#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1urf h ILE 120 N 0.00 1.01 -3.96 -0.61 2.04 -2.06 -3.43 117.51 110.50 1urf h ILE 120 Ca 0.00 -0.03 -0.54 0.00 1.00 0.00 0.00 64.86 65.30 1urf h ILE 120 Cb 0.00 0.95 0.10 0.00 -0.74 0.00 0.00 36.82 37.13 1urf h ILE 120 CO 0.00 0.01 0.71 -2.16 0.00 0.00 0.00 178.15 176.71 1urf s PRO 121 N -6.18 3.94 0.40 2.37 0.04 -1.26 -4.74 135.00 129.58 1urf s PRO 121 Ca -0.13 2.41 0.00 0.00 0.04 0.00 0.00 61.00 63.32 1urf s PRO 121 Cb 0.07 -2.82 0.00 0.00 0.04 0.00 0.00 34.50 31.78 1urf s PRO 121 CO 0.67 -0.60 0.00 0.00 0.04 0.00 0.00 177.00 177.10 1urf n ALA 122 N 0.18 -1.55 -2.88 8.56 0.00 -1.26 -4.93 120.51 118.63 1urf n ALA 122 Ca 0.03 0.33 -0.11 0.00 0.00 0.00 0.00 53.44 53.69 1urf n ALA 122 Cb 0.41 -1.17 0.06 0.00 0.00 0.00 0.00 19.45 18.75 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 -2.05 -4.91 -3.64 0.00 -1.04 -1.26 -4.97 114.28 96.41 1urf n THR 123 Ca 0.00 -0.53 -0.01 0.00 -2.04 0.00 0.00 64.05 61.47 1urf n THR 123 Cb 0.28 -4.60 -0.06 0.00 -1.82 0.00 0.00 70.33 64.12 1urf n THR 123 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 1urf s ASN 124 N -3.71 -0.38 0.00 8.00 4.22 -1.26 -5.04 114.94 116.76 1urf s ASN 124 Ca 0.10 0.61 0.00 0.00 -2.14 0.00 0.00 52.86 51.44 1urf s ASN 124 Cb -0.01 1.16 0.00 0.00 1.28 0.00 0.00 41.25 43.68 1urf s ASN 124 CO 0.50 -0.10 0.00 0.18 -2.04 0.00 0.00 177.10 175.64 1urf n LEU 125 N 3.54 0.00 -0.25 3.54 4.77 -1.26 -4.96 117.00 122.38 1urf n LEU 125 Ca -0.18 0.00 0.16 0.00 -0.03 0.00 0.00 56.01 55.95 1urf n LEU 125 Cb 0.57 0.00 0.45 0.00 -2.33 0.00 0.00 43.42 42.11 1urf n LEU 125 CO 0.03 0.00 1.22 0.77 -1.33 0.00 0.00 177.39 178.08 1urf h SER 126 N 0.00 0.53 -0.18 -1.43 4.64 -2.02 -1.52 113.55 113.58 1urf h SER 126 Ca 0.00 0.04 0.03 0.00 -0.47 0.00 0.00 61.79 61.39 1urf h SER 126 Cb 0.00 -0.06 -0.03 0.00 -0.31 0.00 0.00 62.40 62.01 1urf h SER 126 CO 0.00 0.24 0.01 -0.09 -0.87 0.00 0.00 176.83 176.12 1urf h ARG 127 N 0.54 0.07 0.15 4.77 2.43 -1.99 0.74 114.38 121.09 1urf h ARG 127 Ca 0.46 -0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.62 1urf h ARG 127 Cb 0.94 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.48 1urf h ARG 127 CO -0.20 0.05 -0.07 0.28 -1.51 0.00 0.00 179.97 178.51 1urf h VAL 128 N 0.07 0.97 -0.96 0.20 2.07 -1.67 -2.63 116.25 114.31 1urf h VAL 128 Ca 0.08 -0.58 0.07 0.00 0.82 0.00 0.00 66.70 67.09 1urf h VAL 128 Cb 0.09 1.33 -0.06 0.00 -1.52 0.00 0.00 31.29 31.13 1urf h VAL 128 CO -0.13 0.14 0.62 0.00 0.02 0.00 0.00 177.57 178.21 1urf h ALA 129 N 0.31 1.47 -0.45 1.67 0.00 -1.32 -0.96 119.26 119.98 1urf h ALA 129 Ca -0.02 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 1urf h ALA 129 Cb 0.38 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 1urf h ALA 129 CO 0.03 0.38 0.20 0.78 0.00 0.00 0.00 179.25 180.64 1urf h GLY 130 N 1.09 0.71 0.78 0.00 0.00 -0.80 -1.35 103.07 103.50 1urf h GLY 130 Ca 0.42 -0.37 -0.03 0.00 0.00 0.00 0.00 47.33 47.35 1urf h GLY 130 CO -0.16 0.35 -0.01 1.41 0.00 0.00 0.00 176.54 178.13 1urf h LEU 131 N 0.58 0.26 -0.21 3.11 3.38 -1.04 -2.52 115.31 118.86 1urf h LEU 131 Ca 0.15 -0.32 0.03 0.00 0.09 0.00 0.00 57.88 57.83 1urf h LEU 131 Cb 0.16 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 40.81 1urf h LEU 131 CO -0.02 0.52 0.02 -0.33 0.09 0.00 0.00 178.44 178.73 1urf h GLU 132 N -0.01 0.10 -0.61 1.13 4.39 -1.13 -2.11 114.58 116.34 1urf h GLU 132 Ca 0.04 -0.01 0.01 0.00 0.34 0.00 0.00 59.36 59.74 1urf h GLU 132 Cb 0.39 -0.02 -0.03 0.00 -0.10 0.00 0.00 28.75 28.99 1urf h GLU 132 CO 0.01 0.06 0.41 1.57 -1.16 0.00 0.00 179.01 179.90 1urf h LYS 133 N 0.10 0.80 -0.18 2.33 2.10 -1.26 -2.47 116.57 117.99 1urf h LYS 133 Ca 0.10 -0.05 0.03 0.00 -2.00 0.00 0.00 60.65 58.72 1urf h LYS 133 Cb 0.10 -0.18 -0.03 0.00 -0.90 0.00 0.00 32.23 31.23 1urf h LYS 133 CO -0.14 0.53 0.02 1.96 -2.00 0.00 0.00 179.45 179.82 1urf h GLN 134 N 0.82 0.08 -0.87 0.07 1.08 -0.93 -0.77 115.11 114.60 1urf h GLN 134 Ca 0.22 -0.00 0.03 0.00 -1.45 0.00 0.00 58.65 57.45 1urf h GLN 134 Cb -0.09 -0.02 -0.05 0.00 -0.05 0.00 0.00 27.48 27.27 1urf h GLN 134 CO -0.05 0.05 0.57 -0.07 -0.95 0.00 0.00 178.83 178.39 1urf h LEU 135 N 0.09 0.94 -0.27 1.46 -0.00 -1.13 -1.24 115.31 115.16 1urf h LEU 135 Ca 0.08 -0.01 -0.02 0.00 -0.00 0.00 0.00 57.88 57.93 1urf h LEU 135 Cb 0.09 -0.22 -0.01 0.00 -0.00 0.00 0.00 40.66 40.52 1urf h LEU 135 CO -0.13 0.65 0.08 0.00 -0.00 0.00 0.00 178.44 179.04 1urf h ALA 136 N 1.49 0.35 0.05 1.53 0.00 -1.02 -2.24 119.26 119.42 1urf h ALA 136 Ca 0.34 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 55.10 1urf h ALA 136 Cb -0.00 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.69 1urf h ALA 136 CO -0.10 -0.01 -0.03 0.82 0.00 0.00 0.00 179.25 179.93 1urf h ILE 137 N 0.26 1.13 -0.51 0.00 2.04 -0.76 -2.30 117.51 117.37 1urf h ILE 137 Ca 0.08 -0.60 0.07 0.00 1.00 0.00 0.00 64.86 65.42 1urf h ILE 137 Cb 0.25 1.52 -0.06 0.00 -0.74 0.00 0.00 36.82 37.79 1urf h ILE 137 CO -0.00 0.15 0.18 -0.33 0.00 0.00 0.00 178.15 178.15 1urf h GLU 138 N -0.34 0.35 -0.77 2.37 3.07 -1.27 -0.59 114.58 117.40 1urf h GLU 138 Ca -0.01 -0.02 -0.03 0.00 -0.50 0.00 0.00 59.36 58.80 1urf h GLU 138 Cb 0.30 -0.08 -0.04 0.00 -0.84 0.00 0.00 28.75 28.10 1urf h GLU 138 CO 0.01 0.23 0.38 -0.07 -1.40 0.00 0.00 179.01 178.16 1urf h LEU 139 N 0.36 1.00 -0.47 1.33 3.38 -1.40 -0.57 115.31 118.94 1urf h LEU 139 Ca 0.25 -0.13 -0.02 0.00 0.09 0.00 0.00 57.88 58.07 1urf h LEU 139 Cb 0.27 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 1urf h LEU 139 CO -0.26 0.85 0.23 0.50 0.09 0.00 0.00 178.44 179.86 1urf h LYS 140 N 1.09 0.67 -0.44 1.13 3.64 -0.76 -0.61 116.57 121.28 1urf h LYS 140 Ca 0.27 -0.09 -0.05 0.00 -1.27 0.00 0.00 60.65 59.50 1urf h LYS 140 Cb 0.11 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 31.79 1urf h LYS 140 CO -0.03 0.56 0.09 0.28 -2.27 0.00 0.00 179.45 178.07 1urf h VAL 141 N 0.61 1.24 -0.42 2.00 2.07 -0.85 -0.85 116.25 120.05 1urf h VAL 141 Ca 0.16 -0.86 -0.00 0.00 0.82 0.00 0.00 66.70 66.83 1urf h VAL 141 Cb 0.10 0.95 -0.02 0.00 -1.52 0.00 0.00 31.29 30.80 1urf h VAL 141 CO -0.02 0.30 0.26 0.50 0.02 0.00 0.00 177.57 178.63 1urf h LYS 142 N 0.58 0.56 -0.34 1.57 3.64 -0.90 -0.32 116.57 121.36 1urf h LYS 142 Ca 0.14 -0.05 -0.02 0.00 -1.27 0.00 0.00 60.65 59.45 1urf h LYS 142 Cb 0.35 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 32.04 1urf h LYS 142 CO 0.01 0.41 0.16 0.37 -2.27 0.00 0.00 179.45 178.12 1urf h GLN 143 N 0.56 0.50 -0.76 1.90 5.75 -0.99 -2.04 115.11 120.03 1urf h GLN 143 Ca 0.15 -0.08 0.00 0.00 -0.15 0.00 0.00 58.65 58.57 1urf h GLN 143 Cb -0.02 -0.09 -0.04 0.00 1.07 0.00 0.00 27.48 28.41 1urf h GLN 143 CO -0.03 0.47 0.49 0.78 -2.65 0.00 0.00 178.83 177.89 1urf h GLY 144 N 0.41 1.08 1.12 2.39 0.00 -0.87 -1.54 103.07 105.67 1urf h GLY 144 Ca 0.12 -0.42 -0.06 0.00 0.00 0.00 0.00 47.33 46.96 1urf h GLY 144 CO -0.01 0.41 0.18 0.00 0.00 0.00 0.00 176.54 177.12 1urf h ALA 145 N 1.50 1.01 -0.31 3.60 0.00 -0.74 -2.22 119.26 122.10 1urf h ALA 145 Ca 0.28 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 1urf h ALA 145 Cb -0.09 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.42 1urf h ALA 145 CO -0.06 0.65 0.14 0.93 0.00 0.00 0.00 179.25 180.91 1urf h GLU 146 N 1.04 0.45 -0.97 0.00 5.08 -0.63 -1.91 114.58 117.65 1urf h GLU 146 Ca 0.22 -0.07 0.09 0.00 -1.00 0.00 0.00 59.36 58.60 1urf h GLU 146 Cb 0.34 -0.08 -0.07 0.00 0.50 0.00 0.00 28.75 29.44 1urf h GLU 146 CO -0.00 0.45 0.61 -0.91 -1.00 0.00 0.00 179.01 178.15 1urf h ASN 147 N 0.36 0.93 -0.24 1.42 2.35 -1.04 -1.53 115.58 117.82 1urf h ASN 147 Ca 0.10 0.03 -0.01 0.00 -0.55 0.00 0.00 56.30 55.88 1urf h ASN 147 Cb 0.15 -0.16 -0.01 0.00 0.05 0.00 0.00 38.32 38.35 1urf h ASN 147 CO -0.01 0.54 0.13 0.24 -1.65 0.00 0.00 177.43 176.68 1urf h MET 148 N 1.03 0.34 -0.11 0.81 2.86 -0.97 -0.68 114.93 118.20 1urf h MET 148 Ca 0.45 -0.04 0.03 0.00 -2.06 0.00 0.00 59.70 58.08 1urf h MET 148 Cb 0.33 -0.06 -0.03 0.00 0.06 0.00 0.00 31.60 31.89 1urf h MET 148 CO -0.22 0.32 -0.08 0.82 1.06 0.00 0.00 176.91 178.80 1urf h ILE 149 N 0.27 0.75 -0.88 -1.22 2.04 -0.54 -1.40 117.51 116.52 1urf h ILE 149 Ca 0.08 0.00 0.01 0.00 1.00 0.00 0.00 64.86 65.96 1urf h ILE 149 Cb 0.08 0.75 -0.04 0.00 -0.74 0.00 0.00 36.82 36.87 1urf h ILE 149 CO -0.01 0.00 0.59 1.56 0.00 0.00 0.00 178.15 180.28 1urf h GLN 150 N -0.09 1.15 -0.46 2.37 7.50 -1.19 -0.93 115.11 123.45 1urf h GLN 150 Ca 0.07 -0.07 0.03 0.00 0.50 0.00 0.00 58.65 59.18 1urf h GLN 150 Cb 0.20 -0.26 -0.03 0.00 0.05 0.00 0.00 27.48 27.44 1urf h GLN 150 CO -0.17 0.76 0.25 1.15 -1.50 0.00 0.00 178.83 179.32 1urf h THR 151 N 1.19 1.01 -0.26 -0.54 2.02 -0.30 -2.49 112.91 113.54 1urf h THR 151 Ca 0.33 -0.17 -0.14 0.00 0.77 0.00 0.00 66.41 67.19 1urf h THR 151 Cb -0.12 0.46 -0.01 0.00 -1.74 0.00 0.00 68.15 66.74 1urf h THR 151 CO -0.07 0.09 -0.42 1.88 0.37 0.00 0.00 175.52 177.37 1urf h TYR 152 N 0.51 0.76 -0.43 3.16 -1.99 -0.79 -3.20 116.97 114.99 1urf h TYR 152 Ca 0.19 -0.23 0.08 0.00 2.00 0.00 0.00 58.73 60.78 1urf h TYR 152 Cb 0.06 -0.16 -0.08 0.00 2.00 0.00 0.00 36.73 38.55 1urf h TYR 152 CO -0.08 0.95 -0.07 1.03 -0.00 0.00 0.00 178.16 179.99 1urf h SER 153 N 0.52 -0.32 -3.63 3.88 0.87 -0.74 -3.24 113.55 110.90 1urf h SER 153 Ca 0.04 0.12 -0.52 0.00 -1.23 0.00 0.00 61.79 60.20 1urf h SER 153 Cb 0.95 0.23 0.03 0.00 -0.44 0.00 0.00 62.40 63.17 1urf h SER 153 CO 0.09 -0.11 0.57 0.20 -0.53 0.00 0.00 176.83 177.05 1urf s ASN 154 N -5.23 7.03 -0.36 6.23 0.01 -1.06 -4.90 114.94 116.65 1urf s ASN 154 Ca -0.14 2.37 -0.27 0.00 -0.71 0.00 0.00 52.86 54.11 1urf s ASN 154 Cb 0.15 -2.62 -0.07 0.00 0.41 0.00 0.00 41.25 39.12 1urf s ASN 154 CO 0.71 -0.38 2.32 0.61 -1.51 0.00 0.00 177.10 178.86 1urf n GLY 155 N 1.69 0.58 0.00 0.66 0.00 -1.26 -3.73 105.19 103.13 1urf n GLY 155 Ca 0.02 0.73 0.00 0.00 0.00 0.00 0.00 46.02 46.78 1urf n GLY 155 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1urf n SER 156 N 13.61 0.00 -2.70 1.61 2.88 -1.26 -4.99 113.62 122.77 1urf n SER 156 Ca 0.34 0.00 -0.06 0.00 -1.33 0.00 0.00 58.87 57.82 1urf n SER 156 Cb 0.48 0.00 0.07 0.00 -0.75 0.00 0.00 64.21 64.01 1urf n SER 156 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 1urf n THR 157 N 0.00 0.63 -0.92 2.46 -2.24 -1.24 -4.99 114.28 107.98 1urf n THR 157 Ca 0.00 -2.34 -0.11 0.00 -2.27 0.00 0.00 64.05 59.32 1urf n THR 157 Cb 0.00 0.91 -0.15 0.00 -2.10 0.00 0.00 70.33 68.99 1urf n THR 157 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 1urf n LYS 158 N -0.48 1.86 -1.84 -0.78 4.81 -1.22 -4.21 118.16 116.30 1urf n LYS 158 Ca 0.02 -0.93 -0.42 0.00 -0.87 0.00 0.00 58.31 56.11 1urf n LYS 158 Cb 0.83 -1.97 -0.02 0.00 0.02 0.00 0.00 35.03 33.89 1urf n LYS 158 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 1urf s ASP 159 N 2.09 6.47 -0.05 3.14 1.11 -1.26 -4.94 116.67 123.22 1urf s ASP 159 Ca 0.62 2.81 -0.20 0.00 0.18 0.00 0.00 52.55 55.96 1urf s ASP 159 Cb 0.29 -2.62 -0.15 0.00 1.07 0.00 0.00 42.92 41.52 1urf s ASP 159 CO -0.00 -0.87 0.83 -0.09 1.18 0.00 0.00 175.17 176.22 1urf h ARG 160 N 5.75 -0.22 -0.11 8.23 9.65 -1.99 -2.47 114.38 133.22 1urf h ARG 160 Ca -0.45 0.02 -0.01 0.00 -1.10 0.00 0.00 59.98 58.44 1urf h ARG 160 Cb 1.21 0.05 -0.00 0.00 -1.39 0.00 0.00 29.97 29.84 1urf h ARG 160 CO 0.86 0.19 0.03 1.57 2.80 0.00 0.00 179.97 185.41 1urf h LYS 161 N -0.88 0.17 -0.94 0.20 2.10 -2.00 -2.60 116.57 112.62 1urf h LYS 161 Ca -0.02 -0.04 0.03 0.00 -2.00 0.00 0.00 60.65 58.62 1urf h LYS 161 Cb 0.51 -0.02 -0.05 0.00 -0.90 0.00 0.00 32.23 31.77 1urf h LYS 161 CO 0.04 0.33 0.61 -0.07 -2.00 0.00 0.00 179.45 178.36 1urf h LEU 162 N -0.02 1.04 -0.70 7.07 3.38 -1.98 -2.17 115.31 121.92 1urf h LEU 162 Ca 0.03 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.99 1urf h LEU 162 Cb 0.23 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.70 1urf h LEU 162 CO -0.00 0.72 0.44 0.25 0.09 0.00 0.00 178.44 179.94 1urf h LEU 163 N 1.21 0.83 -0.91 1.67 5.85 -1.33 -1.86 115.31 120.76 1urf h LEU 163 Ca 0.36 -0.05 0.10 0.00 0.84 0.00 0.00 57.88 59.13 1urf h LEU 163 Cb -0.05 -0.21 -0.08 0.00 0.37 0.00 0.00 40.66 40.70 1urf h LEU 163 CO -0.11 0.63 0.55 -0.07 -0.34 0.00 0.00 178.44 179.11 1urf h LEU 164 N 0.96 0.82 -0.49 2.25 3.38 -1.00 0.12 115.31 121.34 1urf h LEU 164 Ca 0.25 0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.27 1urf h LEU 164 Cb -0.06 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.55 1urf h LEU 164 CO -0.05 0.46 0.31 0.74 0.09 0.00 0.00 178.44 180.00 1urf h THR 165 N 0.92 1.14 -0.26 0.22 2.02 -1.02 -1.48 112.91 114.45 1urf h THR 165 Ca 0.44 -0.28 -0.05 0.00 0.77 0.00 0.00 66.41 67.29 1urf h THR 165 Cb 0.37 0.44 -0.01 0.00 -1.74 0.00 0.00 68.15 67.22 1urf h THR 165 CO -0.24 0.14 -0.03 0.00 0.37 0.00 0.00 175.52 175.76 1urf h ALA 166 N 1.16 0.36 -0.65 6.16 0.00 -0.72 -2.21 119.26 123.36 1urf h ALA 166 Ca 0.18 -0.25 0.07 0.00 0.00 0.00 0.00 54.91 54.91 1urf h ALA 166 Cb -0.05 -0.10 -0.06 0.00 0.00 0.00 0.00 17.79 17.59 1urf h ALA 166 CO -0.04 0.13 0.34 1.96 0.00 0.00 0.00 179.25 181.64 1urf h GLN 167 N 0.25 0.61 -0.69 0.00 4.20 -0.64 -0.55 115.11 118.28 1urf h GLN 167 Ca 0.07 -0.04 -0.03 0.00 0.06 0.00 0.00 58.65 58.71 1urf h GLN 167 Cb 0.47 -0.14 -0.03 0.00 0.30 0.00 0.00 27.48 28.08 1urf h GLN 167 CO 0.02 0.40 0.31 1.96 -0.67 0.00 0.00 178.83 180.85 1urf h GLN 168 N 0.62 0.99 -0.34 1.46 1.08 -1.19 -2.32 115.11 115.42 1urf h GLN 168 Ca 0.30 -0.15 -0.01 0.00 -1.45 0.00 0.00 58.65 57.34 1urf h GLN 168 Cb 0.23 -0.18 -0.02 0.00 -0.05 0.00 0.00 27.48 27.47 1urf h GLN 168 CO -0.21 0.79 0.16 0.52 -0.95 0.00 0.00 178.83 179.14 1urf h MET 169 N 0.99 0.48 -0.36 1.46 2.86 -0.51 0.38 114.93 120.23 1urf h MET 169 Ca 0.24 -0.07 0.02 0.00 -2.06 0.00 0.00 59.70 57.82 1urf h MET 169 Cb 0.14 -0.09 -0.02 0.00 0.06 0.00 0.00 31.60 31.68 1urf h MET 169 CO -0.03 0.44 0.21 1.25 1.06 0.00 0.00 176.91 179.84 1urf h LEU 170 N 0.41 0.33 -0.41 1.22 7.12 -0.87 -0.05 115.31 123.06 1urf h LEU 170 Ca 0.12 0.01 -0.07 0.00 0.13 0.00 0.00 57.88 58.06 1urf h LEU 170 Cb 0.12 -0.06 -0.01 0.00 -0.53 0.00 0.00 40.66 40.17 1urf h LEU 170 CO -0.01 0.24 -0.02 -0.61 -0.13 0.00 0.00 178.44 177.90 1urf h GLN 171 N 0.42 0.74 -0.47 1.25 5.75 -1.28 -2.70 115.11 118.82 1urf h GLN 171 Ca 0.14 -0.25 -0.00 0.00 -0.15 0.00 0.00 58.65 58.39 1urf h GLN 171 Cb 0.01 -0.06 -0.02 0.00 1.07 0.00 0.00 27.48 28.48 1urf h GLN 171 CO -0.07 0.83 0.28 0.22 -2.65 0.00 0.00 178.83 177.44 1urf h ASP 172 N 0.56 0.56 -0.51 -0.69 3.58 -0.65 -2.44 116.42 116.84 1urf h ASP 172 Ca 0.11 -0.06 0.03 0.00 0.42 0.00 0.00 57.03 57.53 1urf h ASP 172 Cb 0.52 -0.14 -0.04 0.00 1.72 0.00 0.00 39.33 41.39 1urf h ASP 172 CO 0.03 0.46 0.30 0.77 -2.88 0.00 0.00 179.24 177.92 1urf h SER 173 N 0.62 0.48 -0.78 2.28 4.64 -0.95 -2.00 113.55 117.84 1urf h SER 173 Ca 0.17 0.01 0.06 0.00 -0.47 0.00 0.00 61.79 61.55 1urf h SER 173 Cb 0.00 -0.09 -0.06 0.00 -0.31 0.00 0.00 62.40 61.94 1urf h SER 173 CO -0.03 0.33 0.47 0.11 -0.87 0.00 0.00 176.83 176.84 1urf h LYS 174 N 0.59 0.84 -0.58 4.77 1.57 -1.22 -1.10 116.57 121.44 1urf h LYS 174 Ca 0.21 -0.05 0.01 0.00 -1.87 0.00 0.00 60.65 58.95 1urf h LYS 174 Cb 0.04 -0.19 -0.03 0.00 0.08 0.00 0.00 32.23 32.13 1urf h LYS 174 CO -0.10 0.55 0.37 1.15 -0.57 0.00 0.00 179.45 180.85 1urf h THR 175 N 0.86 1.12 -0.76 -0.16 2.02 -0.92 -2.00 112.91 113.08 1urf h THR 175 Ca 0.34 -0.26 -0.01 0.00 0.77 0.00 0.00 66.41 67.25 1urf h THR 175 Cb 0.16 0.30 -0.04 0.00 -1.74 0.00 0.00 68.15 66.83 1urf h THR 175 CO -0.17 0.14 0.45 0.11 0.37 0.00 0.00 175.52 176.42 1urf h LYS 176 N 0.76 1.04 -0.91 6.66 1.57 -0.65 -2.36 116.57 122.67 1urf h LYS 176 Ca 0.22 -0.10 0.04 0.00 -1.87 0.00 0.00 60.65 58.93 1urf h LYS 176 Cb -0.05 -0.21 -0.05 0.00 0.08 0.00 0.00 32.23 31.99 1urf h LYS 176 CO -0.06 0.75 0.59 0.82 -0.57 0.00 0.00 179.45 180.97 1urf h ILE 177 N 1.04 1.14 -0.38 1.86 2.04 -0.66 -1.23 117.51 121.31 1urf h ILE 177 Ca 0.27 -0.39 0.00 0.00 1.00 0.00 0.00 64.86 65.74 1urf h ILE 177 Cb -0.02 -0.10 -0.02 0.00 -0.74 0.00 0.00 36.82 35.95 1urf h ILE 177 CO -0.05 0.21 0.24 -0.78 0.00 0.00 0.00 178.15 177.77 1urf h ASP 178 N 1.14 0.45 -0.38 1.72 3.58 -0.87 -0.04 116.42 122.02 1urf h ASP 178 Ca 0.37 -0.03 0.00 0.00 0.42 0.00 0.00 57.03 57.79 1urf h ASP 178 Cb 0.02 -0.11 -0.02 0.00 1.72 0.00 0.00 39.33 40.94 1urf h ASP 178 CO -0.13 0.35 0.25 0.40 -2.88 0.00 0.00 179.24 177.24 1urf h ILE 179 N 0.51 1.10 -0.95 2.25 2.04 -1.05 -2.18 117.51 119.24 1urf h ILE 179 Ca 0.14 -0.19 0.03 0.00 1.00 0.00 0.00 64.86 65.83 1urf h ILE 179 Cb -0.03 0.54 -0.05 0.00 -0.74 0.00 0.00 36.82 36.54 1urf h ILE 179 CO -0.03 0.10 0.62 0.40 0.00 0.00 0.00 178.15 179.24 1urf h ILE 180 N 0.52 1.19 -0.81 -0.67 2.04 -0.91 -1.83 117.51 117.04 1urf h ILE 180 Ca 0.14 -0.42 0.09 0.00 1.00 0.00 0.00 64.86 65.67 1urf h ILE 180 Cb -0.05 -0.15 -0.07 0.00 -0.74 0.00 0.00 36.82 35.81 1urf h ILE 180 CO -0.03 0.22 0.46 -0.09 0.00 0.00 0.00 178.15 178.72 1urf h ARG 181 N 1.23 0.76 -0.86 2.37 2.43 -0.39 -0.52 114.38 119.39 1urf h ARG 181 Ca 0.37 -0.05 -0.02 0.00 -0.81 0.00 0.00 59.98 59.47 1urf h ARG 181 Cb -0.05 -0.17 -0.04 0.00 -0.42 0.00 0.00 29.97 29.29 1urf h ARG 181 CO -0.10 0.50 0.46 0.52 -1.51 0.00 0.00 179.97 179.83 1urf h MET 182 N 0.78 1.20 -0.61 0.20 2.86 -0.90 -1.67 114.93 116.79 1urf h MET 182 Ca 0.39 -0.15 -0.06 0.00 -2.06 0.00 0.00 59.70 57.83 1urf h MET 182 Cb 0.35 -0.23 -0.03 0.00 0.06 0.00 0.00 31.60 31.76 1urf h MET 182 CO -0.24 0.89 0.16 1.96 1.06 0.00 0.00 176.91 180.74 1urf h GLN 183 N 1.20 0.97 0.08 1.72 1.08 -0.80 -2.29 115.11 117.07 1urf h GLN 183 Ca 0.30 -0.23 -0.00 0.00 -1.45 0.00 0.00 58.65 57.27 1urf h GLN 183 Cb 0.05 -0.13 0.00 0.00 -0.05 0.00 0.00 27.48 27.35 1urf h GLN 183 CO -0.05 0.88 -0.04 -0.07 -0.95 0.00 0.00 178.83 178.60 1urf h LEU 184 N 0.88 -0.09 -0.58 1.46 -0.00 -0.80 -1.00 115.31 115.19 1urf h LEU 184 Ca 0.19 -0.20 0.04 0.00 -0.00 0.00 0.00 57.88 57.92 1urf h LEU 184 Cb 0.34 0.02 -0.04 0.00 -0.00 0.00 0.00 40.66 40.98 1urf h LEU 184 CO -0.00 0.15 0.33 0.08 -0.00 0.00 0.00 178.44 179.00 1urf h ARG 185 N -0.32 0.62 -0.62 1.13 0.11 -1.30 -0.48 114.38 113.52 1urf h ARG 185 Ca -0.01 -0.04 -0.06 0.00 0.10 0.00 0.00 59.98 59.97 1urf h ARG 185 Cb 0.28 -0.14 -0.03 0.00 1.11 0.00 0.00 29.97 31.19 1urf h ARG 185 CO 0.02 0.41 0.16 0.00 0.10 0.00 0.00 179.97 180.66 1urf h ARG 186 N 0.64 0.99 -0.42 0.08 3.08 -1.38 -2.02 114.38 115.35 1urf h ARG 186 Ca 0.25 -0.23 -0.01 0.00 0.07 0.00 0.00 59.98 60.05 1urf h ARG 186 Cb 0.09 -0.13 -0.02 0.00 0.08 0.00 0.00 29.97 29.99 1urf h ARG 186 CO -0.13 0.89 0.22 0.00 -1.07 0.00 0.00 179.97 179.88 1urf h ALA 187 N 1.05 0.55 -0.43 0.04 0.00 -0.65 -2.29 119.26 117.53 1urf h ALA 187 Ca 0.20 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1urf h ALA 187 Cb 0.34 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 1urf h ALA 187 CO -0.00 0.09 0.27 -0.07 0.00 0.00 0.00 179.25 179.54 1urf h LEU 188 N 0.55 0.51 -1.18 0.00 3.38 -0.95 -2.36 115.31 115.26 1urf h LEU 188 Ca 0.15 -0.04 0.07 0.00 0.09 0.00 0.00 57.88 58.15 1urf h LEU 188 Cb 0.08 -0.13 -0.06 0.00 0.09 0.00 0.00 40.66 40.65 1urf h LEU 188 CO -0.02 0.39 0.57 1.56 0.09 0.00 0.00 178.44 181.04 1urf h GLN 189 N 0.58 0.96 -0.24 1.13 1.08 -1.16 -1.02 115.11 116.43 1urf h GLN 189 Ca 0.16 -0.06 -0.01 0.00 -1.45 0.00 0.00 58.65 57.29 1urf h GLN 189 Cb -0.03 -0.22 -0.01 0.00 -0.05 0.00 0.00 27.48 27.17 1urf h GLN 189 CO -0.03 0.63 0.12 0.00 -0.95 0.00 0.00 178.83 178.60 1urf h ALA 190 N 1.52 0.31 0.17 3.87 0.00 -0.90 -3.20 119.26 121.03 1urf h ALA 190 Ca 0.38 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 55.19 1urf h ALA 190 Cb 0.21 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.91 1urf h ALA 190 CO -0.14 -0.13 -0.08 -0.44 0.00 0.00 0.00 179.25 178.46 1urf h ASP 191 N 0.26 -0.19 -3.42 0.00 5.19 -1.09 -3.43 116.42 113.75 1urf h ASP 191 Ca 0.08 -0.19 -0.52 0.00 -0.62 0.00 0.00 57.03 55.78 1urf h ASP 191 Cb 0.11 0.05 0.03 0.00 0.18 0.00 0.00 39.33 39.70 1urf h ASP 191 CO -0.01 0.09 0.62 0.00 -3.12 0.00 0.00 179.24 176.82 1urf s GLN 192 N -5.10 4.42 -0.30 3.56 -2.07 -0.44 -5.00 119.66 114.74 1urf s GLN 192 Ca -0.15 1.99 -0.16 0.00 -1.82 0.00 0.00 55.36 55.22 1urf s GLN 192 Cb 0.03 -3.21 0.19 0.00 -1.09 0.00 0.00 33.01 28.93 1urf s GLN 192 CO 0.62 -0.20 1.18 -1.17 -1.32 0.00 0.00 175.29 174.40 1urf s LEU 193 N -0.15 -0.19 -0.29 2.60 1.98 -1.26 -4.80 118.68 116.57 1urf s LEU 193 Ca 0.55 0.31 -0.20 0.00 -2.89 0.00 0.00 54.13 51.90 1urf s LEU 193 Cb -0.35 1.28 0.17 0.00 0.66 0.00 0.00 46.19 47.95 1urf s LEU 193 CO 0.38 -0.05 1.19 -0.70 -1.89 0.00 0.00 176.35 175.28 1urf s GLU 194 N 1.16 0.22 0.28 1.98 2.56 -1.26 -5.14 118.70 118.50 1urf s GLU 194 Ca -0.08 0.32 0.00 0.00 0.00 0.00 0.00 54.97 55.21 1urf s GLU 194 Cb -0.03 0.08 0.00 0.00 2.00 0.00 0.00 34.13 36.18 1urf s GLU 194 CO -0.11 -0.04 0.00 -1.71 -0.56 0.00 0.00 175.26 172.84 1urf n ASN 195 N 2.68 -8.26 -4.73 -1.70 4.05 -1.26 -4.86 115.26 101.19 1urf n ASN 195 Ca -0.15 1.16 -0.42 0.00 0.45 0.00 0.00 54.58 55.63 1urf n ASN 195 Cb 0.57 -4.29 -0.03 0.00 1.23 0.00 0.00 39.78 37.26 1urf n ASN 195 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1urf s GLN 196 N -1.92 4.32 0.34 1.20 -2.07 -1.26 -4.96 119.66 115.31 1urf s GLN 196 Ca 0.00 2.13 -0.29 0.00 -1.82 0.00 0.00 55.36 55.38 1urf s GLN 196 Cb 0.00 -3.20 -0.11 0.00 -1.09 0.00 0.00 33.01 28.61 1urf s GLN 196 CO 0.00 -0.40 1.39 0.00 -1.32 0.00 0.00 175.29 174.96 1urf s ALA 197 N 0.68 3.54 -0.92 2.60 0.00 -1.26 -3.66 121.76 122.74 1urf s ALA 197 Ca 0.62 1.39 -0.04 0.00 0.00 0.00 0.00 51.96 53.93 1urf s ALA 197 Cb -0.38 -3.54 -0.05 0.00 0.00 0.00 0.00 23.12 19.15 1urf s ALA 197 CO 0.34 -0.81 0.82 0.00 0.00 0.00 0.00 175.76 176.11 1urf n ALA 198 N 0.85 -2.40 0.00 0.00 0.00 -1.26 -5.29 120.51 112.40 1urf n ALA 198 Ca 0.01 0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.55 1urf n ALA 198 Cb 0.41 -4.52 0.00 0.00 0.00 0.00 0.00 19.45 15.34 1urf n ALA 198 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15