#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bn5 s VAL 111 N 0.00 4.93 0.52 0.58 1.01 -1.26 -4.82 120.40 121.36 1bn5 s VAL 111 Ca 0.00 -0.99 -0.20 0.00 0.00 0.00 0.00 61.98 60.79 1bn5 s VAL 111 Cb 0.00 -3.73 -0.06 0.00 0.00 0.00 0.00 36.38 32.58 1bn5 s VAL 111 CO 0.00 -0.28 1.13 -1.58 0.00 0.00 0.00 175.10 174.37 1bn5 s GLN 112 N -4.04 3.49 0.61 2.72 2.00 -1.26 -4.96 119.66 118.23 1bn5 s GLN 112 Ca 0.37 1.64 -0.03 0.00 -2.00 0.00 0.00 55.36 55.33 1bn5 s GLN 112 Cb -0.09 -2.12 0.04 0.00 0.80 0.00 0.00 33.01 31.64 1bn5 s GLN 112 CO 0.30 -0.74 0.89 0.95 -0.50 0.00 0.00 175.29 176.19 1bn5 s THR 113 N -1.73 2.83 0.00 -0.34 -4.23 -1.26 -5.04 115.64 105.88 1bn5 s THR 113 Ca 0.70 -0.35 0.00 0.00 -1.18 0.00 0.00 61.69 60.85 1bn5 s THR 113 Cb -0.25 -3.14 0.00 0.00 1.34 0.00 0.00 72.50 70.46 1bn5 s THR 113 CO 0.28 -0.13 0.55 -0.67 -0.54 0.00 0.00 174.62 174.12 1bn5 n ASP 114 N -2.60 0.00 -4.68 3.99 -0.08 -1.26 -3.45 116.55 108.47 1bn5 n ASP 114 Ca 0.07 0.55 -0.42 0.00 -1.51 0.00 0.00 54.79 53.48 1bn5 n ASP 114 Cb 0.59 -0.05 -0.03 0.00 2.34 0.00 0.00 41.12 43.97 1bn5 n ASP 114 CO 0.00 0.00 0.00 -2.16 0.12 0.00 0.00 177.20 175.16 1bn5 s PRO 115 N -1.21 4.22 0.23 -0.67 0.04 -1.26 -4.97 135.00 131.38 1bn5 s PRO 115 Ca 0.00 2.16 -0.30 0.00 0.04 0.00 0.00 61.00 62.90 1bn5 s PRO 115 Cb 0.00 -3.72 -0.09 0.00 0.04 0.00 0.00 34.50 30.73 1bn5 s PRO 115 CO 0.00 -0.72 1.33 -2.14 0.04 0.00 0.00 177.00 175.51 1bn5 s PRO 116 N 3.04 4.37 0.00 0.56 0.02 -1.22 -4.89 135.00 136.87 1bn5 s PRO 116 Ca 0.70 2.12 0.00 0.00 0.02 0.00 0.00 61.00 63.84 1bn5 s PRO 116 Cb -0.35 -3.16 0.00 0.00 0.02 0.00 0.00 34.50 31.01 1bn5 s PRO 116 CO 0.29 -0.26 0.00 -1.13 -0.33 0.00 0.00 177.00 175.57 1bn5 n SER 117 N 2.25 0.00 -4.66 2.53 3.41 -1.26 -4.93 113.62 110.96 1bn5 n SER 117 Ca 0.05 0.00 -0.41 0.00 -0.26 0.00 0.00 58.87 58.25 1bn5 n SER 117 Cb 0.42 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.33 1bn5 n SER 117 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1bn5 s VAL 118 N 0.00 4.89 0.46 -3.33 1.01 -1.26 -4.78 120.40 117.39 1bn5 s VAL 118 Ca 0.00 1.56 -0.23 0.00 0.00 0.00 0.00 61.98 63.31 1bn5 s VAL 118 Cb 0.00 -4.11 -0.09 0.00 0.00 0.00 0.00 36.38 32.18 1bn5 s VAL 118 CO 0.00 0.02 1.06 -2.65 0.00 0.00 0.00 175.10 173.53 1bn5 n PRO 119 N 5.32 1.39 -0.26 2.72 -0.02 -1.26 -4.77 135.00 138.13 1bn5 n PRO 119 Ca 0.04 0.50 0.07 0.00 -2.02 0.00 0.00 63.50 62.09 1bn5 n PRO 119 Cb 0.49 -2.14 0.31 0.00 -0.02 0.00 0.00 33.50 32.14 1bn5 n PRO 119 CO 0.00 0.00 0.00 0.82 1.98 0.00 0.00 175.50 178.30 1bn5 h ILE 120 N 1.45 0.98 0.00 4.25 1.08 -1.51 -1.69 117.51 122.07 1bn5 h ILE 120 Ca -0.46 -0.29 -0.02 0.00 -0.39 0.00 0.00 64.86 63.70 1bn5 h ILE 120 Cb 1.33 0.06 -0.00 0.00 -3.07 0.00 0.00 36.82 35.14 1bn5 h ILE 120 CO 0.56 0.15 -0.10 0.00 -0.69 0.00 0.00 178.15 178.07 1bn5 h ASP 122 N 0.00 0.00 1.37 0.00 3.32 -1.66 -3.31 116.42 116.14 1bn5 h ASP 122 Ca -0.00 -0.04 -0.10 0.00 0.02 0.00 0.00 57.03 56.91 1bn5 h ASP 122 Cb 0.39 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.92 1bn5 h ASP 122 CO 0.01 0.02 -0.66 -0.07 -1.72 0.00 0.00 179.24 176.83 1bn5 h LEU 123 N 0.00 0.00 -6.86 1.55 3.38 -1.25 -3.30 115.31 108.83 1bn5 h LEU 123 Ca 0.00 0.00 -0.61 0.00 0.09 0.00 0.00 57.88 57.36 1bn5 h LEU 123 Cb 0.83 0.00 -0.41 0.00 0.09 0.00 0.00 40.66 41.17 1bn5 h LEU 123 CO 0.00 0.43 -0.71 -0.31 0.09 0.00 0.00 178.44 177.95 1bn5 s TYR 124 N -3.00 2.71 0.42 1.13 2.02 -1.09 -4.86 117.35 114.67 1bn5 s TYR 124 Ca 0.03 -2.98 0.11 0.00 -0.37 0.00 0.00 57.07 53.86 1bn5 s TYR 124 Cb 0.08 -2.11 0.89 0.00 -0.40 0.00 0.00 41.96 40.41 1bn5 s TYR 124 CO 0.75 -0.65 1.97 -1.35 -1.57 0.00 0.00 175.55 174.70 1bn5 h PRO 125 N 5.57 0.18 -0.01 -1.71 0.11 -1.79 -2.35 132.00 132.00 1bn5 h PRO 125 Ca 0.17 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.25 1bn5 h PRO 125 Cb 0.81 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 31.90 1bn5 h PRO 125 CO 0.60 0.29 0.00 0.09 -0.21 0.00 0.00 178.00 178.77 1bn5 n ASN 126 N -4.32 0.18 0.00 -2.05 3.02 -1.26 -4.89 115.26 105.93 1bn5 n ASN 126 Ca -0.01 -1.19 0.00 0.00 -0.03 0.00 0.00 54.58 53.34 1bn5 n ASN 126 Cb 0.23 -0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.40 1bn5 n ASN 126 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1bn5 n GLY 127 N 0.95 0.47 3.28 7.41 0.00 -0.88 -5.00 105.19 111.42 1bn5 n GLY 127 Ca 0.20 -0.42 -0.35 0.00 0.00 0.00 0.00 46.02 45.45 1bn5 n GLY 127 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1bn5 s VAL 128 N -2.00 3.34 0.28 1.61 1.01 -1.26 -5.01 120.40 118.37 1bn5 s VAL 128 Ca 0.00 -0.71 0.08 0.00 0.00 0.00 0.00 61.98 61.35 1bn5 s VAL 128 Cb 0.00 -2.62 -0.04 0.00 0.00 0.00 0.00 36.38 33.73 1bn5 s VAL 128 CO 0.00 0.28 0.18 -0.36 0.00 0.00 0.00 175.10 175.20 1bn5 s PHE 129 N 1.43 2.96 0.27 5.22 0.08 -1.26 -4.92 117.98 121.76 1bn5 s PHE 129 Ca 0.03 -0.20 -0.30 0.00 0.12 0.00 0.00 56.93 56.59 1bn5 s PHE 129 Cb -0.16 -1.48 -0.10 0.00 -0.57 0.00 0.00 43.02 40.71 1bn5 s PHE 129 CO -0.02 0.44 1.46 -2.14 -0.10 0.00 0.00 175.22 174.86 1bn5 s PRO 130 N -3.85 4.24 0.65 0.24 0.02 -1.26 -4.95 135.00 130.09 1bn5 s PRO 130 Ca 0.35 2.36 -0.16 0.00 0.02 0.00 0.00 61.00 63.57 1bn5 s PRO 130 Cb -0.07 -3.08 -0.00 0.00 0.02 0.00 0.00 34.50 31.37 1bn5 s PRO 130 CO 0.24 -0.44 1.13 0.15 -0.33 0.00 0.00 177.00 177.75 1bn5 s LYS 131 N -0.61 2.79 0.00 5.54 1.02 -1.26 -4.83 119.74 122.38 1bn5 s LYS 131 Ca 0.59 1.49 0.00 0.00 0.02 0.00 0.00 55.97 58.07 1bn5 s LYS 131 Cb -0.43 -1.94 0.00 0.00 -0.52 0.00 0.00 37.83 34.94 1bn5 s LYS 131 CO 0.46 -1.28 0.00 0.41 -0.92 0.00 0.00 175.35 174.02 1bn5 n GLY 132 N -0.25 -0.36 3.68 -3.33 0.00 -1.26 -5.00 105.19 98.67 1bn5 n GLY 132 Ca 0.11 -1.71 -0.42 0.00 0.00 0.00 0.00 46.02 44.00 1bn5 n GLY 132 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1bn5 s GLN 133 N -0.07 4.26 -0.16 1.61 0.74 -0.95 -4.82 119.66 120.28 1bn5 s GLN 133 Ca 0.00 1.90 -0.08 0.00 0.05 0.00 0.00 55.36 57.23 1bn5 s GLN 133 Cb 0.00 -3.69 -0.04 0.00 1.10 0.00 0.00 33.01 30.38 1bn5 s GLN 133 CO 0.00 -0.64 0.12 -1.21 -0.55 0.00 0.00 175.29 173.02 1bn5 s GLU 134 N 2.92 3.77 -0.02 1.67 2.02 -1.26 -0.56 118.70 127.23 1bn5 s GLU 134 Ca 0.62 -0.20 0.03 0.00 0.02 0.00 0.00 54.97 55.44 1bn5 s GLU 134 Cb -0.29 -3.27 -0.00 0.00 0.10 0.00 0.00 34.13 30.67 1bn5 s GLU 134 CO 0.24 0.54 -0.09 0.00 0.02 0.00 0.00 175.26 175.97 1bn5 s GLU 136 N 0.06 3.71 0.45 0.00 1.03 -1.26 -1.32 118.70 121.37 1bn5 s GLU 136 Ca -0.01 2.16 -0.24 0.00 0.03 0.00 0.00 54.97 56.91 1bn5 s GLU 136 Cb -0.07 -2.58 -0.07 0.00 -0.80 0.00 0.00 34.13 30.61 1bn5 s GLU 136 CO 0.00 -0.71 1.30 0.71 -1.33 0.00 0.00 175.26 175.24 1bn5 s TYR 137 N -1.30 2.66 -0.51 4.83 2.02 -1.26 -4.82 117.35 118.97 1bn5 s TYR 137 Ca 0.62 1.41 0.00 0.00 -0.37 0.00 0.00 57.07 58.72 1bn5 s TYR 137 Cb -0.38 -3.67 0.00 0.00 -0.40 0.00 0.00 41.96 37.50 1bn5 s TYR 137 CO 0.48 -2.27 0.00 -0.35 -1.57 0.00 0.00 175.55 171.84 1bn5 n PRO 138 N -0.30 0.00 0.00 -1.71 -0.04 -1.26 -5.13 135.00 126.57 1bn5 n PRO 138 Ca 0.06 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.52 1bn5 n PRO 138 Cb 0.45 -0.98 0.00 0.00 -0.04 0.00 0.00 33.50 32.92 1bn5 n PRO 138 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1bn5 n GLU 153 N 0.52 0.00 -0.01 0.54 1.02 -1.26 -5.04 120.64 116.41 1bn5 n GLU 153 Ca 0.00 0.00 -0.04 0.00 -0.02 0.00 0.00 57.16 57.10 1bn5 n GLU 153 Cb 0.00 0.00 0.17 0.00 -0.02 0.00 0.00 31.44 31.59 1bn5 n GLU 153 CO 0.00 0.00 0.00 1.49 1.18 0.00 0.00 177.13 179.80 1bn5 h GLU 154 N 0.00 0.55 -0.00 3.49 4.81 -2.04 -2.80 114.58 118.60 1bn5 h GLU 154 Ca 0.00 -0.21 -0.15 0.00 -0.13 0.00 0.00 59.36 58.87 1bn5 h GLU 154 Cb 0.00 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.33 1bn5 h GLU 154 CO 0.00 0.75 -0.72 0.87 -0.73 0.00 0.00 179.01 179.18 1bn5 h LYS 155 N 0.49 0.01 -0.08 1.92 1.57 -1.98 -0.81 116.57 117.69 1bn5 h LYS 155 Ca 0.07 -0.01 -0.12 0.00 -1.87 0.00 0.00 60.65 58.72 1bn5 h LYS 155 Cb 0.68 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.98 1bn5 h LYS 155 CO 0.05 0.72 -0.50 -0.22 -0.57 0.00 0.00 179.45 178.93 1bn5 h LYS 156 N 0.01 0.20 -0.34 3.15 3.11 -1.90 0.25 116.57 121.04 1bn5 h LYS 156 Ca -0.01 -0.11 -0.12 0.00 -2.81 0.00 0.00 60.65 57.60 1bn5 h LYS 156 Cb 1.27 0.01 -0.01 0.00 -1.00 0.00 0.00 32.23 32.50 1bn5 h LYS 156 CO 0.09 0.66 -0.27 0.00 -2.81 0.00 0.00 179.45 177.12 1bn5 h ALA 157 N 1.33 0.49 -0.63 5.00 0.00 -1.22 -2.27 119.26 121.96 1bn5 h ALA 157 Ca 0.01 -0.40 -0.05 0.00 0.00 0.00 0.00 54.91 54.46 1bn5 h ALA 157 Cb 0.94 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.59 1bn5 h ALA 157 CO 0.08 0.50 0.18 1.25 0.00 0.00 0.00 179.25 181.25 1bn5 h LEU 158 N 0.57 0.91 -0.26 0.00 5.85 -0.82 -1.89 115.31 119.67 1bn5 h LEU 158 Ca 0.06 -0.17 -0.03 0.00 0.84 0.00 0.00 57.88 58.59 1bn5 h LEU 158 Cb 0.84 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.62 1bn5 h LEU 158 CO 0.07 0.86 0.04 -0.78 -0.34 0.00 0.00 178.44 178.30 1bn5 h ASP 159 N 0.93 0.41 0.48 1.25 1.82 -0.94 -3.14 116.42 117.24 1bn5 h ASP 159 Ca 0.20 -0.26 -0.06 0.00 -0.39 0.00 0.00 57.03 56.53 1bn5 h ASP 159 Cb 0.30 -0.11 -0.01 0.00 0.68 0.00 0.00 39.33 40.19 1bn5 h ASP 159 CO -0.00 0.56 -0.29 -0.61 -1.61 0.00 0.00 179.24 177.29 1bn5 h GLN 160 N 0.23 0.00 0.00 0.28 5.75 -1.26 -2.46 115.11 117.65 1bn5 h GLN 160 Ca 0.08 0.00 -0.04 0.00 -0.15 0.00 0.00 58.65 58.54 1bn5 h GLN 160 Cb 0.33 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 28.87 1bn5 h GLN 160 CO 0.00 0.29 -0.17 0.00 -2.65 0.00 0.00 178.83 176.30 1bn5 h ALA 161 N 1.71 1.55 -0.54 3.38 0.00 -1.29 -2.51 119.26 121.57 1bn5 h ALA 161 Ca -0.00 -0.15 -0.09 0.00 0.00 0.00 0.00 54.91 54.67 1bn5 h ALA 161 Cb 0.61 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.32 1bn5 h ALA 161 CO 0.04 0.21 0.09 0.43 0.00 0.00 0.00 179.25 180.02 1bn5 n SER 162 N -4.09 4.75 -0.28 0.00 7.64 -0.93 -4.68 113.62 116.03 1bn5 n SER 162 Ca -0.02 -3.12 0.06 0.00 1.01 0.00 0.00 58.87 56.80 1bn5 n SER 162 Cb 0.25 -0.67 0.28 0.00 -1.01 0.00 0.00 64.21 63.06 1bn5 n SER 162 CO 0.00 0.00 0.00 -0.08 -3.01 0.00 0.00 175.04 171.95 1bn5 h GLU 163 N 2.78 0.90 -0.59 1.43 4.57 -1.46 -0.81 114.58 121.39 1bn5 h GLU 163 Ca 0.11 -0.05 -0.01 0.00 -1.18 0.00 0.00 59.36 58.22 1bn5 h GLU 163 Cb 1.95 -0.20 -0.03 0.00 -0.16 0.00 0.00 28.75 30.31 1bn5 h GLU 163 CO 0.51 0.60 0.33 0.93 -1.18 0.00 0.00 179.01 180.19 1bn5 h GLU 164 N 0.93 0.81 -0.33 1.92 5.08 -1.84 -1.46 114.58 119.68 1bn5 h GLU 164 Ca 0.40 -0.08 -0.07 0.00 -1.00 0.00 0.00 59.36 58.61 1bn5 h GLU 164 Cb 0.32 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.39 1bn5 h GLU 164 CO -0.16 0.59 -0.06 0.82 -1.00 0.00 0.00 179.01 179.20 1bn5 h ILE 165 N 0.82 1.27 -0.72 3.13 2.04 -1.53 -2.20 117.51 120.33 1bn5 h ILE 165 Ca 0.21 -1.09 -0.06 0.00 1.00 0.00 0.00 64.86 64.92 1bn5 h ILE 165 Cb 0.02 1.31 -0.03 0.00 -0.74 0.00 0.00 36.82 37.38 1bn5 h ILE 165 CO -0.04 0.35 0.21 -0.50 0.00 0.00 0.00 178.15 178.18 1bn5 h TRP 166 N 0.41 1.17 -0.54 1.37 -0.00 -1.23 -1.92 115.95 115.21 1bn5 h TRP 166 Ca 0.09 -0.12 -0.07 0.00 -0.00 0.00 0.00 58.89 58.79 1bn5 h TRP 166 Cb 0.54 -0.34 -0.02 0.00 -0.00 0.00 0.00 29.16 29.34 1bn5 h TRP 166 CO 0.05 0.93 0.06 -0.97 -0.00 0.00 0.00 178.44 178.50 1bn5 h ASN 167 N 1.07 0.83 -0.51 -3.49 -1.24 -1.21 -0.25 115.58 110.79 1bn5 h ASN 167 Ca 0.23 -0.19 -0.04 0.00 0.71 0.00 0.00 56.30 57.02 1bn5 h ASN 167 Cb 0.32 -0.22 -0.02 0.00 0.73 0.00 0.00 38.32 39.13 1bn5 h ASN 167 CO -0.00 0.86 0.17 0.44 -1.29 0.00 0.00 177.43 177.61 1bn5 h ASP 168 N 0.82 0.72 -0.90 1.15 3.32 -0.75 -1.48 116.42 119.30 1bn5 h ASP 168 Ca 0.17 -0.19 0.00 0.00 0.02 0.00 0.00 57.03 57.03 1bn5 h ASP 168 Cb 0.41 -0.19 -0.04 0.00 0.22 0.00 0.00 39.33 39.72 1bn5 h ASP 168 CO 0.01 0.72 0.58 -0.26 -1.72 0.00 0.00 179.24 178.58 1bn5 h PHE 169 N 0.68 1.15 -0.38 4.55 0.04 -0.92 -2.30 116.94 119.76 1bn5 h PHE 169 Ca 0.17 0.02 -0.08 0.00 2.80 0.00 0.00 57.97 60.87 1bn5 h PHE 169 Cb 0.25 -0.39 -0.02 0.00 2.20 0.00 0.00 35.95 37.99 1bn5 h PHE 169 CO 0.01 0.74 -0.10 0.00 -0.60 0.00 0.00 178.31 178.36 1bn5 h ARG 170 N 1.23 0.66 -0.49 1.51 3.08 -0.73 0.36 114.38 120.00 1bn5 h ARG 170 Ca 0.33 -0.20 -0.02 0.00 0.07 0.00 0.00 59.98 60.16 1bn5 h ARG 170 Cb -0.11 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 29.85 1bn5 h ARG 170 CO -0.07 0.75 0.24 1.49 -1.07 0.00 0.00 179.97 181.31 1bn5 h GLU 171 N 0.61 0.71 -0.37 0.04 4.81 -1.10 -0.26 114.58 119.02 1bn5 h GLU 171 Ca 0.11 -0.11 -0.09 0.00 -0.13 0.00 0.00 59.36 59.15 1bn5 h GLU 171 Cb 0.53 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.77 1bn5 h GLU 171 CO 0.03 0.60 -0.13 0.00 -0.73 0.00 0.00 179.01 178.78 1bn5 h ALA 172 N 1.08 1.08 -0.21 2.92 0.00 -1.11 -2.32 119.26 120.70 1bn5 h ALA 172 Ca 0.17 -0.31 -0.15 0.00 0.00 0.00 0.00 54.91 54.63 1bn5 h ALA 172 Cb 0.12 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 1bn5 h ALA 172 CO -0.02 0.57 -0.48 0.00 0.00 0.00 0.00 179.25 179.31 1bn5 h ALA 173 N 1.26 0.77 -0.24 0.00 0.00 -0.62 -1.63 119.26 118.80 1bn5 h ALA 173 Ca 0.10 -0.48 -0.11 0.00 0.00 0.00 0.00 54.91 54.42 1bn5 h ALA 173 Cb 0.57 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 1bn5 h ALA 173 CO 0.04 0.67 -0.31 1.49 0.00 0.00 0.00 179.25 181.13 1bn5 h GLU 174 N 0.44 0.50 -0.55 0.00 4.57 -0.83 -0.05 114.58 118.67 1bn5 h GLU 174 Ca 0.02 -0.21 -0.02 0.00 -1.18 0.00 0.00 59.36 57.97 1bn5 h GLU 174 Cb 1.00 -0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 29.55 1bn5 h GLU 174 CO 0.09 0.76 0.26 0.00 -1.18 0.00 0.00 179.01 178.94 1bn5 h ALA 175 N 1.24 0.71 -0.54 2.92 0.00 -1.24 -1.84 119.26 120.51 1bn5 h ALA 175 Ca 0.05 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 54.81 1bn5 h ALA 175 Cb 0.76 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.31 1bn5 h ALA 175 CO 0.06 0.28 0.25 1.25 0.00 0.00 0.00 179.25 181.09 1bn5 h HIS 176 N 0.74 0.78 -0.23 0.00 -0.00 -0.84 0.18 115.15 115.79 1bn5 h HIS 176 Ca 0.19 -0.04 0.03 0.00 -0.00 0.00 0.00 60.37 60.55 1bn5 h HIS 176 Cb 0.13 -0.24 -0.03 0.00 -0.00 0.00 0.00 27.41 27.27 1bn5 h HIS 176 CO -0.00 0.62 0.03 0.00 -0.00 0.00 0.00 177.93 178.58 1bn5 h ARG 177 N 0.72 0.12 -0.20 5.26 3.08 -0.86 -1.25 114.38 121.24 1bn5 h ARG 177 Ca 0.18 -0.01 -0.16 0.00 0.07 0.00 0.00 59.98 60.07 1bn5 h ARG 177 Cb 0.14 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.15 1bn5 h ARG 177 CO -0.02 0.08 -0.52 1.96 -1.07 0.00 0.00 179.97 180.39 1bn5 h GLN 178 N 0.12 0.57 0.28 0.04 4.20 -0.87 -2.38 115.11 117.07 1bn5 h GLN 178 Ca 0.10 -0.34 -0.01 0.00 0.06 0.00 0.00 58.65 58.46 1bn5 h GLN 178 Cb 0.11 0.03 0.00 0.00 0.30 0.00 0.00 27.48 27.93 1bn5 h GLN 178 CO -0.15 0.95 -0.14 0.28 -0.67 0.00 0.00 178.83 179.11 1bn5 h VAL 179 N 0.44 0.76 -0.39 -0.54 2.07 -0.80 -2.80 116.25 114.99 1bn5 h VAL 179 Ca 0.01 -0.37 -0.04 0.00 0.82 0.00 0.00 66.70 67.13 1bn5 h VAL 179 Cb 1.06 0.97 -0.02 0.00 -1.52 0.00 0.00 31.29 31.77 1bn5 h VAL 179 CO 0.10 0.08 0.08 0.08 0.02 0.00 0.00 177.57 177.92 1bn5 h ARG 180 N -0.57 0.58 -0.75 1.57 0.11 -1.24 -0.32 114.38 113.76 1bn5 h ARG 180 Ca -0.04 -0.10 0.03 0.00 0.10 0.00 0.00 59.98 59.97 1bn5 h ARG 180 Cb 0.42 -0.10 -0.05 0.00 1.11 0.00 0.00 29.97 31.36 1bn5 h ARG 180 CO 0.06 0.55 0.47 -0.22 0.10 0.00 0.00 179.97 180.93 1bn5 h LYS 181 N 0.57 0.88 -0.25 0.08 3.64 -1.41 -1.00 116.57 119.08 1bn5 h LYS 181 Ca 0.13 -0.05 -0.02 0.00 -1.27 0.00 0.00 60.65 59.44 1bn5 h LYS 181 Cb 0.24 -0.20 -0.01 0.00 -0.41 0.00 0.00 32.23 31.85 1bn5 h LYS 181 CO -0.00 0.58 0.08 -0.92 -2.27 0.00 0.00 179.45 176.93 1bn5 h TYR 182 N 0.91 0.39 -0.54 1.91 3.20 -1.16 -2.76 116.97 118.92 1bn5 h TYR 182 Ca 0.30 -0.04 0.07 0.00 3.14 0.00 0.00 58.73 62.20 1bn5 h TYR 182 Cb 0.04 -0.11 -0.06 0.00 1.54 0.00 0.00 36.73 38.13 1bn5 h TYR 182 CO -0.04 0.43 0.22 0.28 -1.64 0.00 0.00 178.16 177.42 1bn5 h VAL 183 N 0.24 0.86 0.00 1.81 2.07 -0.86 -1.22 116.25 119.14 1bn5 h VAL 183 Ca 0.08 -0.15 -0.02 0.00 0.82 0.00 0.00 66.70 67.44 1bn5 h VAL 183 Cb 0.22 0.39 -0.00 0.00 -1.52 0.00 0.00 31.29 30.38 1bn5 h VAL 183 CO -0.00 0.08 -0.08 0.24 0.02 0.00 0.00 177.57 177.83 1bn5 h MET 184 N 0.43 0.00 0.00 1.57 2.86 -0.97 -0.93 114.93 117.89 1bn5 h MET 184 Ca 0.26 0.00 -0.06 0.00 -2.06 0.00 0.00 59.70 57.83 1bn5 h MET 184 Cb 0.25 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.90 1bn5 h MET 184 CO -0.23 0.08 -0.29 0.66 1.06 0.00 0.00 176.91 178.18 1bn5 h SER 185 N 0.00 0.00 0.00 1.22 4.64 -0.94 -3.37 113.55 115.10 1bn5 h SER 185 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1bn5 h SER 185 Cb 0.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.30 1bn5 h SER 185 CO 0.01 0.29 -0.29 -2.67 -0.87 0.00 0.00 176.83 173.31 1bn5 n TRP 186 N -3.53 0.00 -2.10 4.77 4.27 -0.80 -5.04 117.44 115.01 1bn5 n TRP 186 Ca -0.00 0.00 -0.42 0.00 -3.89 0.00 0.00 57.50 53.19 1bn5 n TRP 186 Cb 0.44 0.00 -0.03 0.00 -1.36 0.00 0.00 31.31 30.36 1bn5 n TRP 186 CO 0.00 0.00 0.00 -1.50 -2.29 0.00 0.00 177.69 173.90 1bn5 s ILE 187 N -0.91 3.14 -0.02 -1.67 2.07 -0.42 -4.97 121.20 118.42 1bn5 s ILE 187 Ca 0.00 0.80 -0.18 0.00 -1.41 0.00 0.00 60.65 59.86 1bn5 s ILE 187 Cb 0.00 -3.51 0.03 0.00 0.13 0.00 0.00 42.46 39.11 1bn5 s ILE 187 CO 0.00 0.06 0.37 -0.54 -1.91 0.00 0.00 174.94 172.92 1bn5 s LYS 188 N 1.25 0.73 0.56 3.50 -0.14 -1.26 -5.01 119.74 119.37 1bn5 s LYS 188 Ca 0.66 -0.12 -0.20 0.00 -1.36 0.00 0.00 55.97 54.95 1bn5 s LYS 188 Cb -0.38 0.33 -0.05 0.00 -1.68 0.00 0.00 37.83 36.04 1bn5 s LYS 188 CO 0.30 -0.21 1.15 -0.35 -0.76 0.00 0.00 175.35 175.48 1bn5 n PRO 189 N 1.22 1.26 0.00 -1.68 -0.05 -1.26 -2.55 135.00 131.93 1bn5 n PRO 189 Ca -0.21 0.47 0.00 0.00 -0.05 0.00 0.00 63.50 63.71 1bn5 n PRO 189 Cb 0.56 -2.34 0.00 0.00 -0.05 0.00 0.00 33.50 31.67 1bn5 n PRO 189 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 175.50 175.86 1bn5 n GLY 190 N 1.04 3.01 3.78 0.55 0.00 0.07 -4.99 105.19 108.66 1bn5 n GLY 190 Ca 0.12 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.78 1bn5 n GLY 190 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1bn5 s MET 191 N -0.40 3.93 0.64 1.61 -1.94 -1.06 -4.77 119.30 117.31 1bn5 s MET 191 Ca 0.00 1.53 -0.12 0.00 -1.71 0.00 0.00 55.69 55.39 1bn5 s MET 191 Cb 0.00 -2.36 -0.03 0.00 2.01 0.00 0.00 34.83 34.46 1bn5 s MET 191 CO 0.00 -0.35 1.04 0.95 -0.01 0.00 0.00 175.02 176.65 1bn5 s THR 192 N -1.73 4.41 0.30 2.05 -4.23 -1.26 -1.34 115.64 113.84 1bn5 s THR 192 Ca 0.63 0.82 0.02 0.00 -1.18 0.00 0.00 61.69 61.98 1bn5 s THR 192 Cb -0.22 -3.67 0.13 0.00 1.34 0.00 0.00 72.50 70.08 1bn5 s THR 192 CO 0.27 -0.98 1.81 0.24 -0.54 0.00 0.00 174.62 175.42 1bn5 h MET 193 N -0.34 0.63 -0.35 3.99 0.00 -1.53 -2.09 114.93 115.23 1bn5 h MET 193 Ca -0.44 -0.16 -0.00 0.00 0.00 0.00 0.00 59.70 59.10 1bn5 h MET 193 Cb 1.20 -0.08 -0.02 0.00 0.00 0.00 0.00 31.60 32.70 1bn5 h MET 193 CO 0.60 0.67 0.22 0.82 0.00 0.00 0.00 176.91 179.22 1bn5 h ILE 194 N 0.59 1.11 -0.89 -1.22 2.04 -1.85 -0.44 117.51 116.85 1bn5 h ILE 194 Ca 0.12 -0.24 0.08 0.00 1.00 0.00 0.00 64.86 65.82 1bn5 h ILE 194 Cb 0.42 0.64 -0.07 0.00 -0.74 0.00 0.00 36.82 37.06 1bn5 h ILE 194 CO 0.02 0.11 0.54 -0.33 0.00 0.00 0.00 178.15 178.49 1bn5 h GLU 195 N 0.47 0.92 -0.11 2.37 5.08 -1.84 -0.09 114.58 121.38 1bn5 h GLU 195 Ca 0.13 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 58.41 1bn5 h GLU 195 Cb -0.01 -0.21 -0.00 0.00 0.50 0.00 0.00 28.75 29.03 1bn5 h GLU 195 CO -0.03 0.61 -0.00 0.82 -1.00 0.00 0.00 179.01 179.41 1bn5 h ILE 196 N 0.95 1.26 -0.60 3.13 2.04 -1.13 -2.13 117.51 121.02 1bn5 h ILE 196 Ca 0.41 -0.82 -0.06 0.00 1.00 0.00 0.00 64.86 65.38 1bn5 h ILE 196 Cb 0.27 1.59 -0.03 0.00 -0.74 0.00 0.00 36.82 37.92 1bn5 h ILE 196 CO -0.21 0.23 0.12 0.00 0.00 0.00 0.00 178.15 178.30 1bn5 h GLU 198 N 0.91 0.73 -0.51 0.00 5.08 -0.98 -0.62 114.58 119.19 1bn5 h GLU 198 Ca 0.19 -0.49 -0.12 0.00 -1.00 0.00 0.00 59.36 57.94 1bn5 h GLU 198 Cb 0.36 0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.67 1bn5 h GLU 198 CO 0.00 1.11 -0.17 -0.22 -1.00 0.00 0.00 179.01 178.74 1bn5 h LYS 199 N 0.55 1.01 -0.22 2.33 3.64 -1.31 -0.41 116.57 122.16 1bn5 h LYS 199 Ca -0.00 -0.41 -0.02 0.00 -1.27 0.00 0.00 60.65 58.95 1bn5 h LYS 199 Cb 1.18 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.95 1bn5 h LYS 199 CO 0.12 1.09 0.07 1.25 -2.27 0.00 0.00 179.45 179.71 1bn5 h LEU 200 N 0.88 0.33 -0.69 5.20 6.46 -1.20 -3.03 115.31 123.26 1bn5 h LEU 200 Ca 0.12 -0.20 -0.14 0.00 -0.12 0.00 0.00 57.88 57.55 1bn5 h LEU 200 Cb 0.74 -0.09 -0.01 0.00 -0.73 0.00 0.00 40.66 40.58 1bn5 h LEU 200 CO 0.06 0.44 -0.48 -0.33 -0.62 0.00 0.00 178.44 177.51 1bn5 h GLU 201 N 0.19 0.42 -0.51 1.25 5.08 -1.00 -1.17 114.58 118.84 1bn5 h GLU 201 Ca 0.07 -0.24 0.05 0.00 -1.00 0.00 0.00 59.36 58.25 1bn5 h GLU 201 Cb 0.23 0.02 -0.05 0.00 0.50 0.00 0.00 28.75 29.45 1bn5 h GLU 201 CO -0.00 0.81 0.23 -0.44 -1.00 0.00 0.00 179.01 178.61 1bn5 h ASP 202 N 0.33 0.31 -0.48 1.42 5.19 -1.09 -0.46 116.42 121.64 1bn5 h ASP 202 Ca 0.02 0.04 -0.10 0.00 -0.62 0.00 0.00 57.03 56.37 1bn5 h ASP 202 Cb 0.97 -0.01 -0.02 0.00 0.18 0.00 0.00 39.33 40.46 1bn5 h ASP 202 CO 0.08 0.21 -0.07 0.00 -3.12 0.00 0.00 179.24 176.35 1bn5 h SER 204 N 0.75 0.82 -0.80 0.00 0.87 -0.94 -1.11 113.55 113.14 1bn5 h SER 204 Ca 0.13 -0.13 -0.02 0.00 -1.23 0.00 0.00 61.79 60.54 1bn5 h SER 204 Cb 0.61 -0.21 -0.04 0.00 -0.44 0.00 0.00 62.40 62.32 1bn5 h SER 204 CO 0.04 0.72 0.42 0.03 -0.53 0.00 0.00 176.83 177.51 1bn5 h ARG 205 N 0.86 1.13 -0.25 2.24 3.08 -1.04 -1.12 114.38 119.27 1bn5 h ARG 205 Ca 0.21 -0.14 -0.02 0.00 0.07 0.00 0.00 59.98 60.10 1bn5 h ARG 205 Cb 0.12 -0.22 -0.01 0.00 0.08 0.00 0.00 29.97 29.95 1bn5 h ARG 205 CO -0.03 0.84 0.07 0.87 -1.07 0.00 0.00 179.97 180.66 1bn5 h LYS 206 N 1.12 0.39 0.00 0.04 6.56 -1.15 -2.00 116.57 121.52 1bn5 h LYS 206 Ca 0.28 -0.09 -0.16 0.00 -1.06 0.00 0.00 60.65 59.62 1bn5 h LYS 206 Cb 0.06 -0.05 -0.02 0.00 -0.57 0.00 0.00 32.23 31.64 1bn5 h LYS 206 CO -0.04 0.48 -0.78 -0.07 -2.06 0.00 0.00 179.45 176.98 1bn5 h LEU 207 N 0.23 0.00 0.00 2.94 3.38 -0.98 -2.81 115.31 118.07 1bn5 h LEU 207 Ca 0.08 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.05 1bn5 h LEU 207 Cb 0.26 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.01 1bn5 h LEU 207 CO -0.00 0.78 -0.10 0.00 0.09 0.00 0.00 178.44 179.20 1bn5 n ILE 208 N -3.44 0.19 -3.23 1.22 0.13 -0.44 -1.36 119.36 112.42 1bn5 n ILE 208 Ca 0.00 -0.10 -0.12 0.00 -1.10 0.00 0.00 62.75 61.43 1bn5 n ILE 208 Cb 0.80 -0.41 0.05 0.00 -0.84 0.00 0.00 39.64 39.24 1bn5 n ILE 208 CO 0.00 0.00 0.00 1.17 2.80 0.00 0.00 176.55 180.52 1bn5 n LYS 209 N -1.75 -1.98 -1.57 9.51 4.81 -0.96 -4.67 118.16 121.54 1bn5 n LYS 209 Ca 0.06 1.00 -0.50 0.00 -0.87 0.00 0.00 58.31 58.00 1bn5 n LYS 209 Cb 0.37 -5.72 -0.05 0.00 0.02 0.00 0.00 35.03 29.66 1bn5 n LYS 209 CO 0.00 0.00 0.00 -1.91 1.17 0.00 0.00 177.40 176.66 1bn5 n GLU 210 N -2.93 1.01 -3.06 1.64 2.13 -0.79 -4.79 120.64 113.84 1bn5 n GLU 210 Ca -0.06 0.36 -0.12 0.00 0.66 0.00 0.00 57.16 58.01 1bn5 n GLU 210 Cb 0.59 -1.86 -0.03 0.00 0.27 0.00 0.00 31.44 30.41 1bn5 n GLU 210 CO 0.00 0.00 0.00 1.21 -0.41 0.00 0.00 177.13 177.93 1bn5 s ASN 211 N 0.03 -0.31 1.07 4.31 2.47 0.07 -4.97 114.94 117.61 1bn5 s ASN 211 Ca 0.76 -1.99 0.00 0.00 0.42 0.00 0.00 52.86 52.05 1bn5 s ASN 211 Cb -0.91 1.08 0.00 0.00 -1.45 0.00 0.00 41.25 39.97 1bn5 s ASN 211 CO 0.52 -0.12 0.00 0.61 -3.72 0.00 0.00 177.10 174.38 1bn5 n GLY 212 N 3.24 3.14 0.81 1.21 0.00 -1.26 -1.10 105.19 111.24 1bn5 n GLY 212 Ca 0.20 -0.03 0.10 0.00 0.00 0.00 0.00 46.02 46.29 1bn5 n GLY 212 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1bn5 n LEU 213 N 0.00 2.42 0.09 0.99 4.77 -1.26 -4.06 117.00 119.94 1bn5 n LEU 213 Ca 0.00 -1.07 0.02 0.00 -0.03 0.00 0.00 56.01 54.93 1bn5 n LEU 213 Cb 0.00 -0.20 -0.03 0.00 -2.33 0.00 0.00 43.42 40.86 1bn5 n LEU 213 CO 0.00 0.54 0.08 0.78 -1.33 0.00 0.00 177.39 177.45 1bn5 h ASN 214 N 3.03 0.00 -3.83 -1.43 -0.26 -1.52 -3.40 115.58 108.17 1bn5 h ASN 214 Ca 0.00 0.00 -0.06 0.00 -0.56 0.00 0.00 56.30 55.68 1bn5 h ASN 214 Cb 0.67 0.00 -0.22 0.00 -1.06 0.00 0.00 38.32 37.71 1bn5 h ASN 214 CO 0.00 0.50 0.01 0.00 -1.06 0.00 0.00 177.43 176.89 1bn5 s ALA 215 N -2.97 -1.58 0.00 -0.83 0.00 -1.12 -0.60 121.76 114.66 1bn5 s ALA 215 Ca 0.00 1.84 0.00 0.00 0.00 0.00 0.00 51.96 53.81 1bn5 s ALA 215 Cb 0.08 -1.07 0.00 0.00 0.00 0.00 0.00 23.12 22.13 1bn5 s ALA 215 CO 0.78 -0.31 0.00 0.41 0.00 0.00 0.00 175.76 176.64 1bn5 n GLY 216 N 2.97 -0.58 3.74 0.00 0.00 -0.82 -0.75 105.19 109.75 1bn5 n GLY 216 Ca -0.15 -0.70 -0.38 0.00 0.00 0.00 0.00 46.02 44.79 1bn5 n GLY 216 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1bn5 s LEU 217 N 0.00 4.32 0.19 0.99 1.43 -1.26 -1.55 118.68 122.80 1bn5 s LEU 217 Ca 0.00 0.89 0.16 0.00 -1.03 0.00 0.00 54.13 54.15 1bn5 s LEU 217 Cb 0.00 -2.72 -0.02 0.00 0.03 0.00 0.00 46.19 43.48 1bn5 s LEU 217 CO 0.00 0.05 1.17 0.00 0.23 0.00 0.00 176.35 177.80 1bn5 h ALA 218 N 6.32 0.66 -2.22 4.21 0.00 -1.50 -3.46 119.26 123.27 1bn5 h ALA 218 Ca -0.43 -0.57 0.12 0.00 0.00 0.00 0.00 54.91 54.04 1bn5 h ALA 218 Cb 1.19 0.07 -0.15 0.00 0.00 0.00 0.00 17.79 18.90 1bn5 h ALA 218 CO 0.73 0.68 0.52 -0.59 0.00 0.00 0.00 179.25 180.59 1bn5 s PHE 219 N -2.98 -0.32 0.69 0.00 -0.12 -1.26 -3.28 117.98 110.71 1bn5 s PHE 219 Ca 0.01 0.19 -0.16 0.00 -0.05 0.00 0.00 56.93 56.92 1bn5 s PHE 219 Cb 0.08 0.54 0.02 0.00 -0.63 0.00 0.00 43.02 43.03 1bn5 s PHE 219 CO 0.77 -0.53 1.19 -2.14 -0.05 0.00 0.00 175.22 174.47 1bn5 s PRO 220 N -3.07 2.39 -0.38 1.99 0.02 -1.26 -4.10 135.00 130.58 1bn5 s PRO 220 Ca 0.06 1.72 -0.28 0.00 0.02 0.00 0.00 61.00 62.51 1bn5 s PRO 220 Cb -0.01 -1.87 -0.02 0.00 0.02 0.00 0.00 34.50 32.63 1bn5 s PRO 220 CO -0.08 -1.63 1.78 0.99 -0.33 0.00 0.00 177.00 177.72 1bn5 s THR 221 N -1.97 3.49 0.28 0.99 2.01 -1.26 -4.74 115.64 114.45 1bn5 s THR 221 Ca 0.74 0.47 -0.29 0.00 0.31 0.00 0.00 61.69 62.92 1bn5 s THR 221 Cb -0.28 -3.74 -0.09 0.00 0.01 0.00 0.00 72.50 68.40 1bn5 s THR 221 CO 0.42 -0.52 1.08 -0.83 -0.69 0.00 0.00 174.62 174.08 1bn5 s GLY 222 N 6.28 3.05 -0.28 4.40 0.00 0.49 -4.51 107.32 116.75 1bn5 s GLY 222 Ca 0.76 0.85 0.21 0.00 0.00 0.00 0.00 44.72 46.54 1bn5 s GLY 222 CO 0.31 1.44 1.16 0.00 0.00 0.00 0.00 173.10 176.01 1bn5 s SER 224 N -3.33 6.56 -0.07 0.00 0.01 -1.09 -4.49 113.70 111.28 1bn5 s SER 224 Ca 0.24 2.87 0.02 0.00 1.31 0.00 0.00 55.95 60.39 1bn5 s SER 224 Cb 0.35 -2.66 -0.03 0.00 0.21 0.00 0.00 66.02 63.90 1bn5 s SER 224 CO -0.05 -0.71 -0.11 -0.76 0.41 0.00 0.00 173.24 172.02 1bn5 s LEU 225 N -1.85 2.90 0.00 2.44 1.43 -1.23 -1.14 118.68 121.22 1bn5 s LEU 225 Ca 0.51 -0.16 0.00 0.00 -1.03 0.00 0.00 54.13 53.46 1bn5 s LEU 225 Cb -0.43 -1.62 0.00 0.00 0.03 0.00 0.00 46.19 44.17 1bn5 s LEU 225 CO 0.57 0.32 0.00 0.59 0.23 0.00 0.00 176.35 178.06 1bn5 n ASN 226 N 2.52 0.00 0.23 2.29 3.02 -0.18 -0.97 115.26 122.17 1bn5 n ASN 226 Ca -0.18 0.00 0.14 0.00 -0.03 0.00 0.00 54.58 54.52 1bn5 n ASN 226 Cb 0.52 0.00 0.45 0.00 -0.61 0.00 0.00 39.78 40.14 1bn5 n ASN 226 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 1bn5 h ASN 227 N 0.00 0.00 -3.26 6.41 -1.07 -1.79 -2.17 115.58 113.71 1bn5 h ASN 227 Ca 0.00 0.00 -0.55 0.00 0.07 0.00 0.00 56.30 55.82 1bn5 h ASN 227 Cb 0.00 0.00 -0.02 0.00 -2.07 0.00 0.00 38.32 36.23 1bn5 h ASN 227 CO 0.00 0.00 0.53 0.00 0.07 0.00 0.00 177.43 178.03 1bn5 n ALA 229 N 4.46 2.05 -3.49 0.00 0.00 0.22 -3.57 120.51 120.18 1bn5 n ALA 229 Ca 0.08 -0.94 -0.12 0.00 0.00 0.00 0.00 53.44 52.46 1bn5 n ALA 229 Cb 0.48 -0.39 -0.03 0.00 0.00 0.00 0.00 19.45 19.51 1bn5 n ALA 229 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1bn5 s ALA 230 N -2.87 -1.75 -0.90 0.00 0.00 -1.18 -4.85 121.76 110.20 1bn5 s ALA 230 Ca -0.09 0.97 0.00 0.00 0.00 0.00 0.00 51.96 52.85 1bn5 s ALA 230 Cb 0.09 0.35 0.00 0.00 0.00 0.00 0.00 23.12 23.55 1bn5 s ALA 230 CO 0.82 -0.60 0.00 0.72 0.00 0.00 0.00 175.76 176.70 1bn5 n HIS 231 N 0.07 0.00 -3.64 0.00 8.25 -1.26 -1.45 115.22 117.19 1bn5 n HIS 231 Ca -0.14 0.00 -0.36 0.00 -0.26 0.00 0.00 57.72 56.96 1bn5 n HIS 231 Cb 0.61 -1.73 -0.08 0.00 1.12 0.00 0.00 29.99 29.92 1bn5 n HIS 231 CO 0.00 0.00 0.00 -0.47 0.64 0.00 0.00 176.34 176.51 1bn5 s TYR 232 N -2.30 3.40 0.01 4.41 5.04 -1.26 -3.59 117.35 123.06 1bn5 s TYR 232 Ca 0.00 0.39 -0.01 0.00 -2.44 0.00 0.00 57.07 55.01 1bn5 s TYR 232 Cb 0.00 -2.26 -0.01 0.00 0.35 0.00 0.00 41.96 40.04 1bn5 s TYR 232 CO 0.00 0.20 0.01 -0.08 -1.34 0.00 0.00 175.55 174.33 1bn5 s THR 233 N 0.63 0.09 0.38 4.34 -1.32 -1.26 -1.40 115.64 117.10 1bn5 s THR 233 Ca 0.11 -0.73 -0.27 0.00 -1.21 0.00 0.00 61.69 59.59 1bn5 s THR 233 Cb -0.12 -0.25 -0.09 0.00 -1.51 0.00 0.00 72.50 70.52 1bn5 s THR 233 CO 0.02 -0.40 1.26 -2.16 -2.21 0.00 0.00 174.62 171.13 1bn5 s PRO 234 N -1.21 4.12 0.62 7.08 0.04 -1.26 -4.73 135.00 139.66 1bn5 s PRO 234 Ca -0.13 2.07 -0.02 0.00 0.04 0.00 0.00 61.00 62.96 1bn5 s PRO 234 Cb -0.08 -2.84 0.05 0.00 0.04 0.00 0.00 34.50 31.67 1bn5 s PRO 234 CO -0.00 -0.34 0.89 -0.80 0.04 0.00 0.00 177.00 176.78 1bn5 s ASN 235 N -0.78 5.01 0.18 6.66 0.01 -1.26 -4.70 114.94 120.06 1bn5 s ASN 235 Ca 0.54 0.14 -0.32 0.00 -0.71 0.00 0.00 52.86 52.51 1bn5 s ASN 235 Cb -0.36 -0.90 -0.16 0.00 0.41 0.00 0.00 41.25 40.24 1bn5 s ASN 235 CO 0.47 -1.38 1.13 0.00 -1.51 0.00 0.00 177.10 175.81 1bn5 n ALA 236 N -2.61 -0.88 0.00 0.60 0.00 -1.26 -2.17 120.51 114.19 1bn5 n ALA 236 Ca 0.09 0.46 0.00 0.00 0.00 0.00 0.00 53.44 53.99 1bn5 n ALA 236 Cb 0.60 -2.01 0.00 0.00 0.00 0.00 0.00 19.45 18.04 1bn5 n ALA 236 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1bn5 n GLY 237 N 1.95 2.15 3.67 0.00 0.00 -1.26 -5.02 105.19 106.68 1bn5 n GLY 237 Ca 0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.75 1bn5 n GLY 237 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1bn5 s ASP 238 N -2.35 6.51 0.00 1.61 -1.08 -0.92 -4.88 116.67 115.56 1bn5 s ASP 238 Ca 0.00 2.56 0.20 0.00 -0.52 0.00 0.00 52.55 54.79 1bn5 s ASP 238 Cb 0.00 -2.54 0.53 0.00 -1.46 0.00 0.00 42.92 39.45 1bn5 s ASP 238 CO 0.00 -1.00 1.44 0.35 0.52 0.00 0.00 175.17 176.48 1bn5 n THR 239 N 5.33 0.69 -1.66 1.71 -2.24 -1.26 -4.75 114.28 112.11 1bn5 n THR 239 Ca 0.19 -0.75 -0.47 0.00 -2.27 0.00 0.00 64.05 60.75 1bn5 n THR 239 Cb 0.41 0.50 -0.04 0.00 -2.10 0.00 0.00 70.33 69.10 1bn5 n THR 239 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 1bn5 n THR 240 N 1.21 0.01 -4.73 4.28 -1.04 -1.26 -4.90 114.28 107.86 1bn5 n THR 240 Ca 0.20 -0.00 -0.33 0.00 -2.04 0.00 0.00 64.05 61.87 1bn5 n THR 240 Cb 0.51 -1.44 -0.13 0.00 -1.82 0.00 0.00 70.33 67.45 1bn5 n THR 240 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 1bn5 s VAL 241 N 0.92 3.36 0.15 12.58 1.01 -1.26 -1.30 120.40 135.85 1bn5 s VAL 241 Ca 0.80 -0.59 -0.31 0.00 0.00 0.00 0.00 61.98 61.88 1bn5 s VAL 241 Cb -0.72 -2.37 -0.08 0.00 0.00 0.00 0.00 36.38 33.20 1bn5 s VAL 241 CO 0.39 0.57 1.39 -0.22 0.00 0.00 0.00 175.10 177.24 1bn5 s LEU 242 N -0.43 4.38 0.32 3.92 2.96 -0.45 -4.89 118.68 124.49 1bn5 s LEU 242 Ca 0.06 2.40 0.08 0.00 -0.22 0.00 0.00 54.13 56.44 1bn5 s LEU 242 Cb -0.12 -3.59 -0.04 0.00 0.50 0.00 0.00 46.19 42.94 1bn5 s LEU 242 CO 0.02 -0.65 0.17 -1.10 -1.32 0.00 0.00 176.35 173.48 1bn5 s GLN 243 N 0.74 2.52 0.24 1.98 -1.52 -1.26 -0.76 119.66 121.60 1bn5 s GLN 243 Ca 0.63 -1.41 -0.07 0.00 -1.95 0.00 0.00 55.36 52.56 1bn5 s GLN 243 Cb -0.38 -2.30 0.22 0.00 -0.22 0.00 0.00 33.01 30.33 1bn5 s GLN 243 CO 0.33 0.17 1.88 -0.92 -0.25 0.00 0.00 175.29 176.50 1bn5 h TYR 244 N 1.50 1.22 -0.22 0.91 3.20 -1.95 -1.76 116.97 119.86 1bn5 h TYR 244 Ca -0.45 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.42 1bn5 h TYR 244 Cb 1.25 -0.40 0.00 0.00 1.54 0.00 0.00 36.73 39.12 1bn5 h TYR 244 CO 0.60 0.81 0.00 -0.25 -1.64 0.00 0.00 178.16 177.68 1bn5 n ASP 245 N -4.37 1.26 -4.81 -2.11 8.00 -1.26 -3.66 116.55 109.60 1bn5 n ASP 245 Ca 0.10 -1.93 -0.33 0.00 0.71 0.00 0.00 54.79 53.34 1bn5 n ASP 245 Cb 0.06 -0.15 -0.05 0.00 -0.02 0.00 0.00 41.12 40.96 1bn5 n ASP 245 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 1bn5 s ASP 246 N -1.10 6.70 -0.26 -2.24 1.01 -0.66 -4.99 116.67 115.13 1bn5 s ASP 246 Ca 0.19 1.76 -0.01 0.00 0.71 0.00 0.00 52.55 55.20 1bn5 s ASP 246 Cb 0.10 -2.54 0.03 0.00 1.01 0.00 0.00 42.92 41.52 1bn5 s ASP 246 CO 0.13 -0.53 -0.06 -0.51 0.21 0.00 0.00 175.17 174.42 1bn5 s ILE 247 N -2.15 2.80 -0.17 0.77 2.07 -1.26 -4.39 121.20 118.87 1bn5 s ILE 247 Ca 0.64 -1.13 -0.01 0.00 -1.41 0.00 0.00 60.65 58.73 1bn5 s ILE 247 Cb -0.12 -2.46 -0.01 0.00 0.13 0.00 0.00 42.46 40.00 1bn5 s ILE 247 CO 0.17 0.14 -0.11 0.00 -1.91 0.00 0.00 174.94 173.24 1bn5 s LYS 249 N 0.84 3.49 -0.42 0.00 3.01 -0.29 -0.65 119.74 125.72 1bn5 s LYS 249 Ca -0.03 -0.41 -0.19 0.00 -1.01 0.00 0.00 55.97 54.33 1bn5 s LYS 249 Cb -0.15 -3.84 0.02 0.00 -1.01 0.00 0.00 37.83 32.85 1bn5 s LYS 249 CO 0.00 -0.62 0.54 0.42 0.51 0.00 0.00 175.35 176.21 1bn5 s ILE 250 N 2.15 4.96 -0.19 2.17 -1.09 -0.15 -2.66 121.20 126.39 1bn5 s ILE 250 Ca 0.14 -0.06 -0.01 0.00 -2.23 0.00 0.00 60.65 58.49 1bn5 s ILE 250 Cb -0.16 -4.11 0.05 0.00 -1.58 0.00 0.00 42.46 36.66 1bn5 s ILE 250 CO 0.12 -0.48 -0.02 -0.62 -1.23 0.00 0.00 174.94 172.71 1bn5 s ASP 251 N 1.90 3.06 0.05 3.58 -1.08 -0.82 -1.85 116.67 121.51 1bn5 s ASP 251 Ca 0.18 -0.82 -0.08 0.00 -0.52 0.00 0.00 52.55 51.30 1bn5 s ASP 251 Cb -0.15 -0.85 -0.00 0.00 -1.46 0.00 0.00 42.92 40.46 1bn5 s ASP 251 CO 0.16 -0.24 0.17 0.72 0.52 0.00 0.00 175.17 176.50 1bn5 s PHE 252 N 1.67 0.11 0.03 -5.34 -0.71 -1.19 -0.38 117.98 112.16 1bn5 s PHE 252 Ca -0.01 -0.39 0.03 0.00 -1.04 0.00 0.00 56.93 55.52 1bn5 s PHE 252 Cb -0.17 -0.06 -0.02 0.00 -1.21 0.00 0.00 43.02 41.56 1bn5 s PHE 252 CO -0.07 -0.44 -0.11 0.20 -1.34 0.00 0.00 175.22 173.46 1bn5 s GLY 253 N -2.27 0.61 0.19 1.99 0.00 -1.26 -3.74 107.32 102.84 1bn5 s GLY 253 Ca -0.03 -0.68 0.09 0.00 0.00 0.00 0.00 44.72 44.10 1bn5 s GLY 253 CO -0.06 -0.67 -0.18 -0.51 0.00 0.00 0.00 173.10 171.68 1bn5 s THR 254 N -0.83 1.95 0.04 0.90 -4.23 -1.13 -1.47 115.64 110.87 1bn5 s THR 254 Ca -0.01 -2.06 -0.12 0.00 -1.18 0.00 0.00 61.69 58.32 1bn5 s THR 254 Cb -0.07 -1.98 0.01 0.00 1.34 0.00 0.00 72.50 71.80 1bn5 s THR 254 CO 0.01 -0.37 0.26 -1.38 -0.54 0.00 0.00 174.62 172.60 1bn5 s HIS 255 N -2.28 -0.04 -0.10 3.99 -3.43 -0.59 -1.23 115.29 111.60 1bn5 s HIS 255 Ca 0.20 -0.12 0.03 0.00 -0.80 0.00 0.00 55.06 54.37 1bn5 s HIS 255 Cb -0.05 0.04 0.01 0.00 -1.43 0.00 0.00 32.58 31.15 1bn5 s HIS 255 CO 0.08 -0.46 -0.20 0.42 -2.00 0.00 0.00 174.74 172.58 1bn5 s ILE 256 N -2.48 1.77 -1.19 -5.38 -1.09 -1.05 -1.94 121.20 109.85 1bn5 s ILE 256 Ca -0.06 -0.84 -0.08 0.00 -2.23 0.00 0.00 60.65 57.45 1bn5 s ILE 256 Cb -0.01 -1.57 0.06 0.00 -1.58 0.00 0.00 42.46 39.36 1bn5 s ILE 256 CO -0.03 0.50 0.39 -1.20 -1.23 0.00 0.00 174.94 173.36 1bn5 n SER 257 N 3.82 -3.54 0.00 3.58 7.64 0.23 -0.83 113.62 124.51 1bn5 n SER 257 Ca -0.20 -0.27 0.00 0.00 1.01 0.00 0.00 58.87 59.42 1bn5 n SER 257 Cb 0.52 -2.96 0.00 0.00 -1.01 0.00 0.00 64.21 60.76 1bn5 n SER 257 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1bn5 n GLY 258 N -1.07 0.95 3.55 0.23 0.00 -1.26 -4.79 105.19 102.80 1bn5 n GLY 258 Ca -0.03 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.56 1bn5 n GLY 258 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1bn5 s ARG 259 N -0.21 3.47 -0.14 1.61 1.81 -0.01 -1.34 118.95 124.12 1bn5 s ARG 259 Ca 0.00 0.02 -0.07 0.00 -1.72 0.00 0.00 55.73 53.96 1bn5 s ARG 259 Cb 0.00 -3.93 -0.04 0.00 -0.45 0.00 0.00 34.95 30.53 1bn5 s ARG 259 CO 0.00 -1.17 0.09 0.42 -0.68 0.00 0.00 175.30 173.96 1bn5 s ILE 260 N 3.51 5.08 -0.26 1.52 1.01 -1.26 -2.53 121.20 128.27 1bn5 s ILE 260 Ca 0.33 0.06 -0.10 0.00 0.00 0.00 0.00 60.65 60.94 1bn5 s ILE 260 Cb -0.11 -3.24 -0.04 0.00 0.01 0.00 0.00 42.46 39.07 1bn5 s ILE 260 CO 0.24 0.54 0.15 -0.63 0.00 0.00 0.00 174.94 175.25 1bn5 s ILE 261 N -0.40 5.08 -0.30 2.92 -1.09 -0.37 -5.01 121.20 122.04 1bn5 s ILE 261 Ca 0.10 0.09 -0.03 0.00 -2.23 0.00 0.00 60.65 58.58 1bn5 s ILE 261 Cb -0.12 -3.40 0.04 0.00 -1.58 0.00 0.00 42.46 37.40 1bn5 s ILE 261 CO 0.02 0.29 0.02 -0.62 -1.23 0.00 0.00 174.94 173.42 1bn5 s ASP 262 N 1.56 4.91 -0.08 3.58 -1.08 -1.26 -2.83 116.67 121.46 1bn5 s ASP 262 Ca 0.07 -1.13 -0.10 0.00 -0.52 0.00 0.00 52.55 50.87 1bn5 s ASP 262 Cb -0.15 -1.75 0.02 0.00 -1.46 0.00 0.00 42.92 39.58 1bn5 s ASP 262 CO 0.08 -0.25 0.27 0.00 0.52 0.00 0.00 175.17 175.79 1bn5 s ALA 264 N -0.14 -1.17 0.18 0.00 0.00 -0.96 -3.19 121.76 116.48 1bn5 s ALA 264 Ca -0.03 0.64 -0.05 0.00 0.00 0.00 0.00 51.96 52.52 1bn5 s ALA 264 Cb -0.03 0.14 -0.02 0.00 0.00 0.00 0.00 23.12 23.21 1bn5 s ALA 264 CO 0.01 -0.36 0.22 -0.59 0.00 0.00 0.00 175.76 175.04 1bn5 s PHE 265 N -1.65 0.71 -0.08 0.00 -0.71 -0.77 -1.12 117.98 114.37 1bn5 s PHE 265 Ca -0.10 -1.04 0.02 0.00 -1.04 0.00 0.00 56.93 54.77 1bn5 s PHE 265 Cb -0.02 -0.26 -0.02 0.00 -1.21 0.00 0.00 43.02 41.50 1bn5 s PHE 265 CO 0.04 -0.69 -0.12 0.99 -1.34 0.00 0.00 175.22 174.10 1bn5 s THR 266 N -4.05 3.25 -0.16 -4.49 2.01 -1.19 -0.97 115.64 110.03 1bn5 s THR 266 Ca 0.26 -0.63 -0.04 0.00 0.31 0.00 0.00 61.69 61.58 1bn5 s THR 266 Cb 0.05 -2.32 -0.03 0.00 0.01 0.00 0.00 72.50 70.21 1bn5 s THR 266 CO 0.05 0.57 -0.01 -0.69 -0.69 0.00 0.00 174.62 173.85 1bn5 s VAL 267 N -0.43 4.12 0.12 3.82 1.01 0.18 -4.97 120.40 124.25 1bn5 s VAL 267 Ca 0.05 -0.28 -0.01 0.00 0.00 0.00 0.00 61.98 61.75 1bn5 s VAL 267 Cb -0.12 -2.81 -0.04 0.00 0.00 0.00 0.00 36.38 33.40 1bn5 s VAL 267 CO 0.02 0.49 0.05 0.42 0.00 0.00 0.00 175.10 176.08 1bn5 s THR 268 N 0.30 0.12 0.00 3.92 -4.23 -1.26 -1.24 115.64 113.25 1bn5 s THR 268 Ca -0.02 -1.90 0.00 0.00 -1.18 0.00 0.00 61.69 58.59 1bn5 s THR 268 Cb -0.14 -1.99 0.00 0.00 1.34 0.00 0.00 72.50 71.72 1bn5 s THR 268 CO 0.02 -0.52 0.00 0.49 -0.54 0.00 0.00 174.62 174.07 1bn5 n PHE 269 N -0.07 0.00 -3.59 3.99 3.72 -1.26 -5.01 117.46 115.24 1bn5 n PHE 269 Ca -0.06 0.00 -0.37 0.00 -0.05 0.00 0.00 57.45 56.97 1bn5 n PHE 269 Cb 0.63 0.00 -0.08 0.00 -0.94 0.00 0.00 39.48 39.09 1bn5 n PHE 269 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 176.76 177.92 1bn5 s ASN 270 N -1.33 6.27 0.00 4.37 3.84 -1.24 -5.00 114.94 121.85 1bn5 s ASN 270 Ca 0.00 0.31 0.12 0.00 0.21 0.00 0.00 52.86 53.49 1bn5 s ASN 270 Cb 0.00 -2.15 0.53 0.00 -0.55 0.00 0.00 41.25 39.09 1bn5 s ASN 270 CO 0.00 0.06 1.34 -0.81 -2.79 0.00 0.00 177.10 174.90 1bn5 n PRO 271 N 4.04 0.06 0.10 0.43 -0.04 -1.26 -2.78 135.00 135.56 1bn5 n PRO 271 Ca -0.13 0.25 0.17 0.00 -0.04 0.00 0.00 63.50 63.75 1bn5 n PRO 271 Cb 0.52 -1.50 0.72 0.00 -0.04 0.00 0.00 33.50 33.19 1bn5 n PRO 271 CO 0.00 0.00 0.00 1.57 -0.04 0.00 0.00 175.50 177.03 1bn5 h LYS 272 N 0.00 0.00 -0.18 0.54 2.10 -1.94 -1.53 116.57 115.56 1bn5 h LYS 272 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1bn5 h LYS 272 Cb 0.17 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.50 1bn5 h LYS 272 CO 0.00 0.00 0.00 0.66 -2.00 0.00 0.00 179.45 178.11 1bn5 n TYR 273 N -4.24 0.23 -0.22 0.07 4.01 -1.12 -4.56 117.16 111.33 1bn5 n TYR 273 Ca 0.05 -0.11 -0.03 0.00 -0.16 0.00 0.00 57.90 57.64 1bn5 n TYR 273 Cb 0.44 0.00 0.07 0.00 -0.31 0.00 0.00 39.34 39.54 1bn5 n TYR 273 CO 0.00 0.00 0.00 -0.44 -0.46 0.00 0.00 176.86 175.96 1bn5 h ASP 274 N 1.90 0.60 0.09 7.72 3.32 -1.52 -1.46 116.42 127.08 1bn5 h ASP 274 Ca 0.00 0.01 -0.10 0.00 0.02 0.00 0.00 57.03 56.96 1bn5 h ASP 274 Cb 0.42 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 39.85 1bn5 h ASP 274 CO 0.00 0.41 -0.35 0.74 -1.72 0.00 0.00 179.24 178.32 1bn5 h THR 275 N 0.73 1.29 -0.71 0.35 2.02 -1.83 -1.10 112.91 113.66 1bn5 h THR 275 Ca 0.27 -1.41 -0.07 0.00 0.77 0.00 0.00 66.41 65.97 1bn5 h THR 275 Cb 0.08 1.54 -0.03 0.00 -1.74 0.00 0.00 68.15 68.00 1bn5 h THR 275 CO -0.13 0.43 0.18 0.25 0.37 0.00 0.00 175.52 176.62 1bn5 h LEU 276 N 0.31 1.06 -0.57 2.58 5.85 -1.69 0.36 115.31 123.21 1bn5 h LEU 276 Ca 0.04 -0.22 -0.09 0.00 0.84 0.00 0.00 57.88 58.45 1bn5 h LEU 276 Cb 0.76 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 41.49 1bn5 h LEU 276 CO 0.06 1.01 0.01 -0.07 -0.34 0.00 0.00 178.44 179.11 1bn5 h LEU 277 N 1.07 0.97 -0.90 2.25 4.07 -1.05 -2.50 115.31 119.22 1bn5 h LEU 277 Ca 0.22 -0.30 -0.04 0.00 0.08 0.00 0.00 57.88 57.84 1bn5 h LEU 277 Cb 0.36 -0.26 -0.03 0.00 1.08 0.00 0.00 40.66 41.80 1bn5 h LEU 277 CO 0.00 1.03 0.28 0.50 -1.08 0.00 0.00 178.44 179.17 1bn5 h LYS 278 N 0.88 1.09 -0.44 1.13 3.64 -0.86 -0.92 116.57 121.10 1bn5 h LYS 278 Ca 0.16 -0.19 0.02 0.00 -1.27 0.00 0.00 60.65 59.37 1bn5 h LYS 278 Cb 0.53 -0.18 -0.03 0.00 -0.41 0.00 0.00 32.23 32.14 1bn5 h LYS 278 CO 0.03 0.89 0.25 0.00 -2.27 0.00 0.00 179.45 178.34 1bn5 h ALA 279 N 1.24 0.55 -0.09 5.00 0.00 -0.62 -0.61 119.26 124.74 1bn5 h ALA 279 Ca 0.24 -0.00 -0.24 0.00 0.00 0.00 0.00 54.91 54.91 1bn5 h ALA 279 Cb 0.22 -0.11 0.02 0.00 0.00 0.00 0.00 17.79 17.91 1bn5 h ALA 279 CO -0.02 -0.08 -0.88 0.28 0.00 0.00 0.00 179.25 178.55 1bn5 h VAL 280 N 0.50 1.28 -0.69 0.00 2.07 -1.15 -1.01 116.25 117.26 1bn5 h VAL 280 Ca 0.18 -2.08 0.03 0.00 0.82 0.00 0.00 66.70 65.64 1bn5 h VAL 280 Cb 0.03 2.17 -0.04 0.00 -1.52 0.00 0.00 31.29 31.93 1bn5 h VAL 280 CO -0.09 0.65 0.43 0.50 0.02 0.00 0.00 177.57 179.08 1bn5 h LYS 281 N 0.46 0.83 -0.69 1.57 3.64 -1.08 -0.24 116.57 121.05 1bn5 h LYS 281 Ca -0.09 -0.05 -0.07 0.00 -1.27 0.00 0.00 60.65 59.18 1bn5 h LYS 281 Cb 1.52 -0.19 -0.03 0.00 -0.41 0.00 0.00 32.23 33.13 1bn5 h LYS 281 CO 0.18 0.55 0.16 0.22 -2.27 0.00 0.00 179.45 178.29 1bn5 h ASP 282 N 0.85 1.04 -0.62 4.20 3.58 -1.03 -1.30 116.42 123.14 1bn5 h ASP 282 Ca 0.27 -0.22 -0.08 0.00 0.42 0.00 0.00 57.03 57.42 1bn5 h ASP 282 Cb 0.01 -0.27 -0.02 0.00 1.72 0.00 0.00 39.33 40.76 1bn5 h ASP 282 CO -0.10 1.00 0.07 0.00 -2.88 0.00 0.00 179.24 177.33 1bn5 h ALA 283 N 1.13 0.83 -0.58 -0.78 0.00 -0.80 0.51 119.26 119.57 1bn5 h ALA 283 Ca 0.22 -0.28 -0.07 0.00 0.00 0.00 0.00 54.91 54.78 1bn5 h ALA 283 Cb 0.37 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 1bn5 h ALA 283 CO 0.00 0.61 0.09 1.15 0.00 0.00 0.00 179.25 181.10 1bn5 h THR 284 N 0.95 1.26 -0.22 0.00 2.02 -0.86 -1.28 112.91 114.78 1bn5 h THR 284 Ca 0.18 -1.00 -0.07 0.00 0.77 0.00 0.00 66.41 66.30 1bn5 h THR 284 Cb 0.47 0.78 -0.01 0.00 -1.74 0.00 0.00 68.15 67.65 1bn5 h THR 284 CO 0.02 0.36 -0.17 0.78 0.37 0.00 0.00 175.52 176.88 1bn5 h ASN 285 N 0.86 0.36 -0.55 4.18 2.35 -0.97 -1.02 115.58 120.79 1bn5 h ASN 285 Ca 0.17 -0.10 -0.07 0.00 -0.55 0.00 0.00 56.30 55.75 1bn5 h ASN 285 Cb 0.43 -0.10 -0.02 0.00 0.05 0.00 0.00 38.32 38.68 1bn5 h ASN 285 CO 0.01 0.56 0.05 0.74 -1.65 0.00 0.00 177.43 177.14 1bn5 h THR 286 N 0.35 1.26 -0.74 2.81 2.02 -0.51 -0.37 112.91 117.73 1bn5 h THR 286 Ca 0.06 -1.03 -0.06 0.00 0.77 0.00 0.00 66.41 66.15 1bn5 h THR 286 Cb 0.51 0.85 -0.03 0.00 -1.74 0.00 0.00 68.15 67.74 1bn5 h THR 286 CO 0.03 0.37 0.21 1.23 0.37 0.00 0.00 175.52 177.73 1bn5 h GLY 287 N 0.81 1.25 1.01 2.16 0.00 -0.67 -1.34 103.07 106.29 1bn5 h GLY 287 Ca 0.16 -0.76 -0.03 0.00 0.00 0.00 0.00 47.33 46.71 1bn5 h GLY 287 CO 0.02 0.71 0.31 -2.22 0.00 0.00 0.00 176.54 175.35 1bn5 h ILE 288 N 1.11 1.23 -0.18 2.60 2.04 -1.08 -2.02 117.51 121.20 1bn5 h ILE 288 Ca 0.24 -0.68 -0.11 0.00 1.00 0.00 0.00 64.86 65.31 1bn5 h ILE 288 Cb 0.34 0.43 -0.01 0.00 -0.74 0.00 0.00 36.82 36.84 1bn5 h ILE 288 CO -0.00 0.28 -0.37 0.11 0.00 0.00 0.00 178.15 178.17 1bn5 h LYS 289 N 0.94 0.39 0.00 2.37 1.57 -0.65 -3.09 116.57 118.11 1bn5 h LYS 289 Ca 0.23 -0.18 -0.14 0.00 -1.87 0.00 0.00 60.65 58.69 1bn5 h LYS 289 Cb 0.15 -0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.43 1bn5 h LYS 289 CO -0.03 0.71 -0.68 0.00 -0.57 0.00 0.00 179.45 178.89 1bn5 s ALA 291 N -3.39 2.41 0.00 0.00 0.00 -0.78 -4.90 121.76 115.10 1bn5 s ALA 291 Ca -0.01 1.14 0.00 0.00 0.00 0.00 0.00 51.96 53.10 1bn5 s ALA 291 Cb 0.12 -3.52 0.00 0.00 0.00 0.00 0.00 23.12 19.72 1bn5 s ALA 291 CO 0.77 -1.49 0.00 0.41 0.00 0.00 0.00 175.76 175.44 1bn5 n GLY 292 N 0.76 1.11 3.74 0.00 0.00 -1.26 -4.57 105.19 104.97 1bn5 n GLY 292 Ca 0.15 -0.90 -0.41 0.00 0.00 0.00 0.00 46.02 44.86 1bn5 n GLY 292 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1bn5 s ILE 293 N -2.00 2.56 0.00 -0.61 1.01 -1.26 -2.31 121.20 118.59 1bn5 s ILE 293 Ca 0.00 0.46 0.00 0.00 0.00 0.00 0.00 60.65 61.11 1bn5 s ILE 293 Cb 0.00 -3.30 0.00 0.00 0.01 0.00 0.00 42.46 39.17 1bn5 s ILE 293 CO 0.00 0.07 0.00 0.47 0.00 0.00 0.00 174.94 175.48 1bn5 n ASP 294 N 2.48 -2.77 -4.75 3.58 8.00 -0.23 -4.99 116.55 117.87 1bn5 n ASP 294 Ca 0.08 0.00 -0.40 0.00 0.71 0.00 0.00 54.79 55.18 1bn5 n ASP 294 Cb 0.40 -1.12 -0.05 0.00 -0.02 0.00 0.00 41.12 40.32 1bn5 n ASP 294 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1bn5 s VAL 295 N -2.14 4.39 0.13 2.53 1.01 -0.98 -4.81 120.40 120.52 1bn5 s VAL 295 Ca 0.00 1.90 -0.30 0.00 0.00 0.00 0.00 61.98 63.58 1bn5 s VAL 295 Cb 0.00 -4.24 -0.07 0.00 0.00 0.00 0.00 36.38 32.08 1bn5 s VAL 295 CO 0.00 0.43 1.10 -0.13 0.00 0.00 0.00 175.10 176.50 1bn5 s ARG 296 N -0.65 4.56 0.45 2.72 0.52 -1.26 -1.50 118.95 123.80 1bn5 s ARG 296 Ca 0.41 1.68 0.11 0.00 -0.52 0.00 0.00 55.73 57.40 1bn5 s ARG 296 Cb -0.24 -3.32 1.02 0.00 0.52 0.00 0.00 34.95 32.94 1bn5 s ARG 296 CO 0.28 0.00 2.09 -0.07 0.02 0.00 0.00 175.30 177.62 1bn5 h LEU 297 N 5.69 0.27 -1.39 2.53 3.38 -0.92 -2.02 115.31 122.85 1bn5 h LEU 297 Ca -0.43 -0.01 -0.05 0.00 0.09 0.00 0.00 57.88 57.48 1bn5 h LEU 297 Cb 1.21 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.88 1bn5 h LEU 297 CO 0.75 0.21 -0.15 0.00 0.09 0.00 0.00 178.44 179.33 1bn5 h ASP 299 N 0.21 0.79 -0.17 0.00 3.32 -1.67 -1.57 116.42 117.33 1bn5 h ASP 299 Ca 0.04 -0.29 -0.01 0.00 0.02 0.00 0.00 57.03 56.79 1bn5 h ASP 299 Cb 0.40 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.72 1bn5 h ASP 299 CO 0.02 1.00 0.06 0.58 -1.72 0.00 0.00 179.24 179.18 1bn5 h VAL 300 N 0.67 1.17 -0.31 -1.35 2.07 -1.37 -1.47 116.25 115.67 1bn5 h VAL 300 Ca 0.09 -0.53 0.05 0.00 0.82 0.00 0.00 66.70 67.13 1bn5 h VAL 300 Cb 0.75 1.20 -0.05 0.00 -1.52 0.00 0.00 31.29 31.67 1bn5 h VAL 300 CO 0.06 0.17 -0.00 1.23 0.02 0.00 0.00 177.57 179.04 1bn5 h GLY 301 N 0.11 0.30 0.91 2.17 0.00 -1.35 -1.11 103.07 104.10 1bn5 h GLY 301 Ca 0.06 0.04 0.03 0.00 0.00 0.00 0.00 47.33 47.45 1bn5 h GLY 301 CO -0.00 -0.07 0.51 -2.09 0.00 0.00 0.00 176.54 174.89 1bn5 h GLU 302 N 0.08 0.98 -0.17 4.80 4.81 -1.08 -2.08 114.58 121.92 1bn5 h GLU 302 Ca 0.15 -0.06 -0.00 0.00 -0.13 0.00 0.00 59.36 59.32 1bn5 h GLU 302 Cb 0.20 -0.22 -0.01 0.00 0.63 0.00 0.00 28.75 29.35 1bn5 h GLU 302 CO -0.25 0.65 0.10 0.00 -0.73 0.00 0.00 179.01 178.78 1bn5 h ALA 303 N 1.32 0.22 -0.38 2.92 0.00 -1.02 -1.58 119.26 120.73 1bn5 h ALA 303 Ca 0.31 -0.04 0.05 0.00 0.00 0.00 0.00 54.91 55.23 1bn5 h ALA 303 Cb -0.02 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 17.65 1bn5 h ALA 303 CO -0.10 -0.27 0.13 0.82 0.00 0.00 0.00 179.25 179.83 1bn5 h ILE 304 N 0.20 0.88 -0.58 0.00 2.04 -1.11 -2.70 117.51 116.25 1bn5 h ILE 304 Ca 0.06 -0.10 -0.10 0.00 1.00 0.00 0.00 64.86 65.72 1bn5 h ILE 304 Cb 0.02 0.57 -0.02 0.00 -0.74 0.00 0.00 36.82 36.65 1bn5 h ILE 304 CO -0.01 0.05 -0.02 -0.61 0.00 0.00 0.00 178.15 177.56 1bn5 h GLN 305 N 0.29 1.03 -0.58 2.37 4.15 -1.26 -0.94 115.11 120.17 1bn5 h GLN 305 Ca 0.18 -0.33 0.01 0.00 0.77 0.00 0.00 58.65 59.27 1bn5 h GLN 305 Cb 0.16 -0.09 -0.03 0.00 0.21 0.00 0.00 27.48 27.72 1bn5 h GLN 305 CO -0.18 1.02 0.38 1.49 -1.93 0.00 0.00 178.83 179.61 1bn5 h GLU 306 N 0.94 0.74 -0.19 1.69 4.81 -1.14 -1.04 114.58 120.40 1bn5 h GLU 306 Ca 0.16 -0.04 -0.05 0.00 -0.13 0.00 0.00 59.36 59.30 1bn5 h GLU 306 Cb 0.57 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 29.78 1bn5 h GLU 306 CO 0.03 0.49 -0.08 0.28 -0.73 0.00 0.00 179.01 179.00 1bn5 h VAL 307 N 0.76 1.31 -0.87 0.32 2.07 -1.34 -2.96 116.25 115.54 1bn5 h VAL 307 Ca 0.22 -1.13 0.02 0.00 0.82 0.00 0.00 66.70 66.63 1bn5 h VAL 307 Cb -0.05 1.65 -0.05 0.00 -1.52 0.00 0.00 31.29 31.32 1bn5 h VAL 307 CO -0.06 0.34 0.57 -0.03 0.02 0.00 0.00 177.57 178.40 1bn5 h MET 308 N 0.08 1.11 0.00 1.57 1.85 -0.93 -1.68 114.93 116.94 1bn5 h MET 308 Ca 0.04 -0.07 0.00 0.00 -0.61 0.00 0.00 59.70 59.07 1bn5 h MET 308 Cb 0.56 -0.25 0.00 0.00 0.43 0.00 0.00 31.60 32.34 1bn5 h MET 308 CO 0.03 0.74 0.00 0.39 -0.40 0.00 0.00 176.91 177.66 1bn5 n GLU 309 N -4.50 0.41 0.00 0.39 1.02 -0.41 -2.72 120.64 114.83 1bn5 n GLU 309 Ca 0.10 0.01 0.12 0.00 -0.02 0.00 0.00 57.16 57.36 1bn5 n GLU 309 Cb 0.04 -1.50 0.60 0.00 -0.02 0.00 0.00 31.44 30.55 1bn5 n GLU 309 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 1bn5 n SER 310 N -1.29 0.00 -4.78 1.62 3.41 -0.63 -4.76 113.62 107.18 1bn5 n SER 310 Ca 0.14 0.04 -0.36 0.00 -0.26 0.00 0.00 58.87 58.43 1bn5 n SER 310 Cb 0.24 -0.33 -0.07 0.00 -0.26 0.00 0.00 64.21 63.79 1bn5 n SER 310 CO 0.00 0.00 0.00 -0.31 -0.16 0.00 0.00 175.04 174.57 1bn5 s TYR 311 N -2.65 3.44 -0.02 7.33 1.51 -1.10 -5.07 117.35 120.78 1bn5 s TYR 311 Ca 0.21 0.37 0.06 0.00 -1.01 0.00 0.00 57.07 56.70 1bn5 s TYR 311 Cb 0.16 -1.96 -0.02 0.00 -0.11 0.00 0.00 41.96 40.03 1bn5 s TYR 311 CO 0.39 0.54 -0.21 -1.83 -1.11 0.00 0.00 175.55 173.32 1bn5 s GLU 312 N -0.59 1.73 0.14 -0.62 -1.05 -1.26 -2.07 118.70 114.98 1bn5 s GLU 312 Ca 0.12 -0.75 0.06 0.00 -0.15 0.00 0.00 54.97 54.26 1bn5 s GLU 312 Cb -0.12 -1.65 -0.04 0.00 -0.44 0.00 0.00 34.13 31.88 1bn5 s GLU 312 CO 0.02 0.44 -0.15 0.14 0.95 0.00 0.00 175.26 176.66 1bn5 s VAL 313 N -0.45 1.45 -0.13 1.83 -7.23 -0.27 -4.95 120.40 110.65 1bn5 s VAL 313 Ca 0.07 -1.81 0.00 0.00 -1.81 0.00 0.00 61.98 58.43 1bn5 s VAL 313 Cb -0.08 -1.65 0.02 0.00 0.56 0.00 0.00 36.38 35.23 1bn5 s VAL 313 CO -0.00 -0.43 -0.12 -0.70 -0.31 0.00 0.00 175.10 173.53 1bn5 s GLU 314 N -2.83 2.05 -0.14 4.82 2.12 -1.26 -0.95 118.70 122.52 1bn5 s GLU 314 Ca 0.12 -0.47 -0.01 0.00 0.36 0.00 0.00 54.97 54.97 1bn5 s GLU 314 Cb -0.04 -1.90 0.04 0.00 0.26 0.00 0.00 34.13 32.49 1bn5 s GLU 314 CO 0.04 -0.20 -0.02 0.42 -0.54 0.00 0.00 175.26 174.95 1bn5 s ILE 315 N 1.43 0.76 -1.43 -3.70 1.01 -0.64 -4.85 121.20 113.78 1bn5 s ILE 315 Ca 0.02 -0.34 -0.07 0.00 0.00 0.00 0.00 60.65 60.26 1bn5 s ILE 315 Cb -0.13 -0.98 0.04 0.00 0.01 0.00 0.00 42.46 41.40 1bn5 s ILE 315 CO -0.08 0.14 0.79 0.47 0.00 0.00 0.00 174.94 176.26 1bn5 n ASP 316 N 5.00 -2.69 0.00 3.58 8.00 -1.26 -2.12 116.55 127.06 1bn5 n ASP 316 Ca -0.10 -0.83 0.00 0.00 0.71 0.00 0.00 54.79 54.57 1bn5 n ASP 316 Cb 0.49 -3.83 0.00 0.00 -0.02 0.00 0.00 41.12 37.76 1bn5 n ASP 316 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1bn5 n GLY 317 N -1.66 0.72 3.30 0.44 0.00 -1.26 -5.02 105.19 101.70 1bn5 n GLY 317 Ca -0.14 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.58 1bn5 n GLY 317 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1bn5 s LYS 318 N -0.14 1.86 0.10 1.61 2.20 -0.90 -5.13 119.74 119.33 1bn5 s LYS 318 Ca 0.00 -0.96 0.03 0.00 -0.36 0.00 0.00 55.97 54.68 1bn5 s LYS 318 Cb 0.00 -1.90 -0.04 0.00 -1.51 0.00 0.00 37.83 34.39 1bn5 s LYS 318 CO 0.00 0.51 0.11 0.95 -0.36 0.00 0.00 175.35 176.55 1bn5 s THR 319 N -0.67 4.62 0.01 3.43 -4.23 -1.26 -1.62 115.64 115.91 1bn5 s THR 319 Ca 0.10 -0.79 0.00 0.00 -1.18 0.00 0.00 61.69 59.82 1bn5 s THR 319 Cb -0.10 -3.26 -0.01 0.00 1.34 0.00 0.00 72.50 70.48 1bn5 s THR 319 CO 0.00 0.08 -0.01 -0.31 -0.54 0.00 0.00 174.62 173.84 1bn5 s TYR 320 N -1.47 0.11 -0.11 3.99 1.51 -0.13 -4.99 117.35 116.26 1bn5 s TYR 320 Ca 0.30 -0.17 -0.24 0.00 -1.01 0.00 0.00 57.07 55.96 1bn5 s TYR 320 Cb -0.12 -0.08 -0.03 0.00 -0.11 0.00 0.00 41.96 41.63 1bn5 s TYR 320 CO 0.23 -0.06 0.73 -1.14 -1.11 0.00 0.00 175.55 174.20 1bn5 s GLN 321 N -0.46 4.37 0.15 -0.62 0.74 -1.26 -1.11 119.66 121.46 1bn5 s GLN 321 Ca -0.05 0.89 -0.31 0.00 0.05 0.00 0.00 55.36 55.93 1bn5 s GLN 321 Cb -0.03 -3.50 -0.10 0.00 1.10 0.00 0.00 33.01 30.48 1bn5 s GLN 321 CO -0.00 -0.09 1.53 0.08 -0.55 0.00 0.00 175.29 176.25 1bn5 s VAL 322 N 1.35 2.79 -0.02 1.34 1.01 -0.88 -4.91 120.40 121.08 1bn5 s VAL 322 Ca 0.37 0.56 0.05 0.00 0.00 0.00 0.00 61.98 62.96 1bn5 s VAL 322 Cb -0.17 -3.36 -0.03 0.00 0.00 0.00 0.00 36.38 32.82 1bn5 s VAL 322 CO 0.16 0.04 -0.17 -1.59 0.00 0.00 0.00 175.10 173.54 1bn5 s LYS 323 N 1.16 2.33 0.51 2.72 -2.85 -0.95 -4.11 119.74 118.55 1bn5 s LYS 323 Ca 0.69 -0.80 -0.22 0.00 -1.00 0.00 0.00 55.97 54.63 1bn5 s LYS 323 Cb -0.42 -2.28 -0.06 0.00 -2.06 0.00 0.00 37.83 33.01 1bn5 s LYS 323 CO 0.31 0.59 1.29 -2.14 0.10 0.00 0.00 175.35 175.50 1bn5 s PRO 324 N -0.89 3.40 -0.53 1.78 0.02 -1.26 -0.44 135.00 137.08 1bn5 s PRO 324 Ca 0.12 2.07 -0.27 0.00 0.02 0.00 0.00 61.00 62.94 1bn5 s PRO 324 Cb -0.10 -2.34 0.03 0.00 0.02 0.00 0.00 34.50 32.11 1bn5 s PRO 324 CO 0.01 -0.93 1.09 0.42 -0.33 0.00 0.00 177.00 177.26 1bn5 s ILE 325 N -1.39 4.21 0.16 2.83 1.01 -0.82 -4.69 121.20 122.51 1bn5 s ILE 325 Ca 0.68 0.82 0.31 0.00 0.00 0.00 0.00 60.65 62.47 1bn5 s ILE 325 Cb -0.36 -4.62 0.35 0.00 0.01 0.00 0.00 42.46 37.84 1bn5 s ILE 325 CO 0.43 -1.14 1.97 0.08 0.00 0.00 0.00 174.94 176.28 1bn5 h ARG 326 N 9.35 0.00 -0.49 2.79 0.11 -1.25 -2.52 114.38 122.38 1bn5 h ARG 326 Ca -0.25 0.00 -0.07 0.00 0.10 0.00 0.00 59.98 59.76 1bn5 h ARG 326 Cb 1.06 0.00 -0.04 0.00 1.11 0.00 0.00 29.97 32.10 1bn5 h ARG 326 CO 1.13 0.07 0.07 0.27 0.10 0.00 0.00 179.97 181.60 1bn5 n ASN 327 N -3.21 4.55 -4.48 0.08 6.94 -1.26 -4.80 115.26 113.08 1bn5 n ASN 327 Ca 0.00 -3.12 -0.28 0.00 -0.02 0.00 0.00 54.58 51.17 1bn5 n ASN 327 Cb 0.32 -0.65 -0.11 0.00 -2.36 0.00 0.00 39.78 36.98 1bn5 n ASN 327 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 1bn5 s LEU 328 N -2.90 2.65 0.15 -4.53 1.43 -0.95 -4.93 118.68 109.60 1bn5 s LEU 328 Ca 0.50 -0.68 -0.18 0.00 -1.03 0.00 0.00 54.13 52.73 1bn5 s LEU 328 Cb 0.40 -1.42 0.04 0.00 0.03 0.00 0.00 46.19 45.24 1bn5 s LEU 328 CO 0.11 0.14 0.48 0.20 0.23 0.00 0.00 176.35 177.51 1bn5 s ASN 329 N -2.49 -0.34 0.97 2.29 -0.87 -1.26 -4.34 114.94 108.90 1bn5 s ASN 329 Ca 0.20 -0.25 -0.15 0.00 -1.57 0.00 0.00 52.86 51.09 1bn5 s ASN 329 Cb -0.09 0.53 0.21 0.00 -0.02 0.00 0.00 41.25 41.88 1bn5 s ASN 329 CO 0.11 -0.92 1.28 0.61 -2.57 0.00 0.00 177.10 175.61 1bn5 n GLY 330 N -0.29 -1.28 3.56 0.66 0.00 0.25 -4.85 105.19 103.25 1bn5 n GLY 330 Ca -0.15 -1.74 -0.16 0.00 0.00 0.00 0.00 46.02 43.97 1bn5 n GLY 330 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1bn5 s HIS 331 N -3.79 -0.66 0.71 1.61 -3.43 -0.78 -0.51 115.29 108.44 1bn5 s HIS 331 Ca 0.74 1.32 -0.13 0.00 -0.80 0.00 0.00 55.06 56.18 1bn5 s HIS 331 Cb -0.02 0.37 0.03 0.00 -1.43 0.00 0.00 32.58 31.53 1bn5 s HIS 331 CO 0.51 -0.50 1.10 -1.54 -2.00 0.00 0.00 174.74 172.32 1bn5 s SER 332 N -0.67 4.81 -0.06 7.38 1.04 -0.61 -0.69 113.70 124.90 1bn5 s SER 332 Ca -0.06 1.93 0.06 0.00 0.48 0.00 0.00 55.95 58.36 1bn5 s SER 332 Cb -0.02 -2.54 -0.01 0.00 0.10 0.00 0.00 66.02 63.56 1bn5 s SER 332 CO 0.06 -1.83 -0.24 -0.63 0.98 0.00 0.00 173.24 171.58 1bn5 s ILE 333 N -2.57 2.02 0.46 -1.02 1.01 0.03 -1.06 121.20 120.07 1bn5 s ILE 333 Ca 0.65 -1.04 0.03 0.00 0.00 0.00 0.00 60.65 60.28 1bn5 s ILE 333 Cb -0.19 -1.72 -0.03 0.00 0.01 0.00 0.00 42.46 40.53 1bn5 s ILE 333 CO 0.48 0.56 0.04 -0.83 0.00 0.00 0.00 174.94 175.19 1bn5 s GLY 334 N -0.06 2.79 -0.01 6.18 0.00 0.09 -4.34 107.32 111.97 1bn5 s GLY 334 Ca -0.06 -0.96 -0.30 0.00 0.00 0.00 0.00 44.72 43.40 1bn5 s GLY 334 CO 0.05 -2.07 1.56 1.62 0.00 0.00 0.00 173.10 174.26 1bn5 s GLN 335 N -3.81 4.22 -1.48 2.90 0.74 -1.26 -1.31 119.66 119.65 1bn5 s GLN 335 Ca 0.16 2.13 0.00 0.00 0.05 0.00 0.00 55.36 57.70 1bn5 s GLN 335 Cb 0.03 -3.76 0.00 0.00 1.10 0.00 0.00 33.01 30.39 1bn5 s GLN 335 CO 0.09 -0.73 0.00 0.66 -0.55 0.00 0.00 175.29 174.76 1bn5 n TYR 336 N 6.21 -1.03 -3.44 1.67 4.01 -0.45 -4.93 117.16 119.19 1bn5 n TYR 336 Ca 0.15 0.00 -0.26 0.00 -0.16 0.00 0.00 57.90 57.63 1bn5 n TYR 336 Cb 0.43 -3.29 -0.11 0.00 -0.31 0.00 0.00 39.34 36.06 1bn5 n TYR 336 CO 0.00 0.00 0.00 0.50 -0.46 0.00 0.00 176.86 176.90 1bn5 s ARG 337 N -4.73 0.54 0.50 -0.72 3.52 -0.43 -4.26 118.95 113.37 1bn5 s ARG 337 Ca 0.00 -1.16 0.17 0.00 -0.13 0.00 0.00 55.73 54.61 1bn5 s ARG 337 Cb 0.00 -1.15 1.23 0.00 -1.56 0.00 0.00 34.95 33.47 1bn5 s ARG 337 CO 0.00 -1.19 2.09 0.97 -0.81 0.00 0.00 175.30 176.35 1bn5 h ILE 338 N 5.12 0.94 -3.51 4.11 6.09 -1.87 0.30 117.51 128.69 1bn5 h ILE 338 Ca 0.04 -0.04 -0.64 0.00 -1.37 0.00 0.00 64.86 62.85 1bn5 h ILE 338 Cb 0.99 0.82 -0.40 0.00 0.47 0.00 0.00 36.82 38.70 1bn5 h ILE 338 CO 0.26 0.02 -0.70 -1.00 -3.07 0.00 0.00 178.15 173.66 1bn5 s HIS 339 N -5.14 3.31 -0.98 2.19 3.76 -1.26 -4.41 115.29 112.76 1bn5 s HIS 339 Ca -0.06 -2.93 0.26 0.00 -0.15 0.00 0.00 55.06 52.19 1bn5 s HIS 339 Cb 0.18 -2.74 0.65 0.00 1.11 0.00 0.00 32.58 31.79 1bn5 s HIS 339 CO 0.70 -0.87 1.52 0.00 -0.85 0.00 0.00 174.74 175.24 1bn5 n ALA 340 N 3.90 3.26 0.00 -1.40 0.00 -0.22 -4.92 120.51 121.13 1bn5 n ALA 340 Ca 0.04 -0.29 0.00 0.00 0.00 0.00 0.00 53.44 53.19 1bn5 n ALA 340 Cb 0.38 -1.20 0.00 0.00 0.00 0.00 0.00 19.45 18.64 1bn5 n ALA 340 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1bn5 n GLY 341 N 1.49 1.28 3.90 0.00 0.00 -1.26 -4.96 105.19 105.65 1bn5 n GLY 341 Ca 0.06 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.76 1bn5 n GLY 341 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1bn5 s LYS 342 N 0.00 3.55 0.06 1.61 1.02 -1.26 -4.99 119.74 119.72 1bn5 s LYS 342 Ca 0.00 -0.21 0.09 0.00 0.02 0.00 0.00 55.97 55.87 1bn5 s LYS 342 Cb 0.00 -2.96 -0.03 0.00 -0.52 0.00 0.00 37.83 34.32 1bn5 s LYS 342 CO 0.00 0.55 -0.24 0.95 -0.92 0.00 0.00 175.35 175.69 1bn5 s THR 343 N -1.54 1.93 -0.42 2.17 -4.23 -1.26 -1.57 115.64 110.72 1bn5 s THR 343 Ca 0.36 -1.35 -0.10 0.00 -1.18 0.00 0.00 61.69 59.42 1bn5 s THR 343 Cb -0.13 -1.67 0.07 0.00 1.34 0.00 0.00 72.50 72.11 1bn5 s THR 343 CO 0.24 0.25 0.26 -0.69 -0.54 0.00 0.00 174.62 174.15 1bn5 s VAL 344 N -0.84 4.36 0.70 2.29 1.01 0.33 -4.90 120.40 123.35 1bn5 s VAL 344 Ca 0.10 -1.29 -0.14 0.00 0.00 0.00 0.00 61.98 60.65 1bn5 s VAL 344 Cb -0.09 -3.63 0.02 0.00 0.00 0.00 0.00 36.38 32.68 1bn5 s VAL 344 CO 0.02 -0.47 1.12 -2.16 0.00 0.00 0.00 175.10 173.62 1bn5 s PRO 345 N 1.46 2.51 -0.02 2.72 0.04 -1.26 -0.58 135.00 139.87 1bn5 s PRO 345 Ca 0.03 1.41 0.05 0.00 0.04 0.00 0.00 61.00 62.53 1bn5 s PRO 345 Cb -0.23 -1.91 0.13 0.00 0.04 0.00 0.00 34.50 32.54 1bn5 s PRO 345 CO 0.03 -1.48 1.10 0.44 0.04 0.00 0.00 177.00 177.13 1bn5 n ILE 346 N -2.76 1.12 -4.28 0.56 -5.35 -1.26 -3.34 119.36 104.04 1bn5 n ILE 346 Ca 0.11 -1.13 -0.15 0.00 -0.27 0.00 0.00 62.75 61.30 1bn5 n ILE 346 Cb 0.52 0.41 -0.10 0.00 -1.74 0.00 0.00 39.64 38.73 1bn5 n ILE 346 CO 0.00 0.00 0.00 0.27 -1.76 0.00 0.00 176.55 175.06 1bn5 s ILE 347 N -1.21 0.74 0.83 7.28 -4.36 -1.23 -3.64 121.20 119.59 1bn5 s ILE 347 Ca 0.11 -2.00 -0.10 0.00 -0.26 0.00 0.00 60.65 58.40 1bn5 s ILE 347 Cb 0.07 -2.32 0.09 0.00 1.25 0.00 0.00 42.46 41.55 1bn5 s ILE 347 CO 0.05 -0.31 1.11 -1.59 0.24 0.00 0.00 174.94 174.44 1bn5 s LYS 348 N -3.93 1.80 0.00 0.37 -2.85 -1.25 -3.98 119.74 109.89 1bn5 s LYS 348 Ca 0.29 1.28 0.00 0.00 -1.00 0.00 0.00 55.97 56.54 1bn5 s LYS 348 Cb 0.06 -1.84 0.00 0.00 -2.06 0.00 0.00 37.83 34.00 1bn5 s LYS 348 CO 0.08 -2.00 0.00 0.41 0.10 0.00 0.00 175.35 173.94 1bn5 n GLY 349 N -0.73 0.81 0.00 0.59 0.00 -1.26 -4.95 105.19 99.65 1bn5 n GLY 349 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.12 1bn5 n GLY 349 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bn5 n GLY 350 N -1.49 0.50 3.82 -0.02 0.00 -1.26 -5.05 105.19 101.69 1bn5 n GLY 350 Ca 0.00 -1.83 -0.34 0.00 0.00 0.00 0.00 46.02 43.85 1bn5 n GLY 350 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1bn5 s GLU 351 N 0.97 4.23 -0.05 1.61 2.02 -1.26 -4.72 118.70 121.50 1bn5 s GLU 351 Ca 0.00 1.01 0.07 0.00 0.02 0.00 0.00 54.97 56.07 1bn5 s GLU 351 Cb 0.00 -2.41 0.28 0.00 0.10 0.00 0.00 34.13 32.11 1bn5 s GLU 351 CO 0.00 0.11 1.08 0.00 0.02 0.00 0.00 175.26 176.47 1bn5 n ALA 352 N -0.26 2.76 -1.56 5.21 0.00 -1.26 -1.40 120.51 124.00 1bn5 n ALA 352 Ca 0.04 -0.62 -0.46 0.00 0.00 0.00 0.00 53.44 52.41 1bn5 n ALA 352 Cb 0.53 -1.02 -0.02 0.00 0.00 0.00 0.00 19.45 18.94 1bn5 n ALA 352 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1bn5 n THR 353 N 0.28 1.84 -3.80 0.00 -1.04 -1.26 -4.50 114.28 105.80 1bn5 n THR 353 Ca 0.10 -0.46 -0.32 0.00 -2.04 0.00 0.00 64.05 61.33 1bn5 n THR 353 Cb 0.44 -0.84 -0.05 0.00 -1.82 0.00 0.00 70.33 68.06 1bn5 n THR 353 CO 0.00 0.00 0.00 -0.13 -0.64 0.00 0.00 175.07 174.30 1bn5 s ARG 354 N -1.32 3.53 0.37 -2.82 0.52 -1.26 -0.49 118.95 117.48 1bn5 s ARG 354 Ca 0.61 -0.24 -0.26 0.00 -0.52 0.00 0.00 55.73 55.32 1bn5 s ARG 354 Cb -0.75 -2.98 -0.09 0.00 0.52 0.00 0.00 34.95 31.65 1bn5 s ARG 354 CO 0.58 0.57 1.19 -1.64 0.02 0.00 0.00 175.30 176.02 1bn5 s MET 355 N -2.38 4.20 0.17 3.54 -1.94 -0.56 -4.91 119.30 117.42 1bn5 s MET 355 Ca 0.35 1.91 0.11 0.00 -1.71 0.00 0.00 55.69 56.35 1bn5 s MET 355 Cb -0.13 -2.83 -0.04 0.00 2.01 0.00 0.00 34.83 33.85 1bn5 s MET 355 CO 0.24 -0.22 -0.24 -1.21 -0.01 0.00 0.00 175.02 173.59 1bn5 s GLU 356 N -2.08 1.44 0.29 2.03 2.02 -1.26 -1.07 118.70 120.07 1bn5 s GLU 356 Ca 0.54 -1.46 -0.30 0.00 0.02 0.00 0.00 54.97 53.77 1bn5 s GLU 356 Cb -0.33 -1.76 -0.12 0.00 0.10 0.00 0.00 34.13 32.02 1bn5 s GLU 356 CO 0.42 0.39 1.45 -1.91 0.02 0.00 0.00 175.26 175.63 1bn5 n GLU 357 N 0.43 2.34 0.00 1.61 2.13 -1.26 -2.15 120.64 123.74 1bn5 n GLU 357 Ca -0.14 0.83 0.00 0.00 0.66 0.00 0.00 57.16 58.51 1bn5 n GLU 357 Cb 0.55 -2.52 0.00 0.00 0.27 0.00 0.00 31.44 29.75 1bn5 n GLU 357 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1bn5 n GLY 358 N 1.71 2.26 3.79 8.31 0.00 0.12 -5.04 105.19 116.34 1bn5 n GLY 358 Ca 0.08 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.80 1bn5 n GLY 358 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1bn5 s GLU 359 N -0.40 2.34 -0.04 1.61 2.02 -0.91 -4.78 118.70 118.53 1bn5 s GLU 359 Ca 0.00 0.88 0.03 0.00 0.02 0.00 0.00 54.97 55.90 1bn5 s GLU 359 Cb 0.00 -1.93 0.01 0.00 0.10 0.00 0.00 34.13 32.31 1bn5 s GLU 359 CO 0.00 -1.50 -0.11 0.08 0.02 0.00 0.00 175.26 173.75 1bn5 s VAL 360 N -3.04 0.99 0.06 2.63 1.01 -1.26 -1.23 120.40 119.55 1bn5 s VAL 360 Ca 0.60 -0.43 0.07 0.00 0.00 0.00 0.00 61.98 62.22 1bn5 s VAL 360 Cb -0.15 -0.89 -0.03 0.00 0.00 0.00 0.00 36.38 35.31 1bn5 s VAL 360 CO 0.55 0.31 -0.19 -0.31 0.00 0.00 0.00 175.10 175.46 1bn5 s TYR 361 N 0.42 1.66 -0.38 5.22 1.51 -0.58 -0.79 117.35 124.40 1bn5 s TYR 361 Ca -0.08 -0.38 -0.17 0.00 -1.01 0.00 0.00 57.07 55.42 1bn5 s TYR 361 Cb -0.12 -0.96 0.00 0.00 -0.11 0.00 0.00 41.96 40.77 1bn5 s TYR 361 CO 0.02 0.11 0.45 0.00 -1.11 0.00 0.00 175.55 175.02 1bn5 s ALA 362 N -0.92 3.45 -0.48 3.71 0.00 0.14 -0.77 121.76 126.89 1bn5 s ALA 362 Ca 0.06 -1.25 -0.18 0.00 0.00 0.00 0.00 51.96 50.58 1bn5 s ALA 362 Cb -0.09 -2.99 0.05 0.00 0.00 0.00 0.00 23.12 20.09 1bn5 s ALA 362 CO 0.02 -1.34 0.57 0.42 0.00 0.00 0.00 175.76 175.43 1bn5 s ILE 363 N 2.23 4.95 0.01 0.00 -1.09 -0.17 -1.86 121.20 125.28 1bn5 s ILE 363 Ca 0.15 -0.49 0.05 0.00 -2.23 0.00 0.00 60.65 58.13 1bn5 s ILE 363 Cb -0.16 -4.23 -0.02 0.00 -1.58 0.00 0.00 42.46 36.47 1bn5 s ILE 363 CO 0.13 -0.70 -0.17 -1.83 -1.23 0.00 0.00 174.94 171.15 1bn5 s GLU 364 N 2.44 1.23 0.06 2.79 -1.05 -1.26 -1.89 118.70 121.03 1bn5 s GLU 364 Ca 0.14 -0.69 0.03 0.00 -0.15 0.00 0.00 54.97 54.29 1bn5 s GLU 364 Cb -0.19 -1.23 -0.03 0.00 -0.44 0.00 0.00 34.13 32.24 1bn5 s GLU 364 CO 0.12 0.33 -0.09 0.95 0.95 0.00 0.00 175.26 177.52 1bn5 s THR 365 N -0.58 0.72 -0.03 1.83 -4.23 -0.76 -4.15 115.64 108.45 1bn5 s THR 365 Ca 0.05 -1.30 0.04 0.00 -1.18 0.00 0.00 61.69 59.31 1bn5 s THR 365 Cb -0.07 -0.92 -0.01 0.00 1.34 0.00 0.00 72.50 72.84 1bn5 s THR 365 CO 0.00 -0.43 -0.15 -0.36 -0.54 0.00 0.00 174.62 173.14 1bn5 s PHE 366 N -1.76 1.46 0.08 3.99 0.40 -1.26 -2.53 117.98 118.36 1bn5 s PHE 366 Ca -0.04 -0.35 0.09 0.00 -0.60 0.00 0.00 56.93 56.03 1bn5 s PHE 366 Cb -0.07 -0.97 -0.03 0.00 0.51 0.00 0.00 43.02 42.45 1bn5 s PHE 366 CO 0.00 -0.10 -0.23 0.20 0.70 0.00 0.00 175.22 175.79 1bn5 s GLY 367 N -0.10 1.32 0.03 4.36 0.00 -0.28 -1.95 107.32 110.70 1bn5 s GLY 367 Ca 0.00 -1.25 -0.01 0.00 0.00 0.00 0.00 44.72 43.45 1bn5 s GLY 367 CO 0.01 -1.21 -0.00 -0.45 0.00 0.00 0.00 173.10 171.44 1bn5 s SER 368 N -1.64 0.31 0.00 1.64 0.15 0.42 -1.36 113.70 113.22 1bn5 s SER 368 Ca 0.09 -0.68 0.26 0.00 0.70 0.00 0.00 55.95 56.33 1bn5 s SER 368 Cb -0.10 0.16 0.84 0.00 -1.71 0.00 0.00 66.02 65.21 1bn5 s SER 368 CO 0.04 -0.44 1.62 0.35 1.20 0.00 0.00 173.24 176.00 1bn5 n THR 369 N 0.92 0.06 0.00 6.45 -2.24 -0.37 -2.24 114.28 116.86 1bn5 n THR 369 Ca -0.20 -0.33 0.00 0.00 -2.27 0.00 0.00 64.05 61.26 1bn5 n THR 369 Cb 0.58 0.65 0.00 0.00 -2.10 0.00 0.00 70.33 69.46 1bn5 n THR 369 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1bn5 n GLY 370 N 1.21 1.32 0.24 3.38 0.00 -1.26 -4.82 105.19 105.25 1bn5 n GLY 370 Ca 0.18 -1.08 0.14 0.00 0.00 0.00 0.00 46.02 45.26 1bn5 n GLY 370 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1bn5 h LYS 371 N 0.00 0.00 -0.24 1.61 1.79 -1.94 -3.48 116.57 114.31 1bn5 h LYS 371 Ca 0.00 0.00 -0.06 0.00 -2.18 0.00 0.00 60.65 58.41 1bn5 h LYS 371 Cb 0.00 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.64 1bn5 h LYS 371 CO 0.00 0.00 -0.06 0.41 -1.08 0.00 0.00 179.45 178.72 1bn5 n GLY 372 N 0.60 0.44 2.87 3.86 0.00 -1.26 -4.97 105.19 106.73 1bn5 n GLY 372 Ca 0.02 -0.88 -0.13 0.00 0.00 0.00 0.00 46.02 45.04 1bn5 n GLY 372 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1bn5 s VAL 373 N -2.12 -0.01 0.15 1.61 1.01 -1.26 -0.66 120.40 119.12 1bn5 s VAL 373 Ca 0.00 0.04 0.06 0.00 0.00 0.00 0.00 61.98 62.09 1bn5 s VAL 373 Cb 0.00 -0.05 -0.04 0.00 0.00 0.00 0.00 36.38 36.29 1bn5 s VAL 373 CO 0.00 0.02 0.01 0.68 0.00 0.00 0.00 175.10 175.80 1bn5 s VAL 374 N 0.22 3.84 0.16 2.92 -7.23 -1.26 -4.28 120.40 114.77 1bn5 s VAL 374 Ca -0.02 -1.28 0.07 0.00 -1.81 0.00 0.00 61.98 58.95 1bn5 s VAL 374 Cb -0.03 -2.90 -0.04 0.00 0.56 0.00 0.00 36.38 33.97 1bn5 s VAL 374 CO -0.01 -0.04 -0.15 -1.38 -0.31 0.00 0.00 175.10 173.21 1bn5 s HIS 375 N -1.60 1.61 0.27 2.82 -3.43 -0.32 -4.84 115.29 109.79 1bn5 s HIS 375 Ca 0.27 -0.56 -0.30 0.00 -0.80 0.00 0.00 55.06 53.67 1bn5 s HIS 375 Cb -0.10 -0.79 -0.11 0.00 -1.43 0.00 0.00 32.58 30.15 1bn5 s HIS 375 CO 0.19 0.26 1.49 -0.51 -2.00 0.00 0.00 174.74 174.17 1bn5 s ASP 376 N -2.86 6.55 0.10 7.38 1.01 -1.26 -1.43 116.67 126.16 1bn5 s ASP 376 Ca 0.16 2.78 -0.20 0.00 0.71 0.00 0.00 52.55 55.99 1bn5 s ASP 376 Cb -0.03 -2.63 0.05 0.00 1.01 0.00 0.00 42.92 41.32 1bn5 s ASP 376 CO 0.05 -0.78 0.50 -0.62 0.21 0.00 0.00 175.17 174.53 1bn5 s ASP 377 N 0.37 -0.40 0.29 0.27 2.15 -0.45 -4.92 116.67 113.98 1bn5 s ASP 377 Ca 0.60 -0.05 0.00 0.00 0.43 0.00 0.00 52.55 53.54 1bn5 s ASP 377 Cb -0.44 0.51 0.00 0.00 -0.30 0.00 0.00 42.92 42.69 1bn5 s ASP 377 CO 0.46 -0.83 0.00 0.23 -0.17 0.00 0.00 175.17 174.86 1bn5 n MET 378 N -0.02 -1.22 -2.48 4.34 2.81 -1.26 -3.74 117.12 115.55 1bn5 n MET 378 Ca -0.17 0.80 -0.36 0.00 -1.81 0.00 0.00 57.70 56.16 1bn5 n MET 378 Cb 0.63 -1.49 -0.03 0.00 -0.71 0.00 0.00 33.22 31.62 1bn5 n MET 378 CO 0.00 0.00 0.00 -2.00 1.51 0.00 0.00 175.97 175.48 1bn5 s GLU 379 N -1.25 4.05 0.12 0.03 2.12 -1.26 -4.79 118.70 117.73 1bn5 s GLU 379 Ca 0.00 1.56 -0.25 0.00 0.36 0.00 0.00 54.97 56.64 1bn5 s GLU 379 Cb 0.00 -2.48 -0.07 0.00 0.26 0.00 0.00 34.13 31.84 1bn5 s GLU 379 CO 0.00 -0.25 0.78 0.00 -0.54 0.00 0.00 175.26 175.25 1bn5 n SER 381 N 2.04 4.20 -4.77 0.00 3.41 -1.26 -4.96 113.62 112.27 1bn5 n SER 381 Ca -0.04 0.00 -0.36 0.00 -0.26 0.00 0.00 58.87 58.21 1bn5 n SER 381 Cb 0.49 0.53 -0.07 0.00 -0.26 0.00 0.00 64.21 64.90 1bn5 n SER 381 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 1bn5 s HIS 382 N -1.80 3.47 0.04 7.33 3.76 -1.26 -2.58 115.29 124.25 1bn5 s HIS 382 Ca 0.00 0.41 -0.00 0.00 -0.15 0.00 0.00 55.06 55.32 1bn5 s HIS 382 Cb 0.00 -2.11 -0.03 0.00 1.11 0.00 0.00 32.58 31.55 1bn5 s HIS 382 CO 0.00 0.42 -0.03 0.71 -0.85 0.00 0.00 174.74 174.98 1bn5 s TYR 383 N -0.04 0.40 -0.25 1.40 1.51 -0.61 -0.92 117.35 118.85 1bn5 s TYR 383 Ca 0.11 -0.80 -0.19 0.00 -1.01 0.00 0.00 57.07 55.17 1bn5 s TYR 383 Cb -0.11 -0.30 0.07 0.00 -0.11 0.00 0.00 41.96 41.51 1bn5 s TYR 383 CO 0.00 -0.28 0.64 1.41 -1.11 0.00 0.00 175.55 176.21 1bn5 s MET 384 N -2.72 0.71 0.33 -0.62 1.75 -0.52 -1.18 119.30 117.06 1bn5 s MET 384 Ca -0.04 1.01 -0.29 0.00 -1.25 0.00 0.00 55.69 55.13 1bn5 s MET 384 Cb -0.01 0.25 -0.12 0.00 2.84 0.00 0.00 34.83 37.79 1bn5 s MET 384 CO -0.06 -0.12 1.40 1.17 -0.65 0.00 0.00 175.02 176.76 1bn5 n LYS 385 N 3.47 2.33 -2.07 4.11 4.81 -1.26 -1.07 118.16 128.47 1bn5 n LYS 385 Ca -0.17 0.82 -0.42 0.00 -0.87 0.00 0.00 58.31 57.67 1bn5 n LYS 385 Cb 0.57 -2.48 -0.03 0.00 0.02 0.00 0.00 35.03 33.11 1bn5 n LYS 385 CO 0.00 0.00 0.00 1.21 1.17 0.00 0.00 177.40 179.78 1bn5 s ASN 386 N -0.07 6.72 0.42 3.14 3.84 -0.31 -4.82 114.94 123.87 1bn5 s ASN 386 Ca 0.58 2.28 0.10 0.00 0.21 0.00 0.00 52.86 56.03 1bn5 s ASN 386 Cb -0.55 -2.56 0.91 0.00 -0.55 0.00 0.00 41.25 38.51 1bn5 s ASN 386 CO 0.59 -0.82 2.01 0.15 -2.79 0.00 0.00 177.10 176.24 1bn5 h PHE 387 N 8.28 0.29 -0.00 0.43 3.57 -1.91 -2.77 116.94 124.82 1bn5 h PHE 387 Ca -0.40 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.09 1bn5 h PHE 387 Cb 1.19 -0.09 0.00 0.00 2.79 0.00 0.00 35.95 39.84 1bn5 h PHE 387 CO 0.78 0.28 -0.30 -0.25 -2.23 0.00 0.00 178.31 176.59 1bn5 n ASP 388 N -4.40 0.64 -4.73 0.41 8.00 -1.26 -4.87 116.55 110.34 1bn5 n ASP 388 Ca 0.00 -0.48 -0.41 0.00 0.71 0.00 0.00 54.79 54.61 1bn5 n ASP 388 Cb 0.16 0.09 -0.04 0.00 -0.02 0.00 0.00 41.12 41.30 1bn5 n ASP 388 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1bn5 s VAL 389 N -2.72 4.71 0.00 2.53 1.01 -1.05 -5.05 120.40 119.83 1bn5 s VAL 389 Ca 0.19 1.87 0.00 0.00 0.00 0.00 0.00 61.98 64.04 1bn5 s VAL 389 Cb 0.19 -4.23 0.00 0.00 0.00 0.00 0.00 36.38 32.34 1bn5 s VAL 389 CO 0.58 0.29 0.00 0.61 0.00 0.00 0.00 175.10 176.58 1bn5 n GLY 390 N 2.53 -0.08 3.73 4.51 0.00 -1.26 -4.98 105.19 109.64 1bn5 n GLY 390 Ca 0.01 -1.77 -0.42 0.00 0.00 0.00 0.00 46.02 43.84 1bn5 n GLY 390 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1bn5 n HIS 391 N -0.72 2.80 -3.85 1.61 -0.00 -1.26 -5.02 115.22 108.78 1bn5 n HIS 391 Ca 0.00 0.20 -0.27 0.00 0.46 0.00 0.00 57.72 58.11 1bn5 n HIS 391 Cb 0.00 -2.62 -0.17 0.00 -0.12 0.00 0.00 29.99 27.09 1bn5 n HIS 391 CO 0.00 0.00 0.00 0.08 0.46 0.00 0.00 176.34 176.88 1bn5 s VAL 392 N 0.34 0.88 0.08 3.57 1.01 -1.26 -5.11 120.40 119.91 1bn5 s VAL 392 Ca 0.67 -0.41 -0.31 0.00 0.00 0.00 0.00 61.98 61.93 1bn5 s VAL 392 Cb -0.50 -1.06 -0.09 0.00 0.00 0.00 0.00 36.38 34.72 1bn5 s VAL 392 CO 0.44 0.15 1.71 -2.84 0.00 0.00 0.00 175.10 174.56 1bn5 s PRO 393 N 1.74 4.18 -0.07 2.72 0.02 -1.26 -5.02 135.00 137.31 1bn5 s PRO 393 Ca 0.02 2.40 0.04 0.00 0.02 0.00 0.00 61.00 63.48 1bn5 s PRO 393 Cb -0.14 -3.63 0.00 0.00 0.02 0.00 0.00 34.50 30.75 1bn5 s PRO 393 CO -0.07 -0.77 -0.18 0.42 -0.33 0.00 0.00 177.00 176.06 1bn5 s ILE 394 N 2.77 1.59 -0.18 2.83 -1.09 -1.26 -5.03 121.20 120.83 1bn5 s ILE 394 Ca 0.76 -0.77 0.17 0.00 -2.23 0.00 0.00 60.65 58.58 1bn5 s ILE 394 Cb -0.41 -1.39 -0.23 0.00 -1.58 0.00 0.00 42.46 38.85 1bn5 s ILE 394 CO 0.33 0.45 0.08 0.54 -1.23 0.00 0.00 174.94 175.12 1bn5 n ARG 395 N 3.46 0.93 -1.68 2.79 1.74 -1.26 -4.75 116.66 117.88 1bn5 n ARG 395 Ca -0.20 -0.02 -0.50 0.00 -0.77 0.00 0.00 57.85 56.37 1bn5 n ARG 395 Cb 0.52 -1.48 -0.05 0.00 -1.02 0.00 0.00 32.46 30.43 1bn5 n ARG 395 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 1bn5 n LEU 396 N -2.68 3.28 -0.12 0.55 4.77 -1.26 -4.85 117.00 116.69 1bn5 n LEU 396 Ca -0.30 0.99 -0.10 0.00 -0.03 0.00 0.00 56.01 56.58 1bn5 n LEU 396 Cb 1.09 -1.34 -0.02 0.00 -2.33 0.00 0.00 43.42 40.82 1bn5 n LEU 396 CO 0.40 -0.12 0.87 -0.65 -1.33 0.00 0.00 177.39 176.56 1bn5 h PRO 397 N 8.77 0.56 -0.11 3.23 0.10 -1.99 0.97 132.00 143.53 1bn5 h PRO 397 Ca -0.48 -0.12 -0.18 0.00 0.10 0.00 0.00 66.00 65.31 1bn5 h PRO 397 Cb 1.28 -0.08 -0.00 0.00 0.10 0.00 0.00 31.00 32.30 1bn5 h PRO 397 CO 0.95 0.59 -0.70 0.00 0.10 0.00 0.00 178.00 178.93 1bn5 h ARG 398 N 0.42 0.48 -0.37 1.05 3.08 -2.00 -1.03 114.38 116.01 1bn5 h ARG 398 Ca 0.11 -0.37 -0.10 0.00 0.07 0.00 0.00 59.98 59.69 1bn5 h ARG 398 Cb 0.27 0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.38 1bn5 h ARG 398 CO -0.00 1.00 -0.17 1.15 -1.07 0.00 0.00 179.97 180.88 1bn5 h THR 399 N 0.33 1.28 -0.29 2.04 2.02 -1.85 -1.73 112.91 114.71 1bn5 h THR 399 Ca -0.03 -1.29 -0.00 0.00 0.77 0.00 0.00 66.41 65.86 1bn5 h THR 399 Cb 1.28 1.34 -0.01 0.00 -1.74 0.00 0.00 68.15 69.01 1bn5 h THR 399 CO 0.13 0.43 0.18 0.50 0.37 0.00 0.00 175.52 177.12 1bn5 h LYS 400 N 0.55 0.40 -0.49 6.66 3.64 -0.74 -1.24 116.57 125.35 1bn5 h LYS 400 Ca 0.08 -0.03 0.02 0.00 -1.27 0.00 0.00 60.65 59.45 1bn5 h LYS 400 Cb 0.71 -0.08 -0.03 0.00 -0.41 0.00 0.00 32.23 32.42 1bn5 h LYS 400 CO 0.05 0.30 0.29 1.25 -2.27 0.00 0.00 179.45 179.08 1bn5 h HIS 401 N 0.38 0.55 -0.57 1.91 2.76 -1.13 -1.32 115.15 117.73 1bn5 h HIS 401 Ca 0.11 0.02 -0.09 0.00 -2.20 0.00 0.00 60.37 58.20 1bn5 h HIS 401 Cb 0.00 -0.18 -0.02 0.00 1.55 0.00 0.00 27.41 28.77 1bn5 h HIS 401 CO -0.04 0.32 0.01 1.25 -1.30 0.00 0.00 177.93 178.16 1bn5 h LEU 402 N 0.59 0.98 -1.05 0.26 5.85 -1.13 -0.77 115.31 120.04 1bn5 h LEU 402 Ca 0.19 -0.30 0.01 0.00 0.84 0.00 0.00 57.88 58.62 1bn5 h LEU 402 Cb 0.01 -0.26 -0.05 0.00 0.37 0.00 0.00 40.66 40.72 1bn5 h LEU 402 CO -0.08 1.04 0.63 0.25 -0.34 0.00 0.00 178.44 179.94 1bn5 h LEU 403 N 0.89 1.11 -0.59 2.25 5.85 -1.06 0.33 115.31 124.09 1bn5 h LEU 403 Ca 0.16 -0.03 -0.02 0.00 0.84 0.00 0.00 57.88 58.83 1bn5 h LEU 403 Cb 0.53 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 41.26 1bn5 h LEU 403 CO 0.03 0.81 0.29 0.78 -0.34 0.00 0.00 178.44 180.00 1bn5 h ASN 404 N 1.30 0.76 -0.44 1.25 2.35 -0.82 0.30 115.58 120.28 1bn5 h ASN 404 Ca 0.35 -0.12 0.05 0.00 -0.55 0.00 0.00 56.30 56.03 1bn5 h ASN 404 Cb -0.14 -0.19 -0.05 0.00 0.05 0.00 0.00 38.32 37.98 1bn5 h ASN 404 CO -0.07 0.67 0.16 0.58 -1.65 0.00 0.00 177.43 177.11 1bn5 h VAL 405 N 0.80 0.87 -0.49 2.81 2.07 -0.59 -0.74 116.25 120.96 1bn5 h VAL 405 Ca 0.20 -0.12 -0.02 0.00 0.82 0.00 0.00 66.70 67.58 1bn5 h VAL 405 Cb 0.10 0.50 -0.02 0.00 -1.52 0.00 0.00 31.29 30.35 1bn5 h VAL 405 CO -0.03 0.06 0.22 0.40 0.02 0.00 0.00 177.57 178.25 1bn5 h ILE 406 N 0.34 1.20 -0.84 4.57 2.04 -0.61 -1.65 117.51 122.56 1bn5 h ILE 406 Ca 0.21 -0.59 -0.03 0.00 1.00 0.00 0.00 64.86 65.45 1bn5 h ILE 406 Cb 0.19 0.67 -0.04 0.00 -0.74 0.00 0.00 36.82 36.91 1bn5 h ILE 406 CO -0.21 0.23 0.41 0.78 0.00 0.00 0.00 178.15 179.36 1bn5 h ASN 407 N 0.66 1.09 -0.24 1.72 2.35 -0.64 0.12 115.58 120.64 1bn5 h ASN 407 Ca 0.17 -0.13 -0.19 0.00 -0.55 0.00 0.00 56.30 55.60 1bn5 h ASN 407 Cb 0.15 -0.28 0.00 0.00 0.05 0.00 0.00 38.32 38.24 1bn5 h ASN 407 CO -0.02 0.91 -0.58 -0.33 -1.65 0.00 0.00 177.43 175.77 1bn5 h GLU 408 N 1.19 0.84 0.01 0.81 5.08 -0.96 -3.17 114.58 118.37 1bn5 h GLU 408 Ca 0.29 -0.55 -0.37 0.00 -1.00 0.00 0.00 59.36 57.73 1bn5 h GLU 408 Cb 0.11 0.07 -0.07 0.00 0.50 0.00 0.00 28.75 29.36 1bn5 h GLU 408 CO -0.04 1.18 -2.32 0.09 -1.00 0.00 0.00 179.01 176.92 1bn5 n ASN 409 N -3.99 0.66 -0.01 1.42 3.02 -0.64 -4.73 115.26 110.99 1bn5 n ASN 409 Ca -0.05 0.02 -0.01 0.00 -0.03 0.00 0.00 54.58 54.51 1bn5 n ASN 409 Cb 0.64 0.47 -0.02 0.00 -0.61 0.00 0.00 39.78 40.26 1bn5 n ASN 409 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 1bn5 n PHE 410 N -2.94 0.00 0.00 3.10 3.72 0.29 -4.78 117.46 116.86 1bn5 n PHE 410 Ca -0.34 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.06 1bn5 n PHE 410 Cb 1.10 -0.10 0.00 0.00 -0.94 0.00 0.00 39.48 39.55 1bn5 n PHE 410 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1bn5 n GLY 411 N 2.85 3.65 1.30 1.37 0.00 -0.39 -1.32 105.19 112.66 1bn5 n GLY 411 Ca -0.03 0.16 0.11 0.00 0.00 0.00 0.00 46.02 46.26 1bn5 n GLY 411 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1bn5 n THR 412 N 0.00 0.95 -2.68 2.61 -2.24 -1.26 -4.53 114.28 107.12 1bn5 n THR 412 Ca 0.00 -0.94 -0.32 0.00 -2.27 0.00 0.00 64.05 60.52 1bn5 n THR 412 Cb 0.00 0.46 -0.05 0.00 -2.10 0.00 0.00 70.33 68.64 1bn5 n THR 412 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1bn5 s LEU 413 N -1.01 3.82 0.66 3.22 1.43 -0.43 -4.67 118.68 121.70 1bn5 s LEU 413 Ca 0.47 1.57 -0.14 0.00 -1.03 0.00 0.00 54.13 55.00 1bn5 s LEU 413 Cb 0.24 -4.45 -0.00 0.00 0.03 0.00 0.00 46.19 42.01 1bn5 s LEU 413 CO 0.32 -0.44 1.08 0.00 0.23 0.00 0.00 176.35 177.54 1bn5 s ALA 414 N -2.35 2.56 0.25 4.21 0.00 -1.21 -4.60 121.76 120.62 1bn5 s ALA 414 Ca 0.59 0.37 -0.03 0.00 0.00 0.00 0.00 51.96 52.90 1bn5 s ALA 414 Cb -0.10 -3.26 -0.02 0.00 0.00 0.00 0.00 23.12 19.74 1bn5 s ALA 414 CO 0.22 -1.20 0.29 -0.59 0.00 0.00 0.00 175.76 174.47 1bn5 s PHE 415 N -2.60 1.06 0.35 0.00 -0.71 -0.32 -4.39 117.98 111.38 1bn5 s PHE 415 Ca 0.63 -1.26 0.03 0.00 -1.04 0.00 0.00 56.93 55.29 1bn5 s PHE 415 Cb -0.17 -0.34 -0.04 0.00 -1.21 0.00 0.00 43.02 41.26 1bn5 s PHE 415 CO 0.45 -0.84 0.10 0.00 -1.34 0.00 0.00 175.22 173.59 1bn5 h ARG 417 N 2.00 0.66 -0.65 0.00 3.08 -1.86 -2.41 114.38 115.20 1bn5 h ARG 417 Ca -0.38 -0.18 0.03 0.00 0.07 0.00 0.00 59.98 59.53 1bn5 h ARG 417 Cb 1.26 -0.08 -0.04 0.00 0.08 0.00 0.00 29.97 31.20 1bn5 h ARG 417 CO 0.62 0.71 0.43 0.00 -1.07 0.00 0.00 179.97 180.66 1bn5 h ARG 418 N 0.62 0.76 0.00 0.04 3.08 -1.88 -1.10 114.38 115.89 1bn5 h ARG 418 Ca 0.12 -0.05 -0.07 0.00 0.07 0.00 0.00 59.98 60.06 1bn5 h ARG 418 Cb 0.45 -0.17 -0.01 0.00 0.08 0.00 0.00 29.97 30.32 1bn5 h ARG 418 CO 0.02 0.50 -0.31 -1.49 -1.07 0.00 0.00 179.97 177.62 1bn5 h TRP 419 N 0.78 0.00 -0.11 3.04 4.06 -1.85 -2.06 115.95 119.81 1bn5 h TRP 419 Ca 0.26 0.00 -0.22 0.00 2.06 0.00 0.00 58.89 60.99 1bn5 h TRP 419 Cb 0.06 0.00 0.01 0.00 -1.00 0.00 0.00 29.16 28.24 1bn5 h TRP 419 CO -0.00 0.31 -0.79 -0.07 -3.56 0.00 0.00 178.44 174.33 1bn5 h LEU 420 N 0.00 0.89 -1.00 -4.49 3.38 -1.07 -3.27 115.31 109.74 1bn5 h LEU 420 Ca -0.00 -0.66 0.02 0.00 0.09 0.00 0.00 57.88 57.33 1bn5 h LEU 420 Cb 0.75 -0.27 -0.05 0.00 0.09 0.00 0.00 40.66 41.18 1bn5 h LEU 420 CO 0.04 1.41 0.66 0.44 0.09 0.00 0.00 178.44 181.08 1bn5 h ASP 421 N 0.44 1.12 0.26 -0.43 3.32 -1.07 -1.91 116.42 118.16 1bn5 h ASP 421 Ca -0.07 -0.02 -0.03 0.00 0.02 0.00 0.00 57.03 56.93 1bn5 h ASP 421 Cb 1.44 -0.27 -0.00 0.00 0.22 0.00 0.00 39.33 40.71 1bn5 h ASP 421 CO 0.16 0.79 -0.15 -0.09 -1.72 0.00 0.00 179.24 178.23 1bn5 h ARG 422 N 1.31 0.00 -0.16 3.56 2.43 -1.47 -1.15 114.38 118.90 1bn5 h ARG 422 Ca 0.38 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.55 1bn5 h ARG 422 Cb -0.08 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.47 1bn5 h ARG 422 CO -0.10 0.15 0.00 1.28 -1.51 0.00 0.00 179.97 179.79 1bn5 n LEU 423 N -3.95 1.13 0.00 3.80 4.77 -0.74 -4.90 117.00 117.11 1bn5 n LEU 423 Ca -0.02 -0.52 0.00 0.00 -0.03 0.00 0.00 56.01 55.44 1bn5 n LEU 423 Cb 0.24 -0.11 0.00 0.00 -2.33 0.00 0.00 43.42 41.22 1bn5 n LEU 423 CO 0.33 0.26 0.00 0.61 -1.33 0.00 0.00 177.39 177.26 1bn5 n GLY 424 N 0.94 0.61 3.77 -0.72 0.00 -0.43 -5.05 105.19 104.31 1bn5 n GLY 424 Ca 0.12 -0.06 -0.38 0.00 0.00 0.00 0.00 46.02 45.70 1bn5 n GLY 424 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1bn5 s GLU 425 N -0.31 4.57 0.11 1.61 0.41 -1.07 -5.04 118.70 118.98 1bn5 s GLU 425 Ca 0.00 1.49 -0.08 0.00 -0.41 0.00 0.00 54.97 55.97 1bn5 s GLU 425 Cb 0.00 -2.93 -0.01 0.00 -1.78 0.00 0.00 34.13 29.41 1bn5 s GLU 425 CO 0.00 0.24 0.19 -1.54 -0.49 0.00 0.00 175.26 173.66 1bn5 s SER 426 N -1.38 0.14 -1.34 -0.19 1.04 -1.26 -4.34 113.70 106.37 1bn5 s SER 426 Ca 0.49 -0.79 -0.04 0.00 0.48 0.00 0.00 55.95 56.08 1bn5 s SER 426 Cb -0.23 0.35 0.02 0.00 0.10 0.00 0.00 66.02 66.26 1bn5 s SER 426 CO 0.29 -0.77 0.87 0.29 0.98 0.00 0.00 173.24 174.90 1bn5 n LYS 427 N -0.10 -5.69 -0.01 4.02 5.02 -1.26 -4.89 118.16 115.25 1bn5 n LYS 427 Ca -0.12 0.68 0.07 0.00 -2.02 0.00 0.00 58.31 56.92 1bn5 n LYS 427 Cb 0.63 -5.45 0.06 0.00 -0.02 0.00 0.00 35.03 30.25 1bn5 n LYS 427 CO 0.00 0.00 0.00 2.48 -0.52 0.00 0.00 177.40 179.36 1bn5 n TYR 428 N -4.41 0.03 0.06 2.13 0.18 -1.26 -4.70 117.16 109.18 1bn5 n TYR 428 Ca -0.19 -0.03 -0.05 0.00 1.88 0.00 0.00 57.90 59.51 1bn5 n TYR 428 Cb 0.63 -0.00 0.15 0.00 -0.38 0.00 0.00 39.34 39.74 1bn5 n TYR 428 CO 0.00 0.00 0.00 -0.07 -2.08 0.00 0.00 176.86 174.71 1bn5 h LEU 429 N 2.64 0.37 -0.38 -3.48 3.38 -1.99 0.93 115.31 116.79 1bn5 h LEU 429 Ca 0.00 -0.18 -0.18 0.00 0.09 0.00 0.00 57.88 57.62 1bn5 h LEU 429 Cb 0.57 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 41.22 1bn5 h LEU 429 CO 0.00 0.79 -0.55 -0.03 0.09 0.00 0.00 178.44 178.74 1bn5 h MET 430 N 0.28 0.75 -0.99 1.13 4.05 -2.00 -0.34 114.93 117.82 1bn5 h MET 430 Ca 0.02 -0.48 0.01 0.00 -0.28 0.00 0.00 59.70 58.97 1bn5 h MET 430 Cb 0.94 0.06 -0.05 0.00 -0.80 0.00 0.00 31.60 31.74 1bn5 h MET 430 CO 0.08 1.10 0.66 0.00 0.23 0.00 0.00 176.91 178.98 1bn5 h ALA 431 N 0.80 1.29 -0.54 0.39 0.00 -1.70 -0.77 119.26 118.73 1bn5 h ALA 431 Ca 0.01 -0.07 -0.04 0.00 0.00 0.00 0.00 54.91 54.82 1bn5 h ALA 431 Cb 1.14 -0.40 -0.02 0.00 0.00 0.00 0.00 17.79 18.50 1bn5 h ALA 431 CO 0.12 0.66 0.19 1.25 0.00 0.00 0.00 179.25 181.46 1bn5 h LEU 432 N 1.34 0.76 -0.61 0.00 5.85 -0.57 -1.92 115.31 120.17 1bn5 h LEU 432 Ca 0.36 -0.19 0.03 0.00 0.84 0.00 0.00 57.88 58.93 1bn5 h LEU 432 Cb -0.15 -0.20 -0.04 0.00 0.37 0.00 0.00 40.66 40.64 1bn5 h LEU 432 CO -0.08 0.75 0.37 0.50 -0.34 0.00 0.00 178.44 179.63 1bn5 h LYS 433 N 0.74 0.70 -0.51 1.25 3.64 -0.83 -1.70 116.57 119.85 1bn5 h LYS 433 Ca 0.18 -0.04 0.07 0.00 -1.27 0.00 0.00 60.65 59.58 1bn5 h LYS 433 Cb 0.24 -0.16 -0.06 0.00 -0.41 0.00 0.00 32.23 31.84 1bn5 h LYS 433 CO -0.01 0.46 0.18 -0.91 -2.27 0.00 0.00 179.45 176.90 1bn5 h ASN 434 N 0.72 0.19 0.26 4.20 2.35 -0.75 0.56 115.58 123.10 1bn5 h ASN 434 Ca 0.25 0.06 -0.04 0.00 -0.55 0.00 0.00 56.30 56.02 1bn5 h ASN 434 Cb 0.04 0.04 -0.01 0.00 0.05 0.00 0.00 38.32 38.45 1bn5 h ASN 434 CO -0.11 0.13 -0.18 -0.07 -1.65 0.00 0.00 177.43 175.56 1bn5 h LEU 435 N 0.36 0.00 0.00 1.61 3.38 -1.07 -0.26 115.31 119.34 1bn5 h LEU 435 Ca 0.25 0.00 -0.23 0.00 0.09 0.00 0.00 57.88 57.99 1bn5 h LEU 435 Cb 0.26 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.03 1bn5 h LEU 435 CO -0.25 0.18 -0.89 0.00 0.09 0.00 0.00 178.44 177.57 1bn5 h ASP 437 N 0.21 0.00 0.88 0.00 3.32 -0.54 -0.90 116.42 119.39 1bn5 h ASP 437 Ca -0.11 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.94 1bn5 h ASP 437 Cb 1.57 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.12 1bn5 h ASP 437 CO 0.17 0.38 0.00 0.18 -1.72 0.00 0.00 179.24 178.25 1bn5 n LEU 438 N -3.99 0.41 -0.08 1.55 4.77 -0.14 -4.91 117.00 114.61 1bn5 n LEU 438 Ca -0.02 0.57 -0.01 0.00 -0.03 0.00 0.00 56.01 56.53 1bn5 n LEU 438 Cb 0.42 -0.49 -0.00 0.00 -2.33 0.00 0.00 43.42 41.02 1bn5 n LEU 438 CO 0.38 -0.30 -0.01 0.61 -1.33 0.00 0.00 177.39 176.75 1bn5 n GLY 439 N 0.56 0.46 0.18 -0.72 0.00 -0.34 -4.90 105.19 100.42 1bn5 n GLY 439 Ca 0.04 -0.17 -0.18 0.00 0.00 0.00 0.00 46.02 45.72 1bn5 n GLY 439 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1bn5 h ILE 440 N 0.00 1.34 -3.92 -0.61 2.04 -1.54 -3.43 117.51 111.40 1bn5 h ILE 440 Ca -0.02 -2.01 -0.68 0.00 1.00 0.00 0.00 64.86 63.15 1bn5 h ILE 440 Cb 0.26 2.27 -0.21 0.00 -0.74 0.00 0.00 36.82 38.40 1bn5 h ILE 440 CO 0.03 0.61 -0.79 -0.69 0.00 0.00 0.00 178.15 177.31 1bn5 s VAL 441 N -3.51 2.92 -0.08 1.67 1.01 -0.93 -1.17 120.40 120.32 1bn5 s VAL 441 Ca -0.12 -1.12 0.01 0.00 0.00 0.00 0.00 61.98 60.75 1bn5 s VAL 441 Cb 0.06 -2.24 -0.03 0.00 0.00 0.00 0.00 36.38 34.18 1bn5 s VAL 441 CO 0.87 0.35 -0.08 -1.81 0.00 0.00 0.00 175.10 174.43 1bn5 s ASP 442 N -1.43 4.57 0.21 3.32 1.01 -0.23 -4.03 116.67 120.08 1bn5 s ASP 442 Ca 0.15 -0.06 -0.23 0.00 0.71 0.00 0.00 52.55 53.12 1bn5 s ASP 442 Cb -0.11 -1.21 -0.08 0.00 1.01 0.00 0.00 42.92 42.53 1bn5 s ASP 442 CO 0.06 0.33 0.78 -2.16 0.21 0.00 0.00 175.17 174.39 1bn5 s PRO 443 N -0.64 4.45 -0.49 8.23 0.04 -1.26 -1.43 135.00 143.89 1bn5 s PRO 443 Ca 0.10 1.07 0.03 0.00 0.04 0.00 0.00 61.00 62.24 1bn5 s PRO 443 Cb -0.11 -3.04 0.14 0.00 0.04 0.00 0.00 34.50 31.52 1bn5 s PRO 443 CO 0.02 0.46 0.27 0.71 0.04 0.00 0.00 177.00 178.50 1bn5 s TYR 444 N -1.36 2.52 0.80 0.56 1.51 -0.10 -4.98 117.35 116.31 1bn5 s TYR 444 Ca 0.41 -2.77 -0.11 0.00 -1.01 0.00 0.00 57.07 53.58 1bn5 s TYR 444 Cb -0.20 -2.27 0.07 0.00 -0.11 0.00 0.00 41.96 39.46 1bn5 s TYR 444 CO 0.24 -0.75 1.09 -1.25 -1.11 0.00 0.00 175.55 173.77 1bn5 s PRO 445 N -0.04 2.05 0.49 -1.71 0.04 -1.26 -4.11 135.00 130.46 1bn5 s PRO 445 Ca 0.18 0.77 -0.23 0.00 0.04 0.00 0.00 61.00 61.77 1bn5 s PRO 445 Cb -0.22 -1.90 -0.08 0.00 0.04 0.00 0.00 34.50 32.34 1bn5 s PRO 445 CO -0.02 -1.68 1.17 -2.30 0.04 0.00 0.00 177.00 174.21 1bn5 n PRO 446 N -3.49 1.52 -4.06 0.56 -0.02 -1.24 -4.80 135.00 123.48 1bn5 n PRO 446 Ca 0.07 0.55 -0.33 0.00 -2.02 0.00 0.00 63.50 61.77 1bn5 n PRO 446 Cb 0.55 -2.31 -0.15 0.00 -0.02 0.00 0.00 33.50 31.57 1bn5 n PRO 446 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1bn5 s LEU 447 N -1.92 2.71 0.04 2.45 1.43 -0.53 -1.34 118.68 121.53 1bn5 s LEU 447 Ca 0.67 -0.85 0.05 0.00 -1.03 0.00 0.00 54.13 52.97 1bn5 s LEU 447 Cb -0.48 -1.55 -0.02 0.00 0.03 0.00 0.00 46.19 44.17 1bn5 s LEU 447 CO 0.53 -0.07 -0.14 0.00 0.23 0.00 0.00 176.35 176.90 1bn5 n ASP 449 N 1.82 0.18 -4.74 0.00 -0.08 0.06 -1.18 116.55 112.62 1bn5 n ASP 449 Ca -0.18 -1.21 -0.32 0.00 -1.51 0.00 0.00 54.79 51.57 1bn5 n ASP 449 Cb 0.55 -0.22 0.10 0.00 2.34 0.00 0.00 41.12 43.89 1bn5 n ASP 449 CO 0.00 0.00 0.00 0.27 0.12 0.00 0.00 177.20 177.59 1bn5 s ILE 450 N -1.20 2.86 0.26 5.18 -4.36 -1.26 -4.79 121.20 117.89 1bn5 s ILE 450 Ca 0.18 0.33 -0.30 0.00 -0.26 0.00 0.00 60.65 60.60 1bn5 s ILE 450 Cb -0.01 -2.72 -0.13 0.00 1.25 0.00 0.00 42.46 40.85 1bn5 s ILE 450 CO 0.13 -0.32 1.35 1.17 0.24 0.00 0.00 174.94 177.51 1bn5 n LYS 451 N -3.33 2.00 -0.47 0.37 4.81 -1.26 -1.89 118.16 118.39 1bn5 n LYS 451 Ca 0.11 0.71 0.00 0.00 -0.87 0.00 0.00 58.31 58.26 1bn5 n LYS 451 Cb 0.52 -2.33 0.00 0.00 0.02 0.00 0.00 35.03 33.24 1bn5 n LYS 451 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1bn5 n GLY 452 N 1.79 1.38 3.93 3.14 0.00 -1.26 -5.06 105.19 109.11 1bn5 n GLY 452 Ca 0.10 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.87 1bn5 n GLY 452 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1bn5 s SER 453 N -3.18 6.05 -0.07 1.61 1.04 -0.79 -4.99 113.70 113.36 1bn5 s SER 453 Ca 0.00 0.57 0.05 0.00 0.48 0.00 0.00 55.95 57.05 1bn5 s SER 453 Cb 0.00 -1.89 -0.01 0.00 0.10 0.00 0.00 66.02 64.22 1bn5 s SER 453 CO 0.00 -0.60 -0.24 -0.31 0.98 0.00 0.00 173.24 173.07 1bn5 s TYR 454 N -2.60 2.49 0.07 5.02 2.02 -1.26 -2.40 117.35 120.70 1bn5 s TYR 454 Ca 0.46 -0.79 0.08 0.00 -0.37 0.00 0.00 57.07 56.45 1bn5 s TYR 454 Cb -0.10 -1.64 -0.03 0.00 -0.40 0.00 0.00 41.96 39.79 1bn5 s TYR 454 CO 0.40 -0.26 -0.21 0.95 -1.57 0.00 0.00 175.55 174.87 1bn5 s THR 455 N -0.03 1.69 0.06 -0.71 -4.23 -0.82 -1.23 115.64 110.37 1bn5 s THR 455 Ca -0.08 -1.38 0.02 0.00 -1.18 0.00 0.00 61.69 59.07 1bn5 s THR 455 Cb -0.15 -1.51 -0.03 0.00 1.34 0.00 0.00 72.50 72.15 1bn5 s THR 455 CO 0.05 0.07 -0.07 0.00 -0.54 0.00 0.00 174.62 174.12 1bn5 s ALA 456 N -0.99 0.67 -0.01 3.99 0.00 -0.46 -4.78 121.76 120.17 1bn5 s ALA 456 Ca 0.07 -0.93 -0.01 0.00 0.00 0.00 0.00 51.96 51.09 1bn5 s ALA 456 Cb -0.09 0.08 0.01 0.00 0.00 0.00 0.00 23.12 23.12 1bn5 s ALA 456 CO 0.03 -0.09 0.03 -1.14 0.00 0.00 0.00 175.76 174.59 1bn5 s GLN 457 N -2.26 0.03 0.00 0.00 0.74 -1.26 -1.13 119.66 115.79 1bn5 s GLN 457 Ca -0.04 0.07 0.02 0.00 0.05 0.00 0.00 55.36 55.46 1bn5 s GLN 457 Cb -0.05 -0.01 -0.01 0.00 1.10 0.00 0.00 33.01 34.04 1bn5 s GLN 457 CO -0.01 -0.02 -0.06 -0.06 -0.55 0.00 0.00 175.29 174.58 1bn5 s PHE 458 N 0.15 0.57 -0.05 1.67 0.08 -1.05 -3.19 117.98 116.16 1bn5 s PHE 458 Ca -0.01 -0.17 -0.12 0.00 0.12 0.00 0.00 56.93 56.75 1bn5 s PHE 458 Cb -0.02 -0.36 0.02 0.00 -0.57 0.00 0.00 43.02 42.09 1bn5 s PHE 458 CO -0.00 -0.02 0.28 -2.00 -0.10 0.00 0.00 175.22 173.37 1bn5 s GLU 459 N -0.41 0.51 0.10 0.44 2.12 -0.27 -1.83 118.70 119.36 1bn5 s GLU 459 Ca 0.00 0.02 0.02 0.00 0.36 0.00 0.00 54.97 55.38 1bn5 s GLU 459 Cb -0.04 0.23 -0.04 0.00 0.26 0.00 0.00 34.13 34.54 1bn5 s GLU 459 CO -0.00 -0.12 -0.08 -1.01 -0.54 0.00 0.00 175.26 173.52 1bn5 s HIS 460 N -0.74 0.96 -0.17 5.30 3.76 -0.79 -2.26 115.29 121.34 1bn5 s HIS 460 Ca -0.08 -0.82 -0.12 0.00 -0.15 0.00 0.00 55.06 53.89 1bn5 s HIS 460 Cb -0.04 -0.54 -0.05 0.00 1.11 0.00 0.00 32.58 33.06 1bn5 s HIS 460 CO 0.02 -0.08 0.21 0.99 -0.85 0.00 0.00 174.74 175.03 1bn5 s THR 461 N -3.23 5.36 0.08 1.30 2.01 -1.20 -1.00 115.64 118.95 1bn5 s THR 461 Ca 0.10 0.37 0.09 0.00 0.31 0.00 0.00 61.69 62.57 1bn5 s THR 461 Cb 0.02 -3.55 -0.03 0.00 0.01 0.00 0.00 72.50 68.95 1bn5 s THR 461 CO -0.03 0.43 -0.25 0.27 -0.69 0.00 0.00 174.62 174.35 1bn5 s ILE 462 N 0.31 2.05 -0.16 1.82 -4.36 0.05 -2.21 121.20 118.70 1bn5 s ILE 462 Ca 0.13 -1.50 -0.03 0.00 -0.26 0.00 0.00 60.65 58.99 1bn5 s ILE 462 Cb -0.12 -1.79 -0.02 0.00 1.25 0.00 0.00 42.46 41.78 1bn5 s ILE 462 CO 0.01 0.20 -0.05 -0.76 0.24 0.00 0.00 174.94 174.58 1bn5 s LEU 463 N -1.58 3.12 -1.21 0.37 1.43 0.31 -1.53 118.68 119.59 1bn5 s LEU 463 Ca 0.11 -0.20 -0.12 0.00 -1.03 0.00 0.00 54.13 52.89 1bn5 s LEU 463 Cb -0.10 -1.76 0.18 0.00 0.03 0.00 0.00 46.19 44.55 1bn5 s LEU 463 CO 0.04 0.13 1.47 0.18 0.23 0.00 0.00 176.35 178.40 1bn5 n LEU 464 N 3.76 5.47 -4.81 1.79 4.77 -0.37 -1.74 117.00 125.87 1bn5 n LEU 464 Ca -0.18 -4.55 -0.31 0.00 -0.03 0.00 0.00 56.01 50.94 1bn5 n LEU 464 Cb 0.52 -1.58 0.04 0.00 -2.33 0.00 0.00 43.42 40.07 1bn5 n LEU 464 CO 0.32 0.89 0.71 -0.13 -1.33 0.00 0.00 177.39 177.85 1bn5 s ARG 465 N 1.07 3.00 0.32 3.23 0.52 -0.66 0.13 118.95 126.56 1bn5 s ARG 465 Ca 0.41 1.02 0.03 0.00 -0.52 0.00 0.00 55.73 56.68 1bn5 s ARG 465 Cb -0.02 -2.00 0.63 0.00 0.52 0.00 0.00 34.95 34.09 1bn5 s ARG 465 CO -0.00 -1.05 1.89 -1.35 0.02 0.00 0.00 175.30 174.81 1bn5 h PRO 466 N -0.47 0.88 -0.00 3.54 0.11 -1.93 -3.11 132.00 131.02 1bn5 h PRO 466 Ca -0.44 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1bn5 h PRO 466 Cb 1.21 -0.20 0.00 0.00 0.11 0.00 0.00 31.00 32.12 1bn5 h PRO 466 CO 0.57 0.58 -0.71 0.25 -0.21 0.00 0.00 178.00 178.48 1bn5 n THR 467 N -4.53 0.00 0.00 -1.15 -2.24 -1.26 -4.92 114.28 100.18 1bn5 n THR 467 Ca 0.15 -0.04 0.00 0.00 -2.27 0.00 0.00 64.05 61.89 1bn5 n THR 467 Cb 0.29 0.72 0.00 0.00 -2.10 0.00 0.00 70.33 69.25 1bn5 n THR 467 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1bn5 s LYS 469 N -2.00 4.12 -0.19 0.00 2.20 -0.44 -1.65 119.74 121.78 1bn5 s LYS 469 Ca 0.00 -0.19 -0.03 0.00 -0.36 0.00 0.00 55.97 55.39 1bn5 s LYS 469 Cb 0.00 -3.51 -0.01 0.00 -1.51 0.00 0.00 37.83 32.80 1bn5 s LYS 469 CO 0.00 0.11 -0.07 -2.00 -0.36 0.00 0.00 175.35 173.03 1bn5 s GLU 470 N 0.92 3.38 -1.08 4.03 2.12 -0.71 -0.47 118.70 126.89 1bn5 s GLU 470 Ca 0.09 -0.64 -0.18 0.00 0.36 0.00 0.00 54.97 54.61 1bn5 s GLU 470 Cb -0.13 -2.90 0.12 0.00 0.26 0.00 0.00 34.13 31.48 1bn5 s GLU 470 CO 0.04 -0.08 1.35 0.08 -0.54 0.00 0.00 175.26 176.11 1bn5 s VAL 471 N 1.15 4.62 0.33 3.70 1.01 0.27 -0.53 120.40 130.95 1bn5 s VAL 471 Ca 0.02 -1.83 0.12 0.00 0.00 0.00 0.00 61.98 60.28 1bn5 s VAL 471 Cb -0.14 -4.92 0.04 0.00 0.00 0.00 0.00 36.38 31.36 1bn5 s VAL 471 CO -0.02 -1.68 1.73 1.62 0.00 0.00 0.00 175.10 176.76 1bn5 h VAL 472 N 5.58 1.34 -0.53 2.92 3.04 -1.72 -2.08 116.25 124.80 1bn5 h VAL 472 Ca 0.25 -1.63 0.00 0.00 -1.01 0.00 0.00 66.70 64.31 1bn5 h VAL 472 Cb 0.95 1.87 0.00 0.00 -2.01 0.00 0.00 31.29 32.11 1bn5 h VAL 472 CO 1.25 0.47 0.00 -1.54 -1.01 0.00 0.00 177.57 176.73 1bn5 n SER 473 N -3.98 3.05 -4.77 3.17 3.41 -1.24 -4.29 113.62 108.98 1bn5 n SER 473 Ca -0.02 -2.07 -0.41 0.00 -0.26 0.00 0.00 58.87 56.12 1bn5 n SER 473 Cb 0.49 -0.39 -0.00 0.00 -0.26 0.00 0.00 64.21 64.05 1bn5 n SER 473 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 1bn5 s ARG 474 N -1.38 4.06 0.00 4.33 6.06 -0.82 -4.92 118.95 126.28 1bn5 s ARG 474 Ca 0.37 2.45 0.00 0.00 -2.50 0.00 0.00 55.73 56.05 1bn5 s ARG 474 Cb 0.20 -2.91 0.00 0.00 0.06 0.00 0.00 34.95 32.30 1bn5 s ARG 474 CO 0.23 -0.53 0.00 0.41 -2.50 0.00 0.00 175.30 172.91 1bn5 n GLY 475 N 0.55 5.27 0.17 8.12 0.00 -1.26 -4.77 105.19 113.27 1bn5 n GLY 475 Ca 0.02 -1.85 0.13 0.00 0.00 0.00 0.00 46.02 44.32 1bn5 n GLY 475 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1bn5 n ASP 476 N -1.04 0.74 -0.11 1.61 5.68 -1.26 -4.00 116.55 118.17 1bn5 n ASP 476 Ca 0.00 -0.68 -0.23 0.00 -0.50 0.00 0.00 54.79 53.38 1bn5 n ASP 476 Cb 0.00 0.04 -0.11 0.00 -1.14 0.00 0.00 41.12 39.91 1bn5 n ASP 476 CO 0.00 0.00 0.00 -0.90 -1.33 0.00 0.00 177.20 174.97 1bn5 n ASP 477 N -0.85 1.87 0.00 -1.12 5.68 -1.26 -5.28 116.55 115.59 1bn5 n ASP 477 Ca 0.12 0.42 0.00 0.00 -0.50 0.00 0.00 54.79 54.83 1bn5 n ASP 477 Cb 0.32 -0.95 0.00 0.00 -1.14 0.00 0.00 41.12 39.35 1bn5 n ASP 477 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87