#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dlg s SER 2 N 0.00 6.81 0.16 1.61 0.01 -1.26 -5.06 113.70 115.97 2dlg s SER 2 Ca 0.00 0.96 -0.29 0.00 1.31 0.00 0.00 55.95 57.93 2dlg s SER 2 Cb 0.00 -2.26 -0.07 0.00 0.21 0.00 0.00 66.02 63.90 2dlg s SER 2 CO 0.00 0.28 0.92 -0.44 0.41 0.00 0.00 173.24 174.41 2dlg s SER 3 N -0.86 7.52 0.00 2.44 0.01 -1.26 -5.03 113.70 116.52 2dlg s SER 3 Ca 0.24 1.81 0.00 0.00 1.31 0.00 0.00 55.95 59.31 2dlg s SER 3 Cb -0.17 -2.58 0.00 0.00 0.21 0.00 0.00 66.02 63.49 2dlg s SER 3 CO 0.13 0.05 0.00 0.61 0.41 0.00 0.00 173.24 174.45 2dlg n GLY 4 N 1.91 2.75 3.19 3.44 0.00 -1.26 -5.15 105.19 110.07 2dlg n GLY 4 Ca -0.00 -0.37 -0.24 0.00 0.00 0.00 0.00 46.02 45.40 2dlg n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2dlg s SER 5 N 0.98 2.14 -0.15 1.61 1.04 -1.26 -5.13 113.70 112.92 2dlg s SER 5 Ca 0.00 -0.41 -0.05 0.00 0.48 0.00 0.00 55.95 55.97 2dlg s SER 5 Cb 0.00 -0.20 0.07 0.00 0.10 0.00 0.00 66.02 66.00 2dlg s SER 5 CO 0.00 0.16 0.27 -0.94 0.98 0.00 0.00 173.24 173.72 2dlg s SER 6 N -0.81 0.47 0.00 7.02 1.04 -1.26 -5.11 113.70 115.04 2dlg s SER 6 Ca 0.06 0.47 0.00 0.00 0.48 0.00 0.00 55.95 56.96 2dlg s SER 6 Cb -0.08 0.71 0.00 0.00 0.10 0.00 0.00 66.02 66.76 2dlg s SER 6 CO 0.01 -0.26 0.00 0.61 0.98 0.00 0.00 173.24 174.58 2dlg n GLY 7 N 5.35 0.34 2.95 7.32 0.00 -1.26 -5.09 105.19 114.79 2dlg n GLY 7 Ca -0.06 0.68 -0.47 0.00 0.00 0.00 0.00 46.02 46.16 2dlg n GLY 7 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2dlg n ARG 8 N 0.00 0.00 -3.40 1.61 1.74 -1.26 -4.87 116.66 110.48 2dlg n ARG 8 Ca 0.00 0.00 -0.34 0.00 -0.77 0.00 0.00 57.85 56.74 2dlg n ARG 8 Cb 0.00 -1.33 -0.06 0.00 -1.02 0.00 0.00 32.46 30.06 2dlg n ARG 8 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2dlg s ALA 9 N 6.23 3.59 1.18 7.54 0.00 -1.26 -5.09 121.76 133.95 2dlg s ALA 9 Ca 1.11 -0.21 -0.19 0.00 0.00 0.00 0.00 51.96 52.68 2dlg s ALA 9 Cb -1.25 -2.47 0.28 0.00 0.00 0.00 0.00 23.12 19.68 2dlg s ALA 9 CO 0.53 0.48 1.11 -1.25 0.00 0.00 0.00 175.76 176.64 2dlg s PRO 10 N -2.26 -1.07 -0.66 0.00 0.04 -1.26 -4.98 135.00 124.80 2dlg s PRO 10 Ca 0.41 -0.01 -0.17 0.00 0.04 0.00 0.00 61.00 61.26 2dlg s PRO 10 Cb -0.14 -1.61 0.13 0.00 0.04 0.00 0.00 34.50 32.93 2dlg s PRO 10 CO 0.20 -3.62 0.72 -1.12 0.04 0.00 0.00 177.00 173.21 2dlg s SER 11 N -3.85 6.34 0.34 6.66 0.01 -1.26 -4.87 113.70 117.07 2dlg s SER 11 Ca 0.70 -1.81 0.18 0.00 1.31 0.00 0.00 55.95 56.33 2dlg s SER 11 Cb -0.11 -2.28 0.45 0.00 0.21 0.00 0.00 66.02 64.30 2dlg s SER 11 CO 0.56 -0.95 1.62 -0.37 0.41 0.00 0.00 173.24 174.51 2dlg h VAL 12 N 5.69 0.83 -2.29 3.43 -1.51 -1.94 -3.46 116.25 117.00 2dlg h VAL 12 Ca -0.17 -1.77 -0.55 0.00 -1.23 0.00 0.00 66.70 62.97 2dlg h VAL 12 Cb 1.07 2.12 -0.14 0.00 -2.13 0.00 0.00 31.29 32.22 2dlg h VAL 12 CO 1.02 0.40 -0.65 0.00 -1.23 0.00 0.00 177.57 177.12 2dlg s ALA 13 N -3.33 2.68 0.22 5.19 0.00 -1.26 -5.03 121.76 120.22 2dlg s ALA 13 Ca 0.02 -2.06 0.10 0.00 0.00 0.00 0.00 51.96 50.02 2dlg s ALA 13 Cb 0.09 0.20 -0.05 0.00 0.00 0.00 0.00 23.12 23.37 2dlg s ALA 13 CO 0.70 -0.08 -0.20 0.99 0.00 0.00 0.00 175.76 177.18 2dlg s THR 14 N -2.89 2.16 0.09 0.00 2.01 -1.26 -3.78 115.64 111.97 2dlg s THR 14 Ca 0.33 -2.16 -0.24 0.00 0.31 0.00 0.00 61.69 59.93 2dlg s THR 14 Cb 0.05 -2.10 -0.07 0.00 0.01 0.00 0.00 72.50 70.40 2dlg s THR 14 CO 0.15 -0.34 0.72 0.54 -0.69 0.00 0.00 174.62 175.00 2dlg s VAL 15 N -2.27 4.61 0.00 3.82 0.11 -1.23 -3.95 120.40 121.49 2dlg s VAL 15 Ca 0.23 1.55 0.00 0.00 -2.93 0.00 0.00 61.98 60.83 2dlg s VAL 15 Cb -0.05 -4.07 0.00 0.00 -1.53 0.00 0.00 36.38 30.73 2dlg s VAL 15 CO 0.10 0.46 0.00 0.61 -3.33 0.00 0.00 175.10 172.94 2dlg n GLY 16 N 2.00 1.75 3.79 6.54 0.00 -1.25 -4.53 105.19 113.49 2dlg n GLY 16 Ca -0.05 -0.04 -0.37 0.00 0.00 0.00 0.00 46.02 45.56 2dlg n GLY 16 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dlg s SER 17 N 0.03 7.28 0.06 1.61 0.01 -1.25 -4.90 113.70 116.53 2dlg s SER 17 Ca 0.00 1.68 -0.31 0.00 1.31 0.00 0.00 55.95 58.64 2dlg s SER 17 Cb 0.00 -2.52 -0.08 0.00 0.21 0.00 0.00 66.02 63.64 2dlg s SER 17 CO 0.00 0.02 1.58 -0.63 0.41 0.00 0.00 173.24 174.62 2dlg s ILE 18 N -1.49 3.20 -0.05 1.44 -1.09 -1.26 -4.51 121.20 117.43 2dlg s ILE 18 Ca 0.45 0.65 -0.15 0.00 -2.23 0.00 0.00 60.65 59.37 2dlg s ILE 18 Cb -0.19 -3.42 -0.05 0.00 -1.58 0.00 0.00 42.46 37.22 2dlg s ILE 18 CO 0.24 0.00 0.40 0.00 -1.23 0.00 0.00 174.94 174.34 2dlg s ASP 20 N -0.52 4.17 0.29 0.00 1.47 -1.24 -3.25 116.67 117.59 2dlg s ASP 20 Ca 0.23 -0.39 -0.11 0.00 1.18 0.00 0.00 52.55 53.46 2dlg s ASP 20 Cb -0.16 -1.70 -0.07 0.00 -0.34 0.00 0.00 42.92 40.65 2dlg s ASP 20 CO 0.11 0.02 0.63 -0.22 0.68 0.00 0.00 175.17 176.39 2dlg s LEU 21 N 1.26 4.07 -0.39 2.11 2.96 -0.93 -4.90 118.68 122.86 2dlg s LEU 21 Ca 0.03 1.02 -0.10 0.00 -0.22 0.00 0.00 54.13 54.86 2dlg s LEU 21 Cb -0.14 -3.82 0.05 0.00 0.50 0.00 0.00 46.19 42.78 2dlg s LEU 21 CO -0.03 -0.18 0.23 0.20 -1.32 0.00 0.00 176.35 175.26 2dlg s ASN 22 N -2.57 5.70 0.04 3.68 0.01 -1.26 -3.93 114.94 116.61 2dlg s ASN 22 Ca 0.49 -1.21 0.03 0.00 -0.71 0.00 0.00 52.86 51.47 2dlg s ASN 22 Cb -0.11 -2.01 -0.02 0.00 0.41 0.00 0.00 41.25 39.52 2dlg s ASN 22 CO 0.23 -0.45 -0.10 -0.76 -1.51 0.00 0.00 177.10 174.51 2dlg s LEU 23 N 1.50 2.20 -0.25 0.60 1.43 -1.18 -5.05 118.68 117.94 2dlg s LEU 23 Ca 0.02 -0.47 -0.04 0.00 -1.03 0.00 0.00 54.13 52.62 2dlg s LEU 23 Cb -0.21 -0.35 0.14 0.00 0.03 0.00 0.00 46.19 45.81 2dlg s LEU 23 CO 0.05 -0.08 0.46 -1.59 0.23 0.00 0.00 176.35 175.42 2dlg s LYS 24 N -1.28 0.42 -0.27 1.70 -2.85 -1.26 -1.74 119.74 114.46 2dlg s LYS 24 Ca -0.04 0.81 -0.01 0.00 -1.00 0.00 0.00 55.97 55.74 2dlg s LYS 24 Cb -0.08 0.03 0.15 0.00 -2.06 0.00 0.00 37.83 35.86 2dlg s LYS 24 CO 0.01 -0.54 0.38 0.42 0.10 0.00 0.00 175.35 175.73 2dlg s ILE 25 N 2.67 -0.60 0.32 3.79 1.01 -0.96 -5.01 121.20 122.41 2dlg s ILE 25 Ca 0.11 -0.20 0.12 0.00 0.00 0.00 0.00 60.65 60.68 2dlg s ILE 25 Cb -0.14 -0.90 0.05 0.00 0.01 0.00 0.00 42.46 41.47 2dlg s ILE 25 CO -0.17 -0.22 1.74 1.55 0.00 0.00 0.00 174.94 177.84 2dlg h PRO 26 N 8.18 0.00 -0.31 2.79 0.13 -1.88 -3.09 132.00 137.82 2dlg h PRO 26 Ca -0.14 0.00 -0.17 0.00 -0.87 0.00 0.00 66.00 64.81 2dlg h PRO 26 Cb 1.13 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.26 2dlg h PRO 26 CO 0.27 0.47 -0.48 0.93 -0.23 0.00 0.00 178.00 178.96 2dlg h GLU 27 N 0.00 0.84 -5.93 0.86 4.39 -1.95 -3.44 114.58 109.36 2dlg h GLU 27 Ca -0.00 -0.50 -0.66 0.00 0.34 0.00 0.00 59.36 58.54 2dlg h GLU 27 Cb 0.85 0.04 -0.09 0.00 -0.10 0.00 0.00 28.75 29.45 2dlg h GLU 27 CO 0.06 1.13 -0.56 0.42 -1.16 0.00 0.00 179.01 178.91 2dlg s ILE 28 N -4.21 4.90 0.30 3.13 1.01 -1.17 -5.12 121.20 120.04 2dlg s ILE 28 Ca -0.10 -0.28 0.04 0.00 0.00 0.00 0.00 60.65 60.30 2dlg s ILE 28 Cb 0.11 -3.22 0.04 0.00 0.01 0.00 0.00 42.46 39.40 2dlg s ILE 28 CO 0.88 0.40 0.32 0.59 0.00 0.00 0.00 174.94 177.12 2dlg n ASN 29 N 1.32 1.56 0.03 3.58 3.02 -1.26 -4.68 115.26 118.82 2dlg n ASN 29 Ca -0.14 -1.92 0.12 0.00 -0.03 0.00 0.00 54.58 52.61 2dlg n ASN 29 Cb 0.53 -0.12 0.21 0.00 -0.61 0.00 0.00 39.78 39.79 2dlg n ASN 29 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40 2dlg n SER 30 N -2.26 0.58 0.07 6.41 2.88 -1.26 -3.15 113.62 116.89 2dlg n SER 30 Ca 0.04 -0.07 -0.06 0.00 -1.33 0.00 0.00 58.87 57.45 2dlg n SER 30 Cb 0.33 0.24 -0.08 0.00 -0.75 0.00 0.00 64.21 63.94 2dlg n SER 30 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 2dlg h SER 31 N 0.00 0.00 0.06 -3.46 0.02 -2.01 -3.23 113.55 104.92 2dlg h SER 31 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2dlg h SER 31 Cb 0.62 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.16 2dlg h SER 31 CO 0.00 0.95 -0.68 -0.90 -1.14 0.00 0.00 176.83 175.06 2dlg n ASP 32 N -3.41 1.38 -4.89 3.07 5.68 -1.25 -4.95 116.55 112.18 2dlg n ASP 32 Ca -0.00 -1.14 -0.29 0.00 -0.50 0.00 0.00 54.79 52.86 2dlg n ASP 32 Cb 0.90 0.65 -0.02 0.00 -1.14 0.00 0.00 41.12 41.51 2dlg n ASP 32 CO 0.00 0.00 0.00 -0.04 -1.33 0.00 0.00 177.20 175.83 2dlg s MET 33 N -2.74 3.66 -0.27 0.11 -1.94 -1.19 -4.24 119.30 112.69 2dlg s MET 33 Ca 0.14 0.27 -0.07 0.00 -1.71 0.00 0.00 55.69 54.32 2dlg s MET 33 Cb 0.17 -2.43 0.13 0.00 2.01 0.00 0.00 34.83 34.71 2dlg s MET 33 CO 0.70 -0.05 0.56 -1.12 -0.01 0.00 0.00 175.02 175.11 2dlg s SER 34 N -3.53 -0.87 -0.05 3.03 0.01 -1.25 -4.96 113.70 106.08 2dlg s SER 34 Ca 0.48 1.20 -0.00 0.00 1.31 0.00 0.00 55.95 58.95 2dlg s SER 34 Cb -0.10 1.96 -0.03 0.00 0.21 0.00 0.00 66.02 68.06 2dlg s SER 34 CO 0.36 -0.24 -0.01 0.00 0.41 0.00 0.00 173.24 173.76 2dlg s ALA 35 N 2.80 3.23 -0.06 1.44 0.00 -1.26 -3.49 121.76 124.42 2dlg s ALA 35 Ca 0.02 -0.88 -0.01 0.00 0.00 0.00 0.00 51.96 51.09 2dlg s ALA 35 Cb -0.13 -1.38 0.03 0.00 0.00 0.00 0.00 23.12 21.64 2dlg s ALA 35 CO -0.18 0.61 -0.00 -1.01 0.00 0.00 0.00 175.76 175.18 2dlg s HIS 36 N -0.95 0.61 -0.66 0.00 3.76 -1.12 -1.59 115.29 115.34 2dlg s HIS 36 Ca 0.15 -0.14 -0.22 0.00 -0.15 0.00 0.00 55.06 54.71 2dlg s HIS 36 Cb -0.11 -0.72 0.07 0.00 1.11 0.00 0.00 32.58 32.93 2dlg s HIS 36 CO 0.05 -0.28 0.96 0.08 -0.85 0.00 0.00 174.74 174.71 2dlg s VAL 37 N 1.69 4.34 -0.25 -0.90 1.01 -0.22 -2.81 120.40 123.26 2dlg s VAL 37 Ca 0.00 -0.40 -0.18 0.00 0.00 0.00 0.00 61.98 61.41 2dlg s VAL 37 Cb -0.13 -4.68 -0.03 0.00 0.00 0.00 0.00 36.38 31.54 2dlg s VAL 37 CO -0.04 -1.45 0.50 -0.89 0.00 0.00 0.00 175.10 173.22 2dlg s THR 38 N 4.01 5.09 0.53 3.92 2.01 -0.59 -1.93 115.64 128.68 2dlg s THR 38 Ca 0.22 0.86 -0.09 0.00 0.31 0.00 0.00 61.69 62.99 2dlg s THR 38 Cb -0.17 -3.82 -0.05 0.00 0.01 0.00 0.00 72.50 68.48 2dlg s THR 38 CO 0.10 0.12 0.90 -0.44 -0.69 0.00 0.00 174.62 174.61 2dlg s SER 39 N 1.45 6.32 0.08 3.53 0.01 0.85 -1.13 113.70 124.81 2dlg s SER 39 Ca 0.21 1.22 0.17 0.00 1.31 0.00 0.00 55.95 58.86 2dlg s SER 39 Cb -0.16 -2.37 0.72 0.00 0.21 0.00 0.00 66.02 64.42 2dlg s SER 39 CO 0.09 -0.68 1.53 -0.81 0.41 0.00 0.00 173.24 173.79 2dlg n PRO 40 N -2.27 0.06 0.08 12.44 -0.04 -1.23 -2.28 135.00 141.76 2dlg n PRO 40 Ca 0.04 0.31 0.03 0.00 -0.04 0.00 0.00 63.50 63.83 2dlg n PRO 40 Cb 0.54 -1.61 -0.03 0.00 -0.04 0.00 0.00 33.50 32.36 2dlg n PRO 40 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2dlg h SER 41 N 0.00 0.00 0.00 3.54 4.64 -1.92 -3.48 113.55 116.33 2dlg h SER 41 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2dlg h SER 41 Cb 0.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.37 2dlg h SER 41 CO 0.00 0.44 0.00 0.61 -0.87 0.00 0.00 176.83 177.01 2dlg n GLY 42 N 1.31 1.84 3.26 -0.77 0.00 -0.96 -5.12 105.19 104.75 2dlg n GLY 42 Ca -0.05 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.63 2dlg n GLY 42 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2dlg s ARG 43 N -0.01 3.21 0.04 1.61 3.52 -1.25 -4.92 118.95 121.14 2dlg s ARG 43 Ca 0.00 -0.73 0.08 0.00 -0.13 0.00 0.00 55.73 54.95 2dlg s ARG 43 Cb 0.00 -2.94 -0.03 0.00 -1.56 0.00 0.00 34.95 30.42 2dlg s ARG 43 CO 0.00 -0.24 -0.21 0.54 -0.81 0.00 0.00 175.30 174.58 2dlg s VAL 44 N 1.42 2.58 0.25 7.11 0.11 -1.26 -0.10 120.40 130.52 2dlg s VAL 44 Ca 0.05 -1.26 0.01 0.00 -2.93 0.00 0.00 61.98 57.85 2dlg s VAL 44 Cb -0.15 -2.07 -0.05 0.00 -1.53 0.00 0.00 36.38 32.59 2dlg s VAL 44 CO -0.05 0.34 0.12 0.42 -3.33 0.00 0.00 175.10 172.60 2dlg s THR 45 N -0.89 0.37 -0.14 5.04 -4.23 -0.81 -4.95 115.64 110.02 2dlg s THR 45 Ca 0.14 -2.00 -0.20 0.00 -1.18 0.00 0.00 61.69 58.45 2dlg s THR 45 Cb -0.10 -2.58 -0.04 0.00 1.34 0.00 0.00 72.50 71.12 2dlg s THR 45 CO 0.04 0.00 0.55 -0.70 -0.54 0.00 0.00 174.62 173.98 2dlg s GLU 46 N -4.03 4.30 0.53 3.99 2.12 -1.26 -1.05 118.70 123.30 2dlg s GLU 46 Ca 0.38 0.55 -0.04 0.00 0.36 0.00 0.00 54.97 56.22 2dlg s GLU 46 Cb 0.07 -3.49 -0.00 0.00 0.26 0.00 0.00 34.13 30.97 2dlg s GLU 46 CO 0.14 0.00 0.82 0.00 -0.54 0.00 0.00 175.26 175.68 2dlg s ALA 47 N 1.10 3.44 -0.16 6.30 0.00 -0.62 -4.90 121.76 126.92 2dlg s ALA 47 Ca 0.28 -0.75 -0.06 0.00 0.00 0.00 0.00 51.96 51.43 2dlg s ALA 47 Cb -0.16 -2.48 -0.04 0.00 0.00 0.00 0.00 23.12 20.44 2dlg s ALA 47 CO 0.11 -0.59 0.06 -2.00 0.00 0.00 0.00 175.76 173.34 2dlg s GLU 48 N -4.82 3.75 -0.26 0.00 2.12 -1.25 -4.70 118.70 113.53 2dlg s GLU 48 Ca 0.51 -0.33 -0.09 0.00 0.36 0.00 0.00 54.97 55.42 2dlg s GLU 48 Cb -0.10 -3.14 -0.04 0.00 0.26 0.00 0.00 34.13 31.11 2dlg s GLU 48 CO 0.43 0.41 0.14 0.42 -0.54 0.00 0.00 175.26 176.12 2dlg s ILE 49 N -0.02 4.91 -0.16 -3.70 1.01 -1.26 -2.46 121.20 119.51 2dlg s ILE 49 Ca 0.06 0.03 -0.02 0.00 0.00 0.00 0.00 60.65 60.72 2dlg s ILE 49 Cb -0.12 -3.32 -0.02 0.00 0.01 0.00 0.00 42.46 39.01 2dlg s ILE 49 CO 0.01 0.29 -0.08 -0.69 0.00 0.00 0.00 174.94 174.47 2dlg s VAL 50 N 1.65 3.41 -0.27 2.92 1.01 0.13 -4.89 120.40 124.35 2dlg s VAL 50 Ca 0.07 -0.52 -0.29 0.00 0.00 0.00 0.00 61.98 61.24 2dlg s VAL 50 Cb -0.15 -2.48 -0.02 0.00 0.00 0.00 0.00 36.38 33.72 2dlg s VAL 50 CO 0.08 0.49 1.65 -2.16 0.00 0.00 0.00 175.10 175.15 2dlg s PRO 51 N 0.61 3.64 -0.03 2.72 0.04 -1.26 0.35 135.00 141.07 2dlg s PRO 51 Ca -0.05 1.51 -0.01 0.00 0.04 0.00 0.00 61.00 62.49 2dlg s PRO 51 Cb -0.15 -4.08 -0.01 0.00 0.04 0.00 0.00 34.50 30.30 2dlg s PRO 51 CO 0.03 -1.49 0.10 0.52 0.04 0.00 0.00 177.00 176.20 2dlg h MET 52 N 11.35 -0.04 0.00 4.56 2.86 -1.76 -3.48 114.93 128.42 2dlg h MET 52 Ca -0.33 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.31 2dlg h MET 52 Cb 1.15 0.01 0.00 0.00 0.06 0.00 0.00 31.60 32.82 2dlg h MET 52 CO 1.02 -0.02 0.00 0.41 1.06 0.00 0.00 176.91 179.37 2dlg n GLY 53 N 1.66 0.43 3.55 8.32 0.00 -1.26 -4.97 105.19 112.93 2dlg n GLY 53 Ca -0.00 0.45 -0.14 0.00 0.00 0.00 0.00 46.02 46.33 2dlg n GLY 53 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2dlg n LYS 54 N 0.00 0.45 -3.00 1.61 4.01 -1.26 -3.30 118.16 116.68 2dlg n LYS 54 Ca 0.00 -0.91 -0.11 0.00 -0.51 0.00 0.00 58.31 56.77 2dlg n LYS 54 Cb 0.00 -3.54 -0.02 0.00 -0.51 0.00 0.00 35.03 30.97 2dlg n LYS 54 CO 0.00 0.00 0.00 0.09 -1.11 0.00 0.00 177.40 176.38 2dlg n ASN 55 N 17.96 -1.45 -4.92 4.39 4.13 -1.26 -4.70 115.26 129.41 2dlg n ASN 55 Ca 0.47 0.05 -0.28 0.00 1.68 0.00 0.00 54.58 56.51 2dlg n ASN 55 Cb 0.42 -1.34 -0.03 0.00 -1.54 0.00 0.00 39.78 37.29 2dlg n ASN 55 CO 0.00 0.00 0.00 -0.44 0.28 0.00 0.00 177.26 177.10 2dlg s SER 56 N -2.31 6.39 0.10 6.41 0.01 -1.21 -2.27 113.70 120.82 2dlg s SER 56 Ca 0.21 0.41 0.08 0.00 1.31 0.00 0.00 55.95 57.96 2dlg s SER 56 Cb -0.12 -2.02 -0.03 0.00 0.21 0.00 0.00 66.02 64.06 2dlg s SER 56 CO 0.25 -0.04 -0.19 -1.00 0.41 0.00 0.00 173.24 172.67 2dlg s HIS 57 N -1.86 1.67 -0.20 2.43 3.76 -0.71 -2.25 115.29 118.14 2dlg s HIS 57 Ca 0.39 -0.43 -0.02 0.00 -0.15 0.00 0.00 55.06 54.85 2dlg s HIS 57 Cb -0.11 -0.92 0.06 0.00 1.11 0.00 0.00 32.58 32.72 2dlg s HIS 57 CO 0.29 0.18 0.01 0.00 -0.85 0.00 0.00 174.74 174.37 2dlg s VAL 59 N 1.76 4.91 -0.16 0.00 1.01 -1.25 -0.70 120.40 125.98 2dlg s VAL 59 Ca -0.02 1.43 0.01 0.00 0.00 0.00 0.00 61.98 63.40 2dlg s VAL 59 Cb -0.17 -4.05 0.00 0.00 0.00 0.00 0.00 36.38 32.16 2dlg s VAL 59 CO -0.07 0.01 -0.17 -0.13 0.00 0.00 0.00 175.10 174.73 2dlg s ARG 60 N 2.42 3.14 0.22 2.72 0.52 -1.03 -2.19 118.95 124.75 2dlg s ARG 60 Ca 0.33 -0.78 -0.18 0.00 -0.52 0.00 0.00 55.73 54.57 2dlg s ARG 60 Cb -0.16 -2.59 0.03 0.00 0.52 0.00 0.00 34.95 32.75 2dlg s ARG 60 CO 0.09 -0.03 0.58 -0.59 0.02 0.00 0.00 175.30 175.38 2dlg s PHE 61 N 0.90 -0.13 -0.42 -0.53 -0.12 -1.20 -3.78 117.98 112.70 2dlg s PHE 61 Ca -0.04 -0.24 -0.07 0.00 -0.05 0.00 0.00 56.93 56.54 2dlg s PHE 61 Cb -0.15 0.47 0.10 0.00 -0.63 0.00 0.00 43.02 42.81 2dlg s PHE 61 CO -0.02 -1.01 0.25 0.08 -0.05 0.00 0.00 175.22 174.47 2dlg s VAL 62 N -3.89 3.85 1.23 -2.49 1.01 -1.26 -1.71 120.40 117.14 2dlg s VAL 62 Ca 0.10 -1.72 -0.21 0.00 0.00 0.00 0.00 61.98 60.16 2dlg s VAL 62 Cb -0.02 -3.48 0.31 0.00 0.00 0.00 0.00 36.38 33.18 2dlg s VAL 62 CO 0.00 -0.62 1.10 -0.81 0.00 0.00 0.00 175.10 174.77 2dlg n PRO 63 N 4.79 -3.15 -3.77 2.72 -0.04 -1.26 -4.93 135.00 129.36 2dlg n PRO 63 Ca -0.07 -1.75 -0.23 0.00 -0.04 0.00 0.00 63.50 61.40 2dlg n PRO 63 Cb 0.42 -1.64 -0.03 0.00 -0.04 0.00 0.00 33.50 32.21 2dlg n PRO 63 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 2dlg s GLN 64 N -5.49 2.38 0.18 0.54 -1.52 -1.26 -3.95 119.66 110.54 2dlg s GLN 64 Ca 0.71 -1.76 -0.25 0.00 -1.95 0.00 0.00 55.36 52.11 2dlg s GLN 64 Cb -0.07 -2.21 -0.08 0.00 -0.22 0.00 0.00 33.01 30.42 2dlg s GLN 64 CO 0.55 -0.33 0.79 -1.83 -0.25 0.00 0.00 175.29 174.21 2dlg s GLU 65 N -4.15 4.56 -1.50 2.91 1.03 -1.26 -4.05 118.70 116.25 2dlg s GLU 65 Ca 0.43 1.16 -0.03 0.00 0.03 0.00 0.00 54.97 56.56 2dlg s GLU 65 Cb -0.01 -3.21 0.03 0.00 -0.80 0.00 0.00 34.13 30.13 2dlg s GLU 65 CO 0.25 0.54 0.07 -1.33 -1.33 0.00 0.00 175.26 173.46 2dlg n MET 66 N 1.48 -0.92 -3.83 -4.83 2.81 -1.23 -4.91 117.12 105.69 2dlg n MET 66 Ca -0.05 0.09 -0.17 0.00 -1.81 0.00 0.00 57.70 55.76 2dlg n MET 66 Cb 0.49 -3.51 -0.17 0.00 -0.71 0.00 0.00 33.22 29.33 2dlg n MET 66 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 2dlg s GLY 67 N -4.17 0.21 -0.39 3.03 0.00 -1.25 -5.01 107.32 99.75 2dlg s GLY 67 Ca 0.10 0.19 -0.21 0.00 0.00 0.00 0.00 44.72 44.80 2dlg s GLY 67 CO 0.95 0.80 0.66 0.14 0.00 0.00 0.00 173.10 175.64 2dlg s VAL 68 N 1.29 4.85 0.56 1.40 1.01 -1.26 -3.06 120.40 125.19 2dlg s VAL 68 Ca -0.06 0.46 0.09 0.00 0.00 0.00 0.00 61.98 62.47 2dlg s VAL 68 Cb -0.13 -4.14 0.08 0.00 0.00 0.00 0.00 36.38 32.19 2dlg s VAL 68 CO -0.03 -0.43 0.74 -1.00 0.00 0.00 0.00 175.10 174.39 2dlg s HIS 69 N 2.80 1.52 -0.01 5.22 3.76 -1.08 -3.56 115.29 123.94 2dlg s HIS 69 Ca 0.25 -0.71 0.01 0.00 -0.15 0.00 0.00 55.06 54.45 2dlg s HIS 69 Cb -0.14 -2.19 0.01 0.00 1.11 0.00 0.00 32.58 31.36 2dlg s HIS 69 CO 0.17 -1.04 -0.02 0.99 -0.85 0.00 0.00 174.74 173.99 2dlg s THR 70 N -2.65 0.20 -0.35 1.30 2.01 -0.29 -2.83 115.64 113.03 2dlg s THR 70 Ca 0.59 -0.05 -0.09 0.00 0.31 0.00 0.00 61.69 62.45 2dlg s THR 70 Cb -0.06 -0.22 0.03 0.00 0.01 0.00 0.00 72.50 72.27 2dlg s THR 70 CO 0.37 0.09 0.15 -0.69 -0.69 0.00 0.00 174.62 173.85 2dlg s VAL 71 N 0.28 4.19 -0.41 3.82 1.01 0.15 -1.55 120.40 127.89 2dlg s VAL 71 Ca -0.03 -0.97 -0.14 0.00 0.00 0.00 0.00 61.98 60.84 2dlg s VAL 71 Cb -0.05 -3.35 0.03 0.00 0.00 0.00 0.00 36.38 33.01 2dlg s VAL 71 CO -0.01 -0.19 0.29 -0.44 0.00 0.00 0.00 175.10 174.75 2dlg s SER 72 N 1.48 6.01 -0.38 3.32 0.01 -1.12 0.41 113.70 123.44 2dlg s SER 72 Ca 0.00 -1.01 0.02 0.00 1.31 0.00 0.00 55.95 56.27 2dlg s SER 72 Cb -0.19 -2.13 0.11 0.00 0.21 0.00 0.00 66.02 64.02 2dlg s SER 72 CO 0.05 -0.47 0.12 -0.69 0.41 0.00 0.00 173.24 172.65 2dlg s VAL 73 N 1.64 2.64 0.19 3.43 1.01 -1.26 -2.81 120.40 125.24 2dlg s VAL 73 Ca 0.04 -2.31 0.04 0.00 0.00 0.00 0.00 61.98 59.75 2dlg s VAL 73 Cb -0.20 -2.89 -0.03 0.00 0.00 0.00 0.00 36.38 33.26 2dlg s VAL 73 CO 0.08 -0.64 0.26 -0.54 0.00 0.00 0.00 175.10 174.26 2dlg s LYS 74 N 0.91 3.26 -0.23 2.72 1.02 -1.23 -2.86 119.74 123.32 2dlg s LYS 74 Ca 0.10 -0.76 -0.02 0.00 0.02 0.00 0.00 55.97 55.32 2dlg s LYS 74 Cb -0.21 -2.83 0.07 0.00 -0.52 0.00 0.00 37.83 34.35 2dlg s LYS 74 CO -0.06 0.47 0.05 -0.47 -0.92 0.00 0.00 175.35 174.42 2dlg s TYR 75 N -1.86 1.29 -1.59 3.18 5.04 0.10 -3.76 117.35 119.75 2dlg s TYR 75 Ca 0.33 -1.18 0.00 0.00 -2.44 0.00 0.00 57.07 53.79 2dlg s TYR 75 Cb -0.10 -1.26 0.00 0.00 0.35 0.00 0.00 41.96 40.96 2dlg s TYR 75 CO 0.27 -0.71 0.00 0.54 -1.34 0.00 0.00 175.55 174.31 2dlg n ARG 76 N 4.97 -1.32 -1.45 4.97 1.74 -1.26 -2.72 116.66 121.59 2dlg n ARG 76 Ca -0.07 0.92 0.00 0.00 -0.77 0.00 0.00 57.85 57.93 2dlg n ARG 76 Cb 0.45 -5.31 0.00 0.00 -1.02 0.00 0.00 32.46 26.58 2dlg n ARG 76 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2dlg n GLY 77 N -0.97 0.98 3.35 -0.13 0.00 -1.26 -5.09 105.19 102.08 2dlg n GLY 77 Ca -0.19 -0.42 -0.09 0.00 0.00 0.00 0.00 46.02 45.32 2dlg n GLY 77 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2dlg s GLN 78 N -2.95 0.43 0.05 1.61 -2.07 -1.10 -5.14 119.66 110.50 2dlg s GLN 78 Ca 0.00 0.99 -0.31 0.00 -1.82 0.00 0.00 55.36 54.22 2dlg s GLN 78 Cb 0.00 0.19 -0.07 0.00 -1.09 0.00 0.00 33.01 32.04 2dlg s GLN 78 CO 0.00 -0.19 1.39 -1.01 -1.32 0.00 0.00 175.29 174.16 2dlg s HIS 79 N 1.96 3.03 0.91 9.60 3.76 -1.26 0.00 115.29 133.28 2dlg s HIS 79 Ca -0.07 0.89 -0.12 0.00 -0.15 0.00 0.00 55.06 55.61 2dlg s HIS 79 Cb -0.09 -3.66 0.13 0.00 1.11 0.00 0.00 32.58 30.07 2dlg s HIS 79 CO -0.14 -2.39 1.10 0.14 -0.85 0.00 0.00 174.74 172.59 2dlg s VAL 80 N 1.81 2.55 0.15 -0.90 -7.23 -1.13 -4.93 120.40 110.72 2dlg s VAL 80 Ca 0.64 0.18 -0.31 0.00 -1.81 0.00 0.00 61.98 60.68 2dlg s VAL 80 Cb -0.34 -2.71 -0.11 0.00 0.56 0.00 0.00 36.38 33.78 2dlg s VAL 80 CO 0.28 -0.23 1.80 -0.89 -0.31 0.00 0.00 175.10 175.75 2dlg s THR 81 N -2.99 2.36 0.00 5.32 2.01 -1.26 -2.11 115.64 118.97 2dlg s THR 81 Ca 0.63 0.03 0.00 0.00 0.31 0.00 0.00 61.69 62.66 2dlg s THR 81 Cb -0.17 -3.02 0.00 0.00 0.01 0.00 0.00 72.50 69.32 2dlg s THR 81 CO 0.56 0.00 0.00 0.61 -0.69 0.00 0.00 174.62 175.11 2dlg n GLY 82 N 4.16 2.75 3.79 4.40 0.00 -1.26 -5.03 105.19 114.01 2dlg n GLY 82 Ca 0.17 -0.73 -0.34 0.00 0.00 0.00 0.00 46.02 45.13 2dlg n GLY 82 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2dlg s SER 83 N 0.00 6.01 0.24 1.61 1.04 -0.90 -3.93 113.70 117.77 2dlg s SER 83 Ca 0.00 1.94 -0.30 0.00 0.48 0.00 0.00 55.95 58.07 2dlg s SER 83 Cb 0.00 -2.56 -0.09 0.00 0.10 0.00 0.00 66.02 63.47 2dlg s SER 83 CO 0.00 -1.01 1.27 -2.16 0.98 0.00 0.00 173.24 172.32 2dlg s PRO 84 N -3.54 4.42 -0.33 4.02 0.04 -1.26 -4.64 135.00 133.71 2dlg s PRO 84 Ca 0.67 2.05 -0.22 0.00 0.04 0.00 0.00 61.00 63.54 2dlg s PRO 84 Cb -0.18 -3.16 0.00 0.00 0.04 0.00 0.00 34.50 31.20 2dlg s PRO 84 CO 0.27 -0.16 0.72 -0.06 0.04 0.00 0.00 177.00 177.82 2dlg s PHE 85 N -0.41 3.17 -0.10 0.56 0.08 0.17 -4.79 117.98 116.65 2dlg s PHE 85 Ca 0.53 0.59 -0.08 0.00 0.12 0.00 0.00 56.93 58.08 2dlg s PHE 85 Cb -0.36 -3.21 -0.04 0.00 -0.57 0.00 0.00 43.02 38.83 2dlg s PHE 85 CO 0.42 -0.61 0.18 -1.14 -0.10 0.00 0.00 175.22 173.97 2dlg s GLN 86 N 2.88 3.50 -0.04 0.44 0.74 -1.26 0.30 119.66 126.22 2dlg s GLN 86 Ca 0.29 -0.07 -0.04 0.00 0.05 0.00 0.00 55.36 55.59 2dlg s GLN 86 Cb -0.14 -3.19 0.01 0.00 1.10 0.00 0.00 33.01 30.79 2dlg s GLN 86 CO 0.14 0.76 0.11 -0.59 -0.55 0.00 0.00 175.29 175.16 2dlg s PHE 87 N -1.05 -0.12 -0.20 1.67 -0.12 -1.13 -4.99 117.98 112.04 2dlg s PHE 87 Ca 0.17 0.29 -0.13 0.00 -0.05 0.00 0.00 56.93 57.20 2dlg s PHE 87 Cb -0.13 0.03 -0.05 0.00 -0.63 0.00 0.00 43.02 42.25 2dlg s PHE 87 CO 0.06 -0.06 0.26 0.99 -0.05 0.00 0.00 175.22 176.42 2dlg s THR 88 N 0.09 5.31 0.04 -4.49 2.01 -1.26 -2.64 115.64 114.70 2dlg s THR 88 Ca -0.00 0.43 -0.20 0.00 0.31 0.00 0.00 61.69 62.22 2dlg s THR 88 Cb -0.01 -3.60 -0.06 0.00 0.01 0.00 0.00 72.50 68.84 2dlg s THR 88 CO -0.00 0.34 0.58 -0.69 -0.69 0.00 0.00 174.62 174.17 2dlg s VAL 89 N 0.89 4.80 0.00 3.82 1.01 -1.17 -4.37 120.40 125.37 2dlg s VAL 89 Ca 0.13 1.24 0.00 0.00 0.00 0.00 0.00 61.98 63.35 2dlg s VAL 89 Cb -0.13 -3.92 0.00 0.00 0.00 0.00 0.00 36.38 32.33 2dlg s VAL 89 CO 0.04 0.50 0.00 0.61 0.00 0.00 0.00 175.10 176.25 2dlg n GLY 90 N 2.03 5.76 3.77 4.51 0.00 -1.25 -3.56 105.19 116.45 2dlg n GLY 90 Ca -0.09 -1.99 -0.38 0.00 0.00 0.00 0.00 46.02 43.56 2dlg n GLY 90 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dlg s PRO 91 N 1.78 4.01 0.56 1.61 0.04 -1.26 -3.58 135.00 138.17 2dlg s PRO 91 Ca 0.00 1.88 0.34 0.00 0.04 0.00 0.00 61.00 63.25 2dlg s PRO 91 Cb 0.00 -2.66 1.48 0.00 0.04 0.00 0.00 34.50 33.36 2dlg s PRO 91 CO 0.00 -0.36 1.78 1.37 0.04 0.00 0.00 177.00 179.83 2dlg h LEU 92 N 2.59 0.00 0.00 -3.56 8.10 -1.95 -3.40 115.31 117.08 2dlg h LEU 92 Ca -0.49 0.00 0.00 0.00 0.11 0.00 0.00 57.88 57.50 2dlg h LEU 92 Cb 1.24 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 41.46 2dlg h LEU 92 CO 0.62 0.00 0.00 0.61 -4.11 0.00 0.00 178.44 175.56 2dlg n GLY 93 N -1.71 2.62 2.79 0.17 0.00 -1.26 -4.79 105.19 103.01 2dlg n GLY 93 Ca 0.21 -0.50 -0.30 0.00 0.00 0.00 0.00 46.02 45.44 2dlg n GLY 93 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2dlg s GLU 94 N -1.22 1.27 -0.71 1.61 2.12 -1.26 -5.02 118.70 115.48 2dlg s GLU 94 Ca 0.00 -1.85 0.04 0.00 0.36 0.00 0.00 54.97 53.52 2dlg s GLU 94 Cb 0.00 -2.50 0.25 0.00 0.26 0.00 0.00 34.13 32.14 2dlg s GLU 94 CO 0.00 -1.08 0.81 0.41 -0.54 0.00 0.00 175.26 174.86 2dlg n GLY 95 N 3.88 4.76 0.00 -1.50 0.00 -1.26 -5.00 105.19 106.07 2dlg n GLY 95 Ca 0.05 -2.74 0.00 0.00 0.00 0.00 0.00 46.02 43.33 2dlg n GLY 95 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dlg n GLY 96 N 1.08 2.24 3.24 -0.02 0.00 -1.26 -5.16 105.19 105.30 2dlg n GLY 96 Ca 0.28 0.10 -0.31 0.00 0.00 0.00 0.00 46.02 46.09 2dlg n GLY 96 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2dlg s SER 97 N 0.00 2.95 0.00 1.61 1.04 -1.26 -4.83 113.70 113.21 2dlg s SER 97 Ca 0.00 -0.50 0.00 0.00 0.48 0.00 0.00 55.95 55.93 2dlg s SER 97 Cb 0.00 -0.96 0.00 0.00 0.10 0.00 0.00 66.02 65.16 2dlg s SER 97 CO 0.00 0.21 0.00 0.61 0.98 0.00 0.00 173.24 175.04 2dlg n GLY 98 N 3.13 0.90 0.06 7.32 0.00 -1.26 -5.04 105.19 110.30 2dlg n GLY 98 Ca -0.18 -0.65 -0.13 0.00 0.00 0.00 0.00 46.02 45.06 2dlg n GLY 98 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dlg h PRO 99 N 0.00 -0.01 -6.29 1.61 0.13 -1.93 -3.41 132.00 122.10 2dlg h PRO 99 Ca 0.00 0.00 -0.61 0.00 -0.87 0.00 0.00 66.00 64.52 2dlg h PRO 99 Cb 0.32 0.00 -0.10 0.00 0.13 0.00 0.00 31.00 31.35 2dlg h PRO 99 CO 0.00 0.47 -0.63 -1.12 -0.23 0.00 0.00 178.00 176.49 2dlg s SER 100 N -5.67 5.12 -1.24 1.44 0.01 -1.26 -4.58 113.70 107.51 2dlg s SER 100 Ca -0.16 -0.23 -0.07 0.00 1.31 0.00 0.00 55.95 56.81 2dlg s SER 100 Cb 0.02 -1.23 0.01 0.00 0.21 0.00 0.00 66.02 65.03 2dlg s SER 100 CO 0.67 0.11 1.08 -0.24 0.41 0.00 0.00 173.24 175.27 2dlg n SER 101 N 0.06 -5.24 0.00 2.44 2.88 -1.26 -5.23 113.62 107.27 2dlg n SER 101 Ca -0.09 -0.52 0.00 0.00 -1.33 0.00 0.00 58.87 56.92 2dlg n SER 101 Cb 0.54 -4.77 0.00 0.00 -0.75 0.00 0.00 64.21 59.22 2dlg n SER 101 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42