#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ldr n SER 2 N 0.00 3.49 -3.52 -1.43 3.41 -1.26 -4.84 113.62 109.46 1ldr n SER 2 Ca 0.00 -3.21 -0.22 0.00 -0.26 0.00 0.00 58.87 55.19 1ldr n SER 2 Cb 0.00 -0.85 -0.04 0.00 -0.26 0.00 0.00 64.21 63.06 1ldr n SER 2 CO 0.00 0.00 0.00 0.55 -0.16 0.00 0.00 175.04 175.43 1ldr n VAL 3 N 1.99 -0.05 -3.78 -3.33 3.14 -1.26 -4.89 118.33 110.14 1ldr n VAL 3 Ca 0.21 0.00 -0.13 0.00 -2.96 0.00 0.00 64.34 61.46 1ldr n VAL 3 Cb 0.36 -0.33 -0.14 0.00 -1.06 0.00 0.00 33.84 32.67 1ldr n VAL 3 CO 0.00 0.00 0.00 0.42 -6.46 0.00 0.00 176.83 170.79 1ldr s THR 4 N -2.65 -0.03 -0.66 1.55 -4.23 -1.26 -4.96 115.64 103.40 1ldr s THR 4 Ca 0.42 0.11 -0.01 0.00 -1.18 0.00 0.00 61.69 61.04 1ldr s THR 4 Cb -0.24 -0.22 0.00 0.00 1.34 0.00 0.00 72.50 73.38 1ldr s THR 4 CO 0.52 0.05 0.47 0.00 -0.54 0.00 0.00 174.62 175.12 1ldr n LYS 6 N -2.24 3.36 -3.15 0.00 2.85 -1.26 -4.07 118.16 113.65 1ldr n LYS 6 Ca -0.25 -3.34 -0.19 0.00 -1.05 0.00 0.00 58.31 53.48 1ldr n LYS 6 Cb 0.55 -2.31 -0.05 0.00 -0.65 0.00 0.00 35.03 32.56 1ldr n LYS 6 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 177.40 177.78 1ldr n SER 7 N 0.30 -1.30 -1.15 -5.58 7.64 -1.26 -4.89 113.62 107.39 1ldr n SER 7 Ca 0.52 -2.64 -0.15 0.00 1.01 0.00 0.00 58.87 57.61 1ldr n SER 7 Cb 0.34 0.20 -0.06 0.00 -1.01 0.00 0.00 64.21 63.67 1ldr n SER 7 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1ldr n GLY 8 N 2.49 1.49 0.00 0.23 0.00 -1.26 -4.96 105.19 103.17 1ldr n GLY 8 Ca 0.24 -0.15 0.00 0.00 0.00 0.00 0.00 46.02 46.11 1ldr n GLY 8 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1ldr n ASP 9 N -0.84 0.54 -3.52 1.61 8.00 -1.26 -2.61 116.55 118.47 1ldr n ASP 9 Ca -0.15 -0.79 0.01 0.00 0.71 0.00 0.00 54.79 54.57 1ldr n ASP 9 Cb 0.55 0.00 -0.05 0.00 -0.02 0.00 0.00 41.12 41.60 1ldr n ASP 9 CO 0.00 0.00 0.00 0.72 -0.39 0.00 0.00 177.20 177.53 1ldr s PHE 10 N 0.73 -0.42 0.15 1.24 -0.12 0.18 -4.62 117.98 115.12 1ldr s PHE 10 Ca 0.00 0.78 -0.31 0.00 -0.05 0.00 0.00 56.93 57.35 1ldr s PHE 10 Cb 0.00 0.25 -0.09 0.00 -0.63 0.00 0.00 43.02 42.55 1ldr s PHE 10 CO 0.00 -0.21 1.45 -1.54 -0.05 0.00 0.00 175.22 174.87 1ldr s SER 11 N 1.67 6.74 0.21 1.98 1.04 -1.26 -1.10 113.70 122.99 1ldr s SER 11 Ca -0.06 2.45 -0.09 0.00 0.48 0.00 0.00 55.95 58.73 1ldr s SER 11 Cb -0.04 -2.59 0.32 0.00 0.10 0.00 0.00 66.02 63.81 1ldr s SER 11 CO -0.15 -0.71 1.69 0.00 0.98 0.00 0.00 173.24 175.06 1ldr n GLY 13 N -1.33 -0.29 0.00 0.00 0.00 -1.26 -3.62 105.19 98.70 1ldr n GLY 13 Ca 0.10 0.09 0.00 0.00 0.00 0.00 0.00 46.02 46.20 1ldr n GLY 13 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ldr n GLY 14 N 0.00 2.01 3.58 -0.02 0.00 -1.26 -5.03 105.19 104.47 1ldr n GLY 14 Ca 0.00 -0.88 -0.37 0.00 0.00 0.00 0.00 46.02 44.78 1ldr n GLY 14 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ldr s ARG 15 N -0.86 3.91 -0.90 1.61 1.81 -1.26 -4.55 118.95 118.70 1ldr s ARG 15 Ca 0.00 -0.35 -0.11 0.00 -1.72 0.00 0.00 55.73 53.55 1ldr s ARG 15 Cb 0.00 -3.47 0.10 0.00 -0.45 0.00 0.00 34.95 31.13 1ldr s ARG 15 CO 0.00 -0.05 0.29 1.55 -0.68 0.00 0.00 175.30 176.41 1ldr n VAL 16 N 4.59 -0.10 0.01 3.52 3.14 -1.26 -4.83 118.33 123.39 1ldr n VAL 16 Ca -0.15 0.00 -0.01 0.00 -2.96 0.00 0.00 64.34 61.22 1ldr n VAL 16 Cb 0.52 -0.40 -0.00 0.00 -1.06 0.00 0.00 33.84 32.90 1ldr n VAL 16 CO 0.00 0.00 0.00 0.78 -6.46 0.00 0.00 176.83 171.15 1ldr h ASN 17 N -0.44 -0.05 -3.00 6.55 2.35 -2.00 -3.49 115.58 115.50 1ldr h ASN 17 Ca -0.29 0.00 0.11 0.00 -0.55 0.00 0.00 56.30 55.57 1ldr h ASN 17 Cb 1.19 0.01 -0.28 0.00 0.05 0.00 0.00 38.32 39.29 1ldr h ASN 17 CO 0.42 0.10 0.62 -0.60 -1.65 0.00 0.00 177.43 176.32 1ldr s ARG 18 N -1.54 0.36 0.42 0.81 3.52 -1.26 -5.10 118.95 116.17 1ldr s ARG 18 Ca -0.01 0.36 0.07 0.00 -0.13 0.00 0.00 55.73 56.02 1ldr s ARG 18 Cb 0.00 0.18 0.01 0.00 -1.56 0.00 0.00 34.95 33.58 1ldr s ARG 18 CO 0.02 -0.06 0.58 0.00 -0.81 0.00 0.00 175.30 175.03 1ldr s ILE 20 N -2.37 0.00 0.77 0.00 -4.36 -0.25 -4.86 121.20 110.13 1ldr s ILE 20 Ca 0.54 -1.39 -0.11 0.00 -0.26 0.00 0.00 60.65 59.43 1ldr s ILE 20 Cb -0.10 -2.19 0.05 0.00 1.25 0.00 0.00 42.46 41.48 1ldr s ILE 20 CO 0.33 -0.01 1.09 -2.16 0.24 0.00 0.00 174.94 174.44 1ldr s PRO 21 N -4.01 2.32 0.51 0.37 0.04 -1.26 0.50 135.00 133.47 1ldr s PRO 21 Ca 0.22 0.68 0.20 0.00 0.04 0.00 0.00 61.00 62.14 1ldr s PRO 21 Cb -0.01 -1.94 1.34 0.00 0.04 0.00 0.00 34.50 33.93 1ldr s PRO 21 CO 0.09 -1.46 2.12 1.96 0.04 0.00 0.00 177.00 179.74 1ldr h GLN 22 N -0.98 0.00 -0.37 4.56 1.08 -1.76 -2.23 115.11 115.42 1ldr h GLN 22 Ca -0.46 0.00 -0.05 0.00 -1.45 0.00 0.00 58.65 56.68 1ldr h GLN 22 Cb 1.26 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 28.67 1ldr h GLN 22 CO 0.59 0.07 0.02 0.35 -0.95 0.00 0.00 178.83 178.92 1ldr h PHE 23 N 0.00 0.69 0.00 2.96 3.04 -1.92 -2.19 116.94 119.53 1ldr h PHE 23 Ca -0.00 -0.11 0.00 0.00 3.98 0.00 0.00 57.97 61.84 1ldr h PHE 23 Cb 0.15 -0.18 0.00 0.00 2.56 0.00 0.00 35.95 38.47 1ldr h PHE 23 CO 0.00 0.72 0.00 0.91 -2.02 0.00 0.00 178.31 177.92 1ldr n TRP 24 N -4.51 0.00 -2.23 0.41 7.02 -0.85 -4.50 117.44 112.78 1ldr n TRP 24 Ca -0.01 0.00 -0.39 0.00 -1.02 0.00 0.00 57.50 56.08 1ldr n TRP 24 Cb 0.26 -0.47 -0.02 0.00 -2.42 0.00 0.00 31.31 28.66 1ldr n TRP 24 CO 0.00 0.00 0.00 0.50 -2.02 0.00 0.00 177.69 176.17 1ldr s ARG 25 N -2.94 4.09 0.00 -0.99 6.06 -0.82 0.12 118.95 124.47 1ldr s ARG 25 Ca 0.09 1.94 0.00 0.00 -2.50 0.00 0.00 55.73 55.26 1ldr s ARG 25 Cb 0.10 -2.76 0.00 0.00 0.06 0.00 0.00 34.95 32.36 1ldr s ARG 25 CO 0.28 -0.32 0.00 0.00 -2.50 0.00 0.00 175.30 172.76 1ldr n ASP 27 N 3.50 0.00 0.00 0.00 9.92 -1.20 -4.24 116.55 124.53 1ldr n ASP 27 Ca 0.00 0.02 0.00 0.00 -0.53 0.00 0.00 54.79 54.28 1ldr n ASP 27 Cb 0.00 -0.07 0.00 0.00 -0.64 0.00 0.00 41.12 40.41 1ldr n ASP 27 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1ldr n GLY 28 N 2.39 0.98 7.00 0.44 0.00 0.33 -3.75 105.19 112.58 1ldr n GLY 28 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1ldr n GLY 28 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1ldr n GLN 29 N -2.00 0.00 -2.91 1.61 6.02 -1.26 -2.93 117.38 115.90 1ldr n GLN 29 Ca 0.00 0.00 -0.13 0.00 -0.01 0.00 0.00 57.00 56.86 1ldr n GLN 29 Cb 0.00 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.26 1ldr n GLN 29 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 1ldr n VAL 30 N 0.00 -0.27 -0.62 5.09 0.31 -1.26 -4.86 118.33 116.72 1ldr n VAL 30 Ca 0.00 -2.31 0.05 0.00 -0.01 0.00 0.00 64.34 62.07 1ldr n VAL 30 Cb 0.00 0.26 0.34 0.00 -0.91 0.00 0.00 33.84 33.53 1ldr n VAL 30 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 1ldr n ASP 31 N 1.75 4.97 -3.22 4.52 2.03 -1.15 -4.77 116.55 120.67 1ldr n ASP 31 Ca 0.14 -2.82 -0.02 0.00 0.52 0.00 0.00 54.79 52.62 1ldr n ASP 31 Cb 0.59 -0.67 -0.03 0.00 -0.72 0.00 0.00 41.12 40.29 1ldr n ASP 31 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1ldr n ASP 33 N 5.39 0.00 0.18 0.00 9.92 -1.26 -0.67 116.55 130.11 1ldr n ASP 33 Ca 0.02 0.00 0.19 0.00 -0.53 0.00 0.00 54.79 54.47 1ldr n ASP 33 Cb 0.52 0.00 0.80 0.00 -0.64 0.00 0.00 41.12 41.79 1ldr n ASP 33 CO 0.00 0.00 0.00 -0.55 0.13 0.00 0.00 177.20 176.78 1ldr h ASN 34 N 4.67 0.00 0.00 -2.24 7.08 -2.00 -3.43 115.58 119.66 1ldr h ASN 34 Ca 0.00 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.22 1ldr h ASN 34 Cb 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 36.24 1ldr h ASN 34 CO 0.00 0.00 0.00 0.61 -2.08 0.00 0.00 177.43 175.96 1ldr n GLY 35 N -1.41 0.12 0.04 9.14 0.00 0.15 -4.95 105.19 108.28 1ldr n GLY 35 Ca 0.04 -0.17 0.12 0.00 0.00 0.00 0.00 46.02 46.00 1ldr n GLY 35 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1ldr n SER 36 N 0.00 0.63 -0.01 1.61 3.41 -0.81 -3.88 113.62 114.58 1ldr n SER 36 Ca 0.00 -0.14 0.21 0.00 -0.26 0.00 0.00 58.87 58.68 1ldr n SER 36 Cb 0.00 0.51 0.69 0.00 -0.26 0.00 0.00 64.21 65.15 1ldr n SER 36 CO 0.00 0.00 0.00 -2.24 -0.16 0.00 0.00 175.04 172.64 1ldr h ASP 37 N 0.00 0.00 -1.65 4.04 3.04 -1.81 0.39 116.42 120.43 1ldr h ASP 37 Ca 0.00 0.00 -0.65 0.00 -3.24 0.00 0.00 57.03 53.14 1ldr h ASP 37 Cb 0.69 -0.00 -0.37 0.00 -1.04 0.00 0.00 39.33 38.61 1ldr h ASP 37 CO 0.00 0.00 -0.09 -1.84 -2.04 0.00 0.00 179.24 175.27 1ldr n GLU 38 N -4.37 3.19 -3.09 4.15 0.28 -1.25 -3.11 120.64 116.45 1ldr n GLU 38 Ca 0.10 -4.14 -0.43 0.00 -0.16 0.00 0.00 57.16 52.53 1ldr n GLU 38 Cb 0.62 -2.26 0.00 0.00 1.43 0.00 0.00 31.44 31.24 1ldr n GLU 38 CO 0.00 0.00 0.00 0.94 -0.16 0.00 0.00 177.13 177.91 1ldr n GLN 39 N -0.51 4.23 -0.54 3.44 7.27 0.13 -4.71 117.38 126.68 1ldr n GLN 39 Ca 0.45 -4.55 0.00 0.00 0.07 0.00 0.00 57.00 52.97 1ldr n GLN 39 Cb 0.52 -2.50 0.00 0.00 2.41 0.00 0.00 30.24 30.67 1ldr n GLN 39 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1ldr n GLY 40 N 1.52 -0.44 0.00 1.69 0.00 -1.26 -5.03 105.19 101.67 1ldr n GLY 40 Ca 0.26 -0.51 0.03 0.00 0.00 0.00 0.00 46.02 45.80 1ldr n GLY 40 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32