#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jup n ALA 2 N 0.00 4.89 -2.36 4.61 0.00 -1.26 -4.94 120.51 121.45 2jup n ALA 2 Ca 0.00 -3.93 -0.43 0.00 0.00 0.00 0.00 53.44 49.08 2jup n ALA 2 Cb 0.00 -3.49 -0.02 0.00 0.00 0.00 0.00 19.45 15.94 2jup n ALA 2 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2jup s THR 3 N 3.18 3.97 0.28 0.00 2.01 -1.26 -4.96 115.64 118.85 2jup s THR 3 Ca 0.48 1.03 -0.08 0.00 0.31 0.00 0.00 61.69 63.43 2jup s THR 3 Cb 0.10 -4.16 -0.00 0.00 0.01 0.00 0.00 72.50 68.45 2jup s THR 3 CO -0.03 -0.64 0.45 0.00 -0.69 0.00 0.00 174.62 173.71 2jup s ALA 4 N 5.09 0.25 0.43 7.40 0.00 -1.26 -5.19 121.76 128.48 2jup s ALA 4 Ca 0.60 -1.19 0.05 0.00 0.00 0.00 0.00 51.96 51.43 2jup s ALA 4 Cb -0.15 1.12 -0.06 0.00 0.00 0.00 0.00 23.12 24.03 2jup s ALA 4 CO 0.29 -0.81 0.01 0.14 0.00 0.00 0.00 175.76 175.40 2jup s VAL 5 N -3.64 1.73 1.03 0.00 -7.23 -1.26 -5.06 120.40 105.98 2jup s VAL 5 Ca 0.27 -2.00 -0.17 0.00 -1.81 0.00 0.00 61.98 58.27 2jup s VAL 5 Cb 0.00 -2.78 0.22 0.00 0.56 0.00 0.00 36.38 34.38 2jup s VAL 5 CO 0.13 0.00 1.24 -0.44 -0.31 0.00 0.00 175.10 175.72 2jup s SER 6 N -3.74 2.51 -0.51 4.85 0.01 -1.26 -4.93 113.70 110.63 2jup s SER 6 Ca 0.28 0.45 -0.28 0.00 1.31 0.00 0.00 55.95 57.71 2jup s SER 6 Cb 0.08 -0.61 0.01 0.00 0.21 0.00 0.00 66.02 65.71 2jup s SER 6 CO 0.14 -3.12 1.40 -1.61 0.41 0.00 0.00 173.24 170.45 2jup s GLU 7 N -5.68 3.42 -0.27 12.44 8.01 -1.26 -4.95 118.70 130.41 2jup s GLU 7 Ca 0.72 0.63 0.00 0.00 0.01 0.00 0.00 54.97 56.32 2jup s GLU 7 Cb -0.07 -4.08 0.05 0.00 -4.31 0.00 0.00 34.13 25.72 2jup s GLU 7 CO 0.54 -1.78 -0.06 -1.58 0.01 0.00 0.00 175.26 172.39 2jup s TRP 8 N 5.75 3.20 0.38 1.61 0.23 -1.26 -0.43 118.94 128.42 2jup s TRP 8 Ca 0.55 -1.94 0.04 0.00 -2.03 0.00 0.00 56.10 52.72 2jup s TRP 8 Cb -0.11 -2.03 -0.01 0.00 0.03 0.00 0.00 33.47 31.35 2jup s TRP 8 CO 0.28 -0.81 0.55 -0.08 0.96 0.00 0.00 176.95 177.85 2jup s THR 9 N 1.22 3.99 -0.30 2.01 -1.32 -1.24 -4.95 115.64 115.05 2jup s THR 9 Ca -0.05 -0.81 -0.05 0.00 -1.21 0.00 0.00 61.69 59.57 2jup s THR 9 Cb -0.19 -3.42 0.03 0.00 -1.51 0.00 0.00 72.50 67.41 2jup s THR 9 CO -0.04 -0.21 0.05 -1.83 -2.21 0.00 0.00 174.62 170.38 2jup s GLU 10 N -4.33 2.82 0.04 7.08 -1.05 -1.26 -3.26 118.70 118.74 2jup s GLU 10 Ca 0.47 -1.03 0.03 0.00 -0.15 0.00 0.00 54.97 54.29 2jup s GLU 10 Cb -0.10 -3.29 -0.02 0.00 -0.44 0.00 0.00 34.13 30.28 2jup s GLU 10 CO 0.34 -0.52 -0.10 0.71 0.95 0.00 0.00 175.26 176.64 2jup s TYR 11 N 1.40 0.82 -0.04 4.83 2.02 -0.15 -5.02 117.35 121.21 2jup s TYR 11 Ca -0.00 -0.44 0.02 0.00 -0.37 0.00 0.00 57.07 56.27 2jup s TYR 11 Cb -0.18 -0.48 0.02 0.00 -0.40 0.00 0.00 41.96 40.91 2jup s TYR 11 CO 0.01 -0.04 -0.07 -1.59 -1.57 0.00 0.00 175.55 172.29 2jup s LYS 12 N -1.45 0.98 0.59 -0.62 -2.85 -1.26 0.14 119.74 115.27 2jup s LYS 12 Ca -0.06 -0.20 0.08 0.00 -1.00 0.00 0.00 55.97 54.79 2jup s LYS 12 Cb -0.09 -0.92 0.09 0.00 -2.06 0.00 0.00 37.83 34.85 2jup s LYS 12 CO 0.01 -0.01 0.82 0.95 0.10 0.00 0.00 175.35 177.22 2jup s THR 13 N 0.65 2.15 -0.26 3.79 -4.23 -1.21 -4.97 115.64 111.57 2jup s THR 13 Ca -0.10 -0.95 0.22 0.00 -1.18 0.00 0.00 61.69 59.69 2jup s THR 13 Cb -0.13 -2.21 0.22 0.00 1.34 0.00 0.00 72.50 71.73 2jup s THR 13 CO 0.01 0.00 1.67 0.00 -0.54 0.00 0.00 174.62 175.76 2jup n ALA 14 N -2.32 1.17 0.59 3.99 0.00 -1.26 -1.28 120.51 121.40 2jup n ALA 14 Ca 0.16 0.18 0.12 0.00 0.00 0.00 0.00 53.44 53.89 2jup n ALA 14 Cb 0.61 -1.33 0.45 0.00 0.00 0.00 0.00 19.45 19.19 2jup n ALA 14 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2jup n ASP 15 N -2.26 0.45 -0.48 0.00 2.03 -1.26 -4.89 116.55 110.14 2jup n ASP 15 Ca -0.01 0.58 0.00 0.00 0.52 0.00 0.00 54.79 55.88 2jup n ASP 15 Cb 0.07 -0.68 0.00 0.00 -0.72 0.00 0.00 41.12 39.79 2jup n ASP 15 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2jup n GLY 16 N 0.65 0.96 3.34 0.27 0.00 -0.41 -5.07 105.19 104.93 2jup n GLY 16 Ca 0.04 -0.66 -0.30 0.00 0.00 0.00 0.00 46.02 45.11 2jup n GLY 16 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jup s LYS 17 N -4.82 1.81 -1.16 1.61 -0.14 -1.26 -5.02 119.74 110.77 2jup s LYS 17 Ca 0.00 -1.09 -0.17 0.00 -1.36 0.00 0.00 55.97 53.34 2jup s LYS 17 Cb 0.00 -1.97 0.11 0.00 -1.68 0.00 0.00 37.83 34.29 2jup s LYS 17 CO 0.00 0.51 1.48 0.99 -0.76 0.00 0.00 175.35 177.57 2jup s THR 18 N -0.79 4.51 -0.03 2.17 2.01 -1.26 -3.33 115.64 118.92 2jup s THR 18 Ca 0.11 -1.92 -0.26 0.00 0.31 0.00 0.00 61.69 59.93 2jup s THR 18 Cb -0.10 -5.00 -0.04 0.00 0.01 0.00 0.00 72.50 67.37 2jup s THR 18 CO 0.02 -1.78 0.81 -0.47 -0.69 0.00 0.00 174.62 172.51 2jup s TYR 19 N 3.16 3.63 0.01 4.92 5.04 0.12 -4.51 117.35 129.71 2jup s TYR 19 Ca 0.45 1.44 -0.00 0.00 -2.44 0.00 0.00 57.07 56.52 2jup s TYR 19 Cb -0.01 -2.92 -0.04 0.00 0.35 0.00 0.00 41.96 39.34 2jup s TYR 19 CO -0.01 0.07 0.09 0.71 -1.34 0.00 0.00 175.55 175.07 2jup s TYR 20 N 0.78 3.29 -0.37 4.97 1.51 0.15 -0.98 117.35 126.70 2jup s TYR 20 Ca 0.43 0.20 -0.04 0.00 -1.01 0.00 0.00 57.07 56.65 2jup s TYR 20 Cb -0.19 -1.73 0.08 0.00 -0.11 0.00 0.00 41.96 40.01 2jup s TYR 20 CO 0.22 0.55 0.14 -0.47 -1.11 0.00 0.00 175.55 174.88 2jup s TYR 21 N -1.24 3.43 -0.32 2.71 6.14 -1.20 -0.29 117.35 126.58 2jup s TYR 21 Ca 0.24 -2.04 -0.27 0.00 0.64 0.00 0.00 57.07 55.64 2jup s TYR 21 Cb -0.12 -2.75 -0.05 0.00 0.42 0.00 0.00 41.96 39.46 2jup s TYR 21 CO 0.16 -0.88 2.22 1.21 0.64 0.00 0.00 175.55 178.90 2jup s ASN 22 N 1.64 5.19 0.00 4.32 3.84 0.67 -3.60 114.94 127.00 2jup s ASN 22 Ca 0.02 1.55 0.29 0.00 0.21 0.00 0.00 52.86 54.94 2jup s ASN 22 Cb -0.21 -2.51 1.34 0.00 -0.55 0.00 0.00 41.25 39.31 2jup s ASN 22 CO -0.02 -2.22 1.91 0.59 -2.79 0.00 0.00 177.10 174.57 2jup n ASN 23 N 12.83 0.96 0.00 -4.21 3.02 0.43 0.13 115.26 128.42 2jup n ASN 23 Ca 0.31 -1.29 0.00 0.00 -0.03 0.00 0.00 54.58 53.57 2jup n ASN 23 Cb 0.48 -0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.65 2jup n ASN 23 CO 0.00 0.00 0.00 -1.14 -2.62 0.00 0.00 177.26 173.50 2jup n ARG 24 N -0.27 0.00 -0.32 3.52 0.63 -1.25 -4.03 116.66 114.94 2jup n ARG 24 Ca 0.20 0.22 0.10 0.00 -0.92 0.00 0.00 57.85 57.46 2jup n ARG 24 Cb 0.27 -1.22 0.28 0.00 0.45 0.00 0.00 32.46 32.25 2jup n ARG 24 CO 0.00 0.00 0.00 -2.37 -2.51 0.00 0.00 177.63 172.75 2jup n THR 25 N -1.17 0.97 -2.64 5.15 5.66 -1.26 -4.95 114.28 116.05 2jup n THR 25 Ca 0.00 -0.99 -0.03 0.00 -3.05 0.00 0.00 64.05 59.98 2jup n THR 25 Cb 0.00 0.53 0.01 0.00 -1.55 0.00 0.00 70.33 69.32 2jup n THR 25 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 175.07 172.20 2jup n LEU 26 N 1.41 -5.15 -4.60 1.09 4.77 -1.12 -5.08 117.00 108.32 2jup n LEU 26 Ca 0.22 -0.18 -0.27 0.00 -0.03 0.00 0.00 56.01 55.74 2jup n LEU 26 Cb 0.58 -2.57 -0.11 0.00 -2.33 0.00 0.00 43.42 38.99 2jup n LEU 26 CO 0.15 -0.54 -0.30 -0.70 -1.33 0.00 0.00 177.39 174.67 2jup s GLU 27 N -3.29 1.93 0.15 3.23 2.56 0.12 -4.99 118.70 118.41 2jup s GLU 27 Ca 0.10 -2.08 0.09 0.00 0.00 0.00 0.00 54.97 53.07 2jup s GLU 27 Cb -0.01 -1.60 -0.04 0.00 2.00 0.00 0.00 34.13 34.47 2jup s GLU 27 CO 0.53 -0.04 -0.13 -1.12 -0.56 0.00 0.00 175.26 173.93 2jup s SER 28 N -3.69 4.11 -0.07 -1.70 0.01 -1.26 -0.24 113.70 110.86 2jup s SER 28 Ca 0.35 -0.57 -0.02 0.00 1.31 0.00 0.00 55.95 57.02 2jup s SER 28 Cb 0.09 -0.65 0.04 0.00 0.21 0.00 0.00 66.02 65.71 2jup s SER 28 CO 0.18 0.14 0.05 0.42 0.41 0.00 0.00 173.24 174.44 2jup s THR 29 N -1.47 -0.00 -0.02 1.44 -4.23 0.61 -4.78 115.64 107.19 2jup s THR 29 Ca 0.22 0.24 -0.24 0.00 -1.18 0.00 0.00 61.69 60.73 2jup s THR 29 Cb -0.10 -0.32 -0.17 0.00 1.34 0.00 0.00 72.50 73.25 2jup s THR 29 CO 0.13 0.10 1.13 -0.50 -0.54 0.00 0.00 174.62 174.93 2jup h TRP 30 N 8.41 -0.25 -4.60 3.99 4.06 -1.91 0.42 115.95 126.08 2jup h TRP 30 Ca -0.14 -0.01 -0.18 0.00 2.06 0.00 0.00 58.89 60.62 2jup h TRP 30 Cb 1.13 0.08 -0.01 0.00 -1.00 0.00 0.00 29.16 29.36 2jup h TRP 30 CO 0.41 0.13 -0.09 0.39 -3.56 0.00 0.00 178.44 175.73 2jup n GLU 31 N -5.01 1.22 -1.69 0.49 1.02 -1.26 -3.50 120.64 111.91 2jup n GLU 31 Ca -0.09 -1.10 -0.60 0.00 -0.02 0.00 0.00 57.16 55.36 2jup n GLU 31 Cb 0.26 0.11 -0.08 0.00 -0.02 0.00 0.00 31.44 31.71 2jup n GLU 31 CO 0.00 0.00 0.00 0.36 1.18 0.00 0.00 177.13 178.67 2jup n LYS 32 N -0.93 0.69 -0.70 3.49 2.85 -1.26 -4.65 118.16 117.65 2jup n LYS 32 Ca -0.00 0.25 -0.32 0.00 -1.05 0.00 0.00 58.31 57.18 2jup n LYS 32 Cb 0.20 -1.86 0.16 0.00 -0.65 0.00 0.00 35.03 32.88 2jup n LYS 32 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 177.40 177.00 2jup n PRO 33 N 4.18 -1.26 0.23 -1.58 -0.04 -1.26 -4.81 135.00 130.46 2jup n PRO 33 Ca 0.26 -0.34 0.16 0.00 -0.04 0.00 0.00 63.50 63.53 2jup n PRO 33 Cb 0.08 -1.75 0.73 0.00 -0.04 0.00 0.00 33.50 32.51 2jup n PRO 33 CO 0.00 0.00 0.00 1.96 -0.04 0.00 0.00 175.50 177.42 2jup h GLN 34 N -1.94 0.00 0.00 0.54 4.20 -1.96 -0.17 115.11 115.78 2jup h GLN 34 Ca -0.51 0.00 -0.08 0.00 0.06 0.00 0.00 58.65 58.12 2jup h GLN 34 Cb 1.34 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 29.11 2jup h GLN 34 CO 0.37 0.00 -1.10 0.93 -0.67 0.00 0.00 178.83 178.37 2jup h GLU 35 N 0.00 0.00 -4.15 1.46 5.08 -1.97 -3.42 114.58 111.57 2jup h GLU 35 Ca 0.00 0.00 -0.77 0.00 -1.00 0.00 0.00 59.36 57.59 2jup h GLU 35 Cb 0.25 0.00 -0.23 0.00 0.50 0.00 0.00 28.75 29.27 2jup h GLU 35 CO 0.00 0.15 0.85 -0.51 -1.00 0.00 0.00 179.01 178.50 2jup s LEU 36 N -5.64 5.74 0.00 1.33 1.43 -0.07 -4.97 118.68 116.50 2jup s LEU 36 Ca -0.01 -3.24 0.00 0.00 -1.03 0.00 0.00 54.13 49.85 2jup s LEU 36 Cb 0.09 -2.30 0.00 0.00 0.03 0.00 0.00 46.19 44.01 2jup s LEU 36 CO 0.79 -0.53 0.00 0.29 0.23 0.00 0.00 176.35 177.13