#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jxc n TRP 122 N 0.00 2.33 -0.20 0.54 -0.00 -1.08 -4.63 117.44 114.40 2jxc n TRP 122 Ca 0.00 0.05 -0.06 0.00 -0.00 0.00 0.00 57.50 57.49 2jxc n TRP 122 Cb 0.00 -2.64 -0.00 0.00 -0.00 0.00 0.00 31.31 28.67 2jxc n TRP 122 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 177.69 177.69 2jxc h ALA 123 N 8.33 -0.10 -2.39 5.87 0.00 -1.20 -3.38 119.26 126.39 2jxc h ALA 123 Ca -0.47 0.15 -0.54 0.00 0.00 0.00 0.00 54.91 54.05 2jxc h ALA 123 Cb 1.26 0.81 0.01 0.00 0.00 0.00 0.00 17.79 19.88 2jxc h ALA 123 CO 0.93 -0.70 0.94 0.08 0.00 0.00 0.00 179.25 180.50 2jxc s VAL 124 N -5.97 3.38 -0.01 0.00 1.01 -1.26 -4.98 120.40 112.57 2jxc s VAL 124 Ca -0.14 0.76 -0.05 0.00 0.00 0.00 0.00 61.98 62.55 2jxc s VAL 124 Cb 0.15 -3.49 -0.04 0.00 0.00 0.00 0.00 36.38 33.00 2jxc s VAL 124 CO 0.69 -0.01 0.22 -0.54 0.00 0.00 0.00 175.10 175.46 2jxc s LYS 125 N 2.72 3.51 0.59 2.72 -0.14 -1.26 -4.86 119.74 123.01 2jxc s LYS 125 Ca 0.70 -0.19 0.31 0.00 -1.36 0.00 0.00 55.97 55.43 2jxc s LYS 125 Cb -0.36 -3.10 1.27 0.00 -1.68 0.00 0.00 37.83 33.97 2jxc s LYS 125 CO 0.29 0.67 1.59 -1.35 -0.76 0.00 0.00 175.35 175.80 2jxc h PRO 126 N 4.00 0.00 -0.40 -1.68 0.11 -1.94 1.30 132.00 133.39 2jxc h PRO 126 Ca -0.50 0.00 -0.15 0.00 0.11 0.00 0.00 66.00 65.46 2jxc h PRO 126 Cb 1.20 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.30 2jxc h PRO 126 CO 0.67 0.00 -0.34 1.49 -0.21 0.00 0.00 178.00 179.60 2jxc h GLU 127 N 0.00 0.91 0.03 1.05 4.81 -1.99 -1.66 114.58 117.73 2jxc h GLU 127 Ca 0.45 -0.45 -0.22 0.00 -0.13 0.00 0.00 59.36 59.00 2jxc h GLU 127 Cb 2.33 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 31.70 2jxc h GLU 127 CO -0.00 1.11 -0.99 -0.44 -0.73 0.00 0.00 179.01 177.95 2jxc h ASP 128 N 0.76 0.27 -0.30 1.04 3.32 0.11 -2.61 116.42 119.01 2jxc h ASP 128 Ca 0.07 -0.25 -0.00 0.00 0.02 0.00 0.00 57.03 56.87 2jxc h ASP 128 Cb 0.92 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 40.37 2jxc h ASP 128 CO 0.09 1.11 0.17 0.11 -1.72 0.00 0.00 179.24 178.99 2jxc h LYS 129 N 0.09 0.42 -0.97 3.56 1.79 -0.53 0.60 116.57 121.52 2jxc h LYS 129 Ca -0.06 -0.04 0.01 0.00 -2.18 0.00 0.00 60.65 58.38 2jxc h LYS 129 Cb 1.67 -0.08 -0.05 0.00 -1.58 0.00 0.00 32.23 32.19 2jxc h LYS 129 CO 0.15 0.34 0.64 0.00 -1.08 0.00 0.00 179.45 179.51 2jxc h ALA 130 N 1.05 1.24 -0.55 3.86 0.00 -1.31 0.42 119.26 123.97 2jxc h ALA 130 Ca 0.11 -0.06 -0.09 0.00 0.00 0.00 0.00 54.91 54.86 2jxc h ALA 130 Cb 0.04 -0.39 -0.02 0.00 0.00 0.00 0.00 17.79 17.43 2jxc h ALA 130 CO -0.02 0.61 -0.01 -0.22 0.00 0.00 0.00 179.25 179.61 2jxc h LYS 131 N 1.31 0.96 -0.03 0.00 3.64 -1.02 -2.22 116.57 119.21 2jxc h LYS 131 Ca 0.36 -0.29 -0.21 0.00 -1.27 0.00 0.00 60.65 59.24 2jxc h LYS 131 Cb -0.13 -0.09 -0.00 0.00 -0.41 0.00 0.00 32.23 31.60 2jxc h LYS 131 CO -0.08 0.96 -0.86 1.88 -2.27 0.00 0.00 179.45 179.07 2jxc h TYR 132 N 0.88 0.55 0.00 1.91 0.05 0.98 -2.39 116.97 118.95 2jxc h TYR 132 Ca 0.16 -0.28 -0.01 0.00 0.05 0.00 0.00 58.73 58.64 2jxc h TYR 132 Cb 0.54 -0.07 -0.00 0.00 1.01 0.00 0.00 36.73 38.20 2jxc h TYR 132 CO 0.03 1.08 -0.07 0.22 -1.05 0.00 0.00 178.16 178.38 2jxc h ASP 133 N 0.23 0.00 -0.01 3.88 1.82 -0.08 0.27 116.42 122.54 2jxc h ASP 133 Ca -0.06 0.00 -0.01 0.00 -0.39 0.00 0.00 57.03 56.57 2jxc h ASP 133 Cb 1.48 0.00 0.00 0.00 0.68 0.00 0.00 39.33 41.49 2jxc h ASP 133 CO 0.15 0.07 -0.02 0.00 -1.61 0.00 0.00 179.24 177.82 2jxc h ALA 134 N 1.93 0.01 -0.41 -0.78 0.00 -0.92 -0.37 119.26 118.73 2jxc h ALA 134 Ca -0.00 -0.33 -0.11 0.00 0.00 0.00 0.00 54.91 54.47 2jxc h ALA 134 Cb 0.14 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 2jxc h ALA 134 CO 0.01 -0.15 -0.19 -0.84 0.00 0.00 0.00 179.25 178.08 2jxc h ILE 135 N -0.60 1.27 0.44 0.00 3.07 -1.25 -2.39 117.51 118.04 2jxc h ILE 135 Ca -0.00 -1.29 -0.01 0.00 1.55 0.00 0.00 64.86 65.11 2jxc h ILE 135 Cb 0.67 1.16 -0.02 0.00 -0.27 0.00 0.00 36.82 38.35 2jxc h ILE 135 CO 0.01 0.43 -0.47 0.15 -1.05 0.00 0.00 178.15 177.22 2jxc h PHE 136 N 0.69 -1.30 0.00 0.16 3.04 -0.46 -2.85 116.94 116.22 2jxc h PHE 136 Ca 0.10 0.01 -0.03 0.00 3.98 0.00 0.00 57.97 62.03 2jxc h PHE 136 Cb 0.69 0.51 -0.00 0.00 2.56 0.00 0.00 35.95 39.71 2jxc h PHE 136 CO 0.04 -0.61 -0.14 0.22 -2.02 0.00 0.00 178.31 175.79 2jxc h ASP 137 N -0.91 0.00 0.55 0.41 3.58 -1.07 -1.67 116.42 117.31 2jxc h ASP 137 Ca -0.05 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.40 2jxc h ASP 137 Cb 0.80 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.85 2jxc h ASP 137 CO -0.07 0.14 0.00 -0.24 -2.88 0.00 0.00 179.24 176.18 2jxc n SER 138 N -3.71 0.66 -0.38 2.28 2.88 -0.90 -1.50 113.62 112.94 2jxc n SER 138 Ca -0.02 0.70 0.11 0.00 -1.33 0.00 0.00 58.87 58.33 2jxc n SER 138 Cb 0.25 -0.82 0.05 0.00 -0.75 0.00 0.00 64.21 62.94 2jxc n SER 138 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 2jxc n LEU 139 N -2.26 1.70 -3.00 2.46 4.77 -0.63 -5.01 117.00 115.02 2jxc n LEU 139 Ca 0.01 -0.62 -0.03 0.00 -0.03 0.00 0.00 56.01 55.34 2jxc n LEU 139 Cb 0.18 -0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.25 2jxc n LEU 139 CO 0.17 0.33 0.25 -1.20 -1.33 0.00 0.00 177.39 175.61 2jxc n SER 140 N -0.36 -7.83 -4.34 -1.43 7.64 -0.56 -5.00 113.62 101.74 2jxc n SER 140 Ca 0.09 0.11 -0.29 0.00 1.01 0.00 0.00 58.87 59.79 2jxc n SER 140 Cb 0.43 -5.31 0.22 0.00 -1.01 0.00 0.00 64.21 58.54 2jxc n SER 140 CO 0.00 0.00 0.00 -2.84 -3.01 0.00 0.00 175.04 169.19 2jxc s PRO 141 N -2.89 -0.59 -0.54 1.43 0.02 -1.26 -5.00 135.00 126.17 2jxc s PRO 141 Ca 0.08 0.40 -0.10 0.00 0.02 0.00 0.00 61.00 61.39 2jxc s PRO 141 Cb -0.02 -1.63 0.14 0.00 0.02 0.00 0.00 34.50 33.01 2jxc s PRO 141 CO 0.76 -3.39 0.43 0.08 -0.33 0.00 0.00 177.00 174.54 2jxc s VAL 142 N -2.81 4.47 -1.80 3.83 1.01 0.19 -4.60 120.40 120.68 2jxc s VAL 142 Ca 0.68 -1.94 0.00 0.00 0.00 0.00 0.00 61.98 60.72 2jxc s VAL 142 Cb -0.18 -3.90 0.00 0.00 0.00 0.00 0.00 36.38 32.30 2jxc s VAL 142 CO 0.59 -0.83 0.00 0.59 0.00 0.00 0.00 175.10 175.45 2jxc n ASN 143 N 4.72 -5.80 0.00 3.32 3.02 -1.26 -0.45 115.26 118.80 2jxc n ASN 143 Ca -0.05 0.04 0.00 0.00 -0.03 0.00 0.00 54.58 54.55 2jxc n ASN 143 Cb 0.41 -4.86 0.00 0.00 -0.61 0.00 0.00 39.78 34.72 2jxc n ASN 143 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2jxc n GLY 144 N -0.94 0.64 3.23 7.41 0.00 -1.26 -5.03 105.19 109.24 2jxc n GLY 144 Ca -0.24 -0.10 -0.28 0.00 0.00 0.00 0.00 46.02 45.39 2jxc n GLY 144 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2jxc s PHE 145 N -2.00 2.02 0.16 1.61 0.08 0.40 -1.91 117.98 118.34 2jxc s PHE 145 Ca 0.00 -0.46 0.09 0.00 0.12 0.00 0.00 56.93 56.68 2jxc s PHE 145 Cb 0.00 -1.32 -0.04 0.00 -0.57 0.00 0.00 43.02 41.09 2jxc s PHE 145 CO 0.00 -0.09 -0.12 -0.51 -0.10 0.00 0.00 175.22 174.40 2jxc s LEU 146 N -0.36 2.91 0.46 -0.37 1.43 -0.04 0.52 118.68 123.24 2jxc s LEU 146 Ca 0.04 -0.56 0.04 0.00 -1.03 0.00 0.00 54.13 52.62 2jxc s LEU 146 Cb -0.10 -1.64 -0.04 0.00 0.03 0.00 0.00 46.19 44.44 2jxc s LEU 146 CO 0.00 0.13 0.03 -0.94 0.23 0.00 0.00 176.35 175.80 2jxc s SER 147 N -2.61 4.06 0.23 2.29 1.04 -1.26 0.08 113.70 117.53 2jxc s SER 147 Ca 0.23 -1.49 -0.06 0.00 0.48 0.00 0.00 55.95 55.11 2jxc s SER 147 Cb -0.09 0.08 0.39 0.00 0.10 0.00 0.00 66.02 66.50 2jxc s SER 147 CO 0.14 -0.68 1.76 1.23 0.98 0.00 0.00 173.24 176.67 2jxc h GLY 148 N 1.51 1.11 2.00 7.32 0.00 -1.96 0.41 103.07 113.46 2jxc h GLY 148 Ca -0.44 -0.20 0.00 0.00 0.00 0.00 0.00 47.33 46.70 2jxc h GLY 148 CO 0.76 -0.00 0.00 1.29 0.00 0.00 0.00 176.54 178.59 2jxc h ASP 149 N 0.54 0.00 0.00 0.19 2.03 -1.97 0.33 116.42 117.55 2jxc h ASP 149 Ca 0.38 0.00 -0.36 0.00 -0.73 0.00 0.00 57.03 56.32 2jxc h ASP 149 Cb 0.48 0.00 -0.05 0.00 -0.83 0.00 0.00 39.33 38.93 2jxc h ASP 149 CO -0.32 0.00 -1.98 0.29 -1.03 0.00 0.00 179.24 176.19 2jxc n LYS 150 N -3.01 0.59 -0.14 4.15 5.02 -0.09 -4.57 118.16 120.10 2jxc n LYS 150 Ca -0.00 0.39 -0.12 0.00 -2.02 0.00 0.00 58.31 56.56 2jxc n LYS 150 Cb 0.24 -1.61 -0.02 0.00 -0.02 0.00 0.00 35.03 33.63 2jxc n LYS 150 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 2jxc h VAL 151 N -0.92 1.28 0.04 -0.18 2.07 -0.02 -2.92 116.25 115.59 2jxc h VAL 151 Ca -0.54 -1.41 0.03 0.00 0.82 0.00 0.00 66.70 65.59 2jxc h VAL 151 Cb 1.51 1.28 -0.04 0.00 -1.52 0.00 0.00 31.29 32.52 2jxc h VAL 151 CO -0.31 0.48 -0.29 0.50 0.02 0.00 0.00 177.57 177.97 2jxc h LYS 152 N 0.73 -0.45 0.00 1.57 3.11 -0.55 0.83 116.57 121.81 2jxc h LYS 152 Ca 0.09 0.03 -0.01 0.00 -2.81 0.00 0.00 60.65 57.94 2jxc h LYS 152 Cb 0.83 0.10 -0.00 0.00 -1.00 0.00 0.00 32.23 32.16 2jxc h LYS 152 CO 0.07 -0.30 -0.06 -1.35 -2.81 0.00 0.00 179.45 175.00 2jxc h PRO 153 N -0.46 0.00 -0.11 1.90 0.11 -1.75 0.30 132.00 131.98 2jxc h PRO 153 Ca 0.05 0.00 -0.24 0.00 0.11 0.00 0.00 66.00 65.92 2jxc h PRO 153 Cb 0.53 0.00 0.01 0.00 0.11 0.00 0.00 31.00 31.65 2jxc h PRO 153 CO -0.22 0.06 -0.86 0.28 -0.21 0.00 0.00 178.00 177.04 2jxc h VAL 154 N 0.00 1.28 -0.21 3.15 2.07 -1.07 -3.24 116.25 118.22 2jxc h VAL 154 Ca -0.00 -2.06 -0.03 0.00 0.82 0.00 0.00 66.70 65.43 2jxc h VAL 154 Cb 0.40 2.11 -0.01 0.00 -1.52 0.00 0.00 31.29 32.26 2jxc h VAL 154 CO 0.01 0.65 0.01 -0.07 0.02 0.00 0.00 177.57 178.19 2jxc h LEU 155 N 0.49 0.27 -1.06 2.57 3.38 0.30 0.19 115.31 121.46 2jxc h LEU 155 Ca -0.08 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.86 2jxc h LEU 155 Cb 1.50 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 42.18 2jxc h LEU 155 CO 0.17 0.32 0.00 0.18 0.09 0.00 0.00 178.44 179.20 2jxc n LEU 156 N -4.37 0.90 0.32 1.67 4.77 0.81 -3.32 117.00 117.79 2jxc n LEU 156 Ca 0.00 -0.45 0.21 0.00 -0.03 0.00 0.00 56.01 55.74 2jxc n LEU 156 Cb 0.18 -0.40 1.09 0.00 -2.33 0.00 0.00 43.42 41.96 2jxc n LEU 156 CO 0.37 0.21 1.14 -0.55 -1.33 0.00 0.00 177.39 177.23 2jxc h ASN 157 N 0.20 0.00 -0.78 -1.43 -0.00 -0.72 -3.45 115.58 109.41 2jxc h ASN 157 Ca 0.00 0.00 -0.55 0.00 -0.00 0.00 0.00 56.30 55.75 2jxc h ASN 157 Cb 0.43 0.00 -0.03 0.00 -0.00 0.00 0.00 38.32 38.72 2jxc h ASN 157 CO 0.00 0.00 -0.28 -0.94 -0.00 0.00 0.00 177.43 176.22 2jxc s SER 158 N -5.34 4.79 -0.00 6.14 1.04 -1.21 -4.99 113.70 114.13 2jxc s SER 158 Ca -0.04 -1.09 0.03 0.00 0.48 0.00 0.00 55.95 55.34 2jxc s SER 158 Cb 0.12 0.22 0.09 0.00 0.10 0.00 0.00 66.02 66.56 2jxc s SER 158 CO 0.45 -1.07 1.05 0.29 0.98 0.00 0.00 173.24 174.93 2jxc n LYS 159 N -1.82 1.24 -3.22 4.02 5.02 -1.26 -4.91 118.16 117.23 2jxc n LYS 159 Ca 0.03 -0.35 -0.39 0.00 -2.02 0.00 0.00 58.31 55.58 2jxc n LYS 159 Cb 0.63 -1.11 -0.06 0.00 -0.02 0.00 0.00 35.03 34.48 2jxc n LYS 159 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2jxc s LEU 160 N -0.96 4.54 0.74 -0.35 1.43 -1.26 -5.06 118.68 117.75 2jxc s LEU 160 Ca 0.07 1.34 -0.12 0.00 -1.03 0.00 0.00 54.13 54.38 2jxc s LEU 160 Cb 0.03 -2.98 0.04 0.00 0.03 0.00 0.00 46.19 43.31 2jxc s LEU 160 CO 0.04 0.26 1.10 -2.84 0.23 0.00 0.00 176.35 175.14 2jxc s PRO 161 N -1.13 2.42 0.62 1.29 0.02 -1.26 -4.87 135.00 132.09 2jxc s PRO 161 Ca 0.30 1.24 0.39 0.00 0.02 0.00 0.00 61.00 62.95 2jxc s PRO 161 Cb -0.20 -1.91 2.04 0.00 0.02 0.00 0.00 34.50 34.45 2jxc s PRO 161 CO 0.20 -1.52 2.25 -0.39 -0.33 0.00 0.00 177.00 177.21 2jxc h VAL 162 N -0.77 0.12 -0.37 3.83 -1.51 -1.97 -2.18 116.25 113.39 2jxc h VAL 162 Ca -0.44 -0.17 -0.00 0.00 -1.23 0.00 0.00 66.70 64.85 2jxc h VAL 162 Cb 1.24 1.15 -0.02 0.00 -2.13 0.00 0.00 31.29 31.53 2jxc h VAL 162 CO 0.52 0.01 0.21 -0.78 -1.23 0.00 0.00 177.57 176.31 2jxc h ASP 163 N 0.00 0.45 0.43 4.19 1.82 -1.99 0.39 116.42 121.72 2jxc h ASP 163 Ca -0.00 -0.07 -0.25 0.00 -0.39 0.00 0.00 57.03 56.32 2jxc h ASP 163 Cb 0.15 -0.11 0.01 0.00 0.68 0.00 0.00 39.33 40.05 2jxc h ASP 163 CO 0.00 0.39 -1.08 0.16 -1.61 0.00 0.00 179.24 177.10 2jxc h ILE 164 N 0.48 1.43 -0.57 2.25 -0.00 -1.79 -2.43 117.51 116.88 2jxc h ILE 164 Ca 0.13 -2.68 -0.05 0.00 -0.00 0.00 0.00 64.86 62.27 2jxc h ILE 164 Cb 0.03 2.64 -0.03 0.00 -0.00 0.00 0.00 36.82 39.46 2jxc h ILE 164 CO -0.02 0.79 0.16 -0.07 -0.00 0.00 0.00 178.15 179.01 2jxc h LEU 165 N 0.17 0.80 -0.25 0.16 3.38 -1.27 0.19 115.31 118.49 2jxc h LEU 165 Ca -0.11 -0.14 -0.10 0.00 0.09 0.00 0.00 57.88 57.63 2jxc h LEU 165 Cb 1.75 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 42.29 2jxc h LEU 165 CO 0.18 0.77 -0.23 1.23 0.09 0.00 0.00 178.44 180.48 2jxc h GLY 166 N 0.98 0.65 1.05 0.83 0.00 -0.18 0.64 103.07 107.03 2jxc h GLY 166 Ca 0.19 -0.65 -0.07 0.00 0.00 0.00 0.00 47.33 46.80 2jxc h GLY 166 CO -0.01 0.59 0.14 3.21 0.00 0.00 0.00 176.54 180.48 2jxc h ARG 167 N 0.30 1.06 -0.10 4.80 3.08 -1.11 -1.16 114.38 121.26 2jxc h ARG 167 Ca 0.04 -0.26 0.00 0.00 0.07 0.00 0.00 59.98 59.83 2jxc h ARG 167 Cb 0.78 -0.13 -0.00 0.00 0.08 0.00 0.00 29.97 30.69 2jxc h ARG 167 CO 0.06 0.96 0.06 0.28 -1.07 0.00 0.00 179.97 180.26 2jxc h VAL 168 N 0.98 1.04 -0.30 2.04 2.07 -0.59 -1.86 116.25 119.64 2jxc h VAL 168 Ca 0.20 -0.09 0.07 0.00 0.82 0.00 0.00 66.70 67.70 2jxc h VAL 168 Cb 0.39 0.93 -0.07 0.00 -1.52 0.00 0.00 31.29 31.01 2jxc h VAL 168 CO 0.01 0.04 -0.21 -0.25 0.02 0.00 0.00 177.57 177.17 2jxc h TRP 169 N 0.12 -0.54 0.00 1.57 2.91 -0.55 0.57 115.95 120.03 2jxc h TRP 169 Ca 0.04 0.04 -0.06 0.00 1.13 0.00 0.00 58.89 60.04 2jxc h TRP 169 Cb 0.01 0.28 -0.01 0.00 -0.51 0.00 0.00 29.16 28.93 2jxc h TRP 169 CO -0.07 -0.28 -0.28 0.93 -1.03 0.00 0.00 178.44 177.71 2jxc h GLU 170 N -0.18 0.00 0.00 2.65 4.39 -1.07 -0.95 114.58 119.42 2jxc h GLU 170 Ca 0.16 0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.83 2jxc h GLU 170 Cb 0.42 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.07 2jxc h GLU 170 CO -0.41 0.28 -0.14 -0.07 -1.16 0.00 0.00 179.01 177.51 2jxc h LEU 171 N 0.00 0.00 -1.13 1.33 4.07 -0.77 -3.38 115.31 115.43 2jxc h LEU 171 Ca -0.00 -0.91 -0.07 0.00 0.08 0.00 0.00 57.88 56.98 2jxc h LEU 171 Cb 0.51 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 42.24 2jxc h LEU 171 CO 0.04 1.04 -0.11 0.77 -1.08 0.00 0.00 178.44 179.10 2jxc h SER 172 N -1.00 0.46 -0.88 -0.43 4.64 0.29 -3.33 113.55 113.31 2jxc h SER 172 Ca -0.04 -0.11 -0.53 0.00 -0.47 0.00 0.00 61.79 60.64 2jxc h SER 172 Cb 1.00 -0.12 -0.08 0.00 -0.31 0.00 0.00 62.40 62.89 2jxc h SER 172 CO -0.02 0.61 1.50 -0.62 -0.87 0.00 0.00 176.83 177.43 2jxc s ASP 173 N -6.78 6.14 0.16 4.97 2.15 -0.38 -4.53 116.67 118.42 2jxc s ASP 173 Ca -0.07 -1.63 -0.21 0.00 0.43 0.00 0.00 52.55 51.07 2jxc s ASP 173 Cb 0.15 -2.57 0.07 0.00 -0.30 0.00 0.00 42.92 40.26 2jxc s ASP 173 CO 0.77 -1.86 1.62 0.40 -0.17 0.00 0.00 175.17 175.93 2jxc h ILE 174 N 6.44 0.35 -0.00 4.11 2.04 -1.87 -2.13 117.51 126.45 2jxc h ILE 174 Ca 0.26 0.00 0.00 0.00 1.00 0.00 0.00 64.86 66.12 2jxc h ILE 174 Cb 0.96 0.35 0.00 0.00 -0.74 0.00 0.00 36.82 37.39 2jxc h ILE 174 CO 1.37 0.00 -0.34 -0.90 0.00 0.00 0.00 178.15 178.28 2jxc n ASP 175 N -5.39 0.78 -3.70 1.72 5.75 -1.26 -4.93 116.55 109.52 2jxc n ASP 175 Ca 0.01 -0.61 -0.25 0.00 -0.01 0.00 0.00 54.79 53.93 2jxc n ASP 175 Cb 0.31 0.16 0.06 0.00 -1.03 0.00 0.00 41.12 40.61 2jxc n ASP 175 CO 0.00 0.00 0.00 1.41 -0.11 0.00 0.00 177.20 178.50 2jxc n HIS 176 N -1.00 -2.47 1.58 2.11 8.25 -0.80 -4.86 115.22 118.02 2jxc n HIS 176 Ca 0.10 0.95 0.15 0.00 -0.26 0.00 0.00 57.72 58.65 2jxc n HIS 176 Cb 0.34 -4.59 0.76 0.00 1.12 0.00 0.00 29.99 27.62 2jxc n HIS 176 CO 0.00 0.00 0.00 -0.40 0.64 0.00 0.00 176.34 176.58 2jxc n ASP 177 N -2.97 0.18 0.00 0.41 5.75 -1.26 -4.86 116.55 113.80 2jxc n ASP 177 Ca -0.06 -0.54 0.00 0.00 -0.01 0.00 0.00 54.79 54.19 2jxc n ASP 177 Cb 0.58 -0.14 0.00 0.00 -1.03 0.00 0.00 41.12 40.53 2jxc n ASP 177 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2jxc n GLY 178 N 1.20 0.71 3.27 6.12 0.00 -1.26 -5.03 105.19 110.21 2jxc n GLY 178 Ca 0.17 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.04 2jxc n GLY 178 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2jxc s MET 179 N -0.58 1.20 -0.26 1.61 -1.94 -1.26 -4.46 119.30 113.60 2jxc s MET 179 Ca 0.00 -1.59 -0.02 0.00 -1.71 0.00 0.00 55.69 52.38 2jxc s MET 179 Cb 0.00 -0.41 0.03 0.00 2.01 0.00 0.00 34.83 36.46 2jxc s MET 179 CO 0.00 -0.11 -0.04 -0.51 -0.01 0.00 0.00 175.02 174.35 2jxc s LEU 180 N -3.22 3.33 0.86 -0.03 1.43 0.11 -4.82 118.68 116.33 2jxc s LEU 180 Ca 0.25 -0.91 -0.12 0.00 -1.03 0.00 0.00 54.13 52.33 2jxc s LEU 180 Cb 0.06 -1.68 0.11 0.00 0.03 0.00 0.00 46.19 44.70 2jxc s LEU 180 CO 0.06 -0.15 1.10 -0.62 0.23 0.00 0.00 176.35 176.97 2jxc s ASP 181 N 1.33 3.90 0.35 2.29 2.15 -1.26 -0.86 116.67 124.57 2jxc s ASP 181 Ca -0.00 1.32 0.13 0.00 0.43 0.00 0.00 52.55 54.42 2jxc s ASP 181 Cb -0.17 -2.01 0.95 0.00 -0.30 0.00 0.00 42.92 41.38 2jxc s ASP 181 CO -0.04 -2.35 1.77 -0.09 -0.17 0.00 0.00 175.17 174.29 2jxc h ARG 182 N -1.35 0.53 -0.04 4.34 2.43 -1.78 0.36 114.38 118.86 2jxc h ARG 182 Ca -0.49 -0.03 -0.07 0.00 -0.81 0.00 0.00 59.98 58.58 2jxc h ARG 182 Cb 1.29 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 30.72 2jxc h ARG 182 CO 0.58 0.35 -0.26 -0.44 -1.51 0.00 0.00 179.97 178.69 2jxc h ASP 183 N 0.55 0.30 -0.68 -3.80 3.32 -1.91 -2.63 116.42 111.56 2jxc h ASP 183 Ca 0.59 -0.68 0.00 0.00 0.02 0.00 0.00 57.03 56.97 2jxc h ASP 183 Cb 1.24 -0.09 -0.03 0.00 0.22 0.00 0.00 39.33 40.67 2jxc h ASP 183 CO -0.36 0.93 0.43 -0.33 -1.72 0.00 0.00 179.24 178.19 2jxc h GLU 184 N -0.32 0.91 -0.05 3.56 5.08 -1.33 -1.66 114.58 120.78 2jxc h GLU 184 Ca -0.02 -0.07 -0.20 0.00 -1.00 0.00 0.00 59.36 58.08 2jxc h GLU 184 Cb 0.93 -0.20 -0.00 0.00 0.50 0.00 0.00 28.75 29.98 2jxc h GLU 184 CO 0.05 0.62 -0.81 0.35 -1.00 0.00 0.00 179.01 178.23 2jxc h PHE 185 N 0.92 0.54 -0.79 4.33 3.57 -0.48 -1.81 116.94 123.22 2jxc h PHE 185 Ca 0.25 -0.26 0.06 0.00 3.53 0.00 0.00 57.97 61.54 2jxc h PHE 185 Cb -0.07 -0.07 -0.05 0.00 2.79 0.00 0.00 35.95 38.54 2jxc h PHE 185 CO -0.02 1.04 0.52 0.00 -2.23 0.00 0.00 178.31 177.62 2jxc h ALA 186 N 0.88 1.60 0.13 2.41 0.00 -1.06 0.27 119.26 123.49 2jxc h ALA 186 Ca -0.05 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.84 2jxc h ALA 186 Cb 1.40 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.96 2jxc h ALA 186 CO 0.14 0.28 -0.08 0.28 0.00 0.00 0.00 179.25 179.87 2jxc h VAL 187 N 0.89 0.83 0.42 0.00 2.07 -0.85 -1.46 116.25 118.15 2jxc h VAL 187 Ca 0.34 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.84 2jxc h VAL 187 Cb 0.19 0.83 0.00 0.00 -1.52 0.00 0.00 31.29 30.79 2jxc h VAL 187 CO -0.11 0.00 -0.21 0.00 0.02 0.00 0.00 177.57 177.26 2jxc h ALA 188 N 0.67 -0.58 0.00 1.67 0.00 -0.29 -2.34 119.26 118.39 2jxc h ALA 188 Ca -0.01 -0.12 -0.08 0.00 0.00 0.00 0.00 54.91 54.70 2jxc h ALA 188 Cb 0.17 0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 2jxc h ALA 188 CO 0.01 -0.83 -0.36 0.52 0.00 0.00 0.00 179.25 178.59 2jxc h MET 189 N -0.58 0.00 -0.56 0.00 2.86 -0.60 -0.85 114.93 115.19 2jxc h MET 189 Ca -0.05 0.00 -0.05 0.00 -2.06 0.00 0.00 59.70 57.54 2jxc h MET 189 Cb 0.46 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.09 2jxc h MET 189 CO 0.08 0.36 0.16 0.35 1.06 0.00 0.00 176.91 178.92 2jxc h PHE 190 N 0.00 0.88 0.00 -0.22 3.57 -1.09 -2.09 116.94 117.99 2jxc h PHE 190 Ca -0.00 -0.08 -0.09 0.00 3.53 0.00 0.00 57.97 61.33 2jxc h PHE 190 Cb 0.70 -0.26 -0.01 0.00 2.79 0.00 0.00 35.95 39.17 2jxc h PHE 190 CO 0.00 0.72 -0.43 -0.07 -2.23 0.00 0.00 178.31 176.30 2jxc h LEU 191 N 0.83 0.00 -0.22 0.59 3.38 -0.62 0.47 115.31 119.74 2jxc h LEU 191 Ca 0.19 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 58.02 2jxc h LEU 191 Cb 0.27 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.02 2jxc h LEU 191 CO -0.01 0.43 -0.40 0.58 0.09 0.00 0.00 178.44 179.13 2jxc h VAL 192 N 0.00 1.32 -0.22 1.22 2.07 -0.90 -1.64 116.25 118.09 2jxc h VAL 192 Ca -0.00 -1.62 -0.12 0.00 0.82 0.00 0.00 66.70 65.77 2jxc h VAL 192 Cb 0.98 1.81 -0.01 0.00 -1.52 0.00 0.00 31.29 32.55 2jxc h VAL 192 CO 0.06 0.51 -0.37 1.88 0.02 0.00 0.00 177.57 179.66 2jxc h TYR 193 N 0.36 0.58 -0.76 1.57 0.05 -1.24 -2.38 116.97 115.14 2jxc h TYR 193 Ca 0.01 -0.16 0.06 0.00 0.05 0.00 0.00 58.73 58.69 2jxc h TYR 193 Cb 1.00 -0.13 -0.06 0.00 1.01 0.00 0.00 36.73 38.56 2jxc h TYR 193 CO 0.09 0.80 0.46 0.00 -1.05 0.00 0.00 178.16 178.45 2jxc h ALA 195 N 1.37 0.91 -0.05 0.00 0.00 -1.23 0.14 119.26 120.41 2jxc h ALA 195 Ca 0.33 -0.56 -0.12 0.00 0.00 0.00 0.00 54.91 54.56 2jxc h ALA 195 Cb 0.16 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 2jxc h ALA 195 CO -0.17 0.76 -0.53 -0.07 0.00 0.00 0.00 179.25 179.24 2jxc h LEU 196 N 0.08 0.14 -1.39 0.00 -0.00 -0.58 -2.02 115.31 111.55 2jxc h LEU 196 Ca -0.01 -0.07 0.00 0.00 -0.00 0.00 0.00 57.88 57.80 2jxc h LEU 196 Cb 1.11 -0.04 0.00 0.00 -0.00 0.00 0.00 40.66 41.73 2jxc h LEU 196 CO 0.09 0.65 0.00 -1.84 -0.00 0.00 0.00 178.44 177.34 2jxc n GLU 197 N -3.92 1.94 -1.97 1.13 0.28 0.11 -4.90 120.64 113.31 2jxc n GLU 197 Ca -0.02 -1.25 -0.13 0.00 -0.16 0.00 0.00 57.16 55.59 2jxc n GLU 197 Cb 0.55 -1.35 -0.02 0.00 1.43 0.00 0.00 31.44 32.05 2jxc n GLU 197 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 2jxc n LYS 198 N 0.46 -1.02 -2.99 3.44 4.76 -0.76 -5.01 118.16 117.04 2jxc n LYS 198 Ca 0.12 0.76 -0.36 0.00 -2.87 0.00 0.00 58.31 55.95 2jxc n LYS 198 Cb 0.35 -4.94 -0.06 0.00 -1.84 0.00 0.00 35.03 28.53 2jxc n LYS 198 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 2jxc s GLU 199 N -4.16 4.35 0.04 1.97 0.41 0.48 -5.00 118.70 116.79 2jxc s GLU 199 Ca 0.00 1.02 -0.31 0.00 -0.41 0.00 0.00 54.97 55.27 2jxc s GLU 199 Cb 0.00 -2.81 -0.07 0.00 -1.78 0.00 0.00 34.13 29.47 2jxc s GLU 199 CO 0.00 0.33 1.46 -1.25 -0.49 0.00 0.00 175.26 175.32 2jxc s PRO 200 N -2.08 4.27 -0.28 0.39 0.04 -1.26 -4.12 135.00 131.95 2jxc s PRO 200 Ca 0.46 2.08 -0.21 0.00 0.04 0.00 0.00 61.00 63.38 2jxc s PRO 200 Cb -0.17 -3.51 -0.01 0.00 0.04 0.00 0.00 34.50 30.85 2jxc s PRO 200 CO 0.21 -0.59 0.66 0.08 0.04 0.00 0.00 177.00 177.40 2jxc s VAL 201 N 2.19 4.94 0.52 -0.36 1.01 -1.26 -5.01 120.40 122.42 2jxc s VAL 201 Ca 0.67 1.05 -0.21 0.00 0.00 0.00 0.00 61.98 63.49 2jxc s VAL 201 Cb -0.35 -3.99 -0.06 0.00 0.00 0.00 0.00 36.38 31.98 2jxc s VAL 201 CO 0.29 -0.08 1.17 -2.84 0.00 0.00 0.00 175.10 173.64 2jxc s PRO 202 N 2.62 3.45 0.00 2.72 0.02 -1.26 -4.95 135.00 137.60 2jxc s PRO 202 Ca 0.27 1.74 0.19 0.00 0.02 0.00 0.00 61.00 63.22 2jxc s PRO 202 Cb -0.15 -2.17 0.02 0.00 0.02 0.00 0.00 34.50 32.22 2jxc s PRO 202 CO 0.10 -0.80 0.99 -1.33 -0.33 0.00 0.00 177.00 175.63 2jxc n MET 203 N -0.99 1.52 -4.41 5.54 2.81 -1.26 -4.89 117.12 115.43 2jxc n MET 203 Ca 0.10 -1.02 -0.32 0.00 -1.81 0.00 0.00 57.70 54.66 2jxc n MET 203 Cb 0.49 -1.37 -0.10 0.00 -0.71 0.00 0.00 33.22 31.53 2jxc n MET 203 CO 0.00 0.00 0.00 -1.12 1.51 0.00 0.00 175.97 176.36 2jxc s SER 204 N -2.09 4.61 -0.21 7.83 0.01 -1.26 -5.02 113.70 117.57 2jxc s SER 204 Ca 0.17 -0.18 -0.31 0.00 1.31 0.00 0.00 55.95 56.94 2jxc s SER 204 Cb 0.15 -1.05 -0.08 0.00 0.21 0.00 0.00 66.02 65.26 2jxc s SER 204 CO 0.45 0.26 2.15 -0.11 0.41 0.00 0.00 173.24 176.40 2jxc n LEU 205 N 1.39 3.12 -4.59 2.44 -0.00 -1.26 -4.91 117.00 113.19 2jxc n LEU 205 Ca -0.15 0.41 -0.43 0.00 -0.00 0.00 0.00 56.01 55.85 2jxc n LEU 205 Cb 0.52 -1.46 -0.02 0.00 -0.00 0.00 0.00 43.42 42.46 2jxc n LEU 205 CO 0.31 -0.53 1.00 -2.84 -0.00 0.00 0.00 177.39 175.33 2jxc s PRO 206 N 5.87 3.65 0.52 1.96 0.02 -1.26 -4.90 135.00 140.85 2jxc s PRO 206 Ca 1.01 0.43 0.35 0.00 0.02 0.00 0.00 61.00 62.80 2jxc s PRO 206 Cb -0.51 -3.94 1.73 0.00 0.02 0.00 0.00 34.50 31.80 2jxc s PRO 206 CO 0.41 -1.43 2.05 -1.35 -0.33 0.00 0.00 177.00 176.35 2jxc h PRO 207 N 9.28 0.00 -0.01 5.54 0.11 -1.93 0.26 132.00 145.24 2jxc h PRO 207 Ca -0.24 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.88 2jxc h PRO 207 Cb 1.06 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.17 2jxc h PRO 207 CO 1.13 0.00 0.08 0.00 -0.21 0.00 0.00 178.00 178.99 2jxc h ALA 208 N 2.03 1.18 0.00 -0.75 0.00 -1.90 -2.16 119.26 117.66 2jxc h ALA 208 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2jxc h ALA 208 Cb 0.18 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.97 2jxc h ALA 208 CO 0.00 -0.08 -0.01 1.47 0.00 0.00 0.00 179.25 180.63 2jxc n LEU 209 N -3.19 2.09 -4.47 0.00 -0.00 0.89 -0.67 117.00 111.65 2jxc n LEU 209 Ca -0.02 -2.45 -0.43 0.00 -0.00 0.00 0.00 56.01 53.10 2jxc n LEU 209 Cb 0.15 -0.20 -0.06 0.00 -0.00 0.00 0.00 43.42 43.31 2jxc n LEU 209 CO 0.20 0.58 0.41 0.54 -0.00 0.00 0.00 177.39 179.12 2jxc s VAL 210 N -1.83 4.79 -0.44 1.47 0.11 -0.81 -4.79 120.40 118.89 2jxc s VAL 210 Ca 0.15 -0.25 -0.41 0.00 -2.93 0.00 0.00 61.98 58.53 2jxc s VAL 210 Cb 0.13 -4.32 -0.16 0.00 -1.53 0.00 0.00 36.38 30.50 2jxc s VAL 210 CO 0.01 -0.81 2.12 -2.65 -3.33 0.00 0.00 175.10 170.44 2jxc n PRO 211 N 6.40 0.41 -0.23 1.54 -0.02 -1.26 -4.80 135.00 137.04 2jxc n PRO 211 Ca -0.04 0.12 0.31 0.00 -2.02 0.00 0.00 63.50 61.87 2jxc n PRO 211 Cb 0.46 -1.85 0.72 0.00 -0.02 0.00 0.00 33.50 32.82 2jxc n PRO 211 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 2jxc h PRO 212 N 9.89 0.00 0.00 0.52 0.11 -1.93 0.51 132.00 141.10 2jxc h PRO 212 Ca -0.19 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 65.85 2jxc h PRO 212 Cb 1.38 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.48 2jxc h PRO 212 CO 1.06 0.00 -0.35 1.03 -0.21 0.00 0.00 178.00 179.53 2jxc h SER 213 N 0.00 0.00 -0.99 -2.05 0.87 -2.04 -3.07 113.55 106.28 2jxc h SER 213 Ca 0.48 0.00 -0.51 0.00 -1.23 0.00 0.00 61.79 60.53 2jxc h SER 213 Cb 2.05 0.00 -0.30 0.00 -0.44 0.00 0.00 62.40 63.71 2jxc h SER 213 CO -0.01 0.35 0.64 0.29 -0.53 0.00 0.00 176.83 177.58 2jxc n LYS 214 N -3.49 2.31 0.00 2.24 4.76 0.18 -5.30 118.16 118.86 2jxc n LYS 214 Ca -0.00 -3.01 0.13 0.00 -2.87 0.00 0.00 58.31 52.56 2jxc n LYS 214 Cb 0.50 -2.18 0.34 0.00 -1.84 0.00 0.00 35.03 31.85 2jxc n LYS 214 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57