#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bw3 n HIS 77 N 0.00 0.00 -3.79 7.33 8.25 -1.26 -5.25 115.22 120.50 2bw3 n HIS 77 Ca 0.00 0.00 -0.09 0.00 -0.26 0.00 0.00 57.72 57.37 2bw3 n HIS 77 Cb 0.00 0.00 -0.01 0.00 1.12 0.00 0.00 29.99 31.10 2bw3 n HIS 77 CO 0.00 0.00 0.00 1.04 0.64 0.00 0.00 176.34 178.02 2bw3 n GLN 79 N 0.00 0.59 -0.12 -0.41 1.13 -1.26 -5.14 117.38 112.17 2bw3 n GLN 79 Ca 0.00 -1.83 -0.10 0.00 -1.94 0.00 0.00 57.00 53.13 2bw3 n GLN 79 Cb 0.00 1.91 -0.02 0.00 0.11 0.00 0.00 30.24 32.24 2bw3 n GLN 79 CO 0.00 0.00 0.00 0.77 -1.44 0.00 0.00 177.06 176.39 2bw3 h SER 80 N 1.38 0.52 -3.23 1.08 0.02 -2.07 -3.36 113.55 107.89 2bw3 h SER 80 Ca -0.21 -0.20 -0.74 0.00 -0.84 0.00 0.00 61.79 59.80 2bw3 h SER 80 Cb 0.84 -0.14 -0.23 0.00 0.14 0.00 0.00 62.40 63.02 2bw3 h SER 80 CO 0.27 0.59 -0.28 -0.13 -1.14 0.00 0.00 176.83 176.14 2bw3 s ARG 81 N -5.41 2.99 0.59 3.45 0.52 -1.26 -5.05 118.95 114.78 2bw3 s ARG 81 Ca -0.13 -1.44 -0.18 0.00 -0.52 0.00 0.00 55.73 53.45 2bw3 s ARG 81 Cb 0.09 -4.18 -0.04 0.00 0.52 0.00 0.00 34.95 31.35 2bw3 s ARG 81 CO 0.75 -1.13 1.17 -1.21 0.02 0.00 0.00 175.30 174.90 2bw3 s GLU 82 N 1.67 3.03 0.59 3.54 2.02 -1.26 -5.03 118.70 123.27 2bw3 s GLU 82 Ca 0.04 1.71 -0.17 0.00 0.02 0.00 0.00 54.97 56.57 2bw3 s GLU 82 Cb -0.26 -1.95 -0.04 0.00 0.10 0.00 0.00 34.13 31.98 2bw3 s GLU 82 CO 0.06 -1.13 1.08 -0.51 0.02 0.00 0.00 175.26 174.78 2bw3 s LEU 83 N -4.12 3.56 0.26 1.80 1.43 -1.26 -4.97 118.68 115.37 2bw3 s LEU 83 Ca 0.75 1.94 -0.30 0.00 -1.03 0.00 0.00 54.13 55.49 2bw3 s LEU 83 Cb -0.27 -4.55 -0.10 0.00 0.03 0.00 0.00 46.19 41.30 2bw3 s LEU 83 CO 0.32 -1.25 1.37 -0.54 0.23 0.00 0.00 176.35 176.49 2bw3 s LYS 84 N -3.83 4.32 -0.17 1.70 1.02 -1.26 -5.03 119.74 116.50 2bw3 s LYS 84 Ca 0.67 2.21 -0.09 0.00 0.02 0.00 0.00 55.97 58.77 2bw3 s LYS 84 Cb -0.19 -3.12 -0.05 0.00 -0.52 0.00 0.00 37.83 33.95 2bw3 s LYS 84 CO 0.34 -0.31 0.15 0.99 -0.92 0.00 0.00 175.35 175.60 2bw3 s THR 85 N -0.26 5.42 0.75 2.17 2.01 -1.26 -5.09 115.64 119.38 2bw3 s THR 85 Ca 0.56 0.24 -0.09 0.00 0.31 0.00 0.00 61.69 62.72 2bw3 s THR 85 Cb -0.40 -3.47 0.08 0.00 0.01 0.00 0.00 72.50 68.73 2bw3 s THR 85 CO 0.44 0.50 1.08 0.68 -0.69 0.00 0.00 174.62 176.63 2bw3 s VAL 86 N -0.12 2.17 0.97 3.82 -7.23 -1.26 -5.07 120.40 113.68 2bw3 s VAL 86 Ca 0.11 -0.19 -0.12 0.00 -1.81 0.00 0.00 61.98 59.97 2bw3 s VAL 86 Cb -0.12 -2.98 0.17 0.00 0.56 0.00 0.00 36.38 34.02 2bw3 s VAL 86 CO 0.01 0.00 1.09 -0.94 -0.31 0.00 0.00 175.10 174.95 2bw3 s SER 87 N -4.58 2.79 0.14 4.85 1.04 -1.26 -4.84 113.70 111.85 2bw3 s SER 87 Ca 0.62 1.39 -0.15 0.00 0.48 0.00 0.00 55.95 58.29 2bw3 s SER 87 Cb -0.10 -2.07 0.01 0.00 0.10 0.00 0.00 66.02 63.97 2bw3 s SER 87 CO 0.46 -3.05 1.70 0.00 0.98 0.00 0.00 173.24 173.33 2bw3 h ALA 88 N -1.84 0.58 -0.76 5.32 0.00 -2.00 -1.93 119.26 118.64 2bw3 h ALA 88 Ca -0.53 -0.14 0.06 0.00 0.00 0.00 0.00 54.91 54.30 2bw3 h ALA 88 Cb 1.31 -0.17 -0.05 0.00 0.00 0.00 0.00 17.79 18.88 2bw3 h ALA 88 CO 0.55 0.17 0.50 -0.44 0.00 0.00 0.00 179.25 180.03 2bw3 h ASP 89 N 0.58 0.74 -0.27 0.00 3.45 -1.99 -1.11 116.42 117.81 2bw3 h ASP 89 Ca 0.15 0.00 -0.04 0.00 0.43 0.00 0.00 57.03 57.57 2bw3 h ASP 89 Cb 0.17 -0.16 -0.01 0.00 -0.56 0.00 0.00 39.33 38.78 2bw3 h ASP 89 CO -0.01 0.49 0.01 0.00 -1.57 0.00 0.00 179.24 178.15 2bw3 h LYS 91 N 0.25 0.96 -0.49 0.00 1.57 -0.87 -0.50 116.57 117.49 2bw3 h LYS 91 Ca 0.08 -0.06 -0.01 0.00 -1.87 0.00 0.00 60.65 58.79 2bw3 h LYS 91 Cb 0.40 -0.22 -0.02 0.00 0.08 0.00 0.00 32.23 32.47 2bw3 h LYS 91 CO 0.01 0.63 0.29 -0.22 -0.57 0.00 0.00 179.45 179.59 2bw3 h LYS 92 N 0.99 0.67 -0.30 3.15 3.64 -1.10 -2.39 116.57 121.22 2bw3 h LYS 92 Ca 0.28 -0.07 -0.09 0.00 -1.27 0.00 0.00 60.65 59.51 2bw3 h LYS 92 Cb -0.08 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 31.59 2bw3 h LYS 92 CO -0.08 0.51 -0.18 1.49 -2.27 0.00 0.00 179.45 178.92 2bw3 h GLU 93 N 0.65 0.55 -0.75 1.90 4.81 -0.88 -2.22 114.58 118.64 2bw3 h GLU 93 Ca 0.18 -0.19 -0.03 0.00 -0.13 0.00 0.00 59.36 59.18 2bw3 h GLU 93 Cb 0.01 -0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.31 2bw3 h GLU 93 CO -0.03 0.71 0.33 0.00 -0.73 0.00 0.00 179.01 179.29 2bw3 h ALA 94 N 1.31 1.17 -0.28 2.92 0.00 -0.78 0.11 119.26 123.70 2bw3 h ALA 94 Ca 0.08 -0.17 -0.03 0.00 0.00 0.00 0.00 54.91 54.80 2bw3 h ALA 94 Cb 0.60 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 2bw3 h ALA 94 CO 0.04 0.62 0.06 0.82 0.00 0.00 0.00 179.25 180.79 2bw3 h ILE 95 N 1.08 1.22 -0.21 0.00 2.04 -1.14 -1.95 117.51 118.55 2bw3 h ILE 95 Ca 0.26 -0.73 0.00 0.00 1.00 0.00 0.00 64.86 65.39 2bw3 h ILE 95 Cb 0.15 1.16 -0.01 0.00 -0.74 0.00 0.00 36.82 37.38 2bw3 h ILE 95 CO -0.03 0.24 0.13 -0.33 0.00 0.00 0.00 178.15 178.16 2bw3 h GLU 96 N 0.29 0.28 -0.44 2.37 5.08 -0.79 -0.58 114.58 120.79 2bw3 h GLU 96 Ca 0.09 -0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.41 2bw3 h GLU 96 Cb 0.30 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.47 2bw3 h GLU 96 CO 0.00 0.21 0.20 0.87 -1.00 0.00 0.00 179.01 179.29 2bw3 h LYS 97 N 0.27 0.64 -0.47 2.33 1.79 -0.78 -0.92 116.57 119.43 2bw3 h LYS 97 Ca 0.08 -0.10 -0.12 0.00 -2.18 0.00 0.00 60.65 58.33 2bw3 h LYS 97 Cb -0.01 -0.11 -0.02 0.00 -1.58 0.00 0.00 32.23 30.51 2bw3 h LYS 97 CO -0.02 0.56 -0.17 0.00 -1.08 0.00 0.00 179.45 178.75 2bw3 h ALA 99 N 0.98 0.74 -0.18 0.00 0.00 -0.90 -1.88 119.26 118.03 2bw3 h ALA 99 Ca 0.12 -0.16 -0.08 0.00 0.00 0.00 0.00 54.91 54.79 2bw3 h ALA 99 Cb 0.72 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 2bw3 h ALA 99 CO 0.06 0.34 -0.23 1.96 0.00 0.00 0.00 179.25 181.38 2bw3 h GLN 100 N 0.78 0.31 0.33 0.00 4.20 -1.06 -1.42 115.11 118.25 2bw3 h GLN 100 Ca 0.19 -0.10 -0.02 0.00 0.06 0.00 0.00 58.65 58.78 2bw3 h GLN 100 Cb 0.19 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 27.94 2bw3 h GLN 100 CO -0.02 0.53 -0.16 2.35 -0.67 0.00 0.00 178.83 180.86 2bw3 h TRP 101 N 0.28 -0.41 -0.28 2.96 7.01 -0.79 -0.38 115.95 124.35 2bw3 h TRP 101 Ca 0.05 -0.01 -0.06 0.00 2.11 0.00 0.00 58.89 60.97 2bw3 h TRP 101 Cb 0.56 0.13 -0.02 0.00 -2.10 0.00 0.00 29.16 27.74 2bw3 h TRP 101 CO 0.01 -0.19 -0.10 -0.39 -2.79 0.00 0.00 178.44 174.98 2bw3 h VAL 102 N -0.54 1.22 0.08 2.65 -1.51 -1.05 -1.65 116.25 115.44 2bw3 h VAL 102 Ca -0.04 -0.95 -0.00 0.00 -1.23 0.00 0.00 66.70 64.47 2bw3 h VAL 102 Cb 0.40 1.12 0.00 0.00 -2.13 0.00 0.00 31.29 30.68 2bw3 h VAL 102 CO 0.07 0.31 -0.04 0.58 -1.23 0.00 0.00 177.57 177.27 2bw3 h VAL 103 N 0.44 1.19 -0.29 7.19 2.07 -1.20 0.05 116.25 125.70 2bw3 h VAL 103 Ca 0.08 -1.13 -0.09 0.00 0.82 0.00 0.00 66.70 66.39 2bw3 h VAL 103 Cb 0.45 1.90 -0.01 0.00 -1.52 0.00 0.00 31.29 32.11 2bw3 h VAL 103 CO 0.02 0.27 -0.20 0.03 0.02 0.00 0.00 177.57 177.72 2bw3 h ARG 104 N -0.63 0.52 -0.02 1.57 3.08 -1.04 -3.22 114.38 114.64 2bw3 h ARG 104 Ca -0.01 -0.18 0.00 0.00 0.07 0.00 0.00 59.98 59.86 2bw3 h ARG 104 Cb 0.52 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.53 2bw3 h ARG 104 CO 0.02 0.70 -0.02 -0.25 -1.07 0.00 0.00 179.97 179.34 2bw3 n ASP 105 N -4.15 2.38 -3.38 7.04 9.92 -0.62 -5.02 116.55 122.72 2bw3 n ASP 105 Ca 0.00 -1.69 -0.20 0.00 -0.53 0.00 0.00 54.79 52.37 2bw3 n ASP 105 Cb 0.38 0.03 0.06 0.00 -0.64 0.00 0.00 41.12 40.95 2bw3 n ASP 105 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2bw3 s ARG 107 N -4.87 2.45 0.62 0.00 1.81 -0.83 -5.05 118.95 113.09 2bw3 s ARG 107 Ca 0.46 -0.87 -0.17 0.00 -1.72 0.00 0.00 55.73 53.43 2bw3 s ARG 107 Cb -0.09 -2.49 -0.02 0.00 -0.45 0.00 0.00 34.95 31.90 2bw3 s ARG 107 CO 0.78 0.54 1.12 -1.25 -0.68 0.00 0.00 175.30 175.81 2bw3 s PRO 108 N -2.23 2.96 0.45 3.54 0.04 -1.26 -4.73 135.00 133.76 2bw3 s PRO 108 Ca 0.24 1.50 0.12 0.00 0.04 0.00 0.00 61.00 62.90 2bw3 s PRO 108 Cb -0.12 -1.96 1.00 0.00 0.04 0.00 0.00 34.50 33.46 2bw3 s PRO 108 CO 0.17 -1.14 2.05 0.74 0.04 0.00 0.00 177.00 178.85 2bw3 h PHE 109 N 0.43 0.21 0.00 0.56 -1.00 -1.99 -1.76 116.94 113.39 2bw3 h PHE 109 Ca -0.48 -0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.30 2bw3 h PHE 109 Cb 1.26 -0.07 0.00 0.00 3.61 0.00 0.00 35.95 40.75 2bw3 h PHE 109 CO 0.53 0.21 0.00 -1.13 -1.61 0.00 0.00 178.31 176.31 2bw3 n SER 110 N -4.43 0.00 0.27 2.17 3.41 -1.26 -2.82 113.62 110.96 2bw3 n SER 110 Ca -0.01 0.49 0.13 0.00 -0.26 0.00 0.00 58.87 59.21 2bw3 n SER 110 Cb 0.14 -0.49 0.74 0.00 -0.26 0.00 0.00 64.21 64.34 2bw3 n SER 110 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2bw3 h ALA 111 N 2.24 1.35 0.00 7.33 0.00 -1.68 -2.60 119.26 125.89 2bw3 h ALA 111 Ca 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.81 2bw3 h ALA 111 Cb 0.11 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.89 2bw3 h ALA 111 CO 0.00 0.13 0.00 1.33 0.00 0.00 0.00 179.25 180.71 2bw3 n VAL 112 N -3.73 0.12 0.81 0.00 0.24 -1.13 -3.08 118.33 111.57 2bw3 n VAL 112 Ca -0.02 0.03 0.11 0.00 -2.04 0.00 0.00 64.34 62.42 2bw3 n VAL 112 Cb 0.21 -0.56 0.10 0.00 -1.47 0.00 0.00 33.84 32.12 2bw3 n VAL 112 CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15 2bw3 n SER 113 N -1.41 2.85 -4.77 -1.34 3.41 -0.98 -4.83 113.62 106.56 2bw3 n SER 113 Ca 0.09 -1.90 -0.41 0.00 -0.26 0.00 0.00 58.87 56.39 2bw3 n SER 113 Cb 0.28 -0.03 -0.01 0.00 -0.26 0.00 0.00 64.21 64.19 2bw3 n SER 113 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2bw3 s GLY 114 N -1.74 2.71 0.21 5.00 0.00 -1.18 -4.89 107.32 107.44 2bw3 s GLY 114 Ca 0.26 1.44 -0.07 0.00 0.00 0.00 0.00 44.72 46.35 2bw3 s GLY 114 CO 0.27 2.21 1.74 1.48 0.00 0.00 0.00 173.10 178.80 2bw3 h SER 115 N 3.78 1.04 -0.16 1.64 4.64 -1.94 -0.50 113.55 122.06 2bw3 h SER 115 Ca -0.49 -0.21 -0.12 0.00 -0.47 0.00 0.00 61.79 60.50 2bw3 h SER 115 Cb 1.23 -0.27 -0.01 0.00 -0.31 0.00 0.00 62.40 63.03 2bw3 h SER 115 CO 0.69 1.00 -0.29 1.23 -0.87 0.00 0.00 176.83 178.59 2bw3 h GLY 116 N 1.08 0.69 0.84 -0.77 0.00 -1.98 -2.26 103.07 100.68 2bw3 h GLY 116 Ca 0.22 -0.62 -0.00 0.00 0.00 0.00 0.00 47.33 46.93 2bw3 h GLY 116 CO 0.00 0.56 0.00 -2.75 0.00 0.00 0.00 176.54 174.36 2bw3 h PHE 117 N 0.55 0.02 -0.53 5.60 3.57 -1.80 -3.04 116.94 121.30 2bw3 h PHE 117 Ca 0.07 -0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.58 2bw3 h PHE 117 Cb 0.78 -0.00 -0.03 0.00 2.79 0.00 0.00 35.95 39.49 2bw3 h PHE 117 CO 0.03 0.18 0.35 0.82 -2.23 0.00 0.00 178.31 177.46 2bw3 h ILE 118 N -0.15 1.12 0.00 1.41 2.04 -1.04 -0.37 117.51 120.52 2bw3 h ILE 118 Ca 0.00 -0.24 0.00 0.00 1.00 0.00 0.00 64.86 65.62 2bw3 h ILE 118 Cb 0.17 0.35 0.00 0.00 -0.74 0.00 0.00 36.82 36.60 2bw3 h ILE 118 CO -0.00 0.13 0.00 0.47 0.00 0.00 0.00 178.15 178.75 2bw3 n ASP 119 N -4.73 0.21 0.00 1.72 8.00 -0.86 -1.09 116.55 119.80 2bw3 n ASP 119 Ca 0.03 -0.16 0.00 0.00 0.71 0.00 0.00 54.79 55.37 2bw3 n ASP 119 Cb 0.04 -0.04 0.00 0.00 -0.02 0.00 0.00 41.12 41.10 2bw3 n ASP 119 CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43 2bw3 n ILE 121 N 0.85 0.00 -0.10 0.53 2.08 -0.15 -2.24 119.36 120.34 2bw3 n ILE 121 Ca 0.00 0.00 -0.01 0.00 0.56 0.00 0.00 62.75 63.30 2bw3 n ILE 121 Cb 0.04 0.00 0.25 0.00 -0.75 0.00 0.00 39.64 39.17 2bw3 n ILE 121 CO 0.00 0.00 0.00 0.11 0.56 0.00 0.00 176.55 177.22 2bw3 h LYS 122 N 0.00 0.76 -0.30 0.38 1.57 -1.37 -1.64 116.57 115.96 2bw3 h LYS 122 Ca 0.00 -0.13 -0.03 0.00 -1.87 0.00 0.00 60.65 58.62 2bw3 h LYS 122 Cb 0.00 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.17 2bw3 h LYS 122 CO 0.00 0.65 0.06 0.35 -0.57 0.00 0.00 179.45 179.94 2bw3 h PHE 123 N 0.74 0.53 -0.01 -1.35 3.57 -1.72 -2.40 116.94 116.30 2bw3 h PHE 123 Ca 0.17 -0.07 -0.06 0.00 3.53 0.00 0.00 57.97 61.54 2bw3 h PHE 123 Cb 0.20 -0.15 -0.01 0.00 2.79 0.00 0.00 35.95 38.79 2bw3 h PHE 123 CO 0.01 0.58 -0.29 0.74 -2.23 0.00 0.00 178.31 177.11 2bw3 h PHE 124 N 0.33 0.01 -0.58 0.41 -1.00 -1.73 0.47 116.94 114.85 2bw3 h PHE 124 Ca 0.09 -0.00 -0.08 0.00 2.81 0.00 0.00 57.97 60.79 2bw3 h PHE 124 Cb 0.33 -0.00 -0.02 0.00 3.61 0.00 0.00 35.95 39.86 2bw3 h PHE 124 CO 0.02 0.31 0.06 0.82 -1.61 0.00 0.00 178.31 177.91 2bw3 h ILE 125 N 0.01 1.26 -0.72 -0.55 2.04 -1.19 -1.81 117.51 116.54 2bw3 h ILE 125 Ca -0.00 -1.04 -0.05 0.00 1.00 0.00 0.00 64.86 64.77 2bw3 h ILE 125 Cb 0.53 0.79 -0.03 0.00 -0.74 0.00 0.00 36.82 37.37 2bw3 h ILE 125 CO 0.04 0.38 0.25 0.50 0.00 0.00 0.00 178.15 179.31 2bw3 h LYS 126 N 0.88 1.11 -0.21 2.37 3.64 -0.73 0.34 116.57 123.98 2bw3 h LYS 126 Ca 0.17 -0.23 0.02 0.00 -1.27 0.00 0.00 60.65 59.34 2bw3 h LYS 126 Cb 0.46 -0.17 -0.02 0.00 -0.41 0.00 0.00 32.23 32.10 2bw3 h LYS 126 CO 0.02 0.94 0.07 0.28 -2.27 0.00 0.00 179.45 178.49 2bw3 h VAL 127 N 1.06 0.95 -0.88 2.00 2.07 -0.66 -1.44 116.25 119.35 2bw3 h VAL 127 Ca 0.24 -0.06 -0.00 0.00 0.82 0.00 0.00 66.70 67.70 2bw3 h VAL 127 Cb 0.28 0.77 -0.04 0.00 -1.52 0.00 0.00 31.29 30.77 2bw3 h VAL 127 CO -0.01 0.03 0.54 1.23 0.02 0.00 0.00 177.57 179.38 2bw3 h GLY 128 N 0.17 1.28 1.62 2.17 0.00 -0.86 0.29 103.07 107.73 2bw3 h GLY 128 Ca 0.09 -0.53 0.01 0.00 0.00 0.00 0.00 47.33 46.91 2bw3 h GLY 128 CO -0.09 0.51 0.24 0.00 0.00 0.00 0.00 176.54 177.19 2bw3 h ALA 129 N 1.29 1.79 0.00 3.60 0.00 -0.35 0.12 119.26 125.71 2bw3 h ALA 129 Ca 0.32 -0.02 -0.10 0.00 0.00 0.00 0.00 54.91 55.11 2bw3 h ALA 129 Cb -0.06 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 2bw3 h ALA 129 CO -0.06 0.19 -0.54 0.93 0.00 0.00 0.00 179.25 179.76 2bw3 h GLU 130 N 0.45 0.00 0.00 0.00 5.08 -0.63 -3.41 114.58 116.07 2bw3 h GLU 130 Ca 0.14 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.50 2bw3 h GLU 130 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 2bw3 h GLU 130 CO -0.03 0.92 -0.97 0.66 -1.00 0.00 0.00 179.01 178.59 2bw3 n TYR 131 N -4.54 0.04 -0.05 4.33 4.02 0.03 -5.10 117.16 115.89 2bw3 n TYR 131 Ca -0.19 0.01 0.00 0.00 -0.01 0.00 0.00 57.90 57.71 2bw3 n TYR 131 Cb 0.54 -0.15 0.00 0.00 -0.02 0.00 0.00 39.34 39.71 2bw3 n TYR 131 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2bw3 n GLY 132 N 1.47 -3.44 0.21 2.72 0.00 0.43 -4.61 105.19 101.96 2bw3 n GLY 132 Ca 0.03 -1.87 -0.06 0.00 0.00 0.00 0.00 46.02 44.12 2bw3 n GLY 132 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 2bw3 h ASP 133 N 0.00 0.53 -0.21 1.61 -0.00 -1.95 -3.37 116.42 113.04 2bw3 h ASP 133 Ca 0.00 -0.01 -0.63 0.00 -0.00 0.00 0.00 57.03 56.40 2bw3 h ASP 133 Cb 0.00 -0.12 -0.01 0.00 -0.00 0.00 0.00 39.33 39.20 2bw3 h ASP 133 CO 0.00 0.38 3.12 1.41 -0.00 0.00 0.00 179.24 184.16 2bw3 n HIS 134 N -4.77 2.19 -3.38 0.28 -0.00 -1.26 -4.94 115.22 103.33 2bw3 n HIS 134 Ca 0.03 -2.87 -0.35 0.00 -0.00 0.00 0.00 57.72 54.53 2bw3 n HIS 134 Cb 0.05 -2.28 -0.06 0.00 -0.00 0.00 0.00 29.99 27.70 2bw3 n HIS 134 CO 0.00 0.00 0.00 0.08 -0.00 0.00 0.00 176.34 176.42 2bw3 s VAL 135 N 1.41 4.88 -0.86 1.59 1.01 -1.26 -5.00 120.40 122.17 2bw3 s VAL 135 Ca 0.67 0.80 -0.24 0.00 0.00 0.00 0.00 61.98 63.21 2bw3 s VAL 135 Cb 0.20 -3.73 0.06 0.00 0.00 0.00 0.00 36.38 32.91 2bw3 s VAL 135 CO -0.06 0.27 1.28 0.21 0.00 0.00 0.00 175.10 176.80 2bw3 s ASN 136 N -1.69 6.35 0.11 3.32 3.84 -1.26 -4.85 114.94 120.76 2bw3 s ASN 136 Ca 0.37 -1.10 -0.14 0.00 0.21 0.00 0.00 52.86 52.20 2bw3 s ASN 136 Cb -0.15 -2.52 -0.06 0.00 -0.55 0.00 0.00 41.25 37.96 2bw3 s ASN 136 CO 0.19 -1.57 1.46 0.58 -2.79 0.00 0.00 177.10 174.97 2bw3 h VAL 137 N 6.29 1.29 -0.77 -5.21 2.07 -1.98 -2.43 116.25 115.51 2bw3 h VAL 137 Ca -0.05 -1.39 0.05 0.00 0.82 0.00 0.00 66.70 66.13 2bw3 h VAL 137 Cb 1.03 1.45 -0.05 0.00 -1.52 0.00 0.00 31.29 32.20 2bw3 h VAL 137 CO 1.30 0.45 0.51 -0.33 0.02 0.00 0.00 177.57 179.52 2bw3 h GLU 138 N 0.53 0.85 -0.08 1.57 3.07 -1.92 -0.91 114.58 117.69 2bw3 h GLU 138 Ca 0.06 -0.05 -0.12 0.00 -0.50 0.00 0.00 59.36 58.75 2bw3 h GLU 138 Cb 0.81 -0.19 0.01 0.00 -0.84 0.00 0.00 28.75 28.53 2bw3 h GLU 138 CO 0.07 0.56 -0.42 1.05 -1.40 0.00 0.00 179.01 178.86 2bw3 h GLU 139 N 0.87 0.43 -0.88 2.33 -0.00 -1.96 -3.29 114.58 112.09 2bw3 h GLU 139 Ca 0.32 -0.35 0.03 0.00 -0.00 0.00 0.00 59.36 59.35 2bw3 h GLU 139 Cb 0.16 0.07 -0.05 0.00 -0.00 0.00 0.00 28.75 28.94 2bw3 h GLU 139 CO -0.10 0.99 0.57 1.25 -0.00 0.00 0.00 179.01 181.72 2bw3 h LEU 140 N -0.02 0.97 -9.85 3.06 5.85 -0.90 -3.44 115.31 110.97 2bw3 h LEU 140 Ca -0.03 -0.01 -0.48 0.00 0.84 0.00 0.00 57.88 58.20 2bw3 h LEU 140 Cb 1.08 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 41.87 2bw3 h LEU 140 CO 0.09 0.67 0.37 -0.76 -0.34 0.00 0.00 178.44 178.47 2bw3 s LEU 141 N -10.15 4.41 0.63 2.25 1.43 -0.40 -5.05 118.68 111.80 2bw3 s LEU 141 Ca -0.13 1.93 -0.11 0.00 -1.03 0.00 0.00 54.13 54.79 2bw3 s LEU 141 Cb 0.17 -3.90 -0.04 0.00 0.03 0.00 0.00 46.19 42.46 2bw3 s LEU 141 CO 0.80 -0.07 1.03 -2.16 0.23 0.00 0.00 176.35 176.18 2bw3 s PRO 142 N -1.84 3.53 0.72 1.29 0.04 -1.26 -4.94 135.00 132.55 2bw3 s PRO 142 Ca 0.48 0.78 -0.10 0.00 0.04 0.00 0.00 61.00 62.20 2bw3 s PRO 142 Cb -0.22 -2.07 0.04 0.00 0.04 0.00 0.00 34.50 32.29 2bw3 s PRO 142 CO 0.28 -0.62 1.08 -1.54 0.04 0.00 0.00 177.00 176.24 2bw3 s SER 143 N -4.12 5.10 0.20 6.66 1.04 -1.26 -4.83 113.70 116.50 2bw3 s SER 143 Ca 0.55 0.88 -0.10 0.00 0.48 0.00 0.00 55.95 57.76 2bw3 s SER 143 Cb -0.11 -1.59 0.22 0.00 0.10 0.00 0.00 66.02 64.64 2bw3 s SER 143 CO 0.54 -1.51 1.81 -0.65 0.98 0.00 0.00 173.24 174.41 2bw3 h PRO 144 N -0.70 0.66 -0.78 4.02 0.11 -1.99 -0.31 132.00 133.01 2bw3 h PRO 144 Ca -0.45 -0.04 -0.05 0.00 0.11 0.00 0.00 66.00 65.57 2bw3 h PRO 144 Cb 1.29 -0.15 -0.03 0.00 0.11 0.00 0.00 31.00 32.21 2bw3 h PRO 144 CO 0.64 0.44 0.29 0.97 -0.21 0.00 0.00 178.00 180.12 2bw3 h ILE 145 N 0.68 1.26 -0.56 4.15 2.10 -1.99 0.11 117.51 123.26 2bw3 h ILE 145 Ca 0.29 -0.86 -0.06 0.00 1.08 0.00 0.00 64.86 65.30 2bw3 h ILE 145 Cb 0.16 0.35 -0.02 0.00 -1.09 0.00 0.00 36.82 36.21 2bw3 h ILE 145 CO -0.17 0.35 0.10 0.74 -1.08 0.00 0.00 178.15 178.09 2bw3 h THR 146 N 1.15 1.24 -0.25 2.19 2.02 -1.77 -0.96 112.91 116.53 2bw3 h THR 146 Ca 0.26 -0.92 -0.08 0.00 0.77 0.00 0.00 66.41 66.44 2bw3 h THR 146 Cb 0.25 0.70 -0.01 0.00 -1.74 0.00 0.00 68.15 67.36 2bw3 h THR 146 CO -0.02 0.34 -0.16 0.25 0.37 0.00 0.00 175.52 176.30 2bw3 h LEU 147 N 0.85 0.58 -0.38 2.58 5.85 -0.54 -1.73 115.31 122.52 2bw3 h LEU 147 Ca 0.18 -0.43 0.05 0.00 0.84 0.00 0.00 57.88 58.51 2bw3 h LEU 147 Cb 0.37 -0.16 -0.04 0.00 0.37 0.00 0.00 40.66 41.19 2bw3 h LEU 147 CO 0.01 0.89 0.13 -1.28 -0.34 0.00 0.00 178.44 177.84 2bw3 h SER 148 N 0.27 0.13 -0.70 1.25 0.87 -0.49 -0.08 113.55 114.80 2bw3 h SER 148 Ca 0.05 0.04 -0.00 0.00 -1.23 0.00 0.00 61.79 60.66 2bw3 h SER 148 Cb 0.69 0.03 -0.03 0.00 -0.44 0.00 0.00 62.40 62.65 2bw3 h SER 148 CO 0.05 0.11 0.44 0.03 -0.53 0.00 0.00 176.83 176.92 2bw3 h ARG 149 N 0.28 0.95 -0.36 2.24 3.08 -1.08 0.16 114.38 119.64 2bw3 h ARG 149 Ca 0.17 -0.07 -0.06 0.00 0.07 0.00 0.00 59.98 60.09 2bw3 h ARG 149 Cb 0.16 -0.21 -0.01 0.00 0.08 0.00 0.00 29.97 29.99 2bw3 h ARG 149 CO -0.18 0.66 -0.00 -0.22 -1.07 0.00 0.00 179.97 179.15 2bw3 h LYS 150 N 0.97 0.64 -0.64 0.04 1.63 -0.36 -0.98 116.57 117.87 2bw3 h LYS 150 Ca 0.26 -0.21 -0.07 0.00 -0.85 0.00 0.00 60.65 59.78 2bw3 h LYS 150 Cb -0.06 -0.06 -0.03 0.00 -0.60 0.00 0.00 32.23 31.48 2bw3 h LYS 150 CO -0.05 0.76 0.11 0.28 -3.45 0.00 0.00 179.45 177.09 2bw3 h VAL 151 N 0.46 1.26 -0.28 2.00 2.07 -0.32 -0.65 116.25 120.79 2bw3 h VAL 151 Ca 0.10 -1.01 -0.02 0.00 0.82 0.00 0.00 66.70 66.59 2bw3 h VAL 151 Cb 0.47 0.67 -0.01 0.00 -1.52 0.00 0.00 31.29 30.90 2bw3 h VAL 151 CO 0.02 0.38 0.11 0.74 0.02 0.00 0.00 177.57 178.84 2bw3 h THR 152 N 0.98 1.18 -0.42 2.57 2.02 -0.84 -0.89 112.91 117.49 2bw3 h THR 152 Ca 0.20 -0.55 -0.11 0.00 0.77 0.00 0.00 66.41 66.72 2bw3 h THR 152 Cb 0.43 1.02 -0.02 0.00 -1.74 0.00 0.00 68.15 67.84 2bw3 h THR 152 CO 0.01 0.19 -0.17 0.77 0.37 0.00 0.00 175.52 176.69 2bw3 h SER 153 N 0.30 0.81 -1.01 4.18 4.64 -1.06 -0.44 113.55 120.96 2bw3 h SER 153 Ca 0.09 -0.27 0.03 0.00 -0.47 0.00 0.00 61.79 61.17 2bw3 h SER 153 Cb 0.19 -0.22 -0.06 0.00 -0.31 0.00 0.00 62.40 62.00 2bw3 h SER 153 CO -0.01 0.97 0.66 0.44 -0.87 0.00 0.00 176.83 178.03 2bw3 h ASP 154 N 0.71 1.12 -0.12 4.97 5.19 -0.91 -1.96 116.42 125.42 2bw3 h ASP 154 Ca 0.11 -0.02 -0.02 0.00 -0.62 0.00 0.00 57.03 56.48 2bw3 h ASP 154 Cb 0.68 -0.26 -0.00 0.00 0.18 0.00 0.00 39.33 39.92 2bw3 h ASP 154 CO 0.05 0.78 -0.01 0.00 -3.12 0.00 0.00 179.24 176.94 2bw3 h ALA 155 N 1.40 0.16 0.00 3.45 0.00 -0.69 -2.83 119.26 120.74 2bw3 h ALA 155 Ca 0.39 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 55.11 2bw3 h ALA 155 Cb -0.05 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.70 2bw3 h ALA 155 CO -0.11 -0.14 0.00 1.63 0.00 0.00 0.00 179.25 180.63 2bw3 n LYS 156 N -4.78 0.04 0.11 0.00 4.76 -0.22 -1.63 118.16 116.43 2bw3 n LYS 156 Ca -0.06 0.49 0.10 0.00 -2.87 0.00 0.00 58.31 55.97 2bw3 n LYS 156 Cb 0.21 -1.61 0.44 0.00 -1.84 0.00 0.00 35.03 32.23 2bw3 n LYS 156 CO 0.00 0.00 0.00 -1.91 -1.37 0.00 0.00 177.40 174.12 2bw3 n GLU 157 N -1.69 0.13 -1.49 1.97 4.07 -0.78 -3.43 120.64 119.43 2bw3 n GLU 157 Ca 0.00 0.46 -0.29 0.00 -0.06 0.00 0.00 57.16 57.28 2bw3 n GLU 157 Cb 0.04 -1.80 -0.07 0.00 -0.06 0.00 0.00 31.44 29.56 2bw3 n GLU 157 CO 0.00 0.00 0.00 1.63 -0.06 0.00 0.00 177.13 178.70 2bw3 n LYS 158 N -2.05 3.07 0.00 5.31 4.01 -0.65 -5.13 118.16 122.71 2bw3 n LYS 158 Ca 0.01 -2.32 0.11 0.00 -0.51 0.00 0.00 58.31 55.60 2bw3 n LYS 158 Cb 0.14 -2.33 0.09 0.00 -0.51 0.00 0.00 35.03 32.42 2bw3 n LYS 158 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29