#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3k2m n LYS 143 N 0.00 0.04 -2.54 5.31 5.02 -1.26 -4.78 118.16 119.95 3k2m n LYS 143 Ca 0.00 0.25 -0.42 0.00 -2.02 0.00 0.00 58.31 56.12 3k2m n LYS 143 Cb 0.00 -1.57 -0.03 0.00 -0.02 0.00 0.00 35.03 33.41 3k2m n LYS 143 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 3k2m s HIS 144 N -3.06 3.56 0.33 2.13 3.76 -1.26 -4.94 115.29 115.81 3k2m s HIS 144 Ca 0.07 1.51 0.21 0.00 -0.15 0.00 0.00 55.06 56.70 3k2m s HIS 144 Cb 0.11 -3.28 1.03 0.00 1.11 0.00 0.00 32.58 31.55 3k2m s HIS 144 CO 0.32 -0.69 1.91 0.66 -0.85 0.00 0.00 174.74 176.10 3k2m h SER 145 N 6.27 0.00 0.12 1.40 4.64 -1.97 -2.46 113.55 121.56 3k2m h SER 145 Ca -0.42 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.90 3k2m h SER 145 Cb 1.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 3k2m h SER 145 CO 0.77 0.25 -0.35 -2.67 -0.87 0.00 0.00 176.83 173.96 3k2m n TRP 146 N -3.75 0.00 -3.23 4.77 4.27 -1.26 -4.52 117.44 113.71 3k2m n TRP 146 Ca -0.01 0.00 -0.43 0.00 -3.89 0.00 0.00 57.50 53.16 3k2m n TRP 146 Cb 0.35 -0.07 -0.07 0.00 -1.36 0.00 0.00 31.31 30.16 3k2m n TRP 146 CO 0.00 0.00 0.00 -0.47 -2.29 0.00 0.00 177.69 174.93 3k2m s TYR 147 N -2.48 3.11 -1.78 -2.67 5.04 -0.93 0.33 117.35 117.97 3k2m s TYR 147 Ca 0.22 -0.47 0.22 0.00 -2.44 0.00 0.00 57.07 54.61 3k2m s TYR 147 Cb 0.19 -3.26 -0.02 0.00 0.35 0.00 0.00 41.96 39.22 3k2m s TYR 147 CO 0.54 -0.88 1.07 0.72 -1.34 0.00 0.00 175.55 175.66 3k2m n HIS 148 N 5.89 0.00 -4.75 4.97 8.25 0.38 -4.56 115.22 125.39 3k2m n HIS 148 Ca -0.07 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.39 3k2m n HIS 148 Cb 0.46 -0.01 0.00 0.00 1.12 0.00 0.00 29.99 31.56 3k2m n HIS 148 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3k2m n GLY 149 N 1.44 2.05 3.56 -1.41 0.00 -1.24 -4.41 105.19 105.19 3k2m n GLY 149 Ca 0.08 -0.54 -0.18 0.00 0.00 0.00 0.00 46.02 45.38 3k2m n GLY 149 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3k2m s PRO 150 N 0.00 1.82 -0.06 1.61 0.04 -1.26 -1.39 135.00 135.76 3k2m s PRO 150 Ca 0.00 0.03 -0.00 0.00 0.04 0.00 0.00 61.00 61.07 3k2m s PRO 150 Cb 0.00 -4.92 0.02 0.00 0.04 0.00 0.00 34.50 29.65 3k2m s PRO 150 CO 0.00 -4.33 -0.02 0.08 0.04 0.00 0.00 177.00 172.76 3k2m s VAL 151 N 13.76 0.46 0.85 -0.36 1.01 -1.26 -4.99 120.40 129.86 3k2m s VAL 151 Ca 0.84 -0.01 -0.10 0.00 0.00 0.00 0.00 61.98 62.70 3k2m s VAL 151 Cb -0.09 -0.55 0.10 0.00 0.00 0.00 0.00 36.38 35.84 3k2m s VAL 151 CO 0.08 0.24 1.11 -0.94 0.00 0.00 0.00 175.10 175.58 3k2m s SER 152 N 1.38 3.73 0.21 3.32 1.04 -1.26 -4.56 113.70 117.57 3k2m s SER 152 Ca -0.04 1.91 -0.09 0.00 0.48 0.00 0.00 55.95 58.21 3k2m s SER 152 Cb -0.13 -2.50 0.22 0.00 0.10 0.00 0.00 66.02 63.71 3k2m s SER 152 CO -0.03 -2.54 1.84 -0.09 0.98 0.00 0.00 173.24 173.41 3k2m h ARG 153 N -1.48 0.84 -0.14 4.02 2.43 -1.99 0.18 114.38 118.24 3k2m h ARG 153 Ca -0.44 -0.05 -0.00 0.00 -0.81 0.00 0.00 59.98 58.67 3k2m h ARG 153 Cb 1.25 -0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 30.61 3k2m h ARG 153 CO 0.48 0.56 0.07 -0.97 -1.51 0.00 0.00 179.97 178.60 3k2m h ASN 154 N 0.86 0.18 -0.50 -3.80 -1.24 -2.00 -1.77 115.58 107.32 3k2m h ASN 154 Ca 0.30 -0.11 0.09 0.00 0.71 0.00 0.00 56.30 57.28 3k2m h ASN 154 Cb 0.06 -0.05 -0.07 0.00 0.73 0.00 0.00 38.32 38.99 3k2m h ASN 154 CO -0.13 0.24 0.10 0.00 -1.29 0.00 0.00 177.43 176.35 3k2m h ALA 155 N 0.95 0.56 -0.68 1.57 0.00 -1.85 -2.03 119.26 117.78 3k2m h ALA 155 Ca 0.05 0.11 0.01 0.00 0.00 0.00 0.00 54.91 55.07 3k2m h ALA 155 Cb 0.11 0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 3k2m h ALA 155 CO -0.01 -0.31 0.45 0.00 0.00 0.00 0.00 179.25 179.38 3k2m h ALA 156 N 1.39 0.86 -0.20 0.00 0.00 -0.19 0.24 119.26 121.35 3k2m h ALA 156 Ca 0.25 -0.05 -0.11 0.00 0.00 0.00 0.00 54.91 55.01 3k2m h ALA 156 Cb 0.34 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 3k2m h ALA 156 CO -0.33 0.28 -0.33 0.93 0.00 0.00 0.00 179.25 179.80 3k2m h GLU 157 N 0.92 0.42 0.56 0.00 5.08 -1.21 0.36 114.58 120.72 3k2m h GLU 157 Ca 0.25 -0.18 -0.03 0.00 -1.00 0.00 0.00 59.36 58.40 3k2m h GLU 157 Cb -0.10 -0.01 0.01 0.00 0.50 0.00 0.00 28.75 29.14 3k2m h GLU 157 CO -0.06 0.70 -0.27 -0.92 -1.00 0.00 0.00 179.01 177.47 3k2m h TYR 158 N 0.36 -0.70 -0.90 4.33 3.20 -0.84 -0.56 116.97 121.87 3k2m h TYR 158 Ca 0.04 -0.02 0.16 0.00 3.14 0.00 0.00 58.73 62.06 3k2m h TYR 158 Cb 0.76 0.23 -0.07 0.00 1.54 0.00 0.00 36.73 39.19 3k2m h TYR 158 CO 0.02 -0.39 0.58 1.25 -1.64 0.00 0.00 178.16 177.98 3k2m h LEU 159 N -0.86 0.62 0.00 2.82 5.85 -0.12 -1.34 115.31 122.28 3k2m h LEU 159 Ca -0.08 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.69 3k2m h LEU 159 Cb 0.62 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 41.57 3k2m h LEU 159 CO 0.13 0.30 -0.50 0.18 -0.34 0.00 0.00 178.44 178.20 3k2m n LEU 160 N -4.57 0.51 0.07 2.25 4.77 0.12 -4.16 117.00 115.99 3k2m n LEU 160 Ca 0.18 0.11 0.10 0.00 -0.03 0.00 0.00 56.01 56.37 3k2m n LEU 160 Cb 0.52 -0.25 0.55 0.00 -2.33 0.00 0.00 43.42 41.91 3k2m n LEU 160 CO 0.29 0.06 1.14 0.77 -1.33 0.00 0.00 177.39 178.32 3k2m h SER 161 N 0.00 0.22 -0.87 -1.43 4.64 0.11 -0.89 113.55 115.33 3k2m h SER 161 Ca 0.00 -0.00 -0.44 0.00 -0.47 0.00 0.00 61.79 60.88 3k2m h SER 161 Cb 0.57 -0.05 -0.26 0.00 -0.31 0.00 0.00 62.40 62.35 3k2m h SER 161 CO 0.00 0.15 0.50 -1.54 -0.87 0.00 0.00 176.83 175.07 3k2m n SER 162 N -4.48 3.60 -2.62 4.97 3.41 -1.26 -4.96 113.62 112.27 3k2m n SER 162 Ca 0.04 -3.61 -0.05 0.00 -0.26 0.00 0.00 58.87 54.99 3k2m n SER 162 Cb 0.23 -0.80 0.01 0.00 -0.26 0.00 0.00 64.21 63.39 3k2m n SER 162 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3k2m n GLY 163 N -1.08 2.38 1.49 5.00 0.00 -0.34 -5.13 105.19 107.51 3k2m n GLY 163 Ca 0.54 -2.17 -0.12 0.00 0.00 0.00 0.00 46.02 44.26 3k2m n GLY 163 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 3k2m n ILE 164 N -1.07 0.00 -1.68 -0.61 -5.35 -1.26 -5.03 119.36 104.36 3k2m n ILE 164 Ca 0.02 -1.01 -0.45 0.00 -0.27 0.00 0.00 62.75 61.04 3k2m n ILE 164 Cb 0.13 0.27 -0.04 0.00 -1.74 0.00 0.00 39.64 38.27 3k2m n ILE 164 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 3k2m n ASN 165 N -1.44 3.45 0.00 7.28 3.02 -1.26 -2.01 115.26 124.30 3k2m n ASN 165 Ca -0.06 1.06 0.00 0.00 -0.03 0.00 0.00 54.58 55.55 3k2m n ASN 165 Cb 0.27 -1.47 0.00 0.00 -0.61 0.00 0.00 39.78 37.97 3k2m n ASN 165 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3k2m n GLY 166 N 3.73 1.13 3.73 7.41 0.00 -0.53 -4.81 105.19 115.85 3k2m n GLY 166 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.78 3k2m n GLY 166 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3k2m s SER 167 N -3.03 6.68 0.25 1.61 0.01 -0.85 -0.54 113.70 117.84 3k2m s SER 167 Ca 0.00 2.55 -0.12 0.00 1.31 0.00 0.00 55.95 59.70 3k2m s SER 167 Cb 0.00 -2.60 -0.01 0.00 0.21 0.00 0.00 66.02 63.62 3k2m s SER 167 CO 0.00 -0.72 0.46 0.72 0.41 0.00 0.00 173.24 174.11 3k2m s PHE 168 N 0.67 0.45 0.06 2.43 -0.71 -0.68 -1.09 117.98 119.10 3k2m s PHE 168 Ca 0.64 -0.80 -0.15 0.00 -1.04 0.00 0.00 56.93 55.59 3k2m s PHE 168 Cb -0.41 0.14 0.02 0.00 -1.21 0.00 0.00 43.02 41.56 3k2m s PHE 168 CO 0.36 -0.99 0.34 -0.48 -1.34 0.00 0.00 175.22 173.10 3k2m s LEU 169 N -3.04 0.72 -0.06 -1.99 0.05 -0.74 0.06 118.68 113.67 3k2m s LEU 169 Ca 0.24 -0.20 -0.01 0.00 0.05 0.00 0.00 54.13 54.21 3k2m s LEU 169 Cb -0.00 1.51 -0.03 0.00 -2.05 0.00 0.00 46.19 45.61 3k2m s LEU 169 CO 0.10 -0.68 0.01 -0.69 -0.55 0.00 0.00 176.35 174.54 3k2m s VAL 170 N -2.83 4.33 0.17 1.48 1.01 0.99 -1.11 120.40 124.45 3k2m s VAL 170 Ca -0.03 -0.34 -0.08 0.00 0.00 0.00 0.00 61.98 61.53 3k2m s VAL 170 Cb 0.00 -2.87 -0.02 0.00 0.00 0.00 0.00 36.38 33.50 3k2m s VAL 170 CO -0.05 0.52 0.26 0.00 0.00 0.00 0.00 175.10 175.84 3k2m s ARG 171 N -1.14 1.18 0.10 2.72 1.70 -0.28 -0.47 118.95 122.76 3k2m s ARG 171 Ca 0.16 -1.27 -0.30 0.00 -0.47 0.00 0.00 55.73 53.85 3k2m s ARG 171 Cb -0.11 0.36 -0.05 0.00 -0.57 0.00 0.00 34.95 34.57 3k2m s ARG 171 CO 0.05 -0.43 0.97 -1.21 -1.08 0.00 0.00 175.30 173.61 3k2m s GLU 172 N -4.01 4.68 0.19 3.89 2.02 -0.49 -0.64 118.70 124.35 3k2m s GLU 172 Ca 0.21 1.46 -0.30 0.00 0.02 0.00 0.00 54.97 56.36 3k2m s GLU 172 Cb 0.04 -3.38 -0.08 0.00 0.10 0.00 0.00 34.13 30.81 3k2m s GLU 172 CO 0.03 0.17 1.01 0.45 0.02 0.00 0.00 175.26 176.93 3k2m s SER 173 N 0.13 7.46 -0.05 -0.19 0.15 0.22 -4.44 113.70 116.99 3k2m s SER 173 Ca 0.48 1.98 -0.11 0.00 0.70 0.00 0.00 55.95 59.00 3k2m s SER 173 Cb -0.23 -2.60 -0.31 0.00 -1.71 0.00 0.00 66.02 61.16 3k2m s SER 173 CO 0.30 -0.04 0.67 -0.33 1.20 0.00 0.00 173.24 175.05 3k2m h GLU 174 N 4.73 0.40 0.00 5.44 5.08 -1.90 -3.34 114.58 124.99 3k2m h GLU 174 Ca -0.44 -0.68 -0.03 0.00 -1.00 0.00 0.00 59.36 57.21 3k2m h GLU 174 Cb 1.21 0.25 -0.00 0.00 0.50 0.00 0.00 28.75 30.71 3k2m h GLU 174 CO 0.70 1.33 -0.12 0.66 -1.00 0.00 0.00 179.01 180.57 3k2m h SER 175 N 0.11 0.00 -2.34 1.42 4.64 -1.98 -3.30 113.55 112.10 3k2m h SER 175 Ca -0.34 0.00 -0.59 0.00 -0.47 0.00 0.00 61.79 60.39 3k2m h SER 175 Cb 2.10 0.00 -0.40 0.00 -0.31 0.00 0.00 62.40 63.79 3k2m h SER 175 CO 0.18 0.12 -0.83 -1.20 -0.87 0.00 0.00 176.83 174.23 3k2m n SER 176 N -3.33 1.59 -4.65 4.97 7.64 -1.26 -5.10 113.62 113.46 3k2m n SER 176 Ca -0.00 -2.93 -0.62 0.00 1.01 0.00 0.00 58.87 56.33 3k2m n SER 176 Cb 0.33 -0.65 -0.08 0.00 -1.01 0.00 0.00 64.21 62.79 3k2m n SER 176 CO 0.00 0.00 0.00 -2.65 -3.01 0.00 0.00 175.04 169.38 3k2m n PRO 177 N 1.67 0.33 0.00 1.43 -0.02 -1.25 -0.24 135.00 136.92 3k2m n PRO 177 Ca 0.25 0.12 0.00 0.00 -2.02 0.00 0.00 63.50 61.85 3k2m n PRO 177 Cb 0.45 -1.67 0.00 0.00 -0.02 0.00 0.00 33.50 32.26 3k2m n PRO 177 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3k2m n GLY 178 N 3.14 2.78 3.83 -1.23 0.00 -1.26 -5.06 105.19 107.39 3k2m n GLY 178 Ca 0.26 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.94 3k2m n GLY 178 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3k2m s GLN 179 N -0.93 4.11 0.24 1.61 -1.52 0.66 -4.96 119.66 118.86 3k2m s GLN 179 Ca 0.00 0.75 0.07 0.00 -1.95 0.00 0.00 55.36 54.23 3k2m s GLN 179 Cb 0.00 -2.63 -0.04 0.00 -0.22 0.00 0.00 33.01 30.12 3k2m s GLN 179 CO 0.00 0.26 0.20 1.03 -0.25 0.00 0.00 175.29 176.54 3k2m s ARG 180 N -2.53 2.97 0.03 2.91 0.52 -1.26 -0.61 118.95 120.97 3k2m s ARG 180 Ca 0.49 -1.00 -0.01 0.00 -0.52 0.00 0.00 55.73 54.69 3k2m s ARG 180 Cb -0.13 -2.61 -0.02 0.00 0.52 0.00 0.00 34.95 32.71 3k2m s ARG 180 CO 0.19 0.42 -0.00 -1.12 0.02 0.00 0.00 175.30 174.80 3k2m s SER 181 N -3.74 0.26 -0.16 0.23 0.01 0.19 -1.18 113.70 109.30 3k2m s SER 181 Ca 0.33 -0.56 -0.05 0.00 1.31 0.00 0.00 55.95 56.98 3k2m s SER 181 Cb -0.08 0.14 -0.03 0.00 0.21 0.00 0.00 66.02 66.25 3k2m s SER 181 CO 0.25 -0.38 0.00 -0.63 0.41 0.00 0.00 173.24 172.89 3k2m s ILE 182 N -1.98 4.25 -0.18 1.44 1.01 0.17 -1.13 121.20 124.78 3k2m s ILE 182 Ca -0.11 -0.23 -0.02 0.00 0.00 0.00 0.00 60.65 60.29 3k2m s ILE 182 Cb -0.06 -2.87 -0.01 0.00 0.01 0.00 0.00 42.46 39.53 3k2m s ILE 182 CO -0.03 0.49 -0.09 -0.44 0.00 0.00 0.00 174.94 174.88 3k2m s SER 183 N 0.24 4.12 -0.03 3.58 0.01 -0.26 -0.15 113.70 121.20 3k2m s SER 183 Ca -0.00 -0.37 0.01 0.00 1.31 0.00 0.00 55.95 56.90 3k2m s SER 183 Cb -0.13 -1.67 0.02 0.00 0.21 0.00 0.00 66.02 64.45 3k2m s SER 183 CO 0.02 0.07 -0.03 -0.22 0.41 0.00 0.00 173.24 173.49 3k2m s LEU 184 N 0.93 1.38 -0.08 2.44 2.96 0.75 -1.80 118.68 125.28 3k2m s LEU 184 Ca -0.02 -0.08 -0.11 0.00 -0.22 0.00 0.00 54.13 53.71 3k2m s LEU 184 Cb -0.15 -0.32 -0.05 0.00 0.50 0.00 0.00 46.19 46.18 3k2m s LEU 184 CO -0.00 -0.05 0.26 -0.60 -1.32 0.00 0.00 176.35 174.63 3k2m s ARG 185 N 0.77 3.69 -0.22 1.98 3.52 -0.25 0.18 118.95 128.63 3k2m s ARG 185 Ca -0.09 0.10 -0.11 0.00 -0.13 0.00 0.00 55.73 55.50 3k2m s ARG 185 Cb -0.12 -3.22 0.08 0.00 -1.56 0.00 0.00 34.95 30.12 3k2m s ARG 185 CO -0.01 0.70 0.52 -0.47 -0.81 0.00 0.00 175.30 175.24 3k2m s TYR 186 N -0.94 -0.84 -1.30 5.12 5.04 -0.72 -1.46 117.35 122.26 3k2m s TYR 186 Ca 0.18 1.68 -0.12 0.00 -2.44 0.00 0.00 57.07 56.38 3k2m s TYR 186 Cb -0.14 0.44 0.00 0.00 0.35 0.00 0.00 41.96 42.61 3k2m s TYR 186 CO 0.08 -0.45 0.56 0.39 -1.34 0.00 0.00 175.55 174.79 3k2m n GLU 187 N 4.52 -2.08 -1.52 4.97 -0.58 -1.26 -2.23 120.64 122.45 3k2m n GLU 187 Ca -0.20 0.37 -0.15 0.00 -0.42 0.00 0.00 57.16 56.76 3k2m n GLU 187 Cb 0.55 -4.10 -0.06 0.00 -0.57 0.00 0.00 31.44 27.27 3k2m n GLU 187 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3k2m n GLY 188 N -1.92 1.38 3.04 0.62 0.00 -1.26 -5.00 105.19 102.04 3k2m n GLY 188 Ca -0.21 -0.30 -0.14 0.00 0.00 0.00 0.00 46.02 45.37 3k2m n GLY 188 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3k2m s ARG 189 N -3.43 0.50 -0.18 1.61 3.52 -0.95 -5.15 118.95 114.87 3k2m s ARG 189 Ca 0.00 -0.62 -0.08 0.00 -0.13 0.00 0.00 55.73 54.90 3k2m s ARG 189 Cb 0.00 -0.31 -0.04 0.00 -1.56 0.00 0.00 34.95 33.03 3k2m s ARG 189 CO 0.00 0.06 0.08 0.08 -0.81 0.00 0.00 175.30 174.72 3k2m s VAL 190 N -1.08 4.98 -0.11 7.11 1.01 -1.26 -1.76 120.40 129.29 3k2m s VAL 190 Ca -0.07 0.03 -0.01 0.00 0.00 0.00 0.00 61.98 61.93 3k2m s VAL 190 Cb -0.08 -3.25 -0.03 0.00 0.00 0.00 0.00 36.38 33.02 3k2m s VAL 190 CO 0.00 0.47 -0.07 -0.31 0.00 0.00 0.00 175.10 175.19 3k2m s TYR 191 N 0.27 2.94 -0.13 5.22 1.51 0.13 -4.91 117.35 122.38 3k2m s TYR 191 Ca 0.05 -0.21 0.02 0.00 -1.01 0.00 0.00 57.07 55.92 3k2m s TYR 191 Cb -0.12 -1.81 -0.00 0.00 -0.11 0.00 0.00 41.96 39.92 3k2m s TYR 191 CO -0.00 0.11 -0.19 -1.01 -1.11 0.00 0.00 175.55 173.35 3k2m s HIS 192 N -0.21 2.69 -0.10 2.71 3.76 -1.26 -0.18 115.29 122.71 3k2m s HIS 192 Ca 0.03 -1.03 0.04 0.00 -0.15 0.00 0.00 55.06 53.95 3k2m s HIS 192 Cb -0.13 -1.81 -0.00 0.00 1.11 0.00 0.00 32.58 31.75 3k2m s HIS 192 CO 0.03 -0.43 -0.23 0.71 -0.85 0.00 0.00 174.74 173.96 3k2m s TYR 193 N 0.57 2.57 0.23 1.40 2.02 0.78 -4.97 117.35 119.95 3k2m s TYR 193 Ca -0.11 -0.94 -0.30 0.00 -0.37 0.00 0.00 57.07 55.35 3k2m s TYR 193 Cb -0.16 -1.71 -0.09 0.00 -0.40 0.00 0.00 41.96 39.60 3k2m s TYR 193 CO 0.04 -0.36 1.30 1.03 -1.57 0.00 0.00 175.55 175.99 3k2m s ARG 194 N 0.25 4.40 -0.51 -0.62 0.52 -1.26 -0.66 118.95 121.06 3k2m s ARG 194 Ca -0.15 2.07 -0.23 0.00 -0.52 0.00 0.00 55.73 56.90 3k2m s ARG 194 Cb -0.17 -3.17 0.04 0.00 0.52 0.00 0.00 34.95 32.17 3k2m s ARG 194 CO 0.08 -0.21 0.82 0.42 0.02 0.00 0.00 175.30 176.43 3k2m s ILE 195 N -0.19 4.57 0.36 1.52 1.01 -0.33 -4.53 121.20 123.61 3k2m s ILE 195 Ca 0.55 0.16 -0.16 0.00 0.00 0.00 0.00 60.65 61.19 3k2m s ILE 195 Cb -0.37 -4.42 -0.09 0.00 0.01 0.00 0.00 42.46 37.59 3k2m s ILE 195 CO 0.41 -0.93 0.79 0.20 0.00 0.00 0.00 174.94 175.42 3k2m s ASN 196 N 2.59 6.79 -0.26 3.58 0.01 0.49 -4.51 114.94 123.63 3k2m s ASN 196 Ca 0.27 1.37 -0.06 0.00 -0.71 0.00 0.00 52.86 53.74 3k2m s ASN 196 Cb -0.14 -2.41 -0.00 0.00 0.41 0.00 0.00 41.25 39.11 3k2m s ASN 196 CO 0.19 -0.26 0.03 -0.89 -1.51 0.00 0.00 177.10 174.66 3k2m s THR 197 N -2.07 3.82 1.12 1.60 2.01 -1.26 -1.38 115.64 119.47 3k2m s THR 197 Ca 0.56 -0.53 -0.13 0.00 0.31 0.00 0.00 61.69 61.90 3k2m s THR 197 Cb -0.10 -2.86 0.25 0.00 0.01 0.00 0.00 72.50 69.80 3k2m s THR 197 CO 0.18 0.24 1.05 0.00 -0.69 0.00 0.00 174.62 175.40 3k2m s ALA 198 N 1.51 0.08 0.26 7.40 0.00 0.85 -4.88 121.76 126.98 3k2m s ALA 198 Ca 0.04 -0.32 -0.04 0.00 0.00 0.00 0.00 51.96 51.64 3k2m s ALA 198 Cb -0.16 -3.16 0.37 0.00 0.00 0.00 0.00 23.12 20.17 3k2m s ALA 198 CO 0.01 -3.49 1.88 0.66 0.00 0.00 0.00 175.76 174.82 3k2m h SER 199 N -2.38 1.02 -0.03 0.00 4.64 -2.00 -1.66 113.55 113.16 3k2m h SER 199 Ca -0.58 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.74 3k2m h SER 199 Cb 1.34 -0.22 0.00 0.00 -0.31 0.00 0.00 62.40 63.21 3k2m h SER 199 CO 0.53 0.67 0.00 -0.90 -0.87 0.00 0.00 176.83 176.26 3k2m n ASP 200 N -4.50 0.67 0.00 4.97 5.68 -1.26 -4.91 116.55 117.20 3k2m n ASP 200 Ca 0.14 -1.32 0.00 0.00 -0.50 0.00 0.00 54.79 53.12 3k2m n ASP 200 Cb 0.15 -0.01 0.00 0.00 -1.14 0.00 0.00 41.12 40.12 3k2m n ASP 200 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3k2m n GLY 201 N 1.03 0.14 3.75 6.12 0.00 -0.62 -5.08 105.19 110.52 3k2m n GLY 201 Ca 0.20 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.90 3k2m n GLY 201 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3k2m s LYS 202 N -0.97 2.15 0.06 1.61 1.02 -1.26 -4.65 119.74 117.69 3k2m s LYS 202 Ca 0.00 1.35 0.06 0.00 0.02 0.00 0.00 55.97 57.40 3k2m s LYS 202 Cb 0.00 -1.87 -0.04 0.00 -0.52 0.00 0.00 37.83 35.40 3k2m s LYS 202 CO 0.00 -1.75 -0.10 -0.51 -0.92 0.00 0.00 175.35 172.07 3k2m s LEU 203 N -5.72 3.04 0.02 3.17 1.43 0.84 -0.11 118.68 121.35 3k2m s LEU 203 Ca 0.65 -0.31 -0.28 0.00 -1.03 0.00 0.00 54.13 53.16 3k2m s LEU 203 Cb -0.20 -1.81 0.09 0.00 0.03 0.00 0.00 46.19 44.30 3k2m s LEU 203 CO 0.52 0.22 0.75 -0.72 0.23 0.00 0.00 176.35 177.35 3k2m s TYR 204 N -1.12 -0.50 -0.25 0.29 1.13 -0.48 -0.87 117.35 115.55 3k2m s TYR 204 Ca 0.19 0.56 -0.15 0.00 -1.41 0.00 0.00 57.07 56.26 3k2m s TYR 204 Cb -0.11 0.50 -0.11 0.00 -1.10 0.00 0.00 41.96 41.14 3k2m s TYR 204 CO 0.11 -0.64 -0.33 0.28 -2.51 0.00 0.00 175.55 172.47 3k2m n VAL 205 N 0.17 1.52 -3.63 -3.49 0.31 -1.26 -0.38 118.33 111.57 3k2m n VAL 205 Ca -0.15 -0.24 -0.36 0.00 -0.01 0.00 0.00 64.34 63.58 3k2m n VAL 205 Cb 0.61 -2.01 -0.06 0.00 -0.91 0.00 0.00 33.84 31.48 3k2m n VAL 205 CO 0.00 0.00 0.00 -0.44 -1.32 0.00 0.00 176.83 175.07 3k2m s SER 206 N -7.08 6.64 0.36 4.52 0.01 -1.26 -4.92 113.70 111.97 3k2m s SER 206 Ca -0.36 0.76 0.16 0.00 1.31 0.00 0.00 55.95 57.83 3k2m s SER 206 Cb 0.12 -2.17 0.68 0.00 0.21 0.00 0.00 66.02 64.85 3k2m s SER 206 CO 0.48 0.27 1.75 0.77 0.41 0.00 0.00 173.24 176.92 3k2m h SER 207 N 4.26 0.00 0.50 2.44 4.64 -1.95 -2.60 113.55 120.84 3k2m h SER 207 Ca -0.51 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.81 3k2m h SER 207 Cb 1.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 3k2m h SER 207 CO 0.64 0.41 0.00 -0.62 -0.87 0.00 0.00 176.83 176.39 3k2m n GLU 208 N -3.71 0.45 -3.74 4.77 -0.58 -1.26 -4.50 120.64 112.07 3k2m n GLU 208 Ca -0.01 0.01 -0.29 0.00 -0.42 0.00 0.00 57.16 56.45 3k2m n GLU 208 Cb 0.49 -1.50 -0.13 0.00 -0.57 0.00 0.00 31.44 29.73 3k2m n GLU 208 CO 0.00 0.00 0.00 -1.12 -0.48 0.00 0.00 177.13 175.53 3k2m s SER 209 N -2.52 3.72 0.10 1.62 0.01 -0.98 -5.11 113.70 110.54 3k2m s SER 209 Ca 0.29 -2.77 0.07 0.00 1.31 0.00 0.00 55.95 54.85 3k2m s SER 209 Cb 0.20 -1.13 -0.04 0.00 0.21 0.00 0.00 66.02 65.26 3k2m s SER 209 CO 0.43 -0.25 -0.10 -0.13 0.41 0.00 0.00 173.24 173.61 3k2m s ARG 210 N 0.15 2.17 0.04 12.44 0.52 -1.26 -4.45 118.95 128.55 3k2m s ARG 210 Ca 0.19 -1.00 -0.00 0.00 -0.52 0.00 0.00 55.73 54.39 3k2m s ARG 210 Cb -0.22 -2.32 -0.03 0.00 0.52 0.00 0.00 34.95 32.90 3k2m s ARG 210 CO -0.02 0.51 -0.03 -0.06 0.02 0.00 0.00 175.30 175.73 3k2m s PHE 211 N -1.20 0.42 0.16 -0.53 0.08 -0.05 -4.91 117.98 111.95 3k2m s PHE 211 Ca 0.21 -0.81 0.04 0.00 0.12 0.00 0.00 56.93 56.50 3k2m s PHE 211 Cb -0.11 -0.31 -0.05 0.00 -0.57 0.00 0.00 43.02 41.98 3k2m s PHE 211 CO 0.13 -0.28 1.36 -0.91 -0.10 0.00 0.00 175.22 175.42 3k2m h ASN 212 N 3.85 0.15 -4.20 1.36 4.21 -1.94 0.24 115.58 119.26 3k2m h ASN 212 Ca -0.33 -0.13 -0.35 0.00 1.21 0.00 0.00 56.30 56.69 3k2m h ASN 212 Cb 1.17 -0.05 -0.17 0.00 -1.12 0.00 0.00 38.32 38.15 3k2m h ASN 212 CO 0.54 0.98 -0.74 0.42 -1.29 0.00 0.00 177.43 177.35 3k2m s THR 213 N -3.05 1.11 0.25 2.81 -4.23 -1.26 -4.79 115.64 106.48 3k2m s THR 213 Ca -0.01 -1.73 -0.05 0.00 -1.18 0.00 0.00 61.69 58.72 3k2m s THR 213 Cb 0.10 -1.49 0.21 0.00 1.34 0.00 0.00 72.50 72.67 3k2m s THR 213 CO 0.82 -0.54 1.87 0.25 -0.54 0.00 0.00 174.62 176.49 3k2m h LEU 214 N 3.43 1.06 -0.24 4.79 5.85 -1.97 -2.46 115.31 125.77 3k2m h LEU 214 Ca -0.38 -0.09 0.05 0.00 0.84 0.00 0.00 57.88 58.30 3k2m h LEU 214 Cb 1.19 -0.27 -0.06 0.00 0.37 0.00 0.00 40.66 41.90 3k2m h LEU 214 CO 0.54 0.85 -0.12 0.00 -0.34 0.00 0.00 178.44 179.36 3k2m h ALA 215 N 1.32 0.07 -0.77 1.25 0.00 -2.00 -1.05 119.26 118.09 3k2m h ALA 215 Ca 0.30 0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.30 3k2m h ALA 215 Cb 0.03 0.29 -0.04 0.00 0.00 0.00 0.00 17.79 18.07 3k2m h ALA 215 CO -0.05 -0.53 0.50 0.93 0.00 0.00 0.00 179.25 180.10 3k2m h GLU 216 N -0.09 1.02 -0.33 0.00 5.08 -1.94 -0.39 114.58 117.92 3k2m h GLU 216 Ca 0.13 -0.07 0.03 0.00 -1.00 0.00 0.00 59.36 58.45 3k2m h GLU 216 Cb 0.29 -0.23 -0.03 0.00 0.50 0.00 0.00 28.75 29.28 3k2m h GLU 216 CO -0.30 0.68 0.13 1.25 -1.00 0.00 0.00 179.01 179.78 3k2m h LEU 217 N 1.04 0.17 -0.29 1.33 5.85 -1.07 -1.49 115.31 120.85 3k2m h LEU 217 Ca 0.28 0.03 -0.02 0.00 0.84 0.00 0.00 57.88 59.01 3k2m h LEU 217 Cb -0.10 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 40.92 3k2m h LEU 217 CO -0.06 0.13 0.11 0.58 -0.34 0.00 0.00 178.44 178.87 3k2m h VAL 218 N 0.29 1.18 -0.45 1.05 2.07 -0.80 -2.63 116.25 116.96 3k2m h VAL 218 Ca 0.15 -0.55 0.08 0.00 0.82 0.00 0.00 66.70 67.19 3k2m h VAL 218 Cb 0.10 1.01 -0.07 0.00 -1.52 0.00 0.00 31.29 30.81 3k2m h VAL 218 CO -0.13 0.19 0.06 -0.74 0.02 0.00 0.00 177.57 176.96 3k2m h HIS 219 N 0.31 0.08 -0.18 1.57 -0.00 -0.89 -0.64 115.15 115.39 3k2m h HIS 219 Ca 0.09 0.03 0.03 0.00 -0.00 0.00 0.00 60.37 60.52 3k2m h HIS 219 Cb 0.19 0.03 -0.02 0.00 -0.00 0.00 0.00 27.41 27.60 3k2m h HIS 219 CO -0.01 -0.03 0.03 1.25 -0.00 0.00 0.00 177.93 179.17 3k2m h HIS 220 N 0.18 0.04 0.00 5.26 6.17 -1.17 -2.65 115.15 122.98 3k2m h HIS 220 Ca 0.22 0.01 0.00 0.00 0.71 0.00 0.00 60.37 61.31 3k2m h HIS 220 Cb 0.30 0.01 0.00 0.00 2.52 0.00 0.00 27.41 30.24 3k2m h HIS 220 CO -0.24 0.01 0.00 0.72 0.71 0.00 0.00 177.93 179.13 3k2m n HIS 221 N -5.10 0.00 0.17 5.26 8.25 -1.00 -1.39 115.22 121.41 3k2m n HIS 221 Ca -0.03 0.00 0.04 0.00 -0.26 0.00 0.00 57.72 57.47 3k2m n HIS 221 Cb 0.09 -0.46 0.29 0.00 1.12 0.00 0.00 29.99 31.03 3k2m n HIS 221 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 3k2m h SER 222 N 0.00 0.00 0.01 0.41 4.64 -0.76 -0.19 113.55 117.66 3k2m h SER 222 Ca 0.00 0.00 -0.26 0.00 -0.47 0.00 0.00 61.79 61.06 3k2m h SER 222 Cb 0.41 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.46 3k2m h SER 222 CO 0.00 0.43 -1.41 0.41 -0.87 0.00 0.00 176.83 175.40 3k2m n THR 223 N -3.60 1.55 -4.40 2.95 -1.04 -0.49 -4.45 114.28 104.81 3k2m n THR 223 Ca -0.00 -0.10 -0.21 0.00 -2.04 0.00 0.00 64.05 61.70 3k2m n THR 223 Cb 0.54 -2.01 -0.16 0.00 -1.82 0.00 0.00 70.33 66.88 3k2m n THR 223 CO 0.00 0.00 0.00 0.68 -0.64 0.00 0.00 175.07 175.11 3k2m s VAL 224 N -2.39 0.81 0.13 12.58 -7.23 -0.53 -5.01 120.40 118.77 3k2m s VAL 224 Ca -0.29 -0.35 -0.19 0.00 -1.81 0.00 0.00 61.98 59.34 3k2m s VAL 224 Cb 0.07 -0.74 -0.04 0.00 0.56 0.00 0.00 36.38 36.23 3k2m s VAL 224 CO 0.60 0.26 1.76 0.00 -0.31 0.00 0.00 175.10 177.41 3k2m h ALA 225 N 6.57 0.28 -6.48 1.32 0.00 -1.83 -3.35 119.26 115.77 3k2m h ALA 225 Ca -0.34 0.01 -0.50 0.00 0.00 0.00 0.00 54.91 54.09 3k2m h ALA 225 Cb 1.17 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.89 3k2m h ALA 225 CO 0.48 -0.30 -0.89 -3.47 0.00 0.00 0.00 179.25 175.08 3k2m n ASP 226 N -5.00 -0.41 0.00 0.00 2.03 -1.26 -1.76 116.55 110.15 3k2m n ASP 226 Ca -0.02 -1.00 0.00 0.00 0.52 0.00 0.00 54.79 54.29 3k2m n ASP 226 Cb 0.07 -3.08 0.00 0.00 -0.72 0.00 0.00 41.12 37.39 3k2m n ASP 226 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3k2m n GLY 227 N -1.97 3.08 3.73 0.27 0.00 -1.26 -4.61 105.19 104.43 3k2m n GLY 227 Ca -0.31 -1.07 -0.32 0.00 0.00 0.00 0.00 46.02 44.32 3k2m n GLY 227 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3k2m s LEU 228 N 0.00 3.09 0.41 0.99 1.43 -0.72 -4.93 118.68 118.94 3k2m s LEU 228 Ca 0.00 2.07 0.18 0.00 -1.03 0.00 0.00 54.13 55.35 3k2m s LEU 228 Cb 0.00 -4.55 0.88 0.00 0.03 0.00 0.00 46.19 42.54 3k2m s LEU 228 CO 0.00 -2.35 1.85 -0.29 0.23 0.00 0.00 176.35 175.79 3k2m h ILE 229 N -1.01 0.99 -3.61 -0.59 2.10 -1.99 -3.46 117.51 109.95 3k2m h ILE 229 Ca -0.45 -1.18 -0.13 0.00 1.08 0.00 0.00 64.86 64.18 3k2m h ILE 229 Cb 1.26 1.68 -0.05 0.00 -1.09 0.00 0.00 36.82 38.62 3k2m h ILE 229 CO 0.48 0.31 -0.00 0.28 -1.08 0.00 0.00 178.15 178.14 3k2m s THR 230 N -4.01 0.00 0.54 2.19 -1.32 -1.26 -5.07 115.64 106.72 3k2m s THR 230 Ca -0.02 -1.34 -0.16 0.00 -1.21 0.00 0.00 61.69 58.96 3k2m s THR 230 Cb 0.13 -2.59 -0.06 0.00 -1.51 0.00 0.00 72.50 68.46 3k2m s THR 230 CO 0.68 0.00 1.01 0.42 -2.21 0.00 0.00 174.62 174.52 3k2m s THR 231 N -3.06 4.24 -0.86 5.08 -4.23 -1.26 -4.67 115.64 110.88 3k2m s THR 231 Ca 0.23 1.08 -0.24 0.00 -1.18 0.00 0.00 61.69 61.57 3k2m s THR 231 Cb -0.02 -3.59 0.05 0.00 1.34 0.00 0.00 72.50 70.28 3k2m s THR 231 CO 0.14 -0.61 1.31 -0.76 -0.54 0.00 0.00 174.62 174.16 3k2m s LEU 232 N -4.23 3.58 -0.27 4.79 1.43 -0.08 -4.37 118.68 119.53 3k2m s LEU 232 Ca 0.61 -1.05 -0.11 0.00 -1.03 0.00 0.00 54.13 52.55 3k2m s LEU 232 Cb -0.12 -2.54 -0.14 0.00 0.03 0.00 0.00 46.19 43.42 3k2m s LEU 232 CO 0.33 -1.60 -0.27 1.57 0.23 0.00 0.00 176.35 176.62 3k2m n HIS 233 N 8.78 0.12 -3.80 0.29 -0.00 0.10 -4.22 115.22 116.49 3k2m n HIS 233 Ca 0.16 0.04 -0.30 0.00 0.46 0.00 0.00 57.72 58.09 3k2m n HIS 233 Cb 0.49 -1.01 -0.14 0.00 -0.12 0.00 0.00 29.99 29.21 3k2m n HIS 233 CO 0.00 0.00 0.00 0.71 0.46 0.00 0.00 176.34 177.51 3k2m s TYR 234 N -2.50 2.36 0.23 1.57 1.51 0.30 -4.98 117.35 115.84 3k2m s TYR 234 Ca -0.37 -2.49 -0.31 0.00 -1.01 0.00 0.00 57.07 52.90 3k2m s TYR 234 Cb 0.13 -2.15 -0.15 0.00 -0.11 0.00 0.00 41.96 39.68 3k2m s TYR 234 CO 0.53 -0.82 1.15 -2.30 -1.11 0.00 0.00 175.55 173.00 3k2m n PRO 235 N 3.84 1.39 -2.51 -1.71 -0.02 -1.26 -1.68 135.00 133.04 3k2m n PRO 235 Ca 0.05 0.49 -0.37 0.00 -2.02 0.00 0.00 63.50 61.66 3k2m n PRO 235 Cb 0.37 -1.97 -0.04 0.00 -0.02 0.00 0.00 33.50 31.84 3k2m n PRO 235 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3k2m s ALA 236 N -0.49 3.09 0.47 3.55 0.00 0.11 -4.80 121.76 123.70 3k2m s ALA 236 Ca 0.67 0.73 -0.22 0.00 0.00 0.00 0.00 51.96 53.14 3k2m s ALA 236 Cb -0.76 -3.28 -0.07 0.00 0.00 0.00 0.00 23.12 19.00 3k2m s ALA 236 CO 0.55 -0.25 1.12 -1.25 0.00 0.00 0.00 175.76 175.92 3k2m s PRO 237 N -2.47 3.73 0.00 0.00 0.04 -1.26 -4.86 135.00 130.18 3k2m s PRO 237 Ca 0.58 1.63 0.00 0.00 0.04 0.00 0.00 61.00 63.25 3k2m s PRO 237 Cb -0.23 -2.28 0.00 0.00 0.04 0.00 0.00 34.50 32.03 3k2m s PRO 237 CO 0.29 -0.54 0.00 0.36 0.04 0.00 0.00 177.00 177.14