#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2b7k s LYS 112 N 0.00 2.37 0.32 1.61 1.02 -1.26 -4.93 119.74 118.86 2b7k s LYS 112 Ca 0.00 1.01 -0.29 0.00 0.02 0.00 0.00 55.97 56.71 2b7k s LYS 112 Cb 0.00 -1.92 -0.13 0.00 -0.52 0.00 0.00 37.83 35.26 2b7k s LYS 112 CO 0.00 -1.52 1.28 -0.35 -0.92 0.00 0.00 175.35 173.85 2b7k n PRO 113 N -3.42 2.03 -1.12 -1.68 -0.04 -1.26 -4.79 135.00 124.73 2b7k n PRO 113 Ca 0.08 0.71 -0.38 0.00 -0.04 0.00 0.00 63.50 63.87 2b7k n PRO 113 Cb 0.54 -2.29 -0.04 0.00 -0.04 0.00 0.00 33.50 31.67 2b7k n PRO 113 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2b7k n SER 114 N 1.08 3.26 -4.87 3.54 2.88 -1.26 -4.92 113.62 113.33 2b7k n SER 114 Ca 0.06 -2.61 -0.30 0.00 -1.33 0.00 0.00 58.87 54.69 2b7k n SER 114 Cb 0.35 -1.17 -0.02 0.00 -0.75 0.00 0.00 64.21 62.62 2b7k n SER 114 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 2b7k s LEU 115 N 1.01 3.61 0.00 2.46 1.02 -1.26 -4.94 118.68 120.58 2b7k s LEU 115 Ca 0.53 1.28 0.00 0.00 0.02 0.00 0.00 54.13 55.96 2b7k s LEU 115 Cb 0.14 -4.22 0.00 0.00 0.02 0.00 0.00 46.19 42.12 2b7k s LEU 115 CO 0.06 -0.58 0.00 0.61 0.02 0.00 0.00 176.35 176.46 2b7k n GLY 116 N -1.85 -0.16 0.00 -3.19 0.00 -0.08 -4.45 105.19 95.47 2b7k n GLY 116 Ca 0.04 -1.83 0.00 0.00 0.00 0.00 0.00 46.02 44.23 2b7k n GLY 116 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2b7k n GLY 117 N -0.14 -0.29 3.76 -0.02 0.00 -1.26 -4.79 105.19 102.46 2b7k n GLY 117 Ca 0.00 -1.74 -0.41 0.00 0.00 0.00 0.00 46.02 43.87 2b7k n GLY 117 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2b7k s PRO 118 N -1.37 4.11 0.09 1.61 0.04 -1.26 -4.76 135.00 133.46 2b7k s PRO 118 Ca 0.00 2.58 -0.16 0.00 0.04 0.00 0.00 61.00 63.46 2b7k s PRO 118 Cb 0.00 -3.00 0.03 0.00 0.04 0.00 0.00 34.50 31.57 2b7k s PRO 118 CO 0.00 -0.59 0.37 -0.59 0.04 0.00 0.00 177.00 176.23 2b7k s PHE 119 N -0.50 -0.18 -0.16 0.56 -0.12 -1.26 -4.86 117.98 111.45 2b7k s PHE 119 Ca 0.59 -0.05 -0.04 0.00 -0.05 0.00 0.00 56.93 57.37 2b7k s PHE 119 Cb -0.47 0.20 0.06 0.00 -0.63 0.00 0.00 43.02 42.17 2b7k s PHE 119 CO 0.55 -0.63 0.07 -1.58 -0.05 0.00 0.00 175.22 173.58 2b7k s HIS 120 N -3.28 0.42 0.00 3.49 2.46 -1.26 -2.73 115.29 114.38 2b7k s HIS 120 Ca -0.00 -0.41 0.00 0.00 0.47 0.00 0.00 55.06 55.12 2b7k s HIS 120 Cb 0.01 -0.77 0.00 0.00 -0.13 0.00 0.00 32.58 31.69 2b7k s HIS 120 CO -0.08 -0.51 0.00 1.28 -2.47 0.00 0.00 174.74 172.96 2b7k n LEU 121 N 5.22 0.00 -4.04 8.88 4.77 0.17 -4.78 117.00 127.23 2b7k n LEU 121 Ca -0.07 0.00 -0.14 0.00 -0.03 0.00 0.00 56.01 55.77 2b7k n LEU 121 Cb 0.49 0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 41.45 2b7k n LEU 121 CO 0.11 0.00 -0.40 -1.83 -1.33 0.00 0.00 177.39 173.93 2b7k s GLU 122 N -0.95 0.50 0.81 3.23 -1.05 -0.04 -1.52 118.70 119.68 2b7k s GLU 122 Ca 0.00 -0.62 -0.08 0.00 -0.15 0.00 0.00 54.97 54.12 2b7k s GLU 122 Cb 0.00 -0.32 0.14 0.00 -0.44 0.00 0.00 34.13 33.51 2b7k s GLU 122 CO 0.00 0.06 1.13 0.16 0.95 0.00 0.00 175.26 177.56 2b7k s ASP 123 N -1.23 3.94 0.00 0.83 1.47 0.78 -1.05 116.67 121.41 2b7k s ASP 123 Ca -0.07 0.03 0.10 0.00 1.18 0.00 0.00 52.55 53.80 2b7k s ASP 123 Cb -0.08 -0.33 0.57 0.00 -0.34 0.00 0.00 42.92 42.74 2b7k s ASP 123 CO 0.00 -2.16 1.16 1.15 0.68 0.00 0.00 175.17 176.01 2b7k n MET 124 N -3.22 0.22 0.00 2.11 0.00 0.37 -1.11 117.12 115.49 2b7k n MET 124 Ca 0.14 0.12 0.08 0.00 0.00 0.00 0.00 57.70 58.04 2b7k n MET 124 Cb 0.60 -1.50 0.02 0.00 0.00 0.00 0.00 33.22 32.35 2b7k n MET 124 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 175.97 176.63 2b7k n TYR 125 N -1.18 0.00 0.00 3.17 4.02 -1.26 -4.59 117.16 117.33 2b7k n TYR 125 Ca 0.06 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.95 2b7k n TYR 125 Cb 0.06 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.38 2b7k n TYR 125 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2b7k n GLY 126 N 1.09 0.30 3.78 2.72 0.00 -0.27 -5.08 105.19 107.74 2b7k n GLY 126 Ca 0.08 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.73 2b7k n GLY 126 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2b7k s ASN 127 N -2.57 7.11 0.40 1.61 0.01 -1.26 -4.71 114.94 115.52 2b7k s ASN 127 Ca 0.00 1.99 -0.27 0.00 -0.71 0.00 0.00 52.86 53.88 2b7k s ASN 127 Cb 0.00 -2.59 -0.09 0.00 0.41 0.00 0.00 41.25 38.98 2b7k s ASN 127 CO 0.00 -0.24 1.33 -0.70 -1.51 0.00 0.00 177.10 175.98 2b7k s GLU 128 N -2.10 4.01 -0.12 -0.60 2.12 -1.26 -0.16 118.70 120.59 2b7k s GLU 128 Ca 0.52 2.23 -0.04 0.00 0.36 0.00 0.00 54.97 58.04 2b7k s GLU 128 Cb -0.22 -2.81 0.06 0.00 0.26 0.00 0.00 34.13 31.42 2b7k s GLU 128 CO 0.28 -0.48 0.16 0.12 -0.54 0.00 0.00 175.26 174.80 2b7k s PHE 129 N -1.23 -0.15 0.35 5.30 5.36 -0.57 -4.78 117.98 122.27 2b7k s PHE 129 Ca 0.56 0.38 0.01 0.00 -0.96 0.00 0.00 56.93 56.92 2b7k s PHE 129 Cb -0.40 -0.35 -0.00 0.00 -0.34 0.00 0.00 43.02 41.93 2b7k s PHE 129 CO 0.51 -0.39 0.04 0.25 -1.46 0.00 0.00 175.22 174.18 2b7k n THR 130 N 5.32 0.00 0.31 0.12 -2.24 -1.26 -0.65 114.28 115.88 2b7k n THR 130 Ca -0.05 -1.80 0.20 0.00 -2.27 0.00 0.00 64.05 60.13 2b7k n THR 130 Cb 0.50 0.47 1.01 0.00 -2.10 0.00 0.00 70.33 70.21 2b7k n THR 130 CO 0.00 0.00 0.00 1.05 -0.57 0.00 0.00 175.07 175.55 2b7k h GLU 131 N 0.00 0.00 0.00 -0.78 9.09 -1.81 -0.67 114.58 120.41 2b7k h GLU 131 Ca -0.29 0.00 -0.02 0.00 0.05 0.00 0.00 59.36 59.10 2b7k h GLU 131 Cb 0.94 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 28.04 2b7k h GLU 131 CO 0.47 0.00 -0.12 0.87 0.05 0.00 0.00 179.01 180.29 2b7k h LYS 132 N 0.00 0.00 0.00 1.06 1.79 -1.95 -2.16 116.57 115.32 2b7k h LYS 132 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 2b7k h LYS 132 Cb 0.14 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.79 2b7k h LYS 132 CO 0.00 0.12 0.00 0.09 -1.08 0.00 0.00 179.45 178.58 2b7k n ASN 133 N -3.43 0.00 0.09 0.86 4.13 -0.26 -2.69 115.26 113.96 2b7k n ASN 133 Ca -0.01 -0.65 0.12 0.00 1.68 0.00 0.00 54.58 55.72 2b7k n ASN 133 Cb 0.28 -0.09 0.08 0.00 -1.54 0.00 0.00 39.78 38.51 2b7k n ASN 133 CO 0.00 0.00 0.00 -0.07 0.28 0.00 0.00 177.26 177.47 2b7k h LEU 134 N 0.00 0.00 -9.91 3.41 3.38 -1.54 -3.48 115.31 107.17 2b7k h LEU 134 Ca 0.00 -0.11 -0.52 0.00 0.09 0.00 0.00 57.88 57.34 2b7k h LEU 134 Cb 0.08 0.00 0.07 0.00 0.09 0.00 0.00 40.66 40.90 2b7k h LEU 134 CO 0.00 0.05 0.62 -0.76 0.09 0.00 0.00 178.44 178.45 2b7k s LEU 135 N -4.88 4.32 0.00 1.67 1.43 -1.10 -3.50 118.68 116.63 2b7k s LEU 135 Ca 0.03 2.66 0.00 0.00 -1.03 0.00 0.00 54.13 55.79 2b7k s LEU 135 Cb 0.11 -3.78 0.00 0.00 0.03 0.00 0.00 46.19 42.55 2b7k s LEU 135 CO 0.75 -0.69 0.00 0.61 0.23 0.00 0.00 176.35 177.26 2b7k n GLY 136 N 0.72 0.70 3.65 -3.19 0.00 0.51 -5.01 105.19 102.57 2b7k n GLY 136 Ca 0.02 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.96 2b7k n GLY 136 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2b7k s LYS 137 N -0.21 1.40 -0.20 1.61 -2.85 -1.23 -4.93 119.74 113.33 2b7k s LYS 137 Ca 0.00 -0.67 -0.20 0.00 -1.00 0.00 0.00 55.97 54.10 2b7k s LYS 137 Cb 0.00 0.54 -0.03 0.00 -2.06 0.00 0.00 37.83 36.28 2b7k s LYS 137 CO 0.00 -0.63 0.57 -0.06 0.10 0.00 0.00 175.35 175.33 2b7k s PHE 138 N -3.66 3.38 0.12 1.78 0.08 -1.26 -2.61 117.98 115.80 2b7k s PHE 138 Ca 0.07 0.85 0.08 0.00 0.12 0.00 0.00 56.93 58.06 2b7k s PHE 138 Cb -0.03 -2.73 -0.04 0.00 -0.57 0.00 0.00 43.02 39.65 2b7k s PHE 138 CO -0.02 -0.13 -0.15 -1.12 -0.10 0.00 0.00 175.22 173.69 2b7k s SER 139 N 1.17 4.07 -0.12 1.36 0.01 -0.24 -1.04 113.70 118.91 2b7k s SER 139 Ca 0.26 -0.50 -0.00 0.00 1.31 0.00 0.00 55.95 57.02 2b7k s SER 139 Cb -0.16 -0.65 0.02 0.00 0.21 0.00 0.00 66.02 65.45 2b7k s SER 139 CO 0.10 0.17 -0.08 -0.51 0.41 0.00 0.00 173.24 173.33 2b7k s ILE 140 N -1.19 1.11 -0.10 1.44 2.07 -0.56 -0.51 121.20 123.46 2b7k s ILE 140 Ca 0.19 -0.35 -0.01 0.00 -1.41 0.00 0.00 60.65 59.07 2b7k s ILE 140 Cb -0.11 -1.12 -0.03 0.00 0.13 0.00 0.00 42.46 41.34 2b7k s ILE 140 CO 0.12 0.37 -0.04 -0.63 -1.91 0.00 0.00 174.94 172.85 2b7k s ILE 141 N 1.67 3.92 -0.06 2.00 1.01 0.41 -0.87 121.20 129.28 2b7k s ILE 141 Ca 0.05 -0.38 0.01 0.00 0.00 0.00 0.00 60.65 60.33 2b7k s ILE 141 Cb -0.13 -2.65 0.02 0.00 0.01 0.00 0.00 42.46 39.72 2b7k s ILE 141 CO -0.09 0.57 -0.08 -0.47 0.00 0.00 0.00 174.94 174.87 2b7k s TYR 142 N -0.51 1.18 -0.18 3.97 5.04 -0.17 -0.38 117.35 126.30 2b7k s TYR 142 Ca 0.08 -0.43 -0.10 0.00 -2.44 0.00 0.00 57.07 54.18 2b7k s TYR 142 Cb -0.12 -0.93 -0.05 0.00 0.35 0.00 0.00 41.96 41.21 2b7k s TYR 142 CO 0.02 -0.28 0.15 -0.06 -1.34 0.00 0.00 175.55 174.05 2b7k s PHE 143 N 0.93 3.46 0.00 4.97 0.08 -1.26 -0.89 117.98 125.26 2b7k s PHE 143 Ca -0.10 0.41 0.00 0.00 0.12 0.00 0.00 56.93 57.35 2b7k s PHE 143 Cb -0.15 -2.14 0.00 0.00 -0.57 0.00 0.00 43.02 40.16 2b7k s PHE 143 CO 0.01 0.37 0.00 0.41 -0.10 0.00 0.00 175.22 175.91 2b7k n GLY 144 N 3.19 1.67 3.36 4.36 0.00 -0.79 -4.60 105.19 112.38 2b7k n GLY 144 Ca -0.16 -0.68 -0.15 0.00 0.00 0.00 0.00 46.02 45.02 2b7k n GLY 144 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2b7k s PHE 145 N -2.64 -0.40 0.52 1.61 -0.12 -1.26 -0.81 117.98 114.89 2b7k s PHE 145 Ca 0.00 0.66 0.18 0.00 -0.05 0.00 0.00 56.93 57.72 2b7k s PHE 145 Cb 0.00 0.24 1.32 0.00 -0.63 0.00 0.00 43.02 43.94 2b7k s PHE 145 CO 0.00 -0.49 2.12 0.66 -0.05 0.00 0.00 175.22 177.47 2b7k h SER 146 N 3.50 0.00 -0.35 1.98 4.64 -1.97 -1.95 113.55 119.39 2b7k h SER 146 Ca -0.28 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.04 2b7k h SER 146 Cb 1.16 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.25 2b7k h SER 146 CO 0.39 0.00 0.00 0.59 -0.87 0.00 0.00 176.83 176.94 2b7k n ASN 147 N -4.48 3.06 -4.70 4.97 4.13 -1.26 -4.90 115.26 112.08 2b7k n ASN 147 Ca -0.01 -2.32 -0.42 0.00 1.68 0.00 0.00 54.58 53.52 2b7k n ASN 147 Cb 0.19 -0.48 -0.03 0.00 -1.54 0.00 0.00 39.78 37.93 2b7k n ASN 147 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2b7k s PRO 149 N 1.48 4.36 0.00 0.00 0.04 -1.26 -4.59 135.00 135.03 2b7k s PRO 149 Ca 0.54 0.62 0.00 0.00 0.04 0.00 0.00 61.00 62.19 2b7k s PRO 149 Cb -0.23 -3.42 0.00 0.00 0.04 0.00 0.00 34.50 30.89 2b7k s PRO 149 CO 0.25 0.16 0.00 -0.25 0.04 0.00 0.00 177.00 177.20 2b7k n ASP 150 N 3.56 0.00 0.06 6.66 10.43 -1.26 -4.56 116.55 131.43 2b7k n ASP 150 Ca -0.05 0.00 -0.14 0.00 2.57 0.00 0.00 54.79 57.17 2b7k n ASP 150 Cb 0.51 0.00 -0.08 0.00 1.84 0.00 0.00 41.12 43.39 2b7k n ASP 150 CO 0.00 0.00 0.00 0.40 -1.07 0.00 0.00 177.20 176.53 2b7k h ILE 151 N 0.00 0.00 -0.19 0.53 5.03 -1.94 -0.95 117.51 119.99 2b7k h ILE 151 Ca 0.00 0.00 -0.02 0.00 -0.12 0.00 0.00 64.86 64.72 2b7k h ILE 151 Cb 0.00 0.00 -0.01 0.00 -3.03 0.00 0.00 36.82 33.78 2b7k h ILE 151 CO 0.00 0.00 0.04 0.00 -0.68 0.00 0.00 178.15 177.51 2b7k h PRO 153 N 0.11 0.79 -0.74 0.00 0.11 -1.79 -0.35 132.00 130.14 2b7k h PRO 153 Ca 0.06 -0.05 -0.05 0.00 0.11 0.00 0.00 66.00 66.07 2b7k h PRO 153 Cb 0.28 -0.18 -0.03 0.00 0.11 0.00 0.00 31.00 31.18 2b7k h PRO 153 CO 0.00 0.52 0.25 -0.44 -0.21 0.00 0.00 178.00 178.13 2b7k h ASP 154 N 0.82 1.06 -0.29 -2.05 3.32 -0.81 -0.79 116.42 117.68 2b7k h ASP 154 Ca 0.37 -0.19 -0.08 0.00 0.02 0.00 0.00 57.03 57.16 2b7k h ASP 154 Cb 0.27 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.54 2b7k h ASP 154 CO -0.21 0.97 -0.13 -0.33 -1.72 0.00 0.00 179.24 177.82 2b7k h GLU 155 N 1.09 0.59 -0.21 3.56 4.39 -0.63 -1.80 114.58 121.57 2b7k h GLU 155 Ca 0.24 -0.25 -0.06 0.00 0.34 0.00 0.00 59.36 59.63 2b7k h GLU 155 Cb 0.27 -0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 28.89 2b7k h GLU 155 CO -0.01 0.82 -0.14 -0.07 -1.16 0.00 0.00 179.01 178.45 2b7k h LEU 156 N 0.34 0.34 -0.27 1.33 3.38 -0.94 -0.32 115.31 119.17 2b7k h LEU 156 Ca 0.07 -0.08 -0.05 0.00 0.09 0.00 0.00 57.88 57.91 2b7k h LEU 156 Cb 0.64 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.29 2b7k h LEU 156 CO 0.04 0.51 -0.01 0.44 0.09 0.00 0.00 178.44 179.51 2b7k h ASP 157 N 0.33 0.48 -0.83 -0.43 3.45 -0.99 -1.84 116.42 116.59 2b7k h ASP 157 Ca 0.06 -0.32 0.01 0.00 0.43 0.00 0.00 57.03 57.21 2b7k h ASP 157 Cb 0.45 -0.13 -0.04 0.00 -0.56 0.00 0.00 39.33 39.05 2b7k h ASP 157 CO 0.03 0.68 0.54 0.50 -1.57 0.00 0.00 179.24 179.42 2b7k h LYS 158 N 0.27 1.09 -0.96 3.56 3.64 -0.85 -2.14 116.57 121.19 2b7k h LYS 158 Ca 0.08 -0.07 -0.00 0.00 -1.27 0.00 0.00 60.65 59.39 2b7k h LYS 158 Cb 0.44 -0.24 -0.05 0.00 -0.41 0.00 0.00 32.23 31.97 2b7k h LYS 158 CO 0.02 0.73 0.60 1.25 -2.27 0.00 0.00 179.45 179.77 2b7k h LEU 159 N 1.12 1.14 -1.01 5.20 5.85 -0.86 -1.27 115.31 125.47 2b7k h LEU 159 Ca 0.30 -0.06 -0.03 0.00 0.84 0.00 0.00 57.88 58.94 2b7k h LEU 159 Cb -0.12 -0.29 -0.03 0.00 0.37 0.00 0.00 40.66 40.59 2b7k h LEU 159 CO -0.06 0.85 0.36 1.23 -0.34 0.00 0.00 178.44 180.48 2b7k h GLY 160 N 1.31 1.13 0.95 3.75 0.00 -0.70 0.37 103.07 109.89 2b7k h GLY 160 Ca 0.35 -0.55 -0.05 0.00 0.00 0.00 0.00 47.33 47.08 2b7k h GLY 160 CO -0.07 0.52 0.08 1.41 0.00 0.00 0.00 176.54 178.49 2b7k h LEU 161 N 1.05 0.67 0.13 3.11 3.38 -0.91 -2.25 115.31 120.50 2b7k h LEU 161 Ca 0.26 -0.25 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 2b7k h LEU 161 Cb 0.10 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.68 2b7k h LEU 161 CO -0.03 0.75 -0.06 -0.50 0.09 0.00 0.00 178.44 178.68 2b7k h TRP 162 N 0.56 -0.17 -0.49 1.13 6.55 -0.70 -1.76 115.95 121.07 2b7k h TRP 162 Ca 0.13 -0.00 0.07 0.00 0.95 0.00 0.00 58.89 60.04 2b7k h TRP 162 Cb 0.35 0.06 -0.06 0.00 -0.86 0.00 0.00 29.16 28.65 2b7k h TRP 162 CO 0.02 -0.10 0.16 -0.07 -1.05 0.00 0.00 178.44 177.41 2b7k h LEU 163 N -0.19 0.15 -0.78 -4.49 3.38 -0.87 0.15 115.31 112.67 2b7k h LEU 163 Ca -0.02 0.06 -0.10 0.00 0.09 0.00 0.00 57.88 57.92 2b7k h LEU 163 Cb 0.14 0.06 -0.02 0.00 0.09 0.00 0.00 40.66 40.93 2b7k h LEU 163 CO 0.03 0.11 -0.13 0.78 0.09 0.00 0.00 178.44 179.32 2b7k h ASN 164 N 0.33 0.78 -0.36 -0.43 -0.26 -1.32 -1.68 115.58 112.64 2b7k h ASN 164 Ca 0.24 -0.24 -0.13 0.00 -0.56 0.00 0.00 56.30 55.61 2b7k h ASN 164 Cb 0.27 -0.21 -0.01 0.00 -1.06 0.00 0.00 38.32 37.31 2b7k h ASN 164 CO -0.26 0.92 -0.28 0.74 -1.06 0.00 0.00 177.43 177.50 2b7k h THR 165 N 0.71 1.29 -0.23 2.81 2.02 -0.87 -1.44 112.91 117.19 2b7k h THR 165 Ca 0.12 -1.44 0.00 0.00 0.77 0.00 0.00 66.41 65.86 2b7k h THR 165 Cb 0.62 1.42 -0.01 0.00 -1.74 0.00 0.00 68.15 68.44 2b7k h THR 165 CO 0.04 0.47 0.15 -0.07 0.37 0.00 0.00 175.52 176.49 2b7k h LEU 166 N 0.61 0.27 -0.11 2.58 3.38 -0.50 0.01 115.31 121.53 2b7k h LEU 166 Ca 0.07 -0.01 -0.08 0.00 0.09 0.00 0.00 57.88 57.95 2b7k h LEU 166 Cb 0.85 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.54 2b7k h LEU 166 CO 0.07 0.20 -0.22 0.77 0.09 0.00 0.00 178.44 179.35 2b7k h SER 167 N 0.31 0.39 -0.24 -0.43 4.64 -1.00 -1.03 113.55 116.20 2b7k h SER 167 Ca 0.08 -0.56 -0.13 0.00 -0.47 0.00 0.00 61.79 60.72 2b7k h SER 167 Cb -0.03 -0.11 -0.00 0.00 -0.31 0.00 0.00 62.40 61.95 2b7k h SER 167 CO -0.02 0.88 -0.35 0.77 -0.87 0.00 0.00 176.83 177.24 2b7k h SER 168 N -0.07 0.72 0.59 4.97 4.64 -1.25 -1.65 113.55 121.49 2b7k h SER 168 Ca 0.00 -0.51 -0.24 0.00 -0.47 0.00 0.00 61.79 60.58 2b7k h SER 168 Cb 0.81 -0.20 -0.04 0.00 -0.31 0.00 0.00 62.40 62.65 2b7k h SER 168 CO 0.05 1.09 -1.57 0.29 -0.87 0.00 0.00 176.83 175.82 2b7k n LYS 169 N -4.26 0.63 0.00 4.77 5.02 -0.02 -4.53 118.16 119.78 2b7k n LYS 169 Ca -0.05 0.27 0.00 0.00 -2.02 0.00 0.00 58.31 56.51 2b7k n LYS 169 Cb 0.50 -1.80 0.00 0.00 -0.02 0.00 0.00 35.03 33.71 2b7k n LYS 169 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 2b7k n TYR 170 N -2.97 0.00 -2.57 2.13 4.02 -0.70 -5.01 117.16 112.05 2b7k n TYR 170 Ca -0.14 0.00 -0.20 0.00 -0.01 0.00 0.00 57.90 57.56 2b7k n TYR 170 Cb 0.96 0.00 0.01 0.00 -0.02 0.00 0.00 39.34 40.28 2b7k n TYR 170 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2b7k n GLY 171 N 0.19 -0.42 3.70 2.72 0.00 -0.52 -4.95 105.19 105.91 2b7k n GLY 171 Ca 0.00 -0.03 -0.35 0.00 0.00 0.00 0.00 46.02 45.64 2b7k n GLY 171 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2b7k s ILE 172 N -3.02 5.03 -0.18 -0.61 1.01 -0.51 -4.92 121.20 118.00 2b7k s ILE 172 Ca 0.10 0.05 0.01 0.00 0.00 0.00 0.00 60.65 60.80 2b7k s ILE 172 Cb -0.04 -3.25 0.03 0.00 0.01 0.00 0.00 42.46 39.20 2b7k s ILE 172 CO 0.12 0.49 -0.18 -0.89 0.00 0.00 0.00 174.94 174.49 2b7k s THR 173 N 0.04 1.96 0.40 2.92 2.01 -1.26 -2.50 115.64 119.21 2b7k s THR 173 Ca 0.07 -0.96 0.08 0.00 0.31 0.00 0.00 61.69 61.18 2b7k s THR 173 Cb -0.12 -1.83 -0.00 0.00 0.01 0.00 0.00 72.50 70.56 2b7k s THR 173 CO 0.00 0.45 0.49 -0.76 -0.69 0.00 0.00 174.62 174.11 2b7k s LEU 174 N 1.31 3.66 -0.62 4.42 1.43 -1.26 -4.72 118.68 122.89 2b7k s LEU 174 Ca 0.03 -0.45 -0.08 0.00 -1.03 0.00 0.00 54.13 52.60 2b7k s LEU 174 Cb -0.14 -2.52 0.16 0.00 0.03 0.00 0.00 46.19 43.72 2b7k s LEU 174 CO -0.12 -0.65 0.49 -1.58 0.23 0.00 0.00 176.35 174.73 2b7k s GLN 175 N -4.25 2.80 -0.02 1.70 0.74 -0.21 -4.99 119.66 115.44 2b7k s GLN 175 Ca 0.51 -2.24 -0.28 0.00 0.05 0.00 0.00 55.36 53.39 2b7k s GLN 175 Cb -0.08 -3.98 -0.03 0.00 1.10 0.00 0.00 33.01 30.02 2b7k s GLN 175 CO 0.31 -1.21 0.91 -1.25 -0.55 0.00 0.00 175.29 173.50 2b7k s PRO 176 N 0.50 4.53 -0.06 1.67 0.04 -1.26 -1.49 135.00 138.93 2b7k s PRO 176 Ca 0.13 1.28 0.03 0.00 0.04 0.00 0.00 61.00 62.47 2b7k s PRO 176 Cb -0.20 -3.46 0.01 0.00 0.04 0.00 0.00 34.50 30.90 2b7k s PRO 176 CO -0.04 -0.02 -0.14 -0.51 0.04 0.00 0.00 177.00 176.34 2b7k s LEU 177 N 0.94 1.72 -0.32 -3.56 1.43 -0.05 -1.58 118.68 117.26 2b7k s LEU 177 Ca 0.48 -0.32 -0.06 0.00 -1.03 0.00 0.00 54.13 53.20 2b7k s LEU 177 Cb -0.20 -0.87 0.03 0.00 0.03 0.00 0.00 46.19 45.19 2b7k s LEU 177 CO 0.25 0.06 0.09 0.12 0.23 0.00 0.00 176.35 177.10 2b7k s PHE 178 N 0.51 3.23 -0.22 0.29 2.19 -0.03 -1.00 117.98 122.94 2b7k s PHE 178 Ca -0.12 -1.36 -0.08 0.00 0.33 0.00 0.00 56.93 55.70 2b7k s PHE 178 Cb -0.15 -2.25 -0.04 0.00 -1.31 0.00 0.00 43.02 39.27 2b7k s PHE 178 CO 0.04 -0.70 0.08 0.42 1.83 0.00 0.00 175.22 176.88 2b7k s ILE 179 N 1.41 4.58 0.38 3.12 1.01 -0.07 -0.12 121.20 131.51 2b7k s ILE 179 Ca -0.01 -0.09 -0.24 0.00 0.00 0.00 0.00 60.65 60.31 2b7k s ILE 179 Cb -0.19 -3.11 -0.10 0.00 0.01 0.00 0.00 42.46 39.07 2b7k s ILE 179 CO 0.02 0.38 0.97 0.28 0.00 0.00 0.00 174.94 176.59 2b7k s THR 180 N 1.12 4.18 -1.42 2.92 -1.32 -1.01 -1.88 115.64 118.22 2b7k s THR 180 Ca 0.05 1.60 0.15 0.00 -1.21 0.00 0.00 61.69 62.28 2b7k s THR 180 Cb -0.14 -3.80 0.41 0.00 -1.51 0.00 0.00 72.50 67.46 2b7k s THR 180 CO 0.03 -0.05 1.33 0.00 -2.21 0.00 0.00 174.62 173.72 2b7k n ASP 182 N 0.96 2.10 0.30 0.00 2.03 -1.26 -4.94 116.55 115.74 2b7k n ASP 182 Ca 0.16 -3.09 0.20 0.00 0.52 0.00 0.00 54.79 52.58 2b7k n ASP 182 Cb 0.49 -0.66 1.07 0.00 -0.72 0.00 0.00 41.12 41.31 2b7k n ASP 182 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 2b7k h PRO 183 N 4.12 0.00 -0.49 -0.67 0.13 -1.87 -1.04 132.00 132.18 2b7k h PRO 183 Ca 0.14 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 65.16 2b7k h PRO 183 Cb 0.76 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.88 2b7k h PRO 183 CO 0.66 0.00 -0.14 0.00 -0.23 0.00 0.00 178.00 178.29 2b7k h ALA 184 N 1.97 0.82 0.00 -0.56 0.00 -1.92 -3.37 119.26 116.20 2b7k h ALA 184 Ca 0.00 -0.35 -0.17 0.00 0.00 0.00 0.00 54.91 54.39 2b7k h ALA 184 Cb 0.03 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.60 2b7k h ALA 184 CO 0.00 0.66 -1.62 0.54 0.00 0.00 0.00 179.25 178.82 2b7k n ARG 185 N -4.14 2.49 -2.23 0.00 1.74 -1.03 -4.85 116.66 108.64 2b7k n ARG 185 Ca 0.01 -0.00 -0.43 0.00 -0.77 0.00 0.00 57.85 56.66 2b7k n ARG 185 Cb 0.41 -1.23 0.00 0.00 -1.02 0.00 0.00 32.46 30.62 2b7k n ARG 185 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 2b7k n ASP 186 N -2.34 4.61 -4.77 0.55 9.92 -0.42 -4.81 116.55 119.28 2b7k n ASP 186 Ca -0.15 -2.95 -0.29 0.00 -0.53 0.00 0.00 54.79 50.87 2b7k n ASP 186 Cb 0.80 -1.61 0.12 0.00 -0.64 0.00 0.00 41.12 39.78 2b7k n ASP 186 CO 0.00 0.00 0.00 -0.94 0.13 0.00 0.00 177.20 176.39 2b7k s SER 187 N 2.70 3.91 0.26 -2.24 1.04 -1.26 -4.76 113.70 113.34 2b7k s SER 187 Ca 0.46 0.82 -0.02 0.00 0.48 0.00 0.00 55.95 57.68 2b7k s SER 187 Cb 0.09 -1.30 0.45 0.00 0.10 0.00 0.00 66.02 65.35 2b7k s SER 187 CO -0.02 -2.29 1.82 -0.65 0.98 0.00 0.00 173.24 173.09 2b7k h PRO 188 N -1.32 0.87 -0.64 4.02 0.11 -1.90 -1.23 132.00 131.90 2b7k h PRO 188 Ca -0.48 -0.05 -0.07 0.00 0.11 0.00 0.00 66.00 65.51 2b7k h PRO 188 Cb 1.32 -0.20 -0.03 0.00 0.11 0.00 0.00 31.00 32.21 2b7k h PRO 188 CO 0.62 0.57 0.13 0.00 -0.21 0.00 0.00 178.00 179.11 2b7k h ALA 189 N 1.48 0.84 -0.72 -0.75 0.00 -1.93 -1.46 119.26 116.73 2b7k h ALA 189 Ca 0.43 -0.25 -0.06 0.00 0.00 0.00 0.00 54.91 55.04 2b7k h ALA 189 Cb 0.38 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.90 2b7k h ALA 189 CO -0.25 0.58 0.22 0.28 0.00 0.00 0.00 179.25 180.08 2b7k h VAL 190 N 0.95 1.26 -0.48 0.00 2.07 -1.72 -2.14 116.25 116.20 2b7k h VAL 190 Ca 0.20 -0.91 -0.12 0.00 0.82 0.00 0.00 66.70 66.69 2b7k h VAL 190 Cb 0.39 0.48 -0.02 0.00 -1.52 0.00 0.00 31.29 30.63 2b7k h VAL 190 CO 0.01 0.35 -0.16 -0.07 0.02 0.00 0.00 177.57 177.72 2b7k h LEU 191 N 1.07 0.94 -0.57 2.57 3.38 -1.03 -0.70 115.31 120.97 2b7k h LEU 191 Ca 0.23 -0.33 0.00 0.00 0.09 0.00 0.00 57.88 57.88 2b7k h LEU 191 Cb 0.31 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.78 2b7k h LEU 191 CO -0.01 1.09 0.36 0.11 0.09 0.00 0.00 178.44 180.08 2b7k h LYS 192 N 0.82 0.77 -0.33 1.13 1.57 -1.03 0.45 116.57 119.95 2b7k h LYS 192 Ca 0.12 -0.06 -0.09 0.00 -1.87 0.00 0.00 60.65 58.75 2b7k h LYS 192 Cb 0.71 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.84 2b7k h LYS 192 CO 0.05 0.53 -0.15 1.49 -0.57 0.00 0.00 179.45 180.80 2b7k h GLU 193 N 0.77 0.68 -0.29 3.15 4.81 -1.23 -2.24 114.58 120.24 2b7k h GLU 193 Ca 0.21 -0.30 -0.01 0.00 -0.13 0.00 0.00 59.36 59.14 2b7k h GLU 193 Cb -0.05 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.29 2b7k h GLU 193 CO -0.04 0.89 0.16 -0.92 -0.73 0.00 0.00 179.01 178.36 2b7k h TYR 194 N 0.45 0.39 0.00 0.92 3.20 -0.93 -2.83 116.97 118.17 2b7k h TYR 194 Ca 0.07 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.93 2b7k h TYR 194 Cb 0.68 -0.13 0.00 0.00 1.54 0.00 0.00 36.73 38.83 2b7k h TYR 194 CO 0.06 0.32 0.00 1.28 -1.64 0.00 0.00 178.16 178.18 2b7k n LEU 195 N -4.83 0.31 0.26 2.82 4.77 0.13 -3.05 117.00 117.42 2b7k n LEU 195 Ca -0.02 0.55 0.18 0.00 -0.03 0.00 0.00 56.01 56.69 2b7k n LEU 195 Cb 0.08 -0.49 0.89 0.00 -2.33 0.00 0.00 43.42 41.56 2b7k n LEU 195 CO 0.35 -0.26 1.03 0.77 -1.33 0.00 0.00 177.39 177.95 2b7k h SER 196 N 0.00 0.00 -0.28 -1.43 4.64 -1.13 0.08 113.55 115.42 2b7k h SER 196 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2b7k h SER 196 Cb 0.42 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.51 2b7k h SER 196 CO 0.00 0.00 0.00 0.47 -0.87 0.00 0.00 176.83 176.43 2b7k n ASP 197 N -2.78 2.28 -3.21 4.97 10.43 -1.17 -4.94 116.55 122.14 2b7k n ASP 197 Ca -0.01 -1.85 -0.18 0.00 2.57 0.00 0.00 54.79 55.32 2b7k n ASP 197 Cb 0.12 -0.18 -0.05 0.00 1.84 0.00 0.00 41.12 42.85 2b7k n ASP 197 CO 0.00 0.00 0.00 0.49 -1.07 0.00 0.00 177.20 176.62 2b7k n PHE 198 N 0.73 0.25 -1.64 1.24 3.01 0.01 -5.06 117.46 116.00 2b7k n PHE 198 Ca 0.17 -1.70 -0.50 0.00 1.01 0.00 0.00 57.45 56.43 2b7k n PHE 198 Cb 0.41 -0.05 -0.05 0.00 -0.01 0.00 0.00 39.48 39.78 2b7k n PHE 198 CO 0.00 0.00 0.00 1.58 1.01 0.00 0.00 176.76 179.35 2b7k n HIS 199 N -0.65 1.96 0.31 1.38 -0.00 -1.26 -4.84 115.22 112.12 2b7k n HIS 199 Ca -0.06 0.41 0.19 0.00 -0.00 0.00 0.00 57.72 58.26 2b7k n HIS 199 Cb 0.41 -2.47 1.04 0.00 -0.00 0.00 0.00 29.99 28.97 2b7k n HIS 199 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 176.34 174.99 2b7k h PRO 200 N 5.83 0.00 0.00 1.57 0.11 -1.95 -2.48 132.00 135.08 2b7k h PRO 200 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 2b7k h PRO 200 Cb 1.29 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.40 2b7k h PRO 200 CO 0.86 0.00 0.00 0.77 -0.21 0.00 0.00 178.00 179.42 2b7k h SER 201 N 0.00 0.00 -2.80 -2.05 0.02 -1.96 -3.45 113.55 103.32 2b7k h SER 201 Ca 0.01 0.00 -0.53 0.00 -0.84 0.00 0.00 61.79 60.43 2b7k h SER 201 Cb 0.20 0.00 0.02 0.00 0.14 0.00 0.00 62.40 62.76 2b7k h SER 201 CO -0.00 0.00 0.91 -0.63 -1.14 0.00 0.00 176.83 175.97 2b7k s ILE 202 N -3.27 3.19 -0.20 3.27 1.01 -0.94 -4.47 121.20 119.80 2b7k s ILE 202 Ca 0.07 0.69 -0.04 0.00 0.00 0.00 0.00 60.65 61.36 2b7k s ILE 202 Cb 0.07 -3.44 -0.02 0.00 0.01 0.00 0.00 42.46 39.08 2b7k s ILE 202 CO 0.63 0.01 -0.02 -0.22 0.00 0.00 0.00 174.94 175.34 2b7k s LEU 203 N 2.23 3.14 0.10 2.97 2.96 -0.62 -4.94 118.68 124.52 2b7k s LEU 203 Ca 0.70 -0.25 -0.26 0.00 -0.22 0.00 0.00 54.13 54.10 2b7k s LEU 203 Cb -0.38 -1.79 -0.06 0.00 0.50 0.00 0.00 46.19 44.46 2b7k s LEU 203 CO 0.30 0.06 0.81 -0.83 -1.32 0.00 0.00 176.35 175.37 2b7k s GLY 204 N 1.03 2.88 -0.00 7.98 0.00 -1.26 -0.85 107.32 117.10 2b7k s GLY 204 Ca 0.01 0.37 0.08 0.00 0.00 0.00 0.00 44.72 45.18 2b7k s GLY 204 CO 0.01 1.11 -0.25 1.08 0.00 0.00 0.00 173.10 175.05 2b7k s LEU 205 N -0.38 2.08 0.00 0.66 1.43 0.83 -0.48 118.68 122.82 2b7k s LEU 205 Ca 0.39 -0.48 -0.02 0.00 -1.03 0.00 0.00 54.13 52.99 2b7k s LEU 205 Cb -0.22 -1.26 0.01 0.00 0.03 0.00 0.00 46.19 44.75 2b7k s LEU 205 CO 0.25 0.29 0.22 1.07 0.23 0.00 0.00 176.35 178.41 2b7k n THR 206 N 2.29 0.00 -3.10 5.49 5.66 -0.22 -2.42 114.28 121.99 2b7k n THR 206 Ca -0.16 -0.60 0.00 0.00 -3.05 0.00 0.00 64.05 60.24 2b7k n THR 206 Cb 0.52 0.41 0.00 0.00 -1.55 0.00 0.00 70.33 69.71 2b7k n THR 206 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2b7k n GLY 207 N -0.22 -0.55 3.84 1.09 0.00 -1.26 -0.86 105.19 107.23 2b7k n GLY 207 Ca -0.01 -0.75 -0.29 0.00 0.00 0.00 0.00 46.02 44.97 2b7k n GLY 207 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2b7k s THR 208 N -3.07 2.46 0.19 2.61 -4.23 -1.26 -4.79 115.64 107.54 2b7k s THR 208 Ca 0.00 0.15 -0.12 0.00 -1.18 0.00 0.00 61.69 60.53 2b7k s THR 208 Cb 0.00 -3.01 0.10 0.00 1.34 0.00 0.00 72.50 70.93 2b7k s THR 208 CO 0.00 -0.19 1.74 -0.26 -0.54 0.00 0.00 174.62 175.37 2b7k h PHE 209 N -1.15 0.30 -0.54 3.99 0.05 -1.99 -0.85 116.94 116.75 2b7k h PHE 209 Ca -0.48 0.03 0.00 0.00 3.82 0.00 0.00 57.97 61.34 2b7k h PHE 209 Cb 1.31 -0.06 -0.03 0.00 2.00 0.00 0.00 35.95 39.17 2b7k h PHE 209 CO 0.37 0.09 0.35 -0.44 -0.18 0.00 0.00 178.31 178.49 2b7k h ASP 210 N 0.35 0.62 -0.45 2.17 3.45 -1.99 0.14 116.42 120.72 2b7k h ASP 210 Ca 0.25 -0.03 -0.06 0.00 0.43 0.00 0.00 57.03 57.62 2b7k h ASP 210 Cb 0.27 -0.16 -0.02 0.00 -0.56 0.00 0.00 39.33 38.87 2b7k h ASP 210 CO -0.26 0.46 0.05 -0.33 -1.57 0.00 0.00 179.24 177.60 2b7k h GLU 211 N 0.73 0.75 -0.33 3.56 5.08 -1.76 -1.96 114.58 120.66 2b7k h GLU 211 Ca 0.20 -0.21 -0.09 0.00 -1.00 0.00 0.00 59.36 58.26 2b7k h GLU 211 Cb -0.07 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.09 2b7k h GLU 211 CO -0.04 0.79 -0.13 0.28 -1.00 0.00 0.00 179.01 178.90 2b7k h VAL 212 N 0.61 1.29 -0.81 3.13 2.07 -1.00 -2.11 116.25 119.43 2b7k h VAL 212 Ca 0.13 -1.23 0.07 0.00 0.82 0.00 0.00 66.70 66.49 2b7k h VAL 212 Cb 0.41 1.39 -0.06 0.00 -1.52 0.00 0.00 31.29 31.51 2b7k h VAL 212 CO 0.01 0.40 0.48 0.50 0.02 0.00 0.00 177.57 178.98 2b7k h LYS 213 N 0.44 0.85 -0.30 1.57 3.64 -0.67 -0.28 116.57 121.82 2b7k h LYS 213 Ca 0.08 -0.05 -0.04 0.00 -1.27 0.00 0.00 60.65 59.37 2b7k h LYS 213 Cb 0.65 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 32.27 2b7k h LYS 213 CO 0.04 0.56 0.05 -0.97 -2.27 0.00 0.00 179.45 176.86 2b7k h ASN 214 N 0.87 0.48 -0.54 4.20 -1.24 -1.21 -1.20 115.58 116.95 2b7k h ASN 214 Ca 0.36 -0.26 0.02 0.00 0.71 0.00 0.00 56.30 57.12 2b7k h ASN 214 Cb 0.20 -0.13 -0.03 0.00 0.73 0.00 0.00 38.32 39.09 2b7k h ASN 214 CO -0.18 0.63 0.34 0.00 -1.29 0.00 0.00 177.43 176.92 2b7k h ALA 215 N 0.88 0.69 -0.69 1.57 0.00 -0.72 -0.43 119.26 120.57 2b7k h ALA 215 Ca 0.09 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.95 2b7k h ALA 215 Cb 0.35 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.93 2b7k h ALA 215 CO 0.01 0.07 0.29 0.00 0.00 0.00 0.00 179.25 179.62 2b7k h LYS 217 N 0.98 0.82 -0.05 0.00 3.64 -0.42 0.70 116.57 122.24 2b7k h LYS 217 Ca 0.23 -0.23 -0.01 0.00 -1.27 0.00 0.00 60.65 59.37 2b7k h LYS 217 Cb 0.16 -0.09 -0.00 0.00 -0.41 0.00 0.00 32.23 31.88 2b7k h LYS 217 CO -0.02 0.83 -0.03 0.87 -2.27 0.00 0.00 179.45 178.83 2b7k h LYS 218 N 0.70 0.07 -0.58 1.90 6.56 -0.80 -1.62 116.57 122.80 2b7k h LYS 218 Ca 0.15 -0.01 0.00 0.00 -1.06 0.00 0.00 60.65 59.73 2b7k h LYS 218 Cb 0.42 -0.01 0.00 0.00 -0.57 0.00 0.00 32.23 32.06 2b7k h LYS 218 CO 0.01 0.11 0.00 0.66 -2.06 0.00 0.00 179.45 178.17 2b7k n TYR 219 N -4.46 0.77 -3.82 -1.35 4.02 -1.05 -0.90 117.16 110.38 2b7k n TYR 219 Ca -0.02 -0.42 -0.26 0.00 -0.01 0.00 0.00 57.90 57.18 2b7k n TYR 219 Cb 0.14 -0.00 0.03 0.00 -0.02 0.00 0.00 39.34 39.49 2b7k n TYR 219 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 2b7k n ARG 220 N 1.45 -5.39 -2.91 -0.72 1.74 -0.59 -4.89 116.66 105.35 2b7k n ARG 220 Ca 0.21 0.62 -0.21 0.00 -0.77 0.00 0.00 57.85 57.70 2b7k n ARG 220 Cb 0.59 -5.38 0.08 0.00 -1.02 0.00 0.00 32.46 26.73 2b7k n ARG 220 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2b7k s VAL 221 N -3.46 2.11 0.00 1.55 1.01 0.14 -5.02 120.40 116.72 2b7k s VAL 221 Ca 0.39 -0.89 0.00 0.00 0.00 0.00 0.00 61.98 61.49 2b7k s VAL 221 Cb -0.19 -2.22 0.00 0.00 0.00 0.00 0.00 36.38 33.97 2b7k s VAL 221 CO 0.82 0.00 0.00 0.18 0.00 0.00 0.00 175.10 176.10 2b7k n LEU 236 N -2.43 2.58 -0.12 3.92 7.99 -1.26 -5.03 117.00 122.66 2b7k n LEU 236 Ca 0.16 0.00 -0.10 0.00 -0.01 0.00 0.00 56.01 56.05 2b7k n LEU 236 Cb 0.61 0.00 -0.02 0.00 -0.11 0.00 0.00 43.42 43.90 2b7k n LEU 236 CO 0.40 0.43 0.80 0.58 -1.51 0.00 0.00 177.39 178.10 2b7k h VAL 237 N 0.00 1.25 0.00 4.08 2.07 -1.99 -2.45 116.25 119.21 2b7k h VAL 237 Ca 0.00 -0.90 -0.00 0.00 0.82 0.00 0.00 66.70 66.62 2b7k h VAL 237 Cb 0.99 1.16 -0.00 0.00 -1.52 0.00 0.00 31.29 31.92 2b7k h VAL 237 CO 0.00 0.30 -0.00 0.44 0.02 0.00 0.00 177.57 178.33 2b7k h ASP 238 N 0.41 0.00 -0.11 0.57 3.45 -2.03 -2.98 116.42 115.73 2b7k h ASP 238 Ca 0.10 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.56 2b7k h ASP 238 Cb 0.40 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.17 2b7k h ASP 238 CO 0.01 0.00 0.00 1.41 -1.57 0.00 0.00 179.24 179.09 2b7k n HIS 239 N -3.10 0.13 -2.20 4.55 8.25 -1.14 -4.61 115.22 117.10 2b7k n HIS 239 Ca -0.02 -0.15 -0.40 0.00 -0.26 0.00 0.00 57.72 56.89 2b7k n HIS 239 Cb 0.16 -0.01 0.00 0.00 1.12 0.00 0.00 29.99 31.27 2b7k n HIS 239 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 2b7k n SER 240 N 0.54 7.76 0.00 0.41 7.64 -0.93 -4.50 113.62 124.54 2b7k n SER 240 Ca 0.07 -3.35 0.00 0.00 1.01 0.00 0.00 58.87 56.61 2b7k n SER 240 Cb 0.31 -1.28 0.00 0.00 -1.01 0.00 0.00 64.21 62.22 2b7k n SER 240 CO 0.00 0.00 0.00 2.30 -3.01 0.00 0.00 175.04 174.33 2b7k n ILE 241 N 1.03 0.00 -4.22 0.44 -5.35 -1.26 -4.76 119.36 105.24 2b7k n ILE 241 Ca 0.57 -0.50 -0.28 0.00 -0.27 0.00 0.00 62.75 62.27 2b7k n ILE 241 Cb 0.26 1.00 -0.09 0.00 -1.74 0.00 0.00 39.64 39.07 2b7k n ILE 241 CO 0.00 0.00 0.00 -0.36 -1.76 0.00 0.00 176.55 174.43 2b7k s PHE 242 N -0.58 2.77 -0.13 4.28 0.40 -1.26 -3.82 117.98 119.64 2b7k s PHE 242 Ca 0.00 -0.15 -0.03 0.00 -0.60 0.00 0.00 56.93 56.15 2b7k s PHE 242 Cb 0.00 -1.39 -0.03 0.00 0.51 0.00 0.00 43.02 42.11 2b7k s PHE 242 CO 0.00 0.48 -0.04 -0.06 0.70 0.00 0.00 175.22 176.30 2b7k s PHE 243 N -1.51 3.02 -0.27 0.36 0.40 -0.51 -4.42 117.98 115.05 2b7k s PHE 243 Ca 0.25 -0.17 -0.07 0.00 -0.60 0.00 0.00 56.93 56.33 2b7k s PHE 243 Cb -0.10 -1.89 -0.01 0.00 0.51 0.00 0.00 43.02 41.53 2b7k s PHE 243 CO 0.16 0.10 0.08 0.71 0.70 0.00 0.00 175.22 176.97 2b7k s TYR 244 N -0.03 3.11 -0.22 0.36 1.51 0.48 -0.55 117.35 122.00 2b7k s TYR 244 Ca 0.01 -0.68 -0.17 0.00 -1.01 0.00 0.00 57.07 55.22 2b7k s TYR 244 Cb -0.13 -2.25 -0.03 0.00 -0.11 0.00 0.00 41.96 39.43 2b7k s TYR 244 CO 0.03 -0.46 0.48 -1.17 -1.11 0.00 0.00 175.55 173.31 2b7k s LEU 245 N 1.56 4.11 -0.08 -1.29 2.96 0.31 -0.45 118.68 125.81 2b7k s LEU 245 Ca 0.05 0.56 0.03 0.00 -0.22 0.00 0.00 54.13 54.55 2b7k s LEU 245 Cb -0.16 -2.63 -0.01 0.00 0.50 0.00 0.00 46.19 43.89 2b7k s LEU 245 CO 0.03 -0.19 -0.19 -0.04 -1.32 0.00 0.00 176.35 174.64 2b7k s MET 246 N 1.79 2.85 0.88 1.98 -1.94 0.33 -1.52 119.30 123.66 2b7k s MET 246 Ca 0.21 -0.79 -0.14 0.00 -1.71 0.00 0.00 55.69 53.26 2b7k s MET 246 Cb -0.15 -2.36 0.13 0.00 2.01 0.00 0.00 34.83 34.46 2b7k s MET 246 CO 0.09 0.36 1.24 0.16 -0.01 0.00 0.00 175.02 176.86 2b7k s ASP 247 N -0.07 3.88 0.18 3.03 1.47 0.22 -1.08 116.67 124.30 2b7k s ASP 247 Ca -0.05 0.53 0.09 0.00 1.18 0.00 0.00 52.55 54.31 2b7k s ASP 247 Cb -0.14 -0.82 0.51 0.00 -0.34 0.00 0.00 42.92 42.13 2b7k s ASP 247 CO 0.04 -2.28 1.21 -2.65 0.68 0.00 0.00 175.17 172.18 2b7k n PRO 248 N -3.51 0.06 -0.30 2.11 -0.02 -1.07 0.18 135.00 132.45 2b7k n PRO 248 Ca 0.11 0.51 0.11 0.00 -2.02 0.00 0.00 63.50 62.21 2b7k n PRO 248 Cb 0.60 -1.84 0.27 0.00 -0.02 0.00 0.00 33.50 32.52 2b7k n PRO 248 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2b7k n GLU 249 N -1.81 2.64 -1.09 -0.52 1.02 -1.26 -0.36 120.64 119.26 2b7k n GLU 249 Ca -0.01 -2.48 -0.03 0.00 -0.02 0.00 0.00 57.16 54.62 2b7k n GLU 249 Cb 0.15 -1.52 -0.01 0.00 -0.02 0.00 0.00 31.44 30.03 2b7k n GLU 249 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2b7k n GLY 250 N 1.49 0.61 3.88 0.62 0.00 0.13 -4.93 105.19 106.99 2b7k n GLY 250 Ca 0.22 -0.57 -0.35 0.00 0.00 0.00 0.00 46.02 45.32 2b7k n GLY 250 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2b7k s GLN 251 N -1.72 3.64 0.05 1.61 -1.52 -1.25 -4.81 119.66 115.67 2b7k s GLN 251 Ca 0.00 0.02 -0.31 0.00 -1.95 0.00 0.00 55.36 53.13 2b7k s GLN 251 Cb 0.00 -3.08 -0.06 0.00 -0.22 0.00 0.00 33.01 29.64 2b7k s GLN 251 CO 0.00 0.64 1.33 0.12 -0.25 0.00 0.00 175.29 177.13 2b7k s PHE 252 N -1.28 3.16 -0.01 0.91 5.36 -1.26 -0.61 117.98 124.26 2b7k s PHE 252 Ca 0.27 1.02 0.01 0.00 -0.96 0.00 0.00 56.93 57.28 2b7k s PHE 252 Cb -0.14 -3.59 -0.02 0.00 -0.34 0.00 0.00 43.02 38.93 2b7k s PHE 252 CO 0.15 -2.04 0.02 1.33 -1.46 0.00 0.00 175.22 173.23 2b7k n VAL 253 N 4.22 0.03 -3.61 3.12 0.24 -0.57 -4.92 118.33 116.84 2b7k n VAL 253 Ca 0.11 -0.04 -0.05 0.00 -2.04 0.00 0.00 64.34 62.31 2b7k n VAL 253 Cb 0.44 -0.02 -0.04 0.00 -1.47 0.00 0.00 33.84 32.75 2b7k n VAL 253 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 2b7k s ASP 254 N -2.52 -0.17 -0.08 -1.34 2.15 -1.21 -5.03 116.67 108.48 2b7k s ASP 254 Ca -0.01 0.15 0.05 0.00 0.43 0.00 0.00 52.55 53.17 2b7k s ASP 254 Cb 0.01 0.15 -0.01 0.00 -0.30 0.00 0.00 42.92 42.77 2b7k s ASP 254 CO 0.06 -0.19 -0.25 0.00 -0.17 0.00 0.00 175.17 174.63 2b7k s ALA 255 N -1.40 2.17 -0.31 3.66 0.00 -1.26 -0.53 121.76 124.09 2b7k s ALA 255 Ca 0.05 -1.02 -0.06 0.00 0.00 0.00 0.00 51.96 50.94 2b7k s ALA 255 Cb -0.01 -0.73 0.02 0.00 0.00 0.00 0.00 23.12 22.40 2b7k s ALA 255 CO -0.04 0.36 0.08 -0.51 0.00 0.00 0.00 175.76 175.65 2b7k s LEU 256 N 0.04 4.00 0.00 0.00 1.02 0.28 -4.90 118.68 119.12 2b7k s LEU 256 Ca -0.10 -0.89 -0.02 0.00 0.02 0.00 0.00 54.13 53.14 2b7k s LEU 256 Cb -0.15 -1.86 0.05 0.00 0.02 0.00 0.00 46.19 44.24 2b7k s LEU 256 CO 0.06 -0.24 0.29 0.61 0.02 0.00 0.00 176.35 177.09 2b7k n GLY 257 N 4.83 -0.26 0.03 -3.19 0.00 -1.26 -1.42 105.19 103.92 2b7k n GLY 257 Ca -0.14 -1.82 0.08 0.00 0.00 0.00 0.00 46.02 44.14 2b7k n GLY 257 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2b7k n ARG 258 N -1.59 0.04 0.00 1.61 1.74 -1.25 -2.39 116.66 114.82 2b7k n ARG 258 Ca 0.04 0.28 0.13 0.00 -0.77 0.00 0.00 57.85 57.54 2b7k n ARG 258 Cb 0.15 -1.58 0.69 0.00 -1.02 0.00 0.00 32.46 30.70 2b7k n ARG 258 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 2b7k n ASN 259 N -1.66 0.00 -4.75 0.55 3.02 -1.26 -4.63 115.26 106.53 2b7k n ASN 259 Ca 0.03 -0.21 -0.37 0.00 -0.03 0.00 0.00 54.58 54.01 2b7k n ASN 259 Cb 0.18 -0.24 -0.07 0.00 -0.61 0.00 0.00 39.78 39.04 2b7k n ASN 259 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 2b7k s TYR 260 N -2.49 3.49 0.19 3.10 1.51 -1.01 -5.02 117.35 117.13 2b7k s TYR 260 Ca 0.28 0.63 0.03 0.00 -1.01 0.00 0.00 57.07 56.99 2b7k s TYR 260 Cb 0.18 -2.31 0.03 0.00 -0.11 0.00 0.00 41.96 39.75 2b7k s TYR 260 CO 0.39 0.31 0.23 -0.40 -1.11 0.00 0.00 175.55 174.97 2b7k n ASP 261 N 3.30 0.91 0.22 2.29 3.85 -1.26 -4.79 116.55 121.07 2b7k n ASP 261 Ca -0.13 -1.53 0.18 0.00 -0.71 0.00 0.00 54.79 52.60 2b7k n ASP 261 Cb 0.52 -0.11 0.83 0.00 -1.35 0.00 0.00 41.12 41.01 2b7k n ASP 261 CO 0.00 0.00 0.00 1.05 -1.01 0.00 0.00 177.20 177.24 2b7k h GLU 262 N 0.00 0.00 0.00 0.11 9.09 -1.98 -2.11 114.58 119.69 2b7k h GLU 262 Ca -0.10 0.00 -0.43 0.00 0.05 0.00 0.00 59.36 58.88 2b7k h GLU 262 Cb 0.41 0.00 -0.06 0.00 -1.65 0.00 0.00 28.75 27.45 2b7k h GLU 262 CO 0.14 0.00 -2.43 1.63 0.05 0.00 0.00 179.01 178.40 2b7k n LYS 263 N -3.47 0.56 0.22 1.06 4.01 -1.26 -4.29 118.16 114.99 2b7k n LYS 263 Ca 0.02 0.24 0.06 0.00 -0.51 0.00 0.00 58.31 58.13 2b7k n LYS 263 Cb 0.41 -1.44 0.51 0.00 -0.51 0.00 0.00 35.03 34.01 2b7k n LYS 263 CO 0.00 0.00 0.00 1.79 -1.11 0.00 0.00 177.40 178.08 2b7k h THR 264 N -0.95 1.02 -0.45 -0.18 1.35 -1.93 -2.31 112.91 109.46 2b7k h THR 264 Ca -0.65 -0.81 -0.08 0.00 -0.55 0.00 0.00 66.41 64.32 2b7k h THR 264 Cb 1.57 1.45 -0.02 0.00 -1.73 0.00 0.00 68.15 69.43 2b7k h THR 264 CO -0.40 0.22 -0.02 1.23 -0.25 0.00 0.00 175.52 176.31 2b7k h GLY 265 N 0.82 0.87 0.97 5.82 0.00 -1.62 -2.30 103.07 107.63 2b7k h GLY 265 Ca -0.00 -0.66 -0.02 0.00 0.00 0.00 0.00 47.33 46.65 2b7k h GLY 265 CO 0.03 0.60 0.23 -2.08 0.00 0.00 0.00 176.54 175.32 2b7k h VAL 266 N 0.65 1.18 -0.77 4.60 2.07 -1.64 -2.32 116.25 120.02 2b7k h VAL 266 Ca 0.13 -0.52 0.08 0.00 0.82 0.00 0.00 66.70 67.20 2b7k h VAL 266 Cb 0.52 0.67 -0.07 0.00 -1.52 0.00 0.00 31.29 30.90 2b7k h VAL 266 CO 0.03 0.20 0.44 0.44 0.02 0.00 0.00 177.57 178.70 2b7k h ASP 267 N 0.61 0.64 -0.52 0.57 3.32 -1.24 -0.81 116.42 119.00 2b7k h ASP 267 Ca 0.16 0.04 -0.09 0.00 0.02 0.00 0.00 57.03 57.16 2b7k h ASP 267 Cb 0.12 -0.09 -0.02 0.00 0.22 0.00 0.00 39.33 39.56 2b7k h ASP 267 CO -0.02 0.39 -0.03 0.50 -1.72 0.00 0.00 179.24 178.35 2b7k h LYS 268 N 0.77 0.94 -0.27 3.56 1.63 -1.21 -2.23 116.57 119.76 2b7k h LYS 268 Ca 0.36 -0.32 -0.05 0.00 -0.85 0.00 0.00 60.65 59.79 2b7k h LYS 268 Cb 0.28 -0.08 -0.01 0.00 -0.60 0.00 0.00 32.23 31.82 2b7k h LYS 268 CO -0.22 0.98 -0.03 0.82 -3.45 0.00 0.00 179.45 177.54 2b7k h ILE 269 N 0.81 1.27 -0.51 2.00 2.04 -0.96 -2.83 117.51 119.34 2b7k h ILE 269 Ca 0.14 -1.01 0.07 0.00 1.00 0.00 0.00 64.86 65.06 2b7k h ILE 269 Cb 0.57 1.38 -0.06 0.00 -0.74 0.00 0.00 36.82 37.98 2b7k h ILE 269 CO 0.03 0.32 0.18 0.58 0.00 0.00 0.00 178.15 179.26 2b7k h VAL 270 N 0.28 0.82 -0.53 1.67 2.07 -1.10 -0.94 116.25 118.51 2b7k h VAL 270 Ca 0.07 -0.12 0.10 0.00 0.82 0.00 0.00 66.70 67.57 2b7k h VAL 270 Cb 0.49 0.44 -0.08 0.00 -1.52 0.00 0.00 31.29 30.62 2b7k h VAL 270 CO 0.02 0.06 0.10 -0.08 0.02 0.00 0.00 177.57 177.69 2b7k h GLU 271 N 0.35 0.22 -0.31 1.57 4.81 -1.29 -0.11 114.58 119.82 2b7k h GLU 271 Ca 0.24 -0.01 -0.05 0.00 -0.13 0.00 0.00 59.36 59.41 2b7k h GLU 271 Cb 0.26 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.58 2b7k h GLU 271 CO -0.25 0.15 -0.02 0.45 -0.73 0.00 0.00 179.01 178.61 2b7k h HIS 272 N 0.23 0.61 -0.14 0.92 3.86 -1.13 -2.51 115.15 116.99 2b7k h HIS 272 Ca 0.27 -0.11 -0.02 0.00 -1.16 0.00 0.00 60.37 59.35 2b7k h HIS 272 Cb 0.39 -0.16 -0.01 0.00 1.06 0.00 0.00 27.41 28.70 2b7k h HIS 272 CO -0.25 0.70 0.00 0.28 0.86 0.00 0.00 177.93 179.53 2b7k h VAL 273 N 0.34 1.25 0.00 2.45 2.07 -0.79 -2.45 116.25 119.12 2b7k h VAL 273 Ca 0.08 -0.80 -0.05 0.00 0.82 0.00 0.00 66.70 66.76 2b7k h VAL 273 Cb 0.47 1.51 -0.01 0.00 -1.52 0.00 0.00 31.29 31.74 2b7k h VAL 273 CO 0.02 0.23 -0.22 0.11 0.02 0.00 0.00 177.57 177.73 2b7k h LYS 274 N -0.01 0.00 -0.01 1.57 1.57 -1.10 -2.99 116.57 115.59 2b7k h LYS 274 Ca 0.04 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.82 2b7k h LYS 274 Cb 0.35 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.66 2b7k h LYS 274 CO 0.01 0.22 -0.32 -1.13 -0.57 0.00 0.00 179.45 177.66 2b7k n SER 275 N -3.42 1.77 -4.77 0.86 3.41 -0.95 -4.97 113.62 105.55 2b7k n SER 275 Ca -0.00 -1.36 -0.41 0.00 -0.26 0.00 0.00 58.87 56.84 2b7k n SER 275 Cb 0.42 0.28 -0.01 0.00 -0.26 0.00 0.00 64.21 64.65 2b7k n SER 275 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 175.04 174.41 2b7k s TYR 276 N -2.40 2.73 -0.07 7.33 5.04 -0.92 -5.03 117.35 124.03 2b7k s TYR 276 Ca 0.23 1.22 -0.03 0.00 -2.44 0.00 0.00 57.07 56.05 2b7k s TYR 276 Cb 0.19 -3.92 0.04 0.00 0.35 0.00 0.00 41.96 38.61 2b7k s TYR 276 CO 0.51 -2.69 0.15 0.08 -1.34 0.00 0.00 175.55 172.26 2b7k s VAL 277 N -1.06 -0.05 0.98 3.14 1.01 -1.26 -5.07 120.40 118.09 2b7k s VAL 277 Ca 0.52 0.18 -0.11 0.00 0.00 0.00 0.00 61.98 62.57 2b7k s VAL 277 Cb -0.45 -0.24 0.18 0.00 0.00 0.00 0.00 36.38 35.87 2b7k s VAL 277 CO 0.59 0.07 1.10 -2.16 0.00 0.00 0.00 175.10 174.70 2b7k s PRO 278 N 1.17 0.54 0.00 2.72 0.04 -1.26 -5.15 135.00 133.07 2b7k s PRO 278 Ca -0.09 1.18 0.00 0.00 0.04 0.00 0.00 61.00 62.13 2b7k s PRO 278 Cb -0.12 -1.70 0.00 0.00 0.04 0.00 0.00 34.50 32.73 2b7k s PRO 278 CO -0.06 -2.84 0.11 0.00 0.04 0.00 0.00 177.00 174.25