ALA 36 Cb 0.59 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 1qjx h ALA 36 CO 0.04 0.15 -0.23 0.77 0.00 0.00 0.00 179.25 179.98 1qjx h SER 37 N 0.00 0.00 -4.06 0.00 0.02 -1.86 -3.45 113.55 104.20 1qjx h SER 37 Ca -0.00 0.00 -0.49 0.00 -0.84 0.00 0.00 61.79 60.46 1qjx h SER 37 Cb 0.25 0.00 0.16 0.00 0.14 0.00 0.00 62.40 62.95 1qjx h SER 37 CO 0.02 0.23 0.23 -0.94 -1.14 0.00 0.00 176.83 175.23 1qjx s SER 38 N -6.62 3.32 0.45 3.07 1.04 -1.07 -4.99 113.70 108.91 1qjx s SER 38 Ca -0.03 1.62 0.00 0.00 0.48 0.00 0.00 55.95 58.02 1qjx s SER 38 Cb 0.14 -2.28 0.00 0.00 0.10 0.00 0.00 66.02 63.98 1qjx s SER 38 CO 0.66 -2.75 0.00 0.61 0.98 0.00 0.00 173.24 172.74 1qjx n GLY 39 N -0.81 -1.74 3.61 7.32 0.00 -1.26 -4.98 105.19 107.32 1qjx n GLY 39 Ca 0.07 -1.51 -0.38 0.00 0.00 0.00 0.00 46.02 44.20 1qjx n GLY 39 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1qjx n ALA 40 N -3.00 0.16 -1.78 4.61 0.00 -1.26 -4.97 120.51 114.27 1qjx n ALA 40 Ca 0.00 0.03 -0.31 0.00 0.00 0.00 0.00 53.44 53.16 1qjx n ALA 40 Cb 0.00 -2.10 0.01 0.00 0.00 0.00 0.00 19.45 17.36 1qjx n ALA 40 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1qjx s SER 41 N -1.18 6.12 0.75 0.00 0.01 -1.26 -5.06 113.70 113.08 1qjx s SER 41 Ca 0.74 1.54 -0.11 0.00 1.31 0.00 0.00 55.95 59.43 1qjx s SER 41 Cb -0.43 -2.49 0.04 0.00 0.21 0.00 0.00 66.02 63.35 1qjx s SER 41 CO 0.49 -0.94 1.09 -0.13 0.41 0.00 0.00 173.24 174.15 1qjx s ARG 42 N -4.75 2.51 0.14 12.44 0.52 -1.26 -5.05 118.95 123.50 1qjx s ARG 42 Ca 0.57 0.67 0.03 0.00 -0.52 0.00 0.00 55.73 56.48 1qjx s ARG 42 Cb -0.12 -1.96 -0.04 0.00 0.52 0.00 0.00 34.95 33.35 1qjx s ARG 42 CO 0.47 -1.33 0.24 -0.51 0.02 0.00 0.00 175.30 174.19 1qjx s LEU 43 N -5.60 4.24 0.00 2.53 1.43 -1.26 -5.31 118.68 114.70 1qjx s LEU 43 Ca 0.59 0.13 0.00 0.00 -1.03 0.00 0.00 54.13 53.82 1qjx s LEU 43 Cb -0.13 -2.82 0.00 0.00 0.03 0.00 0.00 46.19 43.27 1qjx s LEU 43 CO 0.54 0.07 0.00 -0.90 0.23 0.00 0.00 176.35 176.29