#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2db1 s SER -5 N 0.00 5.39 -0.12 1.61 0.01 -1.26 -5.06 113.70 114.27 2db1 s SER -5 Ca 0.00 -2.68 -0.30 0.00 1.31 0.00 0.00 55.95 54.29 2db1 s SER -5 Cb 0.00 -1.89 -0.02 0.00 0.21 0.00 0.00 66.02 64.32 2db1 s SER -5 CO 0.00 -0.43 1.18 -0.44 0.41 0.00 0.00 173.24 173.96 2db1 s SER -4 N 1.08 7.05 0.36 2.44 0.01 -1.26 -4.64 113.70 118.74 2db1 s SER -4 Ca 0.15 1.69 0.00 0.00 1.31 0.00 0.00 55.95 59.11 2db1 s SER -4 Cb -0.20 -2.55 0.00 0.00 0.21 0.00 0.00 66.02 63.48 2db1 s SER -4 CO -0.04 -0.63 0.00 0.61 0.41 0.00 0.00 173.24 173.59 2db1 n GLY -3 N 3.41 1.91 3.72 3.44 0.00 -1.26 -4.88 105.19 111.53 2db1 n GLY -3 Ca 0.12 -0.12 -0.26 0.00 0.00 0.00 0.00 46.02 45.76 2db1 n GLY -3 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2db1 n SER -2 N 8.00 -5.39 -4.99 1.61 2.88 -1.26 -4.99 113.62 109.48 2db1 n SER -2 Ca 0.00 -0.65 -0.19 0.00 -1.33 0.00 0.00 58.87 56.70 2db1 n SER -2 Cb 0.00 -4.56 0.00 0.00 -0.75 0.00 0.00 64.21 58.90 2db1 n SER -2 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2db1 s SER -1 N -3.40 5.90 0.37 -3.46 0.01 -1.26 -5.00 113.70 106.86 2db1 s SER -1 Ca 0.57 -0.15 0.00 0.00 1.31 0.00 0.00 55.95 57.68 2db1 s SER -1 Cb -0.27 -1.20 0.00 0.00 0.21 0.00 0.00 66.02 64.77 2db1 s SER -1 CO 0.77 -0.52 0.00 0.61 0.41 0.00 0.00 173.24 174.51 2db1 n GLY 0 N -1.74 -3.71 3.30 3.44 0.00 -1.26 -5.00 105.19 100.22 2db1 n GLY 0 Ca 0.01 -0.98 -0.29 0.00 0.00 0.00 0.00 46.02 44.76 2db1 n GLY 0 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2db1 s MET 1 N -4.81 1.81 0.29 1.61 -1.94 -1.26 -5.02 119.30 109.97 2db1 s MET 1 Ca 0.00 -0.96 0.04 0.00 -1.71 0.00 0.00 55.69 53.06 2db1 s MET 1 Cb 0.00 -1.86 0.72 0.00 2.01 0.00 0.00 34.83 35.70 2db1 s MET 1 CO 0.00 0.49 1.71 0.00 -0.01 0.00 0.00 175.02 177.21 2db1 h MET 2 N 5.18 0.44 -6.14 2.03 -0.00 -2.00 -3.39 114.93 111.05 2db1 h MET 2 Ca -0.43 -0.03 -0.57 0.00 -0.00 0.00 0.00 59.70 58.67 2db1 h MET 2 Cb 1.14 -0.10 0.00 0.00 -0.00 0.00 0.00 31.60 32.64 2db1 h MET 2 CO 0.45 0.29 1.37 -0.51 -0.00 0.00 0.00 176.91 178.52 2db1 s LEU 3 N -10.45 3.77 0.00 -0.10 1.02 -1.26 -4.53 118.68 107.13 2db1 s LEU 3 Ca -0.12 2.05 0.00 0.00 0.02 0.00 0.00 54.13 56.08 2db1 s LEU 3 Cb 0.25 -3.52 0.00 0.00 0.02 0.00 0.00 46.19 42.94 2db1 s LEU 3 CO 0.78 -1.62 0.00 0.61 0.02 0.00 0.00 176.35 176.14 2db1 n GLY 4 N 5.29 -1.93 0.00 -3.19 0.00 -1.26 -4.76 105.19 99.33 2db1 n GLY 4 Ca 0.25 -1.04 0.06 0.00 0.00 0.00 0.00 46.02 45.30 2db1 n GLY 4 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2db1 n PRO 5 N 0.63 0.49 -0.64 1.61 -0.04 -1.26 -3.67 135.00 132.13 2db1 n PRO 5 Ca 0.00 0.00 -0.07 0.00 -0.04 0.00 0.00 63.50 63.39 2db1 n PRO 5 Cb 0.00 -1.38 0.02 0.00 -0.04 0.00 0.00 33.50 32.10 2db1 n PRO 5 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 2db1 n GLU 6 N -0.88 1.36 -0.35 0.54 4.07 -1.26 -4.63 120.64 119.49 2db1 n GLU 6 Ca 0.09 -0.72 0.06 0.00 -0.06 0.00 0.00 57.16 56.53 2db1 n GLU 6 Cb 0.04 -1.28 0.14 0.00 -0.06 0.00 0.00 31.44 30.28 2db1 n GLU 6 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2db1 n GLY 7 N 0.86 -1.60 0.00 8.31 0.00 -1.24 -4.84 105.19 106.69 2db1 n GLY 7 Ca 0.14 1.02 0.00 0.00 0.00 0.00 0.00 46.02 47.18 2db1 n GLY 7 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2db1 n GLY 8 N -1.60 2.85 3.50 -0.02 0.00 -1.26 -4.27 105.19 104.38 2db1 n GLY 8 Ca 0.16 -0.73 -0.32 0.00 0.00 0.00 0.00 46.02 45.13 2db1 n GLY 8 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2db1 n GLU 9 N 0.00 -0.34 -3.92 1.61 0.28 -1.26 -4.75 120.64 112.27 2db1 n GLU 9 Ca 0.00 -0.05 -0.09 0.00 -0.16 0.00 0.00 57.16 56.86 2db1 n GLU 9 Cb 0.00 -2.03 -0.06 0.00 1.43 0.00 0.00 31.44 30.78 2db1 n GLU 9 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 177.13 177.17 2db1 s GLY 10 N -2.21 0.36 -0.21 -1.84 0.00 -1.26 -4.83 107.32 97.34 2db1 s GLY 10 Ca 0.60 -0.73 -0.29 0.00 0.00 0.00 0.00 44.72 44.30 2db1 s GLY 10 CO 0.64 -0.67 2.20 -1.72 0.00 0.00 0.00 173.10 173.56 2db1 n TYR 11 N -0.28 1.99 -4.09 1.90 4.01 -1.26 -2.30 117.16 117.13 2db1 n TYR 11 Ca -0.07 -0.12 -0.07 0.00 -0.16 0.00 0.00 57.90 57.48 2db1 n TYR 11 Cb 0.63 -2.72 -0.10 0.00 -0.31 0.00 0.00 39.34 36.84 2db1 n TYR 11 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 2db1 s VAL 12 N 7.90 0.24 -0.02 -0.72 1.01 -1.12 -0.59 120.40 127.09 2db1 s VAL 12 Ca 1.01 -1.77 -0.05 0.00 0.00 0.00 0.00 61.98 61.17 2db1 s VAL 12 Cb -0.39 -1.46 0.00 0.00 0.00 0.00 0.00 36.38 34.54 2db1 s VAL 12 CO 0.37 -0.97 0.11 0.68 0.00 0.00 0.00 175.10 175.29 2db1 s VAL 13 N -3.78 0.04 -0.12 2.92 -7.23 0.33 -2.90 120.40 109.66 2db1 s VAL 13 Ca 0.06 -0.35 -0.02 0.00 -1.81 0.00 0.00 61.98 59.86 2db1 s VAL 13 Cb 0.07 -0.27 -0.03 0.00 0.56 0.00 0.00 36.38 36.71 2db1 s VAL 13 CO -0.09 -0.19 -0.04 -0.75 -0.31 0.00 0.00 175.10 173.71 2db1 s LYS 14 N -0.62 3.28 -0.17 4.82 2.20 0.47 0.68 119.74 130.40 2db1 s LYS 14 Ca -0.07 -0.51 -0.02 0.00 -0.36 0.00 0.00 55.97 55.01 2db1 s LYS 14 Cb -0.04 -2.80 -0.01 0.00 -1.51 0.00 0.00 37.83 33.47 2db1 s LYS 14 CO 0.00 0.45 -0.08 -0.51 -0.36 0.00 0.00 175.35 174.85 2db1 s LEU 15 N -0.20 2.89 0.18 5.43 1.43 0.81 0.17 118.68 129.38 2db1 s LEU 15 Ca 0.04 -0.31 0.11 0.00 -1.03 0.00 0.00 54.13 52.93 2db1 s LEU 15 Cb -0.13 -1.69 -0.04 0.00 0.03 0.00 0.00 46.19 44.36 2db1 s LEU 15 CO 0.02 0.10 -0.20 -0.60 0.23 0.00 0.00 176.35 175.91 2db1 s ARG 16 N 0.73 1.67 0.00 1.70 3.52 0.26 -1.31 118.95 125.51 2db1 s ARG 16 Ca -0.04 -1.43 0.00 0.00 -0.13 0.00 0.00 55.73 54.13 2db1 s ARG 16 Cb -0.15 -1.95 0.00 0.00 -1.56 0.00 0.00 34.95 31.30 2db1 s ARG 16 CO 0.02 0.42 0.00 0.41 -0.81 0.00 0.00 175.30 175.33 2db1 n GLY 17 N 0.27 0.64 3.78 8.12 0.00 -1.26 0.25 105.19 116.99 2db1 n GLY 17 Ca -0.13 -0.20 -0.35 0.00 0.00 0.00 0.00 46.02 45.35 2db1 n GLY 17 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2db1 s LEU 18 N 0.00 3.73 0.39 0.99 1.43 -1.24 -4.29 118.68 119.68 2db1 s LEU 18 Ca 0.00 2.11 -0.26 0.00 -1.03 0.00 0.00 54.13 54.95 2db1 s LEU 18 Cb 0.00 -4.57 -0.09 0.00 0.03 0.00 0.00 46.19 41.56 2db1 s LEU 18 CO 0.00 -1.17 1.19 -2.16 0.23 0.00 0.00 176.35 174.44 2db1 s PRO 19 N -3.36 4.10 0.34 1.29 0.04 -1.26 -4.60 135.00 131.55 2db1 s PRO 19 Ca 0.71 1.91 0.16 0.00 0.04 0.00 0.00 61.00 63.83 2db1 s PRO 19 Cb -0.22 -2.75 0.90 0.00 0.04 0.00 0.00 34.50 32.46 2db1 s PRO 19 CO 0.27 -0.30 1.44 -1.49 0.04 0.00 0.00 177.00 176.96 2db1 h TRP 20 N 2.78 0.00 -0.27 0.56 4.06 -1.95 0.54 115.95 121.67 2db1 h TRP 20 Ca -0.49 0.00 -0.09 0.00 2.06 0.00 0.00 58.89 60.37 2db1 h TRP 20 Cb 1.23 0.00 -0.05 0.00 -1.00 0.00 0.00 29.16 29.34 2db1 h TRP 20 CO 0.55 0.00 -0.06 0.43 -3.56 0.00 0.00 178.44 175.80 2db1 n SER 21 N -2.15 2.94 -4.71 -3.49 7.64 -1.26 -4.78 113.62 107.80 2db1 n SER 21 Ca -0.01 -3.44 -0.42 0.00 1.01 0.00 0.00 58.87 56.01 2db1 n SER 21 Cb 0.23 -0.58 -0.03 0.00 -1.01 0.00 0.00 64.21 62.82 2db1 n SER 21 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2db1 s SER 23 N 1.24 4.14 0.36 0.00 0.01 -1.26 -5.01 113.70 113.18 2db1 s SER 23 Ca 0.67 -0.49 0.17 0.00 1.31 0.00 0.00 55.95 57.60 2db1 s SER 23 Cb -0.39 -0.69 1.22 0.00 0.21 0.00 0.00 66.02 66.37 2db1 s SER 23 CO 0.30 0.17 1.58 0.40 0.41 0.00 0.00 173.24 176.10 2db1 h ILE 24 N 3.33 0.01 -0.19 1.44 2.04 -1.98 0.60 117.51 122.75 2db1 h ILE 24 Ca -0.49 -0.00 0.04 0.00 1.00 0.00 0.00 64.86 65.41 2db1 h ILE 24 Cb 1.17 -0.00 -0.04 0.00 -0.74 0.00 0.00 36.82 37.21 2db1 h ILE 24 CO 0.49 0.00 -0.06 -0.33 0.00 0.00 0.00 178.15 178.26 2db1 h GLU 25 N 0.01 -0.01 -0.75 2.37 5.08 -1.99 0.19 114.58 119.48 2db1 h GLU 25 Ca 0.79 0.00 0.10 0.00 -1.00 0.00 0.00 59.36 59.26 2db1 h GLU 25 Cb 2.02 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 31.22 2db1 h GLU 25 CO -0.80 -0.01 0.50 -0.44 -1.00 0.00 0.00 179.01 177.26 2db1 h ASP 26 N -0.01 0.57 -0.02 1.42 5.19 -0.19 -0.16 116.42 123.22 2db1 h ASP 26 Ca 0.10 0.02 -0.04 0.00 -0.62 0.00 0.00 57.03 56.48 2db1 h ASP 26 Cb 0.16 -0.10 0.00 0.00 0.18 0.00 0.00 39.33 39.57 2db1 h ASP 26 CO -0.21 0.33 -0.16 0.58 -3.12 0.00 0.00 179.24 176.66 2db1 h VAL 27 N 0.63 1.51 -0.46 -1.35 2.07 -0.90 -1.91 116.25 115.85 2db1 h VAL 27 Ca 0.35 -1.75 0.05 0.00 0.82 0.00 0.00 66.70 66.18 2db1 h VAL 27 Cb 0.52 2.60 -0.05 0.00 -1.52 0.00 0.00 31.29 32.85 2db1 h VAL 27 CO -0.13 0.47 0.20 1.56 0.02 0.00 0.00 177.57 179.69 2db1 h GLN 28 N -0.49 0.39 -0.57 1.57 4.20 -0.12 -1.46 115.11 118.63 2db1 h GLN 28 Ca -0.01 -0.02 -0.10 0.00 0.06 0.00 0.00 58.65 58.57 2db1 h GLN 28 Cb 0.86 -0.09 -0.02 0.00 0.30 0.00 0.00 27.48 28.53 2db1 h GLN 28 CO 0.03 0.25 -0.05 -0.91 -0.67 0.00 0.00 178.83 177.49 2db1 h ASN 29 N 0.40 1.03 0.02 1.46 2.35 -1.13 -2.96 115.58 116.75 2db1 h ASN 29 Ca 0.21 -0.33 0.02 0.00 -0.55 0.00 0.00 56.30 55.65 2db1 h ASN 29 Cb 0.16 -0.28 -0.03 0.00 0.05 0.00 0.00 38.32 38.22 2db1 h ASN 29 CO -0.18 1.11 -0.17 0.15 -1.65 0.00 0.00 177.43 176.70 2db1 h PHE 30 N 0.93 -0.43 -0.51 1.19 3.04 -0.76 -2.05 116.94 118.34 2db1 h PHE 30 Ca 0.16 0.01 -0.34 0.00 3.98 0.00 0.00 57.97 61.78 2db1 h PHE 30 Cb 0.61 0.19 -0.15 0.00 2.56 0.00 0.00 35.95 39.17 2db1 h PHE 30 CO 0.04 -0.24 0.44 1.28 -2.02 0.00 0.00 178.31 177.81 2db1 n LEU 31 N -5.30 6.43 -0.09 0.59 4.77 -0.60 -4.53 117.00 118.27 2db1 n LEU 31 Ca -0.05 -3.31 0.11 0.00 -0.03 0.00 0.00 56.01 52.73 2db1 n LEU 31 Cb 0.21 -1.02 0.48 0.00 -2.33 0.00 0.00 43.42 40.77 2db1 n LEU 31 CO 0.26 1.21 1.19 0.77 -1.33 0.00 0.00 177.39 179.48 2db1 h SER 32 N 1.43 0.40 0.47 -1.43 4.64 -1.20 0.17 113.55 118.02 2db1 h SER 32 Ca 0.31 0.01 -0.01 0.00 -0.47 0.00 0.00 61.79 61.64 2db1 h SER 32 Cb 0.99 -0.08 -0.00 0.00 -0.31 0.00 0.00 62.40 63.00 2db1 h SER 32 CO 0.80 0.24 -0.03 0.44 -0.87 0.00 0.00 176.83 177.41 2db1 h ASP 33 N 0.44 0.00 -2.53 4.97 3.32 -1.85 -3.43 116.42 117.35 2db1 h ASP 33 Ca 0.27 0.00 -0.54 0.00 0.02 0.00 0.00 57.03 56.78 2db1 h ASP 33 Cb 0.49 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 39.99 2db1 h ASP 33 CO -0.08 0.03 -0.53 0.00 -1.72 0.00 0.00 179.24 176.94 2db1 s THR 35 N -1.85 5.57 0.11 0.00 2.01 -1.26 -4.95 115.64 115.27 2db1 s THR 35 Ca 0.32 -3.51 -0.36 0.00 0.31 0.00 0.00 61.69 58.46 2db1 s THR 35 Cb -0.10 -4.37 -0.15 0.00 0.01 0.00 0.00 72.50 67.89 2db1 s THR 35 CO 0.25 -1.16 1.45 -0.38 -0.69 0.00 0.00 174.62 174.10 2db1 n ILE 36 N 2.64 0.01 -2.27 1.82 5.41 -1.26 -0.93 119.36 124.79 2db1 n ILE 36 Ca 0.23 -0.00 -0.42 0.00 1.00 0.00 0.00 62.75 63.55 2db1 n ILE 36 Cb 0.39 -1.14 -0.03 0.00 -0.71 0.00 0.00 39.64 38.15 2db1 n ILE 36 CO 0.00 0.00 0.00 -2.28 0.00 0.00 0.00 176.55 174.27 2db1 s HIS 37 N 0.73 2.85 -1.45 1.39 5.65 -0.16 -2.56 115.29 121.74 2db1 s HIS 37 Ca 0.82 0.86 0.00 0.00 0.25 0.00 0.00 55.06 56.99 2db1 s HIS 37 Cb -0.84 -3.63 0.00 0.00 -1.18 0.00 0.00 32.58 26.94 2db1 s HIS 37 CO 0.43 -2.28 0.00 -0.25 -0.65 0.00 0.00 174.74 171.99 2db1 n ASP 38 N 5.57 -4.70 0.00 9.88 9.92 -1.26 -3.15 116.55 132.81 2db1 n ASP 38 Ca 0.13 0.18 0.00 0.00 -0.53 0.00 0.00 54.79 54.57 2db1 n ASP 38 Cb 0.44 -3.69 0.00 0.00 -0.64 0.00 0.00 41.12 37.23 2db1 n ASP 38 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2db1 n GLY 39 N -1.07 1.92 0.52 0.44 0.00 -1.06 0.20 105.19 106.15 2db1 n GLY 39 Ca -0.17 0.07 0.37 0.00 0.00 0.00 0.00 46.02 46.30 2db1 n GLY 39 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 2db1 h VAL 40 N 0.00 0.26 -0.07 1.61 -1.51 -1.92 1.28 116.25 115.90 2db1 h VAL 40 Ca 0.00 -0.04 -0.02 0.00 -1.23 0.00 0.00 66.70 65.42 2db1 h VAL 40 Cb 0.00 0.15 -0.01 0.00 -2.13 0.00 0.00 31.29 29.30 2db1 h VAL 40 CO 0.00 0.02 0.02 0.00 -1.23 0.00 0.00 177.57 176.38 2db1 n ALA 41 N -2.67 2.70 0.00 5.19 0.00 0.53 -3.20 120.51 123.06 2db1 n ALA 41 Ca 0.33 -0.22 0.00 0.00 0.00 0.00 0.00 53.44 53.55 2db1 n ALA 41 Cb 1.38 -1.02 0.00 0.00 0.00 0.00 0.00 19.45 19.81 2db1 n ALA 41 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2db1 n GLY 42 N 0.17 0.31 3.72 0.00 0.00 0.44 -4.70 105.19 105.12 2db1 n GLY 42 Ca 0.04 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.66 2db1 n GLY 42 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2db1 s VAL 43 N -0.74 5.05 -0.20 1.61 1.01 -1.19 -1.64 120.40 124.30 2db1 s VAL 43 Ca 0.00 1.42 0.01 0.00 0.00 0.00 0.00 61.98 63.41 2db1 s VAL 43 Cb 0.00 -4.03 0.04 0.00 0.00 0.00 0.00 36.38 32.39 2db1 s VAL 43 CO 0.00 0.25 -0.12 -1.00 0.00 0.00 0.00 175.10 174.23 2db1 s HIS 44 N 0.82 2.49 0.38 5.22 3.76 -0.54 -5.00 115.29 122.43 2db1 s HIS 44 Ca 0.37 -1.61 -0.09 0.00 -0.15 0.00 0.00 55.06 53.58 2db1 s HIS 44 Cb -0.18 -1.69 -0.06 0.00 1.11 0.00 0.00 32.58 31.77 2db1 s HIS 44 CO 0.18 -0.75 0.72 -0.06 -0.85 0.00 0.00 174.74 173.97 2db1 s PHE 45 N 1.37 3.47 -0.11 1.40 0.40 -1.26 0.11 117.98 123.36 2db1 s PHE 45 Ca -0.00 0.94 -0.04 0.00 -0.60 0.00 0.00 56.93 57.23 2db1 s PHE 45 Cb -0.16 -2.36 -0.04 0.00 0.51 0.00 0.00 43.02 40.98 2db1 s PHE 45 CO -0.09 -0.04 0.05 0.42 0.70 0.00 0.00 175.22 176.26 2db1 s ILE 46 N -2.31 4.70 0.31 0.64 -1.09 0.43 -4.86 121.20 119.02 2db1 s ILE 46 Ca 0.49 -0.09 0.11 0.00 -2.23 0.00 0.00 60.65 58.93 2db1 s ILE 46 Cb -0.10 -3.02 -0.06 0.00 -1.58 0.00 0.00 42.46 37.70 2db1 s ILE 46 CO 0.31 0.59 -0.14 -0.31 -1.23 0.00 0.00 174.94 174.15 2db1 s TYR 47 N -0.72 2.36 0.35 3.97 1.51 -1.25 -3.56 117.35 120.01 2db1 s TYR 47 Ca 0.12 -0.39 0.01 0.00 -1.01 0.00 0.00 57.07 55.80 2db1 s TYR 47 Cb -0.12 -1.16 -0.03 0.00 -0.11 0.00 0.00 41.96 40.54 2db1 s TYR 47 CO 0.02 0.66 0.55 0.95 -1.11 0.00 0.00 175.55 176.62 2db1 s THR 48 N -2.54 4.94 0.59 -0.71 -4.23 -0.54 -4.26 115.64 108.89 2db1 s THR 48 Ca 0.31 -0.51 0.30 0.00 -1.18 0.00 0.00 61.69 60.61 2db1 s THR 48 Cb -0.02 -3.80 0.41 0.00 1.34 0.00 0.00 72.50 70.43 2db1 s THR 48 CO 0.16 -0.51 1.74 -0.09 -0.54 0.00 0.00 174.62 175.38 2db1 h ARG 49 N 0.73 0.00 0.00 3.99 9.65 -1.86 0.63 114.38 127.53 2db1 h ARG 49 Ca -0.49 0.00 -0.30 0.00 -1.10 0.00 0.00 59.98 58.09 2db1 h ARG 49 Cb 1.22 0.00 -0.05 0.00 -1.39 0.00 0.00 29.97 29.75 2db1 h ARG 49 CO 0.60 0.00 -1.75 0.39 2.80 0.00 0.00 179.97 182.01 2db1 n GLU 50 N -3.65 0.64 0.00 0.20 -0.58 -1.26 -4.09 120.64 111.90 2db1 n GLU 50 Ca 0.14 0.28 0.00 0.00 -0.42 0.00 0.00 57.16 57.16 2db1 n GLU 50 Cb 0.96 -1.78 0.00 0.00 -0.57 0.00 0.00 31.44 30.05 2db1 n GLU 50 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2db1 n GLY 51 N 1.57 0.89 3.27 0.62 0.00 0.22 -4.74 105.19 107.02 2db1 n GLY 51 Ca -0.18 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.57 2db1 n GLY 51 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2db1 s ARG 52 N 0.21 1.60 -1.12 1.61 0.52 -1.26 -4.80 118.95 115.72 2db1 s ARG 52 Ca 0.00 -0.93 -0.25 0.00 -0.52 0.00 0.00 55.73 54.03 2db1 s ARG 52 Cb 0.00 -1.68 -0.16 0.00 0.52 0.00 0.00 34.95 33.64 2db1 s ARG 52 CO 0.00 0.44 2.04 -0.65 0.02 0.00 0.00 175.30 177.15 2db1 s GLN 53 N -0.99 1.82 0.58 3.54 -0.21 -1.26 -1.46 119.66 121.68 2db1 s GLN 53 Ca 0.09 -0.75 0.32 0.00 0.02 0.00 0.00 55.36 55.04 2db1 s GLN 53 Cb -0.09 -5.10 1.37 0.00 1.00 0.00 0.00 33.01 30.19 2db1 s GLN 53 CO 0.01 -4.74 1.68 1.03 -2.12 0.00 0.00 175.29 171.15 2db1 h SER 54 N 10.76 0.00 0.00 5.90 0.87 -1.88 -3.43 113.55 125.77 2db1 h SER 54 Ca 0.11 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.67 2db1 h SER 54 Cb 0.97 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.93 2db1 h SER 54 CO 1.12 0.00 0.00 0.61 -0.53 0.00 0.00 176.83 178.03 2db1 n GLY 55 N -1.67 2.36 3.77 5.77 0.00 -1.26 -4.90 105.19 109.26 2db1 n GLY 55 Ca 0.20 -0.79 -0.40 0.00 0.00 0.00 0.00 46.02 45.03 2db1 n GLY 55 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2db1 s GLU 56 N 0.00 4.19 -0.28 1.61 2.02 -1.25 -3.67 118.70 121.31 2db1 s GLU 56 Ca 0.00 2.11 -0.11 0.00 0.02 0.00 0.00 54.97 56.99 2db1 s GLU 56 Cb 0.00 -2.91 0.11 0.00 0.10 0.00 0.00 34.13 31.43 2db1 s GLU 56 CO 0.00 -0.29 0.63 0.00 0.02 0.00 0.00 175.26 175.62 2db1 s ALA 57 N -1.23 -1.87 0.76 5.21 0.00 -0.43 -0.43 121.76 123.78 2db1 s ALA 57 Ca 0.53 2.26 -0.10 0.00 0.00 0.00 0.00 51.96 54.64 2db1 s ALA 57 Cb -0.37 -1.60 0.07 0.00 0.00 0.00 0.00 23.12 21.22 2db1 s ALA 57 CO 0.49 -0.73 1.11 -0.06 0.00 0.00 0.00 175.76 176.57 2db1 s PHE 58 N 2.45 2.96 -0.23 0.00 0.40 0.30 -0.14 117.98 123.72 2db1 s PHE 58 Ca -0.07 0.65 -0.12 0.00 -0.60 0.00 0.00 56.93 56.80 2db1 s PHE 58 Cb -0.10 -3.36 0.08 0.00 0.51 0.00 0.00 43.02 40.15 2db1 s PHE 58 CO -0.18 -1.61 0.55 0.08 0.70 0.00 0.00 175.22 174.76 2db1 s VAL 59 N -3.44 -0.18 0.23 -0.44 1.01 0.21 -1.46 120.40 116.33 2db1 s VAL 59 Ca 0.61 0.06 -0.19 0.00 0.00 0.00 0.00 61.98 62.46 2db1 s VAL 59 Cb -0.11 -0.81 -0.08 0.00 0.00 0.00 0.00 36.38 35.38 2db1 s VAL 59 CO 0.48 0.02 0.71 -1.61 0.00 0.00 0.00 175.10 174.70 2db1 s GLU 60 N 1.78 4.19 0.52 2.72 2.02 -0.65 -0.52 118.70 128.77 2db1 s GLU 60 Ca -0.08 0.81 0.04 0.00 0.02 0.00 0.00 54.97 55.76 2db1 s GLU 60 Cb -0.08 -2.81 0.01 0.00 0.10 0.00 0.00 34.13 31.35 2db1 s GLU 60 CO -0.16 0.36 0.24 -0.51 0.02 0.00 0.00 175.26 175.21 2db1 s LEU 61 N -2.13 2.62 -0.21 1.80 1.43 0.24 -0.98 118.68 121.44 2db1 s LEU 61 Ca 0.44 -1.36 -0.06 0.00 -1.03 0.00 0.00 54.13 52.12 2db1 s LEU 61 Cb -0.16 -1.07 -0.19 0.00 0.03 0.00 0.00 46.19 44.80 2db1 s LEU 61 CO 0.20 -0.95 -0.01 1.21 0.23 0.00 0.00 176.35 177.03 2db1 n GLU 62 N -1.53 0.66 -4.28 1.70 4.07 -0.10 -3.76 120.64 117.40 2db1 n GLU 62 Ca -0.07 0.26 -0.18 0.00 -0.06 0.00 0.00 57.16 57.11 2db1 n GLU 62 Cb 0.65 -1.60 -0.09 0.00 -0.06 0.00 0.00 31.44 30.34 2db1 n GLU 62 CO 0.00 0.00 0.00 -1.12 -0.06 0.00 0.00 177.13 175.95 2db1 s SER 63 N -6.89 1.31 0.06 4.31 0.01 -1.26 -5.00 113.70 106.24 2db1 s SER 63 Ca -0.31 -1.62 -0.33 0.00 1.31 0.00 0.00 55.95 55.00 2db1 s SER 63 Cb 0.09 0.48 -0.19 0.00 0.21 0.00 0.00 66.02 66.61 2db1 s SER 63 CO 0.63 -0.97 1.56 -0.08 0.41 0.00 0.00 173.24 174.80 2db1 h GLU 64 N 2.26 -0.92 -0.71 12.44 4.81 -1.98 -2.94 114.58 127.54 2db1 h GLU 64 Ca -0.30 0.06 0.20 0.00 -0.13 0.00 0.00 59.36 59.19 2db1 h GLU 64 Cb 1.24 0.21 -0.13 0.00 0.63 0.00 0.00 28.75 30.70 2db1 h GLU 64 CO 0.45 -0.61 0.02 -3.47 -0.73 0.00 0.00 179.01 174.67 2db1 n ASP 65 N -5.49 -0.07 -0.21 1.04 2.03 -1.26 0.17 116.55 112.76 2db1 n ASP 65 Ca -0.14 1.21 0.01 0.00 0.52 0.00 0.00 54.79 56.39 2db1 n ASP 65 Cb 0.39 -0.45 0.09 0.00 -0.72 0.00 0.00 41.12 40.43 2db1 n ASP 65 CO 0.00 0.00 0.00 0.44 -1.92 0.00 0.00 177.20 175.72 2db1 h ASP 66 N 0.00 -0.40 0.22 1.67 3.32 -1.88 -1.62 116.42 117.73 2db1 h ASP 66 Ca 0.44 0.17 0.00 0.00 0.02 0.00 0.00 57.03 57.66 2db1 h ASP 66 Cb 0.91 0.32 -0.03 0.00 0.22 0.00 0.00 39.33 40.75 2db1 h ASP 66 CO -0.67 -0.16 -0.43 0.58 -1.72 0.00 0.00 179.24 176.85 2db1 h VAL 67 N 0.07 0.00 -0.94 -1.35 2.07 0.17 0.23 116.25 116.49 2db1 h VAL 67 Ca 0.32 0.00 0.26 0.00 0.82 0.00 0.00 66.70 68.10 2db1 h VAL 67 Cb 0.51 0.00 -0.14 0.00 -1.52 0.00 0.00 31.29 30.15 2db1 h VAL 67 CO -0.58 0.00 0.44 0.11 0.02 0.00 0.00 177.57 177.56 2db1 h LYS 68 N -0.70 0.35 -0.04 1.57 1.57 -1.37 0.51 116.57 118.46 2db1 h LYS 68 Ca -0.02 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.73 2db1 h LYS 68 Cb 0.66 -0.08 -0.00 0.00 0.08 0.00 0.00 32.23 32.89 2db1 h LYS 68 CO -0.16 0.23 -0.00 -0.07 -0.57 0.00 0.00 179.45 178.88 2db1 h LEU 69 N 0.36 0.06 -0.72 2.94 3.38 -0.52 -3.12 115.31 117.70 2db1 h LEU 69 Ca 0.62 -0.32 0.14 0.00 0.09 0.00 0.00 57.88 58.41 2db1 h LEU 69 Cb 1.28 -0.02 -0.09 0.00 0.09 0.00 0.00 40.66 41.92 2db1 h LEU 69 CO -0.57 0.37 0.25 0.00 0.09 0.00 0.00 178.44 178.58 2db1 h ALA 70 N 0.69 0.97 -0.03 1.53 0.00 0.16 0.43 119.26 123.02 2db1 h ALA 70 Ca 0.01 0.13 0.01 0.00 0.00 0.00 0.00 54.91 55.05 2db1 h ALA 70 Cb 0.34 0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.25 2db1 h ALA 70 CO 0.00 -0.25 0.13 -0.07 0.00 0.00 0.00 179.25 179.07 2db1 h LEU 71 N 0.38 0.00 -0.44 0.00 3.38 -1.17 0.29 115.31 117.76 2db1 h LEU 71 Ca 0.39 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.36 2db1 h LEU 71 Cb 0.60 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.35 2db1 h LEU 71 CO -0.42 0.00 0.00 0.11 0.09 0.00 0.00 178.44 178.22 2db1 h LYS 72 N 0.00 0.00 -0.62 1.13 1.57 -0.13 -2.92 116.57 115.59 2db1 h LYS 72 Ca 0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 2db1 h LYS 72 Cb 0.27 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.58 2db1 h LYS 72 CO -0.00 0.00 0.00 1.63 -0.57 0.00 0.00 179.45 180.51 2db1 n LYS 73 N -2.48 2.02 -1.27 3.15 4.76 0.10 -4.92 118.16 119.52 2db1 n LYS 73 Ca 0.03 -0.99 -0.33 0.00 -2.87 0.00 0.00 58.31 54.16 2db1 n LYS 73 Cb 0.36 -1.54 0.10 0.00 -1.84 0.00 0.00 35.03 32.12 2db1 n LYS 73 CO 0.00 0.00 0.00 0.16 -1.37 0.00 0.00 177.40 176.19 2db1 s ASP 74 N -0.55 4.05 -0.78 4.39 -4.77 -1.11 -2.74 116.67 115.15 2db1 s ASP 74 Ca 0.18 2.18 -0.06 0.00 -3.30 0.00 0.00 52.55 51.55 2db1 s ASP 74 Cb 0.12 -2.57 0.06 0.00 -1.09 0.00 0.00 42.92 39.44 2db1 s ASP 74 CO 0.08 -2.35 0.21 0.54 0.70 0.00 0.00 175.17 174.35 2db1 n ARG 75 N -3.18 -2.56 -2.00 2.11 1.74 -1.02 -4.90 116.66 106.84 2db1 n ARG 75 Ca 0.12 0.22 -0.29 0.00 -0.77 0.00 0.00 57.85 57.13 2db1 n ARG 75 Cb 0.51 -4.80 0.19 0.00 -1.02 0.00 0.00 32.46 27.34 2db1 n ARG 75 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 2db1 s GLU 76 N -5.63 0.62 -0.19 5.56 0.41 -0.54 -4.83 118.70 114.11 2db1 s GLU 76 Ca 0.24 -0.53 -0.01 0.00 -0.41 0.00 0.00 54.97 54.25 2db1 s GLU 76 Cb -0.13 -1.88 0.05 0.00 -1.78 0.00 0.00 34.13 30.38 2db1 s GLU 76 CO 0.29 -2.40 -0.02 -1.54 -0.49 0.00 0.00 175.26 171.10 2db1 s SER 77 N -4.91 3.03 -0.32 -0.19 1.04 -1.26 -0.83 113.70 110.25 2db1 s SER 77 Ca 0.74 -0.81 -0.09 0.00 0.48 0.00 0.00 55.95 56.28 2db1 s SER 77 Cb -0.03 -0.84 0.01 0.00 0.10 0.00 0.00 66.02 65.26 2db1 s SER 77 CO 0.53 -0.24 0.15 -0.32 0.98 0.00 0.00 173.24 174.33 2db1 s MET 78 N 1.67 3.13 4.82 4.02 1.75 0.87 -4.94 119.30 130.63 2db1 s MET 78 Ca -0.01 -0.85 0.00 0.00 -1.25 0.00 0.00 55.69 53.57 2db1 s MET 78 Cb -0.17 -3.55 0.00 0.00 2.84 0.00 0.00 34.83 33.95 2db1 s MET 78 CO -0.07 -0.50 0.00 0.41 -0.65 0.00 0.00 175.02 174.21 2db1 n GLY 79 N 4.95 1.02 0.11 2.11 0.00 -1.26 -1.44 105.19 110.68 2db1 n GLY 79 Ca -0.13 0.37 0.09 0.00 0.00 0.00 0.00 46.02 46.34 2db1 n GLY 79 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 2db1 n HIS 80 N 0.00 0.00 -4.25 1.61 1.44 -1.26 -5.05 115.22 107.72 2db1 n HIS 80 Ca 0.00 -0.88 -0.14 0.00 -2.01 0.00 0.00 57.72 54.68 2db1 n HIS 80 Cb 0.00 -0.14 -0.10 0.00 0.12 0.00 0.00 29.99 29.88 2db1 n HIS 80 CO 0.00 0.00 0.00 1.03 -2.81 0.00 0.00 176.34 174.56 2db1 s ARG 81 N -2.53 1.35 0.10 -1.40 0.52 -0.52 -5.15 118.95 111.32 2db1 s ARG 81 Ca 0.28 -1.73 0.02 0.00 -0.52 0.00 0.00 55.73 53.78 2db1 s ARG 81 Cb 0.24 0.14 -0.04 0.00 0.52 0.00 0.00 34.95 35.81 2db1 s ARG 81 CO 0.03 -0.41 0.21 0.71 0.02 0.00 0.00 175.30 175.85 2db1 s TYR 82 N -3.95 3.41 0.01 -0.53 1.51 -1.26 -0.09 117.35 116.46 2db1 s TYR 82 Ca 0.39 0.15 0.06 0.00 -1.01 0.00 0.00 57.07 56.65 2db1 s TYR 82 Cb 0.06 -1.68 -0.02 0.00 -0.11 0.00 0.00 41.96 40.22 2db1 s TYR 82 CO 0.15 0.55 -0.17 0.42 -1.11 0.00 0.00 175.55 175.38 2db1 s ILE 83 N -1.59 1.36 -0.19 2.71 -1.09 -0.01 -4.18 121.20 118.20 2db1 s ILE 83 Ca 0.33 -0.88 0.01 0.00 -2.23 0.00 0.00 60.65 57.88 2db1 s ILE 83 Cb -0.12 -1.16 0.04 0.00 -1.58 0.00 0.00 42.46 39.64 2db1 s ILE 83 CO 0.27 0.26 -0.12 -1.61 -1.23 0.00 0.00 174.94 172.51 2db1 s GLU 84 N -0.72 2.17 0.30 2.79 2.02 0.14 -1.47 118.70 123.93 2db1 s GLU 84 Ca 0.06 -0.80 -0.24 0.00 0.02 0.00 0.00 54.97 54.00 2db1 s GLU 84 Cb -0.07 -2.38 -0.09 0.00 0.10 0.00 0.00 34.13 31.68 2db1 s GLU 84 CO 0.00 -0.38 0.88 0.08 0.02 0.00 0.00 175.26 175.87 2db1 s VAL 85 N 1.39 4.31 -0.03 2.63 1.01 -1.26 -0.57 120.40 127.88 2db1 s VAL 85 Ca 0.00 1.67 -0.00 0.00 0.00 0.00 0.00 61.98 63.65 2db1 s VAL 85 Cb -0.15 -3.96 0.03 0.00 0.00 0.00 0.00 36.38 32.30 2db1 s VAL 85 CO -0.09 0.15 0.02 -0.36 0.00 0.00 0.00 175.10 174.82 2db1 s PHE 86 N -1.61 0.18 -0.18 5.22 0.08 0.13 -4.89 117.98 116.91 2db1 s PHE 86 Ca 0.48 0.09 -0.29 0.00 0.12 0.00 0.00 56.93 57.34 2db1 s PHE 86 Cb -0.18 -0.39 -0.03 0.00 -0.57 0.00 0.00 43.02 41.86 2db1 s PHE 86 CO 0.23 -0.14 1.49 0.21 -0.10 0.00 0.00 175.22 176.91 2db1 s LYS 87 N 1.36 4.02 0.09 0.44 2.36 -1.26 -0.39 119.74 126.36 2db1 s LYS 87 Ca -0.05 1.73 -0.04 0.00 -2.55 0.00 0.00 55.97 55.06 2db1 s LYS 87 Cb -0.13 -3.93 -0.02 0.00 -1.05 0.00 0.00 37.83 32.69 2db1 s LYS 87 CO -0.03 -1.01 0.09 0.45 1.55 0.00 0.00 175.35 176.40 2db1 s SER 88 N 3.24 0.29 0.37 1.43 0.15 -1.14 -4.92 113.70 113.11 2db1 s SER 88 Ca 0.65 -0.92 0.06 0.00 0.70 0.00 0.00 55.95 56.45 2db1 s SER 88 Cb -0.25 0.29 0.06 0.00 -1.71 0.00 0.00 66.02 64.41 2db1 s SER 88 CO 0.25 -0.70 0.51 0.00 1.20 0.00 0.00 173.24 174.50 2db1 n HIS 89 N -0.02 -2.55 0.05 3.44 1.44 -1.26 -2.81 115.22 113.51 2db1 n HIS 89 Ca -0.12 -1.34 -0.03 0.00 -2.01 0.00 0.00 57.72 54.22 2db1 n HIS 89 Cb 0.62 -0.35 -0.01 0.00 0.12 0.00 0.00 29.99 30.37 2db1 n HIS 89 CO 0.00 0.00 0.00 -0.09 -2.81 0.00 0.00 176.34 173.44 2db1 h ARG 90 N 0.00 -0.18 -0.71 -1.40 9.65 -1.78 -3.19 114.38 116.78 2db1 h ARG 90 Ca -0.17 0.01 0.11 0.00 -1.10 0.00 0.00 59.98 58.83 2db1 h ARG 90 Cb 0.79 0.04 -0.11 0.00 -1.39 0.00 0.00 29.97 29.29 2db1 h ARG 90 CO 0.24 -0.12 -0.28 2.41 2.80 0.00 0.00 179.97 185.03 2db1 n THR 91 N -3.95 -0.37 0.06 0.20 -1.04 -1.26 0.66 114.28 108.57 2db1 n THR 91 Ca -0.02 1.66 -0.12 0.00 -2.04 0.00 0.00 64.05 63.53 2db1 n THR 91 Cb 0.07 -2.19 -0.05 0.00 -1.82 0.00 0.00 70.33 66.34 2db1 n THR 91 CO 0.00 0.00 0.00 -0.08 -0.64 0.00 0.00 175.07 174.35 2db1 h GLU 92 N 0.00 -0.43 0.00 -2.82 4.57 -1.99 0.14 114.58 114.05 2db1 h GLU 92 Ca 0.25 0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.46 2db1 h GLU 92 Cb 0.42 0.10 0.00 0.00 -0.16 0.00 0.00 28.75 29.11 2db1 h GLU 92 CO -0.70 -0.28 0.19 1.98 -1.18 0.00 0.00 179.01 179.02 2db1 h MET 93 N -0.44 0.00 -0.08 1.92 4.05 0.24 -0.60 114.93 120.02 2db1 h MET 93 Ca 0.06 0.00 -0.10 0.00 -0.28 0.00 0.00 59.70 59.38 2db1 h MET 93 Cb 0.53 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.34 2db1 h MET 93 CO -0.26 0.00 -0.35 0.22 0.23 0.00 0.00 176.91 176.75 2db1 h ASP 94 N 0.00 0.45 -0.01 1.39 3.58 0.76 -2.74 116.42 119.84 2db1 h ASP 94 Ca 0.00 -0.64 -0.02 0.00 0.42 0.00 0.00 57.03 56.79 2db1 h ASP 94 Cb 0.39 -0.13 0.00 0.00 1.72 0.00 0.00 39.33 41.31 2db1 h ASP 94 CO 0.00 1.01 -0.05 4.11 -2.88 0.00 0.00 179.24 181.43 2db1 h TRP 95 N -0.09 0.07 -0.68 0.28 5.08 -0.86 -2.34 115.95 117.40 2db1 h TRP 95 Ca -0.02 -0.03 0.17 0.00 1.08 0.00 0.00 58.89 60.09 2db1 h TRP 95 Cb 0.99 -0.01 -0.03 0.00 -3.00 0.00 0.00 29.16 27.11 2db1 h TRP 95 CO 0.12 0.72 0.48 -0.39 -1.28 0.00 0.00 178.44 178.09 2db1 h VAL 96 N -0.59 0.72 0.12 0.12 -1.51 -1.42 -2.04 116.25 111.64 2db1 h VAL 96 Ca -0.00 -0.05 -0.01 0.00 -1.23 0.00 0.00 66.70 65.41 2db1 h VAL 96 Cb 0.72 0.56 0.00 0.00 -2.13 0.00 0.00 31.29 30.44 2db1 h VAL 96 CO 0.01 0.03 -0.06 -0.07 -1.23 0.00 0.00 177.57 176.25 2db1 h LEU 97 N 0.14 -0.13 -1.51 4.19 3.38 -1.48 -2.99 115.31 116.92 2db1 h LEU 97 Ca 0.33 0.00 0.48 0.00 0.09 0.00 0.00 57.88 58.78 2db1 h LEU 97 Cb 1.09 0.03 -0.12 0.00 0.09 0.00 0.00 40.66 41.75 2db1 h LEU 97 CO -0.05 0.21 0.97 0.11 0.09 0.00 0.00 178.44 179.77 2db1 h LYS 98 N -0.76 0.03 -1.29 1.13 1.57 -1.17 0.96 116.57 117.05 2db1 h LYS 98 Ca -0.02 -0.00 -0.63 0.00 -1.87 0.00 0.00 60.65 58.13 2db1 h LYS 98 Cb 0.12 -0.01 -0.36 0.00 0.08 0.00 0.00 32.23 32.06 2db1 h LYS 98 CO 0.03 0.02 -0.05 0.72 -0.57 0.00 0.00 179.45 179.60 2db1 n HIS 99 N -4.57 3.10 -0.05 -1.35 8.25 -0.79 -4.62 115.22 115.18 2db1 n HIS 99 Ca 0.40 -2.67 -0.10 0.00 -0.26 0.00 0.00 57.72 55.08 2db1 n HIS 99 Cb 1.59 -0.67 -0.03 0.00 1.12 0.00 0.00 29.99 32.00 2db1 n HIS 99 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 2db1 n SER 100 N -0.65 0.72 -4.77 0.41 3.41 0.33 -4.92 113.62 108.16 2db1 n SER 100 Ca 0.49 0.12 -0.33 0.00 -0.26 0.00 0.00 58.87 58.89 2db1 n SER 100 Cb 0.66 -0.30 0.05 0.00 -0.26 0.00 0.00 64.21 64.37 2db1 n SER 100 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2db1 s GLY 101 N -5.12 2.16 0.00 5.00 0.00 -1.25 -3.19 107.32 104.91 2db1 s GLY 101 Ca -0.13 0.56 0.11 0.00 0.00 0.00 0.00 44.72 45.26 2db1 s GLY 101 CO 0.17 0.92 1.10 -1.55 0.00 0.00 0.00 173.10 173.73 2db1 n PRO 102 N -2.46 0.49 -4.87 2.90 -0.04 -1.20 -4.65 135.00 125.17 2db1 n PRO 102 Ca 0.11 0.00 -0.25 0.00 -0.04 0.00 0.00 63.50 63.31 2db1 n PRO 102 Cb 0.52 -1.35 -0.15 0.00 -0.04 0.00 0.00 33.50 32.47 2db1 n PRO 102 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2db1 s ASN 103 N -1.86 2.11 -0.05 3.54 4.22 -1.26 -4.90 114.94 116.74 2db1 s ASN 103 Ca 0.17 -0.33 0.04 0.00 -2.14 0.00 0.00 52.86 50.60 2db1 s ASN 103 Cb 0.08 -0.25 0.00 0.00 1.28 0.00 0.00 41.25 42.36 2db1 s ASN 103 CO 0.13 0.22 -0.15 -0.94 -2.04 0.00 0.00 177.10 174.32 2db1 s SER 104 N -0.40 1.95 -0.28 3.54 1.04 -1.26 -4.93 113.70 113.36 2db1 s SER 104 Ca 0.06 -0.32 -0.18 0.00 0.48 0.00 0.00 55.95 56.00 2db1 s SER 104 Cb -0.07 -0.62 0.11 0.00 0.10 0.00 0.00 66.02 65.54 2db1 s SER 104 CO -0.01 0.12 0.85 0.00 0.98 0.00 0.00 173.24 175.18 2db1 s ALA 105 N 0.19 -2.05 0.21 5.32 0.00 -1.26 -5.18 121.76 118.99 2db1 s ALA 105 Ca -0.06 2.24 -0.16 0.00 0.00 0.00 0.00 51.96 53.97 2db1 s ALA 105 Cb -0.12 -1.53 0.02 0.00 0.00 0.00 0.00 23.12 21.49 2db1 s ALA 105 CO 0.02 -0.35 0.51 -1.54 0.00 0.00 0.00 175.76 174.41 2db1 s SER 106 N 1.24 -0.21 1.00 0.00 1.04 -1.26 -5.18 113.70 110.34 2db1 s SER 106 Ca -0.07 -0.59 -0.01 0.00 0.48 0.00 0.00 55.95 55.75 2db1 s SER 106 Cb -0.04 0.58 0.02 0.00 0.10 0.00 0.00 66.02 66.67 2db1 s SER 106 CO -0.15 -1.07 0.09 0.61 0.98 0.00 0.00 173.24 173.70 2db1 n GLY 107 N -0.34 -1.39 3.77 7.32 0.00 -1.26 -5.02 105.19 108.27 2db1 n GLY 107 Ca -0.08 -1.63 -0.38 0.00 0.00 0.00 0.00 46.02 43.93 2db1 n GLY 107 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2db1 s PRO 108 N -3.20 3.91 -0.03 1.61 0.04 -1.26 -5.05 135.00 131.02 2db1 s PRO 108 Ca 0.05 1.84 0.07 0.00 0.04 0.00 0.00 61.00 63.00 2db1 s PRO 108 Cb -0.00 -2.56 -0.02 0.00 0.04 0.00 0.00 34.50 31.96 2db1 s PRO 108 CO 0.04 -0.44 -0.25 -1.12 0.04 0.00 0.00 177.00 175.27 2db1 s SER 109 N -1.20 2.92 0.02 6.66 0.01 -1.26 -5.06 113.70 115.78 2db1 s SER 109 Ca 0.60 -0.46 -0.23 0.00 1.31 0.00 0.00 55.95 57.17 2db1 s SER 109 Cb -0.30 -0.46 -0.12 0.00 0.21 0.00 0.00 66.02 65.34 2db1 s SER 109 CO 0.38 0.28 1.10 0.28 0.41 0.00 0.00 173.24 175.69 2db1 h SER 110 N 5.68 -0.69 0.00 2.44 0.02 -2.07 -3.57 113.55 115.36 2db1 h SER 110 Ca -0.39 0.02 0.00 0.00 -0.84 0.00 0.00 61.79 60.58 2db1 h SER 110 Cb 1.14 0.18 0.00 0.00 0.14 0.00 0.00 62.40 63.86 2db1 h SER 110 CO 0.47 -0.40 0.00 0.61 -1.14 0.00 0.00 176.83 176.37