#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3jxo s LEU -6 N 0.00 4.24 0.09 1.20 1.43 -1.26 -5.09 118.68 119.29 3jxo s LEU -6 Ca 0.00 1.19 -0.13 0.00 -1.03 0.00 0.00 54.13 54.16 3jxo s LEU -6 Cb 0.00 -3.63 0.02 0.00 0.03 0.00 0.00 46.19 42.60 3jxo s LEU -6 CO 0.00 -0.03 0.30 -0.72 0.23 0.00 0.00 176.35 176.14 3jxo s TYR -5 N -1.68 -0.06 0.18 0.29 1.13 -1.26 -5.14 117.35 110.81 3jxo s TYR -5 Ca 0.45 -0.23 -0.30 0.00 -1.41 0.00 0.00 57.07 55.58 3jxo s TYR -5 Cb -0.13 0.10 -0.08 0.00 -1.10 0.00 0.00 41.96 40.75 3jxo s TYR -5 CO 0.20 -0.59 1.20 0.12 -2.51 0.00 0.00 175.55 173.97 3jxo s PHE -4 N -3.41 3.42 -0.19 -3.49 5.36 -1.26 -5.05 117.98 113.37 3jxo s PHE -4 Ca 0.01 1.41 -0.09 0.00 -0.96 0.00 0.00 56.93 57.30 3jxo s PHE -4 Cb 0.02 -3.44 0.07 0.00 -0.34 0.00 0.00 43.02 39.33 3jxo s PHE -4 CO -0.09 -1.24 0.43 -1.14 -1.46 0.00 0.00 175.22 171.73 3jxo s GLN -3 N -0.14 0.39 0.00 10.12 0.74 -1.26 -5.00 119.66 124.51 3jxo s GLN -3 Ca 0.53 0.91 0.00 0.00 0.05 0.00 0.00 55.36 56.85 3jxo s GLN -3 Cb -0.33 0.11 0.00 0.00 1.10 0.00 0.00 33.01 33.90 3jxo s GLN -3 CO 0.36 -0.19 0.00 0.41 -0.55 0.00 0.00 175.29 175.32 3jxo n GLY -2 N 4.66 0.22 3.12 2.59 0.00 -1.26 -5.01 105.19 109.51 3jxo n GLY -2 Ca -0.18 -1.57 -0.12 0.00 0.00 0.00 0.00 46.02 44.15 3jxo n GLY -2 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 3jxo s MET -1 N -0.82 0.39 0.04 1.61 0.23 -1.26 -1.13 119.30 118.36 3jxo s MET -1 Ca 0.00 -0.01 0.03 0.00 -1.03 0.00 0.00 55.69 54.68 3jxo s MET -1 Cb 0.00 0.17 -0.02 0.00 -1.53 0.00 0.00 34.83 33.45 3jxo s MET -1 CO 0.00 -0.08 -0.10 0.96 -2.03 0.00 0.00 175.02 173.77 3jxo s ILE 140 N -0.60 0.73 0.40 3.16 -4.36 0.14 -5.00 121.20 115.67 3jxo s ILE 140 Ca -0.07 -0.98 -0.25 0.00 -0.26 0.00 0.00 60.65 59.09 3jxo s ILE 140 Cb -0.04 -0.73 -0.09 0.00 1.25 0.00 0.00 42.46 42.85 3jxo s ILE 140 CO 0.01 -0.21 1.13 -2.84 0.24 0.00 0.00 174.94 173.27 3jxo s PRO 141 N -1.32 4.09 -0.21 0.37 0.02 -1.26 -0.74 135.00 135.95 3jxo s PRO 141 Ca -0.05 1.73 -0.04 0.00 0.02 0.00 0.00 61.00 62.67 3jxo s PRO 141 Cb -0.08 -2.64 -0.12 0.00 0.02 0.00 0.00 34.50 31.68 3jxo s PRO 141 CO 0.01 -0.26 -0.22 1.28 -0.33 0.00 0.00 177.00 177.47 3jxo n LEU 142 N 0.03 2.37 -4.11 -5.54 4.77 0.47 -4.85 117.00 110.15 3jxo n LEU 142 Ca 0.05 0.05 -0.13 0.00 -0.03 0.00 0.00 56.01 55.95 3jxo n LEU 142 Cb 0.47 -0.68 -0.06 0.00 -2.33 0.00 0.00 43.42 40.82 3jxo n LEU 142 CO 0.49 0.68 0.02 -1.61 -1.33 0.00 0.00 177.39 175.64 3jxo s GLU 143 N -2.40 1.59 -0.01 3.23 0.41 -1.05 -5.01 118.70 115.46 3jxo s GLU 143 Ca -0.29 -1.60 -0.31 0.00 -0.41 0.00 0.00 54.97 52.36 3jxo s GLU 143 Cb 0.09 0.39 -0.10 0.00 -1.78 0.00 0.00 34.13 32.73 3jxo s GLU 143 CO 0.43 -0.62 1.96 0.94 -0.49 0.00 0.00 175.26 177.48 3jxo n GLN 144 N -0.43 2.66 -0.86 1.61 7.27 -1.26 -2.08 117.38 124.28 3jxo n GLN 144 Ca 0.01 0.97 0.00 0.00 0.07 0.00 0.00 57.00 58.05 3jxo n GLN 144 Cb 0.63 -2.91 0.00 0.00 2.41 0.00 0.00 30.24 30.37 3jxo n GLN 144 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 3jxo n GLY 145 N 4.54 0.69 2.98 1.69 0.00 -1.26 -5.02 105.19 108.81 3jxo n GLY 145 Ca 0.21 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 46.00 3jxo n GLY 145 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3jxo s ILE 146 N -2.58 0.95 0.16 -0.61 1.01 -0.89 -0.99 121.20 118.25 3jxo s ILE 146 Ca 0.00 -0.36 0.11 0.00 0.00 0.00 0.00 60.65 60.40 3jxo s ILE 146 Cb 0.00 -0.90 -0.04 0.00 0.01 0.00 0.00 42.46 41.53 3jxo s ILE 146 CO 0.00 0.32 -0.25 -0.70 0.00 0.00 0.00 174.94 174.31 3jxo s GLU 147 N 0.80 1.43 -0.12 2.79 2.56 0.17 -0.40 118.70 125.93 3jxo s GLU 147 Ca -0.12 -1.42 0.02 0.00 0.00 0.00 0.00 54.97 53.45 3jxo s GLU 147 Cb -0.15 -1.81 -0.00 0.00 2.00 0.00 0.00 34.13 34.16 3jxo s GLU 147 CO 0.02 0.41 -0.20 0.12 -0.56 0.00 0.00 175.26 175.05 3jxo s PHE 148 N -1.39 2.67 0.06 5.30 5.36 0.09 -1.40 117.98 128.67 3jxo s PHE 148 Ca 0.17 -0.96 -0.07 0.00 -0.96 0.00 0.00 56.93 55.11 3jxo s PHE 148 Cb -0.09 -1.78 -0.01 0.00 -0.34 0.00 0.00 43.02 40.80 3jxo s PHE 148 CO 0.08 -0.38 0.13 -0.48 -1.46 0.00 0.00 175.22 173.10 3jxo s LEU 149 N 0.44 1.68 0.04 6.12 0.05 0.14 -0.68 118.68 126.46 3jxo s LEU 149 Ca -0.14 -0.63 0.02 0.00 0.05 0.00 0.00 54.13 53.43 3jxo s LEU 149 Cb -0.17 0.78 -0.04 0.00 -2.05 0.00 0.00 46.19 44.71 3jxo s LEU 149 CO 0.06 -0.62 0.03 -0.94 -0.55 0.00 0.00 176.35 174.33 3jxo s SER 150 N -2.55 5.29 -0.05 1.48 1.04 -0.29 -0.47 113.70 118.16 3jxo s SER 150 Ca 0.01 -0.02 0.01 0.00 0.48 0.00 0.00 55.95 56.44 3jxo s SER 150 Cb 0.03 -1.39 0.02 0.00 0.10 0.00 0.00 66.02 64.77 3jxo s SER 150 CO -0.08 0.23 -0.07 -0.69 0.98 0.00 0.00 173.24 173.61 3jxo s VAL 151 N -1.22 0.71 -0.27 5.02 1.01 0.06 -4.62 120.40 121.09 3jxo s VAL 151 Ca 0.24 -0.23 -0.12 0.00 0.00 0.00 0.00 61.98 61.86 3jxo s VAL 151 Cb -0.12 -0.69 -0.05 0.00 0.00 0.00 0.00 36.38 35.52 3jxo s VAL 151 CO 0.15 0.26 0.24 0.20 0.00 0.00 0.00 175.10 175.95 3jxo s ASN 152 N 0.78 6.11 -0.34 3.32 -0.87 -1.26 -0.38 114.94 122.29 3jxo s ASN 152 Ca -0.12 0.11 -0.26 0.00 -1.57 0.00 0.00 52.86 51.01 3jxo s ASN 152 Cb -0.14 -2.14 0.01 0.00 -0.02 0.00 0.00 41.25 38.96 3jxo s ASN 152 CO 0.01 -0.06 0.94 -0.69 -2.57 0.00 0.00 177.10 174.73 3jxo s VAL 153 N 1.67 4.61 0.39 1.60 1.01 -0.16 -5.02 120.40 124.51 3jxo s VAL 153 Ca 0.09 1.36 0.06 0.00 0.00 0.00 0.00 61.98 63.49 3jxo s VAL 153 Cb -0.15 -4.32 0.00 0.00 0.00 0.00 0.00 36.38 31.91 3jxo s VAL 153 CO 0.09 -0.45 0.55 -1.61 0.00 0.00 0.00 175.10 173.69 3jxo s GLU 154 N 3.41 2.98 0.53 2.72 0.41 -1.26 -0.34 118.70 127.14 3jxo s GLU 154 Ca 0.39 -0.98 0.22 0.00 -0.41 0.00 0.00 54.97 54.19 3jxo s GLU 154 Cb -0.13 -2.74 1.37 0.00 -1.78 0.00 0.00 34.13 30.86 3jxo s GLU 154 CO 0.16 -0.15 2.06 0.93 -0.49 0.00 0.00 175.26 177.78 3jxo h GLU 155 N 0.68 0.00 -0.18 1.61 5.08 -1.96 -1.91 114.58 117.91 3jxo h GLU 155 Ca -0.44 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.92 3jxo h GLU 155 Cb 1.27 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.52 3jxo h GLU 155 CO 0.51 0.00 0.00 -0.40 -1.00 0.00 0.00 179.01 178.12 3jxo n ASP 156 N -4.40 1.41 -4.75 1.42 5.75 -1.26 -4.94 116.55 109.79 3jxo n ASP 156 Ca 0.04 -1.74 -0.41 0.00 -0.01 0.00 0.00 54.79 52.67 3jxo n ASP 156 Cb 0.39 -0.11 -0.02 0.00 -1.03 0.00 0.00 41.12 40.34 3jxo n ASP 156 CO 0.00 0.00 0.00 -0.55 -0.11 0.00 0.00 177.20 176.54 3jxo s SER 157 N -1.43 6.55 0.44 -1.12 0.15 -0.72 -4.89 113.70 112.68 3jxo s SER 157 Ca 0.28 2.79 0.30 0.00 0.70 0.00 0.00 55.95 60.02 3jxo s SER 157 Cb 0.15 -2.63 1.44 0.00 -1.71 0.00 0.00 66.02 63.27 3jxo s SER 157 CO 0.22 -0.77 1.91 1.55 1.20 0.00 0.00 173.24 177.36 3jxo h PRO 158 N 4.71 0.00 -0.22 5.44 0.13 -1.80 -3.06 132.00 137.20 3jxo h PRO 158 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 3jxo h PRO 158 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 3jxo h PRO 158 CO 0.76 0.00 0.00 1.33 -0.23 0.00 0.00 178.00 179.86 3jxo n VAL 159 N -2.64 0.27 -1.69 1.56 0.24 -1.26 -4.95 118.33 109.85 3jxo n VAL 159 Ca -0.00 -0.63 -0.44 0.00 -2.04 0.00 0.00 64.34 61.22 3jxo n VAL 159 Cb 0.17 1.22 -0.04 0.00 -1.47 0.00 0.00 33.84 33.72 3jxo n VAL 159 CO 0.00 0.00 0.00 0.52 -2.14 0.00 0.00 176.83 175.21 3jxo n VAL 160 N 1.39 0.04 -0.39 3.34 0.31 -1.16 -1.77 118.33 120.10 3jxo n VAL 160 Ca 0.16 -0.01 0.00 0.00 -0.01 0.00 0.00 64.34 64.48 3jxo n VAL 160 Cb 0.59 -1.73 0.00 0.00 -0.91 0.00 0.00 33.84 31.79 3jxo n VAL 160 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3jxo n GLY 161 N 3.59 1.92 3.78 2.92 0.00 0.17 -5.01 105.19 112.57 3jxo n GLY 161 Ca 0.16 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.81 3jxo n GLY 161 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3jxo s LYS 162 N -0.11 4.59 0.32 1.61 1.02 -0.73 -4.68 119.74 121.77 3jxo s LYS 162 Ca 0.00 1.33 -0.26 0.00 0.02 0.00 0.00 55.97 57.06 3jxo s LYS 162 Cb 0.00 -2.82 -0.10 0.00 -0.52 0.00 0.00 37.83 34.40 3jxo s LYS 162 CO 0.00 0.29 0.96 0.15 -0.92 0.00 0.00 175.35 175.83 3jxo s LYS 163 N -2.02 4.57 0.30 1.68 1.02 -1.26 -1.20 119.74 122.83 3jxo s LYS 163 Ca 0.50 1.39 0.03 0.00 0.02 0.00 0.00 55.97 57.91 3jxo s LYS 163 Cb -0.19 -2.85 0.60 0.00 -0.52 0.00 0.00 37.83 34.88 3jxo s LYS 163 CO 0.24 0.26 1.85 -0.07 -0.92 0.00 0.00 175.35 176.71 3jxo h LEU 164 N 3.24 0.88 -2.26 3.17 3.38 -1.05 -0.55 115.31 122.12 3jxo h LEU 164 Ca -0.47 0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.54 3jxo h LEU 164 Cb 1.20 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.81 3jxo h LEU 164 CO 0.65 0.47 0.00 0.07 0.09 0.00 0.00 178.44 179.72 3jxo h LYS 165 N 0.94 0.00 -0.00 1.13 2.10 -1.39 -2.29 116.57 117.06 3jxo h LYS 165 Ca 0.48 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.13 3jxo h LYS 165 Cb 0.50 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.83 3jxo h LYS 165 CO -0.24 0.00 -0.56 -0.25 -2.00 0.00 0.00 179.45 176.40 3jxo n ASP 166 N -3.03 0.90 -4.73 7.07 8.00 -0.22 -4.92 116.55 119.63 3jxo n ASP 166 Ca -0.01 -0.71 -0.41 0.00 0.71 0.00 0.00 54.79 54.36 3jxo n ASP 166 Cb 0.17 0.43 -0.03 0.00 -0.02 0.00 0.00 41.12 41.66 3jxo n ASP 166 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3jxo s LEU 167 N -2.83 4.42 -0.47 0.64 1.43 -0.87 -4.98 118.68 116.02 3jxo s LEU 167 Ca 0.14 2.13 -0.29 0.00 -1.03 0.00 0.00 54.13 55.09 3jxo s LEU 167 Cb 0.18 -3.60 0.03 0.00 0.03 0.00 0.00 46.19 42.83 3jxo s LEU 167 CO 0.69 -0.39 1.12 -2.16 0.23 0.00 0.00 176.35 175.83 3jxo s PRO 168 N 0.27 3.72 0.02 1.29 0.04 -1.26 -5.00 135.00 134.09 3jxo s PRO 168 Ca 0.55 0.55 0.04 0.00 0.04 0.00 0.00 61.00 62.18 3jxo s PRO 168 Cb -0.31 -3.90 -0.02 0.00 0.04 0.00 0.00 34.50 30.31 3jxo s PRO 168 CO 0.33 -1.35 -0.13 -0.51 0.04 0.00 0.00 177.00 175.38 3jxo s LEU 169 N 4.37 2.12 0.86 -3.56 1.43 -1.26 -4.91 118.68 117.73 3jxo s LEU 169 Ca 0.47 -0.38 -0.12 0.00 -1.03 0.00 0.00 54.13 53.07 3jxo s LEU 169 Cb -0.08 -0.60 0.11 0.00 0.03 0.00 0.00 46.19 45.65 3jxo s LEU 169 CO 0.31 0.07 1.10 -2.16 0.23 0.00 0.00 176.35 175.89 3jxo s PRO 170 N -0.87 1.55 0.18 1.29 0.04 -1.26 -4.94 135.00 130.99 3jxo s PRO 170 Ca 0.02 0.72 -0.17 0.00 0.04 0.00 0.00 61.00 61.61 3jxo s PRO 170 Cb -0.07 -1.85 0.13 0.00 0.04 0.00 0.00 34.50 32.75 3jxo s PRO 170 CO 0.01 -2.01 1.65 -0.09 0.04 0.00 0.00 177.00 176.59 3jxo h ARG 171 N -1.38 -0.04 -2.55 4.56 2.43 -2.01 -3.18 114.38 112.22 3jxo h ARG 171 Ca -0.49 0.00 -0.77 0.00 -0.81 0.00 0.00 59.98 57.91 3jxo h ARG 171 Cb 1.28 0.01 -0.19 0.00 -0.42 0.00 0.00 29.97 30.65 3jxo h ARG 171 CO 0.57 -0.03 1.74 -0.25 -1.51 0.00 0.00 179.97 180.49 3jxo n ASP 172 N -5.36 7.48 -3.79 -3.80 8.00 -1.26 -4.86 116.55 112.96 3jxo n ASP 172 Ca 0.03 -3.38 -0.13 0.00 0.71 0.00 0.00 54.79 52.03 3jxo n ASP 172 Cb 0.26 -1.29 -0.10 0.00 -0.02 0.00 0.00 41.12 39.98 3jxo n ASP 172 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 3jxo s SER 173 N -0.42 -0.16 -0.09 -2.24 1.04 -1.20 -1.38 113.70 109.25 3jxo s SER 173 Ca 0.46 0.12 -0.04 0.00 0.48 0.00 0.00 55.95 56.97 3jxo s SER 173 Cb 0.17 0.35 0.05 0.00 0.10 0.00 0.00 66.02 66.69 3jxo s SER 173 CO -0.09 -0.34 0.19 -0.63 0.98 0.00 0.00 173.24 173.35 3jxo s ILE 174 N -0.99 -0.19 -0.77 -1.02 1.01 0.09 -4.97 121.20 114.37 3jxo s ILE 174 Ca -0.11 0.25 -0.25 0.00 0.00 0.00 0.00 60.65 60.54 3jxo s ILE 174 Cb -0.05 -0.32 0.04 0.00 0.01 0.00 0.00 42.46 42.14 3jxo s ILE 174 CO 0.03 0.11 1.24 -0.63 0.00 0.00 0.00 174.94 175.68 3jxo s ILE 175 N 1.81 3.89 0.13 2.92 -1.09 -1.26 -1.43 121.20 126.17 3jxo s ILE 175 Ca -0.03 0.05 -0.01 0.00 -2.23 0.00 0.00 60.65 58.43 3jxo s ILE 175 Cb -0.12 -4.89 -0.19 0.00 -1.58 0.00 0.00 42.46 35.69 3jxo s ILE 175 CO -0.07 -1.78 1.30 0.00 -1.23 0.00 0.00 174.94 173.16 3jxo h ALA 176 N 9.88 0.38 -2.13 9.38 0.00 -0.93 -3.45 119.26 132.39 3jxo h ALA 176 Ca -0.21 -0.75 0.04 0.00 0.00 0.00 0.00 54.91 53.99 3jxo h ALA 176 Cb 1.05 -0.04 -0.18 0.00 0.00 0.00 0.00 17.79 18.62 3jxo h ALA 176 CO 1.28 0.90 0.39 0.00 0.00 0.00 0.00 179.25 181.81 3jxo s ALA 177 N -3.11 -1.80 -0.02 0.00 0.00 -1.01 -4.71 121.76 111.10 3jxo s ALA 177 Ca -0.04 1.16 0.08 0.00 0.00 0.00 0.00 51.96 53.16 3jxo s ALA 177 Cb 0.09 0.08 -0.02 0.00 0.00 0.00 0.00 23.12 23.27 3jxo s ALA 177 CO 0.85 -0.52 -0.25 0.42 0.00 0.00 0.00 175.76 176.26 3jxo s ILE 178 N -2.20 2.00 -0.13 0.00 1.01 -1.00 -0.93 121.20 119.95 3jxo s ILE 178 Ca -0.01 -1.08 0.02 0.00 0.00 0.00 0.00 60.65 59.58 3jxo s ILE 178 Cb -0.01 -1.67 0.00 0.00 0.01 0.00 0.00 42.46 40.80 3jxo s ILE 178 CO -0.02 0.57 -0.20 -0.69 0.00 0.00 0.00 174.94 174.60 3jxo s VAL 179 N -0.55 2.35 -0.11 2.92 1.01 0.30 -0.32 120.40 126.01 3jxo s VAL 179 Ca 0.08 -0.89 -0.02 0.00 0.00 0.00 0.00 61.98 61.15 3jxo s VAL 179 Cb -0.10 -1.95 0.04 0.00 0.00 0.00 0.00 36.38 34.37 3jxo s VAL 179 CO -0.01 0.54 0.01 -0.60 0.00 0.00 0.00 175.10 175.05 3jxo s ARG 180 N 0.62 0.63 -1.51 2.72 3.52 -0.05 -1.46 118.95 123.41 3jxo s ARG 180 Ca -0.11 -0.04 -0.13 0.00 -0.13 0.00 0.00 55.73 55.32 3jxo s ARG 180 Cb -0.16 -1.31 0.09 0.00 -1.56 0.00 0.00 34.95 32.00 3jxo s ARG 180 CO 0.03 -0.40 0.88 0.41 -0.81 0.00 0.00 175.30 175.41 3jxo n GLY 181 N 5.12 -0.50 2.84 8.12 0.00 -1.26 -1.54 105.19 117.98 3jxo n GLY 181 Ca -0.08 0.17 0.00 0.00 0.00 0.00 0.00 46.02 46.12 3jxo n GLY 181 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3jxo n GLY 182 N -1.59 0.72 3.58 -0.02 0.00 -1.26 -5.02 105.19 101.61 3jxo n GLY 182 Ca 0.03 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.71 3jxo n GLY 182 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3jxo s VAL 183 N -3.04 3.91 0.06 1.61 1.01 -0.59 -5.09 120.40 118.28 3jxo s VAL 183 Ca 0.00 -0.38 -0.31 0.00 0.00 0.00 0.00 61.98 61.29 3jxo s VAL 183 Cb 0.00 -2.65 -0.06 0.00 0.00 0.00 0.00 36.38 33.67 3jxo s VAL 183 CO 0.00 0.57 1.27 -0.22 0.00 0.00 0.00 175.10 176.72 3jxo s LEU 184 N -0.45 4.36 -0.18 3.92 2.96 -1.26 -0.87 118.68 127.16 3jxo s LEU 184 Ca 0.07 2.09 -0.02 0.00 -0.22 0.00 0.00 54.13 56.06 3jxo s LEU 184 Cb -0.12 -3.58 -0.01 0.00 0.50 0.00 0.00 46.19 42.99 3jxo s LEU 184 CO 0.02 -0.55 -0.10 -0.69 -1.32 0.00 0.00 176.35 173.71 3jxo s VAL 185 N 1.29 3.00 -0.19 1.68 1.01 0.57 -4.96 120.40 122.80 3jxo s VAL 185 Ca 0.61 -0.64 -0.29 0.00 0.00 0.00 0.00 61.98 61.65 3jxo s VAL 185 Cb -0.31 -2.31 -0.01 0.00 0.00 0.00 0.00 36.38 33.75 3jxo s VAL 185 CO 0.29 0.48 1.23 -0.69 0.00 0.00 0.00 175.10 176.40 3jxo s VAL 186 N 1.05 4.34 0.06 2.92 1.01 -1.26 -2.36 120.40 126.15 3jxo s VAL 186 Ca -0.00 1.61 -0.31 0.00 0.00 0.00 0.00 61.98 63.28 3jxo s VAL 186 Cb -0.15 -4.07 -0.07 0.00 0.00 0.00 0.00 36.38 32.09 3jxo s VAL 186 CO -0.02 -0.18 1.52 -2.84 0.00 0.00 0.00 175.10 173.58 3jxo s PRO 187 N 3.52 4.25 0.24 2.72 0.02 -1.26 -4.98 135.00 139.50 3jxo s PRO 187 Ca 0.53 2.18 0.08 0.00 0.02 0.00 0.00 61.00 63.80 3jxo s PRO 187 Cb -0.20 -3.49 -0.05 0.00 0.02 0.00 0.00 34.50 30.78 3jxo s PRO 187 CO 0.14 -0.62 -0.11 1.03 -0.33 0.00 0.00 177.00 177.10 3jxo s ARG 188 N 2.17 1.46 0.34 5.54 1.81 -1.26 -5.03 118.95 123.97 3jxo s ARG 188 Ca 0.69 -1.69 0.10 0.00 -1.72 0.00 0.00 55.73 53.10 3jxo s ARG 188 Cb -0.37 -1.20 0.86 0.00 -0.45 0.00 0.00 34.95 33.79 3jxo s ARG 188 CO 0.30 0.13 1.79 0.78 -0.68 0.00 0.00 175.30 177.62 3jxo h GLY 189 N 2.41 1.57 -0.89 -3.53 0.00 -1.95 -1.57 103.07 99.11 3jxo h GLY 189 Ca -0.39 -0.31 0.00 0.00 0.00 0.00 0.00 47.33 46.63 3jxo h GLY 189 CO 0.64 -0.07 0.00 1.22 0.00 0.00 0.00 176.54 178.33 3jxo n ASP 190 N -4.71 1.87 -4.71 0.19 8.00 -1.26 -1.14 116.55 114.79 3jxo n ASP 190 Ca 0.23 -1.67 -0.42 0.00 0.71 0.00 0.00 54.79 53.65 3jxo n ASP 190 Cb 0.64 -0.06 -0.03 0.00 -0.02 0.00 0.00 41.12 41.66 3jxo n ASP 190 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 3jxo s THR 191 N -1.89 2.74 -0.12 -3.53 2.01 -0.59 -4.79 115.64 109.47 3jxo s THR 191 Ca 0.35 0.49 -0.14 0.00 0.31 0.00 0.00 61.69 62.70 3jxo s THR 191 Cb 0.20 -3.31 -0.05 0.00 0.01 0.00 0.00 72.50 69.35 3jxo s THR 191 CO 0.30 0.03 0.32 -1.61 -0.69 0.00 0.00 174.62 172.97 3jxo s GLU 192 N 1.37 4.09 0.09 4.92 2.02 -1.26 -1.35 118.70 128.59 3jxo s GLU 192 Ca 0.70 0.17 -0.30 0.00 0.02 0.00 0.00 54.97 55.57 3jxo s GLU 192 Cb -0.43 -3.35 -0.06 0.00 0.10 0.00 0.00 34.13 30.40 3jxo s GLU 192 CO 0.31 0.40 1.04 0.42 0.02 0.00 0.00 175.26 177.45 3jxo s ILE 193 N -0.04 4.35 0.13 -1.63 1.01 -0.34 -4.95 121.20 119.73 3jxo s ILE 193 Ca 0.19 1.85 0.08 0.00 0.00 0.00 0.00 60.65 62.77 3jxo s ILE 193 Cb -0.14 -4.18 -0.04 0.00 0.01 0.00 0.00 42.46 38.11 3jxo s ILE 193 CO 0.07 0.24 -0.13 -0.76 0.00 0.00 0.00 174.94 174.35 3jxo s LEU 194 N 0.33 2.90 0.35 2.97 1.43 -1.26 0.44 118.68 125.83 3jxo s LEU 194 Ca 0.51 -0.49 -0.28 0.00 -1.03 0.00 0.00 54.13 52.83 3jxo s LEU 194 Cb -0.25 -1.69 -0.12 0.00 0.03 0.00 0.00 46.19 44.16 3jxo s LEU 194 CO 0.31 0.16 1.39 -1.54 0.23 0.00 0.00 176.35 176.90 3jxo n SER 195 N 0.59 3.21 0.00 2.29 3.41 -1.26 -1.67 113.62 120.19 3jxo n SER 195 Ca -0.14 1.21 0.00 0.00 -0.26 0.00 0.00 58.87 59.68 3jxo n SER 195 Cb 0.53 -1.54 0.00 0.00 -0.26 0.00 0.00 64.21 62.94 3jxo n SER 195 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3jxo n GLY 196 N 0.83 1.81 3.75 5.00 0.00 0.54 -5.02 105.19 112.10 3jxo n GLY 196 Ca 0.04 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.70 3jxo n GLY 196 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3jxo s ASP 197 N -2.19 4.97 -0.17 1.61 1.01 -0.67 -4.76 116.67 116.47 3jxo s ASP 197 Ca 0.00 2.45 -0.03 0.00 0.71 0.00 0.00 52.55 55.68 3jxo s ASP 197 Cb 0.00 -2.60 -0.02 0.00 1.01 0.00 0.00 42.92 41.31 3jxo s ASP 197 CO 0.00 -1.75 -0.06 -0.75 0.21 0.00 0.00 175.17 172.82 3jxo s LYS 198 N -3.38 3.51 -0.10 8.23 2.20 -0.54 -0.98 119.74 128.68 3jxo s LYS 198 Ca 0.79 -0.59 -0.03 0.00 -0.36 0.00 0.00 55.97 55.77 3jxo s LYS 198 Cb -0.32 -2.88 -0.03 0.00 -1.51 0.00 0.00 37.83 33.08 3jxo s LYS 198 CO 0.36 0.10 0.04 -0.51 -0.36 0.00 0.00 175.35 174.97 3jxo s LEU 199 N 0.72 3.80 -0.14 5.43 1.43 0.48 -0.53 118.68 129.87 3jxo s LEU 199 Ca -0.03 0.23 -0.01 0.00 -1.03 0.00 0.00 54.13 53.30 3jxo s LEU 199 Cb -0.15 -1.89 -0.02 0.00 0.03 0.00 0.00 46.19 44.17 3jxo s LEU 199 CO 0.02 0.39 -0.11 -0.31 0.23 0.00 0.00 176.35 176.57 3jxo s TYR 200 N -0.92 2.86 -0.02 0.29 2.02 -0.11 -0.76 117.35 120.70 3jxo s TYR 200 Ca 0.14 -0.58 0.05 0.00 -0.37 0.00 0.00 57.07 56.30 3jxo s TYR 200 Cb -0.12 -1.87 -0.01 0.00 -0.40 0.00 0.00 41.96 39.56 3jxo s TYR 200 CO 0.03 -0.18 -0.16 0.08 -1.57 0.00 0.00 175.55 173.74 3jxo s VAL 201 N 0.37 1.26 -0.11 0.71 1.01 0.38 -0.19 120.40 123.83 3jxo s VAL 201 Ca -0.09 -0.67 0.02 0.00 0.00 0.00 0.00 61.98 61.23 3jxo s VAL 201 Cb -0.16 -1.05 -0.01 0.00 0.00 0.00 0.00 36.38 35.16 3jxo s VAL 201 CO 0.05 0.36 -0.18 -0.63 0.00 0.00 0.00 175.10 174.70 3jxo s ILE 202 N -0.31 2.61 -0.05 2.22 1.01 -0.52 -0.69 121.20 125.47 3jxo s ILE 202 Ca 0.05 -0.82 -0.15 0.00 0.00 0.00 0.00 60.65 59.73 3jxo s ILE 202 Cb -0.07 -2.06 0.03 0.00 0.01 0.00 0.00 42.46 40.37 3jxo s ILE 202 CO -0.00 0.54 0.35 0.54 0.00 0.00 0.00 174.94 176.37 3jxo s VAL 203 N 0.32 0.04 0.74 2.92 0.11 -0.49 -0.73 120.40 123.31 3jxo s VAL 203 Ca -0.14 -0.30 -0.14 0.00 -2.93 0.00 0.00 61.98 58.47 3jxo s VAL 203 Cb -0.17 -0.61 0.04 0.00 -1.53 0.00 0.00 36.38 34.12 3jxo s VAL 203 CO 0.07 -0.17 1.15 -0.94 -3.33 0.00 0.00 175.10 171.89 3jxo s SER 204 N -0.85 4.33 0.26 3.54 1.04 -0.48 -0.66 113.70 120.88 3jxo s SER 204 Ca -0.09 2.16 -0.02 0.00 0.48 0.00 0.00 55.95 58.47 3jxo s SER 204 Cb -0.04 -2.57 0.49 0.00 0.10 0.00 0.00 66.02 64.00 3jxo s SER 204 CO 0.03 -2.16 1.77 0.00 0.98 0.00 0.00 173.24 173.86 3jxo h ALA 205 N -0.52 1.22 -0.04 5.32 0.00 -1.43 -2.13 119.26 121.69 3jxo h ALA 205 Ca -0.46 0.08 -0.09 0.00 0.00 0.00 0.00 54.91 54.43 3jxo h ALA 205 Cb 1.27 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 19.02 3jxo h ALA 205 CO 0.50 -0.07 -0.41 0.93 0.00 0.00 0.00 179.25 180.20 3jxo h GLU 206 N 0.63 0.08 0.00 0.00 5.08 -1.92 -3.08 114.58 115.37 3jxo h GLU 206 Ca 0.44 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.77 3jxo h GLU 206 Cb 0.59 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.84 3jxo h GLU 206 CO -0.34 0.48 -0.64 0.00 -1.00 0.00 0.00 179.01 177.51 3jxo n ALA 207 N -2.46 3.19 0.02 3.43 0.00 -0.85 -4.62 120.51 119.21 3jxo n ALA 207 Ca -0.02 -0.30 -0.12 0.00 0.00 0.00 0.00 53.44 53.00 3jxo n ALA 207 Cb 0.45 -1.13 -0.06 0.00 0.00 0.00 0.00 19.45 18.71 3jxo n ALA 207 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 3jxo h LYS 208 N 0.00 0.07 -0.92 0.00 3.64 -1.33 -1.74 116.57 116.29 3jxo h LYS 208 Ca 0.00 -0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.37 3jxo h LYS 208 Cb 0.66 -0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 32.42 3jxo h LYS 208 CO 0.00 0.08 0.57 1.49 -2.27 0.00 0.00 179.45 179.31 3jxo h GLU 209 N 0.04 1.24 -0.39 1.90 4.81 -1.82 -0.82 114.58 119.54 3jxo h GLU 209 Ca 0.02 -0.10 -0.02 0.00 -0.13 0.00 0.00 59.36 59.13 3jxo h GLU 209 Cb 0.02 -0.26 -0.02 0.00 0.63 0.00 0.00 28.75 29.12 3jxo h GLU 209 CO -0.00 0.85 0.18 1.15 -0.73 0.00 0.00 179.01 180.46 3jxo h THR 210 N 1.26 1.18 -0.34 0.32 2.02 -1.73 -1.02 112.91 114.59 3jxo h THR 210 Ca 0.33 -0.51 -0.02 0.00 0.77 0.00 0.00 66.41 66.98 3jxo h THR 210 Cb -0.08 0.79 -0.01 0.00 -1.74 0.00 0.00 68.15 67.11 3jxo h THR 210 CO -0.06 0.19 0.13 0.58 0.37 0.00 0.00 175.52 176.72 3jxo h VAL 211 N 0.49 1.19 -0.72 3.16 2.07 -0.98 -1.49 116.25 119.98 3jxo h VAL 211 Ca 0.13 -0.61 0.04 0.00 0.82 0.00 0.00 66.70 67.08 3jxo h VAL 211 Cb 0.13 0.96 -0.05 0.00 -1.52 0.00 0.00 31.29 30.81 3jxo h VAL 211 CO -0.02 0.21 0.44 -0.33 0.02 0.00 0.00 177.57 177.90 3jxo h GLU 212 N 0.40 0.82 -0.69 1.57 5.08 -0.98 -0.60 114.58 120.18 3jxo h GLU 212 Ca 0.11 -0.05 -0.02 0.00 -1.00 0.00 0.00 59.36 58.40 3jxo h GLU 212 Cb 0.21 -0.19 -0.03 0.00 0.50 0.00 0.00 28.75 29.24 3jxo h GLU 212 CO -0.01 0.54 0.34 0.93 -1.00 0.00 0.00 179.01 179.82 3jxo h GLU 213 N 0.85 0.99 -0.43 2.33 5.08 -0.98 0.22 114.58 122.62 3jxo h GLU 213 Ca 0.30 -0.14 -0.04 0.00 -1.00 0.00 0.00 59.36 58.48 3jxo h GLU 213 Cb 0.06 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 29.11 3jxo h GLU 213 CO -0.13 0.78 0.13 1.15 -1.00 0.00 0.00 179.01 179.94 3jxo h THR 214 N 0.96 1.22 0.07 1.13 2.02 -0.88 -3.27 112.91 114.16 3jxo h THR 214 Ca 0.24 -0.75 -0.25 0.00 0.77 0.00 0.00 66.41 66.42 3jxo h THR 214 Cb 0.11 0.89 0.01 0.00 -1.74 0.00 0.00 68.15 67.41 3jxo h THR 214 CO -0.03 0.27 -1.09 -0.07 0.37 0.00 0.00 175.52 174.96 3jxo h LEU 215 N 0.56 0.52 -1.56 2.58 3.38 -0.85 -3.41 115.31 116.54 3jxo h LEU 215 Ca 0.14 -0.47 0.00 0.00 0.09 0.00 0.00 57.88 57.64 3jxo h LEU 215 Cb 0.28 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.87 3jxo h LEU 215 CO -0.00 1.31 0.00 0.18 0.09 0.00 0.00 178.44 180.02