#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bnx s ARG 134 N 0.00 4.56 0.61 1.43 1.81 -1.26 -5.03 118.95 121.06 2bnx s ARG 134 Ca 0.00 1.46 -0.12 0.00 -1.72 0.00 0.00 55.73 55.35 2bnx s ARG 134 Cb 0.00 -3.44 -0.04 0.00 -0.45 0.00 0.00 34.95 31.02 2bnx s ARG 134 CO 0.00 -0.05 1.03 -1.54 -0.68 0.00 0.00 175.30 174.06 2bnx s SER 135 N 0.92 6.21 0.26 0.23 1.04 -1.26 -4.96 113.70 116.14 2bnx s SER 135 Ca 0.52 1.47 -0.03 0.00 0.48 0.00 0.00 55.95 58.39 2bnx s SER 135 Cb -0.22 -2.48 0.37 0.00 0.10 0.00 0.00 66.02 63.78 2bnx s SER 135 CO 0.28 -0.88 1.90 0.00 0.98 0.00 0.00 173.24 175.52 2bnx h ALA 136 N -0.12 1.37 -0.61 5.32 0.00 -1.90 -2.73 119.26 120.58 2bnx h ALA 136 Ca -0.45 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.40 2bnx h ALA 136 Cb 1.19 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 18.62 2bnx h ALA 136 CO 0.61 0.51 0.27 0.52 0.00 0.00 0.00 179.25 181.16 2bnx h MET 137 N 1.23 0.89 -0.40 0.00 2.86 -1.93 -1.32 114.93 116.25 2bnx h MET 137 Ca 0.42 -0.14 0.07 0.00 -2.06 0.00 0.00 59.70 57.98 2bnx h MET 137 Cb 0.08 -0.15 -0.06 0.00 0.06 0.00 0.00 31.60 31.52 2bnx h MET 137 CO -0.15 0.73 0.02 1.98 1.06 0.00 0.00 176.91 180.56 2bnx h MET 138 N 0.84 0.13 -0.49 1.72 -1.53 -1.88 -0.07 114.93 113.65 2bnx h MET 138 Ca 0.21 -0.01 0.01 0.00 -3.44 0.00 0.00 59.70 56.47 2bnx h MET 138 Cb 0.15 -0.03 -0.03 0.00 -0.55 0.00 0.00 31.60 31.15 2bnx h MET 138 CO -0.02 0.09 0.31 1.88 0.14 0.00 0.00 176.91 179.30 2bnx h TYR 139 N 0.13 0.58 -0.38 1.39 0.05 -1.36 0.49 116.97 117.88 2bnx h TYR 139 Ca 0.20 0.02 0.00 0.00 0.05 0.00 0.00 58.73 59.00 2bnx h TYR 139 Cb 0.27 -0.19 -0.02 0.00 1.01 0.00 0.00 36.73 37.80 2bnx h TYR 139 CO -0.25 0.35 0.25 0.82 -1.05 0.00 0.00 178.16 178.28 2bnx h ILE 140 N 0.63 1.09 -0.24 -2.88 2.04 -0.80 0.89 117.51 118.24 2bnx h ILE 140 Ca 0.19 -0.17 0.03 0.00 1.00 0.00 0.00 64.86 65.91 2bnx h ILE 140 Cb -0.04 0.54 -0.03 0.00 -0.74 0.00 0.00 36.82 36.55 2bnx h ILE 140 CO -0.06 0.09 0.04 1.56 0.00 0.00 0.00 178.15 179.78 2bnx h GLN 141 N 0.51 0.13 -0.61 2.37 4.20 -0.80 -2.47 115.11 118.43 2bnx h GLN 141 Ca 0.14 -0.01 0.04 0.00 0.06 0.00 0.00 58.65 58.89 2bnx h GLN 141 Cb -0.05 -0.03 -0.05 0.00 0.30 0.00 0.00 27.48 27.65 2bnx h GLN 141 CO -0.03 0.09 0.35 0.93 -0.67 0.00 0.00 178.83 179.49 2bnx h GLU 142 N 0.13 0.65 0.00 1.46 4.39 -0.64 -1.82 114.58 118.75 2bnx h GLU 142 Ca 0.11 -0.04 -0.00 0.00 0.34 0.00 0.00 59.36 59.77 2bnx h GLU 142 Cb 0.11 -0.15 -0.00 0.00 -0.10 0.00 0.00 28.75 28.62 2bnx h GLU 142 CO -0.15 0.43 -0.01 -0.07 -1.16 0.00 0.00 179.01 178.05 2bnx h LEU 143 N 0.67 0.00 -1.74 1.33 3.38 -0.59 -2.50 115.31 115.86 2bnx h LEU 143 Ca 0.26 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.23 2bnx h LEU 143 Cb 0.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.86 2bnx h LEU 143 CO -0.15 0.01 -0.04 0.54 0.09 0.00 0.00 178.44 178.90 2bnx n ARG 144 N -3.18 1.86 0.00 1.13 1.74 -0.73 -4.86 116.66 112.62 2bnx n ARG 144 Ca -0.02 -1.67 0.00 0.00 -0.77 0.00 0.00 57.85 55.39 2bnx n ARG 144 Cb 0.14 -1.40 0.00 0.00 -1.02 0.00 0.00 32.46 30.18 2bnx n ARG 144 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 2bnx n SER 145 N 1.07 -0.05 -3.52 0.55 3.41 -0.92 -4.98 113.62 109.18 2bnx n SER 145 Ca 0.12 -0.42 -0.30 0.00 -0.26 0.00 0.00 58.87 58.01 2bnx n SER 145 Cb 0.51 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 64.40 2bnx n SER 145 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2bnx n GLY 146 N 4.73 4.95 3.77 5.00 0.00 -1.26 -5.05 105.19 117.33 2bnx n GLY 146 Ca 0.00 -2.76 -0.40 0.00 0.00 0.00 0.00 46.02 42.87 2bnx n GLY 146 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2bnx s LEU 147 N -2.61 4.33 0.12 0.99 1.43 -1.26 -5.03 118.68 116.65 2bnx s LEU 147 Ca 0.39 2.50 0.05 0.00 -1.03 0.00 0.00 54.13 56.03 2bnx s LEU 147 Cb 0.14 -3.82 -0.04 0.00 0.03 0.00 0.00 46.19 42.50 2bnx s LEU 147 CO 0.01 -0.58 -0.11 -0.13 0.23 0.00 0.00 176.35 175.77 2bnx s ARG 148 N -1.99 0.98 5.84 1.70 0.52 -1.26 -4.56 118.95 120.18 2bnx s ARG 148 Ca 0.52 -1.30 0.00 0.00 -0.52 0.00 0.00 55.73 54.44 2bnx s ARG 148 Cb -0.35 -0.67 0.00 0.00 0.52 0.00 0.00 34.95 34.44 2bnx s ARG 148 CO 0.45 0.11 0.00 -0.25 0.02 0.00 0.00 175.30 175.63 2bnx n ASP 149 N 0.25 0.00 0.27 0.23 8.00 -1.26 -1.39 116.55 122.66 2bnx n ASP 149 Ca -0.14 0.00 0.11 0.00 0.71 0.00 0.00 54.79 55.47 2bnx n ASP 149 Cb 0.59 0.00 0.74 0.00 -0.02 0.00 0.00 41.12 42.42 2bnx n ASP 149 CO 0.00 0.00 0.00 0.24 -0.39 0.00 0.00 177.20 177.05 2bnx h MET 150 N 0.00 0.00 -0.07 -1.24 2.86 -1.98 -1.78 114.93 112.72 2bnx h MET 150 Ca 0.00 0.00 -0.03 0.00 -2.06 0.00 0.00 59.70 57.61 2bnx h MET 150 Cb 0.00 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.66 2bnx h MET 150 CO 0.00 0.02 -0.06 0.45 1.06 0.00 0.00 176.91 178.38 2bnx h HIS 151 N 0.00 0.20 -0.26 -0.22 3.86 -1.63 -0.90 115.15 116.20 2bnx h HIS 151 Ca -0.00 -0.06 0.06 0.00 -1.16 0.00 0.00 60.37 59.21 2bnx h HIS 151 Cb 0.04 -0.04 -0.06 0.00 1.06 0.00 0.00 27.41 28.41 2bnx h HIS 151 CO 0.00 0.60 -0.14 1.25 0.86 0.00 0.00 177.93 180.50 2bnx h LEU 152 N -0.25 -0.47 -0.78 2.43 5.85 -1.29 -2.29 115.31 118.51 2bnx h LEU 152 Ca 0.01 0.11 0.09 0.00 0.84 0.00 0.00 57.88 58.93 2bnx h LEU 152 Cb 0.56 0.25 -0.07 0.00 0.37 0.00 0.00 40.66 41.78 2bnx h LEU 152 CO 0.02 -0.18 0.44 0.25 -0.34 0.00 0.00 178.44 178.62 2bnx h LEU 153 N -0.11 0.62 -0.57 2.25 5.85 -1.21 -0.35 115.31 121.78 2bnx h LEU 153 Ca 0.14 0.05 -0.10 0.00 0.84 0.00 0.00 57.88 58.81 2bnx h LEU 153 Cb 0.32 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.27 2bnx h LEU 153 CO -0.33 0.36 -0.47 0.77 -0.34 0.00 0.00 178.44 178.43 2bnx h SER 154 N 0.74 0.00 0.31 1.25 4.64 -0.91 0.31 113.55 119.88 2bnx h SER 154 Ca 0.38 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.68 2bnx h SER 154 Cb 0.35 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.44 2bnx h SER 154 CO -0.25 0.47 -0.15 0.00 -0.87 0.00 0.00 176.83 176.03 2bnx h LEU 156 N -0.45 0.70 -0.39 0.00 3.38 -0.69 -1.01 115.31 116.85 2bnx h LEU 156 Ca -0.04 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.87 2bnx h LEU 156 Cb 0.34 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 2bnx h LEU 156 CO 0.07 0.56 0.26 -0.08 0.09 0.00 0.00 178.44 179.33 2bnx h GLU 157 N 0.78 0.52 -0.43 1.13 4.81 -0.40 -1.36 114.58 119.63 2bnx h GLU 157 Ca 0.21 -0.03 -0.13 0.00 -0.13 0.00 0.00 59.36 59.28 2bnx h GLU 157 Cb -0.01 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 29.24 2bnx h GLU 157 CO -0.04 0.34 -0.24 0.66 -0.73 0.00 0.00 179.01 179.01 2bnx h SER 158 N 0.53 0.91 -0.61 1.04 4.64 -1.11 -2.95 113.55 116.00 2bnx h SER 158 Ca 0.14 -0.34 0.13 0.00 -0.47 0.00 0.00 61.79 61.25 2bnx h SER 158 Cb -0.06 -0.25 -0.10 0.00 -0.31 0.00 0.00 62.40 61.68 2bnx h SER 158 CO -0.03 1.10 0.00 0.25 -0.87 0.00 0.00 176.83 177.28 2bnx h LEU 159 N 0.76 -0.27 -0.33 5.97 5.85 -1.02 -0.04 115.31 126.23 2bnx h LEU 159 Ca 0.10 0.15 0.04 0.00 0.84 0.00 0.00 57.88 59.01 2bnx h LEU 159 Cb 0.79 0.27 -0.04 0.00 0.37 0.00 0.00 40.66 42.05 2bnx h LEU 159 CO 0.07 -0.11 0.10 -0.09 -0.34 0.00 0.00 178.44 178.06 2bnx h ARG 160 N 0.12 0.22 -0.83 1.25 2.43 -1.14 -0.13 114.38 116.30 2bnx h ARG 160 Ca 0.32 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.47 2bnx h ARG 160 Cb 0.52 -0.05 -0.04 0.00 -0.42 0.00 0.00 29.97 29.98 2bnx h ARG 160 CO -0.52 0.15 0.50 0.28 -1.51 0.00 0.00 179.97 178.86 2bnx h VAL 161 N 0.23 1.23 -0.30 0.20 2.07 -1.25 -0.49 116.25 117.95 2bnx h VAL 161 Ca 0.15 -0.52 -0.00 0.00 0.82 0.00 0.00 66.70 67.15 2bnx h VAL 161 Cb 0.14 0.07 -0.01 0.00 -1.52 0.00 0.00 31.29 29.97 2bnx h VAL 161 CO -0.17 0.25 0.18 0.28 0.02 0.00 0.00 177.57 178.12 2bnx h SER 162 N 1.14 0.36 -0.27 0.57 0.02 -0.64 -0.30 113.55 114.44 2bnx h SER 162 Ca 0.30 -0.06 -0.07 0.00 -0.84 0.00 0.00 61.79 61.12 2bnx h SER 162 Cb -0.04 -0.09 -0.02 0.00 0.14 0.00 0.00 62.40 62.39 2bnx h SER 162 CO -0.06 0.32 -0.05 -0.07 -1.14 0.00 0.00 176.83 175.83 2bnx h LEU 163 N 0.38 0.61 0.00 5.07 3.38 -0.60 -0.47 115.31 123.68 2bnx h LEU 163 Ca 0.11 -0.15 -0.02 0.00 0.09 0.00 0.00 57.88 57.91 2bnx h LEU 163 Cb 0.03 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 40.61 2bnx h LEU 163 CO -0.02 0.72 -0.26 0.78 0.09 0.00 0.00 178.44 179.74 2bnx h ASN 164 N 0.59 0.00 0.00 -0.43 2.35 -0.94 -3.39 115.58 113.77 2bnx h ASN 164 Ca 0.11 0.00 -0.12 0.00 -0.55 0.00 0.00 56.30 55.74 2bnx h ASN 164 Cb 0.45 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.80 2bnx h ASN 164 CO 0.02 0.08 -1.71 0.59 -1.65 0.00 0.00 177.43 174.76 2bnx n ASN 165 N -3.04 2.08 -4.87 5.81 3.02 -0.14 -5.03 115.26 113.08 2bnx n ASN 165 Ca 0.03 0.00 -0.31 0.00 -0.03 0.00 0.00 54.58 54.27 2bnx n ASN 165 Cb 0.57 1.14 0.01 0.00 -0.61 0.00 0.00 39.78 40.88 2bnx n ASN 165 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 2bnx s ASN 166 N -4.03 6.26 0.80 6.41 0.01 -0.21 -5.05 114.94 119.14 2bnx s ASN 166 Ca -0.05 1.37 -0.14 0.00 -0.71 0.00 0.00 52.86 53.32 2bnx s ASN 166 Cb 0.06 -2.44 0.05 0.00 0.41 0.00 0.00 41.25 39.33 2bnx s ASN 166 CO 0.51 -0.81 1.02 -0.81 -1.51 0.00 0.00 177.10 175.50 2bnx n PRO 167 N -2.59 0.19 0.19 -0.60 -0.04 -1.26 -4.86 135.00 126.03 2bnx n PRO 167 Ca 0.05 0.13 0.16 0.00 -0.04 0.00 0.00 63.50 63.81 2bnx n PRO 167 Cb 0.54 -2.29 0.78 0.00 -0.04 0.00 0.00 33.50 32.49 2bnx n PRO 167 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 2bnx h VAL 168 N -0.82 0.62 -0.47 0.52 2.07 -1.96 0.21 116.25 116.42 2bnx h VAL 168 Ca -0.46 0.00 0.13 0.00 0.82 0.00 0.00 66.70 67.19 2bnx h VAL 168 Cb 1.31 0.87 -0.02 0.00 -1.52 0.00 0.00 31.29 31.92 2bnx h VAL 168 CO 0.45 0.00 0.33 0.77 0.02 0.00 0.00 177.57 179.14 2bnx h SER 169 N 0.00 0.03 -0.14 0.57 4.64 -2.00 -2.72 113.55 113.94 2bnx h SER 169 Ca 0.09 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.30 2bnx h SER 169 Cb 0.44 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 62.53 2bnx h SER 169 CO -0.00 0.02 -0.36 -0.25 -0.87 0.00 0.00 176.83 175.37 2bnx h TRP 170 N 0.04 0.63 -0.79 4.77 7.01 -0.91 -2.82 115.95 123.88 2bnx h TRP 170 Ca 0.22 -0.24 0.05 0.00 2.11 0.00 0.00 58.89 61.03 2bnx h TRP 170 Cb 0.84 -0.11 -0.05 0.00 -2.10 0.00 0.00 29.16 27.74 2bnx h TRP 170 CO -0.00 0.98 0.52 0.28 -2.79 0.00 0.00 178.44 177.42 2bnx h VAL 171 N 0.10 1.06 -0.21 2.65 2.07 -1.51 -1.44 116.25 118.98 2bnx h VAL 171 Ca -0.01 -0.30 -0.05 0.00 0.82 0.00 0.00 66.70 67.16 2bnx h VAL 171 Cb 0.97 0.10 -0.01 0.00 -1.52 0.00 0.00 31.29 30.83 2bnx h VAL 171 CO 0.08 0.16 -0.11 1.56 0.02 0.00 0.00 177.57 179.28 2bnx h GLN 172 N 0.88 0.33 -0.35 1.57 4.20 -1.46 0.35 115.11 120.64 2bnx h GLN 172 Ca 0.33 -0.08 -0.12 0.00 0.06 0.00 0.00 58.65 58.84 2bnx h GLN 172 Cb 0.18 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 27.90 2bnx h GLN 172 CO -0.11 0.45 -0.27 1.15 -0.67 0.00 0.00 178.83 179.38 2bnx h THR 173 N 0.31 1.28 0.64 -0.54 2.02 -1.02 -3.27 112.91 112.33 2bnx h THR 173 Ca 0.06 -1.39 -0.03 0.00 0.77 0.00 0.00 66.41 65.82 2bnx h THR 173 Cb 0.39 1.30 0.01 0.00 -1.74 0.00 0.00 68.15 68.10 2bnx h THR 173 CO 0.02 0.46 -0.31 0.15 0.37 0.00 0.00 175.52 176.21 2bnx h PHE 174 N 0.62 -0.79 -0.56 3.16 3.57 -0.90 -3.45 116.94 118.60 2bnx h PHE 174 Ca 0.08 -0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.56 2bnx h PHE 174 Cb 0.78 0.26 0.00 0.00 2.79 0.00 0.00 35.95 39.78 2bnx h PHE 174 CO 0.04 -0.49 0.00 0.41 -2.23 0.00 0.00 178.31 176.04 2bnx n GLY 175 N -0.42 -0.29 0.28 2.40 0.00 0.12 -0.86 105.19 106.42 2bnx n GLY 175 Ca -0.11 -1.07 -0.01 0.00 0.00 0.00 0.00 46.02 44.84 2bnx n GLY 175 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bnx h ALA 176 N -0.53 1.34 -0.17 4.61 0.00 -1.89 -0.15 119.26 122.47 2bnx h ALA 176 Ca 0.00 -0.19 -0.07 0.00 0.00 0.00 0.00 54.91 54.64 2bnx h ALA 176 Cb 0.00 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.62 2bnx h ALA 176 CO 0.00 0.46 -0.18 1.49 0.00 0.00 0.00 179.25 181.02 2bnx h GLU 177 N 0.60 0.43 -0.73 0.00 4.81 -1.95 0.24 114.58 117.97 2bnx h GLU 177 Ca 0.13 -0.23 -0.03 0.00 -0.13 0.00 0.00 59.36 59.10 2bnx h GLU 177 Cb 0.30 0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.65 2bnx h GLU 177 CO 0.00 0.80 0.33 0.78 -0.73 0.00 0.00 179.01 180.20 2bnx h GLY 178 N 0.08 1.14 0.60 1.92 0.00 -0.84 -2.49 103.07 103.48 2bnx h GLY 178 Ca 0.03 -0.59 0.02 0.00 0.00 0.00 0.00 47.33 46.79 2bnx h GLY 178 CO 0.05 0.56 -0.20 -2.00 0.00 0.00 0.00 176.54 174.95 2bnx h LEU 179 N 1.03 -0.56 -0.99 3.11 5.85 -0.90 -2.28 115.31 120.57 2bnx h LEU 179 Ca 0.25 0.07 0.07 0.00 0.84 0.00 0.00 57.88 59.11 2bnx h LEU 179 Cb 0.15 0.22 -0.07 0.00 0.37 0.00 0.00 40.66 41.33 2bnx h LEU 179 CO -0.03 -0.27 0.64 0.00 -0.34 0.00 0.00 178.44 178.44 2bnx h ALA 180 N 0.50 1.40 -0.25 1.25 0.00 -0.44 -0.69 119.26 121.03 2bnx h ALA 180 Ca 0.04 -0.01 -0.18 0.00 0.00 0.00 0.00 54.91 54.76 2bnx h ALA 180 Cb 0.39 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 17.89 2bnx h ALA 180 CO -0.14 0.40 -0.55 0.66 0.00 0.00 0.00 179.25 179.61 2bnx h SER 181 N 1.13 0.84 -0.37 0.00 4.64 -1.34 0.10 113.55 118.55 2bnx h SER 181 Ca 0.44 -0.45 0.07 0.00 -0.47 0.00 0.00 61.79 61.38 2bnx h SER 181 Cb 0.22 -0.24 -0.06 0.00 -0.31 0.00 0.00 62.40 62.01 2bnx h SER 181 CO -0.19 1.22 -0.03 -0.07 -0.87 0.00 0.00 176.83 176.89 2bnx h LEU 182 N 0.58 -0.21 -0.90 5.97 3.38 -0.98 -2.61 115.31 120.54 2bnx h LEU 182 Ca 0.01 0.09 -0.08 0.00 0.09 0.00 0.00 57.88 57.99 2bnx h LEU 182 Cb 1.13 0.17 -0.02 0.00 0.09 0.00 0.00 40.66 42.04 2bnx h LEU 182 CO 0.12 -0.06 -0.06 -0.07 0.09 0.00 0.00 178.44 178.45 2bnx h LEU 183 N 0.07 0.72 -0.17 1.67 3.38 -0.71 -1.72 115.31 118.56 2bnx h LEU 183 Ca 0.18 -0.19 0.05 0.00 0.09 0.00 0.00 57.88 58.00 2bnx h LEU 183 Cb 0.26 -0.19 -0.05 0.00 0.09 0.00 0.00 40.66 40.77 2bnx h LEU 183 CO -0.33 0.83 -0.14 0.44 0.09 0.00 0.00 178.44 179.34 2bnx h ASP 184 N 0.69 -0.44 -0.28 -0.43 3.32 -0.75 0.10 116.42 118.63 2bnx h ASP 184 Ca 0.13 0.09 -0.00 0.00 0.02 0.00 0.00 57.03 57.27 2bnx h ASP 184 Cb 0.51 0.22 -0.01 0.00 0.22 0.00 0.00 39.33 40.27 2bnx h ASP 184 CO 0.03 -0.18 0.17 0.40 -1.72 0.00 0.00 179.24 177.94 2bnx h ILE 185 N -0.15 1.10 -0.78 0.35 2.04 -1.29 -2.03 117.51 116.74 2bnx h ILE 185 Ca 0.11 -0.24 0.12 0.00 1.00 0.00 0.00 64.86 65.85 2bnx h ILE 185 Cb 0.31 0.75 -0.08 0.00 -0.74 0.00 0.00 36.82 37.06 2bnx h ILE 185 CO -0.26 0.10 0.39 0.25 0.00 0.00 0.00 178.15 178.63 2bnx h LEU 186 N 0.36 0.48 0.50 1.44 5.85 -1.18 -0.38 115.31 122.37 2bnx h LEU 186 Ca 0.10 0.08 -0.02 0.00 0.84 0.00 0.00 57.88 58.88 2bnx h LEU 186 Cb 0.01 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.05 2bnx h LEU 186 CO -0.02 0.23 -0.24 0.50 -0.34 0.00 0.00 178.44 178.57 2bnx h LYS 187 N 0.60 -0.65 -0.93 1.25 3.64 -0.26 0.13 116.57 120.36 2bnx h LYS 187 Ca 0.41 0.04 0.21 0.00 -1.27 0.00 0.00 60.65 60.04 2bnx h LYS 187 Cb 0.52 0.15 -0.18 0.00 -0.41 0.00 0.00 32.23 32.31 2bnx h LYS 187 CO -0.33 -0.43 -0.15 0.54 -2.27 0.00 0.00 179.45 176.81 2bnx n ARG 188 N -3.83 -0.08 -0.04 1.90 1.74 -0.81 -1.33 116.66 114.21 2bnx n ARG 188 Ca -0.08 1.44 -0.12 0.00 -0.77 0.00 0.00 57.85 58.32 2bnx n ARG 188 Cb 0.26 -2.19 -0.06 0.00 -1.02 0.00 0.00 32.46 29.46 2bnx n ARG 188 CO 0.00 0.00 0.00 -0.07 -1.52 0.00 0.00 177.63 176.04 2bnx h LEU 189 N 0.00 0.22 -1.19 0.55 3.38 -0.83 -2.61 115.31 114.84 2bnx h LEU 189 Ca 0.49 -0.26 0.17 0.00 0.09 0.00 0.00 57.88 58.37 2bnx h LEU 189 Cb 0.84 -0.06 -0.09 0.00 0.09 0.00 0.00 40.66 41.44 2bnx h LEU 189 CO -0.93 0.42 0.61 0.45 0.09 0.00 0.00 178.44 179.08 2bnx h HIS 190 N 0.01 0.90 0.00 1.13 3.86 0.14 -2.37 115.15 118.83 2bnx h HIS 190 Ca 0.04 0.03 -0.04 0.00 -1.16 0.00 0.00 60.37 59.24 2bnx h HIS 190 Cb 0.30 -0.28 -0.01 0.00 1.06 0.00 0.00 27.41 28.48 2bnx h HIS 190 CO 0.02 0.26 -0.21 -0.44 0.86 0.00 0.00 177.93 178.42 2bnx h ASP 191 N 0.70 0.00 -2.84 2.45 5.19 -1.00 -3.47 116.42 117.45 2bnx h ASP 191 Ca 0.51 0.00 -0.54 0.00 -0.62 0.00 0.00 57.03 56.38 2bnx h ASP 191 Cb 0.87 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.38 2bnx h ASP 191 CO -0.28 0.21 0.89 -0.70 -3.12 0.00 0.00 179.24 176.23 2bnx s GLU 192 N -3.54 4.26 0.06 3.56 2.56 -0.89 -4.95 118.70 119.75 2bnx s GLU 192 Ca 0.02 2.05 -0.30 0.00 0.00 0.00 0.00 54.97 56.74 2bnx s GLU 192 Cb 0.09 -3.60 -0.09 0.00 2.00 0.00 0.00 34.13 32.53 2bnx s GLU 192 CO 0.64 -0.63 1.83 0.15 -0.56 0.00 0.00 175.26 176.69 2bnx s LYS 193 N 2.56 4.15 0.18 4.30 1.02 -1.26 -4.84 119.74 125.85 2bnx s LYS 193 Ca 0.66 2.50 0.03 0.00 0.02 0.00 0.00 55.97 59.19 2bnx s LYS 193 Cb -0.33 -3.88 0.49 0.00 -0.52 0.00 0.00 37.83 33.59 2bnx s LYS 193 CO 0.28 -0.87 0.86 -1.91 -0.92 0.00 0.00 175.35 172.79 2bnx n GLU 194 N 6.61 -0.04 -0.07 1.68 2.13 -1.26 -0.11 120.64 129.58 2bnx n GLU 194 Ca 0.18 0.81 0.06 0.00 0.66 0.00 0.00 57.16 58.87 2bnx n GLU 194 Cb 0.40 -1.32 0.23 0.00 0.27 0.00 0.00 31.44 31.02 2bnx n GLU 194 CO 0.00 0.00 0.00 0.39 -0.41 0.00 0.00 177.13 177.11 2bnx n GLU 195 N -4.58 1.41 0.00 5.31 1.02 -1.26 -3.00 120.64 119.54 2bnx n GLU 195 Ca 0.15 -0.64 0.00 0.00 -0.02 0.00 0.00 57.16 56.65 2bnx n GLU 195 Cb 0.49 -1.22 0.00 0.00 -0.02 0.00 0.00 31.44 30.68 2bnx n GLU 195 CO 0.00 0.00 0.00 -2.37 1.18 0.00 0.00 177.13 175.94 2bnx n THR 196 N -0.05 0.00 -2.31 2.62 5.66 0.85 -5.08 114.28 115.97 2bnx n THR 196 Ca 0.10 -0.19 -0.39 0.00 -3.05 0.00 0.00 64.05 60.52 2bnx n THR 196 Cb 0.18 1.60 -0.03 0.00 -1.55 0.00 0.00 70.33 70.53 2bnx n THR 196 CO 0.00 0.00 0.00 -0.44 -3.05 0.00 0.00 175.07 171.58 2bnx s SER 197 N -0.02 6.72 0.49 1.09 0.01 -0.94 -4.96 113.70 116.10 2bnx s SER 197 Ca 0.00 2.38 -0.18 0.00 1.31 0.00 0.00 55.95 59.45 2bnx s SER 197 Cb 0.00 -2.62 -0.08 0.00 0.21 0.00 0.00 66.02 63.53 2bnx s SER 197 CO 0.00 -0.54 0.99 -0.83 0.41 0.00 0.00 173.24 173.27 2bnx s GLY 198 N -0.99 2.25 0.64 3.44 0.00 -1.26 -4.96 107.32 106.43 2bnx s GLY 198 Ca 0.53 0.35 0.35 0.00 0.00 0.00 0.00 44.72 45.95 2bnx s GLY 198 CO 0.41 0.64 2.15 3.43 0.00 0.00 0.00 173.10 179.73 2bnx h ASN 199 N 1.27 0.00 -0.28 1.64 2.35 -1.99 -2.40 115.58 116.17 2bnx h ASN 199 Ca -0.48 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.27 2bnx h ASN 199 Cb 1.19 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.56 2bnx h ASN 199 CO 0.60 0.00 0.00 -1.22 -1.65 0.00 0.00 177.43 175.16 2bnx n TYR 200 N -3.27 0.53 -0.12 1.19 4.01 -1.26 -4.73 117.16 113.50 2bnx n TYR 200 Ca -0.01 -0.62 -0.05 0.00 -0.16 0.00 0.00 57.90 57.06 2bnx n TYR 200 Cb 0.25 -0.11 0.01 0.00 -0.31 0.00 0.00 39.34 39.18 2bnx n TYR 200 CO 0.00 0.00 0.00 -0.44 -0.46 0.00 0.00 176.86 175.96 2bnx h ASP 201 N 1.69 -0.43 0.46 7.72 5.19 -1.82 -0.69 116.42 128.54 2bnx h ASP 201 Ca 0.00 0.13 -0.07 0.00 -0.62 0.00 0.00 57.03 56.46 2bnx h ASP 201 Cb 0.91 0.27 -0.01 0.00 0.18 0.00 0.00 39.33 40.68 2bnx h ASP 201 CO 0.06 -0.15 -0.34 0.77 -3.12 0.00 0.00 179.24 176.45 2bnx h SER 202 N -0.03 0.00 -0.27 6.45 4.64 -1.85 0.11 113.55 122.61 2bnx h SER 202 Ca 0.19 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.40 2bnx h SER 202 Cb 0.32 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.41 2bnx h SER 202 CO -0.42 0.34 -0.26 0.03 -0.87 0.00 0.00 176.83 175.65 2bnx h ARG 203 N 0.00 0.65 -0.31 4.77 2.47 -1.69 -1.62 114.38 118.65 2bnx h ARG 203 Ca -0.00 -0.34 -0.09 0.00 -1.26 0.00 0.00 59.98 58.28 2bnx h ARG 203 Cb 0.67 0.01 -0.01 0.00 -1.65 0.00 0.00 29.97 28.99 2bnx h ARG 203 CO 0.04 0.94 -0.17 -0.91 0.56 0.00 0.00 179.97 180.44 2bnx h ASN 204 N 0.38 0.68 -0.22 7.04 2.35 -0.80 -1.00 115.58 124.01 2bnx h ASN 204 Ca 0.04 -0.42 0.05 0.00 -0.55 0.00 0.00 56.30 55.42 2bnx h ASN 204 Cb 0.82 -0.19 -0.05 0.00 0.05 0.00 0.00 38.32 38.95 2bnx h ASN 204 CO 0.06 0.95 -0.09 1.56 -1.65 0.00 0.00 177.43 178.27 2bnx h GLN 205 N 0.42 -0.05 -0.25 0.81 4.20 -0.82 -1.48 115.11 117.94 2bnx h GLN 205 Ca 0.07 0.00 0.02 0.00 0.06 0.00 0.00 58.65 58.80 2bnx h GLN 205 Cb 0.70 0.01 -0.02 0.00 0.30 0.00 0.00 27.48 28.47 2bnx h GLN 205 CO 0.05 -0.03 0.10 1.25 -0.67 0.00 0.00 178.83 179.52 2bnx h HIS 206 N -0.05 0.18 -0.27 2.96 2.76 -1.21 -1.96 115.15 117.56 2bnx h HIS 206 Ca 0.12 0.01 0.00 0.00 -2.20 0.00 0.00 60.37 58.30 2bnx h HIS 206 Cb 0.23 -0.05 -0.01 0.00 1.55 0.00 0.00 27.41 29.13 2bnx h HIS 206 CO -0.26 0.09 0.17 1.49 -1.30 0.00 0.00 177.93 178.13 2bnx h GLU 207 N 0.22 0.36 -0.40 5.26 4.57 -0.99 -1.42 114.58 122.19 2bnx h GLU 207 Ca 0.10 -0.02 -0.01 0.00 -1.18 0.00 0.00 59.36 58.25 2bnx h GLU 207 Cb 0.06 -0.08 -0.02 0.00 -0.16 0.00 0.00 28.75 28.55 2bnx h GLU 207 CO -0.09 0.25 0.20 0.82 -1.18 0.00 0.00 179.01 179.00 2bnx h ILE 208 N 0.37 1.17 -0.86 2.32 2.04 -0.80 -1.24 117.51 120.52 2bnx h ILE 208 Ca 0.10 -0.47 0.09 0.00 1.00 0.00 0.00 64.86 65.57 2bnx h ILE 208 Cb -0.03 0.75 -0.06 0.00 -0.74 0.00 0.00 36.82 36.74 2bnx h ILE 208 CO -0.02 0.18 0.56 0.40 0.00 0.00 0.00 178.15 179.27 2bnx h ILE 209 N 0.50 0.99 -0.25 -0.67 1.08 -0.59 0.44 117.51 119.01 2bnx h ILE 209 Ca 0.14 -0.30 -0.07 0.00 -0.39 0.00 0.00 64.86 64.24 2bnx h ILE 209 Cb 0.11 0.04 -0.01 0.00 -3.07 0.00 0.00 36.82 33.88 2bnx h ILE 209 CO -0.02 0.16 -0.13 0.03 -0.69 0.00 0.00 178.15 177.51 2bnx h ARG 210 N 0.87 0.42 -0.21 2.37 3.08 -1.03 -1.00 114.38 118.89 2bnx h ARG 210 Ca 0.39 -0.12 -0.21 0.00 0.07 0.00 0.00 59.98 60.11 2bnx h ARG 210 Cb 0.35 -0.05 0.01 0.00 0.08 0.00 0.00 29.97 30.36 2bnx h ARG 210 CO -0.15 0.55 -0.68 0.00 -1.07 0.00 0.00 179.97 178.62 2bnx h LEU 212 N 0.59 -0.18 -0.89 0.00 3.38 -0.00 -0.30 115.31 117.91 2bnx h LEU 212 Ca -0.03 0.04 0.14 0.00 0.09 0.00 0.00 57.88 58.13 2bnx h LEU 212 Cb 1.30 0.10 -0.09 0.00 0.09 0.00 0.00 40.66 42.06 2bnx h LEU 212 CO 0.14 -0.08 0.50 0.50 0.09 0.00 0.00 178.44 179.60 2bnx h LYS 213 N -0.05 0.72 -0.11 1.13 3.64 -1.23 -0.38 116.57 120.28 2bnx h LYS 213 Ca 0.06 -0.04 -0.07 0.00 -1.27 0.00 0.00 60.65 59.33 2bnx h LYS 213 Cb 0.14 -0.16 -0.00 0.00 -0.41 0.00 0.00 32.23 31.80 2bnx h LYS 213 CO -0.14 0.47 -0.19 0.00 -2.27 0.00 0.00 179.45 177.33 2bnx h ALA 214 N 1.55 0.17 -0.93 5.00 0.00 -1.13 -2.99 119.26 120.93 2bnx h ALA 214 Ca 0.47 -0.36 0.10 0.00 0.00 0.00 0.00 54.91 55.13 2bnx h ALA 214 Cb 0.61 -0.03 -0.07 0.00 0.00 0.00 0.00 17.79 18.30 2bnx h ALA 214 CO -0.33 0.10 0.60 0.35 0.00 0.00 0.00 179.25 179.97 2bnx h PHE 215 N -0.10 1.02 -0.01 0.00 3.57 -0.78 -2.49 116.94 118.15 2bnx h PHE 215 Ca 0.01 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.54 2bnx h PHE 215 Cb 0.76 -0.33 0.00 0.00 2.79 0.00 0.00 35.95 39.17 2bnx h PHE 215 CO 0.10 0.45 -0.01 -1.33 -2.23 0.00 0.00 178.31 175.30 2bnx n MET 216 N -4.55 1.31 0.00 1.11 2.81 -0.18 -3.99 117.12 113.65 2bnx n MET 216 Ca 0.16 -0.49 0.02 0.00 -1.81 0.00 0.00 57.70 55.58 2bnx n MET 216 Cb 0.31 -1.49 0.11 0.00 -0.71 0.00 0.00 33.22 31.45 2bnx n MET 216 CO 0.00 0.00 0.00 -1.71 1.51 0.00 0.00 175.97 175.77 2bnx n ASN 217 N -0.41 0.00 -4.15 7.83 4.05 -0.94 -4.04 115.26 117.60 2bnx n ASN 217 Ca 0.21 -1.52 -0.10 0.00 0.45 0.00 0.00 54.58 53.63 2bnx n ASN 217 Cb 0.24 0.00 -0.10 0.00 1.23 0.00 0.00 39.78 41.15 2bnx n ASN 217 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 177.26 174.75 2bnx s ASN 218 N -1.30 0.32 0.11 1.20 2.20 -1.26 -5.04 114.94 111.17 2bnx s ASN 218 Ca 0.06 -1.20 -0.16 0.00 -0.94 0.00 0.00 52.86 50.62 2bnx s ASN 218 Cb 0.03 0.29 -0.05 0.00 -2.00 0.00 0.00 41.25 39.52 2bnx s ASN 218 CO 0.04 -0.72 1.52 0.11 -2.94 0.00 0.00 177.10 175.11 2bnx h LYS 219 N 2.88 0.65 -0.08 3.55 1.57 -1.92 -0.99 116.57 122.23 2bnx h LYS 219 Ca -0.35 -0.24 0.01 0.00 -1.87 0.00 0.00 60.65 58.20 2bnx h LYS 219 Cb 1.20 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 33.45 2bnx h LYS 219 CO 0.59 0.80 0.02 0.35 -0.57 0.00 0.00 179.45 180.65 2bnx h PHE 220 N 0.44 0.03 -0.25 -1.35 3.57 -1.96 -1.85 116.94 115.57 2bnx h PHE 220 Ca 0.09 0.00 -0.05 0.00 3.53 0.00 0.00 57.97 61.55 2bnx h PHE 220 Cb 0.55 -0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.28 2bnx h PHE 220 CO 0.05 0.02 -0.03 0.78 -2.23 0.00 0.00 178.31 176.89 2bnx h GLY 221 N 0.06 0.49 0.98 2.40 0.00 -1.66 0.11 103.07 105.45 2bnx h GLY 221 Ca 0.03 -0.38 -0.01 0.00 0.00 0.00 0.00 47.33 46.97 2bnx h GLY 221 CO -0.04 0.35 0.25 1.19 0.00 0.00 0.00 176.54 178.29 2bnx h ILE 222 N 0.21 1.17 -0.14 2.60 2.10 -1.25 -0.76 117.51 121.44 2bnx h ILE 222 Ca 0.07 -0.46 0.01 0.00 1.08 0.00 0.00 64.86 65.56 2bnx h ILE 222 Cb 0.47 0.60 -0.01 0.00 -1.09 0.00 0.00 36.82 36.78 2bnx h ILE 222 CO 0.02 0.19 0.05 0.50 -1.08 0.00 0.00 178.15 177.82 2bnx h LYS 223 N 0.63 0.11 -0.04 2.19 3.64 -1.14 -1.90 116.57 120.06 2bnx h LYS 223 Ca 0.17 -0.01 -0.06 0.00 -1.27 0.00 0.00 60.65 59.48 2bnx h LYS 223 Cb 0.07 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 31.85 2bnx h LYS 223 CO -0.03 0.08 -0.24 0.00 -2.27 0.00 0.00 179.45 176.99 2bnx h THR 224 N 0.12 1.19 -0.21 1.00 1.03 -0.65 -2.61 112.91 112.79 2bnx h THR 224 Ca 0.06 -0.90 0.01 0.00 -0.01 0.00 0.00 66.41 65.57 2bnx h THR 224 Cb 0.03 1.43 -0.02 0.00 -1.07 0.00 0.00 68.15 68.53 2bnx h THR 224 CO -0.06 0.26 0.11 -0.03 -0.01 0.00 0.00 175.52 175.79 2bnx h MET 225 N 0.06 0.22 -0.16 0.00 1.85 -0.77 -2.64 114.93 113.49 2bnx h MET 225 Ca 0.01 -0.01 0.05 0.00 -0.61 0.00 0.00 59.70 59.13 2bnx h MET 225 Cb 0.46 -0.05 -0.01 0.00 0.43 0.00 0.00 31.60 32.43 2bnx h MET 225 CO 0.03 0.15 0.14 -0.07 -0.40 0.00 0.00 176.91 176.76 2bnx h LEU 226 N 0.23 0.00 0.00 3.39 3.38 -0.99 -1.68 115.31 119.64 2bnx h LEU 226 Ca 0.08 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.05 2bnx h LEU 226 Cb 0.01 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.76 2bnx h LEU 226 CO -0.05 0.00 -0.11 -0.62 0.09 0.00 0.00 178.44 177.75 2bnx n GLU 227 N -4.15 0.27 -1.52 1.13 1.02 -1.01 -4.91 120.64 111.47 2bnx n GLU 227 Ca 0.01 0.20 -0.32 0.00 -0.02 0.00 0.00 57.16 57.03 2bnx n GLU 227 Cb 0.26 -1.79 0.07 0.00 -0.02 0.00 0.00 31.44 29.96 2bnx n GLU 227 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 2bnx s THR 228 N -3.11 3.32 0.22 2.62 -4.23 -0.63 -4.95 115.64 108.87 2bnx s THR 228 Ca 0.10 0.52 -0.06 0.00 -1.18 0.00 0.00 61.69 61.07 2bnx s THR 228 Cb 0.12 -3.03 0.08 0.00 1.34 0.00 0.00 72.50 71.02 2bnx s THR 228 CO 0.62 -0.47 1.69 -0.33 -0.54 0.00 0.00 174.62 175.59 2bnx h GLU 229 N -0.53 0.94 0.00 3.99 5.08 -1.91 -3.40 114.58 118.75 2bnx h GLU 229 Ca -0.45 -0.28 0.00 0.00 -1.00 0.00 0.00 59.36 57.62 2bnx h GLU 229 Cb 1.24 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 30.40 2bnx h GLU 229 CO 0.53 0.94 0.00 0.39 -1.00 0.00 0.00 179.01 179.87 2bnx n GLU 230 N -4.19 0.34 -0.15 2.33 1.02 -1.26 -4.84 120.64 113.90 2bnx n GLU 230 Ca 0.03 -0.52 -0.03 0.00 -0.02 0.00 0.00 57.16 56.62 2bnx n GLU 230 Cb 0.34 -0.69 0.06 0.00 -0.02 0.00 0.00 31.44 31.12 2bnx n GLU 230 CO 0.00 0.00 0.00 0.78 1.18 0.00 0.00 177.13 179.09 2bnx h GLY 231 N 0.00 0.51 0.87 0.62 0.00 -1.83 -0.30 103.07 102.93 2bnx h GLY 231 Ca 0.00 0.05 -0.03 0.00 0.00 0.00 0.00 47.33 47.35 2bnx h GLY 231 CO 0.00 -0.12 0.05 -2.22 0.00 0.00 0.00 176.54 174.25 2bnx h ILE 232 N 0.13 1.22 -0.78 2.60 2.04 -1.88 -1.16 117.51 119.67 2bnx h ILE 232 Ca 0.24 -0.73 0.09 0.00 1.00 0.00 0.00 64.86 65.47 2bnx h ILE 232 Cb 0.36 1.22 -0.07 0.00 -0.74 0.00 0.00 36.82 37.59 2bnx h ILE 232 CO -0.39 0.23 0.43 0.25 0.00 0.00 0.00 178.15 178.67 2bnx h LEU 233 N 0.23 0.60 -0.95 1.44 5.85 -1.83 -0.76 115.31 119.88 2bnx h LEU 233 Ca 0.08 0.05 -0.11 0.00 0.84 0.00 0.00 57.88 58.74 2bnx h LEU 233 Cb 0.30 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.26 2bnx h LEU 233 CO 0.00 0.35 -0.49 -0.07 -0.34 0.00 0.00 178.44 177.89 2bnx h LEU 234 N 0.73 0.08 -0.47 2.25 3.38 -0.62 -0.05 115.31 120.60 2bnx h LEU 234 Ca 0.38 -0.04 -0.06 0.00 0.09 0.00 0.00 57.88 58.25 2bnx h LEU 234 Cb 0.36 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.07 2bnx h LEU 234 CO -0.25 0.56 0.07 0.25 0.09 0.00 0.00 178.44 179.16 2bnx h LEU 235 N 0.06 0.76 -0.55 1.67 5.85 -0.63 -2.35 115.31 120.13 2bnx h LEU 235 Ca -0.00 -0.27 -0.11 0.00 0.84 0.00 0.00 57.88 58.35 2bnx h LEU 235 Cb 0.89 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 41.70 2bnx h LEU 235 CO 0.07 0.84 -0.07 0.58 -0.34 0.00 0.00 178.44 179.52 2bnx h VAL 236 N 0.66 1.27 0.00 1.05 2.07 -0.58 -2.60 116.25 118.12 2bnx h VAL 236 Ca 0.14 -1.22 -0.00 0.00 0.82 0.00 0.00 66.70 66.44 2bnx h VAL 236 Cb 0.41 0.93 -0.00 0.00 -1.52 0.00 0.00 31.29 31.11 2bnx h VAL 236 CO 0.01 0.43 -0.02 0.03 0.02 0.00 0.00 177.57 178.04 2bnx h ARG 237 N 0.90 0.00 0.00 1.57 3.08 -0.93 -0.97 114.38 118.04 2bnx h ARG 237 Ca 0.15 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.20 2bnx h ARG 237 Cb 0.63 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.68 2bnx h ARG 237 CO 0.04 0.02 0.00 0.00 -1.07 0.00 0.00 179.97 178.96 2bnx h ALA 238 N 1.98 1.00 -0.31 0.04 0.00 -1.01 -3.38 119.26 117.58 2bnx h ALA 238 Ca -0.00 0.00 -0.68 0.00 0.00 0.00 0.00 54.91 54.23 2bnx h ALA 238 Cb 0.49 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.23 2bnx h ALA 238 CO 0.00 0.00 2.67 -1.33 0.00 0.00 0.00 179.25 180.59 2bnx n MET 239 N -2.41 2.80 -3.78 0.00 2.81 -0.37 -3.52 117.12 112.66 2bnx n MET 239 Ca 0.01 -2.76 -0.37 0.00 -1.81 0.00 0.00 57.70 52.77 2bnx n MET 239 Cb 0.22 -3.35 -0.13 0.00 -0.71 0.00 0.00 33.22 29.25 2bnx n MET 239 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 2bnx s ASP 240 N 3.84 5.07 0.65 7.83 -1.08 -1.26 -4.96 116.67 126.76 2bnx s ASP 240 Ca 0.51 -0.74 0.39 0.00 -0.52 0.00 0.00 52.55 52.20 2bnx s ASP 240 Cb 0.10 -1.86 2.19 0.00 -1.46 0.00 0.00 42.92 41.89 2bnx s ASP 240 CO -0.01 -0.19 2.29 -0.65 0.52 0.00 0.00 175.17 177.13 2bnx h PRO 241 N 8.22 0.00 0.00 4.34 0.11 -1.89 -0.67 132.00 142.10 2bnx h PRO 241 Ca -0.31 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 65.74 2bnx h PRO 241 Cb 1.12 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.22 2bnx h PRO 241 CO 0.60 0.00 -0.30 0.00 -0.21 0.00 0.00 178.00 178.10 2bnx h ALA 242 N 1.91 1.07 -2.59 -0.75 0.00 -1.98 -3.30 119.26 113.62 2bnx h ALA 242 Ca 0.01 -0.27 -0.62 0.00 0.00 0.00 0.00 54.91 54.03 2bnx h ALA 242 Cb 0.11 -0.05 -0.41 0.00 0.00 0.00 0.00 17.79 17.44 2bnx h ALA 242 CO -0.00 0.37 -0.51 1.55 0.00 0.00 0.00 179.25 180.66 2bnx n VAL 243 N -3.55 2.22 -0.31 0.00 3.14 -0.26 -4.98 118.33 114.60 2bnx n VAL 243 Ca -0.00 -5.10 0.19 0.00 -2.96 0.00 0.00 64.34 56.46 2bnx n VAL 243 Cb 0.44 -2.15 0.45 0.00 -1.06 0.00 0.00 33.84 31.52 2bnx n VAL 243 CO 0.00 0.00 0.00 1.55 -6.46 0.00 0.00 176.83 171.92 2bnx h PRO 244 N 4.81 0.50 0.01 1.45 0.13 -1.65 -1.82 132.00 135.43 2bnx h PRO 244 Ca 0.18 -0.03 -0.20 0.00 -0.87 0.00 0.00 66.00 65.08 2bnx h PRO 244 Cb 0.70 -0.11 -0.02 0.00 0.13 0.00 0.00 31.00 31.71 2bnx h PRO 244 CO 0.81 0.33 -0.89 -0.91 -0.23 0.00 0.00 178.00 177.10 2bnx h ASN 245 N 0.51 0.16 -0.24 1.44 2.35 -1.94 0.20 115.58 118.07 2bnx h ASN 245 Ca 0.56 -0.13 -0.06 0.00 -0.55 0.00 0.00 56.30 56.11 2bnx h ASN 245 Cb 1.23 -0.05 -0.01 0.00 0.05 0.00 0.00 38.32 39.54 2bnx h ASN 245 CO -0.29 0.97 -0.09 -0.03 -1.65 0.00 0.00 177.43 176.33 2bnx h MET 246 N 0.06 0.48 -0.49 0.81 4.05 -1.68 -2.98 114.93 115.18 2bnx h MET 246 Ca -0.03 -0.20 0.10 0.00 -0.28 0.00 0.00 59.70 59.28 2bnx h MET 246 Cb 1.55 -0.02 -0.09 0.00 -0.80 0.00 0.00 31.60 32.24 2bnx h MET 246 CO 0.13 0.74 -0.05 1.98 0.23 0.00 0.00 176.91 179.94 2bnx h MET 247 N 0.21 0.07 -0.51 0.39 1.85 -1.16 -0.70 114.93 115.07 2bnx h MET 247 Ca 0.06 -0.00 0.10 0.00 -0.61 0.00 0.00 59.70 59.24 2bnx h MET 247 Cb 0.58 -0.01 -0.09 0.00 0.43 0.00 0.00 31.60 32.51 2bnx h MET 247 CO 0.03 0.04 -0.06 0.82 -0.40 0.00 0.00 176.91 177.35 2bnx h ILE 248 N 0.07 0.55 -0.47 1.77 2.04 -0.98 0.60 117.51 121.09 2bnx h ILE 248 Ca 0.24 -0.02 -0.06 0.00 1.00 0.00 0.00 64.86 66.02 2bnx h ILE 248 Cb 0.37 0.48 -0.02 0.00 -0.74 0.00 0.00 36.82 36.91 2bnx h ILE 248 CO -0.45 0.01 0.06 0.44 0.00 0.00 0.00 178.15 178.22 2bnx h ASP 249 N 0.06 0.76 -0.24 1.72 3.32 -1.25 -1.88 116.42 118.91 2bnx h ASP 249 Ca 0.25 -0.27 -0.04 0.00 0.02 0.00 0.00 57.03 56.99 2bnx h ASP 249 Cb 0.39 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.73 2bnx h ASP 249 CO -0.47 0.84 -0.01 0.00 -1.72 0.00 0.00 179.24 177.88 2bnx h ALA 250 N 0.95 0.33 -0.76 3.45 0.00 -0.99 -2.56 119.26 119.68 2bnx h ALA 250 Ca 0.14 -0.23 -0.04 0.00 0.00 0.00 0.00 54.91 54.78 2bnx h ALA 250 Cb 0.41 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.08 2bnx h ALA 250 CO 0.01 0.07 0.31 0.00 0.00 0.00 0.00 179.25 179.64 2bnx h ALA 251 N 0.80 1.11 -0.57 0.00 0.00 -0.86 -0.20 119.26 119.54 2bnx h ALA 251 Ca 0.07 -0.18 -0.06 0.00 0.00 0.00 0.00 54.91 54.73 2bnx h ALA 251 Cb 0.43 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 2bnx h ALA 251 CO 0.01 0.64 0.10 -0.22 0.00 0.00 0.00 179.25 179.78 2bnx h LYS 252 N 1.10 0.90 -0.25 0.00 3.64 -1.35 0.11 116.57 120.71 2bnx h LYS 252 Ca 0.25 -0.21 -0.17 0.00 -1.27 0.00 0.00 60.65 59.26 2bnx h LYS 252 Cb 0.20 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 31.90 2bnx h LYS 252 CO -0.02 0.83 -0.51 -0.07 -2.27 0.00 0.00 179.45 177.41 2bnx h LEU 253 N 0.85 0.88 -0.45 5.20 3.38 -1.10 -2.50 115.31 121.58 2bnx h LEU 253 Ca 0.18 -0.55 -0.02 0.00 0.09 0.00 0.00 57.88 57.58 2bnx h LEU 253 Cb 0.36 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.84 2bnx h LEU 253 CO 0.01 1.26 0.19 -0.07 0.09 0.00 0.00 178.44 179.91 2bnx h LEU 254 N 0.53 0.62 -0.78 1.67 3.38 -0.76 -1.61 115.31 118.36 2bnx h LEU 254 Ca 0.01 -0.16 0.12 0.00 0.09 0.00 0.00 57.88 57.93 2bnx h LEU 254 Cb 1.12 -0.16 -0.08 0.00 0.09 0.00 0.00 40.66 41.62 2bnx h LEU 254 CO 0.11 0.61 0.39 0.28 0.09 0.00 0.00 178.44 179.92 2bnx h SER 255 N 0.59 0.47 0.23 -0.43 0.02 -0.84 -0.42 113.55 113.16 2bnx h SER 255 Ca 0.15 0.08 -0.08 0.00 -0.84 0.00 0.00 61.79 61.10 2bnx h SER 255 Cb 0.18 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.72 2bnx h SER 255 CO -0.01 0.23 -0.31 0.00 -1.14 0.00 0.00 176.83 175.59 2bnx h ALA 256 N 1.50 1.33 -0.19 3.77 0.00 -1.04 -2.13 119.26 122.50 2bnx h ALA 256 Ca 0.41 -0.32 -0.05 0.00 0.00 0.00 0.00 54.91 54.95 2bnx h ALA 256 Cb 0.51 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 2bnx h ALA 256 CO -0.32 0.47 -0.06 -0.07 0.00 0.00 0.00 179.25 179.27 2bnx h LEU 257 N 0.13 0.38 -1.18 0.00 3.38 -0.81 -3.08 115.31 114.13 2bnx h LEU 257 Ca 0.02 -0.38 0.08 0.00 0.09 0.00 0.00 57.88 57.69 2bnx h LEU 257 Cb 0.63 -0.10 -0.06 0.00 0.09 0.00 0.00 40.66 41.21 2bnx h LEU 257 CO 0.05 0.67 0.58 0.00 0.09 0.00 0.00 178.44 179.83 2bnx h ILE 259 N 0.94 0.00 -1.89 0.00 1.08 -1.41 -3.37 117.51 112.86 2bnx h ILE 259 Ca 0.40 -0.68 -0.65 0.00 -0.39 0.00 0.00 64.86 63.54 2bnx h ILE 259 Cb 0.32 1.58 0.04 0.00 -3.07 0.00 0.00 36.82 35.69 2bnx h ILE 259 CO -0.16 0.00 0.80 0.18 -0.69 0.00 0.00 178.15 178.27 2bnx n LEU 260 N -2.53 2.61 0.28 1.44 4.32 -1.11 -4.87 117.00 117.14 2bnx n LEU 260 Ca 0.04 1.07 0.17 0.00 -0.02 0.00 0.00 56.01 57.27 2bnx n LEU 260 Cb 0.47 -1.28 0.70 0.00 -1.62 0.00 0.00 43.42 41.69 2bnx n LEU 260 CO 0.33 -0.48 1.00 1.55 -1.22 0.00 0.00 177.39 178.57 2bnx h PRO 261 N 6.60 0.00 -3.17 3.23 0.13 -1.90 -3.44 132.00 133.45 2bnx h PRO 261 Ca -0.47 0.00 -0.28 0.00 -0.87 0.00 0.00 66.00 64.38 2bnx h PRO 261 Cb 1.30 0.00 -0.34 0.00 0.13 0.00 0.00 31.00 32.08 2bnx h PRO 261 CO 0.89 0.00 -0.63 -1.14 -0.23 0.00 0.00 178.00 176.89 2bnx s GLN 262 N -3.68 0.05 1.07 0.86 2.00 -1.26 -3.81 119.66 114.89 2bnx s GLN 262 Ca 0.01 0.48 -0.14 0.00 -2.00 0.00 0.00 55.36 53.71 2bnx s GLN 262 Cb 0.09 -0.25 0.17 0.00 0.80 0.00 0.00 33.01 33.83 2bnx s GLN 262 CO 0.53 -0.25 0.70 -2.30 -0.50 0.00 0.00 175.29 173.47 2bnx n PRO 263 N 4.89 -1.49 0.00 1.67 -0.02 -1.26 -5.08 135.00 133.72 2bnx n PRO 263 Ca -0.13 -0.40 0.13 0.00 -2.02 0.00 0.00 63.50 61.08 2bnx n PRO 263 Cb 0.50 -2.05 0.45 0.00 -0.02 0.00 0.00 33.50 32.38 2bnx n PRO 263 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2bnx n GLU 264 N -3.59 0.27 -1.72 -0.52 1.02 -1.25 -4.00 120.64 110.85 2bnx n GLU 264 Ca 0.05 -0.11 -0.14 0.00 -0.02 0.00 0.00 57.16 56.93 2bnx n GLU 264 Cb 0.55 -1.50 0.07 0.00 -0.02 0.00 0.00 31.44 30.55 2bnx n GLU 264 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 2bnx n ASP 265 N -1.26 3.77 -0.12 1.62 5.75 -1.26 -4.83 116.55 120.21 2bnx n ASP 265 Ca 0.09 -3.60 -0.05 0.00 -0.01 0.00 0.00 54.79 51.22 2bnx n ASP 265 Cb 0.32 -0.40 0.15 0.00 -1.03 0.00 0.00 41.12 40.16 2bnx n ASP 265 CO 0.00 0.00 0.00 0.24 -0.11 0.00 0.00 177.20 177.33 2bnx h MET 266 N 1.89 0.82 -0.26 0.11 2.86 -1.86 -1.74 114.93 116.75 2bnx h MET 266 Ca 0.22 -0.22 -0.04 0.00 -2.06 0.00 0.00 59.70 57.60 2bnx h MET 266 Cb 1.40 -0.09 -0.01 0.00 0.06 0.00 0.00 31.60 32.95 2bnx h MET 266 CO 0.51 0.82 0.00 -2.95 1.06 0.00 0.00 176.91 176.35 2bnx h ASN 267 N 0.76 0.36 0.52 1.22 -1.07 -1.84 -1.34 115.58 114.20 2bnx h ASN 267 Ca 0.15 -0.05 -0.16 0.00 0.07 0.00 0.00 56.30 56.31 2bnx h ASN 267 Cb 0.46 -0.09 -0.01 0.00 -2.07 0.00 0.00 38.32 36.60 2bnx h ASN 267 CO 0.02 0.42 -0.69 -0.33 0.07 0.00 0.00 177.43 176.92 2bnx h GLU 268 N 0.38 0.14 -0.33 4.14 5.08 -1.72 -0.08 114.58 122.20 2bnx h GLU 268 Ca 0.09 -0.11 -0.14 0.00 -1.00 0.00 0.00 59.36 58.19 2bnx h GLU 268 Cb 0.25 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.51 2bnx h GLU 268 CO 0.01 0.77 -0.38 0.00 -1.00 0.00 0.00 179.01 178.41 2bnx h ARG 269 N 0.10 0.77 -0.13 2.33 3.08 -0.95 -1.29 114.38 118.29 2bnx h ARG 269 Ca -0.01 -0.39 -0.08 0.00 0.07 0.00 0.00 59.98 59.56 2bnx h ARG 269 Cb 1.22 0.01 0.00 0.00 0.08 0.00 0.00 29.97 31.28 2bnx h ARG 269 CO 0.10 1.02 -0.24 0.28 -1.07 0.00 0.00 179.97 180.05 2bnx h VAL 270 N 0.63 1.37 -0.89 2.04 2.07 -1.15 -2.16 116.25 118.17 2bnx h VAL 270 Ca 0.06 -1.50 0.06 0.00 0.82 0.00 0.00 66.70 66.13 2bnx h VAL 270 Cb 0.93 2.03 -0.06 0.00 -1.52 0.00 0.00 31.29 32.67 2bnx h VAL 270 CO 0.09 0.44 0.58 0.25 0.02 0.00 0.00 177.57 178.94 2bnx h LEU 271 N -0.01 0.89 0.04 2.57 5.85 -1.05 -0.35 115.31 123.24 2bnx h LEU 271 Ca 0.01 0.00 0.01 0.00 0.84 0.00 0.00 57.88 58.74 2bnx h LEU 271 Cb 0.83 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.66 2bnx h LEU 271 CO 0.05 0.57 -0.07 -0.08 -0.34 0.00 0.00 178.44 178.58 2bnx h GLU 272 N 1.01 -0.13 -0.86 1.25 4.81 -1.12 -0.91 114.58 118.63 2bnx h GLU 272 Ca 0.38 0.01 0.08 0.00 -0.13 0.00 0.00 59.36 59.70 2bnx h GLU 272 Cb 0.19 0.03 -0.06 0.00 0.63 0.00 0.00 28.75 29.54 2bnx h GLU 272 CO -0.14 -0.09 0.56 0.00 -0.73 0.00 0.00 179.01 178.61 2bnx h ALA 273 N 0.82 1.63 -0.43 2.92 0.00 -0.89 -1.21 119.26 122.09 2bnx h ALA 273 Ca 0.01 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.81 2bnx h ALA 273 Cb 0.15 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 2bnx h ALA 273 CO -0.04 0.21 -0.13 0.52 0.00 0.00 0.00 179.25 179.80 2bnx h MET 274 N 0.88 0.80 -0.16 0.00 2.86 -0.63 -1.31 114.93 117.36 2bnx h MET 274 Ca 0.39 -0.28 -0.03 0.00 -2.06 0.00 0.00 59.70 57.71 2bnx h MET 274 Cb 0.34 -0.06 -0.01 0.00 0.06 0.00 0.00 31.60 31.94 2bnx h MET 274 CO -0.15 0.89 -0.03 1.15 1.06 0.00 0.00 176.91 179.83 2bnx h THR 275 N 0.72 1.28 -0.66 2.22 2.02 -0.69 -1.43 112.91 116.36 2bnx h THR 275 Ca 0.12 -0.96 0.04 0.00 0.77 0.00 0.00 66.41 66.38 2bnx h THR 275 Cb 0.63 1.58 -0.05 0.00 -1.74 0.00 0.00 68.15 68.57 2bnx h THR 275 CO 0.04 0.28 0.39 -0.33 0.37 0.00 0.00 175.52 176.28 2bnx h GLU 276 N 0.02 0.73 0.06 6.66 5.08 -1.14 -1.81 114.58 124.18 2bnx h GLU 276 Ca 0.04 -0.04 -0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2bnx h GLU 276 Cb 0.45 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.53 2bnx h GLU 276 CO 0.01 0.48 -0.03 -0.09 -1.00 0.00 0.00 179.01 178.38 2bnx h ARG 277 N 0.75 -0.08 -0.84 2.33 1.12 -1.21 -2.54 114.38 113.90 2bnx h ARG 277 Ca 0.28 0.01 0.18 0.00 -1.11 0.00 0.00 59.98 59.33 2bnx h ARG 277 Cb 0.09 0.02 -0.11 0.00 -0.01 0.00 0.00 29.97 29.96 2bnx h ARG 277 CO -0.14 -0.02 0.36 0.00 -3.11 0.00 0.00 179.97 177.06 2bnx h ALA 278 N 0.81 1.27 -0.67 2.80 0.00 -1.09 -1.25 119.26 121.13 2bnx h ALA 278 Ca -0.01 0.13 -0.06 0.00 0.00 0.00 0.00 54.91 54.97 2bnx h ALA 278 Cb 0.10 0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.97 2bnx h ALA 278 CO 0.01 -0.25 0.18 0.93 0.00 0.00 0.00 179.25 180.12 2bnx h GLU 279 N 0.45 1.05 0.38 0.00 5.08 -1.14 0.12 114.58 120.53 2bnx h GLU 279 Ca 0.49 -0.23 -0.02 0.00 -1.00 0.00 0.00 59.36 58.60 2bnx h GLU 279 Cb 0.84 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.94 2bnx h GLU 279 CO -0.46 0.92 -0.18 0.52 -1.00 0.00 0.00 179.01 178.81 2bnx h MET 280 N 1.01 -0.49 0.00 2.33 2.86 -0.87 -3.14 114.93 116.63 2bnx h MET 280 Ca 0.21 0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.89 2bnx h MET 280 Cb 0.33 0.11 0.00 0.00 0.06 0.00 0.00 31.60 32.11 2bnx h MET 280 CO -0.00 -0.18 0.00 -0.25 1.06 0.00 0.00 176.91 177.54 2bnx n ASP 281 N -5.15 0.00 -1.64 1.22 8.00 -0.57 -4.91 116.55 113.50 2bnx n ASP 281 Ca -0.09 -0.27 -0.15 0.00 0.71 0.00 0.00 54.79 54.99 2bnx n ASP 281 Cb 0.28 -0.21 -0.02 0.00 -0.02 0.00 0.00 41.12 41.14 2bnx n ASP 281 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2bnx n GLU 282 N -1.21 -1.20 -4.12 -1.24 1.02 0.21 -5.03 120.64 109.06 2bnx n GLU 282 Ca 0.14 0.80 -0.25 0.00 -0.02 0.00 0.00 57.16 57.83 2bnx n GLU 282 Cb 0.18 -5.12 -0.07 0.00 -0.02 0.00 0.00 31.44 26.41 2bnx n GLU 282 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 2bnx s VAL 283 N -2.73 2.20 0.23 2.62 0.11 0.06 -4.98 120.40 117.91 2bnx s VAL 283 Ca 0.00 -1.68 -0.30 0.00 -2.93 0.00 0.00 61.98 57.07 2bnx s VAL 283 Cb 0.00 -2.88 -0.09 0.00 -1.53 0.00 0.00 36.38 31.88 2bnx s VAL 283 CO 0.00 0.00 1.25 -1.61 -3.33 0.00 0.00 175.10 171.41 2bnx s GLU 284 N -3.94 4.44 0.51 1.54 0.41 -1.26 -4.56 118.70 115.84 2bnx s GLU 284 Ca 0.39 2.01 0.16 0.00 -0.41 0.00 0.00 54.97 57.11 2bnx s GLU 284 Cb 0.03 -3.18 1.25 0.00 -1.78 0.00 0.00 34.13 30.45 2bnx s GLU 284 CO 0.22 -0.13 2.14 0.07 -0.49 0.00 0.00 175.26 177.07 2bnx h ARG 285 N 4.74 0.03 -0.21 1.61 0.11 -1.92 -0.49 114.38 118.25 2bnx h ARG 285 Ca -0.46 -0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.62 2bnx h ARG 285 Cb 1.22 -0.01 0.00 0.00 1.11 0.00 0.00 29.97 32.29 2bnx h ARG 285 CO 0.73 0.02 0.00 1.19 0.10 0.00 0.00 179.97 182.01 2bnx n PHE 286 N -4.54 0.26 0.05 4.08 3.72 -1.26 -4.51 117.46 115.26 2bnx n PHE 286 Ca -0.03 -0.13 -0.13 0.00 -0.05 0.00 0.00 57.45 57.12 2bnx n PHE 286 Cb 0.09 0.00 -0.08 0.00 -0.94 0.00 0.00 39.48 38.55 2bnx n PHE 286 CO 0.00 0.00 0.00 0.37 -0.05 0.00 0.00 176.76 177.08 2bnx h GLN 287 N 3.63 -0.06 -0.87 -1.08 5.75 -1.46 -1.67 115.11 119.35 2bnx h GLN 287 Ca 0.00 0.00 0.19 0.00 -0.15 0.00 0.00 58.65 58.70 2bnx h GLN 287 Cb 0.79 0.01 -0.06 0.00 1.07 0.00 0.00 27.48 29.29 2bnx h GLN 287 CO 0.00 0.06 0.58 -1.35 -2.65 0.00 0.00 178.83 175.47 2bnx h PRO 288 N -0.16 0.37 -0.24 -2.39 0.11 -1.79 0.61 132.00 128.51 2bnx h PRO 288 Ca -0.01 -0.02 -0.18 0.00 0.11 0.00 0.00 66.00 65.90 2bnx h PRO 288 Cb 0.14 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 31.17 2bnx h PRO 288 CO 0.01 0.25 -0.56 -0.07 -0.21 0.00 0.00 178.00 177.41 2bnx h LEU 289 N 0.38 0.91 -0.87 2.35 3.38 -1.78 -2.41 115.31 117.27 2bnx h LEU 289 Ca 0.44 -0.56 -0.11 0.00 0.09 0.00 0.00 57.88 57.74 2bnx h LEU 289 Cb 1.12 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.60 2bnx h LEU 289 CO -0.15 1.31 -0.42 -0.07 0.09 0.00 0.00 178.44 179.19 2bnx h LEU 290 N 0.56 0.32 -1.14 1.67 3.38 -0.30 -2.85 115.31 116.95 2bnx h LEU 290 Ca -0.00 -0.14 0.09 0.00 0.09 0.00 0.00 57.88 57.93 2bnx h LEU 290 Cb 1.18 -0.09 -0.07 0.00 0.09 0.00 0.00 40.66 41.77 2bnx h LEU 290 CO 0.12 0.70 0.60 0.44 0.09 0.00 0.00 178.44 180.40 2bnx h ASP 291 N 0.25 0.87 1.49 -0.43 3.32 0.32 -2.31 116.42 119.93 2bnx h ASP 291 Ca 0.02 0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.09 2bnx h ASP 291 Cb 0.85 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 40.24 2bnx h ASP 291 CO 0.07 0.51 0.00 1.23 -1.72 0.00 0.00 179.24 179.33 2bnx h GLY 292 N 0.96 0.00 1.49 2.75 0.00 -1.21 -2.77 103.07 104.29 2bnx h GLY 292 Ca 0.43 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.76 2bnx h GLY 292 CO -0.19 0.00 -0.31 1.04 0.00 0.00 0.00 176.54 177.08 2bnx n LEU 293 N -2.73 0.47 -4.51 3.11 4.77 -0.88 -3.28 117.00 113.95 2bnx n LEU 293 Ca 0.04 0.30 -0.38 0.00 -0.03 0.00 0.00 56.01 55.93 2bnx n LEU 293 Cb 0.42 -0.31 0.04 0.00 -2.33 0.00 0.00 43.42 41.24 2bnx n LEU 293 CO 0.30 -0.01 0.20 0.29 -1.33 0.00 0.00 177.39 176.83 2bnx n LYS 294 N -1.80 0.59 -0.09 3.23 5.02 -1.05 -4.90 118.16 119.17 2bnx n LYS 294 Ca 0.05 0.23 0.04 0.00 -2.02 0.00 0.00 58.31 56.62 2bnx n LYS 294 Cb 0.38 -1.84 0.38 0.00 -0.02 0.00 0.00 35.03 33.93 2bnx n LYS 294 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 2bnx h SER 295 N 0.25 0.59 0.73 4.39 4.64 -1.93 -2.33 113.55 119.89 2bnx h SER 295 Ca -0.46 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 60.85 2bnx h SER 295 Cb 1.39 -0.14 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 2bnx h SER 295 CO 0.48 0.41 0.00 0.61 -0.87 0.00 0.00 176.83 177.46 2bnx n GLY 296 N -1.46 -1.27 3.83 -0.77 0.00 -1.26 -4.83 105.19 99.44 2bnx n GLY 296 Ca 0.06 0.07 -0.30 0.00 0.00 0.00 0.00 46.02 45.85 2bnx n GLY 296 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2bnx s THR 297 N -3.28 3.16 0.71 2.61 -4.23 -0.88 -5.04 115.64 108.69 2bnx s THR 297 Ca 0.05 0.38 -0.11 0.00 -1.18 0.00 0.00 61.69 60.82 2bnx s THR 297 Cb 0.09 -3.22 0.02 0.00 1.34 0.00 0.00 72.50 70.74 2bnx s THR 297 CO 0.39 -0.49 1.07 -0.94 -0.54 0.00 0.00 174.62 174.11 2bnx s SER 298 N -4.09 5.12 0.22 3.99 1.04 -1.26 -4.92 113.70 113.80 2bnx s SER 298 Ca 0.60 1.71 -0.05 0.00 0.48 0.00 0.00 55.95 58.69 2bnx s SER 298 Cb -0.13 -2.51 0.21 0.00 0.10 0.00 0.00 66.02 63.69 2bnx s SER 298 CO 0.53 -1.62 1.67 -0.29 0.98 0.00 0.00 173.24 174.52 2bnx h ILE 299 N -0.74 1.26 -0.88 -1.02 6.09 -1.96 -2.46 117.51 117.80 2bnx h ILE 299 Ca -0.44 -1.19 0.10 0.00 -1.37 0.00 0.00 64.86 61.96 2bnx h ILE 299 Cb 1.22 1.01 -0.06 0.00 0.47 0.00 0.00 36.82 39.46 2bnx h ILE 299 CO 0.55 0.41 0.57 0.00 -3.07 0.00 0.00 178.15 176.61 2bnx h ALA 300 N 1.12 1.65 -0.15 0.18 0.00 -1.99 -0.11 119.26 119.96 2bnx h ALA 300 Ca 0.13 -0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.95 2bnx h ALA 300 Cb 0.60 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.19 2bnx h ALA 300 CO 0.04 0.17 -0.22 1.25 0.00 0.00 0.00 179.25 180.49 2bnx h LEU 301 N 0.87 0.45 -0.44 0.00 5.85 -1.78 -1.30 115.31 118.95 2bnx h LEU 301 Ca 0.41 -0.53 0.01 0.00 0.84 0.00 0.00 57.88 58.61 2bnx h LEU 301 Cb 0.41 -0.13 -0.03 0.00 0.37 0.00 0.00 40.66 41.29 2bnx h LEU 301 CO -0.17 0.89 0.28 0.11 -0.34 0.00 0.00 178.44 179.20 2bnx h LYS 302 N 0.02 0.55 -0.50 1.25 1.57 -1.00 -0.60 116.57 117.86 2bnx h LYS 302 Ca 0.01 -0.03 -0.08 0.00 -1.87 0.00 0.00 60.65 58.68 2bnx h LYS 302 Cb 0.79 -0.12 -0.02 0.00 0.08 0.00 0.00 32.23 32.96 2bnx h LYS 302 CO 0.05 0.36 0.00 0.28 -0.57 0.00 0.00 179.45 179.57 2bnx h VAL 303 N 0.56 1.26 -0.82 0.50 2.07 -1.07 -2.21 116.25 116.55 2bnx h VAL 303 Ca 0.17 -1.08 -0.04 0.00 0.82 0.00 0.00 66.70 66.57 2bnx h VAL 303 Cb -0.03 0.96 -0.04 0.00 -1.52 0.00 0.00 31.29 30.67 2bnx h VAL 303 CO -0.06 0.38 0.36 1.23 0.02 0.00 0.00 177.57 179.50 2bnx h GLY 304 N 0.75 1.29 0.79 2.17 0.00 -0.88 -0.41 103.07 106.78 2bnx h GLY 304 Ca 0.14 -0.67 -0.04 0.00 0.00 0.00 0.00 47.33 46.76 2bnx h GLY 304 CO 0.03 0.64 -0.03 0.00 0.00 0.00 0.00 176.54 177.17 2bnx h LEU 306 N 0.06 0.59 -0.80 0.00 5.85 -1.41 -1.52 115.31 118.08 2bnx h LEU 306 Ca 0.05 -0.07 -0.07 0.00 0.84 0.00 0.00 57.88 58.63 2bnx h LEU 306 Cb 0.45 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 41.30 2bnx h LEU 306 CO 0.01 0.54 0.11 -0.61 -0.34 0.00 0.00 178.44 178.16 2bnx h GLN 307 N 0.65 1.01 -0.24 1.25 4.15 -1.02 -0.72 115.11 120.19 2bnx h GLN 307 Ca 0.16 -0.25 -0.20 0.00 0.77 0.00 0.00 58.65 59.13 2bnx h GLN 307 Cb 0.14 -0.13 0.00 0.00 0.21 0.00 0.00 27.48 27.71 2bnx h GLN 307 CO -0.01 0.93 -0.61 1.25 -1.93 0.00 0.00 178.83 178.45 2bnx h LEU 308 N 0.95 0.96 -0.25 -2.39 5.85 -1.21 -0.78 115.31 118.44 2bnx h LEU 308 Ca 0.19 -0.56 0.06 0.00 0.84 0.00 0.00 57.88 58.41 2bnx h LEU 308 Cb 0.40 -0.28 -0.06 0.00 0.37 0.00 0.00 40.66 41.09 2bnx h LEU 308 CO 0.01 1.35 -0.14 0.40 -0.34 0.00 0.00 178.44 179.72 2bnx h ILE 309 N 0.61 0.57 -0.85 4.05 2.04 -1.21 -1.45 117.51 121.27 2bnx h ILE 309 Ca -0.01 0.00 0.10 0.00 1.00 0.00 0.00 64.86 65.95 2bnx h ILE 309 Cb 1.23 0.57 -0.08 0.00 -0.74 0.00 0.00 36.82 37.81 2bnx h ILE 309 CO 0.13 0.00 0.49 0.78 0.00 0.00 0.00 178.15 179.56 2bnx h ASN 310 N -0.12 0.70 0.94 1.72 2.35 -0.90 -2.18 115.58 118.09 2bnx h ASN 310 Ca 0.14 0.05 -0.05 0.00 -0.55 0.00 0.00 56.30 55.89 2bnx h ASN 310 Cb 0.33 -0.08 -0.01 0.00 0.05 0.00 0.00 38.32 38.60 2bnx h ASN 310 CO -0.33 0.39 -0.25 0.00 -1.65 0.00 0.00 177.43 175.59 2bnx h ALA 311 N 1.48 1.01 -0.01 -0.83 0.00 -0.78 0.11 119.26 120.23 2bnx h ALA 311 Ca 0.42 -0.22 -0.18 0.00 0.00 0.00 0.00 54.91 54.92 2bnx h ALA 311 Cb 0.41 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 2bnx h ALA 311 CO -0.26 0.31 -0.82 -0.07 0.00 0.00 0.00 179.25 178.41 2bnx h LEU 312 N 0.00 0.23 0.00 0.00 3.38 -0.63 -3.38 115.31 114.91 2bnx h LEU 312 Ca -0.00 -0.18 -0.26 0.00 0.09 0.00 0.00 57.88 57.53 2bnx h LEU 312 Cb 0.78 -0.07 -0.04 0.00 0.09 0.00 0.00 40.66 41.42 2bnx h LEU 312 CO 0.03 0.95 -1.63 -0.38 0.09 0.00 0.00 178.44 177.50 2bnx n ILE 313 N -3.69 1.51 -0.22 1.22 5.41 -1.04 -4.46 119.36 118.09 2bnx n ILE 313 Ca -0.03 -0.11 -0.03 0.00 1.00 0.00 0.00 62.75 63.57 2bnx n ILE 313 Cb 0.77 -2.07 0.07 0.00 -0.71 0.00 0.00 39.64 37.70 2bnx n ILE 313 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 176.55 177.29 2bnx h THR 314 N -1.00 1.04 0.00 1.39 2.02 -1.01 -1.44 112.91 113.91 2bnx h THR 314 Ca -0.39 -0.25 0.00 0.00 0.77 0.00 0.00 66.41 66.54 2bnx h THR 314 Cb 1.28 0.25 0.00 0.00 -1.74 0.00 0.00 68.15 67.94 2bnx h THR 314 CO -0.24 0.13 0.00 -2.65 0.37 0.00 0.00 175.52 173.13 2bnx n PRO 315 N -4.75 0.09 -2.22 6.66 -0.02 -1.26 -4.81 135.00 128.69 2bnx n PRO 315 Ca 0.07 0.14 -0.42 0.00 -2.02 0.00 0.00 63.50 61.26 2bnx n PRO 315 Cb 0.11 -1.50 -0.03 0.00 -0.02 0.00 0.00 33.50 32.06 2bnx n PRO 315 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2bnx s ALA 316 N -2.86 3.56 0.25 3.55 0.00 -0.54 -4.92 121.76 120.80 2bnx s ALA 316 Ca 0.13 0.99 -0.02 0.00 0.00 0.00 0.00 51.96 53.06 2bnx s ALA 316 Cb 0.13 -3.54 0.32 0.00 0.00 0.00 0.00 23.12 20.02 2bnx s ALA 316 CO 0.34 -0.70 1.75 1.49 0.00 0.00 0.00 175.76 178.65 2bnx h GLU 317 N 7.18 0.81 -5.13 0.00 4.57 -1.87 -3.44 114.58 116.70 2bnx h GLU 317 Ca -0.41 -0.22 -0.62 0.00 -1.18 0.00 0.00 59.36 56.94 2bnx h GLU 317 Cb 1.20 -0.09 -0.14 0.00 -0.16 0.00 0.00 28.75 29.55 2bnx h GLU 317 CO 0.87 0.81 -0.46 -1.21 -1.18 0.00 0.00 179.01 177.85 2bnx s GLU 318 N -4.99 4.08 0.30 1.92 0.41 -1.26 -4.97 118.70 114.19 2bnx s GLU 318 Ca -0.10 -0.20 0.05 0.00 -0.41 0.00 0.00 54.97 54.32 2bnx s GLU 318 Cb 0.15 -3.55 0.78 0.00 -1.78 0.00 0.00 34.13 29.73 2bnx s GLU 318 CO 0.81 0.03 1.67 1.25 -0.49 0.00 0.00 175.26 178.54 2bnx h LEU 319 N 7.59 0.25 -0.65 1.80 5.85 -2.00 -1.68 115.31 126.47 2bnx h LEU 319 Ca -0.37 0.18 0.10 0.00 0.84 0.00 0.00 57.88 58.62 2bnx h LEU 319 Cb 1.17 0.18 -0.08 0.00 0.37 0.00 0.00 40.66 42.30 2bnx h LEU 319 CO 0.66 -0.08 0.26 0.44 -0.34 0.00 0.00 178.44 179.39 2bnx h ASP 320 N 0.32 0.28 -0.33 1.25 3.32 -1.96 -0.83 116.42 118.48 2bnx h ASP 320 Ca 0.59 0.08 -0.14 0.00 0.02 0.00 0.00 57.03 57.58 2bnx h ASP 320 Cb 1.18 0.05 -0.00 0.00 0.22 0.00 0.00 39.33 40.78 2bnx h ASP 320 CO -0.59 0.15 -0.33 0.15 -1.72 0.00 0.00 179.24 176.91 2bnx h PHE 321 N 0.45 0.96 -0.64 4.55 3.57 -1.72 -1.60 116.94 122.52 2bnx h PHE 321 Ca 0.33 -0.29 -0.07 0.00 3.53 0.00 0.00 57.97 61.47 2bnx h PHE 321 Cb 0.42 -0.20 -0.03 0.00 2.79 0.00 0.00 35.95 38.93 2bnx h PHE 321 CO -0.16 1.07 0.12 0.00 -2.23 0.00 0.00 178.31 177.11 2bnx h ARG 322 N 0.57 1.04 -0.28 1.11 3.08 -0.86 -2.22 114.38 116.83 2bnx h ARG 322 Ca 0.05 -0.27 -0.11 0.00 0.07 0.00 0.00 59.98 59.72 2bnx h ARG 322 Cb 0.91 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.82 2bnx h ARG 322 CO 0.08 0.96 -0.28 0.28 -1.07 0.00 0.00 179.97 179.94 2bnx h VAL 323 N 0.96 1.28 0.21 2.04 2.07 -1.14 -1.61 116.25 120.04 2bnx h VAL 323 Ca 0.20 -1.35 -0.01 0.00 0.82 0.00 0.00 66.70 66.35 2bnx h VAL 323 Cb 0.41 1.37 0.00 0.00 -1.52 0.00 0.00 31.29 31.55 2bnx h VAL 323 CO 0.01 0.43 -0.10 -0.74 0.02 0.00 0.00 177.57 177.19 2bnx h HIS 324 N 0.49 -0.26 -0.18 1.57 -0.00 -1.13 0.18 115.15 115.82 2bnx h HIS 324 Ca 0.06 -0.01 -0.04 0.00 -0.00 0.00 0.00 60.37 60.39 2bnx h HIS 324 Cb 0.73 0.08 -0.01 0.00 -0.00 0.00 0.00 27.41 28.22 2bnx h HIS 324 CO 0.03 -0.15 -0.03 0.82 -0.00 0.00 0.00 177.93 178.59 2bnx h ILE 325 N -0.29 1.28 -0.60 6.26 1.08 -1.32 -2.21 117.51 121.71 2bnx h ILE 325 Ca -0.03 -0.98 -0.08 0.00 -0.39 0.00 0.00 64.86 63.37 2bnx h ILE 325 Cb 0.22 1.57 -0.02 0.00 -3.07 0.00 0.00 36.82 35.52 2bnx h ILE 325 CO 0.05 0.29 0.05 -0.09 -0.69 0.00 0.00 178.15 177.76 2bnx h ARG 326 N 0.06 1.03 -0.54 2.37 2.43 -1.23 -1.03 114.38 117.46 2bnx h ARG 326 Ca 0.05 -0.30 0.01 0.00 -0.81 0.00 0.00 59.98 58.93 2bnx h ARG 326 Cb 0.46 -0.11 -0.03 0.00 -0.42 0.00 0.00 29.97 29.88 2bnx h ARG 326 CO 0.02 0.99 0.35 0.77 -1.51 0.00 0.00 179.97 180.58 2bnx h SER 327 N 0.94 0.58 -0.13 -3.80 0.02 -0.62 -0.16 113.55 110.38 2bnx h SER 327 Ca 0.18 -0.01 -0.00 0.00 -0.84 0.00 0.00 61.79 61.12 2bnx h SER 327 Cb 0.49 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 62.90 2bnx h SER 327 CO 0.02 0.41 0.07 -0.08 -1.14 0.00 0.00 176.83 176.12 2bnx h GLU 328 N 0.70 0.18 -0.58 3.45 4.81 -1.05 -0.53 114.58 121.55 2bnx h GLU 328 Ca 0.21 -0.02 0.12 0.00 -0.13 0.00 0.00 59.36 59.53 2bnx h GLU 328 Cb -0.03 -0.04 -0.09 0.00 0.63 0.00 0.00 28.75 29.22 2bnx h GLU 328 CO -0.07 0.20 0.04 -0.07 -0.73 0.00 0.00 179.01 178.38 2bnx h LEU 329 N 0.11 -0.18 -0.44 1.64 -0.00 -0.98 -1.86 115.31 113.60 2bnx h LEU 329 Ca 0.05 0.13 -0.01 0.00 -0.00 0.00 0.00 57.88 58.05 2bnx h LEU 329 Cb 0.07 0.22 -0.02 0.00 -0.00 0.00 0.00 40.66 40.93 2bnx h LEU 329 CO -0.01 -0.07 0.23 0.24 -0.00 0.00 0.00 178.44 178.83 2bnx h MET 330 N 0.16 0.62 0.00 1.13 2.86 -0.70 -1.14 114.93 117.85 2bnx h MET 330 Ca 0.30 -0.08 -0.04 0.00 -2.06 0.00 0.00 59.70 57.83 2bnx h MET 330 Cb 0.47 -0.12 -0.01 0.00 0.06 0.00 0.00 31.60 32.01 2bnx h MET 330 CO -0.46 0.51 -0.17 0.00 1.06 0.00 0.00 176.91 177.85 2bnx h ARG 331 N 0.57 0.00 0.00 1.72 3.08 -0.78 -0.00 114.38 118.97 2bnx h ARG 331 Ca 0.15 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.20 2bnx h ARG 331 Cb 0.08 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.13 2bnx h ARG 331 CO -0.02 0.17 0.00 -0.11 -1.07 0.00 0.00 179.97 178.93 2bnx n LEU 332 N -3.96 0.00 0.00 3.04 7.94 -0.73 -4.92 117.00 118.37 2bnx n LEU 332 Ca -0.02 0.14 0.00 0.00 -1.11 0.00 0.00 56.01 55.02 2bnx n LEU 332 Cb 0.25 -0.14 0.00 0.00 0.53 0.00 0.00 43.42 44.06 2bnx n LEU 332 CO 0.33 -0.01 0.00 0.61 -1.11 0.00 0.00 177.39 177.22 2bnx n GLY 333 N 1.04 0.94 0.29 -3.96 0.00 -0.02 -5.01 105.19 98.48 2bnx n GLY 333 Ca 0.18 -0.10 0.11 0.00 0.00 0.00 0.00 46.02 46.22 2bnx n GLY 333 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2bnx h LEU 334 N 0.00 0.00 0.35 0.99 6.46 -1.29 -3.12 115.31 118.71 2bnx h LEU 334 Ca 0.00 0.00 -0.02 0.00 -0.12 0.00 0.00 57.88 57.74 2bnx h LEU 334 Cb 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 39.93 2bnx h LEU 334 CO 0.00 0.00 -0.17 -0.74 -0.62 0.00 0.00 178.44 176.91 2bnx h HIS 335 N 0.00 -0.44 -0.94 1.25 2.76 -1.84 0.21 115.15 116.15 2bnx h HIS 335 Ca 0.04 -0.01 0.03 0.00 -2.20 0.00 0.00 60.37 58.23 2bnx h HIS 335 Cb 0.18 0.15 -0.05 0.00 1.55 0.00 0.00 27.41 29.23 2bnx h HIS 335 CO 0.00 -0.18 0.62 0.37 -1.30 0.00 0.00 177.93 177.44 2bnx h GLN 336 N -0.65 1.16 -0.62 5.26 5.75 -1.94 -1.31 115.11 122.76 2bnx h GLN 336 Ca -0.05 -0.07 0.02 0.00 -0.15 0.00 0.00 58.65 58.40 2bnx h GLN 336 Cb 0.46 -0.26 -0.04 0.00 1.07 0.00 0.00 27.48 28.72 2bnx h GLN 336 CO 0.08 0.77 0.39 0.28 -2.65 0.00 0.00 178.83 177.70 2bnx h VAL 337 N 1.19 1.11 -0.58 2.39 2.07 -1.41 -2.99 116.25 118.03 2bnx h VAL 337 Ca 0.37 -0.27 -0.02 0.00 0.82 0.00 0.00 66.70 67.60 2bnx h VAL 337 Cb -0.01 0.25 -0.03 0.00 -1.52 0.00 0.00 31.29 29.98 2bnx h VAL 337 CO -0.11 0.14 0.30 -0.07 0.02 0.00 0.00 177.57 177.86 2bnx h LEU 338 N 0.79 0.74 -1.55 2.57 3.38 0.50 -2.73 115.31 119.02 2bnx h LEU 338 Ca 0.24 -0.11 0.13 0.00 0.09 0.00 0.00 57.88 58.23 2bnx h LEU 338 Cb -0.03 -0.19 -0.05 0.00 0.09 0.00 0.00 40.66 40.48 2bnx h LEU 338 CO -0.08 0.64 0.48 1.56 0.09 0.00 0.00 178.44 181.13 2bnx h GLN 339 N 0.79 0.45 -0.04 1.13 1.08 -1.21 -0.96 115.11 116.35 2bnx h GLN 339 Ca 0.20 -0.03 -0.22 0.00 -1.45 0.00 0.00 58.65 57.16 2bnx h GLN 339 Cb 0.08 -0.10 0.00 0.00 -0.05 0.00 0.00 27.48 27.41 2bnx h GLN 339 CO -0.03 0.30 -0.87 0.93 -0.95 0.00 0.00 178.83 178.21 2bnx h GLU 340 N 0.47 0.49 -0.17 1.46 5.08 -1.45 -3.19 114.58 117.27 2bnx h GLU 340 Ca 0.35 -0.47 -0.05 0.00 -1.00 0.00 0.00 59.36 58.19 2bnx h GLU 340 Cb 0.71 0.12 -0.01 0.00 0.50 0.00 0.00 28.75 30.07 2bnx h GLU 340 CO -0.11 1.11 -0.12 -0.07 -1.00 0.00 0.00 179.01 178.81 2bnx h LEU 341 N 0.30 0.25 -0.54 1.33 3.38 -0.93 -2.62 115.31 116.49 2bnx h LEU 341 Ca -0.07 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.85 2bnx h LEU 341 Cb 1.50 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 42.18 2bnx h LEU 341 CO 0.16 0.41 0.00 0.54 0.09 0.00 0.00 178.44 179.63 2bnx n ARG 342 N -4.27 0.06 0.00 1.13 1.74 -0.52 -1.95 116.66 112.86 2bnx n ARG 342 Ca -0.00 0.52 0.11 0.00 -0.77 0.00 0.00 57.85 57.71 2bnx n ARG 342 Cb 0.27 -1.68 0.09 0.00 -1.02 0.00 0.00 32.46 30.12 2bnx n ARG 342 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 2bnx n GLU 343 N -1.80 0.00 -2.83 5.56 1.02 -0.99 -4.91 120.64 116.69 2bnx n GLU 343 Ca -0.00 -0.00 -0.41 0.00 -0.02 0.00 0.00 57.16 56.73 2bnx n GLU 343 Cb 0.04 -1.50 -0.04 0.00 -0.02 0.00 0.00 31.44 29.92 2bnx n GLU 343 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 2bnx s ILE 344 N -3.00 4.91 -1.28 -3.67 1.01 -0.82 -4.97 121.20 113.37 2bnx s ILE 344 Ca 0.10 1.82 -0.15 0.00 0.00 0.00 0.00 60.65 62.42 2bnx s ILE 344 Cb 0.17 -4.21 0.12 0.00 0.01 0.00 0.00 42.46 38.54 2bnx s ILE 344 CO 0.78 0.14 1.71 1.21 0.00 0.00 0.00 174.94 178.77 2bnx n GLU 345 N 4.23 3.28 -3.68 2.79 2.13 -1.26 -4.81 120.64 123.31 2bnx n GLU 345 Ca 0.04 -3.44 -0.11 0.00 0.66 0.00 0.00 57.16 54.31 2bnx n GLU 345 Cb 0.50 -3.23 -0.11 0.00 0.27 0.00 0.00 31.44 28.88 2bnx n GLU 345 CO 0.00 0.00 0.00 1.21 -0.41 0.00 0.00 177.13 177.93 2bnx s ASN 346 N 3.13 -0.26 0.13 4.31 3.84 -1.26 -5.06 114.94 119.76 2bnx s ASN 346 Ca 0.47 0.83 -0.18 0.00 0.21 0.00 0.00 52.86 54.19 2bnx s ASN 346 Cb 0.03 0.90 -0.03 0.00 -0.55 0.00 0.00 41.25 41.61 2bnx s ASN 346 CO 0.02 -0.21 1.74 -0.33 -2.79 0.00 0.00 177.10 175.53 2bnx h GLU 347 N 7.66 0.43 -0.85 0.43 4.39 -1.99 -1.24 114.58 123.41 2bnx h GLU 347 Ca -0.27 -0.05 0.01 0.00 0.34 0.00 0.00 59.36 59.39 2bnx h GLU 347 Cb 1.14 -0.09 -0.04 0.00 -0.10 0.00 0.00 28.75 29.67 2bnx h GLU 347 CO 0.22 0.36 0.56 -0.44 -1.16 0.00 0.00 179.01 178.54 2bnx h ASP 348 N 0.39 0.99 -0.47 1.42 3.32 -1.99 -0.65 116.42 119.42 2bnx h ASP 348 Ca 0.11 -0.03 -0.07 0.00 0.02 0.00 0.00 57.03 57.06 2bnx h ASP 348 Cb 0.05 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.33 2bnx h ASP 348 CO -0.02 0.72 0.03 -0.03 -1.72 0.00 0.00 179.24 178.23 2bnx h MET 349 N 1.16 0.80 -0.95 3.56 4.05 -1.88 -2.35 114.93 119.32 2bnx h MET 349 Ca 0.31 -0.24 0.01 0.00 -0.28 0.00 0.00 59.70 59.50 2bnx h MET 349 Cb -0.12 -0.08 -0.05 0.00 -0.80 0.00 0.00 31.60 30.55 2bnx h MET 349 CO -0.07 0.84 0.62 0.87 0.23 0.00 0.00 176.91 179.41 2bnx h LYS 350 N 0.66 1.26 0.04 0.39 1.57 -0.91 -1.40 116.57 118.17 2bnx h LYS 350 Ca 0.14 -0.08 0.00 0.00 -1.87 0.00 0.00 60.65 58.84 2bnx h LYS 350 Cb 0.45 -0.28 -0.01 0.00 0.08 0.00 0.00 32.23 32.48 2bnx h LYS 350 CO 0.02 0.84 -0.04 0.28 -0.57 0.00 0.00 179.45 179.98 2bnx h VAL 351 N 1.30 0.90 -0.38 0.50 2.07 -0.99 0.38 116.25 120.02 2bnx h VAL 351 Ca 0.35 0.00 -0.07 0.00 0.82 0.00 0.00 66.70 67.80 2bnx h VAL 351 Cb -0.14 0.90 -0.02 0.00 -1.52 0.00 0.00 31.29 30.51 2bnx h VAL 351 CO -0.07 0.00 -0.05 1.56 0.02 0.00 0.00 177.57 179.03 2bnx h GLN 352 N -0.09 0.63 -0.20 1.57 1.08 -0.99 -1.22 115.11 115.89 2bnx h GLN 352 Ca 0.01 -0.17 -0.03 0.00 -1.45 0.00 0.00 58.65 57.00 2bnx h GLN 352 Cb 0.10 -0.07 -0.01 0.00 -0.05 0.00 0.00 27.48 27.44 2bnx h GLN 352 CO -0.02 0.69 -0.00 -0.07 -0.95 0.00 0.00 178.83 178.48 2bnx h LEU 353 N 0.59 0.34 -1.15 1.46 3.38 -1.15 -2.25 115.31 116.54 2bnx h LEU 353 Ca 0.11 -0.31 -0.02 0.00 0.09 0.00 0.00 57.88 57.75 2bnx h LEU 353 Cb 0.45 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 41.08 2bnx h LEU 353 CO 0.02 0.57 0.29 0.00 0.09 0.00 0.00 178.44 179.41 2bnx h VAL 355 N 0.88 1.25 -0.47 0.00 2.07 -1.25 -0.21 116.25 118.52 2bnx h VAL 355 Ca 0.22 -0.80 -0.05 0.00 0.82 0.00 0.00 66.70 66.88 2bnx h VAL 355 Cb 0.11 0.49 -0.02 0.00 -1.52 0.00 0.00 31.29 30.35 2bnx h VAL 355 CO -0.03 0.32 0.08 0.15 0.02 0.00 0.00 177.57 178.11 2bnx h PHE 356 N 0.98 0.82 -0.21 1.57 3.57 -1.01 -2.71 116.94 119.94 2bnx h PHE 356 Ca 0.22 -0.11 -0.19 0.00 3.53 0.00 0.00 57.97 61.42 2bnx h PHE 356 Cb 0.24 -0.23 0.00 0.00 2.79 0.00 0.00 35.95 38.76 2bnx h PHE 356 CO 0.02 0.76 -0.62 -0.44 -2.23 0.00 0.00 178.31 175.79 2bnx h ASP 357 N 0.64 0.83 -0.52 0.41 3.32 -0.83 -1.48 116.42 118.79 2bnx h ASP 357 Ca 0.14 -0.48 -0.08 0.00 0.02 0.00 0.00 57.03 56.63 2bnx h ASP 357 Cb 0.38 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.67 2bnx h ASP 357 CO 0.01 1.25 0.00 -0.08 -1.72 0.00 0.00 179.24 178.70 2bnx h GLU 358 N 0.54 0.92 -0.46 3.56 4.81 -1.02 0.22 114.58 123.15 2bnx h GLU 358 Ca -0.01 -0.29 -0.07 0.00 -0.13 0.00 0.00 59.36 58.86 2bnx h GLU 358 Cb 1.22 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 30.50 2bnx h GLU 358 CO 0.13 0.94 0.02 0.37 -0.73 0.00 0.00 179.01 179.74 2bnx h GLN 359 N 0.79 0.81 -0.35 1.92 5.75 -1.49 -1.30 115.11 121.24 2bnx h GLN 359 Ca 0.15 -0.25 0.03 0.00 -0.15 0.00 0.00 58.65 58.43 2bnx h GLN 359 Cb 0.52 -0.08 -0.03 0.00 1.07 0.00 0.00 27.48 28.96 2bnx h GLN 359 CO 0.03 0.85 0.16 0.78 -2.65 0.00 0.00 178.83 178.00 2bnx h GLY 360 N 0.66 0.47 0.73 2.39 0.00 -1.00 -1.02 103.07 105.30 2bnx h GLY 360 Ca 0.13 -0.11 0.00 0.00 0.00 0.00 0.00 47.33 47.35 2bnx h GLY 360 CO 0.02 0.08 -0.25 -0.55 0.00 0.00 0.00 176.54 175.84 2bnx h ASP 361 N 0.34 -0.66 -0.60 0.19 3.32 -0.47 0.45 116.42 118.98 2bnx h ASP 361 Ca 0.15 0.06 0.12 0.00 0.02 0.00 0.00 57.03 57.38 2bnx h ASP 361 Cb 0.08 0.22 -0.09 0.00 0.22 0.00 0.00 39.33 39.76 2bnx h ASP 361 CO -0.12 -0.36 0.11 -0.33 -1.72 0.00 0.00 179.24 176.82 2bnx h GLU 362 N -0.54 0.23 -0.20 3.56 5.08 -1.19 -0.88 114.58 120.65 2bnx h GLU 362 Ca -0.01 -0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.33 2bnx h GLU 362 Cb 0.49 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.68 2bnx h GLU 362 CO -0.05 0.15 0.11 -0.44 -1.00 0.00 0.00 179.01 177.79 2bnx h ASP 363 N 0.24 0.24 -0.33 1.42 3.32 -0.90 0.16 116.42 120.57 2bnx h ASP 363 Ca 0.32 -0.07 0.07 0.00 0.02 0.00 0.00 57.03 57.36 2bnx h ASP 363 Cb 0.48 -0.06 -0.06 0.00 0.22 0.00 0.00 39.33 39.91 2bnx h ASP 363 CO -0.42 0.24 -0.07 0.15 -1.72 0.00 0.00 179.24 177.42 2bnx h PHE 364 N 0.22 -0.15 -0.43 4.55 3.57 -0.54 -0.39 116.94 123.76 2bnx h PHE 364 Ca 0.07 0.03 -0.06 0.00 3.53 0.00 0.00 57.97 61.54 2bnx h PHE 364 Cb 0.05 0.12 -0.02 0.00 2.79 0.00 0.00 35.95 38.89 2bnx h PHE 364 CO -0.04 -0.13 0.01 0.74 -2.23 0.00 0.00 178.31 176.65 2bnx h PHE 365 N 0.01 0.74 -0.60 0.41 0.04 -0.95 0.21 116.94 116.80 2bnx h PHE 365 Ca 0.16 -0.09 -0.07 0.00 2.80 0.00 0.00 57.97 60.77 2bnx h PHE 365 Cb 0.24 -0.21 -0.03 0.00 2.20 0.00 0.00 35.95 38.16 2bnx h PHE 365 CO -0.30 0.69 0.10 -0.44 -0.60 0.00 0.00 178.31 177.76 2bnx h ASP 366 N 0.66 0.92 0.27 2.17 3.32 -0.23 -2.16 116.42 121.37 2bnx h ASP 366 Ca 0.13 -0.20 -0.25 0.00 0.02 0.00 0.00 57.03 56.74 2bnx h ASP 366 Cb 0.40 -0.24 0.01 0.00 0.22 0.00 0.00 39.33 39.72 2bnx h ASP 366 CO 0.01 0.92 -1.03 0.25 -1.72 0.00 0.00 179.24 177.67 2bnx h LEU 367 N 0.91 0.64 -0.82 1.55 6.46 -0.87 -3.00 115.31 120.18 2bnx h LEU 367 Ca 0.19 -0.54 -0.06 0.00 -0.12 0.00 0.00 57.88 57.34 2bnx h LEU 367 Cb 0.39 -0.20 -0.03 0.00 -0.73 0.00 0.00 40.66 40.10 2bnx h LEU 367 CO 0.01 1.35 0.16 0.50 -0.62 0.00 0.00 178.44 179.84 2bnx h LYS 368 N 0.26 1.04 -0.76 1.25 3.64 -0.97 -1.21 116.57 119.83 2bnx h LYS 368 Ca -0.11 -0.24 0.20 0.00 -1.27 0.00 0.00 60.65 59.24 2bnx h LYS 368 Cb 1.68 -0.14 -0.04 0.00 -0.41 0.00 0.00 32.23 33.32 2bnx h LYS 368 CO 0.18 0.92 0.53 0.78 -2.27 0.00 0.00 179.45 179.60 2bnx h GLY 369 N 1.06 0.22 0.98 5.01 0.00 -1.31 0.63 103.07 109.66 2bnx h GLY 369 Ca 0.21 -0.05 -0.10 0.00 0.00 0.00 0.00 47.33 47.39 2bnx h GLY 369 CO 0.00 0.01 -1.26 0.54 0.00 0.00 0.00 176.54 175.82 2bnx n ARG 370 N -4.37 0.62 0.00 4.80 1.74 -0.65 -4.67 116.66 114.12 2bnx n ARG 370 Ca 0.15 0.18 0.00 0.00 -0.77 0.00 0.00 57.85 57.41 2bnx n ARG 370 Cb 0.75 -1.81 0.00 0.00 -1.02 0.00 0.00 32.46 30.38 2bnx n ARG 370 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 2bnx n LEU 371 N -2.80 0.40 -0.17 0.55 4.77 -0.55 -5.11 117.00 114.09 2bnx n LEU 371 Ca -0.06 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.92 2bnx n LEU 371 Cb 0.73 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.82 2bnx n LEU 371 CO 0.42 0.07 0.00 0.47 -1.33 0.00 0.00 177.39 177.01 2bnx n ASP 372 N -1.96 -1.21 0.00 -1.43 9.92 0.21 -5.04 116.55 117.04 2bnx n ASP 372 Ca 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.26 2bnx n ASP 372 Cb 0.46 -0.44 0.00 0.00 -0.64 0.00 0.00 41.12 40.50 2bnx n ASP 372 CO 0.00 0.00 0.00 0.80 0.13 0.00 0.00 177.20 178.13 2bnx n MET 376 N -0.79 0.00 -3.75 -1.24 1.56 -1.26 -4.93 117.12 106.71 2bnx n MET 376 Ca 0.00 0.00 -0.13 0.00 -0.27 0.00 0.00 57.70 57.30 2bnx n MET 376 Cb 0.44 0.00 -0.10 0.00 2.15 0.00 0.00 33.22 35.71 2bnx n MET 376 CO 0.00 0.00 0.00 -2.00 -0.73 0.00 0.00 175.97 173.24 2bnx s GLU 377 N 0.00 0.50 0.10 2.12 2.12 -1.26 -5.10 118.70 117.18 2bnx s GLU 377 Ca 0.00 0.27 0.17 0.00 0.36 0.00 0.00 54.97 55.77 2bnx s GLU 377 Cb 0.00 0.23 -0.10 0.00 0.26 0.00 0.00 34.13 34.52 2bnx s GLU 377 CO 0.00 -0.09 0.92 0.52 -0.54 0.00 0.00 175.26 176.07 2bnx h MET 378 N 5.01 0.00 -0.03 4.30 2.86 -2.02 -3.39 114.93 121.66 2bnx h MET 378 Ca -0.27 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.37 2bnx h MET 378 Cb 1.18 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.84 2bnx h MET 378 CO 0.32 0.30 0.00 -0.40 1.06 0.00 0.00 176.91 178.19 2bnx n ASP 379 N -2.92 2.07 -4.64 1.22 5.75 -1.26 -4.91 116.55 111.87 2bnx n ASP 379 Ca -0.07 -1.54 -0.40 0.00 -0.01 0.00 0.00 54.79 52.76 2bnx n ASP 379 Cb 0.81 -0.01 -0.06 0.00 -1.03 0.00 0.00 41.12 40.82 2bnx n ASP 379 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 2bnx s ASP 380 N -1.02 6.64 0.08 -1.12 -1.08 -1.26 -5.00 116.67 113.91 2bnx s ASP 380 Ca 0.15 0.78 -0.35 0.00 -0.52 0.00 0.00 52.55 52.61 2bnx s ASP 380 Cb 0.10 -2.35 -0.17 0.00 -1.46 0.00 0.00 42.92 39.05 2bnx s ASP 380 CO 0.15 -0.35 1.55 -0.26 0.52 0.00 0.00 175.17 176.79 2bnx h PHE 381 N 7.73 -1.40 -0.92 -5.34 0.04 -1.94 -1.22 116.94 113.89 2bnx h PHE 381 Ca -0.28 0.01 0.03 0.00 2.80 0.00 0.00 57.97 60.53 2bnx h PHE 381 Cb 1.13 0.55 -0.05 0.00 2.20 0.00 0.00 35.95 39.77 2bnx h PHE 381 CO 0.74 -0.66 0.61 0.78 -0.60 0.00 0.00 178.31 179.17 2bnx h GLY 382 N -0.99 1.33 1.00 -1.45 0.00 -1.99 -0.22 103.07 100.75 2bnx h GLY 382 Ca -0.06 -0.46 -0.08 0.00 0.00 0.00 0.00 47.33 46.73 2bnx h GLY 382 CO -0.07 0.40 -0.04 0.83 0.00 0.00 0.00 176.54 177.66 2bnx h GLU 383 N 1.17 0.84 -0.19 4.80 5.08 -1.88 -1.53 114.58 122.87 2bnx h GLU 383 Ca 0.36 -0.29 -0.03 0.00 -1.00 0.00 0.00 59.36 58.41 2bnx h GLU 383 Cb 0.00 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.18 2bnx h GLU 383 CO -0.11 0.91 0.01 0.28 -1.00 0.00 0.00 179.01 179.10 2bnx h VAL 384 N 0.68 1.25 0.17 3.13 2.07 -0.93 -2.31 116.25 120.32 2bnx h VAL 384 Ca 0.13 -0.84 0.02 0.00 0.82 0.00 0.00 66.70 66.82 2bnx h VAL 384 Cb 0.56 1.43 -0.04 0.00 -1.52 0.00 0.00 31.29 31.72 2bnx h VAL 384 CO 0.03 0.25 -0.38 0.15 0.02 0.00 0.00 177.57 177.65 2bnx h PHE 385 N 0.09 -1.04 -0.98 1.57 3.57 -1.02 -1.80 116.94 117.32 2bnx h PHE 385 Ca 0.05 0.02 0.20 0.00 3.53 0.00 0.00 57.97 61.78 2bnx h PHE 385 Cb 0.37 0.44 -0.11 0.00 2.79 0.00 0.00 35.95 39.44 2bnx h PHE 385 CO 0.03 -0.49 0.57 0.37 -2.23 0.00 0.00 178.31 176.56 2bnx h GLN 386 N -0.64 0.66 -0.41 1.11 5.75 -1.25 -0.52 115.11 119.81 2bnx h GLN 386 Ca 0.02 -0.04 -0.10 0.00 -0.15 0.00 0.00 58.65 58.38 2bnx h GLN 386 Cb 0.65 -0.15 -0.01 0.00 1.07 0.00 0.00 27.48 29.04 2bnx h GLN 386 CO -0.19 0.44 -0.13 0.82 -2.65 0.00 0.00 178.83 177.12 2bnx h ILE 387 N 0.68 1.28 0.08 2.39 2.04 -1.04 -0.30 117.51 122.65 2bnx h ILE 387 Ca 0.58 -1.24 0.02 0.00 1.00 0.00 0.00 64.86 65.21 2bnx h ILE 387 Cb 0.95 1.23 -0.03 0.00 -0.74 0.00 0.00 36.82 38.24 2bnx h ILE 387 CO -0.41 0.42 -0.19 0.40 0.00 0.00 0.00 178.15 178.37 2bnx h ILE 388 N 0.62 0.57 -0.38 -0.67 2.04 -0.62 -1.33 117.51 117.74 2bnx h ILE 388 Ca 0.10 0.00 0.05 0.00 1.00 0.00 0.00 64.86 66.00 2bnx h ILE 388 Cb 0.67 0.57 -0.08 0.00 -0.74 0.00 0.00 36.82 37.24 2bnx h ILE 388 CO 0.05 0.00 -0.53 -0.07 0.00 0.00 0.00 178.15 177.60 2bnx h LEU 389 N -0.35 -1.77 -1.51 1.44 3.38 -0.93 -0.16 115.31 115.41 2bnx h LEU 389 Ca 0.03 0.23 0.19 0.00 0.09 0.00 0.00 57.88 58.43 2bnx h LEU 389 Cb 0.38 0.72 -0.06 0.00 0.09 0.00 0.00 40.66 41.79 2bnx h LEU 389 CO -0.12 -0.39 0.58 0.78 0.09 0.00 0.00 178.44 179.39 2bnx h ASN 390 N -0.39 0.41 -0.22 -0.43 2.35 -1.03 0.45 115.58 116.73 2bnx h ASN 390 Ca 0.07 0.04 -0.17 0.00 -0.55 0.00 0.00 56.30 55.68 2bnx h ASN 390 Cb 0.57 -0.04 -0.00 0.00 0.05 0.00 0.00 38.32 38.90 2bnx h ASN 390 CO -0.56 0.17 -0.51 0.74 -1.65 0.00 0.00 177.43 175.63 2bnx h THR 391 N 0.41 1.28 0.00 2.81 2.02 0.08 -3.31 112.91 116.20 2bnx h THR 391 Ca 0.46 -1.70 0.00 0.00 0.77 0.00 0.00 66.41 65.93 2bnx h THR 391 Cb 1.12 1.60 0.00 0.00 -1.74 0.00 0.00 68.15 69.13 2bnx h THR 391 CO -0.17 0.55 -1.70 1.33 0.37 0.00 0.00 175.52 175.90 2bnx n VAL 392 N -4.01 0.10 -1.60 3.16 0.24 -0.23 -4.98 118.33 111.01 2bnx n VAL 392 Ca -0.03 -0.44 -0.52 0.00 -2.04 0.00 0.00 64.34 61.30 2bnx n VAL 392 Cb 0.60 0.06 -0.06 0.00 -1.47 0.00 0.00 33.84 32.97 2bnx n VAL 392 CO 0.00 0.00 0.00 1.17 -2.14 0.00 0.00 176.83 175.86 2bnx n LYS 393 N -2.23 1.15 -2.19 7.34 4.81 0.15 -1.62 118.16 125.57 2bnx n LYS 393 Ca -0.02 0.41 -0.18 0.00 -0.87 0.00 0.00 58.31 57.65 2bnx n LYS 393 Cb 0.54 -2.06 -0.02 0.00 0.02 0.00 0.00 35.03 33.50 2bnx n LYS 393 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 2bnx n ASP 394 N 2.71 -5.26 -4.45 3.14 8.00 -1.26 -5.01 116.55 114.43 2bnx n ASP 394 Ca 0.19 0.07 -0.23 0.00 0.71 0.00 0.00 54.79 55.53 2bnx n ASP 394 Cb 0.19 -4.33 -0.10 0.00 -0.02 0.00 0.00 41.12 36.85 2bnx n ASP 394 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 2bnx s SER 395 N -2.30 2.58 0.12 -2.24 1.04 -0.64 -5.03 113.70 107.23 2bnx s SER 395 Ca 0.00 -1.41 0.15 0.00 0.48 0.00 0.00 55.95 55.17 2bnx s SER 395 Cb 0.00 -0.05 0.67 0.00 0.10 0.00 0.00 66.02 66.74 2bnx s SER 395 CO 0.00 -0.63 1.46 0.29 0.98 0.00 0.00 173.24 175.34 2bnx n LYS 396 N -0.74 0.08 0.19 4.02 5.02 -1.26 -2.50 118.16 122.96 2bnx n LYS 396 Ca -0.03 0.42 0.07 0.00 -2.02 0.00 0.00 58.31 56.75 2bnx n LYS 396 Cb 0.67 -1.68 0.20 0.00 -0.02 0.00 0.00 35.03 34.20 2bnx n LYS 396 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2bnx h ALA 397 N 2.24 0.86 -0.30 7.82 0.00 -1.96 -3.38 119.26 124.53 2bnx h ALA 397 Ca 0.00 -0.26 -0.05 0.00 0.00 0.00 0.00 54.91 54.61 2bnx h ALA 397 Cb 0.18 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 2bnx h ALA 397 CO 0.00 0.35 0.00 1.49 0.00 0.00 0.00 179.25 181.09 2bnx h GLU 398 N 0.00 0.53 -0.77 0.00 4.81 -1.60 -1.67 114.58 115.88 2bnx h GLU 398 Ca -0.00 -0.17 0.12 0.00 -0.13 0.00 0.00 59.36 59.18 2bnx h GLU 398 Cb 1.09 -0.05 -0.09 0.00 0.63 0.00 0.00 28.75 30.33 2bnx h GLU 398 CO 0.04 0.67 0.36 -1.35 -0.73 0.00 0.00 179.01 178.00 2bnx h PRO 399 N 0.32 0.55 -0.60 0.92 0.11 -1.78 -2.13 132.00 129.38 2bnx h PRO 399 Ca 0.08 -0.03 -0.09 0.00 0.11 0.00 0.00 66.00 66.07 2bnx h PRO 399 Cb 0.43 -0.12 -0.02 0.00 0.11 0.00 0.00 31.00 31.40 2bnx h PRO 399 CO 0.02 0.36 0.03 0.45 -0.21 0.00 0.00 178.00 178.64 2bnx h HIS 400 N 0.56 1.12 -0.67 0.65 3.86 -1.72 -2.12 115.15 116.83 2bnx h HIS 400 Ca 0.41 -0.18 -0.07 0.00 -1.16 0.00 0.00 60.37 59.36 2bnx h HIS 400 Cb 0.54 -0.30 -0.03 0.00 1.06 0.00 0.00 27.41 28.68 2bnx h HIS 400 CO -0.12 0.98 0.13 0.35 0.86 0.00 0.00 177.93 180.13 2bnx h PHE 401 N 0.96 1.15 -0.22 2.45 3.57 -0.83 -1.19 116.94 122.83 2bnx h PHE 401 Ca 0.18 -0.15 -0.01 0.00 3.53 0.00 0.00 57.97 61.52 2bnx h PHE 401 Cb 0.52 -0.32 -0.01 0.00 2.79 0.00 0.00 35.95 38.92 2bnx h PHE 401 CO 0.04 0.95 0.10 1.25 -2.23 0.00 0.00 178.31 178.42 2bnx h LEU 402 N 1.03 0.30 -1.30 0.59 6.46 -1.28 -2.42 115.31 118.68 2bnx h LEU 402 Ca 0.21 -0.14 -0.04 0.00 -0.12 0.00 0.00 57.88 57.79 2bnx h LEU 402 Cb 0.41 -0.08 -0.02 0.00 -0.73 0.00 0.00 40.66 40.24 2bnx h LEU 402 CO 0.01 0.35 0.02 -1.28 -0.62 0.00 0.00 178.44 176.92 2bnx h SER 403 N 0.23 0.46 0.45 1.25 0.87 -1.29 -1.50 113.55 114.02 2bnx h SER 403 Ca 0.08 -0.07 -0.02 0.00 -1.23 0.00 0.00 61.79 60.54 2bnx h SER 403 Cb 0.14 -0.12 0.00 0.00 -0.44 0.00 0.00 62.40 61.98 2bnx h SER 403 CO -0.01 0.51 -0.22 0.40 -0.53 0.00 0.00 176.83 176.98 2bnx h ILE 404 N 0.48 0.55 -0.96 2.23 2.04 -0.96 -0.84 117.51 120.05 2bnx h ILE 404 Ca 0.11 -0.09 0.18 0.00 1.00 0.00 0.00 64.86 66.06 2bnx h ILE 404 Cb 0.27 0.60 -0.09 0.00 -0.74 0.00 0.00 36.82 36.87 2bnx h ILE 404 CO 0.01 0.02 0.61 -0.07 0.00 0.00 0.00 178.15 178.71 2bnx h LEU 405 N -0.66 0.68 -0.54 1.44 3.38 -1.13 -1.63 115.31 116.85 2bnx h LEU 405 Ca -0.06 0.07 -0.16 0.00 0.09 0.00 0.00 57.88 57.81 2bnx h LEU 405 Cb 0.49 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.17 2bnx h LEU 405 CO 0.10 0.28 -0.67 1.56 0.09 0.00 0.00 178.44 179.80 2bnx h GLN 406 N 0.68 0.27 0.00 1.13 4.20 -0.93 -2.77 115.11 117.69 2bnx h GLN 406 Ca 0.52 -0.21 -0.08 0.00 0.06 0.00 0.00 58.65 58.94 2bnx h GLN 406 Cb 0.91 0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.72 2bnx h GLN 406 CO -0.28 0.84 -0.39 0.45 -0.67 0.00 0.00 178.83 178.78 2bnx h HIS 407 N 0.19 0.00 -0.15 2.96 3.86 -0.21 -2.52 115.15 119.27 2bnx h HIS 407 Ca -0.02 0.00 -0.06 0.00 -1.16 0.00 0.00 60.37 59.13 2bnx h HIS 407 Cb 1.21 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.66 2bnx h HIS 407 CO 0.03 0.39 -0.18 -0.07 0.86 0.00 0.00 177.93 178.95 2bnx h LEU 408 N 0.00 0.24 -1.85 2.43 3.38 -1.14 -1.89 115.31 116.48 2bnx h LEU 408 Ca -0.00 -0.06 -0.02 0.00 0.09 0.00 0.00 57.88 57.88 2bnx h LEU 408 Cb 0.71 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 41.40 2bnx h LEU 408 CO 0.05 0.45 -0.10 -0.07 0.09 0.00 0.00 178.44 178.86 2bnx h LEU 409 N 0.24 0.00 -0.01 1.67 3.38 -1.35 -2.43 115.31 116.80 2bnx h LEU 409 Ca 0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.01 2bnx h LEU 409 Cb 0.47 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.22 2bnx h LEU 409 CO 0.03 0.10 0.00 -0.11 0.09 0.00 0.00 178.44 178.55 2bnx n LEU 410 N -3.45 0.29 -4.67 1.67 0.00 -0.71 -4.86 117.00 105.27 2bnx n LEU 410 Ca -0.01 0.53 -0.47 0.00 0.00 0.00 0.00 56.01 56.06 2bnx n LEU 410 Cb 0.26 -0.44 -0.04 0.00 0.00 0.00 0.00 43.42 43.19 2bnx n LEU 410 CO 0.29 -0.08 1.53 0.52 0.00 0.00 0.00 177.39 179.65 2bnx n VAL 411 N -1.78 0.62 -1.05 1.96 0.31 -0.92 -4.78 118.33 112.70 2bnx n VAL 411 Ca 0.06 -0.12 -0.41 0.00 -0.01 0.00 0.00 64.34 63.86 2bnx n VAL 411 Cb 0.36 -1.98 -0.06 0.00 -0.91 0.00 0.00 33.84 31.25 2bnx n VAL 411 CO 0.00 0.00 0.00 -1.14 -1.32 0.00 0.00 176.83 174.37 2bnx n ARG 412 N 6.92 0.00 -1.62 5.55 0.63 -1.26 -4.80 116.66 122.08 2bnx n ARG 412 Ca 0.23 0.00 -0.42 0.00 -0.92 0.00 0.00 57.85 56.73 2bnx n ARG 412 Cb 0.32 -0.95 -0.02 0.00 0.45 0.00 0.00 32.46 32.27 2bnx n ARG 412 CO 0.00 0.00 0.00 -1.71 -2.51 0.00 0.00 177.63 173.41 2bnx n ASN 413 N 1.93 3.54 -3.92 6.15 5.15 -1.26 -4.13 115.26 122.72 2bnx n ASN 413 Ca 0.17 -2.80 -0.18 0.00 -0.60 0.00 0.00 54.58 51.17 2bnx n ASN 413 Cb -0.00 -1.52 -0.15 0.00 -0.53 0.00 0.00 39.78 37.57 2bnx n ASN 413 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 2bnx s ASP 414 N 3.77 0.73 0.21 1.20 2.15 -1.26 -5.04 116.67 118.42 2bnx s ASP 414 Ca 0.50 -0.10 -0.09 0.00 0.43 0.00 0.00 52.55 53.29 2bnx s ASP 414 Cb 0.13 -0.23 0.30 0.00 -0.30 0.00 0.00 42.92 42.82 2bnx s ASP 414 CO -0.02 0.00 1.74 0.22 -0.17 0.00 0.00 175.17 176.94 2bnx h TYR 415 N 6.61 0.41 0.13 -5.34 3.20 -2.01 -1.44 116.97 118.52 2bnx h TYR 415 Ca -0.34 0.03 -0.34 0.00 3.14 0.00 0.00 58.73 61.22 2bnx h TYR 415 Cb 1.17 -0.09 -0.01 0.00 1.54 0.00 0.00 36.73 39.34 2bnx h TYR 415 CO 0.46 0.10 -1.78 0.93 -1.64 0.00 0.00 178.16 176.22 2bnx h GLU 416 N 0.42 0.27 0.04 1.82 4.39 -1.97 -3.39 114.58 116.16 2bnx h GLU 416 Ca 0.32 -0.46 -0.26 0.00 0.34 0.00 0.00 59.36 59.30 2bnx h GLU 416 Cb 0.40 0.17 0.02 0.00 -0.10 0.00 0.00 28.75 29.24 2bnx h GLU 416 CO -0.32 1.14 -1.07 0.00 -1.16 0.00 0.00 179.01 177.60 2bnx h ALA 417 N 0.29 0.18 -0.33 3.43 0.00 -1.89 -3.37 119.26 117.57 2bnx h ALA 417 Ca -0.34 -0.73 0.06 0.00 0.00 0.00 0.00 54.91 53.90 2bnx h ALA 417 Cb 2.05 0.04 -0.06 0.00 0.00 0.00 0.00 17.79 19.82 2bnx h ALA 417 CO 0.13 0.76 -0.06 -0.09 0.00 0.00 0.00 179.25 179.99 2bnx h ARG 418 N 0.28 0.03 -0.45 0.00 2.43 -1.42 -0.50 114.38 114.76 2bnx h ARG 418 Ca -0.13 -0.00 0.07 0.00 -0.81 0.00 0.00 59.98 59.11 2bnx h ARG 418 Cb 1.73 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 31.25 2bnx h ARG 418 CO 0.20 0.02 0.30 -1.35 -1.51 0.00 0.00 179.97 177.63 2bnx h PRO 419 N 0.03 0.29 -0.04 0.20 0.11 -1.78 -1.98 132.00 128.83 2bnx h PRO 419 Ca 0.16 -0.02 -0.16 0.00 0.11 0.00 0.00 66.00 66.09 2bnx h PRO 419 Cb 0.24 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 31.27 2bnx h PRO 419 CO -0.32 0.19 -0.70 1.96 -0.21 0.00 0.00 178.00 178.92 2bnx h GLN 420 N 0.30 0.19 -0.19 1.05 1.08 -1.29 0.88 115.11 117.13 2bnx h GLN 420 Ca 0.20 -0.16 -0.04 0.00 -1.45 0.00 0.00 58.65 57.20 2bnx h GLN 420 Cb 0.41 0.03 -0.01 0.00 -0.05 0.00 0.00 27.48 27.87 2bnx h GLN 420 CO -0.04 0.82 -0.05 1.88 -0.95 0.00 0.00 178.83 180.48 2bnx h TYR 421 N 0.13 0.42 -0.81 2.96 0.05 -0.73 -1.51 116.97 117.47 2bnx h TYR 421 Ca -0.02 -0.09 -0.02 0.00 0.05 0.00 0.00 58.73 58.65 2bnx h TYR 421 Cb 1.25 -0.10 -0.04 0.00 1.01 0.00 0.00 36.73 38.85 2bnx h TYR 421 CO 0.02 0.63 0.42 1.88 -1.05 0.00 0.00 178.16 180.06 2bnx h TYR 422 N 0.08 1.12 -0.08 4.88 -1.99 -1.21 -2.06 116.97 117.72 2bnx h TYR 422 Ca 0.05 -0.03 -0.00 0.00 2.00 0.00 0.00 58.73 60.74 2bnx h TYR 422 Cb 0.50 -0.36 -0.00 0.00 2.00 0.00 0.00 36.73 38.87 2bnx h TYR 422 CO 0.05 0.79 0.05 -0.22 -0.00 0.00 0.00 178.16 178.83 2bnx h LYS 423 N 1.13 0.11 -0.49 4.88 3.64 -0.72 -1.27 116.57 123.85 2bnx h LYS 423 Ca 0.28 -0.01 -0.03 0.00 -1.27 0.00 0.00 60.65 59.63 2bnx h LYS 423 Cb 0.06 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 31.83 2bnx h LYS 423 CO -0.04 0.11 0.20 1.25 -2.27 0.00 0.00 179.45 178.69 2bnx h LEU 424 N 0.08 0.68 -0.70 5.20 5.85 -1.16 -1.67 115.31 123.59 2bnx h LEU 424 Ca 0.03 -0.17 0.00 0.00 0.84 0.00 0.00 57.88 58.58 2bnx h LEU 424 Cb 0.03 -0.18 -0.03 0.00 0.37 0.00 0.00 40.66 40.85 2bnx h LEU 424 CO -0.01 0.66 0.44 0.40 -0.34 0.00 0.00 178.44 179.60 2bnx h ILE 425 N 0.65 1.19 -0.76 4.05 2.04 -1.29 -1.84 117.51 121.55 2bnx h ILE 425 Ca 0.16 -0.38 -0.04 0.00 1.00 0.00 0.00 64.86 65.60 2bnx h ILE 425 Cb 0.19 0.19 -0.03 0.00 -0.74 0.00 0.00 36.82 36.43 2bnx h ILE 425 CO -0.01 0.19 0.33 -0.08 0.00 0.00 0.00 178.15 178.57 2bnx h GLU 426 N 0.95 1.11 0.00 2.37 4.81 -0.78 0.09 114.58 123.12 2bnx h GLU 426 Ca 0.25 -0.18 -0.13 0.00 -0.13 0.00 0.00 59.36 59.18 2bnx h GLU 426 Cb -0.07 -0.19 -0.02 0.00 0.63 0.00 0.00 28.75 29.10 2bnx h GLU 426 CO -0.05 0.88 -0.60 0.93 -0.73 0.00 0.00 179.01 179.43 2bnx h GLU 427 N 1.09 0.00 -0.10 1.92 5.08 -0.99 -0.07 114.58 121.50 2bnx h GLU 427 Ca 0.26 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.54 2bnx h GLU 427 Cb 0.17 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.42 2bnx h GLU 427 CO -0.03 0.60 -0.24 0.00 -1.00 0.00 0.00 179.01 178.35 2bnx h VAL 429 N -0.11 1.10 0.23 0.00 2.07 -0.86 -1.73 116.25 116.95 2bnx h VAL 429 Ca -0.00 -0.27 -0.01 0.00 0.82 0.00 0.00 66.70 67.23 2bnx h VAL 429 Cb 0.84 0.23 0.00 0.00 -1.52 0.00 0.00 31.29 30.84 2bnx h VAL 429 CO 0.05 0.15 -0.11 0.28 0.02 0.00 0.00 177.57 177.96 2bnx h SER 430 N 0.80 -0.26 -0.50 0.57 0.02 -1.08 -2.40 113.55 110.69 2bnx h SER 430 Ca 0.25 -0.02 0.09 0.00 -0.84 0.00 0.00 61.79 61.27 2bnx h SER 430 Cb -0.01 0.07 -0.08 0.00 0.14 0.00 0.00 62.40 62.53 2bnx h SER 430 CO -0.09 -0.15 0.06 -0.61 -1.14 0.00 0.00 176.83 174.89 2bnx h GLN 431 N -0.35 0.18 -0.83 3.45 4.15 -1.26 0.30 115.11 120.74 2bnx h GLN 431 Ca -0.03 -0.01 0.09 0.00 0.77 0.00 0.00 58.65 59.47 2bnx h GLN 431 Cb 0.27 -0.04 -0.07 0.00 0.21 0.00 0.00 27.48 27.85 2bnx h GLN 431 CO 0.05 0.12 0.48 0.82 -1.93 0.00 0.00 178.83 178.37 2bnx h ILE 432 N 0.18 0.94 0.06 2.39 2.04 -1.20 0.83 117.51 122.75 2bnx h ILE 432 Ca 0.25 -0.28 -0.26 0.00 1.00 0.00 0.00 64.86 65.57 2bnx h ILE 432 Cb 0.37 0.04 0.01 0.00 -0.74 0.00 0.00 36.82 36.50 2bnx h ILE 432 CO -0.37 0.15 -1.10 0.58 0.00 0.00 0.00 178.15 177.41 2bnx h VAL 433 N 0.82 1.37 0.00 1.67 2.07 -1.09 -3.31 116.25 117.78 2bnx h VAL 433 Ca 0.39 -2.54 -0.02 0.00 0.82 0.00 0.00 66.70 65.35 2bnx h VAL 433 Cb 0.32 2.59 -0.00 0.00 -1.52 0.00 0.00 31.29 32.68 2bnx h VAL 433 CO -0.23 0.76 -0.29 -0.07 0.02 0.00 0.00 177.57 177.76 2bnx h LEU 434 N 0.23 0.00 -9.73 2.57 3.38 -0.55 -3.47 115.31 107.74 2bnx h LEU 434 Ca -0.13 0.00 -0.54 0.00 0.09 0.00 0.00 57.88 57.30 2bnx h LEU 434 Cb 1.76 0.00 0.08 0.00 0.09 0.00 0.00 40.66 42.59 2bnx h LEU 434 CO 0.20 0.07 0.83 1.57 0.09 0.00 0.00 178.44 181.20 2bnx n HIS 435 N -3.02 2.68 -3.53 1.13 -0.00 0.25 -4.64 115.22 108.09 2bnx n HIS 435 Ca 0.03 0.28 -0.23 0.00 0.46 0.00 0.00 57.72 58.25 2bnx n HIS 435 Cb 0.56 -2.57 -0.14 0.00 -0.12 0.00 0.00 29.99 27.72 2bnx n HIS 435 CO 0.00 0.00 0.00 0.15 0.46 0.00 0.00 176.34 176.95 2bnx s LYS 436 N -0.31 0.17 -1.12 1.57 -0.14 -0.60 -4.88 119.74 114.43 2bnx s LYS 436 Ca 0.66 -0.11 -0.22 0.00 -1.36 0.00 0.00 55.97 54.94 2bnx s LYS 436 Cb -0.53 -1.33 0.00 0.00 -1.68 0.00 0.00 37.83 34.29 2bnx s LYS 436 CO 0.47 -0.80 0.76 -1.71 -0.76 0.00 0.00 175.35 173.32 2bnx n ASN 437 N 5.29 -5.16 0.00 2.83 4.05 -1.26 -1.54 115.26 119.47 2bnx n ASN 437 Ca -0.06 -1.05 0.00 0.00 0.45 0.00 0.00 54.58 53.93 2bnx n ASN 437 Cb 0.47 -2.99 0.00 0.00 1.23 0.00 0.00 39.78 38.49 2bnx n ASN 437 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 2bnx n GLY 438 N -1.77 1.71 3.57 8.20 0.00 -1.26 -5.03 105.19 110.61 2bnx n GLY 438 Ca -0.10 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.58 2bnx n GLY 438 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2bnx s THR 439 N -3.51 4.02 -0.43 2.61 2.01 -0.59 -5.06 115.64 114.69 2bnx s THR 439 Ca 0.00 -0.33 -0.02 0.00 0.31 0.00 0.00 61.69 61.65 2bnx s THR 439 Cb 0.00 -2.73 0.12 0.00 0.01 0.00 0.00 72.50 69.90 2bnx s THR 439 CO 0.00 0.54 0.21 -1.81 -0.69 0.00 0.00 174.62 172.87 2bnx s ASP 440 N -0.15 5.17 0.48 3.53 1.01 -1.26 -1.56 116.67 123.90 2bnx s ASP 440 Ca 0.03 -2.17 0.23 0.00 0.71 0.00 0.00 52.55 51.36 2bnx s ASP 440 Cb -0.13 -1.80 1.24 0.00 1.01 0.00 0.00 42.92 43.24 2bnx s ASP 440 CO 0.02 -0.50 2.00 1.55 0.21 0.00 0.00 175.17 178.46 2bnx h PRO 441 N 7.84 0.00 -4.77 8.23 0.13 -1.90 -3.40 132.00 138.12 2bnx h PRO 441 Ca -0.10 0.00 -0.68 0.00 -0.87 0.00 0.00 66.00 64.34 2bnx h PRO 441 Cb 1.03 0.00 -0.28 0.00 0.13 0.00 0.00 31.00 31.88 2bnx h PRO 441 CO 0.68 0.17 -0.63 0.34 -0.23 0.00 0.00 178.00 178.33 2bnx s ASP 442 N -6.37 5.09 0.55 1.44 -1.08 -1.26 -4.73 116.67 110.31 2bnx s ASP 442 Ca -0.03 -0.88 0.28 0.00 -0.52 0.00 0.00 52.55 51.40 2bnx s ASP 442 Cb 0.13 -1.85 1.45 0.00 -1.46 0.00 0.00 42.92 41.20 2bnx s ASP 442 CO 0.62 -0.23 1.95 0.15 0.52 0.00 0.00 175.17 178.18 2bnx h PHE 443 N 8.20 0.00 0.00 -5.34 3.57 -1.88 -1.24 116.94 120.25 2bnx h PHE 443 Ca -0.29 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.21 2bnx h PHE 443 Cb 1.11 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.85 2bnx h PHE 443 CO 0.60 0.00 0.00 -0.22 -2.23 0.00 0.00 178.31 176.46 2bnx h LYS 444 N 0.00 0.00 -2.37 1.11 3.64 -1.94 -3.34 116.57 113.67 2bnx h LYS 444 Ca 0.29 0.00 -0.65 0.00 -1.27 0.00 0.00 60.65 59.02 2bnx h LYS 444 Cb 1.23 0.00 -0.39 0.00 -0.41 0.00 0.00 32.23 32.66 2bnx h LYS 444 CO -0.00 0.00 -0.29 0.00 -2.27 0.00 0.00 179.45 176.89 2bnx n ARG 446 N 0.97 0.23 0.22 0.00 1.74 -1.26 -4.46 116.66 114.10 2bnx n ARG 446 Ca 0.29 -2.16 0.06 0.00 -0.77 0.00 0.00 57.85 55.28 2bnx n ARG 446 Cb 0.39 -0.19 0.51 0.00 -1.02 0.00 0.00 32.46 32.16 2bnx n ARG 446 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 2bnx h HIS 447 N 1.17 0.00 -3.64 -1.55 3.86 -1.87 -3.42 115.15 109.70 2bnx h HIS 447 Ca -0.23 0.00 -0.63 0.00 -1.16 0.00 0.00 60.37 58.35 2bnx h HIS 447 Cb 1.80 0.00 -0.17 0.00 1.06 0.00 0.00 27.41 30.10 2bnx h HIS 447 CO 0.21 0.23 -0.54 -0.51 0.86 0.00 0.00 177.93 178.18 2bnx s LEU 448 N -8.14 3.93 -1.29 2.43 1.43 -1.26 -5.00 118.68 110.78 2bnx s LEU 448 Ca -0.03 0.02 -0.08 0.00 -1.03 0.00 0.00 54.13 53.01 2bnx s LEU 448 Cb 0.15 -2.06 0.15 0.00 0.03 0.00 0.00 46.19 44.46 2bnx s LEU 448 CO 0.68 0.03 2.04 0.00 0.23 0.00 0.00 176.35 179.33 2bnx n GLN 449 N 4.51 3.94 -3.90 1.70 6.02 -1.26 -4.92 117.38 123.46 2bnx n GLN 449 Ca -0.15 -3.51 -0.14 0.00 -0.01 0.00 0.00 57.00 53.19 2bnx n GLN 449 Cb 0.52 -2.82 -0.15 0.00 1.02 0.00 0.00 30.24 28.80 2bnx n GLN 449 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 2bnx s ILE 450 N -0.13 0.09 -1.16 5.09 1.01 -1.26 -5.07 121.20 119.76 2bnx s ILE 450 Ca 0.44 0.03 -0.21 0.00 0.00 0.00 0.00 60.65 60.91 2bnx s ILE 450 Cb 0.12 -0.13 0.00 0.00 0.01 0.00 0.00 42.46 42.46 2bnx s ILE 450 CO -0.02 0.07 1.78 -1.81 0.00 0.00 0.00 174.94 174.95 2bnx s ASP 451 N 0.44 5.99 0.17 3.58 1.01 -1.26 -4.89 116.67 121.71 2bnx s ASP 451 Ca -0.04 -1.79 -0.19 0.00 0.71 0.00 0.00 52.55 51.24 2bnx s ASP 451 Cb -0.06 -2.58 0.09 0.00 1.01 0.00 0.00 42.92 41.38 2bnx s ASP 451 CO -0.01 -2.03 1.64 0.40 0.21 0.00 0.00 175.17 175.38 2bnx h ILE 452 N 6.20 0.46 -0.58 0.77 5.03 -1.96 0.18 117.51 127.60 2bnx h ILE 452 Ca 0.29 0.00 -0.06 0.00 -0.12 0.00 0.00 64.86 64.97 2bnx h ILE 452 Cb 0.93 0.46 -0.02 0.00 -3.03 0.00 0.00 36.82 35.16 2bnx h ILE 452 CO 1.35 0.00 0.12 -0.33 -0.68 0.00 0.00 178.15 178.61 2bnx h GLU 453 N -0.11 0.94 -0.55 2.37 5.08 -1.90 0.98 114.58 121.39 2bnx h GLU 453 Ca 0.19 -0.24 0.08 0.00 -1.00 0.00 0.00 59.36 58.40 2bnx h GLU 453 Cb 0.40 -0.12 -0.07 0.00 0.50 0.00 0.00 28.75 29.47 2bnx h GLU 453 CO -0.45 0.88 0.20 -0.09 -1.00 0.00 0.00 179.01 178.54 2bnx h ARG 454 N 0.84 0.36 0.62 2.33 2.43 -1.85 0.27 114.38 119.38 2bnx h ARG 454 Ca 0.18 -0.02 -0.03 0.00 -0.81 0.00 0.00 59.98 59.30 2bnx h ARG 454 Cb 0.37 -0.08 0.01 0.00 -0.42 0.00 0.00 29.97 29.85 2bnx h ARG 454 CO 0.01 0.24 -0.30 1.25 -1.51 0.00 0.00 179.97 179.65 2bnx h LEU 455 N 0.37 -0.72 -1.03 3.80 6.46 -0.39 -1.44 115.31 122.36 2bnx h LEU 455 Ca 0.27 0.03 0.13 0.00 -0.12 0.00 0.00 57.88 58.19 2bnx h LEU 455 Cb 0.32 0.19 -0.09 0.00 -0.73 0.00 0.00 40.66 40.35 2bnx h LEU 455 CO -0.28 -0.51 0.63 0.58 -0.62 0.00 0.00 178.44 178.24 2bnx h VAL 456 N -0.83 0.88 -0.42 1.05 2.07 -0.64 0.13 116.25 118.48 2bnx h VAL 456 Ca -0.08 -0.32 -0.00 0.00 0.82 0.00 0.00 66.70 67.11 2bnx h VAL 456 Cb 0.64 -0.14 -0.02 0.00 -1.52 0.00 0.00 31.29 30.25 2bnx h VAL 456 CO 0.13 0.17 0.25 0.44 0.02 0.00 0.00 177.57 178.58 2bnx h ASP 457 N 0.94 0.50 -0.71 0.57 3.32 -0.23 0.52 116.42 121.33 2bnx h ASP 457 Ca 0.51 -0.06 0.04 0.00 0.02 0.00 0.00 57.03 57.53 2bnx h ASP 457 Cb 0.57 -0.13 -0.05 0.00 0.22 0.00 0.00 39.33 39.94 2bnx h ASP 457 CO -0.28 0.42 0.44 1.56 -1.72 0.00 0.00 179.24 179.66 2bnx h GLN 458 N 0.55 0.82 -0.52 3.56 4.20 -0.52 -0.71 115.11 122.48 2bnx h GLN 458 Ca 0.15 -0.05 -0.01 0.00 0.06 0.00 0.00 58.65 58.80 2bnx h GLN 458 Cb 0.01 -0.19 -0.02 0.00 0.30 0.00 0.00 27.48 27.58 2bnx h GLN 458 CO -0.03 0.54 0.27 0.52 -0.67 0.00 0.00 178.83 179.47 2bnx h MET 459 N 0.85 0.74 -0.24 1.46 2.86 -0.33 -2.29 114.93 117.97 2bnx h MET 459 Ca 0.29 -0.09 0.04 0.00 -2.06 0.00 0.00 59.70 57.88 2bnx h MET 459 Cb 0.06 -0.14 -0.04 0.00 0.06 0.00 0.00 31.60 31.54 2bnx h MET 459 CO -0.12 0.59 -0.01 0.82 1.06 0.00 0.00 176.91 179.25 2bnx h ILE 460 N 0.70 0.82 -1.05 -1.22 2.04 -0.64 -2.67 117.51 115.49 2bnx h ILE 460 Ca 0.18 -0.02 0.29 0.00 1.00 0.00 0.00 64.86 66.31 2bnx h ILE 460 Cb 0.07 0.75 -0.12 0.00 -0.74 0.00 0.00 36.82 36.78 2bnx h ILE 460 CO -0.03 0.01 0.63 0.44 0.00 0.00 0.00 178.15 179.21 2bnx h ASP 461 N 0.07 0.53 0.12 1.72 3.32 -1.00 -1.48 116.42 119.70 2bnx h ASP 461 Ca 0.12 0.14 -0.25 0.00 0.02 0.00 0.00 57.03 57.05 2bnx h ASP 461 Cb 0.15 0.07 0.01 0.00 0.22 0.00 0.00 39.33 39.78 2bnx h ASP 461 CO -0.20 0.00 -1.01 0.50 -1.72 0.00 0.00 179.24 176.81 2bnx h LYS 462 N 0.41 0.60 0.00 3.56 3.64 -1.07 -2.55 116.57 121.15 2bnx h LYS 462 Ca 0.68 -0.65 -0.05 0.00 -1.27 0.00 0.00 60.65 59.35 2bnx h LYS 462 Cb 1.56 0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 33.56 2bnx h LYS 462 CO -0.46 1.25 -0.26 1.15 -2.27 0.00 0.00 179.45 178.86 2bnx h THR 463 N 0.34 0.87 0.00 1.00 2.02 -1.16 -1.94 112.91 114.05 2bnx h THR 463 Ca -0.11 -1.01 -0.08 0.00 0.77 0.00 0.00 66.41 65.97 2bnx h THR 463 Cb 1.66 1.60 -0.01 0.00 -1.74 0.00 0.00 68.15 69.66 2bnx h THR 463 CO 0.19 0.26 -1.04 0.07 0.37 0.00 0.00 175.52 175.37 2bnx h LYS 464 N 0.00 0.00 -0.02 6.66 2.10 -1.24 -2.65 116.57 121.42 2bnx h LYS 464 Ca -0.00 0.00 -0.02 0.00 -2.00 0.00 0.00 60.65 58.63 2bnx h LYS 464 Cb 0.58 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.91 2bnx h LYS 464 CO 0.03 0.17 -0.06 0.28 -2.00 0.00 0.00 179.45 177.87 2bnx h VAL 465 N 0.00 1.48 -1.00 0.07 2.07 -1.40 -1.45 116.25 116.01 2bnx h VAL 465 Ca -0.07 -1.50 0.10 0.00 0.82 0.00 0.00 66.70 66.05 2bnx h VAL 465 Cb 1.28 2.44 -0.08 0.00 -1.52 0.00 0.00 31.29 33.41 2bnx h VAL 465 CO 0.03 0.40 0.64 -0.33 0.02 0.00 0.00 177.57 178.32 2bnx h GLU 466 N -0.52 1.03 -0.38 1.57 5.08 -1.45 0.25 114.58 120.16 2bnx h GLU 466 Ca -0.00 -0.06 -0.10 0.00 -1.00 0.00 0.00 59.36 58.20 2bnx h GLU 466 Cb 0.68 -0.23 -0.01 0.00 0.50 0.00 0.00 28.75 29.69 2bnx h GLU 466 CO 0.01 0.68 -0.15 0.87 -1.00 0.00 0.00 179.01 179.42 2bnx h LYS 467 N 1.06 0.77 0.00 2.33 1.57 -1.40 -1.00 116.57 119.90 2bnx h LYS 467 Ca 0.47 -0.32 -0.20 0.00 -1.87 0.00 0.00 60.65 58.73 2bnx h LYS 467 Cb 0.38 -0.03 -0.03 0.00 0.08 0.00 0.00 32.23 32.63 2bnx h LYS 467 CO -0.23 0.94 -1.11 0.66 -0.57 0.00 0.00 179.45 179.14 2bnx h SER 468 N 0.57 0.00 -0.08 0.86 4.64 -1.11 -1.84 113.55 116.59 2bnx h SER 468 Ca 0.09 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.36 2bnx h SER 468 Cb 0.69 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.78 2bnx h SER 468 CO 0.05 0.86 -0.13 -0.33 -0.87 0.00 0.00 176.83 176.41 2bnx h GLU 469 N 0.00 0.22 -0.86 4.77 5.08 -0.99 0.36 114.58 123.16 2bnx h GLU 469 Ca -0.09 -0.13 0.15 0.00 -1.00 0.00 0.00 59.36 58.29 2bnx h GLU 469 Cb 1.73 0.01 -0.10 0.00 0.50 0.00 0.00 28.75 30.90 2bnx h GLU 469 CO 0.10 0.70 0.44 0.00 -1.00 0.00 0.00 179.01 179.25 2bnx h ALA 470 N 0.52 1.30 0.00 3.43 0.00 -1.24 -1.46 119.26 121.81 2bnx h ALA 470 Ca 0.01 0.09 -0.12 0.00 0.00 0.00 0.00 54.91 54.89 2bnx h ALA 470 Cb 0.69 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.46 2bnx h ALA 470 CO 0.03 -0.11 -0.57 -0.22 0.00 0.00 0.00 179.25 178.38 2bnx h LYS 471 N 0.61 0.00 0.10 0.00 3.64 -0.82 -2.88 116.57 117.21 2bnx h LYS 471 Ca 0.47 0.00 -0.26 0.00 -1.27 0.00 0.00 60.65 59.60 2bnx h LYS 471 Cb 0.69 0.00 0.03 0.00 -0.41 0.00 0.00 32.23 32.54 2bnx h LYS 471 CO -0.38 0.57 -1.06 0.00 -2.27 0.00 0.00 179.45 176.31 2bnx h ALA 472 N 1.43 -0.00 -0.92 5.00 0.00 0.26 -3.22 119.26 121.81 2bnx h ALA 472 Ca -0.01 -0.72 0.08 0.00 0.00 0.00 0.00 54.91 54.26 2bnx h ALA 472 Cb 1.17 0.10 -0.07 0.00 0.00 0.00 0.00 17.79 18.99 2bnx h ALA 472 CO 0.07 0.58 0.58 1.15 0.00 0.00 0.00 179.25 181.63 2bnx h THR 473 N 0.12 1.02 -0.02 0.00 2.02 -1.34 -3.51 112.91 111.19 2bnx h THR 473 Ca -0.16 -0.35 0.00 0.00 0.77 0.00 0.00 66.41 66.67 2bnx h THR 473 Cb 1.76 -0.08 0.00 0.00 -1.74 0.00 0.00 68.15 68.08 2bnx h THR 473 CO 0.20 0.19 0.00 1.21 0.37 0.00 0.00 175.52 177.49