#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1be3 s ARG 47 N 0.00 3.13 0.20 -1.58 3.52 -1.26 -5.09 118.95 117.88 1be3 s ARG 47 Ca 0.00 -0.80 -0.32 0.00 -0.13 0.00 0.00 55.73 54.48 1be3 s ARG 47 Cb 0.00 -2.50 -0.12 0.00 -1.56 0.00 0.00 34.95 30.77 1be3 s ARG 47 CO 0.00 0.05 1.73 -1.12 -0.81 0.00 0.00 175.30 175.16 1be3 s SER 48 N 0.69 6.38 -0.66 -2.12 0.01 -1.26 -4.95 113.70 111.80 1be3 s SER 48 Ca -0.09 2.86 0.03 0.00 1.31 0.00 0.00 55.95 60.06 1be3 s SER 48 Cb -0.16 -2.60 0.37 0.00 0.21 0.00 0.00 66.02 63.84 1be3 s SER 48 CO 0.01 -0.98 1.35 0.52 0.41 0.00 0.00 173.24 174.56 1be3 n VAL 49 N 4.06 3.44 0.04 3.43 0.31 -1.26 -4.86 118.33 123.49 1be3 n VAL 49 Ca 0.16 -5.19 -0.13 0.00 -0.01 0.00 0.00 64.34 59.17 1be3 n VAL 49 Cb 0.35 -1.35 -0.14 0.00 -0.91 0.00 0.00 33.84 31.80 1be3 n VAL 49 CO 0.00 0.00 0.00 0.25 -1.32 0.00 0.00 176.83 175.76 1be3 h LEU 50 N 3.05 0.21-10.57 7.52 5.85 -2.04 -3.48 115.31 115.85 1be3 h LEU 50 Ca 0.34 -0.30 -0.52 0.00 0.84 0.00 0.00 57.88 58.24 1be3 h LEU 50 Cb 0.53 -0.07 0.01 0.00 0.37 0.00 0.00 40.66 41.49 1be3 h LEU 50 CO 1.01 1.26 -0.15 0.00 -0.34 0.00 0.00 178.44 180.21 1be3 h ARG 52 N 0.33 0.04 -1.00 0.00 0.11 -2.03 -2.98 114.38 108.84 1be3 h ARG 52 Ca -0.31 -0.00 0.41 0.00 0.10 0.00 0.00 59.98 60.17 1be3 h ARG 52 Cb 1.29 -0.01 -0.18 0.00 1.11 0.00 0.00 29.97 32.18 1be3 h ARG 52 CO 0.45 0.03 0.49 1.05 0.10 0.00 0.00 179.97 182.09 1be3 h GLU 53 N 0.04 0.00 -2.21 0.08 4.11 -1.98 -3.42 114.58 111.20 1be3 h GLU 53 Ca 0.86 -0.00 -0.27 0.00 0.07 0.00 0.00 59.36 60.02 1be3 h GLU 53 Cb 2.76 -0.00 0.03 0.00 0.50 0.00 0.00 28.75 32.03 1be3 h GLU 53 CO -0.43 0.00 -0.08 0.43 0.07 0.00 0.00 179.01 179.00 1be3 n SER 54 N -5.28 -0.22 -0.58 3.06 7.64 -1.13 -4.79 113.62 112.32 1be3 n SER 54 Ca 0.37 0.42 -0.01 0.00 1.01 0.00 0.00 58.87 60.66 1be3 n SER 54 Cb 1.24 -0.34 -0.01 0.00 -1.01 0.00 0.00 64.21 64.09 1be3 n SER 54 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1be3 n LEU 55 N 0.64 -0.16 -4.62 -3.43 4.77 -1.26 -5.12 117.00 107.82 1be3 n LEU 55 Ca 0.07 -1.15 -0.38 0.00 -0.03 0.00 0.00 56.01 54.52 1be3 n LEU 55 Cb 0.06 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.05 1be3 n LEU 55 CO 0.22 1.08 -0.05 -0.13 -1.33 0.00 0.00 177.39 177.17 1be3 s ARG 56 N 0.00 4.02 -0.17 3.23 0.52 -1.26 -5.02 118.95 120.27 1be3 s ARG 56 Ca 0.00 -0.11 -0.29 0.00 -0.52 0.00 0.00 55.73 54.81 1be3 s ARG 56 Cb 0.00 -3.62 0.11 0.00 0.52 0.00 0.00 34.95 31.95 1be3 s ARG 56 CO 0.00 -0.16 0.90 0.20 0.02 0.00 0.00 175.30 176.26 1be3 s GLY 57 N 1.50 -0.35 -0.17 -3.53 0.00 -1.26 -5.18 107.32 98.34 1be3 s GLY 57 Ca 0.11 2.01 -0.02 0.00 0.00 0.00 0.00 44.72 46.82 1be3 s GLY 57 CO 0.09 1.27 -0.10 1.20 0.00 0.00 0.00 173.10 175.57 1be3 s GLN 58 N -0.66 3.36 0.00 2.90 -0.21 -1.26 -5.03 119.66 118.76 1be3 s GLN 58 Ca -0.03 -0.66 0.00 0.00 0.02 0.00 0.00 55.36 54.69 1be3 s GLN 58 Cb -0.02 -2.79 0.00 0.00 1.00 0.00 0.00 33.01 31.20 1be3 s GLN 58 CO 0.02 0.02 0.00 0.00 -2.12 0.00 0.00 175.29 173.20 1be3 n ALA 59 N 4.12 0.00 -2.54 6.09 0.00 -1.26 -5.02 120.51 121.90 1be3 n ALA 59 Ca -0.18 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 52.96 1be3 n ALA 59 Cb 0.52 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.94 1be3 n ALA 59 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1be3 s ALA 60 N 0.00 4.40 0.00 0.00 0.00 -1.25 -5.12 121.76 119.79 1be3 s ALA 60 Ca 0.00 -0.80 0.00 0.00 0.00 0.00 0.00 51.96 51.16 1be3 s ALA 60 Cb 0.00 -0.46 0.00 0.00 0.00 0.00 0.00 23.12 22.66 1be3 s ALA 60 CO 0.00 -0.30 0.15 0.41 0.00 0.00 0.00 175.76 176.01 1be3 n GLY 61 N -1.62 -0.59 0.10 0.00 0.00 -1.26 -4.70 105.19 97.12 1be3 n GLY 61 Ca -0.09 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 45.91 1be3 n GLY 61 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1be3 h ARG 62 N 0.00 -0.15 -6.68 1.61 9.65 -2.00 -3.46 114.38 113.35 1be3 h ARG 62 Ca 0.00 0.01 -0.52 0.00 -1.10 0.00 0.00 59.98 58.37 1be3 h ARG 62 Cb 0.00 0.03 0.03 0.00 -1.39 0.00 0.00 29.97 28.65 1be3 h ARG 62 CO 0.00 -0.10 0.65 -2.14 2.80 0.00 0.00 179.97 181.18 1be3 s PRO 63 N -2.00 4.39 -0.07 0.20 0.02 -1.26 -5.04 135.00 131.23 1be3 s PRO 63 Ca -0.02 2.05 -0.03 0.00 0.02 0.00 0.00 61.00 63.02 1be3 s PRO 63 Cb 0.00 -3.19 0.04 0.00 0.02 0.00 0.00 34.50 31.37 1be3 s PRO 63 CO 0.07 -0.24 0.07 -1.17 -0.33 0.00 0.00 177.00 175.39 1be3 s LEU 64 N -0.16 0.18 -0.56 -5.54 2.96 -1.26 -3.96 118.68 110.34 1be3 s LEU 64 Ca 0.56 -0.09 -0.14 0.00 -0.22 0.00 0.00 54.13 54.25 1be3 s LEU 64 Cb -0.36 -0.15 0.02 0.00 0.50 0.00 0.00 46.19 46.19 1be3 s LEU 64 CO 0.38 -0.27 0.64 0.52 -1.32 0.00 0.00 176.35 176.30 1be3 n VAL 65 N 5.30 -8.78 -3.57 1.68 0.31 -1.26 -4.99 118.33 107.01 1be3 n VAL 65 Ca -0.04 0.34 -0.41 0.00 -0.01 0.00 0.00 64.34 64.22 1be3 n VAL 65 Cb 0.50 -6.09 -0.10 0.00 -0.91 0.00 0.00 33.84 27.24 1be3 n VAL 65 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1be3 s ALA 66 N -2.57 3.32 -0.20 3.52 0.00 -1.17 -4.95 121.76 119.71 1be3 s ALA 66 Ca 0.18 -2.04 -0.09 0.00 0.00 0.00 0.00 51.96 50.00 1be3 s ALA 66 Cb -0.04 -2.70 -0.05 0.00 0.00 0.00 0.00 23.12 20.34 1be3 s ALA 66 CO 0.80 -1.60 0.12 -1.54 0.00 0.00 0.00 175.76 173.54 1be3 s SER 67 N 2.05 6.05 -0.10 0.00 1.04 -1.26 -2.71 113.70 118.77 1be3 s SER 67 Ca 0.03 0.17 -0.02 0.00 0.48 0.00 0.00 55.95 56.61 1be3 s SER 67 Cb -0.22 -2.06 -0.03 0.00 0.10 0.00 0.00 66.02 63.80 1be3 s SER 67 CO 0.04 0.16 0.00 -0.69 0.98 0.00 0.00 173.24 173.73 1be3 s VAL 68 N 0.48 4.33 -0.29 5.02 1.01 -0.92 -5.01 120.40 125.02 1be3 s VAL 68 Ca 0.07 -0.24 0.00 0.00 0.00 0.00 0.00 61.98 61.82 1be3 s VAL 68 Cb -0.12 -2.83 0.09 0.00 0.00 0.00 0.00 36.38 33.52 1be3 s VAL 68 CO -0.00 0.59 0.05 -0.55 0.00 0.00 0.00 175.10 175.19 1be3 s SER 69 N -0.72 4.06 0.26 3.32 0.15 -1.26 -0.87 113.70 118.64 1be3 s SER 69 Ca 0.11 -1.58 0.07 0.00 0.70 0.00 0.00 55.95 55.25 1be3 s SER 69 Cb -0.12 -1.07 -0.03 0.00 -1.71 0.00 0.00 66.02 63.09 1be3 s SER 69 CO 0.02 -0.36 0.23 -0.22 1.20 0.00 0.00 173.24 174.11 1be3 s LEU 70 N 1.44 3.83 0.29 3.45 2.96 -1.02 -5.01 118.68 124.61 1be3 s LEU 70 Ca 0.06 -0.26 -0.02 0.00 -0.22 0.00 0.00 54.13 53.70 1be3 s LEU 70 Cb -0.18 -2.38 0.45 0.00 0.50 0.00 0.00 46.19 44.58 1be3 s LEU 70 CO -0.16 -0.09 1.92 -1.13 -1.32 0.00 0.00 176.35 175.57 1be3 h ASN 71 N 1.42 0.98 0.00 3.68 -1.24 -2.05 -3.39 115.58 114.99 1be3 h ASN 71 Ca -0.48 -0.01 0.00 0.00 0.71 0.00 0.00 56.30 56.52 1be3 h ASN 71 Cb 1.24 -0.22 0.00 0.00 0.73 0.00 0.00 38.32 40.07 1be3 h ASN 71 CO 0.60 0.66 0.00 0.52 -1.29 0.00 0.00 177.43 177.92 1be3 n VAL 72 N -4.46 0.00 -0.22 2.57 0.31 -1.26 -5.07 118.33 110.20 1be3 n VAL 72 Ca 0.13 0.00 -0.21 0.00 -0.01 0.00 0.00 64.34 64.25 1be3 n VAL 72 Cb 0.13 -0.40 0.21 0.00 -0.91 0.00 0.00 33.84 32.86 1be3 n VAL 72 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 1be3 n PRO 73 N 0.00 -3.55 -3.64 5.55 -0.02 -1.26 -5.11 135.00 126.97 1be3 n PRO 73 Ca 0.00 -1.01 -0.07 0.00 -2.02 0.00 0.00 63.50 60.39 1be3 n PRO 73 Cb 0.00 -1.42 -0.07 0.00 -0.02 0.00 0.00 33.50 31.99 1be3 n PRO 73 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1be3 s ALA 74 N -2.08 -2.05 0.06 3.55 0.00 -1.26 -2.44 121.76 117.54 1be3 s ALA 74 Ca 0.47 1.81 -0.09 0.00 0.00 0.00 0.00 51.96 54.15 1be3 s ALA 74 Cb -0.08 -1.54 0.03 0.00 0.00 0.00 0.00 23.12 21.53 1be3 s ALA 74 CO 0.39 -0.19 0.41 -1.13 0.00 0.00 0.00 175.76 175.24 1be3 n SER 75 N 1.98 -0.64 -3.59 0.00 3.41 -0.05 -5.00 113.62 109.73 1be3 n SER 75 Ca -0.12 -1.31 -0.27 0.00 -0.26 0.00 0.00 58.87 56.91 1be3 n SER 75 Cb 0.56 1.04 -0.16 0.00 -0.26 0.00 0.00 64.21 65.39 1be3 n SER 75 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1be3 s VAL 76 N -2.33 -0.08 0.00 -3.33 1.01 -1.26 -2.18 120.40 112.23 1be3 s VAL 76 Ca 0.09 -0.33 0.00 0.00 0.00 0.00 0.00 61.98 61.74 1be3 s VAL 76 Cb -0.01 -0.69 0.00 0.00 0.00 0.00 0.00 36.38 35.68 1be3 s VAL 76 CO 0.02 -0.41 0.00 -2.11 0.00 0.00 0.00 175.10 172.60 1be3 n ARG 77 N 5.27 2.68 0.00 2.72 1.85 -1.10 -5.02 116.66 123.07 1be3 n ARG 77 Ca -0.07 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.78 1be3 n ARG 77 Cb 0.47 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.88 1be3 n ARG 77 CO 0.00 0.00 0.00 2.48 -0.01 0.00 0.00 177.63 180.10