#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3jxj s LYS 133 N 0.00 4.57 -0.03 2.12 2.20 -1.26 -5.05 119.74 122.28 3jxj s LYS 133 Ca 0.00 1.80 0.06 0.00 -0.36 0.00 0.00 55.97 57.47 3jxj s LYS 133 Cb 0.00 -3.11 -0.01 0.00 -1.51 0.00 0.00 37.83 33.19 3jxj s LYS 133 CO 0.00 0.15 -0.23 0.08 -0.36 0.00 0.00 175.35 174.99 3jxj s VAL 134 N -1.21 1.85 0.23 4.02 1.01 -1.26 -4.80 120.40 120.24 3jxj s VAL 134 Ca 0.46 -0.98 0.11 0.00 0.00 0.00 0.00 61.98 61.57 3jxj s VAL 134 Cb -0.31 -1.55 -0.05 0.00 0.00 0.00 0.00 36.38 34.47 3jxj s VAL 134 CO 0.40 0.52 -0.19 -0.36 0.00 0.00 0.00 175.10 175.48 3jxj s PHE 135 N -0.35 2.37 0.33 5.22 0.08 -1.26 -5.10 117.98 119.27 3jxj s PHE 135 Ca 0.04 -0.32 -0.07 0.00 0.12 0.00 0.00 56.93 56.70 3jxj s PHE 135 Cb -0.11 -1.11 0.01 0.00 -0.57 0.00 0.00 43.02 41.25 3jxj s PHE 135 CO 0.01 0.59 0.53 0.54 -0.10 0.00 0.00 175.22 176.79 3jxj s ASN 136 N -3.08 0.56 0.11 1.36 2.20 -1.26 -5.04 114.94 109.78 3jxj s ASN 136 Ca 0.26 -1.32 -0.33 0.00 -0.94 0.00 0.00 52.86 50.53 3jxj s ASN 136 Cb -0.07 0.68 -0.12 0.00 -2.00 0.00 0.00 41.25 39.75 3jxj s ASN 136 CO 0.13 -1.34 1.58 -0.09 -2.94 0.00 0.00 177.10 174.44 3jxj h ARG 137 N 2.12 -0.69 -0.81 3.55 2.43 -1.96 -0.07 114.38 118.95 3jxj h ARG 137 Ca -0.29 0.05 0.05 0.00 -0.81 0.00 0.00 59.98 58.99 3jxj h ARG 137 Cb 1.24 0.16 -0.05 0.00 -0.42 0.00 0.00 29.97 30.90 3jxj h ARG 137 CO 0.39 -0.46 0.53 -1.00 -1.51 0.00 0.00 179.97 177.92 3jxj h PRO 138 N -0.72 0.90 -0.21 0.20 0.13 -1.98 0.42 132.00 130.74 3jxj h PRO 138 Ca 0.01 -0.05 -0.03 0.00 -0.87 0.00 0.00 66.00 65.06 3jxj h PRO 138 Cb 0.72 -0.20 -0.01 0.00 0.13 0.00 0.00 31.00 31.64 3jxj h PRO 138 CO -0.25 0.59 0.03 0.82 -0.23 0.00 0.00 178.00 178.97 3jxj h ILE 139 N 0.92 1.23 -0.57 -3.56 2.04 -1.89 -0.49 117.51 115.18 3jxj h ILE 139 Ca 0.34 -0.76 -0.09 0.00 1.00 0.00 0.00 64.86 65.36 3jxj h ILE 139 Cb 0.17 1.32 -0.02 0.00 -0.74 0.00 0.00 36.82 37.55 3jxj h ILE 139 CO -0.11 0.23 0.01 0.25 0.00 0.00 0.00 178.15 178.53 3jxj h LEU 140 N 0.14 0.98 -0.63 1.44 5.85 0.07 -1.93 115.31 121.24 3jxj h LEU 140 Ca 0.06 -0.30 -0.15 0.00 0.84 0.00 0.00 57.88 58.33 3jxj h LEU 140 Cb 0.32 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.08 3jxj h LEU 140 CO 0.00 1.04 -0.54 -0.26 -0.34 0.00 0.00 178.44 178.35 3jxj h PHE 141 N 0.89 0.51 0.03 1.25 -1.00 -0.18 -1.77 116.94 116.68 3jxj h PHE 141 Ca 0.16 -0.18 -0.00 0.00 2.81 0.00 0.00 57.97 60.76 3jxj h PHE 141 Cb 0.53 -0.10 0.00 0.00 3.61 0.00 0.00 35.95 40.00 3jxj h PHE 141 CO 0.04 0.86 -0.02 0.22 -1.61 0.00 0.00 178.31 177.80 3jxj h ASP 142 N 0.32 -0.04 -0.24 2.17 3.58 -0.98 -1.77 116.42 119.46 3jxj h ASP 142 Ca 0.01 -0.21 0.01 0.00 0.42 0.00 0.00 57.03 57.27 3jxj h ASP 142 Cb 1.05 0.01 -0.02 0.00 1.72 0.00 0.00 39.33 42.09 3jxj h ASP 142 CO 0.09 0.18 0.13 0.40 -2.88 0.00 0.00 179.24 177.16 3jxj h ILE 143 N -0.26 1.00 -0.07 2.25 2.04 -1.25 -1.79 117.51 119.43 3jxj h ILE 143 Ca -0.00 -0.09 -0.13 0.00 1.00 0.00 0.00 64.86 65.63 3jxj h ILE 143 Cb 0.24 0.71 -0.01 0.00 -0.74 0.00 0.00 36.82 37.02 3jxj h ILE 143 CO 0.01 0.05 -0.54 -0.37 0.00 0.00 0.00 178.15 177.29 3jxj h VAL 144 N 0.26 1.37 -0.07 1.67 -1.51 -1.37 0.21 116.25 116.82 3jxj h VAL 144 Ca 0.10 -1.84 -0.14 0.00 -1.23 0.00 0.00 66.70 63.59 3jxj h VAL 144 Cb 0.02 1.91 -0.01 0.00 -2.13 0.00 0.00 31.29 31.08 3jxj h VAL 144 CO -0.06 0.54 -0.57 0.77 -1.23 0.00 0.00 177.57 177.02 3jxj h SER 145 N 0.17 0.23 0.86 4.19 4.64 -1.07 -2.84 113.55 119.72 3jxj h SER 145 Ca 0.00 -0.12 -0.22 0.00 -0.47 0.00 0.00 61.79 60.98 3jxj h SER 145 Cb 1.01 -0.07 -0.02 0.00 -0.31 0.00 0.00 62.40 63.01 3jxj h SER 145 CO 0.08 0.75 -1.02 0.03 -0.87 0.00 0.00 176.83 175.80 3jxj h ARG 146 N 0.16 0.08 -1.11 4.77 3.08 -1.16 -3.46 114.38 116.74 3jxj h ARG 146 Ca -0.00 -0.13 0.00 0.00 0.07 0.00 0.00 59.98 59.92 3jxj h ARG 146 Cb 1.04 0.05 0.00 0.00 0.08 0.00 0.00 29.97 31.14 3jxj h ARG 146 CO 0.09 1.03 0.00 0.41 -1.07 0.00 0.00 179.97 180.42 3jxj n GLY 147 N 1.29 0.74 3.34 0.04 0.00 0.04 -5.04 105.19 105.59 3jxj n GLY 147 Ca -0.02 -0.45 -0.39 0.00 0.00 0.00 0.00 46.02 45.15 3jxj n GLY 147 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3jxj s SER 148 N -2.66 5.54 0.38 1.61 0.15 -1.05 -4.36 113.70 113.32 3jxj s SER 148 Ca 0.00 -1.01 0.20 0.00 0.70 0.00 0.00 55.95 55.84 3jxj s SER 148 Cb 0.00 -1.96 0.60 0.00 -1.71 0.00 0.00 66.02 62.95 3jxj s SER 148 CO 0.00 -0.35 1.69 1.55 1.20 0.00 0.00 173.24 177.33 3jxj h PRO 149 N 8.34 0.00 0.00 5.44 0.13 -1.90 -3.17 132.00 140.85 3jxj h PRO 149 Ca -0.25 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.85 3jxj h PRO 149 Cb 1.10 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.22 3jxj h PRO 149 CO 0.64 0.32 -0.14 -0.44 -0.23 0.00 0.00 178.00 178.14 3jxj h ASP 150 N 0.00 0.00 0.88 1.44 5.19 -1.96 -1.62 116.42 120.34 3jxj h ASP 150 Ca -0.00 0.00 -0.02 0.00 -0.62 0.00 0.00 57.03 56.39 3jxj h ASP 150 Cb 0.98 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 40.48 3jxj h ASP 150 CO 0.04 0.14 -0.10 1.23 -3.12 0.00 0.00 179.24 177.44 3jxj h GLY 151 N 0.64 0.00 -0.25 2.75 0.00 -1.96 -3.18 103.07 101.08 3jxj h GLY 151 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3jxj h GLY 151 CO 0.02 0.00 0.00 1.04 0.00 0.00 0.00 176.54 177.60 3jxj n LEU 152 N -3.27 1.04 -4.77 3.11 4.77 -0.61 -4.88 117.00 112.40 3jxj n LEU 152 Ca 0.00 -0.42 -0.40 0.00 -0.03 0.00 0.00 56.01 55.16 3jxj n LEU 152 Cb 0.34 -0.06 -0.03 0.00 -2.33 0.00 0.00 43.42 41.35 3jxj n LEU 152 CO 0.30 0.21 0.92 -1.83 -1.33 0.00 0.00 177.39 175.66 3jxj s GLU 153 N -1.89 4.40 0.00 3.23 -1.05 -1.20 -2.63 118.70 119.55 3jxj s GLU 153 Ca 0.32 2.09 0.00 0.00 -0.15 0.00 0.00 54.97 57.24 3jxj s GLU 153 Cb 0.17 -3.07 0.00 0.00 -0.44 0.00 0.00 34.13 30.78 3jxj s GLU 153 CO 0.26 -0.10 0.00 0.41 0.95 0.00 0.00 175.26 176.78 3jxj n GLY 154 N 0.88 1.40 0.18 -3.83 0.00 -1.26 -4.90 105.19 97.65 3jxj n GLY 154 Ca 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.84 3jxj n GLY 154 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3jxj h LEU 155 N 0.00 0.74 -0.10 0.99 5.85 -1.85 -2.17 115.31 118.77 3jxj h LEU 155 Ca 0.00 -0.70 0.01 0.00 0.84 0.00 0.00 57.88 58.04 3jxj h LEU 155 Cb 0.00 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 40.79 3jxj h LEU 155 CO 0.00 1.32 0.01 0.25 -0.34 0.00 0.00 178.44 179.68 3jxj h LEU 156 N 0.21 -0.02 -0.99 2.25 5.85 -1.91 -1.26 115.31 119.44 3jxj h LEU 156 Ca -0.07 0.02 0.06 0.00 0.84 0.00 0.00 57.88 58.73 3jxj h LEU 156 Cb 1.38 0.03 -0.07 0.00 0.37 0.00 0.00 40.66 42.38 3jxj h LEU 156 CO 0.14 0.01 0.64 0.28 -0.34 0.00 0.00 178.44 179.17 3jxj h SER 157 N 0.05 1.03 -0.51 1.25 0.02 -1.95 0.21 113.55 113.65 3jxj h SER 157 Ca 0.05 0.01 -0.07 0.00 -0.84 0.00 0.00 61.79 60.93 3jxj h SER 157 Cb 0.05 -0.22 -0.02 0.00 0.14 0.00 0.00 62.40 62.35 3jxj h SER 157 CO -0.07 0.67 0.06 0.15 -1.14 0.00 0.00 176.83 176.50 3jxj h PHE 158 N 1.18 0.93 -0.56 3.45 3.57 -1.11 -1.16 116.94 123.24 3jxj h PHE 158 Ca 0.42 -0.14 -0.11 0.00 3.53 0.00 0.00 57.97 61.67 3jxj h PHE 158 Cb 0.13 -0.25 -0.02 0.00 2.79 0.00 0.00 35.95 38.60 3jxj h PHE 158 CO -0.00 0.85 -0.09 -0.07 -2.23 0.00 0.00 178.31 176.77 3jxj h LEU 159 N 0.75 1.04 -0.15 0.59 3.38 0.03 -2.38 115.31 118.57 3jxj h LEU 159 Ca 0.15 -0.34 -0.03 0.00 0.09 0.00 0.00 57.88 57.76 3jxj h LEU 159 Cb 0.44 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 3jxj h LEU 159 CO 0.02 1.14 -0.01 -0.07 0.09 0.00 0.00 178.44 179.60 3jxj h LEU 160 N 0.93 0.27 -0.63 1.67 4.07 -0.38 -1.18 115.31 120.06 3jxj h LEU 160 Ca 0.15 -0.33 -0.11 0.00 0.08 0.00 0.00 57.88 57.67 3jxj h LEU 160 Cb 0.66 -0.07 -0.02 0.00 1.08 0.00 0.00 40.66 42.31 3jxj h LEU 160 CO 0.05 0.53 -0.52 0.71 -1.08 0.00 0.00 178.44 178.13 3jxj h THR 161 N 0.00 1.10 -0.12 0.22 1.35 -1.21 -3.11 112.91 111.15 3jxj h THR 161 Ca 0.04 -1.99 0.00 0.00 -0.55 0.00 0.00 66.41 63.91 3jxj h THR 161 Cb 0.40 2.17 0.00 0.00 -1.73 0.00 0.00 68.15 68.99 3jxj h THR 161 CO 0.01 0.51 0.00 1.41 -0.25 0.00 0.00 175.52 177.20 3jxj n HIS 162 N -3.52 0.13 -3.67 4.73 8.25 -0.90 -4.99 115.22 115.25 3jxj n HIS 162 Ca -0.00 -0.07 -0.24 0.00 -0.26 0.00 0.00 57.72 57.15 3jxj n HIS 162 Cb 0.62 0.00 0.06 0.00 1.12 0.00 0.00 29.99 31.79 3jxj n HIS 162 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 3jxj n LYS 163 N 1.02 -6.55 -4.44 -0.41 5.02 -0.92 -5.02 118.16 106.86 3jxj n LYS 163 Ca 0.16 0.73 -0.25 0.00 -2.02 0.00 0.00 58.31 56.94 3jxj n LYS 163 Cb 0.52 -5.66 -0.09 0.00 -0.02 0.00 0.00 35.03 29.78 3jxj n LYS 163 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 3jxj s LYS 164 N -6.17 1.92 0.15 1.97 1.02 -0.49 -5.06 119.74 113.08 3jxj s LYS 164 Ca 0.40 -1.80 0.01 0.00 0.02 0.00 0.00 55.97 54.60 3jxj s LYS 164 Cb -0.19 -1.83 -0.04 0.00 -0.52 0.00 0.00 37.83 35.24 3jxj s LYS 164 CO 0.77 0.19 0.01 1.03 -0.92 0.00 0.00 175.35 176.44 3jxj s ARG 165 N -3.63 1.03 0.21 1.68 0.52 -1.26 -4.59 118.95 112.91 3jxj s ARG 165 Ca 0.33 -1.49 0.25 0.00 -0.52 0.00 0.00 55.73 54.29 3jxj s ARG 165 Cb -0.01 -0.10 0.91 0.00 0.52 0.00 0.00 34.95 36.27 3jxj s ARG 165 CO 0.17 -0.16 1.74 1.28 0.02 0.00 0.00 175.30 178.35 3jxj n LEU 166 N -0.18 0.67 -0.01 2.53 4.77 -1.26 -2.42 117.00 121.10 3jxj n LEU 166 Ca -0.07 0.61 0.13 0.00 -0.03 0.00 0.00 56.01 56.66 3jxj n LEU 166 Cb 0.63 -0.46 0.52 0.00 -2.33 0.00 0.00 43.42 41.78 3jxj n LEU 166 CO 0.32 -0.36 0.81 0.35 -1.33 0.00 0.00 177.39 177.19 3jxj n THR 167 N -2.18 0.00 -2.09 -5.08 -2.24 -1.26 -4.71 114.28 96.72 3jxj n THR 167 Ca 0.04 -0.01 -0.38 0.00 -2.27 0.00 0.00 64.05 61.44 3jxj n THR 167 Cb 0.32 -0.24 0.01 0.00 -2.10 0.00 0.00 70.33 68.32 3jxj n THR 167 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 3jxj s ASP 168 N -2.92 5.87 0.52 3.42 1.11 -1.02 -4.89 116.67 118.77 3jxj s ASP 168 Ca 0.15 2.48 0.19 0.00 0.18 0.00 0.00 52.55 55.55 3jxj s ASP 168 Cb 0.19 -2.62 1.31 0.00 1.07 0.00 0.00 42.92 42.87 3jxj s ASP 168 CO 0.57 -1.13 2.11 -0.33 1.18 0.00 0.00 175.17 177.56 3jxj h GLU 169 N 1.88 0.00 0.00 8.23 4.39 -1.91 0.14 114.58 127.31 3jxj h GLU 169 Ca -0.50 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.20 3jxj h GLU 169 Cb 1.26 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.91 3jxj h GLU 169 CO 0.59 0.00 0.00 -0.85 -1.16 0.00 0.00 179.01 177.59 3jxj n GLU 170 N -4.49 0.04 -0.54 2.33 0.28 -1.26 -2.15 120.64 114.84 3jxj n GLU 170 Ca 0.00 0.14 0.03 0.00 -0.16 0.00 0.00 57.16 57.18 3jxj n GLU 170 Cb 0.23 -1.50 0.21 0.00 1.43 0.00 0.00 31.44 31.81 3jxj n GLU 170 CO 0.00 0.00 0.00 1.19 -0.16 0.00 0.00 177.13 178.16 3jxj n PHE 171 N -1.47 0.76 -5.09 -1.84 3.72 0.49 -3.88 117.46 110.15 3jxj n PHE 171 Ca 0.06 -1.25 -0.31 0.00 -0.05 0.00 0.00 57.45 55.90 3jxj n PHE 171 Cb 0.23 -0.35 -0.15 0.00 -0.94 0.00 0.00 39.48 38.26 3jxj n PHE 171 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 3jxj s ARG 172 N -3.05 1.95 0.01 -1.08 0.52 -0.92 -4.33 118.95 112.05 3jxj s ARG 172 Ca 0.41 -1.02 -0.30 0.00 -0.52 0.00 0.00 55.73 54.30 3jxj s ARG 172 Cb 0.36 -2.01 -0.07 0.00 0.52 0.00 0.00 34.95 33.75 3jxj s ARG 172 CO 0.03 0.54 1.61 -2.00 0.02 0.00 0.00 175.30 175.49 3jxj s GLU 173 N -0.94 4.21 0.49 3.54 2.12 0.42 -4.89 118.70 123.64 3jxj s GLU 173 Ca 0.11 2.21 0.28 0.00 0.36 0.00 0.00 54.97 57.93 3jxj s GLU 173 Cb -0.10 -3.76 1.05 0.00 0.26 0.00 0.00 34.13 31.58 3jxj s GLU 173 CO 0.01 -0.75 1.87 -1.00 -0.54 0.00 0.00 175.26 174.84 3jxj h PRO 174 N 8.75 0.00 0.25 4.30 0.13 -1.90 0.75 132.00 144.28 3jxj h PRO 174 Ca -0.40 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.71 3jxj h PRO 174 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 3jxj h PRO 174 CO 0.93 0.11 -0.12 0.66 -0.23 0.00 0.00 178.00 179.35 3jxj h SER 175 N 0.00 -0.29 0.57 1.44 4.64 -1.99 -3.40 113.55 114.52 3jxj h SER 175 Ca -0.00 0.01 -0.28 0.00 -0.47 0.00 0.00 61.79 61.05 3jxj h SER 175 Cb 0.68 0.07 -0.05 0.00 -0.31 0.00 0.00 62.40 62.80 3jxj h SER 175 CO 0.01 0.17 -1.59 0.71 -0.87 0.00 0.00 176.83 175.26 3jxj h THR 176 N -1.09 0.99 0.00 2.95 1.35 -1.77 -3.48 112.91 111.87 3jxj h THR 176 Ca -0.03 -2.82 0.00 0.00 -0.55 0.00 0.00 66.41 63.01 3jxj h THR 176 Cb 0.26 2.50 0.00 0.00 -1.73 0.00 0.00 68.15 69.18 3jxj h THR 176 CO 0.06 0.58 0.00 0.61 -0.25 0.00 0.00 175.52 176.52 3jxj n GLY 177 N 1.53 0.73 3.77 5.82 0.00 0.26 -1.25 105.19 116.04 3jxj n GLY 177 Ca -0.14 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.48 3jxj n GLY 177 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3jxj s LYS 178 N -0.39 4.18 0.82 1.61 1.02 -1.24 -4.56 119.74 121.17 3jxj s LYS 178 Ca 0.00 2.18 -0.07 0.00 0.02 0.00 0.00 55.97 58.10 3jxj s LYS 178 Cb 0.00 -2.92 0.16 0.00 -0.52 0.00 0.00 37.83 34.55 3jxj s LYS 178 CO 0.00 -0.32 1.13 0.95 -0.92 0.00 0.00 175.35 176.19 3jxj s THR 179 N -1.20 2.07 0.27 2.17 -4.23 -1.26 -0.43 115.64 113.02 3jxj s THR 179 Ca 0.53 -0.35 0.36 0.00 -1.18 0.00 0.00 61.69 61.04 3jxj s THR 179 Cb -0.39 -2.72 0.39 0.00 1.34 0.00 0.00 72.50 71.12 3jxj s THR 179 CO 0.51 0.00 2.08 0.00 -0.54 0.00 0.00 174.62 176.67 3jxj h LEU 181 N 0.00 0.03 -0.90 0.00 5.85 -1.94 0.16 115.31 118.51 3jxj h LEU 181 Ca -0.00 -0.39 0.09 0.00 0.84 0.00 0.00 57.88 58.42 3jxj h LEU 181 Cb 0.38 -0.01 -0.07 0.00 0.37 0.00 0.00 40.66 41.33 3jxj h LEU 181 CO 0.00 0.42 0.55 -0.65 -0.34 0.00 0.00 178.44 178.41 3jxj h PRO 182 N -0.35 0.90 -0.25 5.25 0.11 -1.94 0.57 132.00 136.28 3jxj h PRO 182 Ca 0.00 -0.05 -0.03 0.00 0.11 0.00 0.00 66.00 66.03 3jxj h PRO 182 Cb 0.40 -0.20 -0.01 0.00 0.11 0.00 0.00 31.00 31.30 3jxj h PRO 182 CO 0.00 0.60 0.05 -0.22 -0.21 0.00 0.00 178.00 178.21 3jxj h LYS 183 N 0.93 0.36 -0.10 1.05 1.63 -1.48 -0.39 116.57 118.57 3jxj h LYS 183 Ca 0.42 -0.05 -0.04 0.00 -0.85 0.00 0.00 60.65 60.13 3jxj h LYS 183 Cb 0.33 -0.07 -0.00 0.00 -0.60 0.00 0.00 32.23 31.89 3jxj h LYS 183 CO -0.23 0.35 -0.08 0.00 -3.45 0.00 0.00 179.45 176.04 3jxj h ALA 184 N 1.70 0.14 0.00 5.00 0.00 0.69 -2.84 119.26 123.95 3jxj h ALA 184 Ca 0.09 -0.29 -0.06 0.00 0.00 0.00 0.00 54.91 54.65 3jxj h ALA 184 Cb 0.17 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 3jxj h ALA 184 CO -0.00 -0.04 -0.27 -0.07 0.00 0.00 0.00 179.25 178.87 3jxj h LEU 185 N -0.18 0.00 -0.68 0.00 3.38 -0.58 -2.23 115.31 115.02 3jxj h LEU 185 Ca 0.02 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 3jxj h LEU 185 Cb 0.59 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.34 3jxj h LEU 185 CO 0.02 0.27 -0.03 -0.07 0.09 0.00 0.00 178.44 178.73 3jxj h LEU 186 N 0.00 0.00 -7.25 1.67 3.38 -1.07 -3.39 115.31 108.65 3jxj h LEU 186 Ca -0.00 0.00 -0.63 0.00 0.09 0.00 0.00 57.88 57.34 3jxj h LEU 186 Cb 0.52 0.00 -0.41 0.00 0.09 0.00 0.00 40.66 40.85 3jxj h LEU 186 CO 0.04 0.03 -0.60 0.20 0.09 0.00 0.00 178.44 178.19 3jxj s ASN 187 N -6.00 4.55 0.26 -0.43 0.01 -0.84 -5.09 114.94 107.41 3jxj s ASN 187 Ca 0.04 -3.39 0.06 0.00 -0.71 0.00 0.00 52.86 48.86 3jxj s ASN 187 Cb 0.07 -1.64 -0.03 0.00 0.41 0.00 0.00 41.25 40.06 3jxj s ASN 187 CO 0.62 -0.17 0.30 -0.76 -1.51 0.00 0.00 177.10 175.58 3jxj s LEU 188 N -0.82 4.05 -0.13 0.60 1.43 -1.26 -4.73 118.68 117.83 3jxj s LEU 188 Ca 0.20 -0.11 -0.04 0.00 -1.03 0.00 0.00 54.13 53.15 3jxj s LEU 188 Cb -0.16 -2.62 0.07 0.00 0.03 0.00 0.00 46.19 43.51 3jxj s LEU 188 CO -0.07 -0.11 0.25 -0.55 0.23 0.00 0.00 176.35 176.10 3jxj s SER 189 N -3.94 0.51 -1.44 2.29 0.15 0.93 -4.79 113.70 107.40 3jxj s SER 189 Ca 0.35 0.47 -0.09 0.00 0.70 0.00 0.00 55.95 57.38 3jxj s SER 189 Cb -0.08 0.62 0.03 0.00 -1.71 0.00 0.00 66.02 64.87 3jxj s SER 189 CO 0.27 -0.25 0.98 0.00 1.20 0.00 0.00 173.24 175.44 3jxj n ALA 190 N 5.34 -1.21 -1.05 5.45 0.00 -1.26 -2.07 120.51 125.70 3jxj n ALA 190 Ca -0.06 0.32 -0.02 0.00 0.00 0.00 0.00 53.44 53.68 3jxj n ALA 190 Cb 0.50 -4.79 -0.01 0.00 0.00 0.00 0.00 19.45 15.15 3jxj n ALA 190 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3jxj n GLY 191 N -1.79 0.44 3.12 0.00 0.00 -1.26 -4.99 105.19 100.71 3jxj n GLY 191 Ca -0.01 -0.12 -0.14 0.00 0.00 0.00 0.00 46.02 45.75 3jxj n GLY 191 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3jxj s ARG 192 N -1.28 0.70 -0.27 1.61 1.81 -0.88 -5.04 118.95 115.60 3jxj s ARG 192 Ca 0.00 -0.95 -0.01 0.00 -1.72 0.00 0.00 55.73 53.05 3jxj s ARG 192 Cb 0.00 -0.46 0.13 0.00 -0.45 0.00 0.00 34.95 34.17 3jxj s ARG 192 CO 0.00 0.08 0.32 1.21 -0.68 0.00 0.00 175.30 176.23 3jxj s ASN 193 N -1.95 1.14 0.00 0.23 3.84 -1.26 -0.05 114.94 116.88 3jxj s ASN 193 Ca -0.03 -0.43 0.19 0.00 0.21 0.00 0.00 52.86 52.81 3jxj s ASN 193 Cb -0.07 0.71 1.16 0.00 -0.55 0.00 0.00 41.25 42.50 3jxj s ASN 193 CO 0.00 -0.36 1.63 0.47 -2.79 0.00 0.00 177.10 176.06 3jxj n ASP 194 N 5.33 0.00 0.14 -4.21 9.92 -1.26 -2.38 116.55 124.09 3jxj n ASP 194 Ca -0.02 -1.03 0.12 0.00 -0.53 0.00 0.00 54.79 53.33 3jxj n ASP 194 Cb 0.48 0.00 0.27 0.00 -0.64 0.00 0.00 41.12 41.23 3jxj n ASP 194 CO 0.00 0.00 0.00 0.71 0.13 0.00 0.00 177.20 178.04 3jxj h THR 195 N 0.00 0.00 -0.15 -3.53 1.35 -1.89 -3.38 112.91 105.31 3jxj h THR 195 Ca 0.00 -0.69 -0.02 0.00 -0.55 0.00 0.00 66.41 65.14 3jxj h THR 195 Cb 0.00 1.61 -0.01 0.00 -1.73 0.00 0.00 68.15 68.02 3jxj h THR 195 CO 0.00 0.00 -0.00 0.40 -0.25 0.00 0.00 175.52 175.67 3jxj h ILE 196 N 0.00 1.25 -0.47 6.82 2.04 -1.88 -0.56 117.51 124.72 3jxj h ILE 196 Ca 0.00 -0.84 -0.13 0.00 1.00 0.00 0.00 64.86 64.89 3jxj h ILE 196 Cb 0.85 1.52 -0.01 0.00 -0.74 0.00 0.00 36.82 38.43 3jxj h ILE 196 CO 0.00 0.25 -0.21 -0.65 0.00 0.00 0.00 178.15 177.54 3jxj h PRO 197 N 0.00 0.96 -0.27 2.37 0.11 -1.82 -1.88 132.00 131.47 3jxj h PRO 197 Ca 0.04 -0.40 -0.12 0.00 0.11 0.00 0.00 66.00 65.63 3jxj h PRO 197 Cb 0.38 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 31.44 3jxj h PRO 197 CO 0.01 1.07 -0.35 0.97 -0.21 0.00 0.00 178.00 179.49 3jxj h ILE 198 N 0.83 1.29 -0.56 4.15 6.09 -1.74 -1.58 117.51 125.98 3jxj h ILE 198 Ca 0.11 -1.48 -0.01 0.00 -1.37 0.00 0.00 64.86 62.11 3jxj h ILE 198 Cb 0.77 1.46 -0.03 0.00 0.47 0.00 0.00 36.82 39.50 3jxj h ILE 198 CO 0.06 0.47 0.29 -0.07 -3.07 0.00 0.00 178.15 175.84 3jxj h LEU 199 N 0.49 0.72 -1.11 2.19 3.38 -0.74 -0.36 115.31 119.87 3jxj h LEU 199 Ca 0.05 -0.11 -0.07 0.00 0.09 0.00 0.00 57.88 57.85 3jxj h LEU 199 Cb 0.83 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.39 3jxj h LEU 199 CO 0.07 0.62 -0.12 -0.07 0.09 0.00 0.00 178.44 179.03 3jxj h LEU 200 N 0.76 0.47 -0.49 1.67 3.38 -1.16 0.25 115.31 120.19 3jxj h LEU 200 Ca 0.20 -0.12 -0.08 0.00 0.09 0.00 0.00 57.88 57.96 3jxj h LEU 200 Cb 0.07 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.68 3jxj h LEU 200 CO -0.03 0.62 -0.02 -0.78 0.09 0.00 0.00 178.44 178.32 3jxj h ASP 201 N 0.45 0.87 -0.19 -0.43 -0.00 -0.91 -0.60 116.42 115.61 3jxj h ASP 201 Ca 0.08 -0.32 -0.15 0.00 -0.00 0.00 0.00 57.03 56.65 3jxj h ASP 201 Cb 0.48 -0.23 -0.01 0.00 -0.00 0.00 0.00 39.33 39.57 3jxj h ASP 201 CO 0.03 0.98 -0.41 0.40 -0.00 0.00 0.00 179.24 180.24 3jxj h ILE 202 N 0.73 1.29 -0.77 2.25 2.04 -0.63 -1.81 117.51 120.61 3jxj h ILE 202 Ca 0.14 -1.59 -0.00 0.00 1.00 0.00 0.00 64.86 64.40 3jxj h ILE 202 Cb 0.55 1.49 -0.04 0.00 -0.74 0.00 0.00 36.82 38.08 3jxj h ILE 202 CO 0.03 0.51 0.46 0.00 0.00 0.00 0.00 178.15 179.15 3jxj h ALA 203 N 0.94 0.98 -0.26 1.87 0.00 -0.38 -2.29 119.26 120.12 3jxj h ALA 203 Ca 0.05 -0.09 -0.10 0.00 0.00 0.00 0.00 54.91 54.77 3jxj h ALA 203 Cb 0.96 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 18.43 3jxj h ALA 203 CO 0.09 0.45 -0.22 1.49 0.00 0.00 0.00 179.25 181.05 3jxj h GLU 204 N 1.05 0.61 0.00 0.00 4.81 -0.95 -1.58 114.58 118.52 3jxj h GLU 204 Ca 0.27 -0.31 0.00 0.00 -0.13 0.00 0.00 59.36 59.20 3jxj h GLU 204 Cb -0.03 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.35 3jxj h GLU 204 CO -0.05 0.90 0.00 1.63 -0.73 0.00 0.00 179.01 180.76 3jxj n LYS 205 N -4.36 0.11 -0.26 1.92 5.02 -0.69 -1.27 118.16 118.62 3jxj n LYS 205 Ca -0.04 0.27 0.11 0.00 -2.02 0.00 0.00 58.31 56.63 3jxj n LYS 205 Cb 0.42 -1.68 0.25 0.00 -0.02 0.00 0.00 35.03 34.00 3jxj n LYS 205 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 3jxj n THR 206 N -1.88 0.74 -2.97 -0.18 -2.24 -0.88 -4.98 114.28 101.89 3jxj n THR 206 Ca 0.04 -0.87 -0.12 0.00 -2.27 0.00 0.00 64.05 60.83 3jxj n THR 206 Cb 0.25 0.75 0.06 0.00 -2.10 0.00 0.00 70.33 69.30 3jxj n THR 206 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3jxj n GLY 207 N 1.46 -0.38 1.65 3.38 0.00 -0.40 -4.95 105.19 105.95 3jxj n GLY 207 Ca 0.21 0.14 -0.04 0.00 0.00 0.00 0.00 46.02 46.32 3jxj n GLY 207 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3jxj n ASN 208 N -2.70 -0.81 -0.05 1.61 4.05 -0.60 -5.02 115.26 111.74 3jxj n ASN 208 Ca -0.15 -2.07 -0.02 0.00 0.45 0.00 0.00 54.58 52.79 3jxj n ASN 208 Cb 0.61 0.32 -0.02 0.00 1.23 0.00 0.00 39.78 41.92 3jxj n ASN 208 CO 0.00 0.00 0.00 -0.03 -3.05 0.00 0.00 177.26 174.18 3jxj h MET 209 N 0.54 0.00 -0.99 1.20 4.05 -1.84 -2.78 114.93 115.11 3jxj h MET 209 Ca -0.48 0.00 0.09 0.00 -0.28 0.00 0.00 59.70 59.03 3jxj h MET 209 Cb 1.42 0.00 -0.07 0.00 -0.80 0.00 0.00 31.60 32.14 3jxj h MET 209 CO -0.20 0.14 0.63 0.00 0.23 0.00 0.00 176.91 177.71 3jxj h ARG 210 N -1.00 1.04 -0.64 0.39 3.08 -1.87 -1.27 114.38 114.11 3jxj h ARG 210 Ca -0.00 -0.06 -0.08 0.00 0.07 0.00 0.00 59.98 59.90 3jxj h ARG 210 Cb 0.16 -0.23 -0.02 0.00 0.08 0.00 0.00 29.97 29.95 3jxj h ARG 210 CO -0.00 0.69 0.07 0.93 -1.07 0.00 0.00 179.97 180.59 3jxj h GLU 211 N 1.07 1.08 -0.20 0.04 3.07 -1.94 -1.49 114.58 116.22 3jxj h GLU 211 Ca 0.45 -0.31 -0.07 0.00 -0.50 0.00 0.00 59.36 58.93 3jxj h GLU 211 Cb 0.32 -0.12 -0.00 0.00 -0.84 0.00 0.00 28.75 28.11 3jxj h GLU 211 CO -0.21 1.01 -0.16 0.35 -1.40 0.00 0.00 179.01 178.61 3jxj h PHE 212 N 1.00 0.54 -0.27 4.33 3.04 -1.00 -1.57 116.94 123.00 3jxj h PHE 212 Ca 0.19 -0.15 -0.10 0.00 3.98 0.00 0.00 57.97 61.89 3jxj h PHE 212 Cb 0.48 -0.12 -0.00 0.00 2.56 0.00 0.00 35.95 38.87 3jxj h PHE 212 CO 0.04 0.79 -0.23 0.82 -2.02 0.00 0.00 178.31 177.71 3jxj h ILE 213 N 0.13 1.31 -0.24 1.41 2.04 -1.28 -3.15 117.51 117.72 3jxj h ILE 213 Ca 0.04 -1.38 0.00 0.00 1.00 0.00 0.00 64.86 64.52 3jxj h ILE 213 Cb 0.69 1.60 0.00 0.00 -0.74 0.00 0.00 36.82 38.36 3jxj h ILE 213 CO 0.04 0.44 0.00 0.59 0.00 0.00 0.00 178.15 179.22 3jxj n ASN 214 N -4.34 2.21 -4.63 1.72 3.02 -0.56 -3.75 115.26 108.92 3jxj n ASN 214 Ca -0.04 -2.20 -0.43 0.00 -0.03 0.00 0.00 54.58 51.88 3jxj n ASN 214 Cb 0.43 -0.41 -0.03 0.00 -0.61 0.00 0.00 39.78 39.17 3jxj n ASN 214 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 3jxj s SER 215 N -0.58 6.33 0.14 6.41 0.15 -0.59 -4.96 113.70 120.59 3jxj s SER 215 Ca 0.19 1.86 -0.29 0.00 0.70 0.00 0.00 55.95 58.42 3jxj s SER 215 Cb 0.13 -2.53 -0.07 0.00 -1.71 0.00 0.00 66.02 61.84 3jxj s SER 215 CO 0.09 -1.26 0.90 -2.16 1.20 0.00 0.00 173.24 172.01 3jxj s PRO 216 N 4.74 4.69 0.41 5.44 0.04 -1.26 -4.61 135.00 144.45 3jxj s PRO 216 Ca 0.77 1.37 0.04 0.00 0.04 0.00 0.00 61.00 63.21 3jxj s PRO 216 Cb -0.29 -3.34 -0.04 0.00 0.04 0.00 0.00 34.50 30.87 3jxj s PRO 216 CO 0.31 0.33 0.06 -0.59 0.04 0.00 0.00 177.00 177.16 3jxj s PHE 217 N -0.41 1.95 0.04 0.56 -0.71 -0.96 -4.82 117.98 113.63 3jxj s PHE 217 Ca 0.43 -1.04 -0.02 0.00 -1.04 0.00 0.00 56.93 55.26 3jxj s PHE 217 Cb -0.23 -1.38 -0.02 0.00 -1.21 0.00 0.00 43.02 40.17 3jxj s PHE 217 CO 0.29 0.01 0.02 -0.98 -1.34 0.00 0.00 175.22 173.22 3jxj s ARG 218 N -3.80 0.52 0.00 1.99 1.70 -0.38 -1.78 118.95 117.20 3jxj s ARG 218 Ca 0.24 -0.88 0.00 0.00 -0.47 0.00 0.00 55.73 54.62 3jxj s ARG 218 Cb 0.05 0.19 0.00 0.00 -0.57 0.00 0.00 34.95 34.62 3jxj s ARG 218 CO 0.12 -0.11 0.00 -0.40 -1.08 0.00 0.00 175.30 173.83 3jxj n ASP 219 N 0.75 0.89 -0.55 -2.89 5.75 -0.63 -4.47 116.55 115.40 3jxj n ASP 219 Ca -0.19 -0.02 0.04 0.00 -0.01 0.00 0.00 54.79 54.61 3jxj n ASP 219 Cb 0.58 0.00 0.11 0.00 -1.03 0.00 0.00 41.12 40.79 3jxj n ASP 219 CO 0.00 0.00 0.00 0.55 -0.11 0.00 0.00 177.20 177.64 3jxj n VAL 220 N 0.00 0.44 0.00 2.12 3.14 -1.26 -4.10 118.33 118.67 3jxj n VAL 220 Ca 0.00 -0.35 0.00 0.00 -2.96 0.00 0.00 64.34 61.03 3jxj n VAL 220 Cb 0.00 0.04 0.00 0.00 -1.06 0.00 0.00 33.84 32.82 3jxj n VAL 220 CO 0.00 0.00 0.00 -1.22 -6.46 0.00 0.00 176.83 169.15 3jxj n TYR 221 N 0.20 0.00 -4.41 1.45 4.01 -1.26 -4.71 117.16 112.44 3jxj n TYR 221 Ca 0.08 0.00 -0.22 0.00 -0.16 0.00 0.00 57.90 57.60 3jxj n TYR 221 Cb 0.27 0.00 -0.10 0.00 -0.31 0.00 0.00 39.34 39.20 3jxj n TYR 221 CO 0.00 0.00 0.00 0.71 -0.46 0.00 0.00 176.86 177.11 3jxj s TYR 222 N -1.39 2.04 0.16 -0.72 2.02 -1.26 -2.35 117.35 115.84 3jxj s TYR 222 Ca 0.00 -0.43 0.06 0.00 -0.37 0.00 0.00 57.07 56.32 3jxj s TYR 222 Cb 0.00 -0.91 -0.04 0.00 -0.40 0.00 0.00 41.96 40.60 3jxj s TYR 222 CO 0.00 0.55 -0.12 -0.98 -1.57 0.00 0.00 175.55 173.43 3jxj s ARG 223 N -3.50 1.11 -0.83 -0.62 1.70 0.17 -1.60 118.95 115.38 3jxj s ARG 223 Ca 0.26 -1.44 0.00 0.00 -0.47 0.00 0.00 55.73 54.08 3jxj s ARG 223 Cb -0.03 -0.80 0.00 0.00 -0.57 0.00 0.00 34.95 33.55 3jxj s ARG 223 CO 0.11 0.12 0.00 0.41 -1.08 0.00 0.00 175.30 174.86 3jxj n GLY 224 N -0.08 0.28 3.77 3.88 0.00 -0.84 -1.58 105.19 110.61 3jxj n GLY 224 Ca -0.11 -0.53 -0.29 0.00 0.00 0.00 0.00 46.02 45.08 3jxj n GLY 224 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3jxj s GLN 225 N -4.02 1.49 0.26 1.61 -0.21 -0.73 -4.13 119.66 113.93 3jxj s GLN 225 Ca 0.00 0.57 -0.00 0.00 0.02 0.00 0.00 55.36 55.94 3jxj s GLN 225 Cb 0.00 -1.86 -0.03 0.00 1.00 0.00 0.00 33.01 32.13 3jxj s GLN 225 CO 0.00 -2.02 0.26 0.95 -2.12 0.00 0.00 175.29 172.36 3jxj s THR 226 N -3.13 0.00 0.42 -0.19 -4.23 -1.26 -2.26 115.64 104.99 3jxj s THR 226 Ca 0.63 -1.88 0.09 0.00 -1.18 0.00 0.00 61.69 59.35 3jxj s THR 226 Cb -0.16 -2.48 0.28 0.00 1.34 0.00 0.00 72.50 71.48 3jxj s THR 226 CO 0.55 0.00 2.04 0.00 -0.54 0.00 0.00 174.62 176.67 3jxj h ALA 227 N 2.38 1.79 -0.42 3.99 0.00 -1.82 -2.51 119.26 122.68 3jxj h ALA 227 Ca -0.31 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.51 3jxj h ALA 227 Cb 1.24 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.88 3jxj h ALA 227 CO 0.44 0.16 -0.00 1.25 0.00 0.00 0.00 179.25 181.11 3jxj h LEU 228 N 0.50 0.72 -1.03 0.00 5.85 -1.94 -1.74 115.31 117.67 3jxj h LEU 228 Ca 0.17 -0.31 0.05 0.00 0.84 0.00 0.00 57.88 58.63 3jxj h LEU 228 Cb 0.08 -0.19 -0.06 0.00 0.37 0.00 0.00 40.66 40.86 3jxj h LEU 228 CO -0.04 0.85 0.65 0.45 -0.34 0.00 0.00 178.44 180.01 3jxj h HIS 229 N 0.57 1.21 -0.28 1.25 3.86 -1.85 -2.13 115.15 117.77 3jxj h HIS 229 Ca 0.12 0.03 -0.17 0.00 -1.16 0.00 0.00 60.37 59.18 3jxj h HIS 229 Cb 0.48 -0.40 0.00 0.00 1.06 0.00 0.00 27.41 28.55 3jxj h HIS 229 CO 0.04 0.67 -0.50 0.82 0.86 0.00 0.00 177.93 179.82 3jxj h ILE 230 N 1.22 1.28 -0.98 2.45 2.04 -1.32 -1.33 117.51 120.87 3jxj h ILE 230 Ca 0.41 -1.69 0.06 0.00 1.00 0.00 0.00 64.86 64.63 3jxj h ILE 230 Cb 0.06 1.65 -0.06 0.00 -0.74 0.00 0.00 36.82 37.72 3jxj h ILE 230 CO -0.14 0.55 0.64 0.00 0.00 0.00 0.00 178.15 179.20 3jxj h ALA 231 N 0.67 1.42 -0.12 1.87 0.00 -1.01 0.80 119.26 122.89 3jxj h ALA 231 Ca 0.02 -0.03 -0.14 0.00 0.00 0.00 0.00 54.91 54.76 3jxj h ALA 231 Cb 1.11 -0.31 0.01 0.00 0.00 0.00 0.00 17.79 18.60 3jxj h ALA 231 CO 0.11 0.44 -0.49 0.82 0.00 0.00 0.00 179.25 180.14 3jxj h ILE 232 N 1.16 1.36 -0.80 0.00 2.04 -1.32 -2.28 117.51 117.67 3jxj h ILE 232 Ca 0.42 -1.80 0.02 0.00 1.00 0.00 0.00 64.86 64.50 3jxj h ILE 232 Cb 0.15 2.14 -0.04 0.00 -0.74 0.00 0.00 36.82 38.33 3jxj h ILE 232 CO -0.16 0.54 0.52 -0.08 0.00 0.00 0.00 178.15 178.97 3jxj h GLU 233 N 0.15 1.00 -0.04 2.37 4.57 -0.59 -0.94 114.58 121.10 3jxj h GLU 233 Ca -0.03 -0.06 0.00 0.00 -1.18 0.00 0.00 59.36 58.09 3jxj h GLU 233 Cb 1.12 -0.23 0.00 0.00 -0.16 0.00 0.00 28.75 29.49 3jxj h GLU 233 CO 0.10 0.66 0.00 0.54 -1.18 0.00 0.00 179.01 179.14 3jxj n ARG 234 N -4.56 1.23 -3.23 1.92 5.12 0.21 -4.92 116.66 112.43 3jxj n ARG 234 Ca 0.09 -0.35 -0.15 0.00 -1.93 0.00 0.00 57.85 55.51 3jxj n ARG 234 Cb 0.05 -1.37 0.07 0.00 -1.16 0.00 0.00 32.46 30.06 3jxj n ARG 234 CO 0.00 0.00 0.00 0.54 -1.93 0.00 0.00 177.63 176.24 3jxj n ARG 235 N -0.48 -5.71 -3.99 5.56 1.74 -0.36 -4.99 116.66 108.43 3jxj n ARG 235 Ca 0.17 0.71 -0.31 0.00 -0.77 0.00 0.00 57.85 57.65 3jxj n ARG 235 Cb 0.16 -5.32 -0.15 0.00 -1.02 0.00 0.00 32.46 26.14 3jxj n ARG 235 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3jxj h LYS 237 N 7.27 1.19 0.03 0.00 3.64 -1.94 -2.78 116.57 123.98 3jxj h LYS 237 Ca -0.05 -0.07 0.01 0.00 -1.27 0.00 0.00 60.65 59.26 3jxj h LYS 237 Cb 0.98 -0.27 -0.01 0.00 -0.41 0.00 0.00 32.23 32.52 3jxj h LYS 237 CO 0.58 0.79 -0.07 1.25 -2.27 0.00 0.00 179.45 179.73 3jxj h HIS 238 N 1.22 -0.18 0.00 1.91 2.76 -1.96 -0.72 115.15 118.19 3jxj h HIS 238 Ca 0.38 0.00 -0.04 0.00 -2.20 0.00 0.00 60.37 58.52 3jxj h HIS 238 Cb -0.00 0.07 -0.01 0.00 1.55 0.00 0.00 27.41 29.03 3jxj h HIS 238 CO -0.00 -0.11 -0.19 1.88 -1.30 0.00 0.00 177.93 178.21 3jxj h TYR 239 N -0.14 0.00 -0.04 5.26 0.05 -1.92 -2.32 116.97 117.86 3jxj h TYR 239 Ca 0.02 0.00 -0.01 0.00 0.05 0.00 0.00 58.73 58.79 3jxj h TYR 239 Cb 0.15 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 37.89 3jxj h TYR 239 CO -0.12 0.19 0.00 0.28 -1.05 0.00 0.00 178.16 177.46 3jxj h VAL 240 N 0.00 1.24 -0.41 -2.88 2.07 -1.06 -2.43 116.25 112.77 3jxj h VAL 240 Ca -0.00 -0.72 0.07 0.00 0.82 0.00 0.00 66.70 66.87 3jxj h VAL 240 Cb 0.74 1.65 -0.06 0.00 -1.52 0.00 0.00 31.29 32.10 3jxj h VAL 240 CO 0.02 0.19 0.07 -0.33 0.02 0.00 0.00 177.57 177.55 3jxj h GLU 241 N -0.22 0.20 -0.48 1.57 5.08 -0.78 -1.35 114.58 118.61 3jxj h GLU 241 Ca 0.01 -0.01 0.03 0.00 -1.00 0.00 0.00 59.36 58.39 3jxj h GLU 241 Cb 0.31 -0.04 -0.04 0.00 0.50 0.00 0.00 28.75 29.48 3jxj h GLU 241 CO 0.00 0.13 0.27 1.25 -1.00 0.00 0.00 179.01 179.66 3jxj h LEU 242 N 0.20 0.42 -0.12 1.33 6.46 -1.30 0.31 115.31 122.61 3jxj h LEU 242 Ca 0.20 0.01 -0.08 0.00 -0.12 0.00 0.00 57.88 57.89 3jxj h LEU 242 Cb 0.25 -0.07 0.00 0.00 -0.73 0.00 0.00 40.66 40.11 3jxj h LEU 242 CO -0.27 0.29 -0.24 -0.07 -0.62 0.00 0.00 178.44 177.53 3jxj h LEU 243 N 0.53 0.43 -0.55 2.25 3.38 -1.09 -0.93 115.31 119.33 3jxj h LEU 243 Ca 0.20 -0.55 0.01 0.00 0.09 0.00 0.00 57.88 57.63 3jxj h LEU 243 Cb 0.05 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 40.65 3jxj h LEU 243 CO -0.11 0.90 0.35 0.58 0.09 0.00 0.00 178.44 180.25 3jxj h VAL 244 N -0.03 1.10 -0.04 1.22 2.07 -0.87 0.64 116.25 120.35 3jxj h VAL 244 Ca 0.01 -0.24 -0.05 0.00 0.82 0.00 0.00 66.70 67.23 3jxj h VAL 244 Cb 0.83 0.34 -0.01 0.00 -1.52 0.00 0.00 31.29 30.93 3jxj h VAL 244 CO 0.05 0.13 -0.22 -0.33 0.02 0.00 0.00 177.57 177.23 3jxj h GLU 245 N 0.70 0.06 -0.75 1.57 5.08 -0.29 -2.17 114.58 118.78 3jxj h GLU 245 Ca 0.21 -0.01 -0.32 0.00 -1.00 0.00 0.00 59.36 58.24 3jxj h GLU 245 Cb -0.04 -0.01 -0.19 0.00 0.50 0.00 0.00 28.75 29.02 3jxj h GLU 245 CO -0.07 0.28 0.35 1.63 -1.00 0.00 0.00 179.01 180.20 3jxj n LYS 246 N -4.26 2.76 -1.21 2.33 5.02 -0.36 -4.95 118.16 117.49 3jxj n LYS 246 Ca -0.02 -3.06 0.00 0.00 -2.02 0.00 0.00 58.31 53.21 3jxj n LYS 246 Cb 0.29 -2.11 0.00 0.00 -0.02 0.00 0.00 35.03 33.19 3jxj n LYS 246 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3jxj n GLY 247 N -0.75 1.01 3.80 0.72 0.00 -0.53 -4.81 105.19 104.63 3jxj n GLY 247 Ca 0.46 -0.35 -0.36 0.00 0.00 0.00 0.00 46.02 45.77 3jxj n GLY 247 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3jxj s ALA 248 N -2.44 3.34 -0.26 4.61 0.00 0.11 -4.77 121.76 122.35 3jxj s ALA 248 Ca 0.00 0.28 -0.29 0.00 0.00 0.00 0.00 51.96 51.95 3jxj s ALA 248 Cb 0.00 -2.94 0.01 0.00 0.00 0.00 0.00 23.12 20.19 3jxj s ALA 248 CO 0.00 0.28 1.08 0.34 0.00 0.00 0.00 175.76 177.46 3jxj s ASP 249 N -1.66 7.01 0.00 0.00 2.15 -1.26 -4.75 116.67 118.16 3jxj s ASP 249 Ca 0.46 1.28 0.31 0.00 0.43 0.00 0.00 52.55 55.03 3jxj s ASP 249 Cb -0.17 -2.54 1.65 0.00 -0.30 0.00 0.00 42.92 41.56 3jxj s ASP 249 CO 0.22 -0.77 2.08 1.33 -0.17 0.00 0.00 175.17 177.86 3jxj n VAL 250 N 5.55 0.00 -1.28 1.11 0.24 -1.26 -3.44 118.33 119.25 3jxj n VAL 250 Ca 0.12 -0.07 0.08 0.00 -2.04 0.00 0.00 64.34 62.44 3jxj n VAL 250 Cb 0.46 -0.22 0.14 0.00 -1.47 0.00 0.00 33.84 32.76 3jxj n VAL 250 CO 0.00 0.00 0.00 1.41 -2.14 0.00 0.00 176.83 176.10 3jxj n HIS 251 N -0.69 0.00 -2.17 6.34 8.25 -1.26 -4.24 115.22 121.45 3jxj n HIS 251 Ca 0.22 -1.01 -0.42 0.00 -0.26 0.00 0.00 57.72 56.26 3jxj n HIS 251 Cb 0.18 -0.16 -0.03 0.00 1.12 0.00 0.00 29.99 31.10 3jxj n HIS 251 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3jxj s ALA 252 N -2.65 3.56 -0.31 -1.41 0.00 -1.22 -4.94 121.76 114.78 3jxj s ALA 252 Ca 0.31 1.15 -0.08 0.00 0.00 0.00 0.00 51.96 53.34 3jxj s ALA 252 Cb 0.28 -3.51 0.01 0.00 0.00 0.00 0.00 23.12 19.90 3jxj s ALA 252 CO 0.00 -0.59 0.11 -0.65 0.00 0.00 0.00 175.76 174.63 3jxj s GLN 253 N 0.20 3.00 -0.82 0.00 -0.21 -1.26 -4.11 119.66 116.46 3jxj s GLN 253 Ca 0.59 -0.93 -0.24 0.00 0.02 0.00 0.00 55.36 54.81 3jxj s GLN 253 Cb -0.38 -3.45 0.06 0.00 1.00 0.00 0.00 33.01 30.24 3jxj s GLN 253 CO 0.37 -0.51 1.24 0.00 -2.12 0.00 0.00 175.29 174.26 3jxj s ALA 254 N 1.50 2.89 0.07 6.09 0.00 -0.80 -4.65 121.76 126.86 3jxj s ALA 254 Ca 0.02 -1.87 -0.15 0.00 0.00 0.00 0.00 51.96 49.96 3jxj s ALA 254 Cb -0.18 -4.22 -0.06 0.00 0.00 0.00 0.00 23.12 18.66 3jxj s ALA 254 CO 0.03 -3.23 0.49 1.03 0.00 0.00 0.00 175.76 174.08 3jxj s ARG 255 N 4.82 3.99 0.83 0.00 0.52 -0.61 -4.39 118.95 124.10 3jxj s ARG 255 Ca 0.35 0.49 -0.12 0.00 -0.52 0.00 0.00 55.73 55.92 3jxj s ARG 255 Cb -0.07 -3.12 0.09 0.00 0.52 0.00 0.00 34.95 32.36 3jxj s ARG 255 CO 0.04 0.61 1.19 0.20 0.02 0.00 0.00 175.30 177.37 3jxj s GLY 256 N -1.33 1.61 0.00 -3.53 0.00 -1.26 0.42 107.32 103.22 3jxj s GLY 256 Ca 0.30 -0.71 0.00 0.00 0.00 0.00 0.00 44.72 44.31 3jxj s GLY 256 CO 0.17 -0.19 0.00 -0.96 0.00 0.00 0.00 173.10 172.12 3jxj n ARG 257 N -3.36 4.36 -4.60 2.90 1.85 -0.99 -4.68 116.66 112.13 3jxj n ARG 257 Ca 0.09 0.00 -0.28 0.00 -1.00 0.00 0.00 57.85 56.66 3jxj n ARG 257 Cb 0.61 -0.45 -0.09 0.00 -1.05 0.00 0.00 32.46 31.47 3jxj n ARG 257 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 3jxj s PHE 258 N -0.20 2.04 0.00 2.89 0.08 -1.26 -5.09 117.98 116.45 3jxj s PHE 258 Ca 0.00 -0.95 0.00 0.00 0.12 0.00 0.00 56.93 56.10 3jxj s PHE 258 Cb 0.00 -1.49 0.00 0.00 -0.57 0.00 0.00 43.02 40.96 3jxj s PHE 258 CO 0.00 0.13 0.00 1.19 -0.10 0.00 0.00 175.22 176.44 3jxj n PHE 259 N -0.98 0.00 0.00 0.36 3.72 -1.26 -5.07 117.46 114.22 3jxj n PHE 259 Ca -0.09 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.31 3jxj n PHE 259 Cb 0.66 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.20 3jxj n PHE 259 CO 0.00 0.00 0.00 2.48 -0.05 0.00 0.00 176.76 179.19 3jxj n TYR 267 N 0.00 0.00 -3.11 1.38 4.11 -1.26 -5.29 117.16 112.98 3jxj n TYR 267 Ca 0.00 0.00 -0.45 0.00 -0.00 0.00 0.00 57.90 57.45 3jxj n TYR 267 Cb 0.00 0.00 -0.04 0.00 -0.00 0.00 0.00 39.34 39.30 3jxj n TYR 267 CO 0.00 0.00 0.00 0.12 -0.00 0.00 0.00 176.86 176.98 3jxj s PHE 268 N -2.20 3.14 -0.17 -3.48 5.36 -1.26 -5.02 117.98 114.35 3jxj s PHE 268 Ca 0.00 -1.19 -0.29 0.00 -0.96 0.00 0.00 56.93 54.48 3jxj s PHE 268 Cb 0.00 -4.03 -0.03 0.00 -0.34 0.00 0.00 43.02 38.62 3jxj s PHE 268 CO 0.00 -1.28 1.50 -0.47 -1.46 0.00 0.00 175.22 173.50 3jxj s TYR 269 N 2.30 2.33 -0.47 10.12 5.04 -1.26 -4.88 117.35 130.54 3jxj s TYR 269 Ca 0.16 0.61 0.05 0.00 -2.44 0.00 0.00 57.07 55.44 3jxj s TYR 269 Cb -0.19 -3.83 0.09 0.00 0.35 0.00 0.00 41.96 38.39 3jxj s TYR 269 CO 0.01 -2.72 0.93 1.97 -1.34 0.00 0.00 175.55 174.40 3jxj n PHE 270 N 7.50 0.12 -0.21 4.97 1.16 -1.26 -4.58 117.46 125.16 3jxj n PHE 270 Ca 0.17 -0.30 0.00 0.00 -1.87 0.00 0.00 57.45 55.44 3jxj n PHE 270 Cb 0.45 -0.02 0.00 0.00 -1.61 0.00 0.00 39.48 38.29 3jxj n PHE 270 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 3jxj n GLY 271 N 0.06 0.89 5.00 4.97 0.00 -1.26 -3.99 105.19 110.85 3jxj n GLY 271 Ca 0.04 -0.08 0.00 0.00 0.00 0.00 0.00 46.02 45.98 3jxj n GLY 271 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3jxj n GLU 272 N -2.21 0.00 -1.86 1.61 1.02 -1.26 -4.70 120.64 113.25 3jxj n GLU 272 Ca 0.00 0.00 -0.32 0.00 -0.02 0.00 0.00 57.16 56.82 3jxj n GLU 272 Cb 0.00 0.00 0.02 0.00 -0.02 0.00 0.00 31.44 31.44 3jxj n GLU 272 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 3jxj s LEU 273 N 0.00 3.32 0.20 -4.62 1.43 -1.26 -1.90 118.68 115.85 3jxj s LEU 273 Ca 0.00 1.66 -0.07 0.00 -1.03 0.00 0.00 54.13 54.69 3jxj s LEU 273 Cb 0.00 -4.51 0.13 0.00 0.03 0.00 0.00 46.19 41.84 3jxj s LEU 273 CO 0.00 -1.19 1.65 -0.65 0.23 0.00 0.00 176.35 176.40 3jxj h PRO 274 N -0.09 0.98 -0.82 1.29 0.11 -1.74 -0.17 132.00 131.56 3jxj h PRO 274 Ca -0.45 -0.32 0.00 0.00 0.11 0.00 0.00 66.00 65.34 3jxj h PRO 274 Cb 1.21 -0.08 -0.04 0.00 0.11 0.00 0.00 31.00 32.19 3jxj h PRO 274 CO 0.58 1.00 0.52 1.25 -0.21 0.00 0.00 178.00 181.14 3jxj h LEU 275 N 0.89 0.96 -0.17 2.35 5.85 -1.94 -0.73 115.31 122.51 3jxj h LEU 275 Ca 0.15 -0.04 -0.21 0.00 0.84 0.00 0.00 57.88 58.62 3jxj h LEU 275 Cb 0.59 -0.24 0.01 0.00 0.37 0.00 0.00 40.66 41.39 3jxj h LEU 275 CO 0.04 0.71 -0.73 0.28 -0.34 0.00 0.00 178.44 178.40 3jxj h SER 276 N 1.12 0.94 -0.47 1.25 0.02 -1.80 -1.68 113.55 112.93 3jxj h SER 276 Ca 0.30 -0.62 0.03 0.00 -0.84 0.00 0.00 61.79 60.66 3jxj h SER 276 Cb -0.09 -0.28 -0.03 0.00 0.14 0.00 0.00 62.40 62.14 3jxj h SER 276 CO -0.06 1.40 0.27 0.25 -1.14 0.00 0.00 176.83 177.54 3jxj h LEU 277 N 0.53 0.42 -0.57 5.07 5.85 -0.66 0.44 115.31 126.41 3jxj h LEU 277 Ca -0.04 0.01 -0.05 0.00 0.84 0.00 0.00 57.88 58.64 3jxj h LEU 277 Cb 1.36 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 42.28 3jxj h LEU 277 CO 0.15 0.30 0.16 0.00 -0.34 0.00 0.00 178.44 178.71 3jxj h ALA 278 N 1.22 0.75 -0.21 1.25 0.00 -1.07 -1.54 119.26 119.65 3jxj h ALA 278 Ca 0.19 -0.21 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 3jxj h ALA 278 Cb 0.04 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 3jxj h ALA 278 CO -0.10 0.43 -0.00 0.00 0.00 0.00 0.00 179.25 179.58 3jxj h ALA 279 N 1.04 0.29 0.00 0.00 0.00 -0.85 -2.12 119.26 117.61 3jxj h ALA 279 Ca 0.18 -0.21 -0.04 0.00 0.00 0.00 0.00 54.91 54.84 3jxj h ALA 279 Cb 0.31 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 3jxj h ALA 279 CO -0.00 0.01 -0.20 0.00 0.00 0.00 0.00 179.25 179.06 3jxj n THR 281 N -3.42 0.78 -2.79 0.00 -2.24 -0.61 -4.99 114.28 101.02 3jxj n THR 281 Ca -0.00 -0.81 -0.02 0.00 -2.27 0.00 0.00 64.05 60.95 3jxj n THR 281 Cb 0.39 0.46 0.00 0.00 -2.10 0.00 0.00 70.33 69.08 3jxj n THR 281 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 3jxj n ASN 282 N 1.30 -6.99 -3.22 3.42 4.05 -0.93 -5.03 115.26 107.85 3jxj n ASN 282 Ca 0.20 0.07 -0.24 0.00 0.45 0.00 0.00 54.58 55.06 3jxj n ASN 282 Cb 0.52 -4.71 -0.07 0.00 1.23 0.00 0.00 39.78 36.75 3jxj n ASN 282 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 3jxj n GLN 283 N -1.32 0.62 -0.29 1.20 6.02 -0.81 -5.01 117.38 117.80 3jxj n GLN 283 Ca 0.03 -3.21 0.06 0.00 -0.01 0.00 0.00 57.00 53.87 3jxj n GLN 283 Cb 0.47 -1.29 0.28 0.00 1.02 0.00 0.00 30.24 30.73 3jxj n GLN 283 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.06 175.05 3jxj h PRO 284 N 4.27 0.90 -0.44 -1.09 0.13 -1.94 -1.66 132.00 132.16 3jxj h PRO 284 Ca 0.10 -0.05 -0.04 0.00 -0.87 0.00 0.00 66.00 65.14 3jxj h PRO 284 Cb 0.89 -0.20 -0.02 0.00 0.13 0.00 0.00 31.00 31.79 3jxj h PRO 284 CO 0.44 0.59 0.11 0.45 -0.23 0.00 0.00 178.00 179.37 3jxj h HIS 285 N 0.92 0.74 -0.71 1.56 3.86 -1.97 0.64 115.15 120.20 3jxj h HIS 285 Ca 0.40 -0.09 -0.06 0.00 -1.16 0.00 0.00 60.37 59.47 3jxj h HIS 285 Cb 0.34 -0.21 -0.03 0.00 1.06 0.00 0.00 27.41 28.57 3jxj h HIS 285 CO -0.00 0.69 0.22 0.82 0.86 0.00 0.00 177.93 180.52 3jxj h ILE 286 N 0.59 1.26 -0.73 2.45 2.04 -1.85 0.51 117.51 121.77 3jxj h ILE 286 Ca 0.14 -0.89 -0.03 0.00 1.00 0.00 0.00 64.86 65.08 3jxj h ILE 286 Cb 0.32 0.47 -0.03 0.00 -0.74 0.00 0.00 36.82 36.83 3jxj h ILE 286 CO 0.00 0.35 0.33 0.58 0.00 0.00 0.00 178.15 179.41 3jxj h VAL 287 N 1.06 1.24 0.08 1.67 2.07 -0.53 0.54 116.25 122.38 3jxj h VAL 287 Ca 0.23 -0.71 -0.00 0.00 0.82 0.00 0.00 66.70 67.03 3jxj h VAL 287 Cb 0.30 0.35 0.00 0.00 -1.52 0.00 0.00 31.29 30.42 3jxj h VAL 287 CO -0.01 0.29 -0.04 0.45 0.02 0.00 0.00 177.57 178.29 3jxj h HIS 288 N 1.04 -0.10 -0.25 1.57 3.86 0.68 -2.93 115.15 119.02 3jxj h HIS 288 Ca 0.25 -0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.46 3jxj h HIS 288 Cb 0.15 0.03 -0.01 0.00 1.06 0.00 0.00 27.41 28.64 3jxj h HIS 288 CO 0.01 0.11 0.16 -0.92 0.86 0.00 0.00 177.93 178.15 3jxj h TYR 289 N -0.29 0.32 -0.97 2.45 3.20 -0.71 0.87 116.97 121.84 3jxj h TYR 289 Ca -0.01 0.00 0.15 0.00 3.14 0.00 0.00 58.73 62.01 3jxj h TYR 289 Cb 0.25 -0.11 -0.09 0.00 1.54 0.00 0.00 36.73 38.32 3jxj h TYR 289 CO -0.01 0.22 0.59 -0.07 -1.64 0.00 0.00 178.16 177.25 3jxj h LEU 290 N 0.33 0.81 0.00 2.82 3.38 -0.90 0.10 115.31 121.85 3jxj h LEU 290 Ca 0.09 0.07 -0.13 0.00 0.09 0.00 0.00 57.88 58.00 3jxj h LEU 290 Cb -0.02 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 3jxj h LEU 290 CO -0.02 0.37 -1.37 0.35 0.09 0.00 0.00 178.44 177.86 3jxj n THR 291 N -4.72 1.03 0.73 0.22 -2.24 -1.11 -1.05 114.28 107.14 3jxj n THR 291 Ca 0.20 -0.66 0.08 0.00 -2.27 0.00 0.00 64.05 61.40 3jxj n THR 291 Cb 0.44 -0.62 -0.10 0.00 -2.10 0.00 0.00 70.33 67.95 3jxj n THR 291 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3jxj n GLU 292 N -2.82 1.51 -0.82 -0.78 1.02 0.29 -4.64 120.64 114.40 3jxj n GLU 292 Ca -0.08 -0.01 -0.30 0.00 -0.02 0.00 0.00 57.16 56.75 3jxj n GLU 292 Cb 0.77 -1.28 0.18 0.00 -0.02 0.00 0.00 31.44 31.09 3jxj n GLU 292 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 3jxj s ASN 293 N -2.63 2.53 -0.02 1.62 2.20 0.32 -4.99 114.94 113.98 3jxj s ASN 293 Ca 0.05 1.77 -0.07 0.00 -0.94 0.00 0.00 52.86 53.67 3jxj s ASN 293 Cb 0.12 -2.38 -0.30 0.00 -2.00 0.00 0.00 41.25 36.70 3jxj s ASN 293 CO 0.68 -3.27 0.79 1.23 -2.94 0.00 0.00 177.10 173.58 3jxj h GLY 294 N -1.99 0.38 0.18 0.45 0.00 -1.96 -3.41 103.07 96.73 3jxj h GLY 294 Ca -0.51 -0.98 -0.00 0.00 0.00 0.00 0.00 47.33 45.84 3jxj h GLY 294 CO 0.48 0.86 -0.04 0.84 0.00 0.00 0.00 176.54 178.69 3jxj h HIS 295 N 0.09 -0.09 -1.93 5.60 -0.00 -1.94 -3.46 115.15 113.43 3jxj h HIS 295 Ca -0.29 -0.00 -0.11 0.00 -0.00 0.00 0.00 60.37 59.97 3jxj h HIS 295 Cb 2.07 0.03 -0.28 0.00 -0.00 0.00 0.00 27.41 29.22 3jxj h HIS 295 CO 0.08 0.43 -0.43 0.21 -0.00 0.00 0.00 177.93 178.23 3jxj s LYS 296 N -2.70 0.37 0.12 5.26 2.36 -1.26 -5.10 119.74 118.78 3jxj s LYS 296 Ca -0.12 0.70 -0.04 0.00 -2.55 0.00 0.00 55.97 53.96 3jxj s LYS 296 Cb -0.01 -0.19 -0.05 0.00 -1.05 0.00 0.00 37.83 36.53 3jxj s LYS 296 CO 0.45 -0.55 0.34 -0.65 1.55 0.00 0.00 175.35 176.49 3jxj s GLN 297 N 2.60 3.58 -0.12 4.03 -0.21 -1.26 -4.84 119.66 123.44 3jxj s GLN 297 Ca 0.10 -0.15 -0.17 0.00 0.02 0.00 0.00 55.36 55.17 3jxj s GLN 297 Cb -0.15 -2.91 -0.04 0.00 1.00 0.00 0.00 33.01 30.91 3jxj s GLN 297 CO -0.16 0.51 0.42 0.00 -2.12 0.00 0.00 175.29 173.94 3jxj s ALA 298 N -1.60 3.52 -0.03 6.09 0.00 -0.22 -4.99 121.76 124.54 3jxj s ALA 298 Ca 0.39 -0.27 -0.30 0.00 0.00 0.00 0.00 51.96 51.78 3jxj s ALA 298 Cb -0.12 -2.56 -0.04 0.00 0.00 0.00 0.00 23.12 20.40 3jxj s ALA 298 CO 0.25 0.05 1.26 0.34 0.00 0.00 0.00 175.76 177.66 3jxj s ASP 299 N 0.49 6.99 0.34 0.00 2.15 -1.26 -4.59 116.67 120.79 3jxj s ASP 299 Ca 0.23 1.93 0.11 0.00 0.43 0.00 0.00 52.55 55.24 3jxj s ASP 299 Cb -0.15 -2.56 0.59 0.00 -0.30 0.00 0.00 42.92 40.51 3jxj s ASP 299 CO 0.08 -0.61 1.76 -0.07 -0.17 0.00 0.00 175.17 176.16 3jxj h LEU 300 N 8.10 0.06 0.00 -1.34 3.38 -1.99 -2.91 115.31 120.61 3jxj h LEU 300 Ca -0.36 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.59 3jxj h LEU 300 Cb 1.17 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.91 3jxj h LEU 300 CO 0.88 0.48 0.00 0.54 0.09 0.00 0.00 178.44 180.43 3jxj n ARG 301 N -4.03 0.64 -2.03 1.13 1.74 -1.26 -4.24 116.66 108.61 3jxj n ARG 301 Ca -0.02 0.01 -0.41 0.00 -0.77 0.00 0.00 57.85 56.67 3jxj n ARG 301 Cb 0.46 -1.50 -0.02 0.00 -1.02 0.00 0.00 32.46 30.38 3jxj n ARG 301 CO 0.00 0.00 0.00 0.50 -1.52 0.00 0.00 177.63 176.61 3jxj s ARG 302 N -2.30 4.29 0.05 5.56 6.06 -1.10 -4.96 118.95 126.56 3jxj s ARG 302 Ca 0.34 2.32 0.09 0.00 -2.50 0.00 0.00 55.73 55.98 3jxj s ARG 302 Cb 0.19 -3.04 -0.03 0.00 0.06 0.00 0.00 34.95 32.13 3jxj s ARG 302 CO 0.38 -0.28 -0.25 -0.65 -2.50 0.00 0.00 175.30 172.00 3jxj s GLN 303 N -1.87 1.63 0.05 5.12 -0.21 -1.26 -4.23 119.66 118.90 3jxj s GLN 303 Ca 0.50 -1.09 -0.01 0.00 0.02 0.00 0.00 55.36 54.79 3jxj s GLN 303 Cb -0.42 -1.83 0.01 0.00 1.00 0.00 0.00 33.01 31.78 3jxj s GLN 303 CO 0.56 0.47 0.07 -0.40 -2.12 0.00 0.00 175.29 173.87 3jxj n ASP 304 N 1.70 0.04 0.20 5.90 5.75 -0.72 -4.86 116.55 124.57 3jxj n ASP 304 Ca -0.17 -1.05 0.04 0.00 -0.01 0.00 0.00 54.79 53.60 3jxj n ASP 304 Cb 0.52 -0.05 0.43 0.00 -1.03 0.00 0.00 41.12 40.99 3jxj n ASP 304 CO 0.00 0.00 0.00 0.77 -0.11 0.00 0.00 177.20 177.86 3jxj h SER 305 N -0.08 0.00 1.08 -1.12 4.64 -1.91 -0.10 113.55 116.05 3jxj h SER 305 Ca -0.02 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.29 3jxj h SER 305 Cb 0.07 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.16 3jxj h SER 305 CO 0.02 0.29 -0.03 0.03 -0.87 0.00 0.00 176.83 176.27 3jxj h ARG 306 N 0.00 0.00 0.00 4.77 3.08 -1.98 -3.47 114.38 116.78 3jxj h ARG 306 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3jxj h ARG 306 Cb 0.54 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.59 3jxj h ARG 306 CO 0.04 0.03 0.00 0.41 -1.07 0.00 0.00 179.97 179.38 3jxj n GLY 307 N 0.12 0.70 3.69 0.04 0.00 -0.05 -2.21 105.19 107.48 3jxj n GLY 307 Ca 0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 3jxj n GLY 307 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3jxj s ASN 308 N -2.72 7.20 0.85 1.61 0.01 -1.26 -4.00 114.94 116.63 3jxj s ASN 308 Ca 0.00 1.65 -0.03 0.00 -0.71 0.00 0.00 52.86 53.77 3jxj s ASN 308 Cb 0.00 -2.56 0.06 0.00 0.41 0.00 0.00 41.25 39.16 3jxj s ASN 308 CO 0.00 -0.46 0.36 0.35 -1.51 0.00 0.00 177.10 175.84 3jxj n THR 309 N 4.44 0.00 -0.00 1.60 -2.24 -1.26 -1.76 114.28 115.06 3jxj n THR 309 Ca 0.09 -0.34 0.02 0.00 -2.27 0.00 0.00 64.05 61.56 3jxj n THR 309 Cb 0.48 -1.67 0.37 0.00 -2.10 0.00 0.00 70.33 67.41 3jxj n THR 309 CO 0.00 0.00 0.00 1.62 -0.57 0.00 0.00 175.07 176.12 3jxj h VAL 310 N -0.99 1.14 -0.19 2.28 3.04 -1.74 -1.47 116.25 118.33 3jxj h VAL 310 Ca -0.12 -0.43 -0.19 0.00 -1.01 0.00 0.00 66.70 64.95 3jxj h VAL 310 Cb 0.35 0.68 0.00 0.00 -2.01 0.00 0.00 31.29 30.30 3jxj h VAL 310 CO 0.09 0.17 -0.65 -0.07 -1.01 0.00 0.00 177.57 176.11 3jxj h LEU 311 N 0.54 0.78 -0.75 3.16 3.38 -1.93 -2.53 115.31 117.97 3jxj h LEU 311 Ca 0.13 -0.46 -0.08 0.00 0.09 0.00 0.00 57.88 57.56 3jxj h LEU 311 Cb 0.09 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.59 3jxj h LEU 311 CO -0.02 1.23 0.06 0.45 0.09 0.00 0.00 178.44 180.25 3jxj h HIS 312 N 0.50 1.08 -0.83 1.13 3.86 -1.81 -2.70 115.15 116.38 3jxj h HIS 312 Ca -0.01 -0.15 -0.03 0.00 -1.16 0.00 0.00 60.37 59.01 3jxj h HIS 312 Cb 1.24 -0.29 -0.04 0.00 1.06 0.00 0.00 27.41 29.37 3jxj h HIS 312 CO 0.06 0.93 0.40 0.00 0.86 0.00 0.00 177.93 180.19 3jxj h ALA 313 N 1.11 1.14 -0.67 2.45 0.00 -1.11 -1.77 119.26 120.42 3jxj h ALA 313 Ca 0.18 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 3jxj h ALA 313 Cb 0.46 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 17.89 3jxj h ALA 313 CO 0.02 0.65 0.32 -0.07 0.00 0.00 0.00 179.25 180.17 3jxj h LEU 314 N 1.18 0.85 -0.87 0.00 3.38 -1.22 -0.74 115.31 117.90 3jxj h LEU 314 Ca 0.29 -0.09 -0.07 0.00 0.09 0.00 0.00 57.88 58.10 3jxj h LEU 314 Cb 0.11 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.62 3jxj h LEU 314 CO -0.04 0.72 0.04 0.58 0.09 0.00 0.00 178.44 179.84 3jxj h VAL 315 N 0.94 1.25 -0.15 1.22 2.07 -1.12 -1.76 116.25 118.70 3jxj h VAL 315 Ca 0.23 -0.99 -0.04 0.00 0.82 0.00 0.00 66.70 66.72 3jxj h VAL 315 Cb 0.10 0.79 -0.00 0.00 -1.52 0.00 0.00 31.29 30.65 3jxj h VAL 315 CO -0.03 0.36 -0.05 0.00 0.02 0.00 0.00 177.57 177.87 3jxj h ALA 316 N 1.22 0.21 0.00 1.67 0.00 -0.32 -2.78 119.26 119.26 3jxj h ALA 316 Ca 0.16 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.83 3jxj h ALA 316 Cb 0.43 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.17 3jxj h ALA 316 CO 0.02 -0.02 0.00 -0.84 0.00 0.00 0.00 179.25 178.41 3jxj h ILE 317 N -0.01 0.00 -2.52 0.00 3.07 -1.27 -3.44 117.51 113.34 3jxj h ILE 317 Ca 0.04 -0.65 -0.56 0.00 1.55 0.00 0.00 64.86 65.24 3jxj h ILE 317 Cb 0.49 1.64 -0.01 0.00 -0.27 0.00 0.00 36.82 38.67 3jxj h ILE 317 CO 0.02 0.00 1.22 0.00 -1.05 0.00 0.00 178.15 178.34 3jxj s ALA 318 N -3.52 3.24 0.64 0.16 0.00 -0.67 -5.01 121.76 116.60 3jxj s ALA 318 Ca 0.03 0.73 0.04 0.00 0.00 0.00 0.00 51.96 52.75 3jxj s ALA 318 Cb 0.08 -3.89 0.10 0.00 0.00 0.00 0.00 23.12 19.40 3jxj s ALA 318 CO 0.58 -2.03 0.88 0.16 0.00 0.00 0.00 175.76 175.35 3jxj s ASP 319 N 5.08 4.77 -0.17 0.00 1.47 -1.26 -4.95 116.67 121.61 3jxj s ASP 319 Ca 0.81 -0.52 0.10 0.00 1.18 0.00 0.00 52.55 54.12 3jxj s ASP 319 Cb -0.30 -0.01 0.58 0.00 -0.34 0.00 0.00 42.92 42.85 3jxj s ASP 319 CO 0.33 -1.55 1.38 0.59 0.68 0.00 0.00 175.17 176.60 3jxj n ASN 320 N -2.52 4.34 -4.78 2.11 3.02 -1.26 -4.41 115.26 111.76 3jxj n ASN 320 Ca 0.14 -2.65 -0.37 0.00 -0.03 0.00 0.00 54.58 51.67 3jxj n ASN 320 Cb 0.61 -0.63 -0.05 0.00 -0.61 0.00 0.00 39.78 39.10 3jxj n ASN 320 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 3jxj s THR 321 N -2.24 3.78 0.26 3.41 -4.23 -1.26 -4.92 115.64 110.44 3jxj s THR 321 Ca 0.38 1.47 -0.04 0.00 -1.18 0.00 0.00 61.69 62.33 3jxj s THR 321 Cb 0.29 -3.81 0.18 0.00 1.34 0.00 0.00 72.50 70.50 3jxj s THR 321 CO 0.11 0.11 1.84 0.08 -0.54 0.00 0.00 174.62 176.22 3jxj h ARG 322 N 2.91 1.02 0.00 3.99 0.11 -1.99 -1.76 114.38 118.66 3jxj h ARG 322 Ca -0.48 -0.17 -0.18 0.00 0.10 0.00 0.00 59.98 59.26 3jxj h ARG 322 Cb 1.21 -0.18 -0.02 0.00 1.11 0.00 0.00 29.97 32.10 3jxj h ARG 322 CO 0.64 0.82 -0.84 0.93 0.10 0.00 0.00 179.97 181.62 3jxj h GLU 323 N 1.00 0.09 0.47 0.08 4.39 -1.97 0.14 114.58 118.79 3jxj h GLU 323 Ca 0.24 -0.10 -0.02 0.00 0.34 0.00 0.00 59.36 59.81 3jxj h GLU 323 Cb 0.18 0.03 0.00 0.00 -0.10 0.00 0.00 28.75 28.86 3jxj h GLU 323 CO -0.02 0.87 -0.23 -0.97 -1.16 0.00 0.00 179.01 177.50 3jxj h ASN 324 N 0.05 -0.54 -0.50 1.42 -0.73 -1.85 -2.93 115.58 110.51 3jxj h ASN 324 Ca -0.02 0.00 0.05 0.00 1.87 0.00 0.00 56.30 58.20 3jxj h ASN 324 Cb 1.46 0.14 -0.03 0.00 0.27 0.00 0.00 38.32 40.16 3jxj h ASN 324 CO 0.12 -0.36 0.33 0.74 -0.37 0.00 0.00 177.43 177.89 3jxj h THR 325 N -0.67 1.00 0.15 -3.57 2.02 -1.18 0.14 112.91 110.80 3jxj h THR 325 Ca -0.06 -0.16 0.01 0.00 0.77 0.00 0.00 66.41 66.96 3jxj h THR 325 Cb 0.50 0.48 -0.02 0.00 -1.74 0.00 0.00 68.15 67.38 3jxj h THR 325 CO 0.11 0.09 -0.16 0.50 0.37 0.00 0.00 175.52 176.42 3jxj h LYS 326 N 0.48 -0.33 0.12 6.66 1.63 -0.64 -1.25 116.57 123.24 3jxj h LYS 326 Ca 0.21 0.02 -0.29 0.00 -0.85 0.00 0.00 60.65 59.74 3jxj h LYS 326 Cb 0.23 0.08 -0.00 0.00 -0.60 0.00 0.00 32.23 31.94 3jxj h LYS 326 CO -0.06 -0.22 -1.41 0.27 -3.45 0.00 0.00 179.45 174.58 3jxj h PHE 327 N -0.35 0.47 -0.37 1.91 -0.00 -1.28 -2.75 116.94 114.58 3jxj h PHE 327 Ca 0.01 -0.35 0.02 0.00 -0.00 0.00 0.00 57.97 57.65 3jxj h PHE 327 Cb 0.33 -0.02 -0.03 0.00 -0.00 0.00 0.00 35.95 36.24 3jxj h PHE 327 CO -0.14 1.34 0.21 0.28 -0.00 0.00 0.00 178.31 180.00 3jxj h VAL 328 N 0.07 1.03 -0.11 0.88 2.07 -1.00 0.48 116.25 119.66 3jxj h VAL 328 Ca -0.20 -0.15 0.04 0.00 0.82 0.00 0.00 66.70 67.22 3jxj h VAL 328 Cb 2.00 0.57 -0.05 0.00 -1.52 0.00 0.00 31.29 32.29 3jxj h VAL 328 CO 0.18 0.08 -0.20 0.74 0.02 0.00 0.00 177.57 178.38 3jxj h THR 329 N 0.42 0.49 -0.61 2.57 2.02 -1.28 0.14 112.91 116.67 3jxj h THR 329 Ca 0.15 0.00 -0.06 0.00 0.77 0.00 0.00 66.41 67.26 3jxj h THR 329 Cb 0.02 0.49 -0.03 0.00 -1.74 0.00 0.00 68.15 66.89 3jxj h THR 329 CO -0.07 0.00 0.12 0.50 0.37 0.00 0.00 175.52 176.43 3jxj h LYS 330 N -0.27 0.97 -0.19 6.66 3.64 -1.06 -1.62 116.57 124.69 3jxj h LYS 330 Ca 0.09 -0.23 -0.20 0.00 -1.27 0.00 0.00 60.65 59.05 3jxj h LYS 330 Cb 0.41 -0.13 0.01 0.00 -0.41 0.00 0.00 32.23 32.10 3jxj h LYS 330 CO -0.27 0.88 -0.65 1.98 -2.27 0.00 0.00 179.45 179.12 3jxj h MET 331 N 0.92 0.78 -0.36 1.90 4.05 0.16 -2.28 114.93 120.10 3jxj h MET 331 Ca 0.19 -0.58 -0.00 0.00 -0.28 0.00 0.00 59.70 59.03 3jxj h MET 331 Cb 0.37 0.10 -0.02 0.00 -0.80 0.00 0.00 31.60 31.26 3jxj h MET 331 CO 0.01 1.20 0.22 -0.92 0.23 0.00 0.00 176.91 177.65 3jxj h TYR 332 N 0.52 0.46 -0.46 1.39 5.03 -0.38 -2.59 116.97 120.94 3jxj h TYR 332 Ca -0.03 0.00 -0.13 0.00 2.58 0.00 0.00 58.73 61.15 3jxj h TYR 332 Cb 1.28 -0.15 -0.01 0.00 1.55 0.00 0.00 36.73 39.39 3jxj h TYR 332 CO 0.09 0.32 -0.24 -0.44 -1.32 0.00 0.00 178.16 176.57 3jxj h ASP 333 N 0.47 0.97 -0.79 -2.11 3.32 -1.34 -2.73 116.42 114.21 3jxj h ASP 333 Ca 0.13 -0.37 0.08 0.00 0.02 0.00 0.00 57.03 56.88 3jxj h ASP 333 Cb -0.01 -0.27 -0.05 0.00 0.22 0.00 0.00 39.33 39.22 3jxj h ASP 333 CO -0.03 1.16 0.52 0.25 -1.72 0.00 0.00 179.24 179.42 3jxj h LEU 334 N 0.81 0.72 0.03 1.55 6.46 -1.21 -2.64 115.31 121.03 3jxj h LEU 334 Ca 0.10 0.01 -0.14 0.00 -0.12 0.00 0.00 57.88 57.73 3jxj h LEU 334 Cb 0.80 -0.14 0.01 0.00 -0.73 0.00 0.00 40.66 40.60 3jxj h LEU 334 CO 0.07 0.45 -0.56 -0.07 -0.62 0.00 0.00 178.44 177.71 3jxj h LEU 335 N 0.81 0.45 -0.39 2.25 3.38 -1.28 -2.75 115.31 117.77 3jxj h LEU 335 Ca 0.35 -0.81 0.07 0.00 0.09 0.00 0.00 57.88 57.59 3jxj h LEU 335 Cb 0.32 -0.14 -0.07 0.00 0.09 0.00 0.00 40.66 40.87 3jxj h LEU 335 CO -0.13 1.20 -0.02 -0.07 0.09 0.00 0.00 178.44 179.51 3jxj h LEU 336 N -0.26 -0.20 -0.72 1.67 3.38 -1.33 0.14 115.31 118.00 3jxj h LEU 336 Ca -0.08 0.10 -0.07 0.00 0.09 0.00 0.00 57.88 57.92 3jxj h LEU 336 Cb 1.31 0.18 -0.03 0.00 0.09 0.00 0.00 40.66 42.21 3jxj h LEU 336 CO 0.11 -0.06 0.16 0.40 0.09 0.00 0.00 178.44 179.14 3jxj h ILE 337 N 0.08 1.26 -0.36 1.22 2.04 -1.55 0.22 117.51 120.43 3jxj h ILE 337 Ca 0.19 -0.99 -0.08 0.00 1.00 0.00 0.00 64.86 64.98 3jxj h ILE 337 Cb 0.28 0.54 -0.02 0.00 -0.74 0.00 0.00 36.82 36.88 3jxj h ILE 337 CO -0.34 0.38 -0.11 0.50 0.00 0.00 0.00 178.15 178.58 3jxj h LYS 338 N 1.08 0.62 -0.03 2.37 3.11 -1.13 -1.65 116.57 120.94 3jxj h LYS 338 Ca 0.22 -0.19 -0.09 0.00 -2.81 0.00 0.00 60.65 57.78 3jxj h LYS 338 Cb 0.38 -0.06 0.01 0.00 -1.00 0.00 0.00 32.23 31.56 3jxj h LYS 338 CO 0.00 0.72 -0.34 0.00 -2.81 0.00 0.00 179.45 177.03 3jxj h ALA 340 N 0.34 1.49 -0.03 0.00 0.00 -0.55 0.61 119.26 121.11 3jxj h ALA 340 Ca -0.03 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 54.78 3jxj h ALA 340 Cb 1.04 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.61 3jxj h ALA 340 CO 0.07 0.42 0.02 -0.22 0.00 0.00 0.00 179.25 179.53 3jxj h LYS 341 N 0.73 0.05 0.01 0.00 3.64 -1.32 -3.16 116.57 116.51 3jxj h LYS 341 Ca 0.19 -0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.56 3jxj h LYS 341 Cb 0.05 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 31.86 3jxj h LYS 341 CO -0.03 0.13 -0.00 -0.07 -2.27 0.00 0.00 179.45 177.21 3jxj h LEU 342 N -0.05 -0.01 -7.57 5.20 3.38 -1.09 -3.40 115.31 111.77 3jxj h LEU 342 Ca 0.01 -0.74 -0.68 0.00 0.09 0.00 0.00 57.88 56.56 3jxj h LEU 342 Cb 0.10 0.00 -0.37 0.00 0.09 0.00 0.00 40.66 40.48 3jxj h LEU 342 CO -0.00 0.74 -0.46 -0.36 0.09 0.00 0.00 178.44 178.44 3jxj s PHE 343 N -3.20 3.41 0.13 1.13 0.08 0.21 -4.95 117.98 114.79 3jxj s PHE 343 Ca -0.17 -2.78 0.25 0.00 0.12 0.00 0.00 56.93 54.34 3jxj s PHE 343 Cb -0.01 -3.11 0.95 0.00 -0.57 0.00 0.00 43.02 40.28 3jxj s PHE 343 CO 0.67 -0.84 1.84 -1.00 -0.10 0.00 0.00 175.22 175.78 3jxj h PRO 344 N 7.09 0.00 0.11 0.24 0.13 -1.76 -3.28 132.00 134.54 3jxj h PRO 344 Ca -0.05 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.08 3jxj h PRO 344 Cb 0.96 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.09 3jxj h PRO 344 CO 0.70 0.21 -0.05 -0.44 -0.23 0.00 0.00 178.00 178.18 3jxj h ASP 345 N 0.00 -0.12 -3.42 1.44 3.32 -1.92 -3.46 116.42 112.26 3jxj h ASP 345 Ca -0.00 -0.46 -0.54 0.00 0.02 0.00 0.00 57.03 56.05 3jxj h ASP 345 Cb 0.73 0.03 -0.04 0.00 0.22 0.00 0.00 39.33 40.27 3jxj h ASP 345 CO 0.03 0.47 0.14 0.42 -1.72 0.00 0.00 179.24 178.58 3jxj s THR 346 N -3.42 4.70 -0.25 0.35 -4.23 -1.23 -5.05 115.64 106.49 3jxj s THR 346 Ca -0.14 1.60 -0.15 0.00 -1.18 0.00 0.00 61.69 61.82 3jxj s THR 346 Cb 0.00 -4.10 -0.04 0.00 1.34 0.00 0.00 72.50 69.71 3jxj s THR 346 CO 0.54 0.40 0.36 0.21 -0.54 0.00 0.00 174.62 175.58 3jxj s ASN 347 N -0.25 6.28 0.07 3.99 3.04 -1.26 -4.75 114.94 122.06 3jxj s ASN 347 Ca 0.37 0.32 -0.21 0.00 0.04 0.00 0.00 52.86 53.39 3jxj s ASN 347 Cb -0.21 -2.21 -0.11 0.00 -1.54 0.00 0.00 41.25 37.19 3jxj s ASN 347 CO 0.23 -0.14 1.55 0.25 -3.04 0.00 0.00 177.10 175.95 3jxj h LEU 348 N 8.29 0.24 0.00 3.21 6.46 -1.95 -2.44 115.31 129.13 3jxj h LEU 348 Ca -0.33 -0.24 0.00 0.00 -0.12 0.00 0.00 57.88 57.19 3jxj h LEU 348 Cb 1.16 -0.06 0.00 0.00 -0.73 0.00 0.00 40.66 41.03 3jxj h LEU 348 CO 0.66 0.42 0.00 -1.84 -0.62 0.00 0.00 178.44 177.06 3jxj n GLU 349 N -4.81 0.20 0.19 1.25 0.28 -1.26 -2.30 120.64 114.19 3jxj n GLU 349 Ca -0.05 0.13 0.09 0.00 -0.16 0.00 0.00 57.16 57.16 3jxj n GLU 349 Cb 0.17 -1.50 0.16 0.00 1.43 0.00 0.00 31.44 31.69 3jxj n GLU 349 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 3jxj h ALA 350 N 2.82 0.88 -2.87 -1.84 0.00 -1.86 -3.38 119.26 113.00 3jxj h ALA 350 Ca 0.00 -0.18 -0.52 0.00 0.00 0.00 0.00 54.91 54.20 3jxj h ALA 350 Cb 0.21 -0.03 0.06 0.00 0.00 0.00 0.00 17.79 18.04 3jxj h ALA 350 CO 0.00 0.25 0.64 -0.51 0.00 0.00 0.00 179.25 179.63 3jxj s LEU 351 N -6.34 4.43 -0.11 0.00 1.43 -0.97 -4.91 118.68 112.21 3jxj s LEU 351 Ca 0.05 2.68 -0.04 0.00 -1.03 0.00 0.00 54.13 55.80 3jxj s LEU 351 Cb 0.06 -3.65 -0.03 0.00 0.03 0.00 0.00 46.19 42.60 3jxj s LEU 351 CO 0.69 -0.54 0.02 -0.76 0.23 0.00 0.00 176.35 176.00 3jxj s LEU 352 N -1.74 3.67 0.94 1.79 1.43 -1.26 -4.52 118.68 119.00 3jxj s LEU 352 Ca 0.49 0.14 -0.15 0.00 -1.03 0.00 0.00 54.13 53.58 3jxj s LEU 352 Cb -0.40 -1.87 0.18 0.00 0.03 0.00 0.00 46.19 44.13 3jxj s LEU 352 CO 0.52 0.32 1.26 0.54 0.23 0.00 0.00 176.35 179.23 3jxj s ASN 353 N -0.55 3.27 0.21 2.29 4.22 -0.50 -4.87 114.94 119.00 3jxj s ASN 353 Ca 0.10 0.47 0.20 0.00 -2.14 0.00 0.00 52.86 51.49 3jxj s ASN 353 Cb -0.12 -0.68 0.89 0.00 1.28 0.00 0.00 41.25 42.62 3jxj s ASN 353 CO 0.02 -2.66 1.61 0.59 -2.04 0.00 0.00 177.10 174.63 3jxj n ASN 354 N -3.75 0.49 0.00 3.54 5.03 -0.94 -0.22 115.26 119.40 3jxj n ASN 354 Ca 0.13 0.64 0.13 0.00 0.87 0.00 0.00 54.58 56.35 3jxj n ASN 354 Cb 0.60 -0.74 0.64 0.00 -1.02 0.00 0.00 39.78 39.26 3jxj n ASN 354 CO 0.00 0.00 0.00 0.47 -1.83 0.00 0.00 177.26 175.90 3jxj n ASP 355 N -2.06 0.00 0.00 6.41 9.92 -1.26 -4.90 116.55 124.65 3jxj n ASP 355 Ca 0.02 0.12 0.00 0.00 -0.53 0.00 0.00 54.79 54.40 3jxj n ASP 355 Cb 0.17 -0.37 0.00 0.00 -0.64 0.00 0.00 41.12 40.28 3jxj n ASP 355 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 3jxj n GLY 356 N 1.10 0.42 3.59 0.44 0.00 0.69 -5.04 105.19 106.38 3jxj n GLY 356 Ca 0.10 -1.01 -0.31 0.00 0.00 0.00 0.00 46.02 44.81 3jxj n GLY 356 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3jxj s LEU 357 N 0.00 3.10 0.74 0.99 1.43 -1.24 -4.84 118.68 118.86 3jxj s LEU 357 Ca 0.00 -0.26 -0.06 0.00 -1.03 0.00 0.00 54.13 52.78 3jxj s LEU 357 Cb 0.00 -1.84 0.10 0.00 0.03 0.00 0.00 46.19 44.48 3jxj s LEU 357 CO 0.00 0.23 1.04 -0.94 0.23 0.00 0.00 176.35 176.91 3jxj s SER 358 N -1.79 4.47 0.31 2.29 1.04 -1.26 -1.41 113.70 117.34 3jxj s SER 358 Ca 0.19 0.20 -0.00 0.00 0.48 0.00 0.00 55.95 56.82 3jxj s SER 358 Cb -0.11 -0.71 0.48 0.00 0.10 0.00 0.00 66.02 65.78 3jxj s SER 358 CO 0.11 -1.80 1.91 -0.65 0.98 0.00 0.00 173.24 173.79 3jxj h PRO 359 N -0.69 0.88 -0.08 4.02 0.11 -1.79 0.84 132.00 135.28 3jxj h PRO 359 Ca -0.42 -0.11 -0.00 0.00 0.11 0.00 0.00 66.00 65.57 3jxj h PRO 359 Cb 1.29 -0.17 -0.00 0.00 0.11 0.00 0.00 31.00 32.23 3jxj h PRO 359 CO 0.51 0.68 0.04 1.25 -0.21 0.00 0.00 178.00 180.27 3jxj h LEU 360 N 0.88 0.11 -0.68 2.35 5.85 -1.94 0.57 115.31 122.44 3jxj h LEU 360 Ca 0.22 -0.15 -0.11 0.00 0.84 0.00 0.00 57.88 58.68 3jxj h LEU 360 Cb 0.09 -0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.07 3jxj h LEU 360 CO -0.03 0.23 -0.16 0.24 -0.34 0.00 0.00 178.44 178.38 3jxj h MET 361 N -0.01 0.85 -0.58 1.25 2.86 -1.90 -0.54 114.93 116.86 3jxj h MET 361 Ca 0.03 -0.32 -0.04 0.00 -2.06 0.00 0.00 59.70 57.31 3jxj h MET 361 Cb 0.15 -0.05 -0.03 0.00 0.06 0.00 0.00 31.60 31.73 3jxj h MET 361 CO -0.00 0.95 0.21 1.98 1.06 0.00 0.00 176.91 181.11 3jxj h MET 362 N 0.76 0.89 -1.01 1.72 1.85 -0.70 0.14 114.93 118.58 3jxj h MET 362 Ca 0.11 -0.17 0.04 0.00 -0.61 0.00 0.00 59.70 59.07 3jxj h MET 362 Cb 0.68 -0.14 -0.06 0.00 0.43 0.00 0.00 31.60 32.51 3jxj h MET 362 CO 0.05 0.78 0.66 0.00 -0.40 0.00 0.00 176.91 178.00 3jxj h ALA 363 N 1.07 1.35 -0.31 0.39 0.00 -0.50 -0.18 119.26 121.07 3jxj h ALA 363 Ca 0.19 -0.04 -0.13 0.00 0.00 0.00 0.00 54.91 54.93 3jxj h ALA 363 Cb 0.24 -0.35 -0.00 0.00 0.00 0.00 0.00 17.79 17.67 3jxj h ALA 363 CO -0.01 0.54 -0.30 0.00 0.00 0.00 0.00 179.25 179.49 3jxj h ALA 364 N 1.42 0.45 -0.43 0.00 0.00 -0.54 0.72 119.26 120.89 3jxj h ALA 364 Ca 0.41 -0.41 -0.11 0.00 0.00 0.00 0.00 54.91 54.79 3jxj h ALA 364 Cb 0.02 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 3jxj h ALA 364 CO -0.13 0.48 -0.18 -0.22 0.00 0.00 0.00 179.25 179.20 3jxj h LYS 365 N 0.51 0.88 -0.01 0.00 3.64 -0.22 -3.02 116.57 118.35 3jxj h LYS 365 Ca 0.05 -0.37 0.00 0.00 -1.27 0.00 0.00 60.65 59.06 3jxj h LYS 365 Cb 0.87 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.66 3jxj h LYS 365 CO 0.07 1.02 -0.11 0.25 -2.27 0.00 0.00 179.45 178.41 3jxj n THR 366 N -4.22 0.00 -2.26 1.00 -2.24 -0.12 -4.96 114.28 101.48 3jxj n THR 366 Ca -0.01 -0.16 -0.01 0.00 -2.27 0.00 0.00 64.05 61.61 3jxj n THR 366 Cb 0.42 0.29 0.00 0.00 -2.10 0.00 0.00 70.33 68.95 3jxj n THR 366 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3jxj n GLY 367 N 1.24 0.62 3.44 3.38 0.00 -0.82 -4.99 105.19 108.05 3jxj n GLY 367 Ca 0.16 -0.76 -0.44 0.00 0.00 0.00 0.00 46.02 44.98 3jxj n GLY 367 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3jxj s LYS 368 N -4.52 4.08 0.07 1.61 -0.14 0.19 -4.87 119.74 116.16 3jxj s LYS 368 Ca 0.01 -2.67 -0.26 0.00 -1.36 0.00 0.00 55.97 51.69 3jxj s LYS 368 Cb -0.00 -4.94 -0.17 0.00 -1.68 0.00 0.00 37.83 31.04 3jxj s LYS 368 CO 0.01 -1.65 1.66 0.82 -0.76 0.00 0.00 175.35 175.42 3jxj h ILE 369 N 4.52 0.80 -0.06 2.17 2.04 -1.94 -1.45 117.51 123.58 3jxj h ILE 369 Ca 0.28 -0.08 0.04 0.00 1.00 0.00 0.00 64.86 66.09 3jxj h ILE 369 Cb 0.88 0.84 -0.06 0.00 -0.74 0.00 0.00 36.82 37.75 3jxj h ILE 369 CO 1.18 0.02 -0.38 1.23 0.00 0.00 0.00 178.15 180.20 3jxj h GLY 370 N -0.34 -0.65 1.10 5.37 0.00 -1.91 -0.66 103.07 105.98 3jxj h GLY 370 Ca -0.03 0.47 -0.13 0.00 0.00 0.00 0.00 47.33 47.64 3jxj h GLY 370 CO 0.05 -0.24 -0.21 1.19 0.00 0.00 0.00 176.54 177.33 3jxj h ILE 371 N -0.50 1.27 -0.85 2.60 6.09 -1.91 -2.86 117.51 121.35 3jxj h ILE 371 Ca 0.07 -1.38 0.04 0.00 -1.37 0.00 0.00 64.86 62.22 3jxj h ILE 371 Cb 0.61 1.13 -0.05 0.00 0.47 0.00 0.00 36.82 38.98 3jxj h ILE 371 CO -0.34 0.48 0.54 0.15 -3.07 0.00 0.00 178.15 175.91 3jxj h PHE 372 N 0.85 1.01 -0.33 2.19 3.57 -0.66 -1.46 116.94 122.10 3jxj h PHE 372 Ca 0.11 0.03 -0.15 0.00 3.53 0.00 0.00 57.97 61.49 3jxj h PHE 372 Cb 0.79 -0.33 -0.01 0.00 2.79 0.00 0.00 35.95 39.19 3jxj h PHE 372 CO 0.05 0.56 -0.38 1.96 -2.23 0.00 0.00 178.31 178.28 3jxj h GLN 373 N 1.03 0.78 -0.57 1.11 4.20 -1.07 -2.62 115.11 117.97 3jxj h GLN 373 Ca 0.35 -0.39 -0.10 0.00 0.06 0.00 0.00 58.65 58.56 3jxj h GLN 373 Cb 0.05 0.01 -0.02 0.00 0.30 0.00 0.00 27.48 27.82 3jxj h GLN 373 CO -0.13 1.02 -0.03 1.25 -0.67 0.00 0.00 178.83 180.27 3jxj h HIS 374 N 0.64 1.11 -0.12 2.96 2.76 -1.20 0.23 115.15 121.52 3jxj h HIS 374 Ca 0.06 -0.20 -0.00 0.00 -2.20 0.00 0.00 60.37 58.03 3jxj h HIS 374 Cb 0.93 -0.29 -0.01 0.00 1.55 0.00 0.00 27.41 29.59 3jxj h HIS 374 CO 0.05 1.00 0.07 0.82 -1.30 0.00 0.00 177.93 178.57 3jxj h ILE 375 N 0.92 1.08 -0.01 6.26 2.04 -1.24 0.48 117.51 127.05 3jxj h ILE 375 Ca 0.16 -0.22 0.00 0.00 1.00 0.00 0.00 64.86 65.80 3jxj h ILE 375 Cb 0.58 1.01 -0.00 0.00 -0.74 0.00 0.00 36.82 37.67 3jxj h ILE 375 CO 0.03 0.07 -0.01 0.40 0.00 0.00 0.00 178.15 178.65 3jxj h ILE 376 N 0.11 0.98 -0.04 -0.67 1.08 -1.32 0.63 117.51 118.29 3jxj h ILE 376 Ca 0.04 0.00 -0.02 0.00 -0.39 0.00 0.00 64.86 64.49 3jxj h ILE 376 Cb 0.06 0.98 -0.00 0.00 -3.07 0.00 0.00 36.82 34.79 3jxj h ILE 376 CO -0.01 0.00 -0.08 -0.09 -0.69 0.00 0.00 178.15 177.29 3jxj h ARG 377 N -0.01 0.05 0.31 2.37 2.43 -0.29 -2.01 114.38 117.24 3jxj h ARG 377 Ca 0.00 -0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.15 3jxj h ARG 377 Cb 0.01 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.56 3jxj h ARG 377 CO -0.01 0.13 -0.15 -0.09 -1.51 0.00 0.00 179.97 178.34 3jxj h ARG 378 N 0.05 -0.41 -0.63 0.20 2.43 0.39 -3.13 114.38 113.28 3jxj h ARG 378 Ca 0.01 0.03 0.18 0.00 -0.81 0.00 0.00 59.98 59.39 3jxj h ARG 378 Cb 0.17 0.09 -0.03 0.00 -0.42 0.00 0.00 29.97 29.79 3jxj h ARG 378 CO 0.01 -0.11 0.45 0.93 -1.51 0.00 0.00 179.97 179.74 3jxj h GLU 379 N -1.00 0.04 -0.28 0.20 5.08 -0.39 0.32 114.58 118.56 3jxj h GLU 379 Ca -0.04 -0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.26 3jxj h GLU 379 Cb 0.48 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.71 3jxj h GLU 379 CO 0.07 0.03 -0.05 0.82 -1.00 0.00 0.00 179.01 178.88 3jxj h ILE 380 N 0.04 1.28 -0.94 3.13 2.04 -1.48 -1.56 117.51 120.02 3jxj h ILE 380 Ca 0.30 -1.05 0.04 0.00 1.00 0.00 0.00 64.86 65.15 3jxj h ILE 380 Cb 1.15 1.40 -0.06 0.00 -0.74 0.00 0.00 36.82 38.57 3jxj h ILE 380 CO -0.02 0.33 0.61 0.00 0.00 0.00 0.00 178.15 179.08 3jxj h ALA 381 N 0.79 1.25 -0.58 1.87 0.00 -0.37 -1.66 119.26 120.56 3jxj h ALA 381 Ca 0.07 -0.04 -0.09 0.00 0.00 0.00 0.00 54.91 54.85 3jxj h ALA 381 Cb 0.52 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 3jxj h ALA 381 CO 0.02 0.48 0.01 -0.44 0.00 0.00 0.00 179.25 179.33 3jxj h ASP 382 N 1.19 0.98 0.43 0.00 5.19 -1.09 -2.48 116.42 120.63 3jxj h ASP 382 Ca 0.38 -0.26 -0.05 0.00 -0.62 0.00 0.00 57.03 56.47 3jxj h ASP 382 Cb 0.01 -0.26 -0.01 0.00 0.18 0.00 0.00 39.33 39.25 3jxj h ASP 382 CO -0.12 1.02 -0.25 0.00 -3.12 0.00 0.00 179.24 176.77 3jxj h ALA 383 N 1.08 1.32 0.00 3.45 0.00 -0.77 -3.14 119.26 121.20 3jxj h ALA 383 Ca 0.17 -0.23 -0.59 0.00 0.00 0.00 0.00 54.91 54.26 3jxj h ALA 383 Cb 0.52 -0.04 0.02 0.00 0.00 0.00 0.00 17.79 18.29 3jxj h ALA 383 CO 0.03 0.31 3.37 0.00 0.00 0.00 0.00 179.25 182.96 3jxj n ALA 384 N -2.37 6.39 -2.69 0.00 0.00 -0.67 -3.94 120.51 117.22 3jxj n ALA 384 Ca -0.02 -3.10 -0.05 0.00 0.00 0.00 0.00 53.44 50.28 3jxj n ALA 384 Cb 0.34 -3.29 0.04 0.00 0.00 0.00 0.00 19.45 16.54 3jxj n ALA 384 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3jxj n ALA 385 N 4.14 3.05 -2.43 0.00 0.00 -1.19 -5.00 120.51 119.09 3jxj n ALA 385 Ca 0.65 -2.96 -0.22 0.00 0.00 0.00 0.00 53.44 50.91 3jxj n ALA 385 Cb 0.22 -0.79 -0.11 0.00 0.00 0.00 0.00 19.45 18.78 3jxj n ALA 385 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.50 174.12 3jxj s HIS 386 N -3.74 1.98 0.00 0.00 -3.43 -1.25 -5.19 115.29 103.66 3jxj s HIS 386 Ca 0.31 -0.44 0.00 0.00 -0.80 0.00 0.00 55.06 54.13 3jxj s HIS 386 Cb 0.34 -0.94 0.00 0.00 -1.43 0.00 0.00 32.58 30.56 3jxj s HIS 386 CO -0.02 0.45 0.00 0.72 -2.00 0.00 0.00 174.74 173.89