#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hbx n LYS 139 N 0.00 0.24 -4.17 1.97 5.02 -1.26 -5.00 118.16 114.96 1hbx n LYS 139 Ca 0.00 0.22 -0.34 0.00 -2.02 0.00 0.00 58.31 56.17 1hbx n LYS 139 Cb 0.00 -1.06 -0.08 0.00 -0.02 0.00 0.00 35.03 33.87 1hbx n LYS 139 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 1hbx s THR 140 N -1.80 4.69 0.29 -0.18 -4.23 -1.26 -5.00 115.64 108.15 1hbx s THR 140 Ca -0.11 -0.24 0.31 0.00 -1.18 0.00 0.00 61.69 60.47 1hbx s THR 140 Cb 0.02 -3.06 0.31 0.00 1.34 0.00 0.00 72.50 71.11 1hbx s THR 140 CO 0.17 0.50 1.94 0.03 -0.54 0.00 0.00 174.62 176.71 1hbx h ARG 141 N 4.68 0.00 -2.04 3.99 3.08 -2.07 -3.48 114.38 118.54 1hbx h ARG 141 Ca -0.51 0.00 0.17 0.00 0.07 0.00 0.00 59.98 59.71 1hbx h ARG 141 Cb 1.19 0.00 -0.09 0.00 0.08 0.00 0.00 29.97 31.15 1hbx h ARG 141 CO 0.58 0.00 -0.71 0.41 -1.07 0.00 0.00 179.97 179.18 1hbx n GLY 142 N -1.20 -3.15 0.71 0.04 0.00 -1.26 -4.75 105.19 95.57 1hbx n GLY 142 Ca -0.02 -1.19 -0.13 0.00 0.00 0.00 0.00 46.02 44.68 1hbx n GLY 142 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1hbx n ARG 143 N -3.14 0.00 -3.87 1.61 0.63 -1.26 -4.89 116.66 105.75 1hbx n ARG 143 Ca -0.05 0.00 -0.35 0.00 -0.92 0.00 0.00 57.85 56.53 1hbx n ARG 143 Cb 0.38 -0.31 -0.05 0.00 0.45 0.00 0.00 32.46 32.93 1hbx n ARG 143 CO 0.00 0.00 0.00 0.08 -2.51 0.00 0.00 177.63 175.20 1hbx s VAL 144 N 0.95 5.44 0.39 5.15 1.01 -1.26 -5.07 120.40 127.00 1hbx s VAL 144 Ca 0.23 0.06 -0.25 0.00 0.00 0.00 0.00 61.98 62.02 1hbx s VAL 144 Cb -0.31 -3.49 -0.09 0.00 0.00 0.00 0.00 36.38 32.50 1hbx s VAL 144 CO 0.15 0.46 1.14 -0.75 0.00 0.00 0.00 175.10 176.09 1hbx s LYS 145 N -1.53 4.12 0.00 2.72 2.20 -1.26 -5.04 119.74 120.96 1hbx s LYS 145 Ca 0.22 1.76 0.01 0.00 -0.36 0.00 0.00 55.97 57.60 1hbx s LYS 145 Cb -0.13 -2.69 -0.01 0.00 -1.51 0.00 0.00 37.83 33.50 1hbx s LYS 145 CO 0.12 -0.24 -0.03 0.96 -0.36 0.00 0.00 175.35 175.81 1hbx s ILE 146 N -1.45 0.22 -0.07 5.43 -4.36 -1.26 -5.11 121.20 114.60 1hbx s ILE 146 Ca 0.56 -0.25 -0.36 0.00 -0.26 0.00 0.00 60.65 60.34 1hbx s ILE 146 Cb -0.29 -0.22 -0.14 0.00 1.25 0.00 0.00 42.46 43.07 1hbx s ILE 146 CO 0.36 -0.02 1.72 0.29 0.24 0.00 0.00 174.94 177.53 1hbx n LYS 147 N 2.78 1.77 -1.45 0.37 4.76 -1.26 -4.81 118.16 120.33 1hbx n LYS 147 Ca -0.14 0.65 -0.43 0.00 -2.87 0.00 0.00 58.31 55.52 1hbx n LYS 147 Cb 0.58 -2.41 -0.03 0.00 -1.84 0.00 0.00 35.03 31.33 1hbx n LYS 147 CO 0.00 0.00 0.00 -0.12 -1.37 0.00 0.00 177.40 175.91 1hbx n MET 148 N 5.20 2.15 -3.96 1.97 0.00 -1.26 -4.76 117.12 116.47 1hbx n MET 148 Ca 0.22 -2.22 -0.10 0.00 -0.00 0.00 0.00 57.70 55.61 1hbx n MET 148 Cb 0.24 -3.11 -0.06 0.00 0.00 0.00 0.00 33.22 30.29 1hbx n MET 148 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 175.97 174.14 1hbx s GLU 149 N 4.17 1.26 0.05 2.12 -1.05 -1.26 -5.11 118.70 118.88 1hbx s GLU 149 Ca 0.53 -1.18 -0.38 0.00 -0.15 0.00 0.00 54.97 53.79 1hbx s GLU 149 Cb 0.14 0.41 -0.18 0.00 -0.44 0.00 0.00 34.13 34.05 1hbx s GLU 149 CO 0.02 -0.48 1.16 0.34 0.95 0.00 0.00 175.26 177.25 1hbx n PHE 150 N -0.26 0.97 -2.88 4.83 7.35 -1.26 -4.86 117.46 121.35 1hbx n PHE 150 Ca -0.06 0.87 -0.43 0.00 -0.76 0.00 0.00 57.45 57.08 1hbx n PHE 150 Cb 0.63 -2.19 -0.04 0.00 0.35 0.00 0.00 39.48 38.23 1hbx n PHE 150 CO 0.00 0.00 0.00 0.42 -0.76 0.00 0.00 176.76 176.42 1hbx s ILE 151 N 0.13 4.60 -1.24 -2.13 -1.09 -1.26 -4.95 121.20 115.25 1hbx s ILE 151 Ca 0.86 0.85 -0.06 0.00 -2.23 0.00 0.00 60.65 60.07 1hbx s ILE 151 Cb -1.11 -4.33 0.18 0.00 -1.58 0.00 0.00 42.46 35.62 1hbx s ILE 151 CO 0.53 -0.63 2.03 -0.67 -1.23 0.00 0.00 174.94 174.96 1hbx n ASP 152 N 6.80 6.72 -2.94 3.58 2.03 -1.26 -4.61 116.55 126.86 1hbx n ASP 152 Ca 0.05 -3.23 -0.02 0.00 0.52 0.00 0.00 54.79 52.11 1hbx n ASP 152 Cb 0.48 -1.37 0.00 0.00 -0.72 0.00 0.00 41.12 39.52 1hbx n ASP 152 CO 0.00 0.00 0.00 0.21 -1.92 0.00 0.00 177.20 175.49 1hbx s ASN 153 N 0.07 -1.44 0.07 1.67 3.84 -1.26 -5.04 114.94 112.85 1hbx s ASN 153 Ca 0.44 -1.28 0.01 0.00 0.21 0.00 0.00 52.86 52.25 1hbx s ASN 153 Cb 0.14 1.86 0.20 0.00 -0.55 0.00 0.00 41.25 42.90 1hbx s ASN 153 CO -0.04 -0.10 0.34 1.17 -2.79 0.00 0.00 177.10 175.69 1hbx n LYS 154 N 3.56 -0.02 0.30 0.43 4.81 -1.26 0.49 118.16 126.47 1hbx n LYS 154 Ca 0.15 0.32 -0.14 0.00 -0.87 0.00 0.00 58.31 57.77 1hbx n LYS 154 Cb 0.57 -0.52 -0.07 0.00 0.02 0.00 0.00 35.03 35.02 1hbx n LYS 154 CO 0.00 0.00 0.00 1.25 1.17 0.00 0.00 177.40 179.82 1hbx h LEU 155 N 0.00 -0.67 -0.64 3.14 5.85 -1.96 -1.68 115.31 119.34 1hbx h LEU 155 Ca 0.15 -0.02 0.03 0.00 0.84 0.00 0.00 57.88 58.88 1hbx h LEU 155 Cb 0.33 0.17 -0.04 0.00 0.37 0.00 0.00 40.66 41.49 1hbx h LEU 155 CO -0.20 -0.30 0.38 0.03 -0.34 0.00 0.00 178.44 178.02 1hbx h ARG 156 N -1.11 0.72 0.59 1.25 3.08 -0.37 -1.85 114.38 116.70 1hbx h ARG 156 Ca -0.08 -0.04 -0.03 0.00 0.07 0.00 0.00 59.98 59.90 1hbx h ARG 156 Cb 0.65 -0.16 0.00 0.00 0.08 0.00 0.00 29.97 30.55 1hbx h ARG 156 CO 0.13 0.48 -0.29 -0.09 -1.07 0.00 0.00 179.97 179.13 1hbx h ARG 157 N 0.74 -0.78 -0.79 0.04 2.43 -1.07 0.87 114.38 115.83 1hbx h ARG 157 Ca 0.26 0.05 0.05 0.00 -0.81 0.00 0.00 59.98 59.54 1hbx h ARG 157 Cb 0.06 0.18 -0.05 0.00 -0.42 0.00 0.00 29.97 29.74 1hbx h ARG 157 CO -0.12 -0.52 0.52 1.88 -1.51 0.00 0.00 179.97 180.22 1hbx h TYR 158 N -0.81 0.90 -0.49 2.20 0.05 -1.23 1.00 116.97 118.59 1hbx h TYR 158 Ca -0.08 0.02 -0.13 0.00 0.05 0.00 0.00 58.73 58.59 1hbx h TYR 158 Cb 0.62 -0.30 -0.01 0.00 1.01 0.00 0.00 36.73 38.05 1hbx h TYR 158 CO -0.04 0.50 -0.21 1.15 -1.05 0.00 0.00 178.16 178.51 1hbx h THR 159 N 0.91 1.27 0.26 -2.88 2.02 -1.10 -2.34 112.91 111.05 1hbx h THR 159 Ca 0.33 -1.37 -0.01 0.00 0.77 0.00 0.00 66.41 66.12 1hbx h THR 159 Cb 0.14 1.10 0.00 0.00 -1.74 0.00 0.00 68.15 67.66 1hbx h THR 159 CO -0.11 0.48 -0.12 0.74 0.37 0.00 0.00 175.52 176.88 1hbx h THR 160 N 0.87 0.79 -1.12 3.16 2.02 0.16 -2.10 112.91 116.69 1hbx h THR 160 Ca 0.11 -0.34 0.33 0.00 0.77 0.00 0.00 66.41 67.28 1hbx h THR 160 Cb 0.79 0.98 -0.05 0.00 -1.74 0.00 0.00 68.15 68.13 1hbx h THR 160 CO 0.07 0.07 0.81 0.15 0.37 0.00 0.00 175.52 176.99 1hbx h PHE 161 N -0.52 0.00 0.07 3.16 3.57 -0.78 0.31 116.94 122.76 1hbx h PHE 161 Ca -0.04 0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.46 1hbx h PHE 161 Cb 0.39 -0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.13 1hbx h PHE 161 CO -0.01 0.00 -0.04 1.03 -2.23 0.00 0.00 178.31 177.06 1hbx h SER 162 N 0.00 -0.08 -0.47 0.41 0.87 -0.89 -1.88 113.55 111.50 1hbx h SER 162 Ca 0.53 0.00 0.09 0.00 -1.23 0.00 0.00 61.79 61.18 1hbx h SER 162 Cb 2.14 0.02 -0.10 0.00 -0.44 0.00 0.00 62.40 64.02 1hbx h SER 162 CO -0.01 0.03 -0.35 0.11 -0.53 0.00 0.00 176.83 176.09 1hbx h LYS 163 N -0.28 -0.22 0.00 2.24 1.57 -0.69 0.38 116.57 119.57 1hbx h LYS 163 Ca -0.01 0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.78 1hbx h LYS 163 Cb 0.08 0.05 -0.00 0.00 0.08 0.00 0.00 32.23 32.43 1hbx h LYS 163 CO 0.02 -0.15 -0.05 0.00 -0.57 0.00 0.00 179.45 178.70 1hbx h ARG 164 N -0.23 0.00 -0.02 3.15 3.08 -0.56 -0.52 114.38 119.29 1hbx h ARG 164 Ca 0.19 0.00 -0.10 0.00 0.07 0.00 0.00 59.98 60.14 1hbx h ARG 164 Cb 0.55 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.59 1hbx h ARG 164 CO -0.60 0.05 -0.47 -0.22 -1.07 0.00 0.00 179.97 177.66 1hbx h LYS 165 N 0.00 0.04 -0.09 0.04 3.64 0.57 -2.37 116.57 118.40 1hbx h LYS 165 Ca -0.00 -0.02 -0.07 0.00 -1.27 0.00 0.00 60.65 59.29 1hbx h LYS 165 Cb 0.10 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.92 1hbx h LYS 165 CO 0.01 0.50 -0.20 1.15 -2.27 0.00 0.00 179.45 178.63 1hbx h THR 166 N 0.03 1.40 0.60 1.00 2.02 0.13 -2.66 112.91 115.43 1hbx h THR 166 Ca -0.00 -1.52 -0.03 0.00 0.77 0.00 0.00 66.41 65.63 1hbx h THR 166 Cb 0.84 2.17 0.00 0.00 -1.74 0.00 0.00 68.15 69.42 1hbx h THR 166 CO 0.06 0.43 -0.33 1.23 0.37 0.00 0.00 175.52 177.29 1hbx h GLY 167 N -0.17 -0.91 0.57 2.16 0.00 -1.38 -1.50 103.07 101.84 1hbx h GLY 167 Ca -0.00 0.36 0.10 0.00 0.00 0.00 0.00 47.33 47.79 1hbx h GLY 167 CO 0.04 -0.33 0.63 1.19 0.00 0.00 0.00 176.54 178.07 1hbx h ILE 168 N -0.86 0.97 0.16 2.60 2.10 -1.53 0.34 117.51 121.28 1hbx h ILE 168 Ca -0.08 -0.35 -0.01 0.00 1.08 0.00 0.00 64.86 65.50 1hbx h ILE 168 Cb 0.68 -0.15 0.00 0.00 -1.09 0.00 0.00 36.82 36.26 1hbx h ILE 168 CO 0.10 0.19 -0.08 0.24 -1.08 0.00 0.00 178.15 177.52 1hbx h MET 169 N 1.03 -0.21 -0.07 2.19 2.86 -1.30 0.01 114.93 119.44 1hbx h MET 169 Ca 0.47 0.01 0.03 0.00 -2.06 0.00 0.00 59.70 58.16 1hbx h MET 169 Cb 0.40 0.05 -0.06 0.00 0.06 0.00 0.00 31.60 32.05 1hbx h MET 169 CO -0.23 -0.10 -0.47 -0.22 1.06 0.00 0.00 176.91 176.95 1hbx h LYS 170 N -0.26 -0.56 -0.82 1.72 3.64 -0.14 -0.65 116.57 119.50 1hbx h LYS 170 Ca -0.02 0.04 0.16 0.00 -1.27 0.00 0.00 60.65 59.55 1hbx h LYS 170 Cb 0.20 0.13 -0.15 0.00 -0.41 0.00 0.00 32.23 32.00 1hbx h LYS 170 CO 0.04 -0.37 -0.25 0.87 -2.27 0.00 0.00 179.45 177.46 1hbx h LYS 171 N -0.58 -0.02 -0.16 1.90 1.79 -0.02 0.30 116.57 119.78 1hbx h LYS 171 Ca 0.05 0.00 0.04 0.00 -2.18 0.00 0.00 60.65 58.56 1hbx h LYS 171 Cb 0.67 0.01 -0.04 0.00 -1.58 0.00 0.00 32.23 31.29 1hbx h LYS 171 CO -0.38 -0.02 -0.09 0.00 -1.08 0.00 0.00 179.45 177.89 1hbx h ALA 172 N 1.65 0.04 -0.54 3.86 0.00 0.27 0.36 119.26 124.90 1hbx h ALA 172 Ca 0.37 0.06 0.06 0.00 0.00 0.00 0.00 54.91 55.40 1hbx h ALA 172 Cb 0.60 0.21 -0.05 0.00 0.00 0.00 0.00 17.79 18.55 1hbx h ALA 172 CO -0.85 -0.53 0.26 -0.92 0.00 0.00 0.00 179.25 177.21 1hbx h TYR 173 N -0.08 0.47 -0.38 0.00 3.20 0.86 -0.99 116.97 120.04 1hbx h TYR 173 Ca 0.09 0.02 -0.14 0.00 3.14 0.00 0.00 58.73 61.84 1hbx h TYR 173 Cb 0.22 -0.13 -0.01 0.00 1.54 0.00 0.00 36.73 38.35 1hbx h TYR 173 CO -0.23 0.21 -0.30 0.93 -1.64 0.00 0.00 178.16 177.13 1hbx h GLU 174 N 0.50 0.88 -0.17 1.82 5.08 -0.06 -0.27 114.58 122.36 1hbx h GLU 174 Ca 0.25 -0.44 0.04 0.00 -1.00 0.00 0.00 59.36 58.20 1hbx h GLU 174 Cb 0.19 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.40 1hbx h GLU 174 CO -0.19 1.08 -0.05 1.25 -1.00 0.00 0.00 179.01 180.10 1hbx h LEU 175 N 0.69 -0.19 -0.41 1.33 5.85 0.04 1.08 115.31 123.69 1hbx h LEU 175 Ca 0.07 0.06 -0.06 0.00 0.84 0.00 0.00 57.88 58.79 1hbx h LEU 175 Cb 0.89 0.12 -0.02 0.00 0.37 0.00 0.00 40.66 42.02 1hbx h LEU 175 CO 0.08 -0.07 0.03 0.77 -0.34 0.00 0.00 178.44 178.90 1hbx h SER 176 N -0.02 0.69 0.72 1.25 4.64 -1.12 -1.53 113.55 118.19 1hbx h SER 176 Ca 0.08 -0.29 -0.21 0.00 -0.47 0.00 0.00 61.79 60.90 1hbx h SER 176 Cb 0.15 -0.19 -0.01 0.00 -0.31 0.00 0.00 62.40 62.04 1hbx h SER 176 CO -0.18 0.81 -0.96 0.71 -0.87 0.00 0.00 176.83 176.34 1hbx h THR 177 N 0.55 1.56 0.00 2.95 1.35 -0.78 0.38 112.91 118.93 1hbx h THR 177 Ca 0.12 -2.91 -0.10 0.00 -0.55 0.00 0.00 66.41 62.97 1hbx h THR 177 Cb 0.44 2.64 -0.01 0.00 -1.73 0.00 0.00 68.15 69.49 1hbx h THR 177 CO 0.02 0.84 -0.48 -0.07 -0.25 0.00 0.00 175.52 175.58 1hbx h LEU 178 N 0.06 0.00 -2.62 3.87 3.38 0.12 -3.30 115.31 116.82 1hbx h LEU 178 Ca -0.05 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.92 1hbx h LEU 178 Cb 1.64 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.37 1hbx h LEU 178 CO 0.14 0.48 -0.26 0.35 0.09 0.00 0.00 178.44 179.23 1hbx n THR 179 N -3.72 1.12 -2.84 0.22 -2.24 -0.58 -5.00 114.28 101.24 1hbx n THR 179 Ca -0.01 -1.42 -0.09 0.00 -2.27 0.00 0.00 64.05 60.26 1hbx n THR 179 Cb 0.54 0.09 -0.02 0.00 -2.10 0.00 0.00 70.33 68.84 1hbx n THR 179 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1hbx n GLY 180 N -0.80 -0.46 3.86 3.38 0.00 0.13 -4.90 105.19 106.40 1hbx n GLY 180 Ca 0.10 0.01 -0.31 0.00 0.00 0.00 0.00 46.02 45.82 1hbx n GLY 180 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1hbx s THR 181 N -2.18 5.05 0.45 2.61 -4.23 -1.10 -5.02 115.64 111.22 1hbx s THR 181 Ca 0.17 -0.53 -0.24 0.00 -1.18 0.00 0.00 61.69 59.91 1hbx s THR 181 Cb -0.10 -3.45 -0.07 0.00 1.34 0.00 0.00 72.50 70.22 1hbx s THR 181 CO 0.21 0.14 1.22 -1.10 -0.54 0.00 0.00 174.62 174.55 1hbx s GLN 182 N -2.43 3.76 -0.22 3.99 -1.52 -1.26 -4.47 119.66 117.51 1hbx s GLN 182 Ca 0.32 1.93 -0.18 0.00 -1.95 0.00 0.00 55.36 55.48 1hbx s GLN 182 Cb -0.13 -2.50 0.06 0.00 -0.22 0.00 0.00 33.01 30.22 1hbx s GLN 182 CO 0.25 -0.59 0.57 0.08 -0.25 0.00 0.00 175.29 175.35 1hbx s VAL 183 N -1.43 -0.00 -0.05 1.09 1.01 -1.26 -4.99 120.40 114.76 1hbx s VAL 183 Ca 0.62 0.01 -0.02 0.00 0.00 0.00 0.00 61.98 62.60 1hbx s VAL 183 Cb -0.33 -0.80 0.03 0.00 0.00 0.00 0.00 36.38 35.29 1hbx s VAL 183 CO 0.40 0.00 0.03 -0.22 0.00 0.00 0.00 175.10 175.31 1hbx s LEU 184 N 0.53 0.43 0.04 3.92 2.96 -1.26 -1.58 118.68 123.71 1hbx s LEU 184 Ca -0.02 -0.01 0.09 0.00 -0.22 0.00 0.00 54.13 53.98 1hbx s LEU 184 Cb -0.04 -0.29 -0.03 0.00 0.50 0.00 0.00 46.19 46.33 1hbx s LEU 184 CO -0.02 -0.21 -0.26 -0.22 -1.32 0.00 0.00 176.35 174.31 1hbx s LEU 185 N 1.99 2.17 -0.04 -0.68 2.96 0.05 -5.00 118.68 120.14 1hbx s LEU 185 Ca 0.04 -0.58 -0.02 0.00 -0.22 0.00 0.00 54.13 53.35 1hbx s LEU 185 Cb -0.12 -1.29 0.03 0.00 0.50 0.00 0.00 46.19 45.30 1hbx s LEU 185 CO -0.04 0.26 0.08 -0.22 -1.32 0.00 0.00 176.35 175.11 1hbx s LEU 186 N -1.22 1.09 -0.08 -0.68 0.20 -1.26 -0.79 118.68 115.94 1hbx s LEU 186 Ca 0.12 0.16 -0.02 0.00 0.69 0.00 0.00 54.13 55.08 1hbx s LEU 186 Cb -0.10 0.15 0.03 0.00 -0.43 0.00 0.00 46.19 45.85 1hbx s LEU 186 CO 0.02 -0.11 0.01 -0.69 -0.29 0.00 0.00 176.35 175.29 1hbx s VAL 187 N 0.88 0.35 -0.25 1.68 1.01 0.28 -5.00 120.40 119.34 1hbx s VAL 187 Ca -0.07 0.08 -0.08 0.00 0.00 0.00 0.00 61.98 61.91 1hbx s VAL 187 Cb -0.10 -0.55 -0.03 0.00 0.00 0.00 0.00 36.38 35.70 1hbx s VAL 187 CO -0.03 0.20 0.09 0.00 0.00 0.00 0.00 175.10 175.36 1hbx s ALA 188 N 1.98 3.25 0.60 5.51 0.00 -1.26 0.26 121.76 132.10 1hbx s ALA 188 Ca 0.04 -1.10 -0.13 0.00 0.00 0.00 0.00 51.96 50.78 1hbx s ALA 188 Cb -0.13 -2.15 -0.04 0.00 0.00 0.00 0.00 23.12 20.80 1hbx s ALA 188 CO -0.05 -0.45 1.03 -1.54 0.00 0.00 0.00 175.76 174.74 1hbx s SER 189 N 1.56 6.13 0.45 0.00 1.04 0.93 -4.92 113.70 118.89 1hbx s SER 189 Ca 0.06 1.56 0.12 0.00 0.48 0.00 0.00 55.95 58.17 1hbx s SER 189 Cb -0.15 -2.50 1.03 0.00 0.10 0.00 0.00 66.02 64.50 1hbx s SER 189 CO 0.05 -0.93 2.07 -0.08 0.98 0.00 0.00 173.24 175.33 1hbx h GLU 190 N 0.10 0.34 0.00 4.02 4.81 -1.99 0.21 114.58 122.06 1hbx h GLU 190 Ca -0.45 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 58.76 1hbx h GLU 190 Cb 1.20 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 30.50 1hbx h GLU 190 CO 0.60 0.22 0.00 0.25 -0.73 0.00 0.00 179.01 179.36 1hbx n THR 191 N -4.49 0.56 0.00 0.32 -2.24 -1.26 -4.89 114.28 102.28 1hbx n THR 191 Ca 0.03 0.14 0.00 0.00 -2.27 0.00 0.00 64.05 61.95 1hbx n THR 191 Cb 0.15 -0.80 0.00 0.00 -2.10 0.00 0.00 70.33 67.59 1hbx n THR 191 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1hbx n GLY 192 N 0.55 0.49 3.67 3.38 0.00 0.72 -5.06 105.19 108.94 1hbx n GLY 192 Ca 0.06 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.65 1hbx n GLY 192 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1hbx s HIS 193 N -2.00 3.33 -0.33 1.61 3.76 -1.25 -4.78 115.29 115.63 1hbx s HIS 193 Ca 0.00 1.45 -0.14 0.00 -0.15 0.00 0.00 55.06 56.22 1hbx s HIS 193 Cb 0.00 -3.28 -0.02 0.00 1.11 0.00 0.00 32.58 30.40 1hbx s HIS 193 CO 0.00 -0.57 0.31 0.08 -0.85 0.00 0.00 174.74 173.71 1hbx s VAL 194 N 2.82 5.22 0.01 -0.90 1.01 -1.26 -0.05 120.40 127.24 1hbx s VAL 194 Ca 0.47 -0.01 -0.00 0.00 0.00 0.00 0.00 61.98 62.44 1hbx s VAL 194 Cb -0.17 -3.77 -0.04 0.00 0.00 0.00 0.00 36.38 32.40 1hbx s VAL 194 CO 0.11 -0.03 0.10 -0.31 0.00 0.00 0.00 175.10 174.97 1hbx s TYR 195 N 1.91 3.33 -0.20 5.22 2.02 0.14 -4.97 117.35 124.80 1hbx s TYR 195 Ca 0.10 0.22 -0.17 0.00 -0.37 0.00 0.00 57.07 56.85 1hbx s TYR 195 Cb -0.17 -1.74 0.05 0.00 -0.40 0.00 0.00 41.96 39.70 1hbx s TYR 195 CO 0.11 0.57 0.52 0.95 -1.57 0.00 0.00 175.55 176.13 1hbx s THR 196 N -1.25 -0.00 0.05 -0.71 -4.23 -1.26 -0.56 115.64 107.68 1hbx s THR 196 Ca 0.25 0.01 0.09 0.00 -1.18 0.00 0.00 61.69 60.86 1hbx s THR 196 Cb -0.12 -0.73 -0.03 0.00 1.34 0.00 0.00 72.50 72.96 1hbx s THR 196 CO 0.16 0.00 -0.26 0.12 -0.54 0.00 0.00 174.62 174.11 1hbx s PHE 197 N 0.49 2.24 -0.28 3.99 5.36 0.03 -5.00 117.98 124.81 1hbx s PHE 197 Ca -0.02 -0.41 -0.19 0.00 -0.96 0.00 0.00 56.93 55.36 1hbx s PHE 197 Cb -0.04 -1.33 0.11 0.00 -0.34 0.00 0.00 43.02 41.42 1hbx s PHE 197 CO -0.02 0.13 0.88 0.00 -1.46 0.00 0.00 175.22 174.75 1hbx s ALA 198 N -0.82 -2.05 0.66 11.12 0.00 -1.26 -0.77 121.76 128.65 1hbx s ALA 198 Ca 0.11 2.18 -0.13 0.00 0.00 0.00 0.00 51.96 54.12 1hbx s ALA 198 Cb -0.10 -1.52 -0.01 0.00 0.00 0.00 0.00 23.12 21.50 1hbx s ALA 198 CO 0.02 -0.33 1.07 0.95 0.00 0.00 0.00 175.76 177.47 1hbx s THR 199 N 1.09 3.77 0.12 0.00 -4.23 -0.62 -4.68 115.64 111.10 1hbx s THR 199 Ca -0.06 0.71 -0.21 0.00 -1.18 0.00 0.00 61.69 60.95 1hbx s THR 199 Cb -0.04 -3.30 -0.02 0.00 1.34 0.00 0.00 72.50 70.47 1hbx s THR 199 CO -0.13 -0.63 1.09 -1.14 -0.54 0.00 0.00 174.62 173.28 1hbx n ARG 200 N -2.66 -0.29 0.23 3.99 0.63 -1.26 -0.46 116.66 116.85 1hbx n ARG 200 Ca 0.08 1.07 0.06 0.00 -0.92 0.00 0.00 57.85 58.15 1hbx n ARG 200 Cb 0.53 -1.58 0.55 0.00 0.45 0.00 0.00 32.46 32.41 1hbx n ARG 200 CO 0.00 0.00 0.00 0.87 -2.51 0.00 0.00 177.63 175.99 1hbx h LYS 201 N 0.00 0.00 -0.60 -0.14 1.57 -1.98 -2.58 116.57 112.84 1hbx h LYS 201 Ca 0.13 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.91 1hbx h LYS 201 Cb 0.31 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.62 1hbx h LYS 201 CO -0.67 0.15 0.00 1.28 -0.57 0.00 0.00 179.45 179.63 1hbx n LEU 202 N -4.30 3.33 -0.12 2.94 4.77 0.40 -4.27 117.00 119.75 1hbx n LEU 202 Ca -0.03 -1.64 -0.08 0.00 -0.03 0.00 0.00 56.01 54.23 1hbx n LEU 202 Cb 0.22 -0.40 -0.00 0.00 -2.33 0.00 0.00 43.42 40.91 1hbx n LEU 202 CO 0.35 0.82 1.02 -0.61 -1.33 0.00 0.00 177.39 177.64 1hbx h GLN 203 N 3.72 0.52 0.00 3.23 5.75 -0.87 -1.74 115.11 125.71 1hbx h GLN 203 Ca 0.00 -0.04 0.00 0.00 -0.15 0.00 0.00 58.65 58.46 1hbx h GLN 203 Cb 0.85 -0.11 0.00 0.00 1.07 0.00 0.00 27.48 29.28 1hbx h GLN 203 CO 0.00 0.37 0.43 -1.35 -2.65 0.00 0.00 178.83 175.63 1hbx h PRO 204 N 0.51 0.00 -0.31 -2.39 0.11 -1.79 0.29 132.00 128.42 1hbx h PRO 204 Ca 0.14 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 66.18 1hbx h PRO 204 Cb -0.03 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.07 1hbx h PRO 204 CO -0.03 0.00 -0.09 0.52 -0.21 0.00 0.00 178.00 178.20 1hbx h MET 205 N 0.00 0.52 0.00 1.05 2.86 -1.62 -2.97 114.93 114.77 1hbx h MET 205 Ca 0.00 -0.14 0.00 0.00 -2.06 0.00 0.00 59.70 57.50 1hbx h MET 205 Cb 0.87 -0.06 0.00 0.00 0.06 0.00 0.00 31.60 32.46 1hbx h MET 205 CO 0.00 0.61 -0.28 0.44 1.06 0.00 0.00 176.91 178.74 1hbx n ILE 206 N -4.22 0.00 0.34 -1.22 -5.35 0.93 -4.14 119.36 105.70 1hbx n ILE 206 Ca 0.01 -0.38 0.09 0.00 -0.27 0.00 0.00 62.75 62.20 1hbx n ILE 206 Cb 0.30 0.91 -0.13 0.00 -1.74 0.00 0.00 39.64 38.98 1hbx n ILE 206 CO 0.00 0.00 0.00 0.35 -1.76 0.00 0.00 176.55 175.14 1hbx n THR 207 N -1.14 0.00 -2.00 7.28 -2.24 -0.72 -4.33 114.28 111.12 1hbx n THR 207 Ca 0.00 -0.29 -0.33 0.00 -2.27 0.00 0.00 64.05 61.16 1hbx n THR 207 Cb 0.04 0.44 0.02 0.00 -2.10 0.00 0.00 70.33 68.73 1hbx n THR 207 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1hbx s SER 208 N -3.58 5.52 0.29 3.42 1.04 -1.12 -4.87 113.70 114.40 1hbx s SER 208 Ca -0.01 1.98 0.02 0.00 0.48 0.00 0.00 55.95 58.42 1hbx s SER 208 Cb 0.13 -2.55 0.45 0.00 0.10 0.00 0.00 66.02 64.14 1hbx s SER 208 CO 0.77 -1.35 1.77 -0.08 0.98 0.00 0.00 173.24 175.32 1hbx h GLU 209 N 0.51 0.54 0.00 4.02 4.57 -1.92 -0.07 114.58 122.23 1hbx h GLU 209 Ca -0.48 -0.17 0.00 0.00 -1.18 0.00 0.00 59.36 57.53 1hbx h GLU 209 Cb 1.24 -0.05 0.00 0.00 -0.16 0.00 0.00 28.75 29.78 1hbx h GLU 209 CO 0.56 0.68 0.00 2.41 -1.18 0.00 0.00 179.01 181.48 1hbx n THR 210 N -4.18 0.00 -0.06 0.32 -1.04 -1.26 -1.62 114.28 106.44 1hbx n THR 210 Ca 0.00 1.30 0.06 0.00 -2.04 0.00 0.00 64.05 63.38 1hbx n THR 210 Cb 0.35 -2.17 0.43 0.00 -1.82 0.00 0.00 70.33 67.12 1hbx n THR 210 CO 0.00 0.00 0.00 1.23 -0.64 0.00 0.00 175.07 175.66 1hbx h GLY 211 N 0.00 0.66 0.37 3.41 0.00 -1.76 -0.56 103.07 105.20 1hbx h GLY 211 Ca 0.00 -0.22 0.12 0.00 0.00 0.00 0.00 47.33 47.23 1hbx h GLY 211 CO 0.00 0.19 0.44 1.70 0.00 0.00 0.00 176.54 178.87 1hbx h LYS 212 N 0.56 0.67 0.00 4.80 3.64 -0.91 0.12 116.57 125.45 1hbx h LYS 212 Ca 0.22 -0.04 -0.11 0.00 -1.27 0.00 0.00 60.65 59.45 1hbx h LYS 212 Cb 0.15 -0.15 -0.02 0.00 -0.41 0.00 0.00 32.23 31.81 1hbx h LYS 212 CO -0.06 0.44 -0.52 0.00 -2.27 0.00 0.00 179.45 177.05 1hbx h ALA 213 N 1.50 0.89 -0.56 5.00 0.00 -0.15 -2.79 119.26 123.15 1hbx h ALA 213 Ca 0.42 -0.47 -0.11 0.00 0.00 0.00 0.00 54.91 54.75 1hbx h ALA 213 Cb 0.50 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.19 1hbx h ALA 213 CO -0.30 0.65 -0.08 1.25 0.00 0.00 0.00 179.25 180.76 1hbx h LEU 214 N 0.00 1.04 -0.48 0.00 5.85 0.03 -0.39 115.31 121.35 1hbx h LEU 214 Ca -0.01 -0.34 -0.09 0.00 0.84 0.00 0.00 57.88 58.29 1hbx h LEU 214 Cb 1.09 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 41.82 1hbx h LEU 214 CO 0.07 1.14 -0.04 0.40 -0.34 0.00 0.00 178.44 179.67 1hbx h ILE 215 N 0.93 1.27 0.64 4.05 2.04 -1.12 -1.83 117.51 123.49 1hbx h ILE 215 Ca 0.15 -1.13 -0.02 0.00 1.00 0.00 0.00 64.86 64.85 1hbx h ILE 215 Cb 0.65 1.02 -0.01 0.00 -0.74 0.00 0.00 36.82 37.75 1hbx h ILE 215 CO 0.05 0.39 -0.46 -0.61 0.00 0.00 0.00 178.15 177.52 1hbx h GLN 216 N 0.74 -1.02 -0.81 2.37 4.15 -1.24 -1.22 115.11 118.07 1hbx h GLN 216 Ca 0.13 0.07 0.12 0.00 0.77 0.00 0.00 58.65 59.74 1hbx h GLN 216 Cb 0.56 0.23 -0.13 0.00 0.21 0.00 0.00 27.48 28.36 1hbx h GLN 216 CO 0.03 -0.68 -0.44 1.15 -1.93 0.00 0.00 178.83 176.96 1hbx h THR 217 N -1.06 0.05 0.12 2.39 2.02 -0.95 -2.12 112.91 113.35 1hbx h THR 217 Ca -0.08 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.09 1hbx h THR 217 Cb 0.88 0.05 -0.00 0.00 -1.74 0.00 0.00 68.15 67.34 1hbx h THR 217 CO 0.04 0.00 -0.07 0.00 0.37 0.00 0.00 175.52 175.86 1hbx n LEU 219 N -2.61 0.04 -0.27 0.00 4.77 -0.48 -0.53 117.00 117.91 1hbx n LEU 219 Ca -0.02 0.42 0.10 0.00 -0.03 0.00 0.00 56.01 56.47 1hbx n LEU 219 Cb 0.07 -0.42 -0.05 0.00 -2.33 0.00 0.00 43.42 40.70 1hbx n LEU 219 CO 0.05 -0.43 0.15 0.59 -1.33 0.00 0.00 177.39 176.42 1hbx n ASN 220 N -1.46 1.52 -4.77 -1.43 3.02 -0.81 -4.97 115.26 106.37 1hbx n ASN 220 Ca -0.00 -1.26 -0.40 0.00 -0.03 0.00 0.00 54.58 52.89 1hbx n ASN 220 Cb 0.12 0.69 0.01 0.00 -0.61 0.00 0.00 39.78 39.99 1hbx n ASN 220 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 1hbx s SER 221 N -2.56 6.07 0.55 6.41 1.04 0.31 -4.93 113.70 120.59 1hbx s SER 221 Ca 0.13 2.78 -0.21 0.00 0.48 0.00 0.00 55.95 59.13 1hbx s SER 221 Cb 0.16 -2.65 -0.06 0.00 0.10 0.00 0.00 66.02 63.58 1hbx s SER 221 CO 0.65 -1.03 1.12 -0.81 0.98 0.00 0.00 173.24 174.15 1hbx n PRO 222 N -0.06 1.28 0.00 4.02 -0.04 -1.26 -5.09 135.00 133.85 1hbx n PRO 222 Ca 0.05 0.48 0.02 0.00 -0.04 0.00 0.00 63.50 64.01 1hbx n PRO 222 Cb 0.43 -2.30 0.14 0.00 -0.04 0.00 0.00 33.50 31.73 1hbx n PRO 222 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21