#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rfh s ARG 109 N 0.00 2.32 -0.16 0.54 1.81 -1.26 -4.77 118.95 117.44 1rfh s ARG 109 Ca 0.00 1.50 0.05 0.00 -1.72 0.00 0.00 55.73 55.56 1rfh s ARG 109 Cb 0.00 -4.53 -0.23 0.00 -0.45 0.00 0.00 34.95 29.74 1rfh s ARG 109 CO 0.00 -3.02 0.21 1.33 -0.68 0.00 0.00 175.30 173.13 1rfh n VAL 110 N 7.92 1.59 -3.33 3.52 0.24 -1.26 -4.92 118.33 122.09 1rfh n VAL 110 Ca 0.35 -0.71 -0.38 0.00 -2.04 0.00 0.00 64.34 61.56 1rfh n VAL 110 Cb 0.53 -1.23 -0.06 0.00 -1.47 0.00 0.00 33.84 31.60 1rfh n VAL 110 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 1rfh s LEU 111 N -6.37 4.48 0.04 1.34 1.43 -1.26 -5.08 118.68 113.25 1rfh s LEU 111 Ca -0.19 1.12 0.09 0.00 -1.03 0.00 0.00 54.13 54.12 1rfh s LEU 111 Cb 0.07 -2.79 -0.03 0.00 0.03 0.00 0.00 46.19 43.47 1rfh s LEU 111 CO 0.75 0.24 -0.25 0.00 0.23 0.00 0.00 176.35 177.32 1rfh s ALA 112 N -0.81 2.31 -0.78 4.21 0.00 -1.26 -5.04 121.76 120.39 1rfh s ALA 112 Ca 0.27 -1.25 -0.26 0.00 0.00 0.00 0.00 51.96 50.73 1rfh s ALA 112 Cb -0.18 -0.53 -0.14 0.00 0.00 0.00 0.00 23.12 22.28 1rfh s ALA 112 CO 0.16 0.54 2.42 -1.21 0.00 0.00 0.00 175.76 177.67 1rfh s GLU 113 N -1.22 1.60 0.01 0.00 0.41 -1.26 -4.79 118.70 113.45 1rfh s GLU 113 Ca 0.12 0.54 -0.21 0.00 -0.41 0.00 0.00 54.97 55.01 1rfh s GLU 113 Cb -0.10 -4.77 -0.12 0.00 -1.78 0.00 0.00 34.13 27.36 1rfh s GLU 113 CO 0.02 -4.42 1.06 0.00 -0.49 0.00 0.00 175.26 171.43 1rfh h ARG 114 N 13.05 -0.73 -1.21 1.61 -0.00 -1.88 -3.43 114.38 121.79 1rfh h ARG 114 Ca -0.01 0.05 0.14 0.00 -0.50 0.00 0.00 59.98 59.66 1rfh h ARG 114 Cb 1.01 0.17 -0.05 0.00 0.00 0.00 0.00 29.97 31.11 1rfh h ARG 114 CO 1.01 -0.49 -0.26 0.41 0.00 0.00 0.00 179.97 180.64 1rfh n GLY 115 N -0.64 -1.86 2.36 0.04 0.00 -1.26 -4.01 105.19 99.82 1rfh n GLY 115 Ca -0.09 -1.38 -0.39 0.00 0.00 0.00 0.00 46.02 44.16 1rfh n GLY 115 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1rfh n GLU 116 N -2.69 3.58 0.00 1.61 2.13 -1.26 -4.74 120.64 119.27 1rfh n GLU 116 Ca -0.01 -2.22 0.00 0.00 0.66 0.00 0.00 57.16 55.59 1rfh n GLU 116 Cb 0.25 -2.84 0.00 0.00 0.27 0.00 0.00 31.44 29.11 1rfh n GLU 116 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1rfh n GLY 117 N 3.64 -0.56 3.76 8.31 0.00 -1.26 -4.90 105.19 114.17 1rfh n GLY 117 Ca 0.75 -0.25 -0.38 0.00 0.00 0.00 0.00 46.02 46.14 1rfh n GLY 117 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1rfh s HIS 118 N -2.60 2.63 -0.13 1.61 3.76 -1.26 -4.65 115.29 114.65 1rfh s HIS 118 Ca 0.00 1.44 -0.11 0.00 -0.15 0.00 0.00 55.06 56.24 1rfh s HIS 118 Cb 0.00 -3.62 -0.25 0.00 1.11 0.00 0.00 32.58 29.82 1rfh s HIS 118 CO 0.00 -2.20 0.39 0.07 -0.85 0.00 0.00 174.74 172.15 1rfh h ARG 119 N 1.97 0.23 -5.30 1.40 0.11 -1.83 -3.43 114.38 107.52 1rfh h ARG 119 Ca -0.50 -0.39 0.01 0.00 0.10 0.00 0.00 59.98 59.20 1rfh h ARG 119 Cb 1.27 0.14 -0.09 0.00 1.11 0.00 0.00 29.97 32.40 1rfh h ARG 119 CO 0.60 1.18 -1.12 1.19 0.10 0.00 0.00 179.97 181.92 1rfh n PHE 120 N -3.73 -3.21 -3.18 4.08 3.72 -1.26 -4.72 117.46 109.16 1rfh n PHE 120 Ca -0.30 1.87 -0.42 0.00 -0.05 0.00 0.00 57.45 58.55 1rfh n PHE 120 Cb 0.96 -3.07 -0.07 0.00 -0.94 0.00 0.00 39.48 36.36 1rfh n PHE 120 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 1rfh s VAL 121 N -0.46 4.93 -0.10 -4.37 1.01 0.21 -4.67 120.40 116.96 1rfh s VAL 121 Ca -0.20 0.22 -0.34 0.00 0.00 0.00 0.00 61.98 61.66 1rfh s VAL 121 Cb 0.01 -4.08 -0.11 0.00 0.00 0.00 0.00 36.38 32.20 1rfh s VAL 121 CO 0.53 -0.40 1.92 -0.62 0.00 0.00 0.00 175.10 176.53 1rfh n GLU 122 N 5.97 2.19 -2.79 2.72 1.02 -1.26 -2.29 120.64 126.20 1rfh n GLU 122 Ca -0.03 0.79 -0.43 0.00 -0.02 0.00 0.00 57.16 57.47 1rfh n GLU 122 Cb 0.48 -2.70 -0.04 0.00 -0.02 0.00 0.00 31.44 29.17 1rfh n GLU 122 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 1rfh s LEU 123 N 4.44 3.98 -0.72 -4.62 2.96 -0.84 -4.95 118.68 118.92 1rfh s LEU 123 Ca 0.94 -0.38 -0.25 0.00 -0.22 0.00 0.00 54.13 54.22 1rfh s LEU 123 Cb -0.66 -2.81 -0.13 0.00 0.50 0.00 0.00 46.19 43.09 1rfh s LEU 123 CO 0.50 -1.33 2.41 0.00 -1.32 0.00 0.00 176.35 176.61 1rfh n ALA 124 N 7.76 0.47 -1.28 5.97 0.00 -1.26 -4.40 120.51 127.77 1rfh n ALA 124 Ca 0.02 -1.25 -0.37 0.00 0.00 0.00 0.00 53.44 51.84 1rfh n ALA 124 Cb 0.48 -3.23 -0.02 0.00 0.00 0.00 0.00 19.45 16.68 1rfh n ALA 124 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1rfh n LEU 125 N 17.50 7.34 -2.22 0.00 4.32 -1.26 -4.58 117.00 138.09 1rfh n LEU 125 Ca 0.45 -3.94 -0.29 0.00 -0.02 0.00 0.00 56.01 52.21 1rfh n LEU 125 Cb 0.44 -1.46 0.11 0.00 -1.62 0.00 0.00 43.42 40.90 1rfh n LEU 125 CO 0.61 1.44 1.30 0.54 -1.22 0.00 0.00 177.39 180.05 1rfh n ARG 126 N 4.46 2.56 0.00 3.23 5.12 -1.26 -4.65 116.66 126.11 1rfh n ARG 126 Ca 0.65 -3.24 0.00 0.00 -1.93 0.00 0.00 57.85 53.33 1rfh n ARG 126 Cb 0.26 -2.23 0.00 0.00 -1.16 0.00 0.00 32.46 29.33 1rfh n ARG 126 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1rfh n GLY 127 N -0.99 0.99 3.53 -0.13 0.00 -1.26 -5.13 105.19 102.20 1rfh n GLY 127 Ca 0.60 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 46.27 1rfh n GLY 127 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1rfh s GLY 128 N 0.00 1.80 1.15 -0.02 0.00 -1.26 -5.10 107.32 103.89 1rfh s GLY 128 Ca 0.00 -0.90 -0.15 0.00 0.00 0.00 0.00 44.72 43.67 1rfh s GLY 128 CO 0.00 0.19 1.05 2.56 0.00 0.00 0.00 173.10 176.90 1rfh s PRO 129 N 0.81 -0.80 -0.01 2.90 0.04 -1.26 -4.59 135.00 132.09 1rfh s PRO 129 Ca 0.02 0.51 0.00 0.00 0.04 0.00 0.00 61.00 61.57 1rfh s PRO 129 Cb -0.14 -1.59 0.01 0.00 0.04 0.00 0.00 34.50 32.82 1rfh s PRO 129 CO 0.02 -3.56 -0.01 0.20 0.04 0.00 0.00 177.00 173.70 1rfh s GLY 130 N -3.08 0.10 -0.24 0.56 0.00 -1.24 -5.03 107.32 98.39 1rfh s GLY 130 Ca 0.68 0.03 -0.02 0.00 0.00 0.00 0.00 44.72 45.41 1rfh s GLY 130 CO 0.61 0.17 -0.06 -0.98 0.00 0.00 0.00 173.10 172.83 1rfh s TRP 131 N 0.31 3.03 -0.99 1.90 0.52 -1.26 0.18 118.94 122.63 1rfh s TRP 131 Ca -0.03 -1.42 -0.27 0.00 0.02 0.00 0.00 56.10 54.41 1rfh s TRP 131 Cb -0.05 -2.07 -0.21 0.00 -1.15 0.00 0.00 33.47 30.00 1rfh s TRP 131 CO -0.01 -0.69 2.21 0.00 0.02 0.00 0.00 176.95 178.48 1rfh h ASP 133 N 12.00 0.08 0.87 0.00 3.32 -1.68 1.08 116.42 132.09 1rfh h ASP 133 Ca 0.00 0.04 -0.04 0.00 0.02 0.00 0.00 57.03 57.05 1rfh h ASP 133 Cb 1.00 0.03 0.00 0.00 0.22 0.00 0.00 39.33 40.59 1rfh h ASP 133 CO 1.00 -0.04 -0.45 0.25 -1.72 0.00 0.00 179.24 178.28 1rfh h LEU 134 N 0.04 -1.09 0.00 1.55 5.85 -1.85 -3.36 115.31 116.45 1rfh h LEU 134 Ca 0.79 0.05 -0.12 0.00 0.84 0.00 0.00 57.88 59.43 1rfh h LEU 134 Cb 2.93 0.30 -0.02 0.00 0.37 0.00 0.00 40.66 44.24 1rfh h LEU 134 CO -0.12 -0.74 -0.78 0.00 -0.34 0.00 0.00 178.44 176.45 1rfh n GLY 136 N 1.53 1.78 0.00 0.00 0.00 0.35 -5.06 105.19 103.79 1rfh n GLY 136 Ca -0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.82 1rfh n GLY 136 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1rfh n ARG 137 N -0.25 1.79 -3.65 1.61 5.12 -1.25 -4.87 116.66 115.17 1rfh n ARG 137 Ca 0.00 0.00 -0.37 0.00 -1.93 0.00 0.00 57.85 55.55 1rfh n ARG 137 Cb 0.00 0.00 -0.06 0.00 -1.16 0.00 0.00 32.46 31.24 1rfh n ARG 137 CO 0.00 0.00 0.00 -1.21 -1.93 0.00 0.00 177.63 174.49 1rfh s GLU 138 N -0.83 3.82 -0.14 5.56 2.02 -1.26 -1.58 118.70 126.29 1rfh s GLU 138 Ca 0.00 0.14 -0.04 0.00 0.02 0.00 0.00 54.97 55.09 1rfh s GLU 138 Cb 0.00 -3.25 -0.03 0.00 0.10 0.00 0.00 34.13 30.94 1rfh s GLU 138 CO 0.00 0.62 -0.01 0.14 0.02 0.00 0.00 175.26 176.04 1rfh s VAL 139 N -0.72 4.18 -0.20 2.63 -7.23 0.48 -4.80 120.40 114.75 1rfh s VAL 139 Ca 0.19 -0.27 -0.17 0.00 -1.81 0.00 0.00 61.98 59.92 1rfh s VAL 139 Cb -0.14 -2.81 -0.07 0.00 0.56 0.00 0.00 36.38 33.91 1rfh s VAL 139 CO 0.08 0.52 -0.35 0.18 -0.31 0.00 0.00 175.10 175.23 1rfh n LEU 140 N 3.07 1.92 -4.54 1.32 4.77 -1.26 -3.71 117.00 118.57 1rfh n LEU 140 Ca -0.18 0.33 -0.28 0.00 -0.03 0.00 0.00 56.01 55.85 1rfh n LEU 140 Cb 0.53 -0.75 0.23 0.00 -2.33 0.00 0.00 43.42 41.10 1rfh n LEU 140 CO 0.32 -0.08 0.55 -0.13 -1.33 0.00 0.00 177.39 176.72 1rfh s ARG 141 N -2.80 -0.58 -0.84 3.23 0.52 -1.26 -4.76 118.95 112.45 1rfh s ARG 141 Ca -0.31 0.74 -0.25 0.00 -0.52 0.00 0.00 55.73 55.39 1rfh s ARG 141 Cb 0.06 -1.60 -0.17 0.00 0.52 0.00 0.00 34.95 33.77 1rfh s ARG 141 CO 0.44 -3.47 2.34 1.04 0.02 0.00 0.00 175.30 175.66 1rfh n GLN 142 N -4.73 0.44 -1.74 3.54 6.02 -1.26 -4.80 117.38 114.86 1rfh n GLN 142 Ca 0.04 -0.96 -0.41 0.00 -0.01 0.00 0.00 57.00 55.65 1rfh n GLN 142 Cb 0.55 -3.59 0.00 0.00 1.02 0.00 0.00 30.24 28.22 1rfh n GLN 142 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1rfh n ALA 143 N 18.25 1.81 -2.53 -1.58 0.00 -1.26 -4.59 120.51 130.61 1rfh n ALA 143 Ca 0.46 0.33 -0.42 0.00 0.00 0.00 0.00 53.44 53.81 1rfh n ALA 143 Cb 0.42 -2.34 -0.07 0.00 0.00 0.00 0.00 19.45 17.46 1rfh n ALA 143 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1rfh s LEU 144 N -1.72 4.51 -0.49 0.00 1.43 -0.31 -1.99 118.68 120.10 1rfh s LEU 144 Ca 0.56 -0.27 -0.12 0.00 -1.03 0.00 0.00 54.13 53.27 1rfh s LEU 144 Cb -0.51 -2.61 0.12 0.00 0.03 0.00 0.00 46.19 43.22 1rfh s LEU 144 CO 0.62 -0.63 0.39 -0.60 0.23 0.00 0.00 176.35 176.36 1rfh s ARG 145 N 2.53 2.66 -1.29 1.70 3.00 -0.97 -0.09 118.95 126.49 1rfh s ARG 145 Ca 0.19 -1.72 -0.16 0.00 -1.00 0.00 0.00 55.73 53.04 1rfh s ARG 145 Cb -0.15 -4.04 0.10 0.00 0.00 0.00 0.00 34.95 30.85 1rfh s ARG 145 CO 0.16 -1.22 1.73 0.00 0.00 0.00 0.00 175.30 175.96 1rfh n ALA 147 N 7.15 1.06 0.27 0.00 0.00 -1.26 -0.66 120.51 127.07 1rfh n ALA 147 Ca 0.46 0.06 0.15 0.00 0.00 0.00 0.00 53.44 54.11 1rfh n ALA 147 Cb 0.44 -1.11 0.70 0.00 0.00 0.00 0.00 19.45 19.47 1rfh n ALA 147 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 1rfh h ASN 148 N 0.00 0.00 0.00 0.00 2.35 -1.99 -3.44 115.58 112.50 1rfh h ASN 148 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1rfh h ASN 148 Cb 0.02 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.39 1rfh h ASN 148 CO 0.00 0.08 0.00 0.00 -1.65 0.00 0.00 177.43 175.86 1rfh n LYS 150 N -1.99 3.86 -0.81 0.00 5.02 0.17 -5.02 118.16 119.38 1rfh n LYS 150 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 1rfh n LYS 150 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.01 1rfh n LYS 150 CO 0.00 0.00 0.00 1.97 -0.52 0.00 0.00 177.40 178.85 1rfh n PHE 151 N 0.00 -0.48 -2.14 2.13 1.16 -1.23 -4.46 117.46 112.45 1rfh n PHE 151 Ca 0.00 0.00 -0.38 0.00 -1.87 0.00 0.00 57.45 55.20 1rfh n PHE 151 Cb 0.00 0.00 -0.03 0.00 -1.61 0.00 0.00 39.48 37.84 1rfh n PHE 151 CO 0.00 0.00 0.00 0.99 -1.87 0.00 0.00 176.76 175.88 1rfh s THR 152 N -2.65 3.43 0.29 1.97 2.01 -1.26 -2.22 115.64 117.21 1rfh s THR 152 Ca 0.00 0.18 0.06 0.00 0.31 0.00 0.00 61.69 62.25 1rfh s THR 152 Cb 0.00 -4.13 -0.02 0.00 0.01 0.00 0.00 72.50 68.36 1rfh s THR 152 CO 0.00 -1.09 0.36 0.00 -0.69 0.00 0.00 174.62 173.20 1rfh s HIS 154 N -2.13 2.59 0.10 0.00 3.76 -1.26 -1.16 115.29 117.19 1rfh s HIS 154 Ca 0.39 1.46 -0.31 0.00 -0.15 0.00 0.00 55.06 56.45 1rfh s HIS 154 Cb -0.08 -3.57 -0.12 0.00 1.11 0.00 0.00 32.58 29.92 1rfh s HIS 154 CO 0.29 -2.14 1.60 1.03 -0.85 0.00 0.00 174.74 174.66 1rfh h SER 155 N 1.73 -1.09 0.68 1.40 0.87 -1.87 -1.09 113.55 114.19 1rfh h SER 155 Ca -0.50 0.11 0.00 0.00 -1.23 0.00 0.00 61.79 60.17 1rfh h SER 155 Cb 1.27 0.39 0.00 0.00 -0.44 0.00 0.00 62.40 63.62 1rfh h SER 155 CO 0.59 -0.50 0.00 -0.33 -0.53 0.00 0.00 176.83 176.06 1rfh h GLU 156 N -0.71 0.00 0.00 2.24 5.08 -1.96 -2.43 114.58 116.81 1rfh h GLU 156 Ca -0.00 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.29 1rfh h GLU 156 Cb 0.68 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.92 1rfh h GLU 156 CO -0.15 0.00 -0.41 0.00 -1.00 0.00 0.00 179.01 177.46 1rfh h ARG 158 N 0.00 0.82 0.00 0.00 -0.00 -0.72 0.67 114.38 115.16 1rfh h ARG 158 Ca -0.01 -0.05 -0.04 0.00 -0.00 0.00 0.00 59.98 59.88 1rfh h ARG 158 Cb 1.24 -0.19 -0.01 0.00 -0.00 0.00 0.00 29.97 31.02 1rfh h ARG 158 CO 0.04 0.55 -0.18 0.77 -0.00 0.00 0.00 179.97 181.14 1rfh h SER 159 N 0.85 0.00 1.68 0.08 0.02 -1.73 -2.09 113.55 112.36 1rfh h SER 159 Ca 0.37 0.00 -0.04 0.00 -0.84 0.00 0.00 61.79 61.28 1rfh h SER 159 Cb 0.32 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.86 1rfh h SER 159 CO -0.14 0.18 -0.32 -0.07 -1.14 0.00 0.00 176.83 175.34 1rfh h LEU 160 N 0.00 0.00 -8.26 5.07 4.07 -1.05 -3.42 115.31 111.72 1rfh h LEU 160 Ca -0.00 0.00 -0.62 0.00 0.08 0.00 0.00 57.88 57.34 1rfh h LEU 160 Cb 0.46 0.00 -0.14 0.00 1.08 0.00 0.00 40.66 42.06 1rfh h LEU 160 CO 0.02 0.17 0.63 -0.63 -1.08 0.00 0.00 178.44 177.55 1rfh s ILE 161 N -3.15 4.25 -0.47 1.22 1.01 -0.79 -4.87 121.20 118.40 1rfh s ILE 161 Ca 0.05 -0.29 0.03 0.00 0.00 0.00 0.00 60.65 60.44 1rfh s ILE 161 Cb 0.06 -4.72 0.56 0.00 0.01 0.00 0.00 42.46 38.38 1rfh s ILE 161 CO 0.71 -1.52 1.82 0.00 0.00 0.00 0.00 174.94 175.95 1rfh n GLN 162 N 7.92 2.38 -3.26 2.79 6.02 -1.26 -4.97 117.38 127.00 1rfh n GLN 162 Ca -0.02 -3.20 -0.33 0.00 -0.01 0.00 0.00 57.00 53.44 1rfh n GLN 162 Cb 0.46 -2.15 -0.06 0.00 1.02 0.00 0.00 30.24 29.51 1rfh n GLN 162 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1rfh s LEU 163 N -3.46 4.16 0.36 1.08 1.02 -1.26 -5.08 118.68 115.51 1rfh s LEU 163 Ca 0.57 1.14 -0.10 0.00 0.02 0.00 0.00 54.13 55.76 1rfh s LEU 163 Cb 0.47 -3.79 -0.06 0.00 0.02 0.00 0.00 46.19 42.83 1rfh s LEU 163 CO 0.05 -0.09 0.71 -1.81 0.02 0.00 0.00 176.35 175.22 1rfh s ASP 164 N -2.17 6.53 -0.31 2.29 1.01 -1.26 -4.73 116.67 118.03 1rfh s ASP 164 Ca 0.49 1.04 -0.27 0.00 0.71 0.00 0.00 52.55 54.51 1rfh s ASP 164 Cb -0.12 -2.28 -0.05 0.00 1.01 0.00 0.00 42.92 41.48 1rfh s ASP 164 CO 0.19 -0.32 2.23 0.00 0.21 0.00 0.00 175.17 177.48