#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1urf s ILE 120 N 0.00 -0.17 0.41 -0.61 1.10 -1.26 -5.16 121.20 115.51 1urf s ILE 120 Ca 0.00 0.00 -0.26 0.00 -0.51 0.00 0.00 60.65 59.88 1urf s ILE 120 Cb 0.00 -1.00 -0.09 0.00 0.15 0.00 0.00 42.46 41.52 1urf s ILE 120 CO 0.00 0.00 1.37 -2.16 -2.11 0.00 0.00 174.94 172.04 1urf s PRO 121 N 1.82 3.95 -0.13 3.50 0.04 -1.26 -4.88 135.00 138.04 1urf s PRO 121 Ca -0.04 2.31 -0.35 0.00 0.04 0.00 0.00 61.00 62.96 1urf s PRO 121 Cb -0.03 -2.79 -0.12 0.00 0.04 0.00 0.00 34.50 31.59 1urf s PRO 121 CO -0.15 -0.57 1.89 0.00 0.04 0.00 0.00 177.00 178.21 1urf n ALA 122 N 0.16 0.75 0.00 8.56 0.00 -1.26 -4.48 120.51 124.24 1urf n ALA 122 Ca 0.03 0.27 0.00 0.00 0.00 0.00 0.00 53.44 53.75 1urf n ALA 122 Cb 0.42 -2.47 0.00 0.00 0.00 0.00 0.00 19.45 17.40 1urf n ALA 122 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1urf n THR 123 N 5.22 0.00 -0.17 0.00 -1.04 -1.26 -4.95 114.28 112.09 1urf n THR 123 Ca 0.24 0.00 -0.00 0.00 -2.04 0.00 0.00 64.05 62.25 1urf n THR 123 Cb 0.27 0.00 0.25 0.00 -1.82 0.00 0.00 70.33 69.03 1urf n THR 123 CO 0.00 0.00 0.00 0.78 -0.64 0.00 0.00 175.07 175.21 1urf h ASN 124 N 0.00 0.79 -0.99 8.00 -0.26 -1.98 -2.38 115.58 118.77 1urf h ASN 124 Ca 0.00 -0.06 0.13 0.00 -0.56 0.00 0.00 56.30 55.81 1urf h ASN 124 Cb 0.00 -0.20 -0.08 0.00 -1.06 0.00 0.00 38.32 36.98 1urf h ASN 124 CO 0.00 0.64 0.62 -0.07 -1.06 0.00 0.00 177.43 177.56 1urf h LEU 125 N 0.90 0.88 -0.48 1.61 3.38 -1.93 -0.36 115.31 119.32 1urf h LEU 125 Ca 0.23 0.05 -0.00 0.00 0.09 0.00 0.00 57.88 58.24 1urf h LEU 125 Cb 0.02 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.62 1urf h LEU 125 CO -0.04 0.46 0.28 -1.28 0.09 0.00 0.00 178.44 177.95 1urf h SER 126 N 0.94 0.58 -0.24 -0.43 0.87 -1.81 -0.56 113.55 112.90 1urf h SER 126 Ca 0.49 -0.07 -0.04 0.00 -1.23 0.00 0.00 61.79 60.95 1urf h SER 126 Cb 0.53 -0.15 -0.01 0.00 -0.44 0.00 0.00 62.40 62.34 1urf h SER 126 CO -0.26 0.48 0.01 -0.09 -0.53 0.00 0.00 176.83 176.44 1urf h ARG 127 N 0.63 0.42 0.01 2.24 2.43 -1.27 -2.05 114.38 116.79 1urf h ARG 127 Ca 0.17 -0.13 0.01 0.00 -0.81 0.00 0.00 59.98 59.22 1urf h ARG 127 Cb 0.01 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.52 1urf h ARG 127 CO -0.03 0.59 -0.04 0.28 -1.51 0.00 0.00 179.97 179.26 1urf h VAL 128 N 0.19 0.91 -1.00 0.20 2.07 -0.95 -2.06 116.25 115.61 1urf h VAL 128 Ca 0.07 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.61 1urf h VAL 128 Cb 0.40 0.91 -0.05 0.00 -1.52 0.00 0.00 31.29 31.02 1urf h VAL 128 CO 0.01 0.00 0.66 0.00 0.02 0.00 0.00 177.57 178.26 1urf h ALA 129 N 0.92 1.30 -0.54 1.67 0.00 -1.11 -1.10 119.26 120.41 1urf h ALA 129 Ca 0.01 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 1urf h ALA 129 Cb 0.08 -0.38 -0.03 0.00 0.00 0.00 0.00 17.79 17.46 1urf h ALA 129 CO -0.03 0.61 0.32 0.78 0.00 0.00 0.00 179.25 180.92 1urf h GLY 130 N 1.31 0.80 0.98 0.00 0.00 -1.04 -0.48 103.07 104.64 1urf h GLY 130 Ca 0.38 -0.34 -0.08 0.00 0.00 0.00 0.00 47.33 47.29 1urf h GLY 130 CO -0.10 0.33 -0.05 1.41 0.00 0.00 0.00 176.54 178.13 1urf h LEU 131 N 0.73 0.77 -0.13 3.11 3.38 -0.96 -2.68 115.31 119.54 1urf h LEU 131 Ca 0.19 -0.34 -0.01 0.00 0.09 0.00 0.00 57.88 57.82 1urf h LEU 131 Cb 0.01 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.54 1urf h LEU 131 CO -0.03 0.92 0.06 -0.33 0.09 0.00 0.00 178.44 179.14 1urf h GLU 132 N 0.60 0.19 -0.95 1.13 5.08 -0.99 -2.66 114.58 116.98 1urf h GLU 132 Ca 0.11 -0.03 0.02 0.00 -1.00 0.00 0.00 59.36 58.46 1urf h GLU 132 Cb 0.56 -0.03 -0.05 0.00 0.50 0.00 0.00 28.75 29.72 1urf h GLU 132 CO 0.03 0.27 0.63 1.57 -1.00 0.00 0.00 179.01 180.51 1urf h LYS 133 N 0.07 1.22 -0.58 2.33 2.10 -1.10 -2.20 116.57 118.41 1urf h LYS 133 Ca 0.04 -0.07 0.03 0.00 -2.00 0.00 0.00 60.65 58.65 1urf h LYS 133 Cb 0.15 -0.27 -0.04 0.00 -0.90 0.00 0.00 32.23 31.16 1urf h LYS 133 CO -0.00 0.81 0.34 1.96 -2.00 0.00 0.00 179.45 180.55 1urf h GLN 134 N 1.25 0.64 -0.53 0.07 1.08 -1.33 -1.10 115.11 115.20 1urf h GLN 134 Ca 0.36 -0.04 0.00 0.00 -1.45 0.00 0.00 58.65 57.52 1urf h GLN 134 Cb -0.09 -0.14 -0.03 0.00 -0.05 0.00 0.00 27.48 27.17 1urf h GLN 134 CO -0.09 0.42 0.34 -0.07 -0.95 0.00 0.00 178.83 178.48 1urf h LEU 135 N 0.66 0.62 -0.44 1.46 3.38 -1.07 -1.85 115.31 118.07 1urf h LEU 135 Ca 0.24 -0.03 -0.01 0.00 0.09 0.00 0.00 57.88 58.17 1urf h LEU 135 Cb 0.06 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.64 1urf h LEU 135 CO -0.12 0.47 0.25 0.00 0.09 0.00 0.00 178.44 179.13 1urf h ALA 136 N 1.18 0.56 -0.78 1.53 0.00 -0.93 -2.08 119.26 118.73 1urf h ALA 136 Ca 0.19 -0.07 0.01 0.00 0.00 0.00 0.00 54.91 55.04 1urf h ALA 136 Cb -0.05 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.52 1urf h ALA 136 CO -0.04 0.07 0.52 0.82 0.00 0.00 0.00 179.25 180.61 1urf h ILE 137 N 0.58 1.19 -0.71 0.00 2.04 -0.96 -2.48 117.51 117.17 1urf h ILE 137 Ca 0.16 -0.36 -0.03 0.00 1.00 0.00 0.00 64.86 65.63 1urf h ILE 137 Cb 0.02 0.05 -0.03 0.00 -0.74 0.00 0.00 36.82 36.12 1urf h ILE 137 CO -0.03 0.19 0.34 -0.33 0.00 0.00 0.00 178.15 178.32 1urf h GLU 138 N 1.05 1.02 -0.96 2.37 4.39 -1.05 -2.66 114.58 118.73 1urf h GLU 138 Ca 0.29 -0.15 0.00 0.00 0.34 0.00 0.00 59.36 59.84 1urf h GLU 138 Cb -0.10 -0.18 -0.05 0.00 -0.10 0.00 0.00 28.75 28.32 1urf h GLU 138 CO -0.07 0.81 0.61 -0.07 -1.16 0.00 0.00 179.01 179.13 1urf h LEU 139 N 0.99 1.13 -0.10 1.33 3.38 -0.95 0.11 115.31 121.20 1urf h LEU 139 Ca 0.24 -0.05 -0.01 0.00 0.09 0.00 0.00 57.88 58.16 1urf h LEU 139 Cb 0.12 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 40.58 1urf h LEU 139 CO -0.03 0.84 0.04 0.50 0.09 0.00 0.00 178.44 179.88 1urf h LYS 140 N 1.32 0.15 -0.14 1.13 3.64 -1.18 -0.38 116.57 121.10 1urf h LYS 140 Ca 0.35 -0.03 -0.03 0.00 -1.27 0.00 0.00 60.65 59.67 1urf h LYS 140 Cb -0.11 -0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 31.69 1urf h LYS 140 CO -0.07 0.28 -0.05 0.28 -2.27 0.00 0.00 179.45 177.62 1urf h VAL 141 N -0.01 1.30 -0.36 2.00 2.07 -1.28 -1.85 116.25 118.11 1urf h VAL 141 Ca 0.03 -1.03 0.01 0.00 0.82 0.00 0.00 66.70 66.53 1urf h VAL 141 Cb 0.19 1.70 -0.02 0.00 -1.52 0.00 0.00 31.29 31.63 1urf h VAL 141 CO -0.00 0.30 0.22 0.50 0.02 0.00 0.00 177.57 178.61 1urf h LYS 142 N -0.04 0.44 -0.33 1.57 3.64 -0.80 -0.43 116.57 120.62 1urf h LYS 142 Ca 0.03 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.38 1urf h LYS 142 Cb 0.49 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 32.20 1urf h LYS 142 CO 0.02 0.29 0.17 0.37 -2.27 0.00 0.00 179.45 178.02 1urf h GLN 143 N 0.45 0.47 -0.51 1.90 4.15 -1.08 -1.90 115.11 118.58 1urf h GLN 143 Ca 0.14 -0.06 -0.00 0.00 0.77 0.00 0.00 58.65 59.50 1urf h GLN 143 Cb -0.01 -0.09 -0.03 0.00 0.21 0.00 0.00 27.48 27.56 1urf h GLN 143 CO -0.06 0.41 0.31 0.78 -1.93 0.00 0.00 178.83 178.34 1urf h GLY 144 N 0.40 0.74 1.06 2.39 0.00 -1.05 -1.90 103.07 104.71 1urf h GLY 144 Ca 0.11 -0.30 -0.09 0.00 0.00 0.00 0.00 47.33 47.06 1urf h GLY 144 CO -0.02 0.29 0.05 0.00 0.00 0.00 0.00 176.54 176.86 1urf h ALA 145 N 1.63 0.82 -0.75 3.60 0.00 -0.65 -2.57 119.26 121.34 1urf h ALA 145 Ca 0.19 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1urf h ALA 145 Cb -0.02 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 17.50 1urf h ALA 145 CO -0.03 0.62 0.49 0.93 0.00 0.00 0.00 179.25 181.26 1urf h GLU 146 N 0.96 1.00 -0.42 0.00 5.08 -0.58 0.99 114.58 121.60 1urf h GLU 146 Ca 0.18 -0.07 0.01 0.00 -1.00 0.00 0.00 59.36 58.48 1urf h GLU 146 Cb 0.50 -0.22 -0.02 0.00 0.50 0.00 0.00 28.75 29.50 1urf h GLU 146 CO 0.02 0.67 0.27 -0.91 -1.00 0.00 0.00 179.01 178.07 1urf h ASN 147 N 1.02 0.46 -0.30 1.42 2.35 -1.19 0.28 115.58 119.63 1urf h ASN 147 Ca 0.27 -0.01 -0.07 0.00 -0.55 0.00 0.00 56.30 55.95 1urf h ASN 147 Cb -0.10 -0.11 -0.01 0.00 0.05 0.00 0.00 38.32 38.15 1urf h ASN 147 CO -0.06 0.33 -0.09 0.24 -1.65 0.00 0.00 177.43 176.20 1urf h MET 148 N 0.55 0.59 -0.30 0.81 2.86 -1.07 -1.89 114.93 116.48 1urf h MET 148 Ca 0.16 -0.24 -0.01 0.00 -2.06 0.00 0.00 59.70 57.56 1urf h MET 148 Cb -0.04 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 31.57 1urf h MET 148 CO -0.05 0.79 0.16 0.82 1.06 0.00 0.00 176.91 179.70 1urf h ILE 149 N 0.35 1.14 -0.50 -1.22 2.04 -0.61 -0.52 117.51 118.19 1urf h ILE 149 Ca 0.07 -0.37 -0.05 0.00 1.00 0.00 0.00 64.86 65.51 1urf h ILE 149 Cb 0.59 0.83 -0.02 0.00 -0.74 0.00 0.00 36.82 37.48 1urf h ILE 149 CO 0.03 0.14 0.11 1.56 0.00 0.00 0.00 178.15 179.99 1urf h GLN 150 N 0.37 0.81 -0.11 2.37 1.08 -0.96 0.94 115.11 119.61 1urf h GLN 150 Ca 0.11 -0.20 -0.01 0.00 -1.45 0.00 0.00 58.65 57.10 1urf h GLN 150 Cb 0.08 -0.10 -0.00 0.00 -0.05 0.00 0.00 27.48 27.40 1urf h GLN 150 CO -0.02 0.79 0.04 1.15 -0.95 0.00 0.00 178.83 179.85 1urf h THR 151 N 0.70 1.15 -0.41 -0.54 2.02 -1.20 -2.97 112.91 111.66 1urf h THR 151 Ca 0.16 -0.46 -0.14 0.00 0.77 0.00 0.00 66.41 66.74 1urf h THR 151 Cb 0.35 1.25 -0.01 0.00 -1.74 0.00 0.00 68.15 68.00 1urf h THR 151 CO 0.00 0.14 -0.31 1.88 0.37 0.00 0.00 175.52 177.60 1urf h TYR 152 N 0.02 1.10 -0.86 3.16 -1.99 -1.05 -3.14 116.97 114.21 1urf h TYR 152 Ca 0.04 -0.30 0.13 0.00 2.00 0.00 0.00 58.73 60.60 1urf h TYR 152 Cb 0.18 -0.24 -0.07 0.00 2.00 0.00 0.00 36.73 38.60 1urf h TYR 152 CO -0.01 1.12 0.56 0.66 -0.00 0.00 0.00 178.16 180.49 1urf h SER 153 N 0.76 0.63 -3.35 3.88 4.64 -0.78 -3.27 113.55 116.06 1urf h SER 153 Ca 0.08 0.03 -0.03 0.00 -0.47 0.00 0.00 61.79 61.41 1urf h SER 153 Cb 0.89 -0.09 -0.22 0.00 -0.31 0.00 0.00 62.40 62.67 1urf h SER 153 CO 0.08 0.33 -0.02 0.21 -0.87 0.00 0.00 176.83 176.56 1urf s ASN 154 N -5.84 -0.80 0.00 4.97 3.84 -1.13 -5.00 114.94 110.98 1urf s ASN 154 Ca -0.10 1.36 0.00 0.00 0.21 0.00 0.00 52.86 54.33 1urf s ASN 154 Cb 0.22 1.28 0.00 0.00 -0.55 0.00 0.00 41.25 42.19 1urf s ASN 154 CO 0.78 -0.23 0.00 0.61 -2.79 0.00 0.00 177.10 175.48 1urf n GLY 155 N 3.79 0.38 0.08 1.21 0.00 -1.25 -4.52 105.19 104.88 1urf n GLY 155 Ca -0.18 -1.51 -0.13 0.00 0.00 0.00 0.00 46.02 44.20 1urf n GLY 155 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1urf h SER 156 N 0.00 -0.07 -3.67 1.61 0.02 -1.95 -3.44 113.55 106.06 1urf h SER 156 Ca 0.00 -0.49 -0.50 0.00 -0.84 0.00 0.00 61.79 59.96 1urf h SER 156 Cb 0.00 0.02 -0.03 0.00 0.14 0.00 0.00 62.40 62.53 1urf h SER 156 CO 0.00 0.48 0.23 0.42 -1.14 0.00 0.00 176.83 176.82 1urf s THR 157 N -3.89 4.34 -0.19 -2.27 -4.23 -1.26 -4.95 115.64 103.19 1urf s THR 157 Ca -0.15 1.66 0.07 0.00 -1.18 0.00 0.00 61.69 62.09 1urf s THR 157 Cb 0.01 -4.04 0.23 0.00 1.34 0.00 0.00 72.50 70.04 1urf s THR 157 CO 0.62 0.31 1.11 2.29 -0.54 0.00 0.00 174.62 178.42 1urf n LYS 158 N 1.01 0.77 -2.35 3.99 2.85 -1.23 -4.00 118.16 119.20 1urf n LYS 158 Ca -0.02 -0.77 -0.42 0.00 -1.05 0.00 0.00 58.31 56.05 1urf n LYS 158 Cb 0.50 0.31 -0.03 0.00 -0.65 0.00 0.00 35.03 35.16 1urf n LYS 158 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 177.40 177.69 1urf s ASP 159 N -0.73 7.01 0.02 -5.58 -1.08 -1.26 -4.95 116.67 110.10 1urf s ASP 159 Ca 0.05 2.14 -0.24 0.00 -0.52 0.00 0.00 52.55 53.99 1urf s ASP 159 Cb 0.25 -2.59 -0.17 0.00 -1.46 0.00 0.00 42.92 38.96 1urf s ASP 159 CO -0.07 -0.50 1.36 0.03 0.52 0.00 0.00 175.17 176.51 1urf h ARG 160 N 6.47 0.13 -0.06 4.34 2.47 -1.98 0.42 114.38 126.17 1urf h ARG 160 Ca -0.42 -0.06 0.01 0.00 -1.26 0.00 0.00 59.98 58.25 1urf h ARG 160 Cb 1.21 -0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 29.52 1urf h ARG 160 CO 0.81 0.50 0.01 -0.22 0.56 0.00 0.00 179.97 181.63 1urf h LYS 161 N -0.25 0.03 -0.44 0.04 3.64 -2.01 -2.09 116.57 115.49 1urf h LYS 161 Ca 0.01 -0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 59.35 1urf h LYS 161 Cb 0.47 -0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.26 1urf h LYS 161 CO 0.01 0.02 0.10 -0.07 -2.27 0.00 0.00 179.45 177.24 1urf h LEU 162 N 0.03 0.61 0.32 5.20 3.38 -1.97 -2.60 115.31 120.28 1urf h LEU 162 Ca 0.03 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.90 1urf h LEU 162 Cb 0.03 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.59 1urf h LEU 162 CO -0.04 0.61 -0.43 0.25 0.09 0.00 0.00 178.44 178.92 1urf h LEU 163 N 0.64 -1.21 -1.30 1.67 7.12 -0.29 -1.49 115.31 120.46 1urf h LEU 163 Ca 0.15 0.11 0.13 0.00 0.13 0.00 0.00 57.88 58.40 1urf h LEU 163 Cb 0.25 0.42 -0.07 0.00 -0.53 0.00 0.00 40.66 40.74 1urf h LEU 163 CO -0.00 -0.55 0.56 -0.07 -0.13 0.00 0.00 178.44 178.25 1urf h LEU 164 N -0.80 0.67 -0.11 2.25 3.38 -1.25 -1.65 115.31 117.80 1urf h LEU 164 Ca -0.02 0.03 0.02 0.00 0.09 0.00 0.00 57.88 58.01 1urf h LEU 164 Cb 0.74 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.37 1urf h LEU 164 CO -0.13 0.36 -0.04 0.74 0.09 0.00 0.00 178.44 179.46 1urf h THR 165 N 0.72 0.86 -0.65 0.22 2.02 -0.92 -0.50 112.91 114.66 1urf h THR 165 Ca 0.42 0.00 -0.06 0.00 0.77 0.00 0.00 66.41 67.55 1urf h THR 165 Cb 0.63 0.86 -0.03 0.00 -1.74 0.00 0.00 68.15 67.87 1urf h THR 165 CO -0.19 0.00 0.18 0.00 0.37 0.00 0.00 175.52 175.89 1urf h ALA 166 N 1.08 0.85 -0.60 6.16 0.00 -0.56 -2.07 119.26 124.14 1urf h ALA 166 Ca 0.06 -0.22 0.05 0.00 0.00 0.00 0.00 54.91 54.79 1urf h ALA 166 Cb 0.11 -0.25 -0.05 0.00 0.00 0.00 0.00 17.79 17.60 1urf h ALA 166 CO -0.12 0.54 0.33 1.96 0.00 0.00 0.00 179.25 181.96 1urf h GLN 167 N 0.95 0.60 -0.59 0.00 1.08 -0.96 -1.09 115.11 115.10 1urf h GLN 167 Ca 0.21 -0.04 -0.05 0.00 -1.45 0.00 0.00 58.65 57.32 1urf h GLN 167 Cb 0.32 -0.14 -0.03 0.00 -0.05 0.00 0.00 27.48 27.59 1urf h GLN 167 CO -0.00 0.40 0.16 0.37 -0.95 0.00 0.00 178.83 178.80 1urf h GLN 168 N 0.62 0.90 0.07 1.46 5.75 -0.85 -1.33 115.11 121.74 1urf h GLN 168 Ca 0.26 -0.18 -0.00 0.00 -0.15 0.00 0.00 58.65 58.58 1urf h GLN 168 Cb 0.15 -0.14 0.00 0.00 1.07 0.00 0.00 27.48 28.56 1urf h GLN 168 CO -0.16 0.79 -0.04 0.52 -2.65 0.00 0.00 178.83 177.29 1urf h MET 169 N 0.87 -0.10 -0.23 1.69 2.86 -0.54 -0.68 114.93 118.80 1urf h MET 169 Ca 0.19 0.01 -0.02 0.00 -2.06 0.00 0.00 59.70 57.81 1urf h MET 169 Cb 0.29 0.02 -0.01 0.00 0.06 0.00 0.00 31.60 31.96 1urf h MET 169 CO -0.00 -0.01 0.05 1.25 1.06 0.00 0.00 176.91 179.26 1urf h LEU 170 N -0.16 0.36 -0.63 1.22 6.46 -1.10 -2.22 115.31 119.24 1urf h LEU 170 Ca -0.01 -0.24 0.06 0.00 -0.12 0.00 0.00 57.88 57.57 1urf h LEU 170 Cb 0.13 -0.09 -0.05 0.00 -0.73 0.00 0.00 40.66 39.91 1urf h LEU 170 CO 0.02 0.50 0.33 -0.61 -0.62 0.00 0.00 178.44 178.06 1urf h GLN 171 N 0.19 0.60 -0.69 1.25 4.15 -1.19 -1.79 115.11 117.63 1urf h GLN 171 Ca 0.07 -0.04 -0.02 0.00 0.77 0.00 0.00 58.65 59.43 1urf h GLN 171 Cb 0.29 -0.13 -0.03 0.00 0.21 0.00 0.00 27.48 27.81 1urf h GLN 171 CO 0.00 0.40 0.34 0.22 -1.93 0.00 0.00 178.83 177.86 1urf h ASP 172 N 0.62 0.89 -0.20 -0.69 3.58 -1.01 -2.51 116.42 117.10 1urf h ASP 172 Ca 0.29 -0.12 0.01 0.00 0.42 0.00 0.00 57.03 57.62 1urf h ASP 172 Cb 0.20 -0.23 -0.01 0.00 1.72 0.00 0.00 39.33 41.01 1urf h ASP 172 CO -0.19 0.76 0.12 0.28 -2.88 0.00 0.00 179.24 177.33 1urf h SER 173 N 0.95 0.20 -0.20 2.28 0.02 -0.75 -2.15 113.55 113.90 1urf h SER 173 Ca 0.24 -0.00 0.03 0.00 -0.84 0.00 0.00 61.79 61.22 1urf h SER 173 Cb 0.10 -0.04 -0.03 0.00 0.14 0.00 0.00 62.40 62.56 1urf h SER 173 CO -0.03 0.14 0.02 0.11 -1.14 0.00 0.00 176.83 175.93 1urf h LYS 174 N 0.24 0.08 -0.46 3.45 1.57 -1.19 -1.71 116.57 118.55 1urf h LYS 174 Ca 0.07 -0.01 0.06 0.00 -1.87 0.00 0.00 60.65 58.91 1urf h LYS 174 Cb -0.01 -0.02 -0.05 0.00 0.08 0.00 0.00 32.23 32.23 1urf h LYS 174 CO -0.03 0.06 0.16 1.15 -0.57 0.00 0.00 179.45 180.22 1urf h THR 175 N 0.09 0.84 -0.92 -0.16 2.02 -1.29 -0.67 112.91 112.82 1urf h THR 175 Ca 0.09 -0.11 0.02 0.00 0.77 0.00 0.00 66.41 67.18 1urf h THR 175 Cb 0.11 0.48 -0.05 0.00 -1.74 0.00 0.00 68.15 66.95 1urf h THR 175 CO -0.15 0.06 0.60 0.11 0.37 0.00 0.00 175.52 176.52 1urf h LYS 176 N 0.33 1.18 -0.64 6.66 1.57 -1.06 -2.09 116.57 122.51 1urf h LYS 176 Ca 0.22 -0.07 -0.06 0.00 -1.87 0.00 0.00 60.65 58.87 1urf h LYS 176 Cb 0.23 -0.27 -0.03 0.00 0.08 0.00 0.00 32.23 32.24 1urf h LYS 176 CO -0.23 0.78 0.18 0.82 -0.57 0.00 0.00 179.45 180.43 1urf h ILE 177 N 1.22 1.24 -0.27 1.86 2.04 -0.41 -2.19 117.51 120.99 1urf h ILE 177 Ca 0.34 -0.87 0.03 0.00 1.00 0.00 0.00 64.86 65.37 1urf h ILE 177 Cb -0.10 0.56 -0.03 0.00 -0.74 0.00 0.00 36.82 36.51 1urf h ILE 177 CO -0.09 0.33 0.08 0.44 0.00 0.00 0.00 178.15 178.92 1urf h ASP 178 N 0.96 0.08 -0.95 1.72 3.32 -0.47 -0.96 116.42 120.13 1urf h ASP 178 Ca 0.21 0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.29 1urf h ASP 178 Cb 0.30 0.03 -0.05 0.00 0.22 0.00 0.00 39.33 39.83 1urf h ASP 178 CO -0.00 0.08 0.60 0.40 -1.72 0.00 0.00 179.24 178.59 1urf h ILE 179 N 0.20 1.25 0.37 0.35 2.04 -1.26 -2.66 117.51 117.81 1urf h ILE 179 Ca 0.12 -0.52 -0.01 0.00 1.00 0.00 0.00 64.86 65.45 1urf h ILE 179 Cb 0.10 -0.11 -0.01 0.00 -0.74 0.00 0.00 36.82 36.05 1urf h ILE 179 CO -0.13 0.26 -0.29 0.40 0.00 0.00 0.00 178.15 178.38 1urf h ILE 180 N 1.30 0.39 -1.00 -0.67 2.04 -0.71 -2.38 117.51 116.48 1urf h ILE 180 Ca 0.34 0.00 0.19 0.00 1.00 0.00 0.00 64.86 66.39 1urf h ILE 180 Cb -0.09 0.39 -0.11 0.00 -0.74 0.00 0.00 36.82 36.27 1urf h ILE 180 CO -0.07 0.00 0.61 -0.09 0.00 0.00 0.00 178.15 178.60 1urf h ARG 181 N -0.67 0.74 -0.95 2.37 2.43 -1.01 0.24 114.38 117.54 1urf h ARG 181 Ca -0.03 -0.04 0.01 0.00 -0.81 0.00 0.00 59.98 59.10 1urf h ARG 181 Cb 0.58 -0.17 -0.05 0.00 -0.42 0.00 0.00 29.97 29.92 1urf h ARG 181 CO -0.01 0.49 0.63 0.52 -1.51 0.00 0.00 179.97 180.09 1urf h MET 182 N 0.76 1.25 -0.34 0.20 2.86 -1.10 -0.61 114.93 117.95 1urf h MET 182 Ca 0.58 -0.08 -0.09 0.00 -2.06 0.00 0.00 59.70 58.05 1urf h MET 182 Cb 0.90 -0.28 -0.01 0.00 0.06 0.00 0.00 31.60 32.27 1urf h MET 182 CO -0.38 0.83 -0.14 1.96 1.06 0.00 0.00 176.91 180.24 1urf h GLN 183 N 1.29 0.70 -0.04 1.72 1.08 -0.09 -2.02 115.11 117.74 1urf h GLN 183 Ca 0.35 -0.29 -0.00 0.00 -1.45 0.00 0.00 58.65 57.25 1urf h GLN 183 Cb -0.15 -0.03 -0.00 0.00 -0.05 0.00 0.00 27.48 27.25 1urf h GLN 183 CO -0.07 0.89 0.02 -0.07 -0.95 0.00 0.00 178.83 178.64 1urf h LEU 184 N 0.48 0.05 -1.31 1.46 4.07 -0.77 -0.85 115.31 118.44 1urf h LEU 184 Ca 0.08 -0.14 -0.00 0.00 0.08 0.00 0.00 57.88 57.90 1urf h LEU 184 Cb 0.66 -0.01 -0.03 0.00 1.08 0.00 0.00 40.66 42.36 1urf h LEU 184 CO 0.04 0.17 0.37 0.08 -1.08 0.00 0.00 178.44 178.03 1urf h ARG 185 N -0.08 0.84 -0.51 1.13 -0.00 -1.15 -1.30 114.38 113.30 1urf h ARG 185 Ca 0.01 -0.07 -0.06 0.00 -0.00 0.00 0.00 59.98 59.86 1urf h ARG 185 Cb 0.14 -0.18 -0.02 0.00 -0.00 0.00 0.00 29.97 29.91 1urf h ARG 185 CO -0.00 0.59 0.08 -0.09 -0.00 0.00 0.00 179.97 180.55 1urf h ARG 186 N 0.85 0.86 -0.61 0.08 9.65 -1.09 -1.35 114.38 122.77 1urf h ARG 186 Ca 0.22 -0.23 -0.04 0.00 -1.10 0.00 0.00 59.98 58.83 1urf h ARG 186 Cb -0.03 -0.10 -0.03 0.00 -1.39 0.00 0.00 29.97 28.43 1urf h ARG 186 CO -0.04 0.85 0.23 0.00 2.80 0.00 0.00 179.97 183.81 1urf h ALA 187 N 0.97 1.27 -0.09 2.80 0.00 -0.41 -1.50 119.26 122.29 1urf h ALA 187 Ca 0.16 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 1urf h ALA 187 Cb 0.41 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.95 1urf h ALA 187 CO 0.01 0.54 -0.04 1.25 0.00 0.00 0.00 179.25 181.01 1urf h LEU 188 N 0.87 0.20 -0.75 0.00 5.85 -0.97 -0.35 115.31 120.16 1urf h LEU 188 Ca 0.21 -0.40 0.03 0.00 0.84 0.00 0.00 57.88 58.55 1urf h LEU 188 Cb 0.19 -0.05 -0.04 0.00 0.37 0.00 0.00 40.66 41.12 1urf h LEU 188 CO -0.02 0.55 0.48 1.56 -0.34 0.00 0.00 178.44 180.68 1urf h GLN 189 N -0.16 0.92 -0.35 1.25 1.08 -1.07 -1.98 115.11 114.81 1urf h GLN 189 Ca 0.02 -0.06 -0.12 0.00 -1.45 0.00 0.00 58.65 57.05 1urf h GLN 189 Cb 0.47 -0.21 -0.01 0.00 -0.05 0.00 0.00 27.48 27.68 1urf h GLN 189 CO 0.01 0.61 -0.28 0.00 -0.95 0.00 0.00 178.83 178.23 1urf h ALA 190 N 1.31 0.86 0.12 3.87 0.00 -1.25 -1.25 119.26 122.92 1urf h ALA 190 Ca 0.30 -0.39 0.02 0.00 0.00 0.00 0.00 54.91 54.83 1urf h ALA 190 Cb -0.02 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.61 1urf h ALA 190 CO -0.10 0.63 -0.22 0.22 0.00 0.00 0.00 179.25 179.78 1urf h ASP 191 N 0.62 -0.63 0.39 0.00 3.58 -0.34 -1.47 116.42 118.58 1urf h ASP 191 Ca 0.08 0.07 -0.07 0.00 0.42 0.00 0.00 57.03 57.53 1urf h ASP 191 Cb 0.79 0.24 -0.01 0.00 1.72 0.00 0.00 39.33 42.06 1urf h ASP 191 CO 0.06 -0.31 -0.32 0.06 -2.88 0.00 0.00 179.24 175.85 1urf h GLN 192 N -0.42 0.00 -4.84 0.28 3.07 -1.40 -3.37 115.11 108.44 1urf h GLN 192 Ca 0.03 0.00 -0.53 0.00 0.09 0.00 0.00 58.65 58.24 1urf h GLN 192 Cb 0.44 0.00 0.04 0.00 0.08 0.00 0.00 27.48 28.04 1urf h GLN 192 CO -0.12 0.32 1.72 -0.11 0.09 0.00 0.00 178.83 180.72 1urf n LEU 193 N -4.01 3.19 0.00 0.06 7.94 -0.48 -4.88 117.00 118.82 1urf n LEU 193 Ca -0.02 -2.72 0.00 0.00 -1.11 0.00 0.00 56.01 52.16 1urf n LEU 193 Cb 0.38 -1.21 0.00 0.00 0.53 0.00 0.00 43.42 43.12 1urf n LEU 193 CO 0.37 -1.18 0.00 -1.84 -1.11 0.00 0.00 177.39 173.63 1urf n GLU 194 N 7.54 0.00 0.00 1.96 0.28 -1.26 -4.90 120.64 124.26 1urf n GLU 194 Ca 0.48 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.48 1urf n GLU 194 Cb 0.43 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.30 1urf n GLU 194 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 177.13 177.24 1urf n ASN 195 N -2.99 0.00 -4.75 -1.84 0.23 -1.26 -4.79 115.26 99.86 1urf n ASN 195 Ca 0.00 0.00 -0.41 0.00 -0.53 0.00 0.00 54.58 53.64 1urf n ASN 195 Cb 0.00 0.06 -0.03 0.00 -2.08 0.00 0.00 39.78 37.73 1urf n ASN 195 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1urf s GLN 196 N -1.44 4.49 0.26 -3.83 0.00 -1.26 -4.96 119.66 112.92 1urf s GLN 196 Ca 0.00 1.95 -0.31 0.00 -0.00 0.00 0.00 55.36 57.01 1urf s GLN 196 Cb 0.00 -3.18 -0.11 0.00 0.00 0.00 0.00 33.01 29.71 1urf s GLN 196 CO 0.00 -0.04 1.63 0.00 0.00 0.00 0.00 175.29 176.88 1urf s ALA 197 N -0.61 3.81 0.36 2.60 0.00 -1.26 -4.61 121.76 122.05 1urf s ALA 197 Ca 0.50 1.56 0.00 0.00 0.00 0.00 0.00 51.96 54.02 1urf s ALA 197 Cb -0.35 -3.66 0.00 0.00 0.00 0.00 0.00 23.12 19.11 1urf s ALA 197 CO 0.42 -0.95 0.00 0.00 0.00 0.00 0.00 175.76 175.23 1urf n ALA 198 N 2.86 -2.11 0.00 0.00 0.00 -1.26 -5.29 120.51 114.71 1urf n ALA 198 Ca 0.11 0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.94 1urf n ALA 198 Cb 0.37 -1.29 0.00 0.00 0.00 0.00 0.00 19.45 18.53 1urf n ALA 198 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20