#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rfh h ARG 109 N 0.00 -0.01 -3.55 0.54 9.65 -2.12 -3.35 114.38 115.54 1rfh h ARG 109 Ca 0.00 0.00 -0.62 0.00 -1.10 0.00 0.00 59.98 58.26 1rfh h ARG 109 Cb 0.00 0.00 0.01 0.00 -1.39 0.00 0.00 29.97 28.59 1rfh h ARG 109 CO 0.00 0.71 3.21 0.28 2.80 0.00 0.00 179.97 186.97 1rfh n VAL 110 N -4.74 3.37 0.12 0.20 0.31 -1.26 -4.67 118.33 111.66 1rfh n VAL 110 Ca -0.09 -2.33 -0.05 0.00 -0.01 0.00 0.00 64.34 61.86 1rfh n VAL 110 Cb 0.36 -2.48 -0.02 0.00 -0.91 0.00 0.00 33.84 30.79 1rfh n VAL 110 CO 0.00 0.00 0.00 0.25 -1.32 0.00 0.00 176.83 175.76 1rfh h LEU 111 N 8.96 -0.27 -8.18 7.52 5.85 -2.09 -3.44 115.31 123.66 1rfh h LEU 111 Ca 0.66 0.01 -0.67 0.00 0.84 0.00 0.00 57.88 58.71 1rfh h LEU 111 Cb 0.40 0.07 -0.34 0.00 0.37 0.00 0.00 40.66 41.16 1rfh h LEU 111 CO 1.77 -0.14 -0.86 0.00 -0.34 0.00 0.00 178.44 178.87 1rfh s ALA 112 N -3.64 2.31 -1.07 1.25 0.00 -1.26 -5.04 121.76 114.31 1rfh s ALA 112 Ca -0.05 -1.12 -0.25 0.00 0.00 0.00 0.00 51.96 50.54 1rfh s ALA 112 Cb 0.00 -1.08 -0.16 0.00 0.00 0.00 0.00 23.12 21.89 1rfh s ALA 112 CO 0.14 -0.12 2.08 -1.21 0.00 0.00 0.00 175.76 176.65 1rfh s GLU 113 N 0.95 1.74 -0.02 0.00 2.02 -1.26 -4.72 118.70 117.40 1rfh s GLU 113 Ca -0.03 -0.54 -0.23 0.00 0.02 0.00 0.00 54.97 54.19 1rfh s GLU 113 Cb -0.15 -5.04 -0.16 0.00 0.10 0.00 0.00 34.13 28.88 1rfh s GLU 113 CO -0.05 -4.75 1.04 -0.09 0.02 0.00 0.00 175.26 171.43 1rfh h ARG 114 N 11.14 -0.29 0.00 1.61 2.43 -1.89 -3.41 114.38 123.97 1rfh h ARG 114 Ca 0.08 0.02 0.30 0.00 -0.81 0.00 0.00 59.98 59.57 1rfh h ARG 114 Cb 0.98 0.07 -0.07 0.00 -0.42 0.00 0.00 29.97 30.52 1rfh h ARG 114 CO 1.09 0.08 -0.39 0.41 -1.51 0.00 0.00 179.97 179.66 1rfh n GLY 115 N 0.18 -1.93 3.58 2.80 0.00 -1.26 -3.37 105.19 105.20 1rfh n GLY 115 Ca -0.08 -1.22 -0.43 0.00 0.00 0.00 0.00 46.02 44.29 1rfh n GLY 115 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1rfh s GLU 116 N -1.85 3.96 0.00 1.61 0.41 -1.26 -4.74 118.70 116.82 1rfh s GLU 116 Ca 0.00 -1.94 0.00 0.00 -0.41 0.00 0.00 54.97 52.62 1rfh s GLU 116 Cb 0.00 -5.53 0.00 0.00 -1.78 0.00 0.00 34.13 26.82 1rfh s GLU 116 CO 0.00 -2.26 0.00 0.41 -0.49 0.00 0.00 175.26 172.92 1rfh n GLY 117 N 5.50 0.36 3.69 -1.39 0.00 -1.26 -5.02 105.19 107.07 1rfh n GLY 117 Ca 0.48 -1.28 -0.43 0.00 0.00 0.00 0.00 46.02 44.79 1rfh n GLY 117 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1rfh n HIS 118 N 0.00 2.57 0.02 1.61 8.25 -1.26 -4.89 115.22 121.52 1rfh n HIS 118 Ca 0.00 -0.12 -0.19 0.00 -0.26 0.00 0.00 57.72 57.16 1rfh n HIS 118 Cb 0.00 -2.72 -0.12 0.00 1.12 0.00 0.00 29.99 28.28 1rfh n HIS 118 CO 0.00 0.00 0.00 0.07 0.64 0.00 0.00 176.34 177.05 1rfh h ARG 119 N 8.49 0.45 -4.30 -0.41 0.11 -1.79 -3.43 114.38 113.50 1rfh h ARG 119 Ca -0.47 -0.53 0.00 0.00 0.10 0.00 0.00 59.98 59.09 1rfh h ARG 119 Cb 1.23 0.16 0.00 0.00 1.11 0.00 0.00 29.97 32.47 1rfh h ARG 119 CO 0.94 1.18 -0.97 1.19 0.10 0.00 0.00 179.97 182.41 1rfh n PHE 120 N -4.12 -5.01 -3.96 4.08 3.72 -1.26 -4.39 117.46 106.51 1rfh n PHE 120 Ca -0.11 2.84 -0.34 0.00 -0.05 0.00 0.00 57.45 59.79 1rfh n PHE 120 Cb 0.75 -3.74 -0.14 0.00 -0.94 0.00 0.00 39.48 35.41 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 -1.19 2.83 0.28 -4.37 1.01 0.11 -4.74 120.40 114.34 1rfh s VAL 121 Ca 0.00 -1.16 -0.30 0.00 0.00 0.00 0.00 61.98 60.52 1rfh s VAL 121 Cb 0.00 -2.50 -0.13 0.00 0.00 0.00 0.00 36.38 33.76 1rfh s VAL 121 CO 0.00 0.11 1.40 -0.62 0.00 0.00 0.00 175.10 175.99 1rfh n GLU 122 N 4.64 2.18 -3.42 2.72 4.71 -1.26 -1.33 120.64 128.88 1rfh n GLU 122 Ca -0.16 0.77 -0.39 0.00 -0.01 0.00 0.00 57.16 57.38 1rfh n GLU 122 Cb 0.46 -2.42 -0.09 0.00 -1.01 0.00 0.00 31.44 28.37 1rfh n GLU 122 CO 0.00 0.00 0.00 -1.17 0.09 0.00 0.00 177.13 176.05 1rfh s LEU 123 N -0.39 4.03 -0.71 -4.62 2.96 -0.69 -4.92 118.68 114.35 1rfh s LEU 123 Ca 0.63 0.25 -0.26 0.00 -0.22 0.00 0.00 54.13 54.53 1rfh s LEU 123 Cb -0.60 -2.38 -0.08 0.00 0.50 0.00 0.00 46.19 43.63 1rfh s LEU 123 CO 0.54 -0.17 2.19 0.00 -1.32 0.00 0.00 176.35 177.60 1rfh s ALA 124 N 2.03 1.44 1.00 5.97 0.00 -1.26 -4.49 121.76 126.45 1rfh s ALA 124 Ca 0.14 -0.73 0.00 0.00 0.00 0.00 0.00 51.96 51.37 1rfh s ALA 124 Cb -0.16 -4.46 0.00 0.00 0.00 0.00 0.00 23.12 18.50 1rfh s ALA 124 CO 0.10 -4.90 0.00 1.28 0.00 0.00 0.00 175.76 172.24 1rfh n LEU 125 N 15.73 0.00 -1.52 0.00 4.77 -1.26 -4.26 117.00 130.45 1rfh n LEU 125 Ca 0.37 0.00 -0.10 0.00 -0.03 0.00 0.00 56.01 56.26 1rfh n LEU 125 Cb 0.49 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.60 1rfh n LEU 125 CO 0.63 -0.27 0.03 0.54 -1.33 0.00 0.00 177.39 177.00 1rfh n ARG 126 N -0.48 -2.46 0.00 3.23 5.12 -1.26 -4.51 116.66 116.30 1rfh n ARG 126 Ca 0.00 0.37 0.00 0.00 -1.93 0.00 0.00 57.85 56.29 1rfh n ARG 126 Cb 0.00 -4.07 0.00 0.00 -1.16 0.00 0.00 32.46 27.23 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 -1.09 0.40 2.66 -0.13 0.00 -1.26 -5.09 105.19 100.67 1rfh n GLY 127 Ca -0.03 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.69 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 1.03 1.02 -0.02 0.00 -1.26 -5.14 107.32 102.95 1rfh s GLY 128 Ca 0.00 -1.72 -0.21 0.00 0.00 0.00 0.00 44.72 42.79 1rfh s GLY 128 CO 0.00 1.75 -0.60 -1.05 0.00 0.00 0.00 173.10 173.20 1rfh n PRO 129 N 4.63 -0.96 -3.46 2.90 -0.02 -1.26 -4.58 135.00 132.25 1rfh n PRO 129 Ca 0.00 -0.27 -0.25 0.00 -2.02 0.00 0.00 63.50 60.96 1rfh n PRO 129 Cb 0.40 -1.34 -0.12 0.00 -0.02 0.00 0.00 33.50 32.42 1rfh n PRO 129 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 1rfh s GLY 130 N -1.46 0.43 -0.32 -1.23 0.00 -1.26 -5.00 107.32 98.49 1rfh s GLY 130 Ca 0.42 -1.24 -0.28 0.00 0.00 0.00 0.00 44.72 43.62 1rfh s GLY 130 CO 0.58 2.28 1.79 -0.98 0.00 0.00 0.00 173.10 176.77 1rfh s TRP 131 N 1.65 1.82 -0.87 1.90 0.52 -1.26 0.12 118.94 122.82 1rfh s TRP 131 Ca 0.14 0.61 -0.17 0.00 0.02 0.00 0.00 56.10 56.69 1rfh s TRP 131 Cb -0.18 -4.13 -0.23 0.00 -1.15 0.00 0.00 33.47 27.78 1rfh s TRP 131 CO -0.17 -2.98 2.23 0.00 0.02 0.00 0.00 176.95 176.06 1rfh h ASP 133 N 11.75 0.06 0.37 0.00 3.32 -1.59 0.77 116.42 131.10 1rfh h ASP 133 Ca 0.02 0.02 -0.02 0.00 0.02 0.00 0.00 57.03 57.07 1rfh h ASP 133 Cb 1.06 0.01 0.00 0.00 0.22 0.00 0.00 39.33 40.62 1rfh h ASP 133 CO 1.29 -0.01 -0.18 0.25 -1.72 0.00 0.00 179.24 178.87 1rfh h LEU 134 N 0.04 -0.42 0.00 1.55 5.85 -1.84 -3.40 115.31 117.08 1rfh h LEU 134 Ca 0.68 -0.12 0.00 0.00 0.84 0.00 0.00 57.88 59.28 1rfh h LEU 134 Cb 2.58 0.11 0.00 0.00 0.37 0.00 0.00 40.66 43.72 1rfh h LEU 134 CO -0.07 -0.11 -0.16 0.00 -0.34 0.00 0.00 178.44 177.77 1rfh n GLY 136 N 1.68 0.56 3.95 0.00 0.00 0.24 -5.03 105.19 106.59 1rfh n GLY 136 Ca -0.02 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.72 1rfh n GLY 136 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1rfh s ARG 137 N 0.00 1.00 -0.13 1.61 0.52 -1.26 -4.61 118.95 116.08 1rfh s ARG 137 Ca 0.00 -0.59 -0.21 0.00 -0.52 0.00 0.00 55.73 54.42 1rfh s ARG 137 Cb 0.00 -1.99 -0.03 0.00 0.52 0.00 0.00 34.95 33.45 1rfh s ARG 137 CO 0.00 -2.10 0.60 -2.00 0.02 0.00 0.00 175.30 171.83 1rfh s GLU 138 N -5.66 4.32 -0.08 3.54 2.12 -1.26 0.14 118.70 121.82 1rfh s GLU 138 Ca 0.71 0.64 -0.27 0.00 0.36 0.00 0.00 54.97 56.41 1rfh s GLU 138 Cb -0.05 -3.49 -0.02 0.00 0.26 0.00 0.00 34.13 30.83 1rfh s GLU 138 CO 0.50 -0.02 0.90 0.14 -0.54 0.00 0.00 175.26 176.23 1rfh s VAL 139 N 1.18 4.89 -0.00 3.70 -7.23 0.32 -4.83 120.40 118.41 1rfh s VAL 139 Ca 0.30 1.83 -0.19 0.00 -1.81 0.00 0.00 61.98 62.12 1rfh s VAL 139 Cb -0.16 -4.22 -0.33 0.00 0.56 0.00 0.00 36.38 32.23 1rfh s VAL 139 CO 0.13 0.11 0.96 -0.07 -0.31 0.00 0.00 175.10 175.92 1rfh h LEU 140 N 7.40 0.67-10.51 1.32 3.38 -1.97 -3.34 115.31 112.27 1rfh h LEU 140 Ca -0.36 -0.92 -0.45 0.00 0.09 0.00 0.00 57.88 56.23 1rfh h LEU 140 Cb 1.18 -0.22 0.06 0.00 0.09 0.00 0.00 40.66 41.77 1rfh h LEU 140 CO 0.79 1.54 0.11 -0.13 0.09 0.00 0.00 178.44 180.85 1rfh s ARG 141 N -2.57 2.50 -0.80 1.13 1.81 -1.26 -4.93 118.95 114.83 1rfh s ARG 141 Ca -0.11 -0.39 -0.26 0.00 -1.72 0.00 0.00 55.73 53.25 1rfh s ARG 141 Cb 0.03 -2.32 -0.14 0.00 -0.45 0.00 0.00 34.95 32.07 1rfh s ARG 141 CO 0.89 -0.90 2.41 1.04 -0.68 0.00 0.00 175.30 178.06 1rfh n GLN 142 N -2.62 0.55 -1.68 3.54 6.02 -1.26 -4.82 117.38 117.11 1rfh n GLN 142 Ca 0.07 -0.87 -0.38 0.00 -0.01 0.00 0.00 57.00 55.80 1rfh n GLN 142 Cb 0.59 -3.70 0.05 0.00 1.02 0.00 0.00 30.24 28.20 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 18.79 0.81 -2.58 -1.58 0.00 -1.26 -4.50 120.51 130.18 1rfh n ALA 143 Ca 0.47 0.07 -0.39 0.00 0.00 0.00 0.00 53.44 53.59 1rfh n ALA 143 Cb 0.43 -2.22 -0.10 0.00 0.00 0.00 0.00 19.45 17.56 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 -2.67 4.13 -0.51 0.00 1.43 -0.75 -1.70 118.68 118.62 1rfh s LEU 144 Ca 0.74 0.01 -0.12 0.00 -1.03 0.00 0.00 54.13 53.74 1rfh s LEU 144 Cb -0.43 -2.25 0.13 0.00 0.03 0.00 0.00 46.19 43.67 1rfh s LEU 144 CO 0.48 -0.15 0.41 -0.60 0.23 0.00 0.00 176.35 176.72 1rfh s ARG 145 N 1.89 2.68 -1.29 1.70 3.52 -0.44 -0.45 118.95 126.56 1rfh s ARG 145 Ca 0.10 -1.78 -0.17 0.00 -0.13 0.00 0.00 55.73 53.76 1rfh s ARG 145 Cb -0.16 -4.07 0.09 0.00 -1.56 0.00 0.00 34.95 29.26 1rfh s ARG 145 CO 0.11 -1.24 1.72 0.00 -0.81 0.00 0.00 175.30 175.07 1rfh n ALA 147 N 7.50 0.98 0.28 0.00 0.00 -1.26 -0.86 120.51 127.15 1rfh n ALA 147 Ca 0.46 0.00 0.17 0.00 0.00 0.00 0.00 53.44 54.07 1rfh n ALA 147 Cb 0.44 -0.96 0.74 0.00 0.00 0.00 0.00 19.45 19.68 1rfh n ALA 147 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 177.50 176.53 1rfh h ASN 148 N 0.00 0.00 0.00 0.00 -0.73 -1.98 -3.44 115.58 109.44 1rfh h ASN 148 Ca 0.00 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.17 1rfh h ASN 148 Cb 0.04 0.00 0.00 0.00 0.27 0.00 0.00 38.32 38.63 1rfh h ASN 148 CO 0.00 0.04 0.00 0.00 -0.37 0.00 0.00 177.43 177.10 1rfh n LYS 150 N -1.55 3.70 -0.83 0.00 5.02 -0.04 -5.06 118.16 119.41 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 -0.49 -2.34 2.13 1.16 -1.24 -4.44 117.46 112.24 1rfh n PHE 151 Ca 0.00 0.00 -0.40 0.00 -1.87 0.00 0.00 57.45 55.18 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 -2.66 3.58 0.42 1.97 2.01 -1.25 -2.31 115.64 117.41 1rfh s THR 152 Ca 0.00 0.26 0.08 0.00 0.31 0.00 0.00 61.69 62.34 1rfh s THR 152 Cb 0.00 -4.53 0.00 0.00 0.01 0.00 0.00 72.50 67.99 1rfh s THR 152 CO 0.00 -1.48 0.51 0.00 -0.69 0.00 0.00 174.62 172.97 1rfh s HIS 154 N -2.40 2.99 0.14 0.00 3.76 -1.26 -1.81 115.29 116.72 1rfh s HIS 154 Ca 0.53 1.46 -0.26 0.00 -0.15 0.00 0.00 55.06 56.64 1rfh s HIS 154 Cb -0.08 -3.59 -0.01 0.00 1.11 0.00 0.00 32.58 30.01 1rfh s HIS 154 CO 0.31 -1.76 1.60 1.03 -0.85 0.00 0.00 174.74 175.07 1rfh h SER 155 N 2.98 -1.12 0.48 1.40 0.87 -1.87 -0.11 113.55 116.18 1rfh h SER 155 Ca -0.49 0.17 -0.05 0.00 -1.23 0.00 0.00 61.79 60.19 1rfh h SER 155 Cb 1.23 0.48 -0.01 0.00 -0.44 0.00 0.00 62.40 63.67 1rfh h SER 155 CO 0.64 -0.37 -0.23 -0.08 -0.53 0.00 0.00 176.83 176.26 1rfh h GLU 156 N -0.39 0.00 0.00 2.24 4.57 -1.98 -2.40 114.58 116.62 1rfh h GLU 156 Ca 0.11 0.00 -0.04 0.00 -1.18 0.00 0.00 59.36 58.25 1rfh h GLU 156 Cb 0.57 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.15 1rfh h GLU 156 CO -0.41 0.23 -0.19 0.00 -1.18 0.00 0.00 179.01 177.46 1rfh h ARG 158 N 0.00 -0.03 -0.64 0.00 2.43 -0.76 0.95 114.38 116.33 1rfh h ARG 158 Ca -0.00 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.15 1rfh h ARG 158 Cb 0.57 0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 30.10 1rfh h ARG 158 CO 0.02 -0.02 0.33 1.03 -1.51 0.00 0.00 179.97 179.82 1rfh h SER 159 N -0.04 0.79 0.24 -3.80 0.87 -1.74 -1.77 113.55 108.11 1rfh h SER 159 Ca 0.25 -0.07 -0.04 0.00 -1.23 0.00 0.00 61.79 60.69 1rfh h SER 159 Cb 0.41 -0.20 -0.01 0.00 -0.44 0.00 0.00 62.40 62.17 1rfh h SER 159 CO -0.55 0.66 -0.21 -0.07 -0.53 0.00 0.00 176.83 176.13 1rfh h LEU 160 N 0.89 0.00 -8.55 2.23 3.38 -0.99 -3.39 115.31 108.89 1rfh h LEU 160 Ca 0.22 0.00 -0.56 0.00 0.09 0.00 0.00 57.88 57.64 1rfh h LEU 160 Cb 0.06 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 40.73 1rfh h LEU 160 CO -0.03 0.21 0.94 -0.63 0.09 0.00 0.00 178.44 179.01 1rfh s ILE 161 N -4.50 4.03 -0.41 1.22 1.01 -0.41 -4.87 121.20 117.28 1rfh s ILE 161 Ca -0.04 0.77 0.05 0.00 0.00 0.00 0.00 60.65 61.44 1rfh s ILE 161 Cb 0.15 -4.73 0.63 0.00 0.01 0.00 0.00 42.46 38.52 1rfh s ILE 161 CO 0.69 -1.37 1.80 0.00 0.00 0.00 0.00 174.94 176.06 1rfh n GLN 162 N 8.43 2.14 -3.57 2.79 6.02 -1.26 -4.96 117.38 126.96 1rfh n GLN 162 Ca 0.07 -3.06 -0.37 0.00 -0.01 0.00 0.00 57.00 53.63 1rfh n GLN 162 Cb 0.49 -2.09 -0.06 0.00 1.02 0.00 0.00 30.24 29.60 1rfh n GLN 162 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 177.06 174.88 1rfh s LEU 163 N -3.29 4.39 0.44 1.08 1.98 -1.26 -5.09 118.68 116.94 1rfh s LEU 163 Ca 0.54 0.76 -0.06 0.00 -2.89 0.00 0.00 54.13 52.47 1rfh s LEU 163 Cb 0.46 -2.45 -0.05 0.00 0.66 0.00 0.00 46.19 44.82 1rfh s LEU 163 CO 0.08 0.27 0.76 -0.62 -1.89 0.00 0.00 176.35 174.95 1rfh s ASP 164 N -0.61 6.35 -0.30 3.68 2.15 -1.26 -4.95 116.67 121.73 1rfh s ASP 164 Ca 0.21 0.96 -0.28 0.00 0.43 0.00 0.00 52.55 53.87 1rfh s ASP 164 Cb -0.15 -2.26 -0.05 0.00 -0.30 0.00 0.00 42.92 40.16 1rfh s ASP 164 CO 0.09 -0.49 2.23 0.00 -0.17 0.00 0.00 175.17 176.83