#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3bdw s ARG 114 N 0.00 3.43 0.00 0.00 1.81 -1.26 -5.13 118.95 117.81 3bdw s ARG 114 Ca 0.00 -0.64 -0.17 0.00 -1.72 0.00 0.00 55.73 53.20 3bdw s ARG 114 Cb 0.00 -2.94 0.03 0.00 -0.45 0.00 0.00 34.95 31.59 3bdw s ARG 114 CO 0.00 0.50 0.36 -3.38 -0.68 0.00 0.00 175.30 172.10 3bdw s HIS 115 N -1.80 -0.23 -0.15 -0.53 -3.43 -1.26 -5.12 115.29 102.77 3bdw s HIS 115 Ca 0.34 0.29 -0.36 0.00 -0.80 0.00 0.00 55.06 54.53 3bdw s HIS 115 Cb -0.11 0.15 -0.13 0.00 -1.43 0.00 0.00 32.58 31.07 3bdw s HIS 115 CO 0.29 -0.47 1.85 0.00 -2.00 0.00 0.00 174.74 174.41 3bdw h GLY 117 N 8.75 0.70 1.77 0.00 0.00 -2.00 -2.95 103.07 109.35 3bdw h GLY 117 Ca -0.48 -0.26 0.03 0.00 0.00 0.00 0.00 47.33 46.62 3bdw h GLY 117 CO 0.95 0.26 0.09 0.45 0.00 0.00 0.00 176.54 178.29 3bdw h HIS 118 N 0.67 0.04 -1.93 5.60 3.86 -2.06 -3.42 115.15 117.91 3bdw h HIS 118 Ca 0.18 0.00 -0.56 0.00 -1.16 0.00 0.00 60.37 58.83 3bdw h HIS 118 Cb -0.08 -0.01 -0.09 0.00 1.06 0.00 0.00 27.41 28.29 3bdw h HIS 118 CO 0.00 0.02 -0.58 0.00 0.86 0.00 0.00 177.93 178.24 3bdw s PRO 120 N -3.78 -1.56 0.50 0.00 0.02 -1.26 -4.79 135.00 124.13 3bdw s PRO 120 Ca 0.36 -0.08 0.27 0.00 0.02 0.00 0.00 61.00 61.56 3bdw s PRO 120 Cb -0.02 -1.56 1.31 0.00 0.02 0.00 0.00 34.50 34.25 3bdw s PRO 120 CO 0.21 -3.93 2.01 1.49 -0.33 0.00 0.00 177.00 176.45 3bdw h GLU 121 N -2.73 0.00 0.00 5.54 4.81 -1.97 -3.15 114.58 117.08 3bdw h GLU 121 Ca -0.44 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 58.79 3bdw h GLU 121 Cb 1.30 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.67 3bdw h GLU 121 CO 0.32 0.15 -0.23 -0.85 -0.73 0.00 0.00 179.01 177.67 3bdw n GLU 122 N -3.55 0.74 -3.51 1.92 0.00 -1.26 -4.96 120.64 110.02 3bdw n GLU 122 Ca -0.01 -1.94 -0.22 0.00 0.00 0.00 0.00 57.16 54.99 3bdw n GLU 122 Cb 0.29 -1.07 0.00 0.00 0.00 0.00 0.00 31.44 30.66 3bdw n GLU 122 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.13 175.55 3bdw s TRP 123 N -1.67 2.04 0.11 -1.84 0.52 -1.19 -4.90 118.94 112.02 3bdw s TRP 123 Ca 0.19 -0.66 0.09 0.00 0.02 0.00 0.00 56.10 55.74 3bdw s TRP 123 Cb 0.17 -2.11 -0.04 0.00 -1.15 0.00 0.00 33.47 30.34 3bdw s TRP 123 CO 0.01 -0.50 -0.22 0.96 0.02 0.00 0.00 176.95 177.21 3bdw s ILE 124 N -2.61 1.84 0.17 2.03 -4.36 -0.23 -4.92 121.20 113.13 3bdw s ILE 124 Ca 0.47 -1.59 -0.03 0.00 -0.26 0.00 0.00 60.65 59.23 3bdw s ILE 124 Cb -0.04 -1.66 -0.05 0.00 1.25 0.00 0.00 42.46 41.96 3bdw s ILE 124 CO 0.29 -0.02 0.39 0.42 0.24 0.00 0.00 174.94 176.26 3bdw s THR 125 N -1.13 5.17 0.00 8.37 -4.23 -1.26 0.04 115.64 122.60 3bdw s THR 125 Ca 0.08 -0.11 0.00 0.00 -1.18 0.00 0.00 61.69 60.49 3bdw s THR 125 Cb -0.10 -3.67 0.00 0.00 1.34 0.00 0.00 72.50 70.07 3bdw s THR 125 CO 0.05 -0.06 0.00 0.00 -0.54 0.00 0.00 174.62 174.07 3bdw n TYR 126 N -0.24 -0.18 -3.66 3.99 9.36 -1.03 -4.95 117.16 120.45 3bdw n TYR 126 Ca -0.03 0.00 -0.29 0.00 3.32 0.00 0.00 57.90 60.90 3bdw n TYR 126 Cb 0.53 0.33 -0.12 0.00 -0.63 0.00 0.00 39.34 39.45 3bdw n TYR 126 CO 0.00 0.00 0.00 0.45 0.22 0.00 0.00 176.86 177.53 3bdw s SER 127 N -2.07 3.35 -1.57 2.98 0.15 -1.26 -4.86 113.70 110.42 3bdw s SER 127 Ca 0.00 -2.95 -0.16 0.00 0.70 0.00 0.00 55.95 53.54 3bdw s SER 127 Cb 0.00 -0.99 0.13 0.00 -1.71 0.00 0.00 66.02 63.45 3bdw s SER 127 CO 0.00 -0.21 0.75 0.59 1.20 0.00 0.00 173.24 175.57 3bdw n ASN 128 N 3.09 -3.65 -3.63 5.45 3.02 -1.26 -4.92 115.26 113.36 3bdw n ASN 128 Ca 0.16 -0.82 -0.14 0.00 -0.03 0.00 0.00 54.58 53.75 3bdw n ASN 128 Cb 0.38 -2.98 -0.07 0.00 -0.61 0.00 0.00 39.78 36.50 3bdw n ASN 128 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 3bdw s SER 129 N -3.14 -0.71 0.25 6.41 1.04 -1.26 -4.87 113.70 111.42 3bdw s SER 129 Ca 0.65 1.32 -0.10 0.00 0.48 0.00 0.00 55.95 58.31 3bdw s SER 129 Cb -0.35 1.33 -0.07 0.00 0.10 0.00 0.00 66.02 67.03 3bdw s SER 129 CO 0.80 -0.27 0.57 0.00 0.98 0.00 0.00 173.24 175.33 3bdw s TYR 131 N -1.88 1.03 -0.24 0.00 1.51 0.11 -2.25 117.35 115.62 3bdw s TYR 131 Ca 0.48 -0.37 0.02 0.00 -1.01 0.00 0.00 57.07 56.19 3bdw s TYR 131 Cb -0.11 -0.61 0.05 0.00 -0.11 0.00 0.00 41.96 41.18 3bdw s TYR 131 CO 0.22 0.01 -0.13 -0.47 -1.11 0.00 0.00 175.55 174.07 3bdw s TYR 132 N -0.93 3.12 -0.58 2.71 5.04 -0.83 -1.07 117.35 124.80 3bdw s TYR 132 Ca -0.01 -2.06 -0.23 0.00 -2.44 0.00 0.00 57.07 52.33 3bdw s TYR 132 Cb -0.08 -1.94 0.05 0.00 0.35 0.00 0.00 41.96 40.34 3bdw s TYR 132 CO 0.01 -0.85 0.92 0.42 -1.34 0.00 0.00 175.55 174.71 3bdw s ILE 133 N 1.18 4.41 0.05 3.14 1.09 -1.26 -2.44 121.20 127.36 3bdw s ILE 133 Ca -0.04 0.00 -0.20 0.00 -1.10 0.00 0.00 60.65 59.32 3bdw s ILE 133 Cb -0.18 -4.56 -0.14 0.00 -1.06 0.00 0.00 42.46 36.52 3bdw s ILE 133 CO -0.07 -1.20 1.35 1.23 -0.10 0.00 0.00 174.94 176.16 3bdw h GLY 134 N 10.99 0.43 0.00 6.18 0.00 -1.95 -3.48 103.07 115.24 3bdw h GLY 134 Ca -0.27 -0.43 0.00 0.00 0.00 0.00 0.00 47.33 46.62 3bdw h GLY 134 CO 1.11 0.39 0.00 0.28 0.00 0.00 0.00 176.54 178.32 3bdw n LYS 135 N -4.53 -0.96 -4.79 4.80 5.02 -1.26 -5.00 118.16 111.43 3bdw n LYS 135 Ca -0.06 0.24 -0.33 0.00 -2.02 0.00 0.00 58.31 56.15 3bdw n LYS 135 Cb 0.37 -4.28 -0.16 0.00 -0.02 0.00 0.00 35.03 30.94 3bdw n LYS 135 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 3bdw s GLU 136 N -1.20 3.14 0.28 1.97 2.02 -1.26 -5.07 118.70 118.58 3bdw s GLU 136 Ca 0.00 -0.81 -0.29 0.00 0.02 0.00 0.00 54.97 53.89 3bdw s GLU 136 Cb 0.00 -2.48 -0.09 0.00 0.10 0.00 0.00 34.13 31.65 3bdw s GLU 136 CO 0.00 0.08 1.03 1.03 0.02 0.00 0.00 175.26 177.42 3bdw s ARG 137 N 0.62 4.67 0.15 1.61 0.52 -1.26 -3.93 118.95 121.33 3bdw s ARG 137 Ca -0.10 1.64 -0.15 0.00 -0.52 0.00 0.00 55.73 56.59 3bdw s ARG 137 Cb -0.16 -3.14 0.02 0.00 0.52 0.00 0.00 34.95 32.19 3bdw s ARG 137 CO 0.03 0.30 0.40 1.03 0.02 0.00 0.00 175.30 177.08 3bdw s ARG 138 N -1.48 1.16 0.91 3.54 1.81 0.24 -4.73 118.95 120.40 3bdw s ARG 138 Ca 0.45 -0.85 -0.12 0.00 -1.72 0.00 0.00 55.73 53.49 3bdw s ARG 138 Cb -0.28 0.46 0.14 0.00 -0.45 0.00 0.00 34.95 34.82 3bdw s ARG 138 CO 0.36 -0.46 1.09 -0.08 -0.68 0.00 0.00 175.30 175.53 3bdw s THR 139 N -3.86 2.57 0.06 0.02 -1.32 -1.26 -1.01 115.64 110.85 3bdw s THR 139 Ca 0.07 0.19 -0.26 0.00 -1.21 0.00 0.00 61.69 60.48 3bdw s THR 139 Cb 0.01 -2.67 -0.17 0.00 -1.51 0.00 0.00 72.50 68.17 3bdw s THR 139 CO -0.07 -0.24 1.58 -0.25 -2.21 0.00 0.00 174.62 173.42 3bdw h TRP 140 N -1.60 -0.29 -0.65 9.09 7.01 -1.61 0.17 115.95 128.07 3bdw h TRP 140 Ca -0.50 -0.01 -0.02 0.00 2.11 0.00 0.00 58.89 60.47 3bdw h TRP 140 Cb 1.29 0.09 -0.03 0.00 -2.10 0.00 0.00 29.16 28.41 3bdw h TRP 140 CO 0.41 -0.10 0.32 0.93 -2.79 0.00 0.00 178.44 177.21 3bdw h GLU 141 N -0.42 0.92 -0.30 2.65 5.08 -1.94 -1.11 114.58 119.46 3bdw h GLU 141 Ca -0.03 -0.11 -0.05 0.00 -1.00 0.00 0.00 59.36 58.16 3bdw h GLU 141 Cb 0.32 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 29.38 3bdw h GLU 141 CO 0.05 0.70 -0.04 0.93 -1.00 0.00 0.00 179.01 179.66 3bdw h GLU 142 N 0.92 0.48 0.04 2.33 5.08 -1.83 -1.09 114.58 120.50 3bdw h GLU 142 Ca 0.23 -0.11 -0.00 0.00 -1.00 0.00 0.00 59.36 58.48 3bdw h GLU 142 Cb 0.08 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.27 3bdw h GLU 142 CO -0.03 0.54 -0.02 0.77 -1.00 0.00 0.00 179.01 179.27 3bdw h SER 143 N 0.46 -0.04 -0.34 1.42 0.02 -0.02 -0.64 113.55 114.41 3bdw h SER 143 Ca 0.10 -0.46 0.07 0.00 -0.84 0.00 0.00 61.79 60.66 3bdw h SER 143 Cb 0.36 0.01 -0.08 0.00 0.14 0.00 0.00 62.40 62.82 3bdw h SER 143 CO 0.01 0.45 -0.37 0.25 -1.14 0.00 0.00 176.83 176.03 3bdw h LEU 144 N -0.54 -1.22 -1.05 5.07 5.85 -1.06 0.99 115.31 123.34 3bdw h LEU 144 Ca -0.00 0.19 -0.07 0.00 0.84 0.00 0.00 57.88 58.83 3bdw h LEU 144 Cb 0.49 0.54 -0.02 0.00 0.37 0.00 0.00 40.66 42.05 3bdw h LEU 144 CO 0.01 -0.36 -0.11 -0.07 -0.34 0.00 0.00 178.44 177.57 3bdw h LEU 145 N -0.33 0.53 -0.09 2.25 3.38 -1.26 -1.76 115.31 118.02 3bdw h LEU 145 Ca 0.14 -0.14 0.01 0.00 0.09 0.00 0.00 57.88 57.98 3bdw h LEU 145 Cb 0.57 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.17 3bdw h LEU 145 CO -0.51 0.68 0.04 0.00 0.09 0.00 0.00 178.44 178.73 3bdw h ALA 146 N 1.38 0.10 -0.25 1.53 0.00 -0.27 -1.35 119.26 120.40 3bdw h ALA 146 Ca 0.09 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 3bdw h ALA 146 Cb 0.50 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 3bdw h ALA 146 CO 0.03 -0.42 0.09 0.00 0.00 0.00 0.00 179.25 178.95 3bdw h THR 148 N 0.25 1.17 -0.88 0.00 2.02 -1.07 0.41 112.91 114.81 3bdw h THR 148 Ca 0.08 -0.34 0.06 0.00 0.77 0.00 0.00 66.41 66.98 3bdw h THR 148 Cb 0.20 0.11 -0.06 0.00 -1.74 0.00 0.00 68.15 66.65 3bdw h THR 148 CO -0.01 0.18 0.55 -1.28 0.37 0.00 0.00 175.52 175.34 3bdw h SER 149 N 0.98 0.89 0.00 4.18 0.87 -1.17 -1.18 113.55 118.12 3bdw h SER 149 Ca 0.28 0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.85 3bdw h SER 149 Cb -0.07 -0.18 0.00 0.00 -0.44 0.00 0.00 62.40 61.71 3bdw h SER 149 CO -0.07 0.57 0.00 0.29 -0.53 0.00 0.00 176.83 177.10 3bdw n LYS 150 N -4.59 0.85 -3.46 2.24 5.02 0.10 -4.85 118.16 113.48 3bdw n LYS 150 Ca 0.12 0.00 -0.21 0.00 -2.02 0.00 0.00 58.31 56.21 3bdw n LYS 150 Cb 0.16 -1.28 0.07 0.00 -0.02 0.00 0.00 35.03 33.96 3bdw n LYS 150 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 3bdw n ASN 151 N -0.12 -5.76 0.00 4.39 3.02 -0.44 -4.98 115.26 111.37 3bdw n ASN 151 Ca 0.00 -0.48 0.00 0.00 -0.03 0.00 0.00 54.58 54.07 3bdw n ASN 151 Cb 0.14 -4.49 0.00 0.00 -0.61 0.00 0.00 39.78 34.82 3bdw n ASN 151 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 3bdw n SER 152 N -2.48 0.00 -4.22 6.41 3.41 -1.01 -5.03 113.62 110.70 3bdw n SER 152 Ca 0.00 0.00 -0.21 0.00 -0.26 0.00 0.00 58.87 58.40 3bdw n SER 152 Cb 0.56 0.00 -0.12 0.00 -0.26 0.00 0.00 64.21 64.38 3bdw n SER 152 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 3bdw s SER 153 N 1.84 2.04 0.76 4.04 0.01 -1.19 -2.61 113.70 118.58 3bdw s SER 153 Ca 0.00 -0.63 -0.16 0.00 1.31 0.00 0.00 55.95 56.46 3bdw s SER 153 Cb 0.00 -0.09 -0.06 0.00 0.21 0.00 0.00 66.02 66.08 3bdw s SER 153 CO 0.00 -0.01 0.27 -0.11 0.41 0.00 0.00 173.24 173.80 3bdw n LEU 154 N 1.24 -0.67 -4.67 2.44 7.94 -1.26 -0.40 117.00 121.62 3bdw n LEU 154 Ca -0.20 0.52 -0.48 0.00 -1.11 0.00 0.00 56.01 54.73 3bdw n LEU 154 Cb 0.54 -1.12 -0.05 0.00 0.53 0.00 0.00 43.42 43.33 3bdw n LEU 154 CO 0.22 -3.73 1.30 -0.11 -1.11 0.00 0.00 177.39 173.96 3bdw n LEU 155 N 0.38 3.05 -4.74 -1.96 7.94 0.19 -4.42 117.00 117.44 3bdw n LEU 155 Ca 0.08 1.04 -0.26 0.00 -1.11 0.00 0.00 56.01 55.76 3bdw n LEU 155 Cb 0.51 -1.36 -0.06 0.00 0.53 0.00 0.00 43.42 43.03 3bdw n LEU 155 CO 0.51 -0.27 -0.26 -0.94 -1.11 0.00 0.00 177.39 175.32 3bdw s SER 156 N 2.37 5.21 -0.11 1.96 1.04 -1.26 -0.03 113.70 122.87 3bdw s SER 156 Ca 0.86 -0.25 0.03 0.00 0.48 0.00 0.00 55.95 57.07 3bdw s SER 156 Cb -0.74 -1.26 0.01 0.00 0.10 0.00 0.00 66.02 64.12 3bdw s SER 156 CO 0.46 0.07 -0.21 -0.63 0.98 0.00 0.00 173.24 173.91 3bdw s ILE 157 N -1.78 1.92 -0.21 -1.02 -1.09 -1.26 -5.00 121.20 112.76 3bdw s ILE 157 Ca 0.30 -0.91 -0.14 0.00 -2.23 0.00 0.00 60.65 57.66 3bdw s ILE 157 Cb -0.10 -1.69 -0.08 0.00 -1.58 0.00 0.00 42.46 39.01 3bdw s ILE 157 CO 0.22 0.53 -0.32 0.47 -1.23 0.00 0.00 174.94 174.60 3bdw n ASP 158 N 3.85 1.80 -4.83 3.58 10.43 -1.26 -5.05 116.55 125.06 3bdw n ASP 158 Ca -0.20 0.31 -0.27 0.00 2.57 0.00 0.00 54.79 57.20 3bdw n ASP 158 Cb 0.52 -0.72 -0.04 0.00 1.84 0.00 0.00 41.12 42.72 3bdw n ASP 158 CO 0.00 0.00 0.00 0.21 -1.07 0.00 0.00 177.20 176.34 3bdw s ASN 159 N -6.68 4.48 0.28 -2.24 3.04 -1.26 -5.03 114.94 107.52 3bdw s ASN 159 Ca -0.31 -1.29 0.15 0.00 0.04 0.00 0.00 52.86 51.45 3bdw s ASN 159 Cb 0.09 0.21 0.06 0.00 -1.54 0.00 0.00 41.25 40.07 3bdw s ASN 159 CO 0.42 -0.91 1.44 -0.33 -3.04 0.00 0.00 177.10 174.68 3bdw h GLU 160 N 1.05 0.00 0.06 0.43 4.39 -2.00 -3.32 114.58 115.18 3bdw h GLU 160 Ca -0.40 0.00 -0.22 0.00 0.34 0.00 0.00 59.36 59.08 3bdw h GLU 160 Cb 1.29 0.00 0.02 0.00 -0.10 0.00 0.00 28.75 29.96 3bdw h GLU 160 CO 0.64 0.51 -0.90 1.49 -1.16 0.00 0.00 179.01 179.59 3bdw h GLU 161 N 0.00 0.51 -0.67 2.33 4.81 -2.00 -2.52 114.58 117.05 3bdw h GLU 161 Ca -0.01 -0.62 0.14 0.00 -0.13 0.00 0.00 59.36 58.74 3bdw h GLU 161 Cb 1.39 0.20 -0.10 0.00 0.63 0.00 0.00 28.75 30.87 3bdw h GLU 161 CO 0.07 1.25 0.13 1.49 -0.73 0.00 0.00 179.01 181.21 3bdw h GLU 162 N 0.05 0.23 -0.33 1.92 4.81 -1.98 -1.69 114.58 117.60 3bdw h GLU 162 Ca -0.13 -0.01 0.06 0.00 -0.13 0.00 0.00 59.36 59.15 3bdw h GLU 162 Cb 1.61 -0.05 -0.06 0.00 0.63 0.00 0.00 28.75 30.88 3bdw h GLU 162 CO 0.17 0.15 -0.05 1.98 -0.73 0.00 0.00 179.01 180.54 3bdw h MET 163 N 0.24 0.04 -0.72 1.92 4.05 -1.62 0.16 114.93 118.99 3bdw h MET 163 Ca 0.36 -0.00 -0.01 0.00 -0.28 0.00 0.00 59.70 59.77 3bdw h MET 163 Cb 0.59 -0.01 -0.03 0.00 -0.80 0.00 0.00 31.60 31.35 3bdw h MET 163 CO -0.48 0.02 0.41 -0.22 0.23 0.00 0.00 176.91 176.88 3bdw h LYS 164 N 0.04 0.99 -0.07 0.39 1.63 -0.98 -0.88 116.57 117.69 3bdw h LYS 164 Ca 0.16 -0.10 -0.00 0.00 -0.85 0.00 0.00 60.65 59.85 3bdw h LYS 164 Cb 0.23 -0.20 -0.00 0.00 -0.60 0.00 0.00 32.23 31.66 3bdw h LYS 164 CO -0.31 0.72 0.04 0.35 -3.45 0.00 0.00 179.45 176.81 3bdw h PHE 165 N 0.99 0.09 0.00 1.91 3.57 -0.59 -2.68 116.94 120.23 3bdw h PHE 165 Ca 0.26 0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.75 3bdw h PHE 165 Cb 0.01 -0.03 -0.00 0.00 2.79 0.00 0.00 35.95 38.71 3bdw h PHE 165 CO -0.01 0.09 -0.02 1.25 -2.23 0.00 0.00 178.31 177.39 3bdw h LEU 166 N 0.07 0.00 -0.07 0.59 5.85 -0.26 -1.64 115.31 119.85 3bdw h LEU 166 Ca 0.03 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.75 3bdw h LEU 166 Cb 0.02 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.05 3bdw h LEU 166 CO -0.01 0.02 0.00 -1.54 -0.34 0.00 0.00 178.44 176.58 3bdw n SER 167 N -3.50 0.65 0.07 1.25 3.41 -0.38 -1.95 113.62 113.17 3bdw n SER 167 Ca -0.03 0.57 -0.14 0.00 -0.26 0.00 0.00 58.87 59.02 3bdw n SER 167 Cb 0.12 -0.74 -0.14 0.00 -0.26 0.00 0.00 64.21 63.19 3bdw n SER 167 CO 0.00 0.00 0.00 0.40 -0.16 0.00 0.00 175.04 175.28 3bdw h ILE 168 N 0.00 1.34 0.00 -1.33 2.04 -1.27 -3.39 117.51 114.90 3bdw h ILE 168 Ca 0.00 -2.99 -0.24 0.00 1.00 0.00 0.00 64.86 62.63 3bdw h ILE 168 Cb 0.65 2.80 -0.04 0.00 -0.74 0.00 0.00 36.82 39.49 3bdw h ILE 168 CO 0.00 0.84 -1.54 0.40 0.00 0.00 0.00 178.15 177.86 3bdw h ILE 169 N 0.05 0.78 -1.85 -0.67 1.08 -1.52 -3.47 117.51 111.91 3bdw h ILE 169 Ca -0.17 -2.50 0.05 0.00 -0.39 0.00 0.00 64.86 61.85 3bdw h ILE 169 Cb 1.95 2.32 -0.23 0.00 -3.07 0.00 0.00 36.82 37.79 3bdw h ILE 169 CO 0.16 0.45 0.14 -0.44 -0.69 0.00 0.00 178.15 177.77 3bdw s SER 170 N -6.03 -0.80 0.10 1.72 0.01 -0.83 -5.08 113.70 102.79 3bdw s SER 170 Ca -0.03 1.29 -0.15 0.00 1.31 0.00 0.00 55.95 58.37 3bdw s SER 170 Cb 0.08 1.33 -0.07 0.00 0.21 0.00 0.00 66.02 67.57 3bdw s SER 170 CO 0.82 -0.20 1.45 1.55 0.41 0.00 0.00 173.24 177.27 3bdw h PRO 171 N 6.60 0.70 -5.35 12.44 0.13 -1.82 -3.39 132.00 141.31 3bdw h PRO 171 Ca -0.29 -0.34 -0.50 0.00 -0.87 0.00 0.00 66.00 64.00 3bdw h PRO 171 Cb 1.22 -0.01 -0.29 0.00 0.13 0.00 0.00 31.00 32.05 3bdw h PRO 171 CO 0.17 0.94 -0.82 -1.54 -0.23 0.00 0.00 178.00 176.52 3bdw s SER 172 N -6.47 1.76 -0.16 1.44 1.04 -1.26 0.25 113.70 110.31 3bdw s SER 172 Ca -0.12 -0.27 -0.28 0.00 0.48 0.00 0.00 55.95 55.75 3bdw s SER 172 Cb 0.09 -0.23 0.07 0.00 0.10 0.00 0.00 66.02 66.05 3bdw s SER 172 CO 0.82 0.18 0.70 -0.55 0.98 0.00 0.00 173.24 175.37 3bdw s SER 173 N -0.30 -0.71 0.48 7.02 0.15 0.10 -4.59 113.70 115.86 3bdw s SER 173 Ca 0.05 1.09 -0.24 0.00 0.70 0.00 0.00 55.95 57.55 3bdw s SER 173 Cb -0.06 1.02 -0.07 0.00 -1.71 0.00 0.00 66.02 65.19 3bdw s SER 173 CO -0.00 -0.43 1.37 0.26 1.20 0.00 0.00 173.24 175.64 3bdw s TRP 174 N -0.39 2.45 0.23 3.44 0.23 -0.94 0.13 118.94 124.09 3bdw s TRP 174 Ca -0.05 1.34 0.11 0.00 -2.03 0.00 0.00 56.10 55.46 3bdw s TRP 174 Cb -0.03 -3.82 -0.05 0.00 0.03 0.00 0.00 33.47 29.61 3bdw s TRP 174 CO 0.05 -2.75 -0.20 0.96 0.96 0.00 0.00 176.95 175.97 3bdw s ILE 175 N -1.27 2.25 -1.07 2.03 -4.36 -0.99 -4.33 121.20 113.46 3bdw s ILE 175 Ca 0.65 -2.21 -0.15 0.00 -0.26 0.00 0.00 60.65 58.68 3bdw s ILE 175 Cb -0.41 -2.15 -0.08 0.00 1.25 0.00 0.00 42.46 41.07 3bdw s ILE 175 CO 0.51 -0.33 2.15 0.61 0.24 0.00 0.00 174.94 178.12 3bdw n GLY 176 N -0.21 3.35 2.95 6.27 0.00 0.96 -4.52 105.19 113.99 3bdw n GLY 176 Ca -0.09 -1.30 -0.13 0.00 0.00 0.00 0.00 46.02 44.51 3bdw n GLY 176 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3bdw s VAL 177 N 3.91 -0.01 0.26 1.61 1.01 -1.26 -2.82 120.40 123.10 3bdw s VAL 177 Ca 0.52 0.04 -0.19 0.00 0.00 0.00 0.00 61.98 62.35 3bdw s VAL 177 Cb 0.14 -0.16 0.02 0.00 0.00 0.00 0.00 36.38 36.38 3bdw s VAL 177 CO 0.01 0.02 0.65 0.72 0.00 0.00 0.00 175.10 176.50 3bdw s PHE 178 N 0.28 -0.11 0.06 5.22 -0.71 0.12 -1.97 117.98 120.88 3bdw s PHE 178 Ca -0.02 -0.30 0.05 0.00 -1.04 0.00 0.00 56.93 55.63 3bdw s PHE 178 Cb -0.03 0.58 -0.03 0.00 -1.21 0.00 0.00 43.02 42.33 3bdw s PHE 178 CO -0.01 -1.13 -0.15 1.03 -1.34 0.00 0.00 175.22 173.62 3bdw s ARG 179 N -3.92 0.89 0.15 1.99 0.52 0.12 -1.10 118.95 117.61 3bdw s ARG 179 Ca 0.12 -0.92 -0.07 0.00 -0.52 0.00 0.00 55.73 54.34 3bdw s ARG 179 Cb -0.04 -0.93 -0.00 0.00 0.52 0.00 0.00 34.95 34.50 3bdw s ARG 179 CO 0.05 0.22 1.43 -0.91 0.02 0.00 0.00 175.30 176.11 3bdw h ASN 180 N 4.46 0.78 -5.12 0.23 2.35 -1.89 -3.44 115.58 112.94 3bdw h ASN 180 Ca -0.41 -0.44 -0.02 0.00 -0.55 0.00 0.00 56.30 54.89 3bdw h ASN 180 Cb 1.19 -0.23 -0.06 0.00 0.05 0.00 0.00 38.32 39.28 3bdw h ASN 180 CO 0.41 1.20 0.09 -0.94 -1.65 0.00 0.00 177.43 176.54 3bdw s SER 181 N -6.97 -0.05 0.41 5.81 1.04 -1.26 -5.06 113.70 107.62 3bdw s SER 181 Ca -0.09 -0.89 0.26 0.00 0.48 0.00 0.00 55.95 55.71 3bdw s SER 181 Cb 0.10 0.70 1.38 0.00 0.10 0.00 0.00 66.02 68.31 3bdw s SER 181 CO 0.87 -1.35 1.61 0.28 0.98 0.00 0.00 173.24 175.63 3bdw h SER 182 N 2.09 0.29 -2.12 7.02 0.02 -1.93 -2.91 113.55 116.00 3bdw h SER 182 Ca -0.25 0.18 -0.48 0.00 -0.84 0.00 0.00 61.79 60.40 3bdw h SER 182 Cb 1.25 0.17 -0.34 0.00 0.14 0.00 0.00 62.40 63.62 3bdw h SER 182 CO 0.32 -0.26 -0.83 -2.28 -1.14 0.00 0.00 176.83 172.63 3bdw s HIS 183 N -5.39 0.37 0.29 3.45 5.65 -1.26 -5.00 115.29 113.40 3bdw s HIS 183 Ca -0.08 -1.68 0.10 0.00 0.25 0.00 0.00 55.06 53.65 3bdw s HIS 183 Cb 0.31 -0.64 -0.05 0.00 -1.18 0.00 0.00 32.58 31.03 3bdw s HIS 183 CO 0.81 -0.92 -0.04 -1.01 -0.65 0.00 0.00 174.74 172.93 3bdw s HIS 184 N 0.60 2.57 0.82 3.88 4.02 -1.10 -5.12 115.29 120.95 3bdw s HIS 184 Ca 0.27 -0.31 -0.10 0.00 1.02 0.00 0.00 55.06 55.94 3bdw s HIS 184 Cb -0.05 -1.24 0.09 0.00 -1.02 0.00 0.00 32.58 30.35 3bdw s HIS 184 CO -0.11 0.59 1.11 -1.25 1.02 0.00 0.00 174.74 176.10 3bdw s PRO 185 N -3.66 1.85 0.17 8.40 0.04 -1.26 -4.86 135.00 135.68 3bdw s PRO 185 Ca 0.32 1.30 -0.31 0.00 0.04 0.00 0.00 61.00 62.35 3bdw s PRO 185 Cb -0.04 -1.84 -0.09 0.00 0.04 0.00 0.00 34.50 32.57 3bdw s PRO 185 CO 0.19 -1.97 1.40 -1.58 0.04 0.00 0.00 177.00 175.07 3bdw s TRP 186 N -2.82 3.19 0.02 0.56 0.52 -1.26 -4.72 118.94 114.43 3bdw s TRP 186 Ca 0.63 1.00 0.08 0.00 0.02 0.00 0.00 56.10 57.83 3bdw s TRP 186 Cb -0.19 -3.71 -0.02 0.00 -1.15 0.00 0.00 33.47 28.39 3bdw s TRP 186 CO 0.57 -2.41 -0.24 0.08 0.02 0.00 0.00 176.95 174.97 3bdw s VAL 187 N 0.62 1.89 0.78 4.03 1.01 -0.26 -1.83 120.40 126.64 3bdw s VAL 187 Ca 0.62 -1.18 -0.07 0.00 0.00 0.00 0.00 61.98 61.35 3bdw s VAL 187 Cb -0.38 -1.60 0.13 0.00 0.00 0.00 0.00 36.38 34.52 3bdw s VAL 187 CO 0.35 0.38 1.09 0.42 0.00 0.00 0.00 175.10 177.35 3bdw s THR 188 N -0.70 2.15 -1.15 3.92 -4.23 0.09 -0.70 115.64 115.02 3bdw s THR 188 Ca 0.09 -0.32 0.28 0.00 -1.18 0.00 0.00 61.69 60.56 3bdw s THR 188 Cb -0.09 -2.83 0.21 0.00 1.34 0.00 0.00 72.50 71.13 3bdw s THR 188 CO 0.01 0.00 1.75 0.23 -0.54 0.00 0.00 174.62 176.06 3bdw n MET 189 N -3.12 0.16 -0.00 3.99 2.81 -1.13 -2.84 117.12 116.99 3bdw n MET 189 Ca 0.13 -0.05 0.15 0.00 -1.81 0.00 0.00 57.70 56.11 3bdw n MET 189 Cb 0.60 -1.50 0.74 0.00 -0.71 0.00 0.00 33.22 32.35 3bdw n MET 189 CO 0.00 0.00 0.00 0.09 1.51 0.00 0.00 175.97 177.57 3bdw n ASN 190 N -1.37 0.66 -0.11 7.83 3.02 -1.26 -4.95 115.26 119.08 3bdw n ASN 190 Ca 0.08 -1.25 0.00 0.00 -0.03 0.00 0.00 54.58 53.38 3bdw n ASN 190 Cb 0.32 -0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.49 3bdw n ASN 190 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3bdw n GLY 191 N 1.06 0.53 3.47 7.41 0.00 -1.13 -5.07 105.19 111.47 3bdw n GLY 191 Ca 0.21 -0.82 -0.23 0.00 0.00 0.00 0.00 46.02 45.18 3bdw n GLY 191 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3bdw s LEU 192 N -0.22 2.61 -0.01 0.99 1.43 -1.26 -4.92 118.68 117.29 3bdw s LEU 192 Ca 0.00 -1.14 -0.30 0.00 -1.03 0.00 0.00 54.13 51.66 3bdw s LEU 192 Cb 0.00 -0.88 -0.03 0.00 0.03 0.00 0.00 46.19 45.31 3bdw s LEU 192 CO 0.00 -0.18 1.08 0.00 0.23 0.00 0.00 176.35 177.48 3bdw s ALA 193 N -2.75 3.32 -0.47 4.21 0.00 -1.26 -0.73 121.76 124.08 3bdw s ALA 193 Ca 0.30 0.60 -0.29 0.00 0.00 0.00 0.00 51.96 52.57 3bdw s ALA 193 Cb 0.01 -3.41 0.03 0.00 0.00 0.00 0.00 23.12 19.74 3bdw s ALA 193 CO 0.14 -0.44 1.15 0.12 0.00 0.00 0.00 175.76 176.73 3bdw s PHE 194 N 1.40 2.81 -2.19 0.00 2.19 -0.76 -4.89 117.98 116.55 3bdw s PHE 194 Ca 0.54 0.74 0.30 0.00 0.33 0.00 0.00 56.93 58.83 3bdw s PHE 194 Cb -0.23 -4.39 1.38 0.00 -1.31 0.00 0.00 43.02 38.46 3bdw s PHE 194 CO 0.25 -1.29 1.93 1.63 1.83 0.00 0.00 175.22 179.58 3bdw n LYS 195 N 7.81 1.27 -3.58 10.12 5.02 -1.26 -4.77 118.16 132.77 3bdw n LYS 195 Ca 0.12 -0.51 -0.38 0.00 -2.02 0.00 0.00 58.31 55.53 3bdw n LYS 195 Cb 0.49 -1.49 -0.06 0.00 -0.02 0.00 0.00 35.03 33.95 3bdw n LYS 195 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 3bdw s HIS 196 N -2.07 3.66 0.34 2.13 3.76 -1.26 -5.06 115.29 116.78 3bdw s HIS 196 Ca 0.40 0.84 -0.28 0.00 -0.15 0.00 0.00 55.06 55.87 3bdw s HIS 196 Cb 0.21 -2.23 -0.10 0.00 1.11 0.00 0.00 32.58 31.58 3bdw s HIS 196 CO 0.37 0.59 1.22 -1.21 -0.85 0.00 0.00 174.74 174.86 3bdw s GLU 197 N -0.80 4.34 -0.05 1.40 2.02 -1.26 -5.03 118.70 119.32 3bdw s GLU 197 Ca 0.21 2.01 0.04 0.00 0.02 0.00 0.00 54.97 57.25 3bdw s GLU 197 Cb -0.15 -2.99 -0.00 0.00 0.10 0.00 0.00 34.13 31.09 3bdw s GLU 197 CO 0.10 -0.13 -0.16 -1.50 0.02 0.00 0.00 175.26 173.59 3bdw s ILE 198 N -1.22 1.32 1.18 -1.63 -1.16 -1.26 -4.63 121.20 113.81 3bdw s ILE 198 Ca 0.50 -0.65 -0.20 0.00 -0.51 0.00 0.00 60.65 59.80 3bdw s ILE 198 Cb -0.35 -1.15 0.29 0.00 0.61 0.00 0.00 42.46 41.86 3bdw s ILE 198 CO 0.46 0.39 1.07 0.29 -2.81 0.00 0.00 174.94 174.33 3bdw n LYS 199 N 3.26 -3.01 0.00 3.50 5.02 0.75 -4.85 118.16 122.84 3bdw n LYS 199 Ca -0.19 -1.71 0.00 0.00 -2.02 0.00 0.00 58.31 54.40 3bdw n LYS 199 Cb 0.53 -1.58 0.00 0.00 -0.02 0.00 0.00 35.03 33.96 3bdw n LYS 199 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3bdw n ALA 204 N -4.77 0.00 -2.27 7.82 0.00 -1.26 -4.60 120.51 115.43 3bdw n ALA 204 Ca -0.20 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.02 3bdw n ALA 204 Cb 0.57 0.14 0.02 0.00 0.00 0.00 0.00 19.45 20.17 3bdw n ALA 204 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 3bdw n GLU 205 N -0.95 3.29 -3.59 0.00 2.13 -1.26 -4.97 120.64 115.29 3bdw n GLU 205 Ca 0.00 -4.19 -0.40 0.00 0.66 0.00 0.00 57.16 53.23 3bdw n GLU 205 Cb 0.00 -2.17 -0.11 0.00 0.27 0.00 0.00 31.44 29.43 3bdw n GLU 205 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 3bdw s LEU 206 N -3.57 4.58 0.00 4.31 1.43 -1.26 -4.60 118.68 119.56 3bdw s LEU 206 Ca 0.47 -0.82 0.00 0.00 -1.03 0.00 0.00 54.13 52.75 3bdw s LEU 206 Cb 0.40 -2.04 0.00 0.00 0.03 0.00 0.00 46.19 44.58 3bdw s LEU 206 CO -0.04 -0.33 0.90 0.59 0.23 0.00 0.00 176.35 177.69 3bdw n ASN 207 N 5.02 1.64 -4.09 2.29 3.02 -1.21 -4.73 115.26 117.19 3bdw n ASN 207 Ca -0.12 -1.80 -0.18 0.00 -0.03 0.00 0.00 54.58 52.45 3bdw n ASN 207 Cb 0.47 0.00 -0.13 0.00 -0.61 0.00 0.00 39.78 39.51 3bdw n ASN 207 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3bdw s ALA 209 N -0.84 3.81 -0.01 0.00 0.00 -0.83 -0.95 121.76 122.94 3bdw s ALA 209 Ca -0.01 -0.56 0.01 0.00 0.00 0.00 0.00 51.96 51.39 3bdw s ALA 209 Cb -0.07 -2.11 0.00 0.00 0.00 0.00 0.00 23.12 20.94 3bdw s ALA 209 CO 0.01 0.67 -0.03 0.14 0.00 0.00 0.00 175.76 176.55 3bdw s VAL 210 N -1.55 0.23 -0.33 0.00 -7.23 0.15 -2.35 120.40 109.32 3bdw s VAL 210 Ca 0.37 -0.10 -0.19 0.00 -1.81 0.00 0.00 61.98 60.25 3bdw s VAL 210 Cb -0.13 -0.21 -0.01 0.00 0.56 0.00 0.00 36.38 36.59 3bdw s VAL 210 CO 0.23 0.08 0.55 -0.22 -0.31 0.00 0.00 175.10 175.43 3bdw s LEU 211 N 0.05 4.25 -0.25 1.32 2.96 0.34 0.37 118.68 127.72 3bdw s LEU 211 Ca -0.00 0.15 0.00 0.00 -0.22 0.00 0.00 54.13 54.06 3bdw s LEU 211 Cb -0.03 -2.67 0.07 0.00 0.50 0.00 0.00 46.19 44.07 3bdw s LEU 211 CO -0.00 -0.47 -0.00 -1.10 -1.32 0.00 0.00 176.35 173.45 3bdw s GLN 212 N 2.48 1.31 -0.33 1.98 -0.21 -0.13 0.00 119.66 124.77 3bdw s GLN 212 Ca 0.21 -1.02 -0.28 0.00 0.02 0.00 0.00 55.36 54.29 3bdw s GLN 212 Cb -0.15 -2.48 0.04 0.00 1.00 0.00 0.00 33.01 31.42 3bdw s GLN 212 CO 0.13 -0.71 0.48 1.33 -2.12 0.00 0.00 175.29 174.40 3bdw n VAL 213 N 4.71 -3.85 -3.33 1.09 0.24 0.14 -3.11 118.33 114.21 3bdw n VAL 213 Ca -0.08 0.25 -0.21 0.00 -2.04 0.00 0.00 64.34 62.26 3bdw n VAL 213 Cb 0.44 -3.61 -0.02 0.00 -1.47 0.00 0.00 33.84 29.18 3bdw n VAL 213 CO 0.00 0.00 0.00 -3.20 -2.14 0.00 0.00 176.83 171.49 3bdw n ASN 214 N 0.21 -2.66 -3.83 -1.34 4.05 -1.26 -4.95 115.26 105.48 3bdw n ASN 214 Ca -0.06 -0.31 -0.12 0.00 0.45 0.00 0.00 54.58 54.55 3bdw n ASN 214 Cb 0.62 -2.27 -0.10 0.00 1.23 0.00 0.00 39.78 39.26 3bdw n ASN 214 CO 0.00 0.00 0.00 -0.13 -3.05 0.00 0.00 177.26 174.08 3bdw s ARG 215 N -5.95 0.49 -0.33 1.20 1.81 -1.18 -5.01 118.95 109.98 3bdw s ARG 215 Ca 0.37 -0.24 -0.17 0.00 -1.72 0.00 0.00 55.73 53.96 3bdw s ARG 215 Cb -0.20 0.21 -0.01 0.00 -0.45 0.00 0.00 34.95 34.50 3bdw s ARG 215 CO 0.45 -0.12 0.48 -0.51 -0.68 0.00 0.00 175.30 174.92 3bdw s LEU 216 N -1.14 4.31 0.04 2.53 1.43 -1.26 -0.95 118.68 123.62 3bdw s LEU 216 Ca -0.12 0.02 0.06 0.00 -1.03 0.00 0.00 54.13 53.06 3bdw s LEU 216 Cb -0.06 -2.55 -0.03 0.00 0.03 0.00 0.00 46.19 43.58 3bdw s LEU 216 CO 0.02 -0.42 -0.16 -0.75 0.23 0.00 0.00 176.35 175.27 3bdw s LYS 217 N 2.31 2.15 0.16 1.70 2.20 0.16 -0.18 119.74 128.24 3bdw s LYS 217 Ca 0.18 -0.94 -0.26 0.00 -0.36 0.00 0.00 55.97 54.59 3bdw s LYS 217 Cb -0.16 -2.24 -0.08 0.00 -1.51 0.00 0.00 37.83 33.85 3bdw s LYS 217 CO 0.12 0.55 0.80 0.45 -0.36 0.00 0.00 175.35 176.91 3bdw s SER 218 N -1.45 7.40 0.02 1.43 0.15 -1.26 -0.67 113.70 119.32 3bdw s SER 218 Ca 0.15 1.66 -0.09 0.00 0.70 0.00 0.00 55.95 58.38 3bdw s SER 218 Cb -0.11 -2.51 0.00 0.00 -1.71 0.00 0.00 66.02 61.69 3bdw s SER 218 CO 0.06 0.17 0.17 0.00 1.20 0.00 0.00 173.24 174.84 3bdw s ALA 219 N -0.97 -0.34 0.03 5.45 0.00 -0.13 -4.90 121.76 120.90 3bdw s ALA 219 Ca 0.37 -0.22 -0.30 0.00 0.00 0.00 0.00 51.96 51.80 3bdw s ALA 219 Cb -0.23 0.21 -0.07 0.00 0.00 0.00 0.00 23.12 23.02 3bdw s ALA 219 CO 0.27 -0.30 1.64 -1.14 0.00 0.00 0.00 175.76 176.22 3bdw s GLN 220 N -2.10 4.20 0.58 0.00 2.00 -1.26 -2.90 119.66 120.17 3bdw s GLN 220 Ca -0.09 2.27 0.28 0.00 -2.00 0.00 0.00 55.36 55.82 3bdw s GLN 220 Cb -0.03 -3.71 1.72 0.00 0.80 0.00 0.00 33.01 31.78 3bdw s GLN 220 CO -0.02 -0.75 2.20 0.00 -0.50 0.00 0.00 175.29 176.22 3bdw n GLY 222 N -1.37 -0.74 3.77 0.00 0.00 -1.26 -2.05 105.19 103.53 3bdw n GLY 222 Ca -0.01 -0.28 -0.40 0.00 0.00 0.00 0.00 46.02 45.33 3bdw n GLY 222 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3bdw s SER 223 N -2.15 6.73 -0.22 1.61 0.01 -0.12 -4.84 113.70 114.71 3bdw s SER 223 Ca 0.39 2.61 -0.26 0.00 1.31 0.00 0.00 55.95 60.01 3bdw s SER 223 Cb 0.21 -2.64 -0.00 0.00 0.21 0.00 0.00 66.02 63.80 3bdw s SER 223 CO 0.39 -0.56 0.89 -0.44 0.41 0.00 0.00 173.24 173.93 3bdw s SER 224 N -0.62 6.95 0.02 2.44 0.01 -1.26 -4.05 113.70 117.18 3bdw s SER 224 Ca 0.50 1.17 -0.01 0.00 1.31 0.00 0.00 55.95 58.93 3bdw s SER 224 Cb -0.38 -2.47 -0.02 0.00 0.21 0.00 0.00 66.02 63.36 3bdw s SER 224 CO 0.50 -0.52 -0.01 -0.63 0.41 0.00 0.00 173.24 172.99 3bdw s ILE 225 N 2.73 0.12 0.49 1.44 1.01 -0.18 -4.69 121.20 122.13 3bdw s ILE 225 Ca 0.38 -1.02 -0.22 0.00 0.00 0.00 0.00 60.65 59.79 3bdw s ILE 225 Cb -0.16 -0.49 -0.08 0.00 0.01 0.00 0.00 42.46 41.75 3bdw s ILE 225 CO 0.09 -0.56 1.10 -0.38 0.00 0.00 0.00 174.94 175.18 3bdw n ILE 226 N 1.33 3.03 -4.24 2.92 2.08 -1.26 -0.59 119.36 122.63 3bdw n ILE 226 Ca -0.22 -0.50 -0.17 0.00 0.56 0.00 0.00 62.75 62.42 3bdw n ILE 226 Cb 0.56 -1.31 -0.14 0.00 -0.75 0.00 0.00 39.64 38.00 3bdw n ILE 226 CO 0.00 0.00 0.00 -0.72 0.56 0.00 0.00 176.55 176.39 3bdw s TYR 227 N -1.34 0.69 0.25 1.39 1.13 -1.25 -2.21 117.35 116.00 3bdw s TYR 227 Ca 0.68 -0.20 0.09 0.00 -1.41 0.00 0.00 57.07 56.23 3bdw s TYR 227 Cb -0.48 -0.43 -0.04 0.00 -1.10 0.00 0.00 41.96 39.90 3bdw s TYR 227 CO 0.53 -0.02 -0.00 -1.01 -2.51 0.00 0.00 175.55 172.54 3bdw s HIS 228 N -0.41 2.72 0.17 -3.49 3.76 -1.26 -3.31 115.29 113.48 3bdw s HIS 228 Ca 0.01 -0.21 0.11 0.00 -0.15 0.00 0.00 55.06 54.82 3bdw s HIS 228 Cb -0.04 -1.23 -0.04 0.00 1.11 0.00 0.00 32.58 32.38 3bdw s HIS 228 CO -0.00 0.60 -0.22 0.00 -0.85 0.00 0.00 174.74 174.27 3bdw s LYS 230 N -2.50 0.34 -0.04 0.00 2.20 0.46 -1.97 119.74 118.22 3bdw s LYS 230 Ca 0.20 0.32 -0.03 0.00 -0.36 0.00 0.00 55.97 56.10 3bdw s LYS 230 Cb -0.09 0.16 -0.04 0.00 -1.51 0.00 0.00 37.83 36.36 3bdw s LYS 230 CO 0.10 -0.05 0.14 -1.01 -0.36 0.00 0.00 175.35 174.17 3bdw s HIS 231 N 0.02 3.48 -2.00 4.03 3.76 -0.95 -3.14 115.29 120.48 3bdw s HIS 231 Ca -0.01 0.36 0.13 0.00 -0.15 0.00 0.00 55.06 55.38 3bdw s HIS 231 Cb -0.02 -1.84 0.75 0.00 1.11 0.00 0.00 32.58 32.58 3bdw s HIS 231 CO 0.01 0.64 1.18 1.63 -0.85 0.00 0.00 174.74 177.34