#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 1.10 -3.32 -0.61 5.03 -2.10 -3.43 117.51 114.18 1urf h ILE 120 Ca 0.00 -0.45 -0.53 0.00 -0.12 0.00 0.00 64.86 63.76 1urf h ILE 120 Cb 0.00 1.40 0.06 0.00 -3.03 0.00 0.00 36.82 35.24 1urf h ILE 120 CO 0.00 0.12 0.77 -2.16 -0.68 0.00 0.00 178.15 176.20 1urf s PRO 121 N -5.38 4.26 0.00 2.37 0.04 -1.26 -4.69 135.00 130.34 1urf s PRO 121 Ca -0.14 2.31 0.00 0.00 0.04 0.00 0.00 61.00 63.20 1urf s PRO 121 Cb 0.04 -3.12 0.00 0.00 0.04 0.00 0.00 34.50 31.47 1urf s PRO 121 CO 0.66 -0.44 0.00 0.00 0.04 0.00 0.00 177.00 177.25 1urf n ALA 122 N 2.53 0.00 0.00 8.56 0.00 -1.26 -4.98 120.51 125.35 1urf n ALA 122 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.52 1urf n ALA 122 Cb 0.40 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.85 1urf n ALA 122 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1urf n THR 123 N -0.76 0.00 -0.35 0.00 -2.24 -1.26 -4.87 114.28 104.81 1urf n THR 123 Ca 0.00 0.00 0.16 0.00 -2.27 0.00 0.00 64.05 61.94 1urf n THR 123 Cb 0.00 0.00 0.36 0.00 -2.10 0.00 0.00 70.33 68.59 1urf n THR 123 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1urf h ASN 124 N 0.00 0.70 -0.72 3.42 -1.07 -1.94 0.80 115.58 116.79 1urf h ASN 124 Ca 0.00 0.13 0.05 0.00 0.07 0.00 0.00 56.30 56.55 1urf h ASN 124 Cb 0.00 0.01 -0.05 0.00 -2.07 0.00 0.00 38.32 36.21 1urf h ASN 124 CO 0.00 0.15 0.42 -0.07 0.07 0.00 0.00 177.43 178.01 1urf h LEU 125 N 0.63 0.65 -0.99 6.14 3.38 -1.97 -1.62 115.31 121.53 1urf h LEU 125 Ca 0.62 0.02 0.04 0.00 0.09 0.00 0.00 57.88 58.66 1urf h LEU 125 Cb 1.12 -0.12 -0.06 0.00 0.09 0.00 0.00 40.66 41.70 1urf h LEU 125 CO -0.45 0.43 0.65 -1.28 0.09 0.00 0.00 178.44 177.88 1urf h SER 126 N 0.79 1.07 -0.59 -0.43 0.87 -1.20 -2.08 113.55 111.98 1urf h SER 126 Ca 0.31 -0.00 0.02 0.00 -1.23 0.00 0.00 61.79 60.89 1urf h SER 126 Cb 0.14 -0.24 -0.04 0.00 -0.44 0.00 0.00 62.40 61.83 1urf h SER 126 CO -0.16 0.72 0.37 -0.09 -0.53 0.00 0.00 176.83 177.14 1urf h ARG 127 N 1.23 0.72 0.07 2.24 2.43 -1.06 -0.74 114.38 119.26 1urf h ARG 127 Ca 0.40 -0.04 -0.00 0.00 -0.81 0.00 0.00 59.98 59.53 1urf h ARG 127 Cb 0.05 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 29.43 1urf h ARG 127 CO -0.14 0.48 -0.03 0.28 -1.51 0.00 0.00 179.97 179.05 1urf h VAL 128 N 0.74 0.94 -0.85 0.20 2.07 -1.01 -1.79 116.25 116.55 1urf h VAL 128 Ca 0.23 -0.01 -0.01 0.00 0.82 0.00 0.00 66.70 67.73 1urf h VAL 128 Cb -0.02 0.94 -0.04 0.00 -1.52 0.00 0.00 31.29 30.66 1urf h VAL 128 CO -0.08 0.00 0.49 0.00 0.02 0.00 0.00 177.57 178.00 1urf h ALA 129 N 0.84 1.08 -0.84 1.67 0.00 -1.26 -1.74 119.26 119.02 1urf h ALA 129 Ca -0.01 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 54.78 1urf h ALA 129 Cb 0.07 -0.34 -0.04 0.00 0.00 0.00 0.00 17.79 17.48 1urf h ALA 129 CO 0.02 0.57 0.51 0.78 0.00 0.00 0.00 179.25 181.12 1urf h GLY 130 N 1.17 1.21 0.89 0.00 0.00 -0.91 -0.81 103.07 104.63 1urf h GLY 130 Ca 0.30 -0.50 -0.07 0.00 0.00 0.00 0.00 47.33 47.06 1urf h GLY 130 CO -0.05 0.49 -0.10 1.41 0.00 0.00 0.00 176.54 178.29 1urf h LEU 131 N 1.15 0.58 -0.20 3.11 3.38 -0.97 -2.52 115.31 119.85 1urf h LEU 131 Ca 0.30 -0.38 -0.01 0.00 0.09 0.00 0.00 57.88 57.88 1urf h LEU 131 Cb -0.05 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.53 1urf h LEU 131 CO -0.06 0.83 0.09 -0.33 0.09 0.00 0.00 178.44 179.06 1urf h GLU 132 N 0.33 0.29 -0.71 1.13 4.39 -1.10 -2.44 114.58 116.47 1urf h GLU 132 Ca 0.07 -0.05 -0.00 0.00 0.34 0.00 0.00 59.36 59.72 1urf h GLU 132 Cb 0.59 -0.05 -0.03 0.00 -0.10 0.00 0.00 28.75 29.16 1urf h GLU 132 CO 0.03 0.34 0.44 1.57 -1.16 0.00 0.00 179.01 180.23 1urf h LYS 133 N 0.18 0.96 0.15 2.33 2.10 -1.18 -2.63 116.57 118.48 1urf h LYS 133 Ca 0.07 -0.08 -0.00 0.00 -2.00 0.00 0.00 60.65 58.64 1urf h LYS 133 Cb 0.15 -0.21 -0.01 0.00 -0.90 0.00 0.00 32.23 31.27 1urf h LYS 133 CO -0.01 0.67 -0.11 1.96 -2.00 0.00 0.00 179.45 179.96 1urf h GLN 134 N 0.97 -0.26 -0.82 0.07 1.08 -1.34 -2.52 115.11 112.29 1urf h GLN 134 Ca 0.26 0.02 0.14 0.00 -1.45 0.00 0.00 58.65 57.62 1urf h GLN 134 Cb -0.05 0.06 -0.09 0.00 -0.05 0.00 0.00 27.48 27.34 1urf h GLN 134 CO -0.05 -0.17 0.40 1.25 -0.95 0.00 0.00 178.83 179.31 1urf h LEU 135 N -0.27 0.46 -0.91 1.46 5.85 -1.29 -0.37 115.31 120.24 1urf h LEU 135 Ca -0.01 0.09 0.03 0.00 0.84 0.00 0.00 57.88 58.84 1urf h LEU 135 Cb 0.24 0.03 -0.05 0.00 0.37 0.00 0.00 40.66 41.24 1urf h LEU 135 CO -0.01 0.19 0.60 0.00 -0.34 0.00 0.00 178.44 178.88 1urf h ALA 136 N 1.55 1.20 0.14 1.25 0.00 -1.14 -2.03 119.26 120.22 1urf h ALA 136 Ca 0.44 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.30 1urf h ALA 136 Cb 0.63 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 18.09 1urf h ALA 136 CO -0.37 0.48 -0.07 0.82 0.00 0.00 0.00 179.25 180.12 1urf h ILE 137 N 1.17 0.86 -0.73 0.00 2.04 -0.66 -2.58 117.51 117.63 1urf h ILE 137 Ca 0.36 -0.01 -0.00 0.00 1.00 0.00 0.00 64.86 66.21 1urf h ILE 137 Cb -0.03 0.87 -0.04 0.00 -0.74 0.00 0.00 36.82 36.88 1urf h ILE 137 CO -0.11 0.00 0.45 -0.33 0.00 0.00 0.00 178.15 178.16 1urf h GLU 138 N -0.19 0.97 -0.52 2.37 3.07 -1.25 -1.71 114.58 117.33 1urf h GLU 138 Ca -0.02 -0.08 0.01 0.00 -0.50 0.00 0.00 59.36 58.77 1urf h GLU 138 Cb 0.15 -0.21 -0.03 0.00 -0.84 0.00 0.00 28.75 27.82 1urf h GLU 138 CO 0.03 0.67 0.34 -0.07 -1.40 0.00 0.00 179.01 178.58 1urf h LEU 139 N 0.99 0.57 -0.16 1.33 3.38 -1.13 0.18 115.31 120.48 1urf h LEU 139 Ca 0.26 -0.01 -0.04 0.00 0.09 0.00 0.00 57.88 58.18 1urf h LEU 139 Cb -0.06 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 40.55 1urf h LEU 139 CO -0.05 0.41 -0.06 0.11 0.09 0.00 0.00 178.44 178.94 1urf h LYS 140 N 0.68 0.32 -0.27 1.13 1.57 -1.09 -1.41 116.57 117.50 1urf h LYS 140 Ca 0.19 -0.13 -0.01 0.00 -1.87 0.00 0.00 60.65 58.83 1urf h LYS 140 Cb -0.06 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.23 1urf h LYS 140 CO -0.05 0.62 0.12 0.28 -0.57 0.00 0.00 179.45 179.84 1urf h VAL 141 N 0.01 1.17 -0.35 0.50 2.07 -1.16 -0.90 116.25 117.58 1urf h VAL 141 Ca 0.04 -0.50 -0.02 0.00 0.82 0.00 0.00 66.70 67.04 1urf h VAL 141 Cb 0.51 0.99 -0.02 0.00 -1.52 0.00 0.00 31.29 31.26 1urf h VAL 141 CO 0.02 0.17 0.16 0.50 0.02 0.00 0.00 177.57 178.44 1urf h LYS 142 N 0.30 0.51 -0.40 1.57 3.64 -0.68 -0.56 116.57 120.95 1urf h LYS 142 Ca 0.09 -0.08 -0.00 0.00 -1.27 0.00 0.00 60.65 59.39 1urf h LYS 142 Cb 0.16 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 31.88 1urf h LYS 142 CO -0.01 0.48 0.25 0.37 -2.27 0.00 0.00 179.45 178.27 1urf h GLN 143 N 0.43 0.54 -0.71 1.90 4.15 -1.16 -0.73 115.11 119.52 1urf h GLN 143 Ca 0.12 -0.04 -0.07 0.00 0.77 0.00 0.00 58.65 59.42 1urf h GLN 143 Cb 0.14 -0.11 -0.03 0.00 0.21 0.00 0.00 27.48 27.69 1urf h GLN 143 CO -0.01 0.39 0.17 0.78 -1.93 0.00 0.00 178.83 178.22 1urf h GLY 144 N 0.53 1.23 1.00 2.39 0.00 -1.00 -1.33 103.07 105.89 1urf h GLY 144 Ca 0.14 -0.78 -0.07 0.00 0.00 0.00 0.00 47.33 46.63 1urf h GLY 144 CO -0.03 0.73 0.06 0.00 0.00 0.00 0.00 176.54 177.30 1urf h ALA 145 N 1.09 0.69 -0.73 3.60 0.00 -0.85 -2.64 119.26 120.41 1urf h ALA 145 Ca 0.22 -0.25 -0.05 0.00 0.00 0.00 0.00 54.91 54.83 1urf h ALA 145 Cb 0.38 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 1urf h ALA 145 CO 0.00 0.45 0.27 0.93 0.00 0.00 0.00 179.25 180.90 1urf h GLU 146 N 0.75 1.12 -0.58 0.00 5.08 -0.95 -1.06 114.58 118.93 1urf h GLU 146 Ca 0.16 -0.22 0.06 0.00 -1.00 0.00 0.00 59.36 58.35 1urf h GLU 146 Cb 0.43 -0.17 -0.05 0.00 0.50 0.00 0.00 28.75 29.46 1urf h GLU 146 CO 0.01 0.93 0.30 -0.97 -1.00 0.00 0.00 179.01 178.29 1urf h ASN 147 N 1.07 0.43 -0.40 1.42 -0.00 -1.02 -0.62 115.58 116.45 1urf h ASN 147 Ca 0.24 0.03 -0.10 0.00 -0.00 0.00 0.00 56.30 56.47 1urf h ASN 147 Cb 0.25 -0.05 -0.01 0.00 -0.00 0.00 0.00 38.32 38.52 1urf h ASN 147 CO -0.01 0.28 -0.15 0.24 -0.00 0.00 0.00 177.43 177.79 1urf h MET 148 N 0.57 0.81 -0.61 6.67 2.86 -1.17 -2.59 114.93 121.47 1urf h MET 148 Ca 0.26 -0.34 0.03 0.00 -2.06 0.00 0.00 59.70 57.60 1urf h MET 148 Cb 0.18 -0.03 -0.04 0.00 0.06 0.00 0.00 31.60 31.77 1urf h MET 148 CO -0.18 0.96 0.37 0.82 1.06 0.00 0.00 176.91 179.94 1urf h ILE 149 N 0.63 1.06 -0.27 -1.22 2.04 -0.59 -0.24 117.51 118.91 1urf h ILE 149 Ca 0.10 -0.25 -0.02 0.00 1.00 0.00 0.00 64.86 65.68 1urf h ILE 149 Cb 0.69 0.27 -0.01 0.00 -0.74 0.00 0.00 36.82 37.03 1urf h ILE 149 CO 0.05 0.13 0.07 1.56 0.00 0.00 0.00 178.15 179.96 1urf h GLN 150 N 0.72 0.42 0.06 2.37 4.20 -1.09 -0.28 115.11 121.52 1urf h GLN 150 Ca 0.25 -0.10 -0.00 0.00 0.06 0.00 0.00 58.65 58.86 1urf h GLN 150 Cb 0.04 -0.06 0.00 0.00 0.30 0.00 0.00 27.48 27.77 1urf h GLN 150 CO -0.11 0.51 -0.03 1.15 -0.67 0.00 0.00 178.83 179.67 1urf h THR 151 N 0.27 1.04 -0.44 -0.54 2.02 -1.18 -2.12 112.91 111.95 1urf h THR 151 Ca 0.09 -0.32 -0.05 0.00 0.77 0.00 0.00 66.41 66.89 1urf h THR 151 Cb 0.27 1.25 -0.02 0.00 -1.74 0.00 0.00 68.15 67.91 1urf h THR 151 CO -0.00 0.08 0.06 1.88 0.37 0.00 0.00 175.52 177.91 1urf h TYR 152 N -0.22 0.78 -0.06 3.16 -1.99 -1.06 -3.15 116.97 114.42 1urf h TYR 152 Ca -0.01 -0.11 0.02 0.00 2.00 0.00 0.00 58.73 60.63 1urf h TYR 152 Cb 0.19 -0.21 -0.02 0.00 2.00 0.00 0.00 36.73 38.68 1urf h TYR 152 CO -0.03 0.74 -0.08 1.03 -0.00 0.00 0.00 178.16 179.83 1urf h SER 153 N 0.59 -0.23 -3.40 3.88 0.87 -1.03 -3.41 113.55 110.81 1urf h SER 153 Ca 0.13 0.05 -0.52 0.00 -1.23 0.00 0.00 61.79 60.21 1urf h SER 153 Cb 0.39 0.11 0.02 0.00 -0.44 0.00 0.00 62.40 62.49 1urf h SER 153 CO 0.01 -0.11 0.61 0.21 -0.53 0.00 0.00 176.83 177.02 1urf s ASN 154 N -5.11 6.99 -0.21 6.23 3.04 -0.80 -4.91 114.94 120.17 1urf s ASN 154 Ca -0.14 2.30 -0.33 0.00 0.04 0.00 0.00 52.86 54.73 1urf s ASN 154 Cb 0.08 -2.61 -0.09 0.00 -1.54 0.00 0.00 41.25 37.09 1urf s ASN 154 CO 0.67 -0.46 2.09 0.61 -3.04 0.00 0.00 177.10 176.97 1urf n GLY 155 N 2.38 1.02 0.04 1.21 0.00 -1.26 -4.13 105.19 104.45 1urf n GLY 155 Ca 0.06 0.86 0.00 0.00 0.00 0.00 0.00 46.02 46.94 1urf n GLY 155 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1urf n SER 156 N 9.32 -0.02 0.00 1.61 3.41 -1.26 -5.13 113.62 121.55 1urf n SER 156 Ca 0.31 0.11 0.00 0.00 -0.26 0.00 0.00 58.87 59.03 1urf n SER 156 Cb 0.32 0.13 0.00 0.00 -0.26 0.00 0.00 64.21 64.40 1urf n SER 156 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 1urf n THR 157 N -2.22 0.00 0.00 6.66 -1.04 -1.26 -5.07 114.28 111.36 1urf n THR 157 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1urf n THR 157 Cb 0.00 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 1urf n THR 157 CO 0.00 0.00 0.00 2.29 -0.64 0.00 0.00 175.07 176.72 1urf n LYS 158 N 0.00 0.00 -1.54 -2.82 2.85 -1.26 -5.09 118.16 110.30 1urf n LYS 158 Ca 0.00 0.00 -0.31 0.00 -1.05 0.00 0.00 58.31 56.95 1urf n LYS 158 Cb 0.00 0.00 -0.07 0.00 -0.65 0.00 0.00 35.03 34.31 1urf n LYS 158 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 1urf n ASP 159 N -0.70 1.69 -0.02 -5.58 8.00 -1.26 -4.78 116.55 113.90 1urf n ASP 159 Ca 0.00 -0.61 -0.16 0.00 0.71 0.00 0.00 54.79 54.73 1urf n ASP 159 Cb 0.00 -1.44 -0.10 0.00 -0.02 0.00 0.00 41.12 39.56 1urf n ASP 159 CO 0.00 0.00 0.00 -0.09 -0.39 0.00 0.00 177.20 176.72 1urf h ARG 160 N 16.60 0.34 -0.40 -1.24 9.65 -1.98 -3.05 114.38 134.29 1urf h ARG 160 Ca -0.15 -0.31 0.06 0.00 -1.10 0.00 0.00 59.98 58.49 1urf h ARG 160 Cb 1.21 0.07 -0.06 0.00 -1.39 0.00 0.00 29.97 29.81 1urf h ARG 160 CO 1.19 0.97 0.07 0.87 2.80 0.00 0.00 179.97 185.87 1urf h LYS 161 N -0.18 0.19 -0.68 0.20 1.57 -2.01 -1.23 116.57 114.44 1urf h LYS 161 Ca -0.04 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.73 1urf h LYS 161 Cb 1.07 -0.04 -0.03 0.00 0.08 0.00 0.00 32.23 33.30 1urf h LYS 161 CO 0.08 0.13 0.43 -0.07 -0.57 0.00 0.00 179.45 179.45 1urf h LEU 162 N 0.20 0.79 -0.62 2.94 3.38 -1.96 -2.16 115.31 117.88 1urf h LEU 162 Ca 0.20 -0.03 0.07 0.00 0.09 0.00 0.00 57.88 58.20 1urf h LEU 162 Cb 0.24 -0.20 -0.06 0.00 0.09 0.00 0.00 40.66 40.74 1urf h LEU 162 CO -0.26 0.59 0.31 0.25 0.09 0.00 0.00 178.44 179.42 1urf h LEU 163 N 0.92 0.43 -0.60 1.67 5.85 -1.12 0.50 115.31 122.96 1urf h LEU 163 Ca 0.25 0.04 -0.00 0.00 0.84 0.00 0.00 57.88 59.00 1urf h LEU 163 Cb -0.08 -0.04 -0.03 0.00 0.37 0.00 0.00 40.66 40.89 1urf h LEU 163 CO -0.05 0.27 0.36 -0.07 -0.34 0.00 0.00 178.44 178.62 1urf h LEU 164 N 0.57 0.73 -0.76 2.25 3.38 -1.03 -2.30 115.31 118.16 1urf h LEU 164 Ca 0.29 -0.06 -0.02 0.00 0.09 0.00 0.00 57.88 58.17 1urf h LEU 164 Cb 0.23 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.76 1urf h LEU 164 CO -0.21 0.58 0.38 0.74 0.09 0.00 0.00 178.44 180.02 1urf h THR 165 N 0.82 1.24 -0.76 0.22 2.02 -0.99 -2.63 112.91 112.82 1urf h THR 165 Ca 0.22 -0.64 0.02 0.00 0.77 0.00 0.00 66.41 66.78 1urf h THR 165 Cb -0.02 0.27 -0.04 0.00 -1.74 0.00 0.00 68.15 66.62 1urf h THR 165 CO -0.04 0.27 0.49 0.00 0.37 0.00 0.00 175.52 176.62 1urf h ALA 166 N 1.19 0.99 -0.53 6.16 0.00 -0.53 -0.59 119.26 125.96 1urf h ALA 166 Ca 0.26 -0.04 0.02 0.00 0.00 0.00 0.00 54.91 55.15 1urf h ALA 166 Cb 0.09 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.58 1urf h ALA 166 CO -0.04 0.32 0.33 1.96 0.00 0.00 0.00 179.25 181.82 1urf h GLN 167 N 0.97 0.65 -0.66 0.00 4.20 -1.11 -1.52 115.11 117.65 1urf h GLN 167 Ca 0.30 -0.04 -0.03 0.00 0.06 0.00 0.00 58.65 58.94 1urf h GLN 167 Cb -0.03 -0.15 -0.03 0.00 0.30 0.00 0.00 27.48 27.57 1urf h GLN 167 CO -0.09 0.43 0.31 0.37 -0.67 0.00 0.00 178.83 179.18 1urf h GLN 168 N 0.67 0.94 -0.60 1.46 5.75 -1.06 -2.17 115.11 120.10 1urf h GLN 168 Ca 0.20 -0.13 0.04 0.00 -0.15 0.00 0.00 58.65 58.61 1urf h GLN 168 Cb -0.03 -0.18 -0.04 0.00 1.07 0.00 0.00 27.48 28.30 1urf h GLN 168 CO -0.07 0.73 0.35 0.52 -2.65 0.00 0.00 178.83 177.72 1urf h MET 169 N 0.94 0.67 -0.63 1.69 2.86 -0.15 -1.76 114.93 118.55 1urf h MET 169 Ca 0.23 -0.04 -0.08 0.00 -2.06 0.00 0.00 59.70 57.75 1urf h MET 169 Cb 0.11 -0.15 -0.02 0.00 0.06 0.00 0.00 31.60 31.59 1urf h MET 169 CO -0.03 0.44 0.08 1.25 1.06 0.00 0.00 176.91 179.72 1urf h LEU 170 N 0.69 1.02 -0.40 1.22 5.85 -0.88 -2.25 115.31 120.56 1urf h LEU 170 Ca 0.25 -0.27 0.01 0.00 0.84 0.00 0.00 57.88 58.72 1urf h LEU 170 Cb 0.07 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 40.81 1urf h LEU 170 CO -0.13 1.03 0.24 -0.61 -0.34 0.00 0.00 178.44 178.64 1urf h GLN 171 N 0.97 0.48 -0.27 1.25 4.15 -0.86 -1.21 115.11 119.62 1urf h GLN 171 Ca 0.19 -0.03 -0.03 0.00 0.77 0.00 0.00 58.65 59.55 1urf h GLN 171 Cb 0.46 -0.11 -0.01 0.00 0.21 0.00 0.00 27.48 28.03 1urf h GLN 171 CO 0.02 0.32 0.05 0.22 -1.93 0.00 0.00 178.83 177.50 1urf h ASP 172 N 0.49 0.43 -0.27 -0.69 1.82 -1.24 -2.63 116.42 114.33 1urf h ASP 172 Ca 0.15 -0.25 0.01 0.00 -0.39 0.00 0.00 57.03 56.55 1urf h ASP 172 Cb -0.01 -0.11 -0.01 0.00 0.68 0.00 0.00 39.33 39.87 1urf h ASP 172 CO -0.06 0.57 0.17 0.77 -1.61 0.00 0.00 179.24 179.08 1urf h SER 173 N 0.27 0.29 -0.77 2.28 4.64 -1.24 -2.57 113.55 116.45 1urf h SER 173 Ca 0.08 -0.00 0.03 0.00 -0.47 0.00 0.00 61.79 61.43 1urf h SER 173 Cb 0.32 -0.07 -0.05 0.00 -0.31 0.00 0.00 62.40 62.29 1urf h SER 173 CO 0.00 0.21 0.49 0.11 -0.87 0.00 0.00 176.83 176.77 1urf h LYS 174 N 0.35 0.92 -0.00 4.77 1.57 -1.20 -2.12 116.57 120.85 1urf h LYS 174 Ca 0.10 -0.06 0.01 0.00 -1.87 0.00 0.00 60.65 58.83 1urf h LYS 174 Cb -0.03 -0.21 -0.01 0.00 0.08 0.00 0.00 32.23 32.06 1urf h LYS 174 CO -0.03 0.61 -0.04 1.15 -0.57 0.00 0.00 179.45 180.56 1urf h THR 175 N 0.95 0.88 -0.93 -0.16 2.02 -1.21 -1.95 112.91 112.51 1urf h THR 175 Ca 0.31 0.00 0.05 0.00 0.77 0.00 0.00 66.41 67.55 1urf h THR 175 Cb 0.03 0.88 -0.06 0.00 -1.74 0.00 0.00 68.15 67.26 1urf h THR 175 CO -0.12 0.00 0.60 0.11 0.37 0.00 0.00 175.52 176.48 1urf h LYS 176 N -0.08 1.08 -0.78 6.66 1.57 -1.21 -1.80 116.57 122.01 1urf h LYS 176 Ca 0.02 -0.06 -0.02 0.00 -1.87 0.00 0.00 60.65 58.72 1urf h LYS 176 Cb 0.10 -0.24 -0.04 0.00 0.08 0.00 0.00 32.23 32.13 1urf h LYS 176 CO -0.05 0.71 0.42 0.82 -0.57 0.00 0.00 179.45 180.78 1urf h ILE 177 N 1.11 1.23 0.05 1.86 2.04 -1.01 -1.12 117.51 121.67 1urf h ILE 177 Ca 0.39 -0.59 -0.00 0.00 1.00 0.00 0.00 64.86 65.66 1urf h ILE 177 Cb 0.11 0.19 0.00 0.00 -0.74 0.00 0.00 36.82 36.38 1urf h ILE 177 CO -0.16 0.26 -0.02 -0.78 0.00 0.00 0.00 178.15 177.45 1urf h ASP 178 N 1.09 -0.06 0.01 1.72 1.82 -0.56 0.14 116.42 120.58 1urf h ASP 178 Ca 0.27 -0.08 -0.00 0.00 -0.39 0.00 0.00 57.03 56.84 1urf h ASP 178 Cb 0.04 0.02 0.00 0.00 0.68 0.00 0.00 39.33 40.07 1urf h ASP 178 CO -0.04 0.04 -0.01 0.40 -1.61 0.00 0.00 179.24 178.02 1urf h ILE 179 N -0.15 1.18 -0.70 2.25 5.03 -1.33 -2.63 117.51 121.16 1urf h ILE 179 Ca -0.01 -0.57 0.02 0.00 -0.12 0.00 0.00 64.86 64.19 1urf h ILE 179 Cb 0.13 1.56 -0.04 0.00 -3.03 0.00 0.00 36.82 35.44 1urf h ILE 179 CO 0.01 0.15 0.45 0.40 -0.68 0.00 0.00 178.15 178.47 1urf h ILE 180 N -0.26 1.13 -0.77 -0.67 2.04 -1.20 -2.18 117.51 115.59 1urf h ILE 180 Ca -0.00 -0.30 0.10 0.00 1.00 0.00 0.00 64.86 65.65 1urf h ILE 180 Cb 0.25 0.16 -0.07 0.00 -0.74 0.00 0.00 36.82 36.42 1urf h ILE 180 CO 0.00 0.16 0.42 -0.09 0.00 0.00 0.00 178.15 178.64 1urf h ARG 181 N 0.89 0.68 -0.53 2.37 9.65 -0.64 -1.10 114.38 125.68 1urf h ARG 181 Ca 0.27 -0.04 0.02 0.00 -1.10 0.00 0.00 59.98 59.13 1urf h ARG 181 Cb -0.03 -0.15 -0.03 0.00 -1.39 0.00 0.00 29.97 28.37 1urf h ARG 181 CO -0.09 0.45 0.33 1.98 2.80 0.00 0.00 179.97 185.44 1urf h MET 182 N 0.70 0.64 -0.55 0.20 4.05 -1.02 -0.68 114.93 118.28 1urf h MET 182 Ca 0.38 -0.04 -0.02 0.00 -0.28 0.00 0.00 59.70 59.74 1urf h MET 182 Cb 0.38 -0.14 -0.03 0.00 -0.80 0.00 0.00 31.60 31.01 1urf h MET 182 CO -0.26 0.42 0.24 1.96 0.23 0.00 0.00 176.91 179.51 1urf h GLN 183 N 0.66 0.77 -0.34 0.39 4.20 -0.94 -2.60 115.11 117.25 1urf h GLN 183 Ca 0.21 -0.10 -0.12 0.00 0.06 0.00 0.00 58.65 58.70 1urf h GLN 183 Cb -0.00 -0.15 -0.01 0.00 0.30 0.00 0.00 27.48 27.63 1urf h GLN 183 CO -0.08 0.62 -0.26 -0.07 -0.67 0.00 0.00 178.83 178.36 1urf h LEU 184 N 0.77 0.82 0.07 1.46 -0.00 -0.49 -2.31 115.31 115.63 1urf h LEU 184 Ca 0.19 -0.45 0.01 0.00 -0.00 0.00 0.00 57.88 57.63 1urf h LEU 184 Cb 0.11 -0.23 -0.02 0.00 -0.00 0.00 0.00 40.66 40.53 1urf h LEU 184 CO -0.02 1.09 -0.11 0.03 -0.00 0.00 0.00 178.44 179.43 1urf h ARG 185 N 0.55 -0.22 -0.50 1.13 3.08 -0.81 -1.31 114.38 116.31 1urf h ARG 185 Ca 0.06 0.01 -0.04 0.00 0.07 0.00 0.00 59.98 60.08 1urf h ARG 185 Cb 0.83 0.05 -0.02 0.00 0.08 0.00 0.00 29.97 30.91 1urf h ARG 185 CO 0.07 -0.14 0.13 0.07 -1.07 0.00 0.00 179.97 179.03 1urf h ARG 186 N -0.22 0.76 -0.49 0.04 0.11 -1.52 -2.50 114.38 110.55 1urf h ARG 186 Ca 0.02 -0.14 -0.02 0.00 0.10 0.00 0.00 59.98 59.94 1urf h ARG 186 Cb 0.24 -0.12 -0.02 0.00 1.11 0.00 0.00 29.97 31.17 1urf h ARG 186 CO -0.06 0.68 0.24 0.00 0.10 0.00 0.00 179.97 180.93 1urf h ALA 187 N 1.41 0.63 -0.50 0.08 0.00 -1.00 -1.98 119.26 117.90 1urf h ALA 187 Ca 0.17 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 54.92 1urf h ALA 187 Cb 0.26 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 1urf h ALA 187 CO -0.00 0.19 0.15 -0.07 0.00 0.00 0.00 179.25 179.51 1urf h LEU 188 N 0.64 0.74 -0.35 0.00 3.38 -1.01 -1.63 115.31 117.08 1urf h LEU 188 Ca 0.17 -0.21 0.00 0.00 0.09 0.00 0.00 57.88 57.93 1urf h LEU 188 Cb 0.11 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.65 1urf h LEU 188 CO -0.02 0.75 0.23 1.56 0.09 0.00 0.00 178.44 181.05 1urf h GLN 189 N 0.69 0.46 -0.58 1.13 4.20 -1.29 -0.74 115.11 118.98 1urf h GLN 189 Ca 0.16 -0.03 -0.03 0.00 0.06 0.00 0.00 58.65 58.82 1urf h GLN 189 Cb 0.28 -0.10 -0.03 0.00 0.30 0.00 0.00 27.48 27.93 1urf h GLN 189 CO -0.00 0.30 0.25 0.00 -0.67 0.00 0.00 178.83 178.71 1urf h ALA 190 N 1.13 0.75 -0.79 3.87 0.00 -1.25 -2.77 119.26 120.20 1urf h ALA 190 Ca 0.13 -0.15 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 1urf h ALA 190 Cb -0.05 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 17.48 1urf h ALA 190 CO -0.03 0.34 0.39 0.22 0.00 0.00 0.00 179.25 180.17 1urf h ASP 191 N 0.79 1.03 -3.39 0.00 3.58 -1.00 -3.45 116.42 113.97 1urf h ASP 191 Ca 0.19 -0.11 0.03 0.00 0.42 0.00 0.00 57.03 57.56 1urf h ASP 191 Cb 0.17 -0.26 -0.25 0.00 1.72 0.00 0.00 39.33 40.71 1urf h ASP 191 CO -0.02 0.86 0.34 0.00 -2.88 0.00 0.00 179.24 177.54 1urf s GLN 192 N -5.66 0.60 -0.29 0.28 -2.07 -0.31 -5.10 119.66 107.11 1urf s GLN 192 Ca -0.12 0.74 -0.16 0.00 -1.82 0.00 0.00 55.36 54.00 1urf s GLN 192 Cb 0.16 0.28 0.16 0.00 -1.09 0.00 0.00 33.01 32.53 1urf s GLN 192 CO 0.82 -0.08 1.03 -1.17 -1.32 0.00 0.00 175.29 174.58 1urf s LEU 193 N 0.37 -0.42 0.00 2.60 2.96 -1.23 -4.05 118.68 118.90 1urf s LEU 193 Ca 0.01 0.67 0.00 0.00 -0.22 0.00 0.00 54.13 54.59 1urf s LEU 193 Cb -0.05 1.60 0.00 0.00 0.50 0.00 0.00 46.19 48.24 1urf s LEU 193 CO -0.05 -0.10 0.00 -0.62 -1.32 0.00 0.00 176.35 174.26 1urf n GLU 194 N 3.70 2.70 0.00 1.98 -0.58 -1.26 -4.46 120.64 122.73 1urf n GLU 194 Ca -0.17 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.57 1urf n GLU 194 Cb 0.57 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.44 1urf n GLU 194 CO 0.00 0.00 0.00 -1.71 -0.48 0.00 0.00 177.13 174.94 1urf n ASN 195 N 0.00 0.00 -4.73 1.62 5.15 -1.26 -4.89 115.26 111.16 1urf n ASN 195 Ca 0.00 0.00 -0.42 0.00 -0.60 0.00 0.00 54.58 53.56 1urf n ASN 195 Cb 0.00 0.00 -0.03 0.00 -0.53 0.00 0.00 39.78 39.22 1urf n ASN 195 CO 0.00 0.00 0.00 -1.10 1.40 0.00 0.00 177.26 177.56 1urf s GLN 196 N 0.00 4.34 0.24 1.20 -1.52 -1.26 -4.96 119.66 117.69 1urf s GLN 196 Ca 0.00 2.10 -0.30 0.00 -1.95 0.00 0.00 55.36 55.21 1urf s GLN 196 Cb 0.00 -3.21 -0.10 0.00 -0.22 0.00 0.00 33.01 29.48 1urf s GLN 196 CO 0.00 -0.37 1.40 0.00 -0.25 0.00 0.00 175.29 176.07 1urf s ALA 197 N 0.62 3.59 0.41 6.09 0.00 -1.26 -4.70 121.76 126.52 1urf s ALA 197 Ca 0.61 1.26 0.00 0.00 0.00 0.00 0.00 51.96 53.83 1urf s ALA 197 Cb -0.37 -3.53 0.00 0.00 0.00 0.00 0.00 23.12 19.21 1urf s ALA 197 CO 0.34 -0.68 0.00 0.00 0.00 0.00 0.00 175.76 175.43 1urf n ALA 198 N 2.35 -1.94 0.00 0.00 0.00 -1.26 -5.23 120.51 114.44 1urf n ALA 198 Ca 0.06 0.38 0.00 0.00 0.00 0.00 0.00 53.44 53.88 1urf n ALA 198 Cb 0.41 -1.25 0.00 0.00 0.00 0.00 0.00 19.45 18.61 1urf n ALA 198 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20