#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1urf n ILE 120 N 0.00 -1.80 0.00 -0.61 -5.35 -1.26 -4.94 119.36 105.40 1urf n ILE 120 Ca 0.00 -0.49 0.00 0.00 -0.27 0.00 0.00 62.75 61.99 1urf n ILE 120 Cb 0.00 -1.57 0.00 0.00 -1.74 0.00 0.00 39.64 36.33 1urf n ILE 120 CO 0.00 0.00 0.00 -2.65 -1.76 0.00 0.00 176.55 172.14 1urf n PRO 121 N -4.48 3.05 0.22 6.28 -0.02 -1.26 -4.92 135.00 133.86 1urf n PRO 121 Ca -0.17 0.00 -0.13 0.00 -2.02 0.00 0.00 63.50 61.18 1urf n PRO 121 Cb 0.54 0.00 -0.07 0.00 -0.02 0.00 0.00 33.50 33.95 1urf n PRO 121 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1urf h ALA 122 N -2.00 -0.59 -2.00 3.55 0.00 -2.09 -3.42 119.26 112.71 1urf h ALA 122 Ca 0.00 -0.19 -0.57 0.00 0.00 0.00 0.00 54.91 54.15 1urf h ALA 122 Cb 0.00 0.23 -0.06 0.00 0.00 0.00 0.00 17.79 17.96 1urf h ALA 122 CO 0.00 -0.64 0.87 0.95 0.00 0.00 0.00 179.25 180.43 1urf s THR 123 N -4.38 4.45 0.00 0.00 -4.23 -1.26 -4.39 115.64 105.83 1urf s THR 123 Ca -0.13 1.70 0.00 0.00 -1.18 0.00 0.00 61.69 62.07 1urf s THR 123 Cb 0.02 -4.30 0.00 0.00 1.34 0.00 0.00 72.50 69.56 1urf s THR 123 CO 0.46 -0.38 0.00 -3.20 -0.54 0.00 0.00 174.62 170.96 1urf n ASN 124 N 6.86 0.00 -0.14 3.99 5.15 -1.26 -4.94 115.26 124.91 1urf n ASN 124 Ca 0.13 0.00 -0.08 0.00 -0.60 0.00 0.00 54.58 54.02 1urf n ASN 124 Cb 0.46 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.72 1urf n ASN 124 CO 0.00 0.00 0.00 -0.07 1.40 0.00 0.00 177.26 178.59 1urf h LEU 125 N 0.00 0.53 -0.37 1.20 3.38 -1.90 -1.16 115.31 116.99 1urf h LEU 125 Ca 0.00 -0.09 -0.01 0.00 0.09 0.00 0.00 57.88 57.87 1urf h LEU 125 Cb 0.00 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.60 1urf h LEU 125 CO 0.00 0.47 0.18 -1.28 0.09 0.00 0.00 178.44 177.90 1urf h SER 126 N 0.56 0.48 -0.37 -0.43 0.87 -1.94 -1.64 113.55 111.08 1urf h SER 126 Ca 0.15 -0.12 -0.03 0.00 -1.23 0.00 0.00 61.79 60.56 1urf h SER 126 Cb 0.05 -0.12 -0.02 0.00 -0.44 0.00 0.00 62.40 61.87 1urf h SER 126 CO -0.02 0.47 0.12 -0.09 -0.53 0.00 0.00 176.83 176.78 1urf h ARG 127 N 0.46 0.57 -0.16 2.24 2.43 -1.92 -2.05 114.38 115.95 1urf h ARG 127 Ca 0.13 -0.12 -0.00 0.00 -0.81 0.00 0.00 59.98 59.18 1urf h ARG 127 Cb 0.11 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.57 1urf h ARG 127 CO -0.02 0.57 0.09 0.28 -1.51 0.00 0.00 179.97 179.39 1urf h VAL 128 N 0.45 1.09 -0.61 0.20 2.07 -1.12 -1.29 116.25 117.03 1urf h VAL 128 Ca 0.12 -0.23 0.01 0.00 0.82 0.00 0.00 66.70 67.42 1urf h VAL 128 Cb 0.24 0.95 -0.03 0.00 -1.52 0.00 0.00 31.29 30.93 1urf h VAL 128 CO -0.01 0.08 0.40 0.00 0.02 0.00 0.00 177.57 178.07 1urf h ALA 129 N 1.00 0.77 -0.10 1.67 0.00 -1.26 0.69 119.26 122.03 1urf h ALA 129 Ca 0.06 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 1urf h ALA 129 Cb 0.05 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.59 1urf h ALA 129 CO -0.01 0.21 0.02 0.78 0.00 0.00 0.00 179.25 180.24 1urf h GLY 130 N 0.82 0.18 1.02 0.00 0.00 -1.23 -2.01 103.07 101.86 1urf h GLY 130 Ca 0.22 -0.12 -0.06 0.00 0.00 0.00 0.00 47.33 47.37 1urf h GLY 130 CO -0.05 0.11 0.11 1.41 0.00 0.00 0.00 176.54 178.13 1urf h LEU 131 N -0.06 0.91 0.11 3.11 3.38 -1.13 -2.64 115.31 118.99 1urf h LEU 131 Ca 0.03 -0.25 -0.01 0.00 0.09 0.00 0.00 57.88 57.75 1urf h LEU 131 Cb 0.28 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 40.79 1urf h LEU 131 CO 0.00 0.93 -0.05 -0.08 0.09 0.00 0.00 178.44 179.33 1urf h GLU 132 N 0.86 -0.14 -0.93 1.13 4.57 -0.84 -2.62 114.58 116.61 1urf h GLU 132 Ca 0.18 0.01 0.02 0.00 -1.18 0.00 0.00 59.36 58.39 1urf h GLU 132 Cb 0.39 0.03 -0.05 0.00 -0.16 0.00 0.00 28.75 28.96 1urf h GLU 132 CO 0.01 -0.04 0.62 1.57 -1.18 0.00 0.00 179.01 179.98 1urf h LYS 133 N -0.20 1.19 -0.60 1.92 2.10 -1.35 -2.32 116.57 117.31 1urf h LYS 133 Ca -0.01 -0.07 0.03 0.00 -2.00 0.00 0.00 60.65 58.60 1urf h LYS 133 Cb 0.16 -0.27 -0.04 0.00 -0.90 0.00 0.00 32.23 31.18 1urf h LYS 133 CO 0.02 0.79 0.36 1.96 -2.00 0.00 0.00 179.45 180.58 1urf h GLN 134 N 1.23 0.67 -0.62 0.07 1.08 -1.28 -2.21 115.11 114.05 1urf h GLN 134 Ca 0.35 -0.04 0.03 0.00 -1.45 0.00 0.00 58.65 57.54 1urf h GLN 134 Cb -0.08 -0.15 -0.04 0.00 -0.05 0.00 0.00 27.48 27.16 1urf h GLN 134 CO -0.09 0.45 0.38 -0.07 -0.95 0.00 0.00 178.83 178.55 1urf h LEU 135 N 0.69 0.63 -0.25 1.46 3.38 -1.05 -2.03 115.31 118.13 1urf h LEU 135 Ca 0.25 0.00 0.01 0.00 0.09 0.00 0.00 57.88 58.23 1urf h LEU 135 Cb 0.06 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.66 1urf h LEU 135 CO -0.12 0.44 0.14 0.00 0.09 0.00 0.00 178.44 178.99 1urf h ALA 136 N 1.27 0.31 -0.77 1.53 0.00 -1.17 -2.25 119.26 118.18 1urf h ALA 136 Ca 0.25 -0.00 0.02 0.00 0.00 0.00 0.00 54.91 55.18 1urf h ALA 136 Cb 0.01 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 17.69 1urf h ALA 136 CO -0.10 -0.25 0.50 0.82 0.00 0.00 0.00 179.25 180.22 1urf h ILE 137 N 0.30 1.14 -0.66 0.00 2.04 -1.12 -2.51 117.51 116.69 1urf h ILE 137 Ca 0.10 -0.34 0.01 0.00 1.00 0.00 0.00 64.86 65.63 1urf h ILE 137 Cb 0.00 0.07 -0.03 0.00 -0.74 0.00 0.00 36.82 36.12 1urf h ILE 137 CO -0.05 0.18 0.44 -0.33 0.00 0.00 0.00 178.15 178.38 1urf h GLU 138 N 0.98 0.87 -0.72 2.37 4.39 -1.06 -2.59 114.58 118.82 1urf h GLU 138 Ca 0.30 -0.05 0.03 0.00 0.34 0.00 0.00 59.36 59.98 1urf h GLU 138 Cb -0.03 -0.20 -0.05 0.00 -0.10 0.00 0.00 28.75 28.38 1urf h GLU 138 CO -0.10 0.58 0.45 -0.07 -1.16 0.00 0.00 179.01 178.72 1urf h LEU 139 N 0.90 0.74 -0.17 1.33 3.38 -0.99 0.89 115.31 121.38 1urf h LEU 139 Ca 0.24 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.22 1urf h LEU 139 Cb -0.10 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.49 1urf h LEU 139 CO -0.05 0.50 0.10 0.50 0.09 0.00 0.00 178.44 179.58 1urf h LYS 140 N 0.87 0.20 -0.16 1.13 3.64 -1.16 -0.36 116.57 120.73 1urf h LYS 140 Ca 0.29 -0.01 -0.05 0.00 -1.27 0.00 0.00 60.65 59.61 1urf h LYS 140 Cb 0.04 -0.05 -0.00 0.00 -0.41 0.00 0.00 32.23 31.81 1urf h LYS 140 CO -0.12 0.14 -0.09 0.28 -2.27 0.00 0.00 179.45 177.39 1urf h VAL 141 N 0.21 1.32 -0.11 2.00 2.07 -1.17 -1.50 116.25 119.07 1urf h VAL 141 Ca 0.06 -1.16 0.01 0.00 0.82 0.00 0.00 66.70 66.43 1urf h VAL 141 Cb -0.01 1.74 -0.01 0.00 -1.52 0.00 0.00 31.29 31.48 1urf h VAL 141 CO -0.02 0.34 0.04 0.50 0.02 0.00 0.00 177.57 178.45 1urf h LYS 142 N 0.01 0.10 -0.61 1.57 3.64 -0.77 -0.68 116.57 119.83 1urf h LYS 142 Ca 0.03 -0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 59.37 1urf h LYS 142 Cb 0.58 -0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 32.35 1urf h LYS 142 CO 0.03 0.07 0.24 1.96 -2.27 0.00 0.00 179.45 179.47 1urf h GLN 143 N 0.10 0.92 -0.93 1.90 1.08 -1.11 -2.13 115.11 114.94 1urf h GLN 143 Ca 0.05 -0.17 0.01 0.00 -1.45 0.00 0.00 58.65 57.09 1urf h GLN 143 Cb 0.02 -0.15 -0.05 0.00 -0.05 0.00 0.00 27.48 27.26 1urf h GLN 143 CO -0.04 0.79 0.61 0.78 -0.95 0.00 0.00 178.83 180.02 1urf h GLY 144 N 0.85 1.31 1.07 3.46 0.00 -0.97 -1.75 103.07 107.04 1urf h GLY 144 Ca 0.20 -0.48 -0.07 0.00 0.00 0.00 0.00 47.33 46.98 1urf h GLY 144 CO -0.01 0.46 0.17 0.00 0.00 0.00 0.00 176.54 177.16 1urf h ALA 145 N 1.43 0.94 -0.95 3.60 0.00 -0.79 -2.45 119.26 121.04 1urf h ALA 145 Ca 0.34 -0.25 0.01 0.00 0.00 0.00 0.00 54.91 55.02 1urf h ALA 145 Cb -0.12 -0.27 -0.05 0.00 0.00 0.00 0.00 17.79 17.35 1urf h ALA 145 CO -0.08 0.67 0.63 0.93 0.00 0.00 0.00 179.25 181.40 1urf h GLU 146 N 1.08 1.24 -0.58 0.00 4.39 -0.69 -0.01 114.58 120.01 1urf h GLU 146 Ca 0.22 -0.07 -0.00 0.00 0.34 0.00 0.00 59.36 59.85 1urf h GLU 146 Cb 0.38 -0.28 -0.03 0.00 -0.10 0.00 0.00 28.75 28.72 1urf h GLU 146 CO 0.00 0.82 0.36 -0.91 -1.16 0.00 0.00 179.01 178.12 1urf h ASN 147 N 1.28 0.69 -0.49 1.42 -0.26 -0.90 -1.28 115.58 116.04 1urf h ASN 147 Ca 0.35 -0.05 -0.10 0.00 -0.56 0.00 0.00 56.30 55.95 1urf h ASN 147 Cb -0.13 -0.17 -0.02 0.00 -1.06 0.00 0.00 38.32 36.95 1urf h ASN 147 CO -0.08 0.53 -0.08 0.24 -1.06 0.00 0.00 177.43 176.97 1urf h MET 148 N 0.78 0.92 -0.07 0.81 2.86 -1.02 -1.04 114.93 118.17 1urf h MET 148 Ca 0.21 -0.33 -0.00 0.00 -2.06 0.00 0.00 59.70 57.51 1urf h MET 148 Cb -0.04 -0.06 -0.00 0.00 0.06 0.00 0.00 31.60 31.56 1urf h MET 148 CO -0.04 0.99 0.04 0.82 1.06 0.00 0.00 176.91 179.78 1urf h ILE 149 N 0.77 1.06 -0.26 -1.22 2.04 -0.69 0.10 117.51 119.31 1urf h ILE 149 Ca 0.13 -0.17 -0.09 0.00 1.00 0.00 0.00 64.86 65.73 1urf h ILE 149 Cb 0.63 1.05 -0.01 0.00 -0.74 0.00 0.00 36.82 37.75 1urf h ILE 149 CO 0.04 0.05 -0.18 1.56 0.00 0.00 0.00 178.15 179.63 1urf h GLN 150 N 0.04 0.57 -0.21 2.37 1.08 -1.25 -2.91 115.11 114.82 1urf h GLN 150 Ca 0.02 -0.27 -0.02 0.00 -1.45 0.00 0.00 58.65 56.93 1urf h GLN 150 Cb 0.05 -0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.47 1urf h GLN 150 CO -0.00 0.85 0.05 1.15 -0.95 0.00 0.00 178.83 179.93 1urf h THR 151 N 0.30 1.21 0.00 -0.54 2.02 -1.15 -2.47 112.91 112.28 1urf h THR 151 Ca 0.05 -0.68 0.00 0.00 0.77 0.00 0.00 66.41 66.56 1urf h THR 151 Cb 0.71 1.26 0.00 0.00 -1.74 0.00 0.00 68.15 68.38 1urf h THR 151 CO 0.05 0.21 0.00 -1.22 0.37 0.00 0.00 175.52 174.93 1urf n TYR 152 N -4.76 0.00 -0.01 3.16 4.02 0.36 -3.68 117.16 116.25 1urf n TYR 152 Ca -0.04 0.00 -0.13 0.00 -0.01 0.00 0.00 57.90 57.72 1urf n TYR 152 Cb 0.17 0.00 -0.09 0.00 -0.02 0.00 0.00 39.34 39.41 1urf n TYR 152 CO 0.00 0.00 0.00 0.77 -1.01 0.00 0.00 176.86 176.62 1urf h SER 153 N 0.00 0.06 0.00 7.72 0.02 -1.23 -3.45 113.55 116.67 1urf h SER 153 Ca 0.00 -0.37 0.00 0.00 -0.84 0.00 0.00 61.79 60.58 1urf h SER 153 Cb 0.00 -0.02 0.00 0.00 0.14 0.00 0.00 62.40 62.52 1urf h SER 153 CO 0.00 0.42 0.00 0.59 -1.14 0.00 0.00 176.83 176.70 1urf n ASN 154 N -4.87 0.00 -4.76 3.07 3.02 -1.24 -5.05 115.26 105.43 1urf n ASN 154 Ca -0.08 0.00 -0.39 0.00 -0.03 0.00 0.00 54.58 54.09 1urf n ASN 154 Cb 0.21 0.43 0.01 0.00 -0.61 0.00 0.00 39.78 39.82 1urf n ASN 154 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1urf s GLY 155 N -2.37 2.88 0.00 7.41 0.00 -1.25 -4.63 107.32 109.37 1urf s GLY 155 Ca 0.00 1.21 0.00 0.00 0.00 0.00 0.00 44.72 45.93 1urf s GLY 155 CO 0.00 1.76 0.00 -1.26 0.00 0.00 0.00 173.10 173.60 1urf n SER 156 N -0.31 0.00 -4.63 1.64 2.88 -1.26 -4.45 113.62 107.48 1urf n SER 156 Ca 0.06 0.00 -0.50 0.00 -1.33 0.00 0.00 58.87 57.10 1urf n SER 156 Cb 0.45 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.85 1urf n SER 156 CO 0.00 0.00 0.00 0.41 -1.23 0.00 0.00 175.04 174.22 1urf n THR 157 N 0.00 0.06 -0.11 2.46 -1.04 -1.26 -4.89 114.28 109.51 1urf n THR 157 Ca 0.00 -0.01 -0.14 0.00 -2.04 0.00 0.00 64.05 61.86 1urf n THR 157 Cb 0.00 -1.18 -0.11 0.00 -1.82 0.00 0.00 70.33 67.21 1urf n THR 157 CO 0.00 0.00 0.00 1.17 -0.64 0.00 0.00 175.07 175.60 1urf n LYS 158 N 3.35 0.69 -1.55 -2.82 3.00 -1.26 -4.43 118.16 115.14 1urf n LYS 158 Ca 0.19 0.10 -0.47 0.00 -0.00 0.00 0.00 58.31 58.12 1urf n LYS 158 Cb 0.23 -1.46 -0.05 0.00 0.00 0.00 0.00 35.03 33.75 1urf n LYS 158 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 1urf n ASP 159 N -3.05 2.81 0.06 3.14 9.92 -1.26 -4.81 116.55 123.35 1urf n ASP 159 Ca -0.38 0.44 0.11 0.00 -0.53 0.00 0.00 54.79 54.43 1urf n ASP 159 Cb 0.96 -1.39 0.46 0.00 -0.64 0.00 0.00 41.12 40.50 1urf n ASP 159 CO 0.00 0.00 0.00 -1.14 0.13 0.00 0.00 177.20 176.19 1urf n ARG 160 N 8.13 0.12 -0.10 -1.24 0.63 -1.26 -3.59 116.66 119.35 1urf n ARG 160 Ca 0.33 0.23 -0.06 0.00 -0.92 0.00 0.00 57.85 57.44 1urf n ARG 160 Cb 0.32 -1.68 0.00 0.00 0.45 0.00 0.00 32.46 31.56 1urf n ARG 160 CO 0.00 0.00 0.00 -0.22 -2.51 0.00 0.00 177.63 174.90 1urf h LYS 161 N 0.00 -0.02 -0.21 -0.14 3.64 -1.98 0.53 116.57 118.39 1urf h LYS 161 Ca 0.00 0.00 -0.09 0.00 -1.27 0.00 0.00 60.65 59.29 1urf h LYS 161 Cb 0.46 0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.28 1urf h LYS 161 CO 0.00 -0.02 -0.27 -0.07 -2.27 0.00 0.00 179.45 176.83 1urf h LEU 162 N -0.03 0.40 -0.62 5.20 -0.00 -1.98 -2.77 115.31 115.53 1urf h LEU 162 Ca 0.17 -0.14 0.06 0.00 -0.00 0.00 0.00 57.88 57.98 1urf h LEU 162 Cb 0.29 -0.11 -0.05 0.00 -0.00 0.00 0.00 40.66 40.78 1urf h LEU 162 CO -0.38 0.67 0.33 0.25 -0.00 0.00 0.00 178.44 179.31 1urf h LEU 163 N 0.36 0.47 -0.39 1.67 5.85 -1.11 0.22 115.31 122.37 1urf h LEU 163 Ca 0.05 0.03 -0.03 0.00 0.84 0.00 0.00 57.88 58.78 1urf h LEU 163 Cb 0.66 -0.06 -0.02 0.00 0.37 0.00 0.00 40.66 41.62 1urf h LEU 163 CO 0.05 0.31 0.12 -0.07 -0.34 0.00 0.00 178.44 178.51 1urf h LEU 164 N 0.61 0.57 -0.71 2.25 3.38 -0.81 -2.33 115.31 118.27 1urf h LEU 164 Ca 0.28 -0.20 0.02 0.00 0.09 0.00 0.00 57.88 58.07 1urf h LEU 164 Cb 0.19 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 40.75 1urf h LEU 164 CO -0.19 0.62 0.45 0.74 0.09 0.00 0.00 178.44 180.16 1urf h THR 165 N 0.49 1.12 -0.86 0.22 2.02 -1.12 -2.16 112.91 112.61 1urf h THR 165 Ca 0.13 -0.31 0.00 0.00 0.77 0.00 0.00 66.41 67.00 1urf h THR 165 Cb 0.25 0.15 -0.04 0.00 -1.74 0.00 0.00 68.15 66.77 1urf h THR 165 CO -0.00 0.16 0.54 0.00 0.37 0.00 0.00 175.52 176.59 1urf h ALA 166 N 1.29 1.09 -0.74 6.16 0.00 -0.78 -2.06 119.26 124.22 1urf h ALA 166 Ca 0.28 -0.08 0.02 0.00 0.00 0.00 0.00 54.91 55.13 1urf h ALA 166 Cb -0.01 -0.35 -0.04 0.00 0.00 0.00 0.00 17.79 17.39 1urf h ALA 166 CO -0.10 0.53 0.48 1.96 0.00 0.00 0.00 179.25 182.12 1urf h GLN 167 N 1.17 0.92 -0.89 0.00 4.20 -0.85 -1.37 115.11 118.29 1urf h GLN 167 Ca 0.31 -0.06 0.02 0.00 0.06 0.00 0.00 58.65 58.99 1urf h GLN 167 Cb -0.09 -0.21 -0.05 0.00 0.30 0.00 0.00 27.48 27.43 1urf h GLN 167 CO -0.06 0.61 0.58 0.37 -0.67 0.00 0.00 178.83 179.66 1urf h GLN 168 N 0.95 1.12 -0.51 1.46 -0.00 -0.86 -1.90 115.11 115.37 1urf h GLN 168 Ca 0.29 -0.07 0.05 0.00 -0.00 0.00 0.00 58.65 58.93 1urf h GLN 168 Cb -0.03 -0.25 -0.05 0.00 0.00 0.00 0.00 27.48 27.14 1urf h GLN 168 CO -0.09 0.74 0.23 0.52 0.00 0.00 0.00 178.83 180.23 1urf h MET 169 N 1.16 0.44 -0.58 1.69 2.86 -0.61 -2.03 114.93 117.85 1urf h MET 169 Ca 0.34 -0.03 0.03 0.00 -2.06 0.00 0.00 59.70 57.99 1urf h MET 169 Cb -0.05 -0.10 -0.04 0.00 0.06 0.00 0.00 31.60 31.47 1urf h MET 169 CO -0.10 0.29 0.34 1.25 1.06 0.00 0.00 176.91 179.75 1urf h LEU 170 N 0.45 0.55 -0.66 1.22 5.85 -0.70 -2.32 115.31 119.70 1urf h LEU 170 Ca 0.23 0.01 0.03 0.00 0.84 0.00 0.00 57.88 59.00 1urf h LEU 170 Cb 0.19 -0.10 -0.04 0.00 0.37 0.00 0.00 40.66 41.07 1urf h LEU 170 CO -0.19 0.38 0.40 1.56 -0.34 0.00 0.00 178.44 180.25 1urf h GLN 171 N 0.67 0.77 -0.27 1.25 4.20 -0.83 -0.58 115.11 120.32 1urf h GLN 171 Ca 0.24 -0.05 0.00 0.00 0.06 0.00 0.00 58.65 58.90 1urf h GLN 171 Cb 0.05 -0.17 -0.01 0.00 0.30 0.00 0.00 27.48 27.65 1urf h GLN 171 CO -0.12 0.51 0.17 0.22 -0.67 0.00 0.00 178.83 178.94 1urf h ASP 172 N 0.79 0.32 -0.33 1.46 1.82 -0.96 -1.98 116.42 117.54 1urf h ASP 172 Ca 0.27 -0.03 -0.03 0.00 -0.39 0.00 0.00 57.03 56.85 1urf h ASP 172 Cb 0.04 -0.08 -0.01 0.00 0.68 0.00 0.00 39.33 39.95 1urf h ASP 172 CO -0.11 0.26 0.09 0.77 -1.61 0.00 0.00 179.24 178.63 1urf h SER 173 N 0.36 0.50 -0.65 2.28 4.64 -1.12 -2.76 113.55 116.80 1urf h SER 173 Ca 0.10 -0.23 0.05 0.00 -0.47 0.00 0.00 61.79 61.24 1urf h SER 173 Cb -0.01 -0.13 -0.05 0.00 -0.31 0.00 0.00 62.40 61.90 1urf h SER 173 CO -0.02 0.60 0.37 0.11 -0.87 0.00 0.00 176.83 177.01 1urf h LYS 174 N 0.38 0.67 -0.03 4.77 1.57 -0.98 -0.84 116.57 122.11 1urf h LYS 174 Ca 0.10 -0.04 0.01 0.00 -1.87 0.00 0.00 60.65 58.85 1urf h LYS 174 Cb 0.29 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.44 1urf h LYS 174 CO 0.00 0.44 -0.02 1.15 -0.57 0.00 0.00 179.45 180.45 1urf h THR 175 N 0.69 0.94 -0.79 -0.16 2.02 -1.27 -1.19 112.91 113.15 1urf h THR 175 Ca 0.28 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.49 1urf h THR 175 Cb 0.15 0.94 -0.04 0.00 -1.74 0.00 0.00 68.15 67.46 1urf h THR 175 CO -0.16 0.00 0.51 0.11 0.37 0.00 0.00 175.52 176.35 1urf h LYS 176 N -0.02 0.99 -0.40 6.66 1.57 -1.18 -1.78 116.57 122.40 1urf h LYS 176 Ca 0.02 -0.06 -0.02 0.00 -1.87 0.00 0.00 60.65 58.71 1urf h LYS 176 Cb 0.05 -0.22 -0.02 0.00 0.08 0.00 0.00 32.23 32.11 1urf h LYS 176 CO -0.04 0.66 0.15 0.82 -0.57 0.00 0.00 179.45 180.46 1urf h ILE 177 N 1.02 1.16 0.07 1.86 2.04 -0.81 -1.55 117.51 121.30 1urf h ILE 177 Ca 0.31 -0.51 -0.00 0.00 1.00 0.00 0.00 64.86 65.65 1urf h ILE 177 Cb -0.04 0.69 0.00 0.00 -0.74 0.00 0.00 36.82 36.73 1urf h ILE 177 CO -0.09 0.20 -0.03 -0.78 0.00 0.00 0.00 178.15 177.44 1urf h ASP 178 N 0.57 -0.08 -0.23 1.72 3.58 -0.33 0.15 116.42 121.80 1urf h ASP 178 Ca 0.14 -0.05 -0.01 0.00 0.42 0.00 0.00 57.03 57.53 1urf h ASP 178 Cb 0.14 0.02 -0.01 0.00 1.72 0.00 0.00 39.33 41.20 1urf h ASP 178 CO -0.01 -0.00 0.10 0.40 -2.88 0.00 0.00 179.24 176.85 1urf h ILE 179 N -0.16 1.15 -0.62 2.25 5.03 -1.24 -2.62 117.51 121.31 1urf h ILE 179 Ca -0.01 -0.45 0.03 0.00 -0.12 0.00 0.00 64.86 64.31 1urf h ILE 179 Cb 0.13 1.03 -0.04 0.00 -3.03 0.00 0.00 36.82 34.91 1urf h ILE 179 CO 0.02 0.15 0.38 0.40 -0.68 0.00 0.00 178.15 178.42 1urf h ILE 180 N 0.23 1.07 -0.81 -0.67 2.04 -1.18 -1.98 117.51 116.21 1urf h ILE 180 Ca 0.08 -0.25 0.12 0.00 1.00 0.00 0.00 64.86 65.80 1urf h ILE 180 Cb 0.15 0.26 -0.08 0.00 -0.74 0.00 0.00 36.82 36.41 1urf h ILE 180 CO -0.01 0.14 0.43 -0.09 0.00 0.00 0.00 178.15 178.62 1urf h ARG 181 N 0.74 0.66 -0.86 2.37 9.65 -0.49 0.46 114.38 126.92 1urf h ARG 181 Ca 0.25 -0.04 -0.00 0.00 -1.10 0.00 0.00 59.98 59.09 1urf h ARG 181 Cb 0.03 -0.15 -0.04 0.00 -1.39 0.00 0.00 29.97 28.42 1urf h ARG 181 CO -0.11 0.44 0.52 0.52 2.80 0.00 0.00 179.97 184.14 1urf h MET 182 N 0.68 1.16 -0.36 0.20 2.86 -1.00 -1.65 114.93 116.83 1urf h MET 182 Ca 0.41 -0.10 -0.03 0.00 -2.06 0.00 0.00 59.70 57.92 1urf h MET 182 Cb 0.49 -0.24 -0.01 0.00 0.06 0.00 0.00 31.60 31.89 1urf h MET 182 CO -0.30 0.81 0.11 1.96 1.06 0.00 0.00 176.91 180.54 1urf h GLN 183 N 1.18 0.56 0.30 1.72 1.08 -0.54 -1.46 115.11 117.94 1urf h GLN 183 Ca 0.31 -0.12 -0.01 0.00 -1.45 0.00 0.00 58.65 57.37 1urf h GLN 183 Cb -0.05 -0.08 0.00 0.00 -0.05 0.00 0.00 27.48 27.30 1urf h GLN 183 CO -0.06 0.59 -0.14 -0.07 -0.95 0.00 0.00 178.83 178.20 1urf h LEU 184 N 0.43 -0.34 -1.05 1.46 -0.00 -0.87 -1.00 115.31 113.93 1urf h LEU 184 Ca 0.11 -0.05 0.06 0.00 -0.00 0.00 0.00 57.88 58.01 1urf h LEU 184 Cb 0.26 0.09 -0.06 0.00 -0.00 0.00 0.00 40.66 40.95 1urf h LEU 184 CO -0.00 -0.17 0.63 0.08 -0.00 0.00 0.00 178.44 178.98 1urf h ARG 185 N -0.48 1.12 -0.80 1.13 0.11 -1.32 -1.44 114.38 112.70 1urf h ARG 185 Ca -0.04 -0.07 -0.05 0.00 0.10 0.00 0.00 59.98 59.92 1urf h ARG 185 Cb 0.36 -0.25 -0.04 0.00 1.11 0.00 0.00 29.97 31.15 1urf h ARG 185 CO 0.07 0.74 0.31 -0.09 0.10 0.00 0.00 179.97 181.10 1urf h ARG 186 N 1.16 1.20 -0.52 0.08 9.65 -1.05 -1.75 114.38 123.14 1urf h ARG 186 Ca 0.41 -0.22 -0.01 0.00 -1.10 0.00 0.00 59.98 59.06 1urf h ARG 186 Cb 0.13 -0.19 -0.02 0.00 -1.39 0.00 0.00 29.97 28.50 1urf h ARG 186 CO -0.15 0.97 0.27 0.00 2.80 0.00 0.00 179.97 183.86 1urf h ALA 187 N 1.17 0.67 -0.52 2.80 0.00 -0.14 -1.73 119.26 121.52 1urf h ALA 187 Ca 0.27 -0.11 -0.08 0.00 0.00 0.00 0.00 54.91 54.99 1urf h ALA 187 Cb 0.22 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 1urf h ALA 187 CO -0.02 0.21 0.03 -0.07 0.00 0.00 0.00 179.25 179.40 1urf h LEU 188 N 0.70 0.88 -0.37 0.00 4.07 -1.18 -1.28 115.31 118.12 1urf h LEU 188 Ca 0.18 -0.29 -0.01 0.00 0.08 0.00 0.00 57.88 57.84 1urf h LEU 188 Cb 0.08 -0.23 -0.02 0.00 1.08 0.00 0.00 40.66 41.56 1urf h LEU 188 CO -0.03 0.95 0.21 1.56 -1.08 0.00 0.00 178.44 180.05 1urf h GLN 189 N 0.77 0.52 -0.01 1.13 1.08 -1.13 0.22 115.11 117.69 1urf h GLN 189 Ca 0.15 -0.06 -0.00 0.00 -1.45 0.00 0.00 58.65 57.29 1urf h GLN 189 Cb 0.48 -0.10 -0.00 0.00 -0.05 0.00 0.00 27.48 27.81 1urf h GLN 189 CO 0.02 0.42 -0.00 0.00 -0.95 0.00 0.00 178.83 178.32 1urf h ALA 190 N 1.07 0.02 0.62 3.87 0.00 -1.25 -3.33 119.26 120.25 1urf h ALA 190 Ca 0.13 -0.17 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 1urf h ALA 190 Cb 0.05 -0.00 0.01 0.00 0.00 0.00 0.00 17.79 17.84 1urf h ALA 190 CO -0.02 -0.32 -0.30 0.22 0.00 0.00 0.00 179.25 178.84 1urf h ASP 191 N -0.30 -0.71 -2.75 0.00 1.82 -1.20 -3.42 116.42 109.86 1urf h ASP 191 Ca 0.00 -0.02 -0.55 0.00 -0.39 0.00 0.00 57.03 56.08 1urf h ASP 191 Cb 0.33 0.18 -0.01 0.00 0.68 0.00 0.00 39.33 40.51 1urf h ASP 191 CO 0.00 -0.34 0.98 -1.58 -1.61 0.00 0.00 179.24 176.69 1urf s GLN 192 N -4.73 4.22 0.00 0.28 0.74 0.77 -4.26 119.66 116.68 1urf s GLN 192 Ca -0.14 2.01 0.00 0.00 0.05 0.00 0.00 55.36 57.28 1urf s GLN 192 Cb 0.02 -3.82 0.00 0.00 1.10 0.00 0.00 33.01 30.30 1urf s GLN 192 CO 0.46 -0.75 0.00 -0.11 -0.55 0.00 0.00 175.29 174.34 1urf n LEU 193 N 6.55 0.00 0.00 3.68 0.00 -1.26 -4.66 117.00 121.31 1urf n LEU 193 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 56.01 56.16 1urf n LEU 193 Cb 0.43 0.00 0.00 0.00 0.00 0.00 0.00 43.42 43.85 1urf n LEU 193 CO 0.60 0.00 0.00 -1.84 0.00 0.00 0.00 177.39 176.15 1urf n GLU 194 N 0.00 0.00 -3.60 1.96 0.28 -1.26 -5.13 120.64 112.89 1urf n GLU 194 Ca 0.00 0.00 0.03 0.00 -0.16 0.00 0.00 57.16 57.03 1urf n GLU 194 Cb 0.00 0.00 -0.06 0.00 1.43 0.00 0.00 31.44 32.81 1urf n GLU 194 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 177.13 178.18 1urf s ASN 195 N -1.53 -0.05 0.42 -1.84 3.04 -1.26 -5.14 114.94 108.58 1urf s ASN 195 Ca 0.00 0.08 -0.26 0.00 0.04 0.00 0.00 52.86 52.73 1urf s ASN 195 Cb 0.00 1.03 -0.08 0.00 -1.54 0.00 0.00 41.25 40.65 1urf s ASN 195 CO 0.00 -0.01 1.32 0.00 -3.04 0.00 0.00 177.10 175.37 1urf s GLN 196 N 1.15 3.89 0.27 0.43 1.03 -1.26 -4.93 119.66 120.23 1urf s GLN 196 Ca -0.07 2.20 -0.30 0.00 0.04 0.00 0.00 55.36 57.22 1urf s GLN 196 Cb -0.02 -2.71 -0.11 0.00 0.03 0.00 0.00 33.01 30.19 1urf s GLN 196 CO -0.10 -0.58 1.61 0.00 -2.54 0.00 0.00 175.29 173.68 1urf s ALA 197 N -1.26 3.78 -0.29 2.60 0.00 -1.26 -4.99 121.76 120.34 1urf s ALA 197 Ca 0.58 1.55 -0.24 0.00 0.00 0.00 0.00 51.96 53.86 1urf s ALA 197 Cb -0.39 -3.65 0.16 0.00 0.00 0.00 0.00 23.12 19.24 1urf s ALA 197 CO 0.50 -0.95 1.20 0.00 0.00 0.00 0.00 175.76 176.51 1urf s ALA 198 N 0.28 -2.14 -2.00 0.00 0.00 -1.26 -5.32 121.76 111.32 1urf s ALA 198 Ca 0.66 1.84 0.04 0.00 0.00 0.00 0.00 51.96 54.49 1urf s ALA 198 Cb -0.48 -1.63 0.23 0.00 0.00 0.00 0.00 23.12 21.24 1urf s ALA 198 CO 0.44 -0.20 0.71 -0.35 0.00 0.00 0.00 175.76 176.36