#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pp9 h ALA 33 N 0.00 1.13 -2.39 0.00 0.00 -2.05 -3.44 119.26 112.52 1pp9 h ALA 33 Ca 0.00 -0.27 -0.58 0.00 0.00 0.00 0.00 54.91 54.05 1pp9 h ALA 33 Cb 0.00 -0.17 -0.08 0.00 0.00 0.00 0.00 17.79 17.54 1pp9 h ALA 33 CO 0.00 0.55 0.37 0.14 0.00 0.00 0.00 179.25 180.31 1pp9 s VAL 34 N -4.89 4.89 0.45 0.00 -7.23 -1.26 -5.04 120.40 107.32 1pp9 s VAL 34 Ca -0.09 1.55 -0.22 0.00 -1.81 0.00 0.00 61.98 61.41 1pp9 s VAL 34 Cb 0.15 -4.10 -0.09 0.00 0.56 0.00 0.00 36.38 32.89 1pp9 s VAL 34 CO 0.80 0.01 1.04 -2.16 -0.31 0.00 0.00 175.10 174.48 1pp9 s PRO 35 N 2.28 3.95 0.83 4.82 0.06 -1.26 -4.79 135.00 140.90 1pp9 s PRO 35 Ca 0.36 1.40 -0.10 0.00 0.06 0.00 0.00 61.00 62.72 1pp9 s PRO 35 Cb -0.16 -2.26 0.10 0.00 0.06 0.00 0.00 34.50 32.24 1pp9 s PRO 35 CO 0.11 -0.30 1.12 0.00 0.06 0.00 0.00 177.00 177.98 1pp9 s ALA 36 N -1.88 1.91 0.42 8.56 0.00 -1.26 -4.88 121.76 124.62 1pp9 s ALA 36 Ca 0.64 0.41 0.14 0.00 0.00 0.00 0.00 51.96 53.14 1pp9 s ALA 36 Cb -0.18 -3.35 1.00 0.00 0.00 0.00 0.00 23.12 20.59 1pp9 s ALA 36 CO 0.22 -2.21 1.94 0.00 0.00 0.00 0.00 175.76 175.72 1pp9 h THR 37 N -1.46 0.86 -3.20 0.00 1.03 -1.96 -3.38 112.91 104.80 1pp9 h THR 37 Ca -0.43 -0.16 -0.37 0.00 -0.01 0.00 0.00 66.41 65.44 1pp9 h THR 37 Cb 1.25 0.35 -0.39 0.00 -1.07 0.00 0.00 68.15 68.29 1pp9 h THR 37 CO 0.47 0.08 -0.72 -0.55 -0.01 0.00 0.00 175.52 174.79 1pp9 s SER 38 N -6.08 1.30 0.05 0.00 0.15 -1.26 -5.12 113.70 102.74 1pp9 s SER 38 Ca -0.08 -0.01 -0.30 0.00 0.70 0.00 0.00 55.95 56.26 1pp9 s SER 38 Cb 0.20 -0.07 -0.04 0.00 -1.71 0.00 0.00 66.02 64.40 1pp9 s SER 38 CO 0.76 -0.27 0.97 -1.61 1.20 0.00 0.00 173.24 174.29 1pp9 s GLU 39 N 2.19 4.62 0.58 5.44 2.02 -1.26 -4.93 118.70 127.36 1pp9 s GLU 39 Ca 0.04 1.43 -0.06 0.00 0.02 0.00 0.00 54.97 56.40 1pp9 s GLU 39 Cb -0.13 -3.42 0.00 0.00 0.10 0.00 0.00 34.13 30.68 1pp9 s GLU 39 CO -0.05 0.07 0.89 -1.54 0.02 0.00 0.00 175.26 174.64 1pp9 s SER 40 N 0.57 5.70 -0.03 -0.19 1.04 -1.26 -5.11 113.70 114.41 1pp9 s SER 40 Ca 0.50 0.75 -0.29 0.00 0.48 0.00 0.00 55.95 57.39 1pp9 s SER 40 Cb -0.22 -1.79 0.10 0.00 0.10 0.00 0.00 66.02 64.21 1pp9 s SER 40 CO 0.29 -0.99 0.83 -2.84 0.98 0.00 0.00 173.24 171.51 1pp9 s PRO 41 N -4.96 0.87 0.00 4.02 0.03 -1.26 -5.16 135.00 128.55 1pp9 s PRO 41 Ca 0.53 -0.08 0.00 0.00 0.03 0.00 0.00 61.00 61.48 1pp9 s PRO 41 Cb -0.10 0.41 0.00 0.00 0.03 0.00 0.00 34.50 34.83 1pp9 s PRO 41 CO 0.45 -0.33 0.54 1.33 0.03 0.00 0.00 177.00 179.01 1pp9 n VAL 42 N 0.25 0.00 -2.85 3.83 0.24 -1.26 -5.31 118.33 113.22 1pp9 n VAL 42 Ca -0.13 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.17 1pp9 n VAL 42 Cb 0.60 0.20 0.00 0.00 -1.47 0.00 0.00 33.84 33.17 1pp9 n VAL 42 CO 0.00 0.00 0.00 -0.24 -2.14 0.00 0.00 176.83 174.45 1pp9 n SER 48 N 0.00 0.00 -4.69 -1.34 2.88 -1.26 -5.39 113.62 103.82 1pp9 n SER 48 Ca 0.00 -0.61 -0.35 0.00 -1.33 0.00 0.00 58.87 56.58 1pp9 n SER 48 Cb 0.55 0.00 -0.09 0.00 -0.75 0.00 0.00 64.21 63.92 1pp9 n SER 48 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 1pp9 s VAL 49 N -2.76 5.29 -0.01 2.46 1.01 -1.26 -4.98 120.40 120.15 1pp9 s VAL 49 Ca 0.00 0.15 0.01 0.00 0.00 0.00 0.00 61.98 62.14 1pp9 s VAL 49 Cb 0.00 -3.42 0.01 0.00 0.00 0.00 0.00 36.38 32.97 1pp9 s VAL 49 CO 0.00 0.42 0.75 0.18 0.00 0.00 0.00 175.10 176.45 1pp9 n LEU 50 N 3.73 0.89 -3.87 3.92 4.77 -1.26 -5.07 117.00 120.11 1pp9 n LEU 50 Ca -0.16 -0.97 -0.09 0.00 -0.03 0.00 0.00 56.01 54.76 1pp9 n LEU 50 Cb 0.52 -0.02 -0.07 0.00 -2.33 0.00 0.00 43.42 41.52 1pp9 n LEU 50 CO 0.36 0.24 -0.08 0.00 -1.33 0.00 0.00 177.39 176.58 1pp9 h ARG 52 N 2.71 -0.07 -0.54 0.00 2.43 -1.98 -2.44 114.38 114.49 1pp9 h ARG 52 Ca -0.34 0.00 0.11 0.00 -0.81 0.00 0.00 59.98 58.95 1pp9 h ARG 52 Cb 1.21 0.02 -0.11 0.00 -0.42 0.00 0.00 29.97 30.66 1pp9 h ARG 52 CO 0.55 -0.01 -0.17 0.93 -1.51 0.00 0.00 179.97 179.76 1pp9 h GLU 53 N -0.11 -0.04 0.00 0.20 3.07 -1.97 0.26 114.58 115.99 1pp9 h GLU 53 Ca -0.01 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1pp9 h GLU 53 Cb 0.09 0.01 0.00 0.00 -0.84 0.00 0.00 28.75 28.01 1pp9 h GLU 53 CO 0.01 -0.03 0.00 0.43 -1.40 0.00 0.00 179.01 178.02 1pp9 n SER 54 N -5.40 0.55 -0.02 1.42 7.64 -1.17 -2.88 113.62 113.77 1pp9 n SER 54 Ca 0.05 0.62 -0.06 0.00 1.01 0.00 0.00 58.87 60.50 1pp9 n SER 54 Cb 0.31 -0.74 -0.13 0.00 -1.01 0.00 0.00 64.21 62.64 1pp9 n SER 54 CO 0.00 0.00 0.00 -0.11 -3.01 0.00 0.00 175.04 171.92 1pp9 n LEU 55 N -2.09 0.73 -4.68 -3.43 7.94 0.71 -4.83 117.00 111.35 1pp9 n LEU 55 Ca 0.03 0.34 -0.42 0.00 -1.11 0.00 0.00 56.01 54.85 1pp9 n LEU 55 Cb 0.25 0.18 -0.03 0.00 0.53 0.00 0.00 43.42 44.36 1pp9 n LEU 55 CO 0.20 0.32 1.47 -0.60 -1.11 0.00 0.00 177.39 177.68 1pp9 s ARG 56 N -2.70 4.16 0.00 1.96 6.06 0.04 -1.53 118.95 126.93 1pp9 s ARG 56 Ca -0.05 2.50 0.00 0.00 -2.50 0.00 0.00 55.73 55.68 1pp9 s ARG 56 Cb 0.08 -3.80 0.00 0.00 0.06 0.00 0.00 34.95 31.29 1pp9 s ARG 56 CO 0.82 -0.85 0.00 0.41 -2.50 0.00 0.00 175.30 173.18 1pp9 n GLY 57 N 4.26 0.83 0.09 8.12 0.00 -1.26 -4.96 105.19 112.27 1pp9 n GLY 57 Ca 0.18 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.14 1pp9 n GLY 57 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1pp9 h GLN 58 N 2.17 0.03 -6.77 1.61 1.08 -1.60 -3.45 115.11 108.18 1pp9 h GLN 58 Ca 0.00 -0.04 -0.53 0.00 -1.45 0.00 0.00 58.65 56.64 1pp9 h GLN 58 Cb 0.00 0.01 0.07 0.00 -0.05 0.00 0.00 27.48 27.51 1pp9 h GLN 58 CO 0.00 0.89 0.81 0.00 -0.95 0.00 0.00 178.83 179.57 1pp9 s ALA 59 N -3.03 3.67 0.62 3.87 0.00 -1.26 -4.98 121.76 120.65 1pp9 s ALA 59 Ca -0.00 1.42 -0.16 0.00 0.00 0.00 0.00 51.96 53.23 1pp9 s ALA 59 Cb 0.11 -3.59 -0.02 0.00 0.00 0.00 0.00 23.12 19.61 1pp9 s ALA 59 CO 0.81 -0.84 1.08 0.00 0.00 0.00 0.00 175.76 176.81 1pp9 s ALA 60 N -0.03 2.64 0.00 0.00 0.00 -1.26 -4.97 121.76 118.13 1pp9 s ALA 60 Ca 0.61 0.46 0.00 0.00 0.00 0.00 0.00 51.96 53.03 1pp9 s ALA 60 Cb -0.44 -3.27 0.00 0.00 0.00 0.00 0.00 23.12 19.41 1pp9 s ALA 60 CO 0.45 -0.98 0.00 0.41 0.00 0.00 0.00 175.76 175.64 1pp9 n GLY 61 N -0.77 1.00 3.20 0.00 0.00 -1.26 -5.12 105.19 102.23 1pp9 n GLY 61 Ca 0.09 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.01 1pp9 n GLY 61 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1pp9 s ARG 62 N -0.00 1.04 0.92 1.61 0.52 -1.26 -5.15 118.95 116.63 1pp9 s ARG 62 Ca 0.00 -1.45 -0.10 0.00 -0.52 0.00 0.00 55.73 53.65 1pp9 s ARG 62 Cb 0.00 0.27 0.15 0.00 0.52 0.00 0.00 34.95 35.89 1pp9 s ARG 62 CO 0.00 -0.32 1.13 -1.25 0.02 0.00 0.00 175.30 174.88 1pp9 s PRO 63 N -4.07 0.96 0.37 3.54 0.04 -1.26 -4.73 135.00 129.86 1pp9 s PRO 63 Ca 0.27 1.44 -0.23 0.00 0.04 0.00 0.00 61.00 62.52 1pp9 s PRO 63 Cb 0.07 -1.73 -0.10 0.00 0.04 0.00 0.00 34.50 32.77 1pp9 s PRO 63 CO 0.04 -2.63 0.93 -1.17 0.04 0.00 0.00 177.00 174.21 1pp9 s LEU 64 N -6.59 4.13 -0.02 -3.56 2.96 -1.26 -4.61 118.68 109.72 1pp9 s LEU 64 Ca 0.66 1.72 0.01 0.00 -0.22 0.00 0.00 54.13 56.30 1pp9 s LEU 64 Cb -0.22 -4.27 0.01 0.00 0.50 0.00 0.00 46.19 42.21 1pp9 s LEU 64 CO 0.58 -0.22 -0.02 -0.69 -1.32 0.00 0.00 176.35 174.69 1pp9 s VAL 65 N -1.91 0.23 -0.08 1.68 1.01 -1.00 -4.98 120.40 115.34 1pp9 s VAL 65 Ca 0.56 -0.03 0.04 0.00 0.00 0.00 0.00 61.98 62.56 1pp9 s VAL 65 Cb -0.13 -0.26 -0.00 0.00 0.00 0.00 0.00 36.38 35.99 1pp9 s VAL 65 CO 0.18 0.11 -0.23 0.00 0.00 0.00 0.00 175.10 175.16 1pp9 s ALA 66 N 0.49 2.07 0.05 5.51 0.00 -1.26 -0.95 121.76 127.67 1pp9 s ALA 66 Ca -0.05 -0.94 0.09 0.00 0.00 0.00 0.00 51.96 51.06 1pp9 s ALA 66 Cb -0.08 -0.74 -0.03 0.00 0.00 0.00 0.00 23.12 22.27 1pp9 s ALA 66 CO -0.01 0.31 -0.25 -1.12 0.00 0.00 0.00 175.76 174.69 1pp9 s SER 67 N 0.21 3.04 0.00 0.00 0.01 -0.12 -5.00 113.70 111.84 1pp9 s SER 67 Ca -0.14 -0.58 0.02 0.00 1.31 0.00 0.00 55.95 56.56 1pp9 s SER 67 Cb -0.16 -0.27 -0.01 0.00 0.21 0.00 0.00 66.02 65.79 1pp9 s SER 67 CO 0.07 0.24 -0.08 -0.69 0.41 0.00 0.00 173.24 173.19 1pp9 s VAL 68 N -0.81 0.59 0.31 3.43 1.01 -1.26 -2.28 120.40 121.39 1pp9 s VAL 68 Ca 0.11 -0.41 0.03 0.00 0.00 0.00 0.00 61.98 61.71 1pp9 s VAL 68 Cb -0.10 -0.51 -0.04 0.00 0.00 0.00 0.00 36.38 35.73 1pp9 s VAL 68 CO 0.02 0.11 0.13 -0.55 0.00 0.00 0.00 175.10 174.80 1pp9 s SER 69 N -0.34 1.70 -0.14 3.32 0.15 -1.25 -5.03 113.70 112.11 1pp9 s SER 69 Ca 0.02 -1.50 -0.12 0.00 0.70 0.00 0.00 55.95 55.04 1pp9 s SER 69 Cb -0.04 0.28 -0.24 0.00 -1.71 0.00 0.00 66.02 64.31 1pp9 s SER 69 CO -0.00 -0.81 0.35 0.25 1.20 0.00 0.00 173.24 174.22 1pp9 h LEU 70 N 2.19 0.29 -0.22 3.45 5.85 -2.01 -3.41 115.31 121.46 1pp9 h LEU 70 Ca -0.36 -0.81 0.00 0.00 0.84 0.00 0.00 57.88 57.55 1pp9 h LEU 70 Cb 1.25 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 42.19 1pp9 h LEU 70 CO 0.57 1.73 -0.31 0.59 -0.34 0.00 0.00 178.44 180.68 1pp9 n ASN 71 N -3.82 0.59 -4.27 1.25 3.02 -1.26 -4.96 115.26 105.81 1pp9 n ASN 71 Ca -0.31 -0.80 -0.26 0.00 -0.03 0.00 0.00 54.58 53.19 1pp9 n ASN 71 Cb 0.92 0.84 -0.14 0.00 -0.61 0.00 0.00 39.78 40.79 1pp9 n ASN 71 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1pp9 s VAL 72 N -1.57 1.75 0.43 2.41 1.01 -1.26 -3.74 120.40 119.42 1pp9 s VAL 72 Ca 0.04 -1.32 -0.25 0.00 0.00 0.00 0.00 61.98 60.45 1pp9 s VAL 72 Cb 0.06 -1.54 -0.10 0.00 0.00 0.00 0.00 36.38 34.81 1pp9 s VAL 72 CO 0.29 0.15 1.17 -2.65 0.00 0.00 0.00 175.10 174.06 1pp9 n PRO 73 N 1.62 1.67 -1.07 2.72 -0.02 -1.26 -3.96 135.00 134.69 1pp9 n PRO 73 Ca -0.18 0.60 -0.30 0.00 -2.02 0.00 0.00 63.50 61.60 1pp9 n PRO 73 Cb 0.53 -2.26 0.14 0.00 -0.02 0.00 0.00 33.50 31.90 1pp9 n PRO 73 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1pp9 s ALA 74 N -1.24 1.48 0.15 3.55 0.00 -1.26 -4.80 121.76 119.64 1pp9 s ALA 74 Ca 0.63 0.11 -0.12 0.00 0.00 0.00 0.00 51.96 52.58 1pp9 s ALA 74 Cb -0.52 -3.26 0.01 0.00 0.00 0.00 0.00 23.12 19.35 1pp9 s ALA 74 CO 0.57 -2.45 0.34 -1.54 0.00 0.00 0.00 175.76 172.67 1pp9 s SER 75 N -3.20 -0.05 -0.10 0.00 1.04 -0.96 -4.96 113.70 105.47 1pp9 s SER 75 Ca 0.64 -0.68 -0.04 0.00 0.48 0.00 0.00 55.95 56.35 1pp9 s SER 75 Cb -0.19 0.46 0.05 0.00 0.10 0.00 0.00 66.02 66.43 1pp9 s SER 75 CO 0.58 -0.90 0.19 0.54 0.98 0.00 0.00 173.24 174.62 1pp9 s VAL 76 N -3.91 -0.30 -0.04 5.02 0.11 -1.26 -0.95 120.40 119.08 1pp9 s VAL 76 Ca 0.12 0.34 -0.02 0.00 -2.93 0.00 0.00 61.98 59.48 1pp9 s VAL 76 Cb 0.02 -0.33 -0.04 0.00 -1.53 0.00 0.00 36.38 34.50 1pp9 s VAL 76 CO -0.04 0.14 0.10 -0.13 -3.33 0.00 0.00 175.10 171.85 1pp9 s ARG 77 N 2.32 3.20 0.00 1.54 0.52 -0.13 -4.95 118.95 121.46 1pp9 s ARG 77 Ca 0.03 -0.38 0.00 0.00 -0.52 0.00 0.00 55.73 54.86 1pp9 s ARG 77 Cb -0.12 -2.96 0.00 0.00 0.52 0.00 0.00 34.95 32.39 1pp9 s ARG 77 CO -0.06 0.68 0.00 0.66 0.02 0.00 0.00 175.30 176.60