#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 -0.04 0.13 -0.61 1.10 -1.26 -5.04 121.20 115.48 1urf s ILE 120 Ca 0.00 0.00 -0.20 0.00 -0.51 0.00 0.00 60.65 59.94 1urf s ILE 120 Cb 0.00 -1.00 -0.05 0.00 0.15 0.00 0.00 42.46 41.56 1urf s ILE 120 CO 0.00 0.00 1.73 -0.65 -2.11 0.00 0.00 174.94 173.91 1urf h PRO 121 N 5.73 0.09 0.00 3.50 0.11 -2.09 -3.48 132.00 135.85 1urf h PRO 121 Ca -0.24 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.86 1urf h PRO 121 Cb 1.16 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.25 1urf h PRO 121 CO 0.19 0.06 0.00 0.00 -0.21 0.00 0.00 178.00 178.04 1urf n ALA 122 N -2.29 0.00 -4.24 -0.75 0.00 -1.26 -5.04 120.51 106.93 1urf n ALA 122 Ca -0.03 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 53.11 1urf n ALA 122 Cb 0.10 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.47 1urf n ALA 122 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 1urf n THR 123 N 0.00 -1.46 0.00 0.00 5.66 -1.26 -4.56 114.28 112.66 1urf n THR 123 Ca 0.00 -0.44 0.00 0.00 -3.05 0.00 0.00 64.05 60.56 1urf n THR 123 Cb 0.00 -1.42 0.00 0.00 -1.55 0.00 0.00 70.33 67.36 1urf n THR 123 CO 0.00 0.00 0.00 -0.46 -3.05 0.00 0.00 175.07 171.56 1urf n ASN 124 N -2.87 0.00 -0.31 1.09 6.94 -1.26 -4.95 115.26 113.90 1urf n ASN 124 Ca -0.27 0.00 0.05 0.00 -0.02 0.00 0.00 54.58 54.33 1urf n ASN 124 Cb 0.67 0.00 0.25 0.00 -2.36 0.00 0.00 39.78 38.33 1urf n ASN 124 CO 0.00 0.00 0.00 -0.07 -1.03 0.00 0.00 177.26 176.16 1urf h LEU 125 N 0.00 0.90 -0.55 -4.53 3.38 -1.99 -1.91 115.31 110.61 1urf h LEU 125 Ca 0.00 0.01 0.06 0.00 0.09 0.00 0.00 57.88 58.04 1urf h LEU 125 Cb 0.00 -0.18 -0.05 0.00 0.09 0.00 0.00 40.66 40.52 1urf h LEU 125 CO 0.00 0.56 0.25 -1.28 0.09 0.00 0.00 178.44 178.06 1urf h SER 126 N 1.01 0.32 -0.50 -0.43 0.87 -1.96 -0.74 113.55 112.13 1urf h SER 126 Ca 0.40 0.05 -0.06 0.00 -1.23 0.00 0.00 61.79 60.95 1urf h SER 126 Cb 0.25 -0.01 -0.02 0.00 -0.44 0.00 0.00 62.40 62.18 1urf h SER 126 CO -0.16 0.22 0.10 -0.09 -0.53 0.00 0.00 176.83 176.36 1urf h ARG 127 N 0.47 0.82 -0.25 2.24 2.43 -1.75 -2.42 114.38 115.93 1urf h ARG 127 Ca 0.26 -0.21 0.02 0.00 -0.81 0.00 0.00 59.98 59.24 1urf h ARG 127 Cb 0.22 -0.10 -0.02 0.00 -0.42 0.00 0.00 29.97 29.65 1urf h ARG 127 CO -0.21 0.81 0.10 0.28 -1.51 0.00 0.00 179.97 179.43 1urf h VAL 128 N 0.70 0.95 -0.40 0.20 2.07 -0.76 -2.20 116.25 116.81 1urf h VAL 128 Ca 0.15 -0.08 -0.01 0.00 0.82 0.00 0.00 66.70 67.59 1urf h VAL 128 Cb 0.37 0.72 -0.02 0.00 -1.52 0.00 0.00 31.29 30.84 1urf h VAL 128 CO 0.01 0.04 0.22 0.00 0.02 0.00 0.00 177.57 177.86 1urf h ALA 129 N 1.15 0.51 -0.22 1.67 0.00 -1.08 0.00 119.26 121.29 1urf h ALA 129 Ca 0.11 -0.08 0.02 0.00 0.00 0.00 0.00 54.91 54.96 1urf h ALA 129 Cb 0.06 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 1urf h ALA 129 CO -0.10 0.03 0.06 0.78 0.00 0.00 0.00 179.25 180.02 1urf h GLY 130 N 0.52 0.25 0.93 0.00 0.00 -1.22 0.13 103.07 103.68 1urf h GLY 130 Ca 0.14 -0.03 -0.09 0.00 0.00 0.00 0.00 47.33 47.35 1urf h GLY 130 CO -0.02 0.02 -0.15 1.41 0.00 0.00 0.00 176.54 177.79 1urf h LEU 131 N 0.16 0.68 -0.31 3.11 3.38 -1.32 -2.69 115.31 118.31 1urf h LEU 131 Ca 0.10 -0.41 -0.01 0.00 0.09 0.00 0.00 57.88 57.65 1urf h LEU 131 Cb 0.07 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.62 1urf h LEU 131 CO -0.11 0.94 0.17 -0.08 0.09 0.00 0.00 178.44 179.44 1urf h GLU 132 N 0.42 0.44 -0.87 1.13 4.57 -0.80 -2.72 114.58 116.75 1urf h GLU 132 Ca 0.07 -0.05 -0.02 0.00 -1.18 0.00 0.00 59.36 58.18 1urf h GLU 132 Cb 0.68 -0.08 -0.04 0.00 -0.16 0.00 0.00 28.75 29.14 1urf h GLU 132 CO 0.05 0.38 0.47 1.57 -1.18 0.00 0.00 179.01 180.29 1urf h LYS 133 N 0.38 1.22 -0.53 1.92 2.10 -0.77 -2.58 116.57 118.31 1urf h LYS 133 Ca 0.11 -0.15 0.06 0.00 -2.00 0.00 0.00 60.65 58.67 1urf h LYS 133 Cb 0.07 -0.24 -0.05 0.00 -0.90 0.00 0.00 32.23 31.12 1urf h LYS 133 CO -0.02 0.90 0.24 1.96 -2.00 0.00 0.00 179.45 180.53 1urf h GLN 134 N 1.22 0.45 -0.44 0.07 1.08 -1.26 -0.29 115.11 115.93 1urf h GLN 134 Ca 0.30 -0.03 0.02 0.00 -1.45 0.00 0.00 58.65 57.50 1urf h GLN 134 Cb 0.04 -0.10 -0.03 0.00 -0.05 0.00 0.00 27.48 27.34 1urf h GLN 134 CO -0.05 0.30 0.26 -0.07 -0.95 0.00 0.00 178.83 178.32 1urf h LEU 135 N 0.46 0.42 -0.18 1.46 3.38 -1.16 -2.06 115.31 117.63 1urf h LEU 135 Ca 0.25 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.21 1urf h LEU 135 Cb 0.20 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 1urf h LEU 135 CO -0.20 0.30 0.07 0.00 0.09 0.00 0.00 178.44 178.70 1urf h ALA 136 N 1.20 0.23 -0.73 1.53 0.00 -1.07 -2.62 119.26 117.79 1urf h ALA 136 Ca 0.18 -0.11 0.07 0.00 0.00 0.00 0.00 54.91 55.04 1urf h ALA 136 Cb 0.01 -0.07 -0.06 0.00 0.00 0.00 0.00 17.79 17.67 1urf h ALA 136 CO -0.08 -0.17 0.42 0.82 0.00 0.00 0.00 179.25 180.23 1urf h ILE 137 N 0.13 0.97 -0.73 0.00 2.04 -0.89 -2.07 117.51 116.95 1urf h ILE 137 Ca 0.06 -0.26 -0.02 0.00 1.00 0.00 0.00 64.86 65.64 1urf h ILE 137 Cb 0.18 0.15 -0.03 0.00 -0.74 0.00 0.00 36.82 36.38 1urf h ILE 137 CO -0.00 0.14 0.38 -0.33 0.00 0.00 0.00 178.15 178.34 1urf h GLU 138 N 0.76 1.03 -1.00 2.37 4.39 -1.27 -2.50 114.58 118.35 1urf h GLU 138 Ca 0.33 -0.13 0.05 0.00 0.34 0.00 0.00 59.36 59.95 1urf h GLU 138 Cb 0.21 -0.20 -0.06 0.00 -0.10 0.00 0.00 28.75 28.60 1urf h GLU 138 CO -0.19 0.78 0.65 -0.07 -1.16 0.00 0.00 179.01 179.03 1urf h LEU 139 N 1.01 1.07 -0.08 1.33 3.38 -1.00 0.14 115.31 121.15 1urf h LEU 139 Ca 0.26 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.22 1urf h LEU 139 Cb 0.07 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 40.58 1urf h LEU 139 CO -0.04 0.70 0.04 0.50 0.09 0.00 0.00 178.44 179.73 1urf h LYS 140 N 1.22 0.12 -0.50 1.13 3.64 -1.06 -0.74 116.57 120.38 1urf h LYS 140 Ca 0.42 -0.02 -0.06 0.00 -1.27 0.00 0.00 60.65 59.71 1urf h LYS 140 Cb 0.09 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 31.87 1urf h LYS 140 CO -0.15 0.22 0.06 0.28 -2.27 0.00 0.00 179.45 177.58 1urf h VAL 141 N 0.00 1.25 -0.37 2.00 2.07 -1.12 -1.76 116.25 118.32 1urf h VAL 141 Ca 0.03 -0.97 0.01 0.00 0.82 0.00 0.00 66.70 66.58 1urf h VAL 141 Cb 0.14 0.92 -0.02 0.00 -1.52 0.00 0.00 31.29 30.80 1urf h VAL 141 CO -0.00 0.35 0.24 0.50 0.02 0.00 0.00 177.57 178.67 1urf h LYS 142 N 0.71 0.47 -0.25 1.57 3.64 -0.64 -0.48 116.57 121.59 1urf h LYS 142 Ca 0.15 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.49 1urf h LYS 142 Cb 0.43 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 32.13 1urf h LYS 142 CO 0.01 0.31 0.13 0.37 -2.27 0.00 0.00 179.45 178.01 1urf h GLN 143 N 0.48 0.35 -0.65 1.90 4.15 -1.03 -1.98 115.11 118.33 1urf h GLN 143 Ca 0.14 -0.04 0.01 0.00 0.77 0.00 0.00 58.65 59.52 1urf h GLN 143 Cb -0.04 -0.07 -0.03 0.00 0.21 0.00 0.00 27.48 27.55 1urf h GLN 143 CO -0.04 0.32 0.43 0.78 -1.93 0.00 0.00 178.83 178.39 1urf h GLY 144 N 0.29 0.91 1.03 2.39 0.00 -1.03 -1.69 103.07 104.97 1urf h GLY 144 Ca 0.09 -0.34 -0.09 0.00 0.00 0.00 0.00 47.33 46.99 1urf h GLY 144 CO -0.01 0.33 -0.03 0.00 0.00 0.00 0.00 176.54 176.82 1urf h ALA 145 N 1.60 0.68 -0.71 3.60 0.00 -0.75 -2.51 119.26 121.17 1urf h ALA 145 Ca 0.24 -0.30 -0.03 0.00 0.00 0.00 0.00 54.91 54.81 1urf h ALA 145 Cb -0.10 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.48 1urf h ALA 145 CO -0.05 0.52 0.31 0.93 0.00 0.00 0.00 179.25 180.97 1urf h GLU 146 N 0.77 1.04 -0.97 0.00 4.39 -0.78 -0.57 114.58 118.46 1urf h GLU 146 Ca 0.14 -0.17 0.01 0.00 0.34 0.00 0.00 59.36 59.67 1urf h GLU 146 Cb 0.57 -0.18 -0.05 0.00 -0.10 0.00 0.00 28.75 28.99 1urf h GLU 146 CO 0.03 0.84 0.63 -0.91 -1.16 0.00 0.00 179.01 178.43 1urf h ASN 147 N 1.00 1.12 -0.04 1.42 2.35 -1.16 -1.63 115.58 118.64 1urf h ASN 147 Ca 0.24 -0.04 -0.02 0.00 -0.55 0.00 0.00 56.30 55.93 1urf h ASN 147 Cb 0.16 -0.28 -0.00 0.00 0.05 0.00 0.00 38.32 38.25 1urf h ASN 147 CO -0.03 0.83 -0.05 0.24 -1.65 0.00 0.00 177.43 176.77 1urf h MET 148 N 1.32 0.10 -0.50 0.81 2.86 -1.02 -2.11 114.93 116.38 1urf h MET 148 Ca 0.35 -0.06 0.08 0.00 -2.06 0.00 0.00 59.70 58.02 1urf h MET 148 Cb -0.13 0.00 -0.07 0.00 0.06 0.00 0.00 31.60 31.47 1urf h MET 148 CO -0.07 0.60 0.11 0.82 1.06 0.00 0.00 176.91 179.43 1urf h ILE 149 N -0.39 0.74 -0.48 -1.22 2.04 -0.92 -1.11 117.51 116.17 1urf h ILE 149 Ca 0.00 -0.09 -0.10 0.00 1.00 0.00 0.00 64.86 65.68 1urf h ILE 149 Cb 0.59 0.46 -0.02 0.00 -0.74 0.00 0.00 36.82 37.11 1urf h ILE 149 CO 0.01 0.05 -0.10 0.06 0.00 0.00 0.00 178.15 178.16 1urf h GLN 150 N 0.26 0.87 0.13 2.37 3.07 -1.35 -0.36 115.11 120.09 1urf h GLN 150 Ca 0.25 -0.30 -0.01 0.00 0.09 0.00 0.00 58.65 58.68 1urf h GLN 150 Cb 0.32 -0.07 0.00 0.00 0.08 0.00 0.00 27.48 27.82 1urf h GLN 150 CO -0.31 0.94 -0.06 1.15 0.09 0.00 0.00 178.83 180.63 1urf h THR 151 N 0.79 0.92 0.03 1.86 2.02 -0.60 -3.31 112.91 114.61 1urf h THR 151 Ca 0.13 -0.17 -0.00 0.00 0.77 0.00 0.00 66.41 67.14 1urf h THR 151 Cb 0.62 1.02 0.00 0.00 -1.74 0.00 0.00 68.15 68.05 1urf h THR 151 CO 0.04 0.04 -0.02 1.88 0.37 0.00 0.00 175.52 177.84 1urf h TYR 152 N -0.25 -0.04 -2.69 3.16 -1.99 -1.25 -3.44 116.97 110.47 1urf h TYR 152 Ca -0.02 -0.00 -0.56 0.00 2.00 0.00 0.00 58.73 60.15 1urf h TYR 152 Cb 0.20 0.01 -0.02 0.00 2.00 0.00 0.00 36.73 38.92 1urf h TYR 152 CO -0.04 0.62 1.15 0.45 -0.00 0.00 0.00 178.16 180.34 1urf s SER 153 N -5.85 6.35 0.00 3.88 0.15 -0.15 -4.08 113.70 114.00 1urf s SER 153 Ca -0.16 1.74 0.00 0.00 0.70 0.00 0.00 55.95 58.23 1urf s SER 153 Cb -0.01 -2.53 0.00 0.00 -1.71 0.00 0.00 66.02 61.77 1urf s SER 153 CO 0.62 -1.26 0.00 -0.46 1.20 0.00 0.00 173.24 173.34 1urf n ASN 154 N 8.48 0.00 0.00 5.45 0.23 -1.26 -4.70 115.26 123.47 1urf n ASN 154 Ca 0.19 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 54.24 1urf n ASN 154 Cb 0.45 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.15 1urf n ASN 154 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1urf n GLY 155 N 0.00 -0.36 0.51 4.83 0.00 -1.26 -5.06 105.19 103.85 1urf n GLY 155 Ca 0.00 0.03 0.00 0.00 0.00 0.00 0.00 46.02 46.05 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 -2.11 -0.05 0.00 1.61 2.88 -1.26 -5.15 113.62 109.54 1urf n SER 156 Ca 0.00 0.03 0.00 0.00 -1.33 0.00 0.00 58.87 57.57 1urf n SER 156 Cb 0.00 0.18 0.00 0.00 -0.75 0.00 0.00 64.21 63.64 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 -2.17 0.00 0.00 2.46 -2.24 -1.26 -4.57 114.28 106.50 1urf n THR 157 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1urf n THR 157 Cb 0.00 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.23 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 5.93 3.28 -2.34 -0.78 3.00 -1.26 -4.90 118.16 121.09 1urf n LYS 158 Ca 0.00 0.00 -0.42 0.00 -0.00 0.00 0.00 58.31 57.89 1urf n LYS 158 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 35.03 35.00 1urf n LYS 158 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.40 176.89 1urf s ASP 159 N -1.39 6.97 0.30 3.14 1.11 -1.26 -4.90 116.67 120.64 1urf s ASP 159 Ca 0.00 2.04 0.26 0.00 0.18 0.00 0.00 52.55 55.03 1urf s ASP 159 Cb 0.00 -2.57 0.99 0.00 1.07 0.00 0.00 42.92 42.41 1urf s ASP 159 CO 0.00 -0.59 1.76 -0.09 1.18 0.00 0.00 175.17 177.43 1urf h ARG 160 N 7.24 0.00 -0.95 8.23 2.43 -1.91 -3.10 114.38 126.32 1urf h ARG 160 Ca -0.39 0.00 0.14 0.00 -0.81 0.00 0.00 59.98 58.92 1urf h ARG 160 Cb 1.19 0.00 -0.09 0.00 -0.42 0.00 0.00 29.97 30.65 1urf h ARG 160 CO 0.86 0.00 0.57 1.57 -1.51 0.00 0.00 179.97 181.46 1urf h LYS 161 N 0.00 0.81 -0.08 0.20 2.10 -1.98 0.27 116.57 117.90 1urf h LYS 161 Ca 0.00 -0.05 -0.09 0.00 -2.00 0.00 0.00 60.65 58.51 1urf h LYS 161 Cb 0.48 -0.18 -0.01 0.00 -0.90 0.00 0.00 32.23 31.61 1urf h LYS 161 CO 0.00 0.54 -0.37 -0.07 -2.00 0.00 0.00 179.45 177.54 1urf h LEU 162 N 0.84 0.16 -0.21 7.07 3.38 -1.96 -2.77 115.31 121.82 1urf h LEU 162 Ca 0.50 -0.06 0.02 0.00 0.09 0.00 0.00 57.88 58.43 1urf h LEU 162 Cb 0.60 -0.04 -0.03 0.00 0.09 0.00 0.00 40.66 41.28 1urf h LEU 162 CO -0.31 0.53 0.06 0.25 0.09 0.00 0.00 178.44 179.05 1urf h LEU 163 N 0.14 0.04 -0.39 1.67 5.85 -0.62 0.15 115.31 122.16 1urf h LEU 163 Ca 0.01 0.03 -0.03 0.00 0.84 0.00 0.00 57.88 58.73 1urf h LEU 163 Cb 0.73 0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.77 1urf h LEU 163 CO 0.05 0.06 0.13 -0.07 -0.34 0.00 0.00 178.44 178.27 1urf h LEU 164 N 0.15 0.57 -0.83 2.25 3.38 -1.33 -2.17 115.31 117.32 1urf h LEU 164 Ca 0.10 -0.20 -0.01 0.00 0.09 0.00 0.00 57.88 57.86 1urf h LEU 164 Cb 0.08 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 40.64 1urf h LEU 164 CO -0.11 0.62 0.50 0.74 0.09 0.00 0.00 178.44 180.27 1urf h THR 165 N 0.49 1.23 -0.45 0.22 2.02 -1.20 -1.93 112.91 113.29 1urf h THR 165 Ca 0.13 -0.52 -0.01 0.00 0.77 0.00 0.00 66.41 66.78 1urf h THR 165 Cb 0.25 0.07 -0.02 0.00 -1.74 0.00 0.00 68.15 66.71 1urf h THR 165 CO -0.00 0.25 0.25 0.00 0.37 0.00 0.00 175.52 176.38 1urf h ALA 166 N 1.27 0.58 -1.01 6.16 0.00 -0.50 -1.78 119.26 123.99 1urf h ALA 166 Ca 0.30 -0.09 0.02 0.00 0.00 0.00 0.00 54.91 55.14 1urf h ALA 166 Cb -0.04 -0.18 -0.05 0.00 0.00 0.00 0.00 17.79 17.52 1urf h ALA 166 CO -0.06 0.10 0.66 1.96 0.00 0.00 0.00 179.25 181.92 1urf h GLN 167 N 0.59 1.29 -0.89 0.00 4.20 -1.06 -1.14 115.11 118.11 1urf h GLN 167 Ca 0.16 -0.08 -0.01 0.00 0.06 0.00 0.00 58.65 58.78 1urf h GLN 167 Cb 0.05 -0.29 -0.04 0.00 0.30 0.00 0.00 27.48 27.50 1urf h GLN 167 CO -0.03 0.85 0.52 0.37 -0.67 0.00 0.00 178.83 179.88 1urf h GLN 168 N 1.33 1.21 -0.27 1.46 4.15 -0.85 -1.99 115.11 120.15 1urf h GLN 168 Ca 0.38 -0.12 -0.04 0.00 0.77 0.00 0.00 58.65 59.64 1urf h GLN 168 Cb -0.09 -0.25 -0.01 0.00 0.21 0.00 0.00 27.48 27.34 1urf h GLN 168 CO -0.10 0.86 0.00 0.52 -1.93 0.00 0.00 178.83 178.18 1urf h MET 169 N 1.23 0.48 0.06 1.69 2.86 -0.43 -1.36 114.93 119.45 1urf h MET 169 Ca 0.32 -0.15 0.01 0.00 -2.06 0.00 0.00 59.70 57.82 1urf h MET 169 Cb -0.03 -0.04 -0.02 0.00 0.06 0.00 0.00 31.60 31.56 1urf h MET 169 CO -0.06 0.63 -0.14 1.25 1.06 0.00 0.00 176.91 179.66 1urf h LEU 170 N 0.26 -0.38 -0.67 1.22 7.12 -0.92 0.33 115.31 122.27 1urf h LEU 170 Ca 0.08 0.05 -0.06 0.00 0.13 0.00 0.00 57.88 58.08 1urf h LEU 170 Cb 0.42 0.15 -0.03 0.00 -0.53 0.00 0.00 40.66 40.67 1urf h LEU 170 CO 0.01 -0.20 0.20 0.06 -0.13 0.00 0.00 178.44 178.38 1urf h GLN 171 N -0.26 1.06 -0.53 1.25 3.07 -1.39 -2.59 115.11 115.73 1urf h GLN 171 Ca 0.03 -0.24 -0.01 0.00 0.09 0.00 0.00 58.65 58.52 1urf h GLN 171 Cb 0.29 -0.15 -0.02 0.00 0.08 0.00 0.00 27.48 27.67 1urf h GLN 171 CO -0.09 0.92 0.28 0.22 0.09 0.00 0.00 178.83 180.26 1urf h ASP 172 N 0.99 0.67 -0.47 0.06 3.58 -0.98 -2.40 116.42 117.87 1urf h ASP 172 Ca 0.22 -0.10 0.02 0.00 0.42 0.00 0.00 57.03 57.58 1urf h ASP 172 Cb 0.32 -0.17 -0.03 0.00 1.72 0.00 0.00 39.33 41.17 1urf h ASP 172 CO -0.00 0.58 0.29 -1.28 -2.88 0.00 0.00 179.24 175.94 1urf h SER 173 N 0.70 0.47 -0.82 2.28 0.87 -0.77 -2.41 113.55 113.88 1urf h SER 173 Ca 0.18 -0.00 0.03 0.00 -1.23 0.00 0.00 61.79 60.78 1urf h SER 173 Cb 0.07 -0.10 -0.05 0.00 -0.44 0.00 0.00 62.40 61.87 1urf h SER 173 CO -0.03 0.34 0.53 0.11 -0.53 0.00 0.00 176.83 177.25 1urf h LYS 174 N 0.58 1.00 -0.42 2.24 1.57 -1.24 -2.17 116.57 118.12 1urf h LYS 174 Ca 0.19 -0.06 0.05 0.00 -1.87 0.00 0.00 60.65 58.96 1urf h LYS 174 Cb -0.01 -0.22 -0.05 0.00 0.08 0.00 0.00 32.23 32.03 1urf h LYS 174 CO -0.07 0.66 0.15 1.15 -0.57 0.00 0.00 179.45 180.77 1urf h THR 175 N 1.03 0.87 -0.90 -0.16 2.02 -0.95 -1.28 112.91 113.54 1urf h THR 175 Ca 0.33 -0.11 -0.01 0.00 0.77 0.00 0.00 66.41 67.38 1urf h THR 175 Cb 0.01 0.53 -0.04 0.00 -1.74 0.00 0.00 68.15 66.90 1urf h THR 175 CO -0.11 0.06 0.50 0.11 0.37 0.00 0.00 175.52 176.45 1urf h LYS 176 N 0.32 1.25 -0.70 6.66 1.57 -1.12 -2.59 116.57 121.96 1urf h LYS 176 Ca 0.20 -0.14 -0.03 0.00 -1.87 0.00 0.00 60.65 58.81 1urf h LYS 176 Cb 0.18 -0.25 -0.03 0.00 0.08 0.00 0.00 32.23 32.21 1urf h LYS 176 CO -0.20 0.90 0.32 0.82 -0.57 0.00 0.00 179.45 180.72 1urf h ILE 177 N 1.26 1.24 0.14 1.86 2.04 -0.74 -1.22 117.51 122.08 1urf h ILE 177 Ca 0.32 -0.70 -0.01 0.00 1.00 0.00 0.00 64.86 65.47 1urf h ILE 177 Cb 0.01 0.39 0.00 0.00 -0.74 0.00 0.00 36.82 36.48 1urf h ILE 177 CO -0.05 0.29 -0.07 0.44 0.00 0.00 0.00 178.15 178.76 1urf h ASP 178 N 0.99 -0.16 -0.81 1.72 3.32 -0.90 -1.53 116.42 119.05 1urf h ASP 178 Ca 0.24 -0.02 -0.04 0.00 0.02 0.00 0.00 57.03 57.23 1urf h ASP 178 Cb 0.16 0.04 -0.04 0.00 0.22 0.00 0.00 39.33 39.71 1urf h ASP 178 CO -0.03 -0.09 0.34 0.16 -1.72 0.00 0.00 179.24 177.90 1urf h ILE 179 N -0.22 1.26 -0.46 0.35 3.07 -1.39 -2.69 117.51 117.43 1urf h ILE 179 Ca -0.02 -0.81 0.00 0.00 1.55 0.00 0.00 64.86 65.58 1urf h ILE 179 Cb 0.17 0.28 -0.02 0.00 -0.27 0.00 0.00 36.82 36.97 1urf h ILE 179 CO 0.03 0.34 0.30 0.40 -1.05 0.00 0.00 178.15 178.17 1urf h ILE 180 N 1.18 1.13 -0.67 0.16 2.04 -1.06 -1.95 117.51 118.34 1urf h ILE 180 Ca 0.27 -0.24 0.07 0.00 1.00 0.00 0.00 64.86 65.96 1urf h ILE 180 Cb 0.20 0.46 -0.06 0.00 -0.74 0.00 0.00 36.82 36.68 1urf h ILE 180 CO -0.02 0.12 0.36 0.03 0.00 0.00 0.00 178.15 178.64 1urf h ARG 181 N 0.63 0.63 -0.99 2.37 2.47 -1.04 -0.92 114.38 117.52 1urf h ARG 181 Ca 0.17 -0.04 0.02 0.00 -1.26 0.00 0.00 59.98 58.87 1urf h ARG 181 Cb -0.06 -0.14 -0.05 0.00 -1.65 0.00 0.00 29.97 28.07 1urf h ARG 181 CO -0.04 0.42 0.65 1.98 0.56 0.00 0.00 179.97 183.54 1urf h MET 182 N 0.65 1.26 -0.80 0.04 4.05 -1.13 -1.51 114.93 117.50 1urf h MET 182 Ca 0.31 -0.08 -0.00 0.00 -0.28 0.00 0.00 59.70 59.65 1urf h MET 182 Cb 0.23 -0.28 -0.04 0.00 -0.80 0.00 0.00 31.60 30.71 1urf h MET 182 CO -0.20 0.83 0.48 1.96 0.23 0.00 0.00 176.91 180.21 1urf h GLN 183 N 1.30 1.08 -0.63 0.39 1.08 -0.45 -2.22 115.11 115.67 1urf h GLN 183 Ca 0.38 -0.09 0.00 0.00 -1.45 0.00 0.00 58.65 57.49 1urf h GLN 183 Cb -0.08 -0.23 -0.03 0.00 -0.05 0.00 0.00 27.48 27.09 1urf h GLN 183 CO -0.10 0.75 0.40 -0.07 -0.95 0.00 0.00 178.83 178.86 1urf h LEU 184 N 1.10 0.73 -0.47 1.46 3.38 -0.43 0.41 115.31 121.48 1urf h LEU 184 Ca 0.29 -0.03 0.05 0.00 0.09 0.00 0.00 57.88 58.27 1urf h LEU 184 Cb -0.05 -0.18 -0.05 0.00 0.09 0.00 0.00 40.66 40.47 1urf h LEU 184 CO -0.05 0.55 0.22 0.03 0.09 0.00 0.00 178.44 179.27 1urf h ARG 185 N 0.85 0.41 -0.60 1.13 3.08 -1.02 -0.76 114.38 117.48 1urf h ARG 185 Ca 0.23 -0.02 -0.08 0.00 0.07 0.00 0.00 59.98 60.17 1urf h ARG 185 Cb -0.07 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 29.86 1urf h ARG 185 CO -0.05 0.27 0.06 0.00 -1.07 0.00 0.00 179.97 179.18 1urf h ARG 186 N 0.43 1.00 -0.97 0.04 2.47 -1.09 -2.48 114.38 113.77 1urf h ARG 186 Ca 0.21 -0.27 0.03 0.00 -1.26 0.00 0.00 59.98 58.69 1urf h ARG 186 Cb 0.16 -0.11 -0.05 0.00 -1.65 0.00 0.00 29.97 28.31 1urf h ARG 186 CO -0.17 0.94 0.64 0.00 0.56 0.00 0.00 179.97 181.94 1urf h ALA 187 N 1.13 1.34 -0.49 0.04 0.00 0.00 -2.24 119.26 119.05 1urf h ALA 187 Ca 0.18 -0.05 -0.12 0.00 0.00 0.00 0.00 54.91 54.92 1urf h ALA 187 Cb 0.46 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 1urf h ALA 187 CO 0.02 0.58 -0.16 1.25 0.00 0.00 0.00 179.25 180.94 1urf h LEU 188 N 1.26 0.98 -0.55 0.00 5.85 -0.87 -2.60 115.31 119.38 1urf h LEU 188 Ca 0.37 -0.38 0.04 0.00 0.84 0.00 0.00 57.88 58.76 1urf h LEU 188 Cb -0.06 -0.27 -0.04 0.00 0.37 0.00 0.00 40.66 40.66 1urf h LEU 188 CO -0.10 1.13 0.31 1.56 -0.34 0.00 0.00 178.44 181.00 1urf h GLN 189 N 0.82 0.58 -0.61 1.25 1.08 -0.97 -1.10 115.11 116.16 1urf h GLN 189 Ca 0.12 -0.04 -0.08 0.00 -1.45 0.00 0.00 58.65 57.20 1urf h GLN 189 Cb 0.73 -0.13 -0.02 0.00 -0.05 0.00 0.00 27.48 28.00 1urf h GLN 189 CO 0.06 0.39 0.05 0.00 -0.95 0.00 0.00 178.83 178.38 1urf h ALA 190 N 1.27 0.81 0.03 3.87 0.00 -1.40 -2.18 119.26 121.67 1urf h ALA 190 Ca 0.24 -0.28 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 1urf h ALA 190 Cb 0.09 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.66 1urf h ALA 190 CO -0.14 0.61 -0.01 0.22 0.00 0.00 0.00 179.25 179.93 1urf h ASP 191 N 0.94 -0.03 -0.32 0.00 1.82 -1.04 -2.87 116.42 114.92 1urf h ASP 191 Ca 0.18 -0.11 -0.03 0.00 -0.39 0.00 0.00 57.03 56.68 1urf h ASP 191 Cb 0.49 0.01 -0.02 0.00 0.68 0.00 0.00 39.33 40.49 1urf h ASP 191 CO 0.02 0.09 0.12 0.06 -1.61 0.00 0.00 179.24 177.92 1urf h GLN 192 N -0.15 0.55 -2.10 0.28 3.07 -1.20 -3.02 115.11 112.54 1urf h GLN 192 Ca -0.00 -0.08 -0.10 0.00 0.09 0.00 0.00 58.65 58.55 1urf h GLN 192 Cb 0.14 -0.10 -0.04 0.00 0.08 0.00 0.00 27.48 27.56 1urf h GLN 192 CO 0.01 0.48 -0.16 1.28 0.09 0.00 0.00 178.83 180.52 1urf n LEU 193 N -4.36 4.47 -2.14 0.06 4.77 -0.82 -3.22 117.00 115.77 1urf n LEU 193 Ca 0.02 -2.51 -0.02 0.00 -0.03 0.00 0.00 56.01 53.47 1urf n LEU 193 Cb 0.16 -1.12 0.04 0.00 -2.33 0.00 0.00 43.42 40.18 1urf n LEU 193 CO 0.37 1.18 0.45 1.21 -1.33 0.00 0.00 177.39 179.28 1urf n GLU 194 N 2.22 0.49 -1.93 3.23 2.13 -1.14 -4.99 120.64 120.65 1urf n GLU 194 Ca 0.24 -0.60 -0.39 0.00 0.66 0.00 0.00 57.16 57.07 1urf n GLU 194 Cb 0.65 0.11 0.01 0.00 0.27 0.00 0.00 31.44 32.49 1urf n GLU 194 CO 0.00 0.00 0.00 0.54 -0.41 0.00 0.00 177.13 177.26 1urf s ASN 195 N -0.42 5.90 0.32 4.31 4.22 -1.20 -4.92 114.94 123.15 1urf s ASN 195 Ca 0.05 2.72 -0.29 0.00 -2.14 0.00 0.00 52.86 53.20 1urf s ASN 195 Cb 0.16 -2.64 -0.12 0.00 1.28 0.00 0.00 41.25 39.93 1urf s ASN 195 CO -0.04 -1.14 1.33 0.00 -2.04 0.00 0.00 177.10 175.22 1urf n GLN 196 N -0.32 2.15 -1.69 3.55 1.13 -1.26 -4.87 117.38 116.06 1urf n GLN 196 Ca 0.06 0.76 -0.44 0.00 -1.94 0.00 0.00 57.00 55.43 1urf n GLN 196 Cb 0.44 -2.37 -0.03 0.00 0.11 0.00 0.00 30.24 28.40 1urf n GLN 196 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1urf n ALA 197 N 0.78 1.44 -2.68 -1.58 0.00 -1.26 -4.91 120.51 112.30 1urf n ALA 197 Ca 0.06 0.41 -0.05 0.00 0.00 0.00 0.00 53.44 53.86 1urf n ALA 197 Cb 0.35 -2.32 0.09 0.00 0.00 0.00 0.00 19.45 17.57 1urf n ALA 197 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1urf n ALA 198 N 2.11 -1.96 0.00 0.00 0.00 -1.26 -5.08 120.51 114.32 1urf n ALA 198 Ca 0.12 -0.77 0.00 0.00 0.00 0.00 0.00 53.44 52.79 1urf n ALA 198 Cb 0.32 -2.03 0.00 0.00 0.00 0.00 0.00 19.45 17.74 1urf n ALA 198 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20