#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2p3t n LEU 88 N 0.00 0.00 0.28 -0.35 4.77 -1.26 -0.17 117.00 120.26 2p3t n LEU 88 Ca 0.00 0.00 0.17 0.00 -0.03 0.00 0.00 56.01 56.15 2p3t n LEU 88 Cb 0.00 0.00 0.71 0.00 -2.33 0.00 0.00 43.42 41.80 2p3t n LEU 88 CO 0.00 0.00 0.99 0.00 -1.33 0.00 0.00 177.39 177.05 2p3t n SER 90 N -3.16 0.58 -4.36 0.00 7.64 0.76 -2.56 113.62 112.52 2p3t n SER 90 Ca 0.00 0.58 -0.45 0.00 1.01 0.00 0.00 58.87 60.01 2p3t n SER 90 Cb 0.30 -0.72 -0.03 0.00 -1.01 0.00 0.00 64.21 62.74 2p3t n SER 90 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 2p3t s LEU 91 N -4.14 5.90 -1.51 -3.43 2.96 -0.65 -4.55 118.68 113.26 2p3t s LEU 91 Ca 0.09 -2.01 -0.06 0.00 -0.22 0.00 0.00 54.13 51.93 2p3t s LEU 91 Cb 0.12 -2.28 0.05 0.00 0.50 0.00 0.00 46.19 44.59 2p3t s LEU 91 CO 0.51 -0.89 0.54 -0.67 -1.32 0.00 0.00 176.35 174.52 2p3t n ASP 92 N 5.44 -1.39 -2.35 3.68 2.03 -1.26 -1.08 116.55 121.62 2p3t n ASP 92 Ca 0.04 -1.01 -0.17 0.00 0.52 0.00 0.00 54.79 54.17 2p3t n ASP 92 Cb 0.45 -2.95 -0.01 0.00 -0.72 0.00 0.00 41.12 37.88 2p3t n ASP 92 CO 0.00 0.00 0.00 -3.20 -1.92 0.00 0.00 177.20 172.08 2p3t n ASN 93 N -2.88 -4.91 -0.91 1.67 5.15 -1.06 -1.25 115.26 111.07 2p3t n ASN 93 Ca -0.18 0.11 -0.12 0.00 -0.60 0.00 0.00 54.58 53.79 2p3t n ASN 93 Cb 0.62 -4.14 -0.05 0.00 -0.53 0.00 0.00 39.78 35.67 2p3t n ASN 93 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2p3t n GLY 94 N -0.87 1.25 2.69 8.20 0.00 -0.24 -1.59 105.19 114.63 2p3t n GLY 94 Ca -0.20 -0.23 0.00 0.00 0.00 0.00 0.00 46.02 45.59 2p3t n GLY 94 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2p3t n ASP 95 N -0.53 -4.55 -4.78 1.61 4.64 -0.38 -4.98 116.55 107.58 2p3t n ASP 95 Ca -0.12 0.00 -0.37 0.00 -1.38 0.00 0.00 54.79 52.92 2p3t n ASP 95 Cb 0.47 -2.32 -0.04 0.00 -1.04 0.00 0.00 41.12 38.19 2p3t n ASP 95 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 2p3t h ASP 97 N 2.58 0.76 0.00 0.00 5.19 -1.50 -3.47 116.42 119.98 2p3t h ASP 97 Ca -0.48 -0.24 0.00 0.00 -0.62 0.00 0.00 57.03 55.69 2p3t h ASP 97 Cb 1.22 -0.20 0.00 0.00 0.18 0.00 0.00 39.33 40.52 2p3t h ASP 97 CO 0.63 0.80 0.00 0.00 -3.12 0.00 0.00 179.24 177.55 2p3t n GLN 98 N -4.45 0.00 -2.25 3.56 6.02 -1.26 -5.01 117.38 113.99 2p3t n GLN 98 Ca 0.01 0.00 -0.41 0.00 -0.01 0.00 0.00 57.00 56.59 2p3t n GLN 98 Cb 0.23 0.00 -0.03 0.00 1.02 0.00 0.00 30.24 31.46 2p3t n GLN 98 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 2p3t s PHE 99 N 2.08 3.29 -0.06 1.08 0.08 -0.57 -4.91 117.98 118.96 2p3t s PHE 99 Ca 0.00 1.31 0.05 0.00 0.12 0.00 0.00 56.93 58.41 2p3t s PHE 99 Cb 0.00 -3.56 -0.01 0.00 -0.57 0.00 0.00 43.02 38.89 2p3t s PHE 99 CO 0.00 -1.67 -0.22 0.00 -0.10 0.00 0.00 175.22 173.23 2p3t s HIS 101 N 0.02 0.74 -0.21 0.00 0.09 0.26 -4.99 115.29 111.20 2p3t s HIS 101 Ca -0.07 -0.40 -0.09 0.00 -0.00 0.00 0.00 55.06 54.50 2p3t s HIS 101 Cb -0.14 -0.44 -0.05 0.00 -0.00 0.00 0.00 32.58 31.95 2p3t s HIS 101 CO 0.04 -0.04 0.12 -1.21 -0.00 0.00 0.00 174.74 173.65 2p3t s GLU 102 N -1.25 4.09 -0.06 1.40 2.02 -1.26 0.15 118.70 123.79 2p3t s GLU 102 Ca -0.06 -0.27 -0.02 0.00 0.02 0.00 0.00 54.97 54.64 2p3t s GLU 102 Cb -0.08 -3.40 0.04 0.00 0.10 0.00 0.00 34.13 30.79 2p3t s GLU 102 CO 0.01 0.22 0.11 -1.21 0.02 0.00 0.00 175.26 174.41 2p3t s GLU 103 N 0.58 0.04 -1.56 1.61 2.02 0.70 -4.81 118.70 117.28 2p3t s GLU 103 Ca 0.07 0.36 -0.05 0.00 0.02 0.00 0.00 54.97 55.37 2p3t s GLU 103 Cb -0.12 -0.23 0.01 0.00 0.10 0.00 0.00 34.13 33.88 2p3t s GLU 103 CO 0.00 -0.20 0.63 1.04 0.02 0.00 0.00 175.26 176.76 2p3t n GLN 104 N 4.45 -5.05 -3.08 1.61 1.13 -1.26 -0.74 117.38 114.44 2p3t n GLN 104 Ca -0.22 0.92 -0.22 0.00 -1.94 0.00 0.00 57.00 55.54 2p3t n GLN 104 Cb 0.51 -5.79 0.01 0.00 0.11 0.00 0.00 30.24 25.08 2p3t n GLN 104 CO 0.00 0.00 0.00 -1.71 -1.44 0.00 0.00 177.06 173.91 2p3t n ASN 105 N -2.55 -4.85 -4.20 1.08 2.85 -1.26 -4.98 115.26 101.34 2p3t n ASN 105 Ca -0.11 -0.27 -0.18 0.00 -0.11 0.00 0.00 54.58 53.92 2p3t n ASN 105 Cb 0.62 -3.98 -0.11 0.00 1.24 0.00 0.00 39.78 37.55 2p3t n ASN 105 CO 0.00 0.00 0.00 -0.55 -2.11 0.00 0.00 177.26 174.60 2p3t s SER 106 N -2.61 1.76 0.01 1.20 0.15 0.08 -5.06 113.70 109.24 2p3t s SER 106 Ca 0.30 -0.72 -0.29 0.00 0.70 0.00 0.00 55.95 55.94 2p3t s SER 106 Cb -0.15 -0.05 -0.04 0.00 -1.71 0.00 0.00 66.02 64.08 2p3t s SER 106 CO 0.37 -0.13 0.93 -0.69 1.20 0.00 0.00 173.24 174.92 2p3t s VAL 107 N -1.79 4.82 -0.15 4.45 1.01 -1.26 -0.21 120.40 127.26 2p3t s VAL 107 Ca 0.03 1.96 0.02 0.00 0.00 0.00 0.00 61.98 63.99 2p3t s VAL 107 Cb -0.07 -4.27 0.02 0.00 0.00 0.00 0.00 36.38 32.05 2p3t s VAL 107 CO 0.02 0.21 -0.19 -0.69 0.00 0.00 0.00 175.10 174.46 2p3t s VAL 108 N 0.73 1.86 0.13 2.92 1.01 0.12 -4.93 120.40 122.24 2p3t s VAL 108 Ca 0.48 -0.84 -0.03 0.00 0.00 0.00 0.00 61.98 61.60 2p3t s VAL 108 Cb -0.21 -1.68 -0.05 0.00 0.00 0.00 0.00 36.38 34.44 2p3t s VAL 108 CO 0.27 0.51 0.33 0.00 0.00 0.00 0.00 175.10 176.20 2p3t s SER 110 N -2.59 0.51 0.12 0.00 1.04 -0.48 -4.96 113.70 107.34 2p3t s SER 110 Ca 0.39 -1.30 0.04 0.00 0.48 0.00 0.00 55.95 55.55 2p3t s SER 110 Cb -0.12 0.70 -0.04 0.00 0.10 0.00 0.00 66.02 66.66 2p3t s SER 110 CO 0.26 -1.38 -0.10 0.00 0.98 0.00 0.00 173.24 173.01 2p3t s ALA 112 N -2.97 1.00 0.32 0.00 0.00 -1.26 -4.90 121.76 113.95 2p3t s ALA 112 Ca 0.11 0.16 -0.29 0.00 0.00 0.00 0.00 51.96 51.94 2p3t s ALA 112 Cb 0.01 -3.30 -0.11 0.00 0.00 0.00 0.00 23.12 19.71 2p3t s ALA 112 CO -0.00 -2.87 1.57 0.50 0.00 0.00 0.00 175.76 174.96 2p3t s ARG 113 N -4.70 4.11 0.00 0.00 3.52 -1.26 -2.23 118.95 118.38 2p3t s ARG 113 Ca 0.66 2.59 0.00 0.00 -0.13 0.00 0.00 55.73 58.85 2p3t s ARG 113 Cb -0.21 -3.00 0.00 0.00 -1.56 0.00 0.00 34.95 30.17 2p3t s ARG 113 CO 0.59 -0.62 0.00 0.41 -0.81 0.00 0.00 175.30 174.87 2p3t n GLY 114 N 1.69 0.61 3.38 8.12 0.00 -1.26 -4.68 105.19 113.06 2p3t n GLY 114 Ca 0.06 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.79 2p3t n GLY 114 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2p3t s TYR 115 N -2.38 2.36 -0.09 1.61 2.02 -0.95 -1.61 117.35 118.31 2p3t s TYR 115 Ca 0.00 -0.37 -0.01 0.00 -0.37 0.00 0.00 57.07 56.31 2p3t s TYR 115 Cb 0.00 -1.34 -0.03 0.00 -0.40 0.00 0.00 41.96 40.19 2p3t s TYR 115 CO 0.00 0.24 -0.02 0.99 -1.57 0.00 0.00 175.55 175.19 2p3t s THR 116 N -0.94 4.14 0.06 -0.71 2.01 0.17 -4.82 115.64 115.55 2p3t s THR 116 Ca 0.13 -0.31 -0.31 0.00 0.31 0.00 0.00 61.69 61.52 2p3t s THR 116 Cb -0.10 -2.73 -0.07 0.00 0.01 0.00 0.00 72.50 69.61 2p3t s THR 116 CO 0.05 0.60 1.35 -0.22 -0.69 0.00 0.00 174.62 175.70 2p3t s LEU 117 N -0.78 4.35 1.03 4.42 2.96 -1.26 0.24 118.68 129.64 2p3t s LEU 117 Ca 0.12 2.18 -0.13 0.00 -0.22 0.00 0.00 54.13 56.08 2p3t s LEU 117 Cb -0.11 -3.58 0.21 0.00 0.50 0.00 0.00 46.19 43.21 2p3t s LEU 117 CO 0.02 -0.63 1.09 0.00 -1.32 0.00 0.00 176.35 175.51 2p3t s ALA 118 N 1.52 0.76 0.54 5.97 0.00 0.48 -4.83 121.76 126.21 2p3t s ALA 118 Ca 0.63 -0.39 0.22 0.00 0.00 0.00 0.00 51.96 52.42 2p3t s ALA 118 Cb -0.33 -3.11 1.49 0.00 0.00 0.00 0.00 23.12 21.17 2p3t s ALA 118 CO 0.29 -2.99 2.18 -0.44 0.00 0.00 0.00 175.76 174.80 2p3t h ASP 119 N -2.01 0.00 0.17 0.00 3.45 -1.94 0.12 116.42 116.20 2p3t h ASP 119 Ca -0.56 0.00 0.00 0.00 0.43 0.00 0.00 57.03 56.90 2p3t h ASP 119 Cb 1.33 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 40.10 2p3t h ASP 119 CO 0.57 0.02 0.00 -0.46 -1.57 0.00 0.00 179.24 177.79 2p3t n ASN 120 N -4.20 0.00 -0.52 6.45 0.23 -1.26 -4.88 115.26 111.08 2p3t n ASN 120 Ca -0.03 -0.65 -0.07 0.00 -0.53 0.00 0.00 54.58 53.30 2p3t n ASN 120 Cb 0.10 -0.09 -0.03 0.00 -2.08 0.00 0.00 39.78 37.68 2p3t n ASN 120 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2p3t n GLY 121 N 0.89 0.84 0.72 4.83 0.00 0.41 -4.80 105.19 108.08 2p3t n GLY 121 Ca 0.19 -0.29 0.00 0.00 0.00 0.00 0.00 46.02 45.92 2p3t n GLY 121 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2p3t n LYS 122 N -1.88 0.00 -2.51 1.61 5.02 -1.26 -4.25 118.16 114.89 2p3t n LYS 122 Ca -0.07 0.00 -0.31 0.00 -2.02 0.00 0.00 58.31 55.91 2p3t n LYS 122 Cb 0.34 -0.56 -0.02 0.00 -0.02 0.00 0.00 35.03 34.77 2p3t n LYS 122 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2p3t s ALA 123 N -1.83 3.20 -0.17 7.82 0.00 -1.26 -1.25 121.76 128.27 2p3t s ALA 123 Ca 0.00 -0.05 -0.01 0.00 0.00 0.00 0.00 51.96 51.91 2p3t s ALA 123 Cb 0.00 -2.92 -0.00 0.00 0.00 0.00 0.00 23.12 20.20 2p3t s ALA 123 CO 0.00 -0.22 -0.13 0.00 0.00 0.00 0.00 175.76 175.41 2p3t s ILE 125 N 0.91 4.04 0.41 0.00 -1.09 0.14 -4.88 121.20 120.73 2p3t s ILE 125 Ca -0.03 -0.28 -0.25 0.00 -2.23 0.00 0.00 60.65 57.85 2p3t s ILE 125 Cb -0.15 -2.83 -0.08 0.00 -1.58 0.00 0.00 42.46 37.82 2p3t s ILE 125 CO -0.01 0.43 1.27 -2.16 -1.23 0.00 0.00 174.94 173.23 2p3t s PRO 126 N 0.97 3.93 0.02 2.79 0.04 -1.26 0.45 135.00 141.94 2p3t s PRO 126 Ca 0.02 2.07 0.23 0.00 0.04 0.00 0.00 61.00 63.36 2p3t s PRO 126 Cb -0.14 -2.70 0.08 0.00 0.04 0.00 0.00 34.50 31.78 2p3t s PRO 126 CO 0.02 -0.49 1.08 0.25 0.04 0.00 0.00 177.00 177.90 2p3t n THR 127 N 0.03 0.07 -4.12 1.26 -2.24 -0.63 -4.85 114.28 103.79 2p3t n THR 127 Ca 0.04 -0.11 -0.15 0.00 -2.27 0.00 0.00 64.05 61.57 2p3t n THR 127 Cb 0.44 0.45 -0.06 0.00 -2.10 0.00 0.00 70.33 69.07 2p3t n THR 127 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2p3t s GLY 128 N -3.29 1.52 0.55 3.38 0.00 -1.26 -5.06 107.32 103.15 2p3t s GLY 128 Ca 0.07 -1.56 0.32 0.00 0.00 0.00 0.00 44.72 43.55 2p3t s GLY 128 CO 0.80 -1.08 2.04 -0.56 0.00 0.00 0.00 173.10 174.30 2p3t h PRO 129 N 2.19 0.00 -2.09 2.90 0.13 -1.99 -3.31 132.00 129.83 2p3t h PRO 129 Ca -0.28 0.00 -0.55 0.00 -0.87 0.00 0.00 66.00 64.30 2p3t h PRO 129 Cb 1.24 0.00 -0.40 0.00 0.13 0.00 0.00 31.00 31.97 2p3t h PRO 129 CO 0.40 0.07 -0.96 0.66 -0.23 0.00 0.00 178.00 177.93 2p3t n TYR 130 N -3.27 1.36 -1.85 1.56 4.01 -1.26 -5.11 117.16 112.61 2p3t n TYR 130 Ca -0.01 -3.83 -0.37 0.00 -0.16 0.00 0.00 57.90 53.53 2p3t n TYR 130 Cb 0.27 -0.44 0.05 0.00 -0.31 0.00 0.00 39.34 38.91 2p3t n TYR 130 CO 0.00 0.00 0.00 -1.25 -0.46 0.00 0.00 176.86 175.15 2p3t s PRO 131 N -2.25 2.95 0.61 -0.72 0.04 -1.25 -4.93 135.00 129.44 2p3t s PRO 131 Ca 0.40 2.06 -0.19 0.00 0.04 0.00 0.00 61.00 63.31 2p3t s PRO 131 Cb 0.25 -2.06 -0.03 0.00 0.04 0.00 0.00 34.50 32.69 2p3t s PRO 131 CO -0.09 -1.29 1.25 0.00 0.04 0.00 0.00 177.00 176.91 2p3t n GLY 133 N 0.95 0.90 3.59 0.00 0.00 -1.26 -5.00 105.19 104.37 2p3t n GLY 133 Ca 0.14 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.81 2p3t n GLY 133 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2p3t s LYS 134 N -0.01 3.90 0.50 1.61 -0.14 -1.20 -5.08 119.74 119.31 2p3t s LYS 134 Ca 0.00 -0.37 -0.23 0.00 -1.36 0.00 0.00 55.97 54.01 2p3t s LYS 134 Cb 0.00 -3.28 -0.06 0.00 -1.68 0.00 0.00 37.83 32.81 2p3t s LYS 134 CO 0.00 0.13 1.30 -0.65 -0.76 0.00 0.00 175.35 175.37 2p3t s GLN 135 N 0.77 3.47 -1.00 1.68 -0.21 -1.26 -4.95 119.66 118.16 2p3t s GLN 135 Ca 0.04 2.11 -0.12 0.00 0.02 0.00 0.00 55.36 57.41 2p3t s GLN 135 Cb -0.13 -2.40 0.25 0.00 1.00 0.00 0.00 33.01 31.73 2p3t s GLN 135 CO 0.02 -0.89 0.99 0.95 -2.12 0.00 0.00 175.29 174.25 2p3t s THR 136 N -1.36 5.77 -1.50 -0.19 -4.23 -1.26 -4.83 115.64 108.04 2p3t s THR 136 Ca 0.66 -2.95 0.19 0.00 -1.18 0.00 0.00 61.69 58.42 2p3t s THR 136 Cb -0.37 -4.57 0.61 0.00 1.34 0.00 0.00 72.50 69.51 2p3t s THR 136 CO 0.45 -1.16 1.52 0.18 -0.54 0.00 0.00 174.62 175.07 2p3t n LEU 137 N 3.47 4.02 0.00 4.79 4.77 -1.26 -5.30 117.00 127.50 2p3t n LEU 137 Ca 0.21 -2.16 0.00 0.00 -0.03 0.00 0.00 56.01 54.02 2p3t n LEU 137 Cb 0.43 -0.47 0.00 0.00 -2.33 0.00 0.00 43.42 41.04 2p3t n LEU 137 CO 0.42 0.89 0.00 1.21 -1.33 0.00 0.00 177.39 178.58