#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3cii s ARG 114 N 0.00 1.40 0.32 0.00 1.81 -1.26 -5.16 118.95 116.06 3cii s ARG 114 Ca 0.00 -0.60 0.02 0.00 -1.72 0.00 0.00 55.73 53.43 3cii s ARG 114 Cb 0.00 -1.34 0.02 0.00 -0.45 0.00 0.00 34.95 33.18 3cii s ARG 114 CO 0.00 0.35 0.14 -2.39 -0.68 0.00 0.00 175.30 172.72 3cii n HIS 115 N 2.73 -0.25 -2.25 -0.53 1.44 -1.26 -5.10 115.22 109.99 3cii n HIS 115 Ca -0.15 -1.45 -0.40 0.00 -2.01 0.00 0.00 57.72 53.71 3cii n HIS 115 Cb 0.54 -0.24 -0.03 0.00 0.12 0.00 0.00 29.99 30.38 3cii n HIS 115 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 3cii n GLY 117 N 0.94 -1.06 0.22 0.00 0.00 -1.26 -3.35 105.19 100.69 3cii n GLY 117 Ca -0.00 -0.23 0.12 0.00 0.00 0.00 0.00 46.02 45.90 3cii n GLY 117 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3cii n HIS 118 N -1.07 0.00 -4.17 1.61 8.25 -1.26 -4.97 115.22 113.61 3cii n HIS 118 Ca 0.14 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.49 3cii n HIS 118 Cb 0.27 -0.09 -0.10 0.00 1.12 0.00 0.00 29.99 31.19 3cii n HIS 118 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3cii s PRO 120 N -4.04 -1.48 0.00 0.00 0.02 -1.26 -4.73 135.00 123.50 3cii s PRO 120 Ca 0.25 0.10 -0.01 0.00 0.02 0.00 0.00 61.00 61.36 3cii s PRO 120 Cb 0.07 -1.55 -0.01 0.00 0.02 0.00 0.00 34.50 33.04 3cii s PRO 120 CO 0.03 -3.92 1.01 1.49 -0.33 0.00 0.00 177.00 175.28 3cii h GLU 121 N -2.73 -0.04 -1.00 5.54 4.81 -2.00 -3.15 114.58 116.01 3cii h GLU 121 Ca -0.47 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 58.75 3cii h GLU 121 Cb 1.31 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.69 3cii h GLU 121 CO 0.36 -0.03 0.02 -0.85 -0.73 0.00 0.00 179.01 177.78 3cii n GLU 122 N -2.11 1.04 -4.10 1.92 0.00 -1.26 -4.86 120.64 111.26 3cii n GLU 122 Ca -0.01 -0.08 -0.27 0.00 0.00 0.00 0.00 57.16 56.80 3cii n GLU 122 Cb 0.02 -1.06 -0.06 0.00 0.00 0.00 0.00 31.44 30.33 3cii n GLU 122 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.13 175.55 3cii s TRP 123 N -0.14 3.09 0.04 -1.84 0.52 -1.19 -4.75 118.94 114.66 3cii s TRP 123 Ca 0.01 -0.02 0.04 0.00 0.02 0.00 0.00 56.10 56.16 3cii s TRP 123 Cb 0.01 -1.51 -0.04 0.00 -1.15 0.00 0.00 33.47 30.78 3cii s TRP 123 CO 0.00 0.52 -0.07 0.96 0.02 0.00 0.00 176.95 178.38 3cii s ILE 124 N -1.63 3.61 -0.22 2.03 -4.36 -0.95 -4.93 121.20 114.74 3cii s ILE 124 Ca 0.29 -0.92 -0.05 0.00 -0.26 0.00 0.00 60.65 59.72 3cii s ILE 124 Cb -0.10 -2.61 -0.02 0.00 1.25 0.00 0.00 42.46 40.98 3cii s ILE 124 CO 0.22 0.30 -0.00 0.42 0.24 0.00 0.00 174.94 176.11 3cii s THR 125 N -1.08 3.74 0.00 8.37 -4.23 -1.26 -0.56 115.64 120.62 3cii s THR 125 Ca 0.19 -0.37 0.00 0.00 -1.18 0.00 0.00 61.69 60.33 3cii s THR 125 Cb -0.11 -2.71 0.00 0.00 1.34 0.00 0.00 72.50 71.02 3cii s THR 125 CO 0.10 0.40 0.00 0.00 -0.54 0.00 0.00 174.62 174.58 3cii n TYR 126 N 4.69 0.00 -3.90 3.99 9.36 -1.12 -5.01 117.16 125.16 3cii n TYR 126 Ca -0.17 0.00 -0.30 0.00 3.32 0.00 0.00 57.90 60.74 3cii n TYR 126 Cb 0.51 0.00 -0.14 0.00 -0.63 0.00 0.00 39.34 39.08 3cii n TYR 126 CO 0.00 0.00 0.00 0.45 0.22 0.00 0.00 176.86 177.53 3cii s SER 127 N -0.38 4.30 0.00 2.98 0.15 -1.26 -4.79 113.70 114.69 3cii s SER 127 Ca 0.00 -2.55 0.00 0.00 0.70 0.00 0.00 55.95 54.10 3cii s SER 127 Cb 0.00 -1.45 0.00 0.00 -1.71 0.00 0.00 66.02 62.86 3cii s SER 127 CO 0.00 -0.30 0.00 0.59 1.20 0.00 0.00 173.24 174.73 3cii n ASN 128 N 3.70 0.00 -4.05 5.45 3.02 -1.26 -4.85 115.26 117.27 3cii n ASN 128 Ca 0.05 0.00 -0.24 0.00 -0.03 0.00 0.00 54.58 54.36 3cii n ASN 128 Cb 0.36 -1.41 -0.16 0.00 -0.61 0.00 0.00 39.78 37.96 3cii n ASN 128 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 3cii s SER 129 N -1.27 1.72 0.50 6.41 1.04 -1.26 -4.65 113.70 116.18 3cii s SER 129 Ca 0.00 -0.28 -0.11 0.00 0.48 0.00 0.00 55.95 56.04 3cii s SER 129 Cb 0.00 -0.60 -0.06 0.00 0.10 0.00 0.00 66.02 65.46 3cii s SER 129 CO 0.00 0.08 0.89 0.00 0.98 0.00 0.00 173.24 175.19 3cii s TYR 131 N -2.71 1.34 -0.16 0.00 1.51 0.27 -2.06 117.35 115.54 3cii s TYR 131 Ca 0.53 -0.51 -0.02 0.00 -1.01 0.00 0.00 57.07 56.06 3cii s TYR 131 Cb -0.10 -0.73 -0.02 0.00 -0.11 0.00 0.00 41.96 41.01 3cii s TYR 131 CO 0.40 0.11 -0.09 -0.47 -1.11 0.00 0.00 175.55 174.39 3cii s TYR 132 N -1.74 2.90 -0.10 2.71 5.04 0.06 -2.24 117.35 123.99 3cii s TYR 132 Ca 0.04 -0.65 -0.16 0.00 -2.44 0.00 0.00 57.07 53.86 3cii s TYR 132 Cb -0.07 -1.94 -0.05 0.00 0.35 0.00 0.00 41.96 40.25 3cii s TYR 132 CO 0.03 -0.27 0.41 0.42 -1.34 0.00 0.00 175.55 174.80 3cii s ILE 133 N 0.67 5.17 0.00 3.14 1.09 -1.26 -1.78 121.20 128.23 3cii s ILE 133 Ca -0.05 0.83 0.00 0.00 -1.10 0.00 0.00 60.65 60.33 3cii s ILE 133 Cb -0.15 -3.74 0.00 0.00 -1.06 0.00 0.00 42.46 37.51 3cii s ILE 133 CO 0.02 0.41 0.34 0.61 -0.10 0.00 0.00 174.94 176.22 3cii n GLY 134 N 2.90 -0.90 3.34 6.18 0.00 -1.20 -4.91 105.19 110.60 3cii n GLY 134 Ca -0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.92 3cii n GLY 134 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3cii n LYS 135 N -1.15 -1.11 -5.14 1.61 5.02 -1.26 -4.95 118.16 111.17 3cii n LYS 135 Ca 0.00 0.28 -0.32 0.00 -2.02 0.00 0.00 58.31 56.25 3cii n LYS 135 Cb 0.00 -4.66 -0.15 0.00 -0.02 0.00 0.00 35.03 30.20 3cii n LYS 135 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 3cii s GLU 136 N -1.49 2.29 -0.48 1.97 2.02 -1.26 -5.10 118.70 116.65 3cii s GLU 136 Ca 0.00 -0.84 -0.21 0.00 0.02 0.00 0.00 54.97 53.94 3cii s GLU 136 Cb 0.00 -2.18 0.04 0.00 0.10 0.00 0.00 34.13 32.09 3cii s GLU 136 CO 0.00 0.58 0.71 1.03 0.02 0.00 0.00 175.26 177.60 3cii s ARG 137 N -0.63 3.26 0.21 1.61 0.52 -1.26 -4.04 118.95 118.61 3cii s ARG 137 Ca 0.10 -0.46 -0.02 0.00 -0.52 0.00 0.00 55.73 54.83 3cii s ARG 137 Cb -0.10 -4.01 -0.04 0.00 0.52 0.00 0.00 34.95 31.32 3cii s ARG 137 CO -0.00 -1.17 0.18 1.03 0.02 0.00 0.00 175.30 175.36 3cii s ARG 138 N 3.03 1.27 0.11 3.54 1.81 0.22 -4.83 118.95 124.11 3cii s ARG 138 Ca 0.23 -1.60 -0.00 0.00 -1.72 0.00 0.00 55.73 52.63 3cii s ARG 138 Cb -0.15 0.30 -0.04 0.00 -0.45 0.00 0.00 34.95 34.61 3cii s ARG 138 CO 0.18 -0.44 0.27 -0.08 -0.68 0.00 0.00 175.30 174.55 3cii s THR 139 N -4.10 5.32 0.19 0.02 -1.32 -1.26 -0.80 115.64 113.69 3cii s THR 139 Ca 0.37 -0.41 -0.21 0.00 -1.21 0.00 0.00 61.69 60.23 3cii s THR 139 Cb 0.06 -3.67 0.14 0.00 -1.51 0.00 0.00 72.50 67.51 3cii s THR 139 CO 0.12 0.03 1.57 -0.25 -2.21 0.00 0.00 174.62 173.89 3cii h TRP 140 N 2.67 -1.03 -0.13 9.09 7.01 -1.76 0.99 115.95 132.78 3cii h TRP 140 Ca -0.46 0.08 0.02 0.00 2.11 0.00 0.00 58.89 60.63 3cii h TRP 140 Cb 1.17 0.55 -0.02 0.00 -2.10 0.00 0.00 29.16 28.76 3cii h TRP 140 CO 0.58 -0.39 -0.16 0.93 -2.79 0.00 0.00 178.44 176.61 3cii h GLU 141 N -0.13 -0.09 -0.96 2.65 4.39 -1.96 0.11 114.58 118.59 3cii h GLU 141 Ca 0.25 0.01 0.11 0.00 0.34 0.00 0.00 59.36 60.07 3cii h GLU 141 Cb 0.56 0.02 -0.08 0.00 -0.10 0.00 0.00 28.75 29.15 3cii h GLU 141 CO -0.76 -0.06 0.60 0.93 -1.16 0.00 0.00 179.01 178.55 3cii h GLU 142 N -0.10 0.95 -0.96 2.33 5.08 -1.21 -0.52 114.58 120.15 3cii h GLU 142 Ca 0.02 -0.06 0.06 0.00 -1.00 0.00 0.00 59.36 58.39 3cii h GLU 142 Cb 0.16 -0.21 -0.07 0.00 0.50 0.00 0.00 28.75 29.13 3cii h GLU 142 CO -0.18 0.63 0.61 0.77 -1.00 0.00 0.00 179.01 179.84 3cii h SER 143 N 0.98 0.97 -0.40 1.42 0.02 0.17 0.59 113.55 117.30 3cii h SER 143 Ca 0.47 0.01 -0.16 0.00 -0.84 0.00 0.00 61.79 61.27 3cii h SER 143 Cb 0.41 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 62.75 3cii h SER 143 CO -0.25 0.62 -0.36 0.25 -1.14 0.00 0.00 176.83 175.95 3cii h LEU 144 N 1.11 1.02 0.50 5.07 5.85 0.69 -2.86 115.31 126.69 3cii h LEU 144 Ca 0.41 -0.46 -0.02 0.00 0.84 0.00 0.00 57.88 58.65 3cii h LEU 144 Cb 0.16 -0.28 0.00 0.00 0.37 0.00 0.00 40.66 40.91 3cii h LEU 144 CO -0.17 1.26 -0.24 -0.07 -0.34 0.00 0.00 178.44 178.88 3cii h LEU 145 N 0.79 -0.57 -0.82 2.25 3.38 0.08 -2.44 115.31 117.97 3cii h LEU 145 Ca 0.07 -0.03 0.13 0.00 0.09 0.00 0.00 57.88 58.14 3cii h LEU 145 Cb 0.96 0.15 -0.09 0.00 0.09 0.00 0.00 40.66 41.77 3cii h LEU 145 CO 0.09 -0.33 0.41 0.00 0.09 0.00 0.00 178.44 178.71 3cii h ALA 146 N -0.34 1.20 -0.41 1.53 0.00 0.09 0.20 119.26 121.53 3cii h ALA 146 Ca -0.07 0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 3cii h ALA 146 Cb 0.57 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 3cii h ALA 146 CO 0.11 -0.08 0.22 0.00 0.00 0.00 0.00 179.25 179.50 3cii h THR 148 N 0.53 0.33 0.00 0.00 2.02 -0.51 -0.18 112.91 115.09 3cii h THR 148 Ca 0.14 -0.95 0.00 0.00 0.77 0.00 0.00 66.41 66.38 3cii h THR 148 Cb 0.07 1.72 0.00 0.00 -1.74 0.00 0.00 68.15 68.20 3cii h THR 148 CO -0.02 0.14 0.00 -0.24 0.37 0.00 0.00 175.52 175.77 3cii n SER 149 N -3.26 0.00 -0.87 4.18 2.88 0.52 -3.05 113.62 114.02 3cii n SER 149 Ca 0.01 0.21 0.05 0.00 -1.33 0.00 0.00 58.87 57.80 3cii n SER 149 Cb 0.41 -0.38 0.23 0.00 -0.75 0.00 0.00 64.21 63.71 3cii n SER 149 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 3cii n LYS 150 N -1.38 2.35 -0.76 -1.46 5.02 -0.10 -4.97 118.16 116.87 3cii n LYS 150 Ca 0.08 -2.92 0.00 0.00 -2.02 0.00 0.00 58.31 53.45 3cii n LYS 150 Cb 0.20 -1.79 0.00 0.00 -0.02 0.00 0.00 35.03 33.41 3cii n LYS 150 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 3cii n ASN 151 N -0.83 -2.00 -4.69 4.39 3.02 -1.17 -4.96 115.26 109.02 3cii n ASN 151 Ca 0.24 0.00 -0.33 0.00 -0.03 0.00 0.00 54.58 54.47 3cii n ASN 151 Cb 0.91 -2.27 -0.07 0.00 -0.61 0.00 0.00 39.78 37.74 3cii n ASN 151 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 3cii n SER 152 N -0.29 3.37 -4.92 6.41 3.41 -1.10 -5.02 113.62 115.48 3cii n SER 152 Ca 0.00 -3.25 -0.20 0.00 -0.26 0.00 0.00 58.87 55.16 3cii n SER 152 Cb 0.15 0.38 -0.01 0.00 -0.26 0.00 0.00 64.21 64.46 3cii n SER 152 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 3cii s SER 153 N -3.82 5.19 0.47 4.04 0.01 -0.93 -2.98 113.70 115.69 3cii s SER 153 Ca 0.01 -0.70 -0.21 0.00 1.31 0.00 0.00 55.95 56.36 3cii s SER 153 Cb 0.00 -0.48 -0.08 0.00 0.21 0.00 0.00 66.02 65.66 3cii s SER 153 CO 0.00 -0.75 1.04 -0.22 0.41 0.00 0.00 173.24 173.73 3cii s LEU 154 N -4.23 3.89 -0.11 2.44 2.96 -1.26 -1.06 118.68 121.32 3cii s LEU 154 Ca 0.50 1.96 -0.36 0.00 -0.22 0.00 0.00 54.13 56.00 3cii s LEU 154 Cb -0.05 -4.50 -0.14 0.00 0.50 0.00 0.00 46.19 42.01 3cii s LEU 154 CO 0.29 -0.75 1.75 -0.11 -1.32 0.00 0.00 176.35 176.22 3cii n LEU 155 N -0.82 2.88 -4.49 -0.68 7.94 -0.83 -4.41 117.00 116.58 3cii n LEU 155 Ca 0.09 1.03 -0.33 0.00 -1.11 0.00 0.00 56.01 55.69 3cii n LEU 155 Cb 0.52 -1.28 -0.13 0.00 0.53 0.00 0.00 43.42 43.06 3cii n LEU 155 CO 0.41 -0.30 -0.45 -0.94 -1.11 0.00 0.00 177.39 175.00 3cii s SER 156 N 3.18 4.08 -0.27 1.96 1.04 -1.26 -0.88 113.70 121.55 3cii s SER 156 Ca 0.92 -0.21 -0.15 0.00 0.48 0.00 0.00 55.95 56.99 3cii s SER 156 Cb -0.84 -0.86 -0.04 0.00 0.10 0.00 0.00 66.02 64.38 3cii s SER 156 CO 0.54 0.33 0.38 -0.63 0.98 0.00 0.00 173.24 174.84 3cii s ILE 157 N -0.78 5.17 0.00 -1.02 -1.09 -1.26 -4.98 121.20 117.24 3cii s ILE 157 Ca 0.12 0.59 0.00 0.00 -2.23 0.00 0.00 60.65 59.13 3cii s ILE 157 Cb -0.11 -3.70 0.00 0.00 -1.58 0.00 0.00 42.46 37.07 3cii s ILE 157 CO 0.02 0.16 0.00 0.47 -1.23 0.00 0.00 174.94 174.36 3cii n ASP 158 N 5.30 0.00 -4.60 3.58 10.43 -1.26 -5.02 116.55 124.98 3cii n ASP 158 Ca -0.08 0.22 -0.27 0.00 2.57 0.00 0.00 54.79 57.23 3cii n ASP 158 Cb 0.51 -0.38 -0.09 0.00 1.84 0.00 0.00 41.12 43.00 3cii n ASP 158 CO 0.00 0.00 0.00 0.21 -1.07 0.00 0.00 177.20 176.34 3cii s ASN 159 N -2.84 4.42 0.00 -2.24 3.04 -1.26 -4.99 114.94 111.07 3cii s ASN 159 Ca 0.00 -0.52 0.00 0.00 0.04 0.00 0.00 52.86 52.38 3cii s ASN 159 Cb 0.00 -0.81 0.00 0.00 -1.54 0.00 0.00 41.25 38.90 3cii s ASN 159 CO 0.00 0.10 0.34 -0.62 -3.04 0.00 0.00 177.10 173.88 3cii n GLU 160 N -0.04 0.41 -0.01 0.43 -0.58 -1.26 -2.10 120.64 117.50 3cii n GLU 160 Ca -0.10 0.00 -0.00 0.00 -0.42 0.00 0.00 57.16 56.63 3cii n GLU 160 Cb 0.55 -1.07 -0.01 0.00 -0.57 0.00 0.00 31.44 30.34 3cii n GLU 160 CO 0.00 0.00 0.00 -1.91 -0.48 0.00 0.00 177.13 174.74 3cii n GLU 161 N -0.23 3.17 0.04 3.49 2.13 -1.26 -4.37 120.64 123.61 3cii n GLU 161 Ca 0.00 -0.00 0.03 0.00 0.66 0.00 0.00 57.16 57.84 3cii n GLU 161 Cb 0.04 -1.04 0.39 0.00 0.27 0.00 0.00 31.44 31.10 3cii n GLU 161 CO 0.00 0.00 0.00 1.49 -0.41 0.00 0.00 177.13 178.21 3cii h GLU 162 N 0.00 0.45 -0.55 5.31 4.81 -1.83 -3.29 114.58 119.49 3cii h GLU 162 Ca -0.03 -0.06 -0.09 0.00 -0.13 0.00 0.00 59.36 59.05 3cii h GLU 162 Cb 0.93 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 30.20 3cii h GLU 162 CO 0.00 0.40 -0.00 1.98 -0.73 0.00 0.00 179.01 180.65 3cii h MET 163 N 0.45 0.94 -0.28 1.92 4.05 -1.69 -0.69 114.93 119.63 3cii h MET 163 Ca 0.11 -0.28 -0.03 0.00 -0.28 0.00 0.00 59.70 59.22 3cii h MET 163 Cb 0.13 -0.10 -0.01 0.00 -0.80 0.00 0.00 31.60 30.83 3cii h MET 163 CO -0.01 0.93 0.07 -0.22 0.23 0.00 0.00 176.91 177.91 3cii h LYS 164 N 0.86 0.46 -0.15 0.39 1.63 -1.76 -3.00 116.57 115.00 3cii h LYS 164 Ca 0.16 -0.11 0.05 0.00 -0.85 0.00 0.00 60.65 59.90 3cii h LYS 164 Cb 0.51 -0.06 -0.06 0.00 -0.60 0.00 0.00 32.23 32.03 3cii h LYS 164 CO 0.03 0.54 -0.21 0.35 -3.45 0.00 0.00 179.45 176.71 3cii h PHE 165 N 0.29 -0.56 0.00 1.91 3.57 -1.54 -3.01 116.94 117.60 3cii h PHE 165 Ca 0.09 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.62 3cii h PHE 165 Cb 0.29 0.27 0.00 0.00 2.79 0.00 0.00 35.95 39.30 3cii h PHE 165 CO 0.01 -0.29 0.00 1.25 -2.23 0.00 0.00 178.31 177.05 3cii h LEU 166 N -0.26 0.00 0.00 0.59 5.85 -1.00 0.73 115.31 121.21 3cii h LEU 166 Ca 0.11 0.00 -0.18 0.00 0.84 0.00 0.00 57.88 58.65 3cii h LEU 166 Cb 0.42 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.42 3cii h LEU 166 CO -0.30 0.00 -1.23 0.77 -0.34 0.00 0.00 178.44 177.34 3cii h SER 167 N 0.00 0.00 0.47 1.25 4.64 -1.40 -3.10 113.55 115.41 3cii h SER 167 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3cii h SER 167 Cb 0.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.34 3cii h SER 167 CO 0.00 0.67 -0.17 -0.38 -0.87 0.00 0.00 176.83 176.09 3cii n ILE 168 N -3.03 0.00 -0.06 0.95 5.41 0.21 -4.00 119.36 118.84 3cii n ILE 168 Ca -0.07 -0.05 -0.04 0.00 1.00 0.00 0.00 62.75 63.58 3cii n ILE 168 Cb 0.86 -0.06 -0.01 0.00 -0.71 0.00 0.00 39.64 39.71 3cii n ILE 168 CO 0.00 0.00 0.00 -0.38 0.00 0.00 0.00 176.55 176.17 3cii n ILE 169 N -1.10 1.05 -3.65 1.39 2.08 -1.00 -5.02 119.36 113.11 3cii n ILE 169 Ca 0.12 0.27 -0.05 0.00 0.56 0.00 0.00 62.75 63.65 3cii n ILE 169 Cb 0.30 -2.14 -0.07 0.00 -0.75 0.00 0.00 39.64 36.98 3cii n ILE 169 CO 0.00 0.00 0.00 -0.44 0.56 0.00 0.00 176.55 176.67 3cii s SER 170 N -5.22 -0.83 0.06 4.38 0.01 -1.17 -5.11 113.70 105.83 3cii s SER 170 Ca -0.14 1.35 0.05 0.00 1.31 0.00 0.00 55.95 58.51 3cii s SER 170 Cb 0.02 1.67 -0.24 0.00 0.21 0.00 0.00 66.02 67.68 3cii s SER 170 CO 0.21 -0.22 1.08 1.55 0.41 0.00 0.00 173.24 176.27 3cii h PRO 171 N 7.66 0.08 -5.50 12.44 0.13 -1.78 -3.42 132.00 141.63 3cii h PRO 171 Ca -0.23 -0.14 -0.65 0.00 -0.87 0.00 0.00 66.00 64.11 3cii h PRO 171 Cb 1.15 0.05 -0.21 0.00 0.13 0.00 0.00 31.00 32.12 3cii h PRO 171 CO 0.14 0.96 -0.67 -1.54 -0.23 0.00 0.00 178.00 176.67 3cii s SER 172 N -6.71 4.77 -0.22 1.44 1.04 -1.26 -3.54 113.70 109.21 3cii s SER 172 Ca -0.02 -0.10 -0.26 0.00 0.48 0.00 0.00 55.95 56.04 3cii s SER 172 Cb 0.09 -1.65 0.08 0.00 0.10 0.00 0.00 66.02 64.64 3cii s SER 172 CO 0.84 0.22 0.79 -0.55 0.98 0.00 0.00 173.24 175.52 3cii s SER 173 N 0.06 -0.65 0.35 7.02 0.15 -0.91 -4.50 113.70 115.23 3cii s SER 173 Ca -0.00 1.13 -0.28 0.00 0.70 0.00 0.00 55.95 57.49 3cii s SER 173 Cb -0.13 1.10 -0.10 0.00 -1.71 0.00 0.00 66.02 65.17 3cii s SER 173 CO 0.03 -0.31 1.36 0.26 1.20 0.00 0.00 173.24 175.78 3cii s TRP 174 N -0.05 2.90 0.09 3.44 0.52 -0.93 -0.61 118.94 124.29 3cii s TRP 174 Ca -0.02 1.34 0.09 0.00 0.02 0.00 0.00 56.10 57.53 3cii s TRP 174 Cb -0.04 -3.78 -0.04 0.00 -1.15 0.00 0.00 33.47 28.47 3cii s TRP 174 CO 0.01 -2.21 -0.20 0.96 0.02 0.00 0.00 176.95 175.54 3cii s ILE 175 N -1.14 2.70 -0.45 2.03 -4.36 -1.12 -4.42 121.20 114.44 3cii s ILE 175 Ca 0.50 -1.41 -0.04 0.00 -0.26 0.00 0.00 60.65 59.45 3cii s ILE 175 Cb -0.42 -2.19 -0.03 0.00 1.25 0.00 0.00 42.46 41.08 3cii s ILE 175 CO 0.56 0.20 1.55 0.61 0.24 0.00 0.00 174.94 178.11 3cii n GLY 176 N 1.15 2.35 2.86 6.27 0.00 -0.06 -4.50 105.19 113.27 3cii n GLY 176 Ca -0.16 -0.44 -0.16 0.00 0.00 0.00 0.00 46.02 45.26 3cii n GLY 176 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3cii s VAL 177 N 4.27 -0.30 0.06 1.61 1.01 -1.26 -3.29 120.40 122.50 3cii s VAL 177 Ca 0.21 0.28 -0.05 0.00 0.00 0.00 0.00 61.98 62.41 3cii s VAL 177 Cb 0.05 -0.38 -0.02 0.00 0.00 0.00 0.00 36.38 36.04 3cii s VAL 177 CO -0.01 0.09 0.10 0.72 0.00 0.00 0.00 175.10 176.00 3cii s PHE 178 N 2.32 0.27 0.40 5.22 -0.71 -0.29 -2.06 117.98 123.13 3cii s PHE 178 Ca 0.03 -0.68 0.08 0.00 -1.04 0.00 0.00 56.93 55.32 3cii s PHE 178 Cb -0.13 -0.18 -0.00 0.00 -1.21 0.00 0.00 43.02 41.51 3cii s PHE 178 CO -0.07 -0.43 0.51 1.03 -1.34 0.00 0.00 175.22 174.91 3cii s ARG 179 N -3.40 2.84 0.00 1.99 0.52 0.66 -1.28 118.95 120.28 3cii s ARG 179 Ca 0.02 -1.24 0.00 0.00 -0.52 0.00 0.00 55.73 53.99 3cii s ARG 179 Cb 0.03 -2.70 0.00 0.00 0.52 0.00 0.00 34.95 32.80 3cii s ARG 179 CO -0.08 -0.17 0.00 0.09 0.02 0.00 0.00 175.30 175.16 3cii n ASN 180 N -1.74 0.00 -4.63 0.23 3.02 -1.26 -4.84 115.26 106.05 3cii n ASN 180 Ca 0.05 0.08 -0.24 0.00 -0.03 0.00 0.00 54.58 54.44 3cii n ASN 180 Cb 0.59 -0.28 0.12 0.00 -0.61 0.00 0.00 39.78 39.60 3cii n ASN 180 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 3cii s SER 181 N -2.55 4.22 0.22 6.41 1.04 -1.26 -5.00 113.70 116.77 3cii s SER 181 Ca 0.00 -0.39 -0.08 0.00 0.48 0.00 0.00 55.95 55.96 3cii s SER 181 Cb 0.00 0.08 0.31 0.00 0.10 0.00 0.00 66.02 66.50 3cii s SER 181 CO 0.00 -1.96 1.76 0.28 0.98 0.00 0.00 173.24 174.31 3cii h SER 182 N -0.61 0.37 -3.80 7.02 0.02 -1.89 -3.31 113.55 111.34 3cii h SER 182 Ca -0.36 0.07 -0.72 0.00 -0.84 0.00 0.00 61.79 59.93 3cii h SER 182 Cb 1.26 0.01 -0.33 0.00 0.14 0.00 0.00 62.40 63.48 3cii h SER 182 CO 0.39 0.21 -0.13 -2.28 -1.14 0.00 0.00 176.83 173.88 3cii s HIS 183 N -6.07 3.69 0.21 3.45 5.65 -1.26 -4.98 115.29 115.97 3cii s HIS 183 Ca -0.13 -2.69 -0.12 0.00 0.25 0.00 0.00 55.06 52.37 3cii s HIS 183 Cb 0.17 -3.37 -0.00 0.00 -1.18 0.00 0.00 32.58 28.20 3cii s HIS 183 CO 0.75 -0.84 0.42 -1.01 -0.65 0.00 0.00 174.74 173.41 3cii s HIS 184 N -0.55 0.30 0.51 3.88 4.02 -1.25 -5.03 115.29 117.17 3cii s HIS 184 Ca 0.22 -0.65 -0.19 0.00 1.02 0.00 0.00 55.06 55.45 3cii s HIS 184 Cb -0.13 0.13 -0.07 0.00 -1.02 0.00 0.00 32.58 31.49 3cii s HIS 184 CO -0.08 -0.88 1.04 -1.25 1.02 0.00 0.00 174.74 174.59 3cii s PRO 185 N -3.98 3.70 0.09 8.40 0.04 -1.26 -4.87 135.00 137.13 3cii s PRO 185 Ca 0.19 1.29 -0.30 0.00 0.04 0.00 0.00 61.00 62.21 3cii s PRO 185 Cb 0.01 -2.08 -0.06 0.00 0.04 0.00 0.00 34.50 32.40 3cii s PRO 185 CO 0.04 -0.50 1.17 -1.58 0.04 0.00 0.00 177.00 176.16 3cii s TRP 186 N -2.15 3.48 0.02 0.56 0.52 -1.26 -4.67 118.94 115.44 3cii s TRP 186 Ca 0.66 1.39 0.06 0.00 0.02 0.00 0.00 56.10 58.22 3cii s TRP 186 Cb -0.16 -3.38 -0.02 0.00 -1.15 0.00 0.00 33.47 28.77 3cii s TRP 186 CO 0.25 -1.08 -0.17 0.08 0.02 0.00 0.00 176.95 176.05 3cii s VAL 187 N 0.68 1.34 0.66 4.03 1.01 -0.40 -1.32 120.40 126.40 3cii s VAL 187 Ca 0.56 -0.97 -0.11 0.00 0.00 0.00 0.00 61.98 61.46 3cii s VAL 187 Cb -0.29 -1.17 0.16 0.00 0.00 0.00 0.00 36.38 35.07 3cii s VAL 187 CO 0.31 0.18 0.76 0.35 0.00 0.00 0.00 175.10 176.70 3cii n THR 188 N 2.13 0.00 -0.14 3.92 -2.24 -0.65 -1.14 114.28 116.16 3cii n THR 188 Ca -0.17 -0.48 -0.10 0.00 -2.27 0.00 0.00 64.05 61.04 3cii n THR 188 Cb 0.54 -1.48 -0.01 0.00 -2.10 0.00 0.00 70.33 67.28 3cii n THR 188 CO 0.00 0.00 0.00 0.24 -0.57 0.00 0.00 175.07 174.74 3cii h MET 189 N 0.00 0.64 -0.56 -0.78 2.86 -1.89 -2.79 114.93 112.40 3cii h MET 189 Ca -0.26 -0.15 0.16 0.00 -2.06 0.00 0.00 59.70 57.39 3cii h MET 189 Cb 0.74 -0.08 -0.02 0.00 0.06 0.00 0.00 31.60 32.29 3cii h MET 189 CO 0.18 0.66 0.63 -0.91 1.06 0.00 0.00 176.91 178.52 3cii h ASN 190 N 0.50 0.00 0.00 1.22 2.35 -1.93 -3.44 115.58 114.28 3cii h ASN 190 Ca 0.13 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.88 3cii h ASN 190 Cb 0.30 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.67 3cii h ASN 190 CO 0.00 0.00 0.00 0.61 -1.65 0.00 0.00 177.43 176.39 3cii n GLY 191 N -1.54 0.76 3.85 2.83 0.00 -1.05 -5.07 105.19 104.97 3cii n GLY 191 Ca 0.11 -0.06 -0.34 0.00 0.00 0.00 0.00 46.02 45.73 3cii n GLY 191 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3cii s LEU 192 N 0.00 4.21 -0.18 0.99 1.43 -1.26 -4.85 118.68 119.02 3cii s LEU 192 Ca 0.00 1.18 -0.29 0.00 -1.03 0.00 0.00 54.13 53.99 3cii s LEU 192 Cb 0.00 -3.71 -0.04 0.00 0.03 0.00 0.00 46.19 42.47 3cii s LEU 192 CO 0.00 -0.06 1.76 0.00 0.23 0.00 0.00 176.35 178.28 3cii s ALA 193 N -1.74 3.24 0.28 4.21 0.00 -1.26 -1.64 121.76 124.85 3cii s ALA 193 Ca 0.47 0.65 -0.30 0.00 0.00 0.00 0.00 51.96 52.78 3cii s ALA 193 Cb -0.13 -3.88 -0.10 0.00 0.00 0.00 0.00 23.12 19.01 3cii s ALA 193 CO 0.19 -2.02 1.42 0.12 0.00 0.00 0.00 175.76 175.47 3cii s PHE 194 N 5.55 2.99 -0.56 0.00 5.99 -0.44 -4.93 117.98 126.58 3cii s PHE 194 Ca 0.78 1.12 0.04 0.00 0.00 0.00 0.00 56.93 58.87 3cii s PHE 194 Cb -0.29 -3.81 0.38 0.00 0.00 0.00 0.00 43.02 39.30 3cii s PHE 194 CO 0.32 -2.54 1.19 1.63 -0.00 0.00 0.00 175.22 175.83 3cii n LYS 195 N 1.86 3.43 -3.76 10.12 5.02 -1.26 -4.93 118.16 128.64 3cii n LYS 195 Ca 0.05 -4.54 -0.13 0.00 -2.02 0.00 0.00 58.31 51.67 3cii n LYS 195 Cb 0.40 -2.26 -0.09 0.00 -0.02 0.00 0.00 35.03 33.06 3cii n LYS 195 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 3cii s HIS 196 N -3.62 -0.23 0.15 2.13 3.76 -1.26 -5.14 115.29 111.07 3cii s HIS 196 Ca 0.48 0.44 -0.31 0.00 -0.15 0.00 0.00 55.06 55.52 3cii s HIS 196 Cb 0.35 0.10 -0.09 0.00 1.11 0.00 0.00 32.58 34.05 3cii s HIS 196 CO -0.19 -0.33 1.52 -1.21 -0.85 0.00 0.00 174.74 173.68 3cii s GLU 197 N -0.90 4.24 -0.05 1.40 2.02 -1.26 -5.00 118.70 119.14 3cii s GLU 197 Ca -0.10 2.28 -0.00 0.00 0.02 0.00 0.00 54.97 57.17 3cii s GLU 197 Cb -0.04 -3.20 0.03 0.00 0.10 0.00 0.00 34.13 31.01 3cii s GLU 197 CO 0.03 -0.57 -0.01 -1.50 0.02 0.00 0.00 175.26 173.24 3cii s ILE 198 N 1.20 0.35 -0.04 -1.63 -1.16 -1.26 -4.29 121.20 114.36 3cii s ILE 198 Ca 0.69 0.07 -0.13 0.00 -0.51 0.00 0.00 60.65 60.76 3cii s ILE 198 Cb -0.42 -0.46 -0.05 0.00 0.61 0.00 0.00 42.46 42.14 3cii s ILE 198 CO 0.31 0.22 0.35 -0.54 -2.81 0.00 0.00 174.94 172.47 3cii s LYS 199 N 1.51 3.89 -0.16 3.50 1.02 -0.63 -4.91 119.74 123.96 3cii s LYS 199 Ca -0.02 0.29 -0.12 0.00 0.02 0.00 0.00 55.97 56.14 3cii s LYS 199 Cb -0.13 -3.24 -0.07 0.00 -0.52 0.00 0.00 37.83 33.87 3cii s LYS 199 CO -0.03 0.64 -0.09 0.00 -0.92 0.00 0.00 175.35 174.95 3cii n ALA 204 N 2.10 0.53 -0.74 5.17 0.00 -1.26 -4.47 120.51 121.84 3cii n ALA 204 Ca -0.14 -0.44 0.08 0.00 0.00 0.00 0.00 53.44 52.93 3cii n ALA 204 Cb 0.53 -0.11 0.38 0.00 0.00 0.00 0.00 19.45 20.25 3cii n ALA 204 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 3cii n GLU 205 N -4.57 4.39 -3.37 0.00 2.13 -1.26 -4.61 120.64 113.36 3cii n GLU 205 Ca -0.13 -2.98 -0.38 0.00 0.66 0.00 0.00 57.16 54.33 3cii n GLU 205 Cb 0.36 -2.12 -0.06 0.00 0.27 0.00 0.00 31.44 29.89 3cii n GLU 205 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 3cii s LEU 206 N -2.35 4.38 0.00 4.31 1.43 -1.26 -4.73 118.68 120.45 3cii s LEU 206 Ca 0.52 0.93 0.00 0.00 -1.03 0.00 0.00 54.13 54.55 3cii s LEU 206 Cb 0.38 -2.69 0.00 0.00 0.03 0.00 0.00 46.19 43.91 3cii s LEU 206 CO 0.19 0.15 0.00 0.59 0.23 0.00 0.00 176.35 177.50 3cii n ASN 207 N 2.79 0.15 -4.62 2.29 3.02 -1.14 -4.84 115.26 112.90 3cii n ASN 207 Ca -0.10 -0.03 -0.31 0.00 -0.03 0.00 0.00 54.58 54.10 3cii n ASN 207 Cb 0.52 0.10 -0.10 0.00 -0.61 0.00 0.00 39.78 39.69 3cii n ASN 207 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3cii s ALA 209 N -1.10 3.75 0.08 0.00 0.00 -0.87 -0.56 121.76 123.05 3cii s ALA 209 Ca 0.20 -0.83 0.03 0.00 0.00 0.00 0.00 51.96 51.36 3cii s ALA 209 Cb -0.11 -2.08 -0.03 0.00 0.00 0.00 0.00 23.12 20.89 3cii s ALA 209 CO 0.11 0.22 -0.09 0.14 0.00 0.00 0.00 175.76 176.14 3cii s VAL 210 N -2.08 0.77 -0.12 0.00 -7.23 0.13 -2.79 120.40 109.08 3cii s VAL 210 Ca 0.40 -1.51 -0.22 0.00 -1.81 0.00 0.00 61.98 58.84 3cii s VAL 210 Cb -0.10 -1.18 -0.03 0.00 0.56 0.00 0.00 36.38 35.63 3cii s VAL 210 CO 0.32 -0.55 0.63 -0.22 -0.31 0.00 0.00 175.10 174.97 3cii s LEU 211 N -2.26 4.26 -0.20 1.32 2.96 0.22 -0.55 118.68 124.42 3cii s LEU 211 Ca 0.02 1.01 -0.04 0.00 -0.22 0.00 0.00 54.13 54.89 3cii s LEU 211 Cb -0.04 -2.95 0.10 0.00 0.50 0.00 0.00 46.19 43.80 3cii s LEU 211 CO -0.01 -0.14 0.28 -1.10 -1.32 0.00 0.00 176.35 174.06 3cii s GLN 212 N 1.09 0.23 -0.91 1.98 -0.21 -0.88 -2.14 119.66 118.82 3cii s GLN 212 Ca 0.33 0.43 -0.11 0.00 0.02 0.00 0.00 55.36 56.03 3cii s GLN 212 Cb -0.17 -0.72 0.01 0.00 1.00 0.00 0.00 33.01 33.14 3cii s GLN 212 CO 0.14 -0.56 0.60 1.33 -2.12 0.00 0.00 175.29 174.68 3cii n VAL 213 N 5.34 -2.88 -2.28 1.09 0.24 -1.23 -2.86 118.33 115.74 3cii n VAL 213 Ca -0.05 -0.18 -0.18 0.00 -2.04 0.00 0.00 64.34 61.89 3cii n VAL 213 Cb 0.50 -2.54 -0.01 0.00 -1.47 0.00 0.00 33.84 30.32 3cii n VAL 213 CO 0.00 0.00 0.00 -3.20 -2.14 0.00 0.00 176.83 171.49 3cii n ASN 214 N -2.34 -5.24 -3.84 -1.34 2.85 -1.26 -4.99 115.26 99.10 3cii n ASN 214 Ca -0.25 0.02 -0.10 0.00 -0.11 0.00 0.00 54.58 54.14 3cii n ASN 214 Cb 0.63 -4.31 -0.08 0.00 1.24 0.00 0.00 39.78 37.26 3cii n ASN 214 CO 0.00 0.00 0.00 -0.13 -2.11 0.00 0.00 177.26 175.02 3cii s ARG 215 N -4.80 0.78 -0.15 1.20 1.81 -1.14 -5.04 118.95 111.61 3cii s ARG 215 Ca 0.00 -0.76 -0.06 0.00 -1.72 0.00 0.00 55.73 53.19 3cii s ARG 215 Cb 0.00 0.32 -0.04 0.00 -0.45 0.00 0.00 34.95 34.78 3cii s ARG 215 CO 0.00 -0.24 0.05 -0.51 -0.68 0.00 0.00 175.30 173.92 3cii s LEU 216 N -2.44 3.79 0.15 2.53 1.43 -1.26 -2.08 118.68 120.81 3cii s LEU 216 Ca -0.01 0.13 0.06 0.00 -1.03 0.00 0.00 54.13 53.29 3cii s LEU 216 Cb 0.02 -1.93 -0.04 0.00 0.03 0.00 0.00 46.19 44.27 3cii s LEU 216 CO -0.07 0.26 -0.13 -0.75 0.23 0.00 0.00 176.35 175.89 3cii s LYS 217 N -0.14 1.11 -0.15 1.70 2.20 0.29 -1.60 119.74 123.14 3cii s LYS 217 Ca 0.07 -1.39 -0.15 0.00 -0.36 0.00 0.00 55.97 54.13 3cii s LYS 217 Cb -0.12 -0.86 -0.04 0.00 -1.51 0.00 0.00 37.83 35.29 3cii s LYS 217 CO 0.01 0.14 0.36 0.45 -0.36 0.00 0.00 175.35 175.96 3cii s SER 218 N -2.89 6.53 0.08 1.43 0.15 -1.26 0.18 113.70 117.92 3cii s SER 218 Ca 0.15 0.62 0.02 0.00 0.70 0.00 0.00 55.95 57.44 3cii s SER 218 Cb -0.01 -2.22 -0.03 0.00 -1.71 0.00 0.00 66.02 62.04 3cii s SER 218 CO 0.03 0.06 -0.08 0.00 1.20 0.00 0.00 173.24 174.45 3cii s ALA 219 N 0.54 0.88 -0.12 5.45 0.00 0.28 -4.91 121.76 123.87 3cii s ALA 219 Ca 0.20 -1.12 -0.29 0.00 0.00 0.00 0.00 51.96 50.74 3cii s ALA 219 Cb -0.14 0.09 -0.05 0.00 0.00 0.00 0.00 23.12 23.02 3cii s ALA 219 CO 0.06 -0.12 1.74 -1.14 0.00 0.00 0.00 175.76 176.30 3cii s GLN 220 N -2.86 3.93 0.00 0.00 2.00 -1.26 -2.89 119.66 118.57 3cii s GLN 220 Ca 0.03 2.03 0.02 0.00 -2.00 0.00 0.00 55.36 55.45 3cii s GLN 220 Cb -0.02 -4.07 0.11 0.00 0.80 0.00 0.00 33.01 29.84 3cii s GLN 220 CO -0.02 -1.16 0.95 0.00 -0.50 0.00 0.00 175.29 174.56 3cii n GLY 222 N -1.14 -0.93 3.77 0.00 0.00 -1.26 -3.14 105.19 102.48 3cii n GLY 222 Ca 0.01 -0.53 -0.41 0.00 0.00 0.00 0.00 46.02 45.09 3cii n GLY 222 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3cii s SER 223 N -2.92 6.43 -0.81 1.61 0.01 0.63 -4.88 113.70 113.78 3cii s SER 223 Ca 0.11 2.96 -0.21 0.00 1.31 0.00 0.00 55.95 60.12 3cii s SER 223 Cb 0.17 -2.66 0.09 0.00 0.21 0.00 0.00 66.02 63.83 3cii s SER 223 CO 0.78 -0.81 1.08 -0.44 0.41 0.00 0.00 173.24 174.25 3cii s SER 224 N -0.11 6.40 0.52 2.44 0.01 -1.26 -4.38 113.70 117.32 3cii s SER 224 Ca 0.54 -1.48 0.03 0.00 1.31 0.00 0.00 55.95 56.34 3cii s SER 224 Cb -0.45 -2.42 0.00 0.00 0.21 0.00 0.00 66.02 63.36 3cii s SER 224 CO 0.59 -1.29 0.14 -0.63 0.41 0.00 0.00 173.24 172.46 3cii s ILE 225 N 3.56 1.37 -0.01 1.44 1.01 0.02 -4.57 121.20 124.01 3cii s ILE 225 Ca 0.29 -1.82 -0.16 0.00 0.00 0.00 0.00 60.65 58.95 3cii s ILE 225 Cb -0.10 -2.19 -0.06 0.00 0.01 0.00 0.00 42.46 40.12 3cii s ILE 225 CO -0.00 0.00 0.45 -0.63 0.00 0.00 0.00 174.94 174.76 3cii s ILE 226 N -2.83 5.01 -0.06 2.92 -1.09 -1.26 -0.61 121.20 123.28 3cii s ILE 226 Ca 0.16 0.93 0.03 0.00 -2.23 0.00 0.00 60.65 59.55 3cii s ILE 226 Cb 0.01 -3.77 -0.02 0.00 -1.58 0.00 0.00 42.46 37.09 3cii s ILE 226 CO 0.10 0.52 -0.15 -0.72 -1.23 0.00 0.00 174.94 173.46 3cii s TYR 227 N -0.72 2.69 0.01 3.97 1.13 -1.26 -2.19 117.35 120.98 3cii s TYR 227 Ca 0.25 -0.23 0.07 0.00 -1.41 0.00 0.00 57.07 55.75 3cii s TYR 227 Cb -0.17 -1.65 -0.03 0.00 -1.10 0.00 0.00 41.96 39.02 3cii s TYR 227 CO 0.14 0.13 -0.22 -1.01 -2.51 0.00 0.00 175.55 172.07 3cii s HIS 228 N -0.60 2.44 0.14 -3.49 3.76 -1.26 -3.21 115.29 113.07 3cii s HIS 228 Ca 0.09 -0.34 0.04 0.00 -0.15 0.00 0.00 55.06 54.70 3cii s HIS 228 Cb -0.11 -1.49 -0.04 0.00 1.11 0.00 0.00 32.58 32.05 3cii s HIS 228 CO 0.01 0.11 0.13 0.00 -0.85 0.00 0.00 174.74 174.14 3cii s LYS 230 N -2.89 0.41 0.00 0.00 2.20 -0.22 -0.76 119.74 118.48 3cii s LYS 230 Ca 0.31 -0.55 0.00 0.00 -0.36 0.00 0.00 55.97 55.36 3cii s LYS 230 Cb -0.11 -0.19 0.00 0.00 -1.51 0.00 0.00 37.83 36.02 3cii s LYS 230 CO 0.23 0.03 0.00 0.72 -0.36 0.00 0.00 175.35 175.98 3cii n HIS 231 N 1.90 -0.13 0.09 4.03 8.25 -0.88 -2.19 115.22 126.30 3cii n HIS 231 Ca -0.20 0.00 0.01 0.00 -0.26 0.00 0.00 57.72 57.27 3cii n HIS 231 Cb 0.56 0.00 0.01 0.00 1.12 0.00 0.00 29.99 31.68 3cii n HIS 231 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61