#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dvq h PRO 11 N 0.00 0.00 -3.71 0.00 0.13 -1.90 -3.44 132.00 123.09 1dvq h PRO 11 Ca 0.00 0.00 -0.45 0.00 -0.87 0.00 0.00 66.00 64.68 1dvq h PRO 11 Cb 0.00 0.00 -0.38 0.00 0.13 0.00 0.00 31.00 30.75 1dvq h PRO 11 CO 0.00 0.07 -0.77 -1.17 -0.23 0.00 0.00 178.00 175.90 1dvq s LEU 12 N -6.33 0.67 0.04 1.56 2.96 -1.26 0.80 118.68 117.12 1dvq s LEU 12 Ca 0.03 -0.17 0.04 0.00 -0.22 0.00 0.00 54.13 53.81 1dvq s LEU 12 Cb 0.08 -0.47 -0.02 0.00 0.50 0.00 0.00 46.19 46.28 1dvq s LEU 12 CO 0.60 -0.20 -0.13 -0.32 -1.32 0.00 0.00 176.35 174.98 1dvq s MET 13 N 1.95 0.86 -0.01 1.98 1.75 0.42 -4.39 119.30 121.86 1dvq s MET 13 Ca 0.04 -0.74 0.07 0.00 -1.25 0.00 0.00 55.69 53.81 1dvq s MET 13 Cb -0.13 -0.84 -0.02 0.00 2.84 0.00 0.00 34.83 36.68 1dvq s MET 13 CO -0.06 0.21 -0.21 0.08 -0.65 0.00 0.00 175.02 174.38 1dvq s VAL 14 N -0.89 1.69 -0.05 10.11 1.01 -1.03 -0.45 120.40 130.79 1dvq s VAL 14 Ca 0.00 -0.96 0.01 0.00 0.00 0.00 0.00 61.98 61.04 1dvq s VAL 14 Cb -0.08 -1.41 0.02 0.00 0.00 0.00 0.00 36.38 34.91 1dvq s VAL 14 CO 0.01 0.44 -0.05 -0.75 0.00 0.00 0.00 175.10 174.75 1dvq s LYS 15 N -0.60 0.89 -0.08 2.72 2.20 0.00 -1.02 119.74 123.84 1dvq s LYS 15 Ca 0.08 -0.12 0.03 0.00 -0.36 0.00 0.00 55.97 55.60 1dvq s LYS 15 Cb -0.08 -0.88 0.01 0.00 -1.51 0.00 0.00 37.83 35.36 1dvq s LYS 15 CO -0.00 -0.08 -0.17 0.08 -0.36 0.00 0.00 175.35 174.82 1dvq s VAL 16 N 0.92 1.52 0.17 4.02 1.01 0.31 -0.72 120.40 127.63 1dvq s VAL 16 Ca -0.11 -0.70 0.10 0.00 0.00 0.00 0.00 61.98 61.27 1dvq s VAL 16 Cb -0.14 -1.35 -0.04 0.00 0.00 0.00 0.00 36.38 34.85 1dvq s VAL 16 CO 0.00 0.44 -0.19 -0.76 0.00 0.00 0.00 175.10 174.59 1dvq s LEU 17 N 0.53 2.62 -0.31 3.92 1.43 -0.31 -0.54 118.68 126.01 1dvq s LEU 17 Ca -0.16 -0.72 -0.08 0.00 -1.03 0.00 0.00 54.13 52.13 1dvq s LEU 17 Cb -0.17 -1.37 0.01 0.00 0.03 0.00 0.00 46.19 44.69 1dvq s LEU 17 CO 0.06 0.13 0.11 -0.62 0.23 0.00 0.00 176.35 176.26 1dvq s ASP 18 N -2.57 5.30 0.00 2.29 -1.08 0.14 -0.84 116.67 119.92 1dvq s ASP 18 Ca 0.21 -0.76 0.29 0.00 -0.52 0.00 0.00 52.55 51.77 1dvq s ASP 18 Cb -0.09 -1.92 1.33 0.00 -1.46 0.00 0.00 42.92 40.79 1dvq s ASP 18 CO 0.11 -0.23 1.95 0.00 0.52 0.00 0.00 175.17 177.52 1dvq n ALA 19 N 4.90 2.52 0.01 3.66 0.00 -0.17 -1.49 120.51 129.94 1dvq n ALA 19 Ca -0.14 -0.15 -0.21 0.00 0.00 0.00 0.00 53.44 52.93 1dvq n ALA 19 Cb 0.48 -1.45 -0.14 0.00 0.00 0.00 0.00 19.45 18.34 1dvq n ALA 19 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1dvq n VAL 20 N -1.33 1.78 0.85 0.00 0.31 -1.26 -4.41 118.33 114.27 1dvq n VAL 20 Ca 0.11 -0.64 0.10 0.00 -0.01 0.00 0.00 64.34 63.90 1dvq n VAL 20 Cb 0.29 -1.75 -0.12 0.00 -0.91 0.00 0.00 33.84 31.35 1dvq n VAL 20 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 1dvq n ARG 21 N -3.51 0.32 -2.97 5.55 1.74 -1.25 -5.00 116.66 111.55 1dvq n ARG 21 Ca -0.32 -0.02 -0.12 0.00 -0.77 0.00 0.00 57.85 56.62 1dvq n ARG 21 Cb 1.04 -1.46 0.05 0.00 -1.02 0.00 0.00 32.46 31.07 1dvq n ARG 21 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1dvq n GLY 22 N 1.46 0.00 3.53 -0.13 0.00 -0.55 -5.03 105.19 104.47 1dvq n GLY 22 Ca 0.03 -0.13 -0.10 0.00 0.00 0.00 0.00 46.02 45.82 1dvq n GLY 22 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1dvq s SER 23 N -3.57 -0.03 0.55 1.61 1.04 -1.07 -5.00 113.70 107.23 1dvq s SER 23 Ca 0.13 -1.01 -0.19 0.00 0.48 0.00 0.00 55.95 55.36 1dvq s SER 23 Cb -0.06 0.56 -0.05 0.00 0.10 0.00 0.00 66.02 66.57 1dvq s SER 23 CO 0.43 -1.10 1.10 -2.16 0.98 0.00 0.00 173.24 172.49 1dvq s PRO 24 N -4.01 3.36 -0.54 4.02 0.04 -1.26 0.28 135.00 136.90 1dvq s PRO 24 Ca 0.25 1.49 -0.24 0.00 0.04 0.00 0.00 61.00 62.55 1dvq s PRO 24 Cb 0.00 -2.02 0.04 0.00 0.04 0.00 0.00 34.50 32.57 1dvq s PRO 24 CO 0.10 -0.82 0.90 0.00 0.04 0.00 0.00 177.00 177.22 1dvq s ALA 25 N -1.96 3.19 0.16 8.56 0.00 0.29 -4.61 121.76 127.40 1dvq s ALA 25 Ca 0.70 -1.26 -0.15 0.00 0.00 0.00 0.00 51.96 51.25 1dvq s ALA 25 Cb -0.21 -3.68 -0.07 0.00 0.00 0.00 0.00 23.12 19.15 1dvq s ALA 25 CO 0.28 -2.31 0.58 0.42 0.00 0.00 0.00 175.76 174.73 1dvq s ILE 26 N 3.79 4.80 -1.54 0.00 1.01 -1.26 -4.28 121.20 123.72 1dvq s ILE 26 Ca 0.29 0.92 -0.05 0.00 0.00 0.00 0.00 60.65 61.81 1dvq s ILE 26 Cb -0.13 -3.76 0.01 0.00 0.01 0.00 0.00 42.46 38.59 1dvq s ILE 26 CO 0.19 0.24 0.69 0.59 0.00 0.00 0.00 174.94 176.65 1dvq n ASN 27 N 0.81 -6.20 -4.72 3.58 3.02 -0.34 -4.94 115.26 106.48 1dvq n ASN 27 Ca -0.05 -0.32 -0.39 0.00 -0.03 0.00 0.00 54.58 53.80 1dvq n ASN 27 Cb 0.52 -4.98 -0.06 0.00 -0.61 0.00 0.00 39.78 34.65 1dvq n ASN 27 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1dvq s VAL 28 N -3.20 5.13 0.14 2.41 1.01 -1.26 -4.74 120.40 119.89 1dvq s VAL 28 Ca 0.34 1.13 -0.30 0.00 0.00 0.00 0.00 61.98 63.15 1dvq s VAL 28 Cb -0.15 -3.90 -0.07 0.00 0.00 0.00 0.00 36.38 32.26 1dvq s VAL 28 CO 0.42 0.29 1.06 0.00 0.00 0.00 0.00 175.10 176.87 1dvq s ALA 29 N 0.77 3.33 -0.06 5.51 0.00 -1.26 -1.39 121.76 128.65 1dvq s ALA 29 Ca 0.30 0.74 0.02 0.00 0.00 0.00 0.00 51.96 53.02 1dvq s ALA 29 Cb -0.16 -3.34 0.01 0.00 0.00 0.00 0.00 23.12 19.63 1dvq s ALA 29 CO 0.13 -0.18 -0.12 0.08 0.00 0.00 0.00 175.76 175.68 1dvq s VAL 30 N 0.01 1.08 -0.08 0.00 1.01 0.45 -1.21 120.40 121.65 1dvq s VAL 30 Ca 0.50 -0.45 0.04 0.00 0.00 0.00 0.00 61.98 62.07 1dvq s VAL 30 Cb -0.27 -0.99 -0.00 0.00 0.00 0.00 0.00 36.38 35.11 1dvq s VAL 30 CO 0.32 0.34 -0.22 -1.00 0.00 0.00 0.00 175.10 174.54 1dvq s HIS 31 N 0.66 2.34 -0.06 5.22 3.76 0.15 -1.22 115.29 126.13 1dvq s HIS 31 Ca -0.14 -0.88 0.02 0.00 -0.15 0.00 0.00 55.06 53.91 1dvq s HIS 31 Cb -0.15 -1.57 -0.03 0.00 1.11 0.00 0.00 32.58 31.94 1dvq s HIS 31 CO 0.03 -0.35 -0.11 0.08 -0.85 0.00 0.00 174.74 173.55 1dvq s VAL 32 N 0.26 3.32 0.11 -0.90 1.01 0.12 0.19 120.40 124.51 1dvq s VAL 32 Ca -0.14 -0.62 0.06 0.00 0.00 0.00 0.00 61.98 61.28 1dvq s VAL 32 Cb -0.16 -2.33 -0.03 0.00 0.00 0.00 0.00 36.38 33.85 1dvq s VAL 32 CO 0.07 0.59 -0.16 -0.36 0.00 0.00 0.00 175.10 175.23 1dvq s PHE 33 N -0.66 1.48 -0.05 5.22 0.40 0.57 -0.77 117.98 124.17 1dvq s PHE 33 Ca 0.10 -0.48 0.06 0.00 -0.60 0.00 0.00 56.93 56.00 1dvq s PHE 33 Cb -0.11 -0.79 -0.01 0.00 0.51 0.00 0.00 43.02 42.61 1dvq s PHE 33 CO 0.01 0.15 -0.23 0.50 0.70 0.00 0.00 175.22 176.35 1dvq s ARG 34 N -2.22 2.31 -0.07 0.44 3.52 -0.44 -0.64 118.95 121.85 1dvq s ARG 34 Ca 0.06 -0.84 -0.30 0.00 -0.13 0.00 0.00 55.73 54.52 1dvq s ARG 34 Cb -0.08 -2.00 -0.03 0.00 -1.56 0.00 0.00 34.95 31.29 1dvq s ARG 34 CO 0.03 0.37 1.24 0.21 -0.81 0.00 0.00 175.30 176.34 1dvq s LYS 35 N -0.18 4.32 0.75 5.12 2.20 -0.50 -1.21 119.74 130.25 1dvq s LYS 35 Ca -0.02 1.70 -0.07 0.00 -0.36 0.00 0.00 55.97 57.22 1dvq s LYS 35 Cb -0.13 -3.61 0.10 0.00 -1.51 0.00 0.00 37.83 32.68 1dvq s LYS 35 CO 0.03 -0.52 1.06 0.00 -0.36 0.00 0.00 175.35 175.56 1dvq s ALA 36 N 2.52 3.09 0.25 3.13 0.00 0.17 -4.73 121.76 126.20 1dvq s ALA 36 Ca 0.57 -1.12 -0.03 0.00 0.00 0.00 0.00 51.96 51.38 1dvq s ALA 36 Cb -0.25 -2.52 0.50 0.00 0.00 0.00 0.00 23.12 20.85 1dvq s ALA 36 CO 0.21 -1.53 1.71 0.00 0.00 0.00 0.00 175.76 176.15 1dvq h ALA 37 N -0.77 1.09 -0.10 0.00 0.00 -1.95 -1.02 119.26 116.50 1dvq h ALA 37 Ca -0.43 0.14 -0.04 0.00 0.00 0.00 0.00 54.91 54.57 1dvq h ALA 37 Cb 1.29 0.14 -0.03 0.00 0.00 0.00 0.00 17.79 19.20 1dvq h ALA 37 CO 0.53 -0.27 0.05 -0.40 0.00 0.00 0.00 179.25 179.17 1dvq n ASP 38 N -5.05 2.67 -3.03 0.00 5.75 -1.26 -4.82 116.55 110.82 1dvq n ASP 38 Ca 0.15 -2.16 -0.22 0.00 -0.01 0.00 0.00 54.79 52.55 1dvq n ASP 38 Cb 0.46 -0.53 0.02 0.00 -1.03 0.00 0.00 41.12 40.04 1dvq n ASP 38 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 1dvq n ASP 39 N 0.25 -5.47 -4.56 -1.12 8.00 -0.39 -4.99 116.55 108.27 1dvq n ASP 39 Ca 0.06 -0.27 -0.31 0.00 0.71 0.00 0.00 54.79 54.98 1dvq n ASP 39 Cb 0.56 -4.45 -0.10 0.00 -0.02 0.00 0.00 41.12 37.10 1dvq n ASP 39 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1dvq s THR 40 N -3.09 3.37 -0.46 -3.53 2.01 -1.25 -4.88 115.64 107.81 1dvq s THR 40 Ca 0.29 -1.08 -0.22 0.00 0.31 0.00 0.00 61.69 60.98 1dvq s THR 40 Cb -0.14 -2.51 0.03 0.00 0.01 0.00 0.00 72.50 69.89 1dvq s THR 40 CO 0.36 0.25 0.76 0.26 -0.69 0.00 0.00 174.62 175.55 1dvq s TRP 41 N -1.09 2.99 -0.12 4.92 0.52 -1.26 0.46 118.94 125.37 1dvq s TRP 41 Ca 0.19 0.06 -0.05 0.00 0.02 0.00 0.00 56.10 56.32 1dvq s TRP 41 Cb -0.11 -3.63 -0.04 0.00 -1.15 0.00 0.00 33.47 28.55 1dvq s TRP 41 CO 0.10 -1.00 0.07 -1.83 0.02 0.00 0.00 176.95 174.32 1dvq s GLU 42 N 3.21 3.35 0.24 4.98 -1.05 -0.35 -4.89 118.70 124.19 1dvq s GLU 42 Ca 0.28 -0.27 -0.30 0.00 -0.15 0.00 0.00 54.97 54.52 1dvq s GLU 42 Cb -0.13 -3.04 -0.14 0.00 -0.44 0.00 0.00 34.13 30.38 1dvq s GLU 42 CO 0.21 0.67 1.12 -2.30 0.95 0.00 0.00 175.26 175.91 1dvq n PRO 43 N 2.30 1.39 0.00 -4.83 -0.02 -1.26 -1.32 135.00 131.25 1dvq n PRO 43 Ca -0.19 0.49 0.00 0.00 -2.02 0.00 0.00 63.50 61.78 1dvq n PRO 43 Cb 0.54 -1.95 0.00 0.00 -0.02 0.00 0.00 33.50 32.07 1dvq n PRO 43 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 1dvq n PHE 44 N 0.90 0.00 -3.56 6.00 7.35 0.05 -4.75 117.46 123.46 1dvq n PHE 44 Ca 0.12 0.00 -0.06 0.00 -0.76 0.00 0.00 57.45 56.75 1dvq n PHE 44 Cb 0.29 0.01 -0.02 0.00 0.35 0.00 0.00 39.48 40.11 1dvq n PHE 44 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1dvq s ALA 45 N -1.83 -1.91 0.21 3.13 0.00 -1.07 -5.01 121.76 115.28 1dvq s ALA 45 Ca 0.00 1.12 -0.22 0.00 0.00 0.00 0.00 51.96 52.86 1dvq s ALA 45 Cb 0.00 0.26 0.05 0.00 0.00 0.00 0.00 23.12 23.43 1dvq s ALA 45 CO 0.00 -0.70 0.66 -1.54 0.00 0.00 0.00 175.76 174.17 1dvq s SER 46 N -2.44 -0.44 0.00 0.00 1.04 -1.26 0.10 113.70 110.70 1dvq s SER 46 Ca 0.07 -0.26 0.00 0.00 0.48 0.00 0.00 55.95 56.25 1dvq s SER 46 Cb -0.01 0.65 0.00 0.00 0.10 0.00 0.00 66.02 66.76 1dvq s SER 46 CO -0.06 -1.12 0.00 0.61 0.98 0.00 0.00 173.24 173.64 1dvq n GLY 47 N -0.41 -1.23 3.11 7.32 0.00 -0.36 -4.99 105.19 108.63 1dvq n GLY 47 Ca -0.11 -0.88 -0.21 0.00 0.00 0.00 0.00 46.02 44.81 1dvq n GLY 47 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1dvq s LYS 48 N -0.65 1.03 0.51 1.61 1.02 -1.26 -0.41 119.74 121.59 1dvq s LYS 48 Ca 0.00 -0.55 -0.22 0.00 0.02 0.00 0.00 55.97 55.22 1dvq s LYS 48 Cb 0.00 -1.01 -0.06 0.00 -0.52 0.00 0.00 37.83 36.24 1dvq s LYS 48 CO 0.00 0.27 1.24 0.95 -0.92 0.00 0.00 175.35 176.89 1dvq s THR 49 N -0.46 2.68 0.06 2.17 -4.23 -0.49 -4.78 115.64 110.59 1dvq s THR 49 Ca 0.04 0.49 -0.01 0.00 -1.18 0.00 0.00 61.69 61.04 1dvq s THR 49 Cb -0.06 -3.24 0.01 0.00 1.34 0.00 0.00 72.50 70.55 1dvq s THR 49 CO -0.00 -0.03 0.08 -1.54 -0.54 0.00 0.00 174.62 172.59 1dvq n SER 50 N -0.89 0.04 0.30 3.99 3.41 0.52 -1.20 113.62 119.79 1dvq n SER 50 Ca 0.10 -1.05 0.17 0.00 -0.26 0.00 0.00 58.87 57.83 1dvq n SER 50 Cb 0.47 -0.06 0.97 0.00 -0.26 0.00 0.00 64.21 65.34 1dvq n SER 50 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 1dvq h GLU 51 N 0.00 0.00 -0.28 4.33 4.39 -1.94 0.70 114.58 121.77 1dvq h GLU 51 Ca -0.03 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.67 1dvq h GLU 51 Cb 0.08 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.73 1dvq h GLU 51 CO 0.02 0.02 0.00 -1.13 -1.16 0.00 0.00 179.01 176.76 1dvq n SER 52 N -3.53 2.40 -0.34 1.42 3.41 -1.26 -4.79 113.62 110.92 1dvq n SER 52 Ca -0.03 -1.85 -0.04 0.00 -0.26 0.00 0.00 58.87 56.69 1dvq n SER 52 Cb 0.12 -0.18 -0.02 0.00 -0.26 0.00 0.00 64.21 63.86 1dvq n SER 52 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1dvq n GLY 53 N 1.27 0.71 3.64 5.00 0.00 0.24 -4.80 105.19 111.25 1dvq n GLY 53 Ca 0.17 -0.52 -0.26 0.00 0.00 0.00 0.00 46.02 45.41 1dvq n GLY 53 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1dvq s GLU 54 N -1.93 2.30 -0.19 1.61 2.02 -1.26 -0.53 118.70 120.72 1dvq s GLU 54 Ca 0.00 -1.19 -0.03 0.00 0.02 0.00 0.00 54.97 53.78 1dvq s GLU 54 Cb 0.00 -2.28 0.06 0.00 0.10 0.00 0.00 34.13 32.01 1dvq s GLU 54 CO 0.00 0.44 0.03 -1.17 0.02 0.00 0.00 175.26 174.58 1dvq s LEU 55 N -3.00 1.19 0.44 1.80 2.96 -0.19 -0.36 118.68 121.52 1dvq s LEU 55 Ca 0.27 -0.80 0.07 0.00 -0.22 0.00 0.00 54.13 53.45 1dvq s LEU 55 Cb -0.09 -0.60 -0.03 0.00 0.50 0.00 0.00 46.19 45.97 1dvq s LEU 55 CO 0.18 -0.30 0.25 -1.00 -1.32 0.00 0.00 176.35 174.16 1dvq s HIS 56 N 1.85 2.39 -1.45 5.38 3.76 -1.26 -2.48 115.29 123.49 1dvq s HIS 56 Ca -0.01 -0.64 -0.00 0.00 -0.15 0.00 0.00 55.06 54.26 1dvq s HIS 56 Cb -0.17 -1.97 0.00 0.00 1.11 0.00 0.00 32.58 31.55 1dvq s HIS 56 CO -0.08 0.01 0.06 0.41 -0.85 0.00 0.00 174.74 174.29 1dvq n GLY 57 N -1.40 -0.34 0.24 -2.22 0.00 -1.26 -4.91 105.19 95.31 1dvq n GLY 57 Ca -0.01 -0.15 -0.10 0.00 0.00 0.00 0.00 46.02 45.76 1dvq n GLY 57 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1dvq h LEU 58 N -0.13 0.75 0.00 0.99 3.38 -1.86 -3.48 115.31 114.96 1dvq h LEU 58 Ca -0.41 -0.35 -0.13 0.00 0.09 0.00 0.00 57.88 57.08 1dvq h LEU 58 Cb 1.30 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.82 1dvq h LEU 58 CO 0.48 1.07 0.07 1.07 0.09 0.00 0.00 178.44 181.22 1dvq n THR 59 N -4.03 0.00 -4.49 0.22 5.66 -1.26 -4.79 114.28 105.59 1dvq n THR 59 Ca -0.02 -1.22 -0.24 0.00 -3.05 0.00 0.00 64.05 59.51 1dvq n THR 59 Cb 0.54 0.93 -0.10 0.00 -1.55 0.00 0.00 70.33 70.16 1dvq n THR 59 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 1dvq s THR 60 N -2.47 2.37 0.41 1.09 -4.23 -1.26 -4.57 115.64 106.97 1dvq s THR 60 Ca 0.20 -2.34 0.24 0.00 -1.18 0.00 0.00 61.69 58.61 1dvq s THR 60 Cb -0.03 -2.40 0.25 0.00 1.34 0.00 0.00 72.50 71.67 1dvq s THR 60 CO 0.14 -0.35 2.03 1.05 -0.54 0.00 0.00 174.62 176.96 1dvq h GLU 61 N 2.21 0.00 -0.39 3.99 4.11 -1.99 0.09 114.58 122.59 1dvq h GLU 61 Ca -0.41 0.00 -0.09 0.00 0.07 0.00 0.00 59.36 58.94 1dvq h GLU 61 Cb 1.26 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.49 1dvq h GLU 61 CO 0.63 0.15 -0.10 1.49 0.07 0.00 0.00 179.01 181.26 1dvq h GLU 62 N 0.00 0.76 0.02 1.06 4.57 -2.04 -3.24 114.58 115.71 1dvq h GLU 62 Ca -0.00 -0.29 -0.23 0.00 -1.18 0.00 0.00 59.36 57.65 1dvq h GLU 62 Cb 0.37 -0.04 -0.03 0.00 -0.16 0.00 0.00 28.75 28.89 1dvq h GLU 62 CO 0.02 0.90 -1.15 0.37 -1.18 0.00 0.00 179.01 177.97 1dvq h GLN 63 N 0.57 0.04 -4.93 1.92 4.15 -1.85 -3.41 115.11 111.61 1dvq h GLN 63 Ca 0.10 -0.07 -0.68 0.00 0.77 0.00 0.00 58.65 58.77 1dvq h GLN 63 Cb 0.62 0.03 -0.05 0.00 0.21 0.00 0.00 27.48 28.28 1dvq h GLN 63 CO 0.04 0.95 2.59 0.34 -1.93 0.00 0.00 178.83 180.82 1dvq n PHE 64 N -3.33 3.94 -2.27 3.99 7.35 -0.03 -4.96 117.46 122.15 1dvq n PHE 64 Ca -0.04 -2.80 -0.26 0.00 -0.76 0.00 0.00 57.45 53.59 1dvq n PHE 64 Cb 0.97 -2.56 0.10 0.00 0.35 0.00 0.00 39.48 38.34 1dvq n PHE 64 CO 0.00 0.00 0.00 0.14 -0.76 0.00 0.00 176.76 176.14 1dvq s VAL 65 N 4.09 2.21 0.46 -2.13 -7.23 -1.26 -4.92 120.40 111.61 1dvq s VAL 65 Ca 0.52 -0.32 -0.25 0.00 -1.81 0.00 0.00 61.98 60.11 1dvq s VAL 65 Cb 0.09 -2.88 -0.08 0.00 0.56 0.00 0.00 36.38 34.06 1dvq s VAL 65 CO 0.01 0.00 1.39 -0.62 -0.31 0.00 0.00 175.10 175.56 1dvq n GLU 66 N -3.04 2.11 -3.88 4.82 1.02 -1.26 -4.88 120.64 115.54 1dvq n GLU 66 Ca 0.11 0.75 0.00 0.00 -0.02 0.00 0.00 57.16 58.01 1dvq n GLU 66 Cb 0.60 -2.57 0.00 0.00 -0.02 0.00 0.00 31.44 29.45 1dvq n GLU 66 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1dvq n GLY 67 N 0.66 -2.69 3.64 0.62 0.00 -1.22 -4.99 105.19 101.21 1dvq n GLY 67 Ca 0.06 -1.29 -0.36 0.00 0.00 0.00 0.00 46.02 44.44 1dvq n GLY 67 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1dvq s ILE 68 N -2.03 5.11 0.15 -0.61 1.01 -1.26 -0.69 121.20 122.88 1dvq s ILE 68 Ca 0.00 0.09 0.11 0.00 0.00 0.00 0.00 60.65 60.85 1dvq s ILE 68 Cb 0.00 -3.36 -0.04 0.00 0.01 0.00 0.00 42.46 39.07 1dvq s ILE 68 CO 0.00 0.39 -0.25 -0.31 0.00 0.00 0.00 174.94 174.77 1dvq s TYR 69 N 0.83 2.34 -0.12 3.97 1.51 0.84 -1.41 117.35 125.30 1dvq s TYR 69 Ca 0.06 -0.36 0.01 0.00 -1.01 0.00 0.00 57.07 55.78 1dvq s TYR 69 Cb -0.13 -1.23 0.02 0.00 -0.11 0.00 0.00 41.96 40.51 1dvq s TYR 69 CO 0.02 0.40 -0.14 0.21 -1.11 0.00 0.00 175.55 174.93 1dvq s LYS 70 N -2.29 2.18 -0.25 -0.62 2.20 0.18 -1.19 119.74 119.95 1dvq s LYS 70 Ca 0.17 -0.53 -0.08 0.00 -0.36 0.00 0.00 55.97 55.17 1dvq s LYS 70 Cb -0.09 -1.94 -0.04 0.00 -1.51 0.00 0.00 37.83 34.25 1dvq s LYS 70 CO 0.08 -0.15 0.10 0.08 -0.36 0.00 0.00 175.35 175.10 1dvq s VAL 71 N 1.25 4.63 -0.21 4.02 1.01 0.99 -0.32 120.40 131.77 1dvq s VAL 71 Ca -0.01 -0.07 -0.03 0.00 0.00 0.00 0.00 61.98 61.87 1dvq s VAL 71 Cb -0.14 -3.17 -0.01 0.00 0.00 0.00 0.00 36.38 33.07 1dvq s VAL 71 CO -0.06 0.33 -0.06 -0.70 0.00 0.00 0.00 175.10 174.60 1dvq s GLU 72 N 1.53 3.35 -0.28 2.72 2.12 0.13 -0.96 118.70 127.31 1dvq s GLU 72 Ca 0.06 -0.64 -0.07 0.00 0.36 0.00 0.00 54.97 54.67 1dvq s GLU 72 Cb -0.15 -2.94 -0.00 0.00 0.26 0.00 0.00 34.13 31.30 1dvq s GLU 72 CO 0.05 -0.15 0.08 0.42 -0.54 0.00 0.00 175.26 175.13 1dvq s ILE 73 N 1.33 4.12 -1.17 -3.70 1.01 0.00 -0.67 121.20 122.13 1dvq s ILE 73 Ca 0.04 -0.52 -0.20 0.00 0.00 0.00 0.00 60.65 59.97 1dvq s ILE 73 Cb -0.14 -3.07 -0.04 0.00 0.01 0.00 0.00 42.46 39.22 1dvq s ILE 73 CO -0.03 0.15 1.94 -0.67 0.00 0.00 0.00 174.94 176.32 1dvq n ASP 74 N 4.90 3.61 -0.02 3.58 2.03 -0.35 -1.54 116.55 128.76 1dvq n ASP 74 Ca -0.15 -2.78 -0.07 0.00 0.52 0.00 0.00 54.79 52.31 1dvq n ASP 74 Cb 0.49 -1.58 0.12 0.00 -0.72 0.00 0.00 41.12 39.43 1dvq n ASP 74 CO 0.00 0.00 0.00 0.71 -1.92 0.00 0.00 177.20 175.99 1dvq h THR 75 N 5.17 1.29 -0.02 5.18 1.35 -1.87 -3.24 112.91 120.77 1dvq h THR 75 Ca 0.40 -1.47 0.03 0.00 -0.55 0.00 0.00 66.41 64.82 1dvq h THR 75 Cb 0.80 1.46 -0.04 0.00 -1.73 0.00 0.00 68.15 68.63 1dvq h THR 75 CO 1.60 0.47 -0.19 0.50 -0.25 0.00 0.00 175.52 177.64 1dvq h LYS 76 N 0.49 -0.29 -0.96 4.72 3.64 -1.71 -1.87 116.57 120.59 1dvq h LYS 76 Ca 0.05 0.02 0.06 0.00 -1.27 0.00 0.00 60.65 59.51 1dvq h LYS 76 Cb 0.83 0.07 -0.06 0.00 -0.41 0.00 0.00 32.23 32.65 1dvq h LYS 76 CO 0.07 -0.19 0.61 0.77 -2.27 0.00 0.00 179.45 178.44 1dvq h SER 77 N -0.30 0.99 -0.17 4.20 0.02 -1.86 -1.69 113.55 114.74 1dvq h SER 77 Ca 0.06 0.01 0.02 0.00 -0.84 0.00 0.00 61.79 61.04 1dvq h SER 77 Cb 0.39 -0.20 -0.02 0.00 0.14 0.00 0.00 62.40 62.70 1dvq h SER 77 CO -0.20 0.64 0.03 0.22 -1.14 0.00 0.00 176.83 176.39 1dvq h TYR 78 N 1.13 0.05 -0.39 3.45 3.20 -1.43 -1.61 116.97 121.38 1dvq h TYR 78 Ca 0.41 0.01 -0.14 0.00 3.14 0.00 0.00 58.73 62.14 1dvq h TYR 78 Cb 0.13 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 38.40 1dvq h TYR 78 CO -0.01 0.02 -0.33 -1.49 -1.64 0.00 0.00 178.16 174.71 1dvq h TRP 79 N 0.10 1.04 -0.32 -3.82 4.06 -1.04 -3.03 115.95 112.94 1dvq h TRP 79 Ca 0.08 -0.29 -0.05 0.00 2.06 0.00 0.00 58.89 60.69 1dvq h TRP 79 Cb 0.07 -0.23 -0.02 0.00 -1.00 0.00 0.00 29.16 27.99 1dvq h TRP 79 CO -0.13 1.09 -0.01 0.87 -3.56 0.00 0.00 178.44 176.69 1dvq h LYS 80 N 0.74 0.50 0.00 0.49 1.57 -1.17 -0.49 116.57 118.21 1dvq h LYS 80 Ca 0.07 -0.11 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 1dvq h LYS 80 Cb 0.90 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 33.14 1dvq h LYS 80 CO 0.08 0.54 0.00 0.00 -0.57 0.00 0.00 179.45 179.50 1dvq n ALA 81 N -2.48 1.58 0.17 3.86 0.00 -0.62 -1.56 120.51 121.47 1dvq n ALA 81 Ca 0.01 -0.04 0.06 0.00 0.00 0.00 0.00 53.44 53.47 1dvq n ALA 81 Cb 0.25 -1.21 0.11 0.00 0.00 0.00 0.00 19.45 18.60 1dvq n ALA 81 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1dvq n LEU 82 N -1.51 2.51 -0.19 0.00 4.77 -0.29 -4.98 117.00 117.32 1dvq n LEU 82 Ca 0.03 -1.48 -0.02 0.00 -0.03 0.00 0.00 56.01 54.50 1dvq n LEU 82 Cb 0.15 -0.12 -0.01 0.00 -2.33 0.00 0.00 43.42 41.11 1dvq n LEU 82 CO 0.12 0.56 -0.02 0.61 -1.33 0.00 0.00 177.39 177.33 1dvq n GLY 83 N 0.66 0.47 3.38 -0.72 0.00 -0.60 -5.05 105.19 103.34 1dvq n GLY 83 Ca 0.10 -0.93 -0.32 0.00 0.00 0.00 0.00 46.02 44.87 1dvq n GLY 83 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1dvq s ILE 84 N -2.09 2.48 -0.38 -0.61 1.01 -0.62 -5.02 121.20 115.97 1dvq s ILE 84 Ca 0.00 -0.96 -0.21 0.00 0.00 0.00 0.00 60.65 59.48 1dvq s ILE 84 Cb 0.00 -1.92 0.01 0.00 0.01 0.00 0.00 42.46 40.56 1dvq s ILE 84 CO 0.00 0.58 0.66 -0.94 0.00 0.00 0.00 174.94 175.23 1dvq s SER 85 N -0.69 6.41 0.54 3.58 1.04 -1.26 -3.35 113.70 119.97 1dvq s SER 85 Ca 0.11 0.02 -0.04 0.00 0.48 0.00 0.00 55.95 56.52 1dvq s SER 85 Cb -0.10 -2.33 0.00 0.00 0.10 0.00 0.00 66.02 63.68 1dvq s SER 85 CO -0.00 -0.67 0.83 -2.16 0.98 0.00 0.00 173.24 172.22 1dvq s PRO 86 N 2.81 3.03 -0.19 4.02 0.04 -1.26 -4.90 135.00 138.55 1dvq s PRO 86 Ca 0.25 -0.09 -0.21 0.00 0.04 0.00 0.00 61.00 60.99 1dvq s PRO 86 Cb -0.14 -2.35 -0.21 0.00 0.04 0.00 0.00 34.50 31.84 1dvq s PRO 86 CO 0.17 -0.54 0.32 0.35 0.04 0.00 0.00 177.00 177.34 1dvq h PHE 87 N 0.01 0.07 -3.91 0.56 3.57 -1.47 -3.48 116.94 112.28 1dvq h PHE 87 Ca -0.46 -0.05 -0.46 0.00 3.53 0.00 0.00 57.97 60.53 1dvq h PHE 87 Cb 1.25 -0.00 -0.02 0.00 2.79 0.00 0.00 35.95 39.97 1dvq h PHE 87 CO 0.48 1.46 0.33 -1.01 -2.23 0.00 0.00 178.31 177.34 1dvq s HIS 88 N -2.37 3.59 0.16 0.41 3.76 -1.26 -4.96 115.29 114.62 1dvq s HIS 88 Ca -0.26 1.72 -0.07 0.00 -0.15 0.00 0.00 55.06 56.29 1dvq s HIS 88 Cb 0.05 -2.89 0.02 0.00 1.11 0.00 0.00 32.58 30.87 1dvq s HIS 88 CO 0.63 0.14 1.45 0.93 -0.85 0.00 0.00 174.74 177.04 1dvq h GLU 89 N 2.87 0.69 -1.76 1.40 4.39 -1.97 -3.36 114.58 116.83 1dvq h GLU 89 Ca -0.47 -0.45 0.28 0.00 0.34 0.00 0.00 59.36 59.06 1dvq h GLU 89 Cb 1.19 0.06 -0.10 0.00 -0.10 0.00 0.00 28.75 29.79 1dvq h GLU 89 CO 0.64 1.07 0.74 -3.38 -1.16 0.00 0.00 179.01 176.92 1dvq s HIS 90 N -4.02 -0.05 -0.12 4.33 -3.43 -1.26 -3.56 115.29 107.18 1dvq s HIS 90 Ca -0.09 -0.12 -0.03 0.00 -0.80 0.00 0.00 55.06 54.02 1dvq s HIS 90 Cb 0.11 0.58 -0.03 0.00 -1.43 0.00 0.00 32.58 31.80 1dvq s HIS 90 CO 0.86 -0.44 0.00 0.00 -2.00 0.00 0.00 174.74 173.17 1dvq s ALA 91 N -2.59 3.24 -0.03 -1.38 0.00 -0.59 -4.91 121.76 115.50 1dvq s ALA 91 Ca 0.15 -0.79 0.06 0.00 0.00 0.00 0.00 51.96 51.38 1dvq s ALA 91 Cb 0.03 -1.59 -0.01 0.00 0.00 0.00 0.00 23.12 21.55 1dvq s ALA 91 CO -0.02 0.42 -0.22 -1.21 0.00 0.00 0.00 175.76 174.73 1dvq s GLU 92 N -0.34 2.01 -0.16 0.00 2.02 -1.26 -0.81 118.70 120.15 1dvq s GLU 92 Ca 0.07 -0.80 -0.00 0.00 0.02 0.00 0.00 54.97 54.26 1dvq s GLU 92 Cb -0.12 -1.83 0.04 0.00 0.10 0.00 0.00 34.13 32.31 1dvq s GLU 92 CO 0.02 0.42 -0.08 0.08 0.02 0.00 0.00 175.26 175.72 1dvq s VAL 93 N -0.34 1.27 -0.16 2.63 1.01 -0.13 -4.98 120.40 119.70 1dvq s VAL 93 Ca 0.03 -0.67 -0.00 0.00 0.00 0.00 0.00 61.98 61.34 1dvq s VAL 93 Cb -0.10 -1.37 -0.00 0.00 0.00 0.00 0.00 36.38 34.90 1dvq s VAL 93 CO 0.01 0.21 -0.14 -0.69 0.00 0.00 0.00 175.10 174.48 1dvq s VAL 94 N 1.57 2.69 0.14 2.92 1.01 -1.26 -0.01 120.40 127.47 1dvq s VAL 94 Ca 0.01 -0.75 -0.13 0.00 0.00 0.00 0.00 61.98 61.11 1dvq s VAL 94 Cb -0.15 -2.15 0.01 0.00 0.00 0.00 0.00 36.38 34.10 1dvq s VAL 94 CO -0.08 0.51 0.35 0.72 0.00 0.00 0.00 175.10 176.60 1dvq s PHE 95 N 0.93 0.04 -0.22 5.22 -0.71 -0.33 -4.99 117.98 117.91 1dvq s PHE 95 Ca -0.03 -0.40 -0.11 0.00 -1.04 0.00 0.00 56.93 55.34 1dvq s PHE 95 Cb -0.15 0.14 -0.05 0.00 -1.21 0.00 0.00 43.02 41.75 1dvq s PHE 95 CO -0.02 -0.72 0.19 0.99 -1.34 0.00 0.00 175.22 174.32 1dvq s THR 96 N -3.87 5.35 -0.46 -4.49 2.01 -1.26 -0.11 115.64 112.80 1dvq s THR 96 Ca 0.08 0.26 -0.26 0.00 0.31 0.00 0.00 61.69 62.08 1dvq s THR 96 Cb 0.02 -3.53 0.03 0.00 0.01 0.00 0.00 72.50 69.03 1dvq s THR 96 CO -0.07 0.36 0.98 0.00 -0.69 0.00 0.00 174.62 175.20 1dvq s ALA 97 N 0.91 3.22 -0.01 7.40 0.00 0.13 -4.93 121.76 128.48 1dvq s ALA 97 Ca 0.09 -0.71 -0.23 0.00 0.00 0.00 0.00 51.96 51.12 1dvq s ALA 97 Cb -0.13 -3.71 -0.14 0.00 0.00 0.00 0.00 23.12 19.14 1dvq s ALA 97 CO 0.03 -2.11 1.03 -0.97 0.00 0.00 0.00 175.76 173.75 1dvq h ASN 98 N 9.11 -0.47 -2.86 0.00 -0.73 -1.95 -3.24 115.58 115.44 1dvq h ASN 98 Ca -0.24 -0.11 -0.11 0.00 1.87 0.00 0.00 56.30 57.71 1dvq h ASN 98 Cb 1.07 0.12 0.05 0.00 0.27 0.00 0.00 38.32 39.83 1dvq h ASN 98 CO 1.05 -0.07 -0.23 -0.67 -0.37 0.00 0.00 177.43 177.15 1dvq n ASP 99 N -5.18 -2.61 -4.09 1.15 4.64 -1.26 -4.85 116.55 104.35 1dvq n ASP 99 Ca -0.09 -0.18 -0.36 0.00 -1.38 0.00 0.00 54.79 52.77 1dvq n ASP 99 Cb 0.29 -1.93 -0.08 0.00 -1.04 0.00 0.00 41.12 38.36 1dvq n ASP 99 CO 0.00 0.00 0.00 -0.94 -0.82 0.00 0.00 177.20 175.44 1dvq s SER 100 N -3.28 5.60 0.00 1.67 1.04 -1.26 -5.00 113.70 112.47 1dvq s SER 100 Ca 0.08 -3.33 0.00 0.00 0.48 0.00 0.00 55.95 53.18 1dvq s SER 100 Cb -0.04 -1.88 0.00 0.00 0.10 0.00 0.00 66.02 64.21 1dvq s SER 100 CO 0.23 -0.27 0.00 0.61 0.98 0.00 0.00 173.24 174.79 1dvq n GLY 101 N 2.85 -0.03 3.65 7.32 0.00 -1.26 -4.87 105.19 112.85 1dvq n GLY 101 Ca 0.15 -1.85 -0.42 0.00 0.00 0.00 0.00 46.02 43.90 1dvq n GLY 101 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1dvq n PRO 102 N 0.03 2.71 -3.72 1.61 -0.02 -1.26 -4.97 135.00 129.38 1dvq n PRO 102 Ca 0.00 0.96 -0.12 0.00 -2.02 0.00 0.00 63.50 62.32 1dvq n PRO 102 Cb 0.00 -3.05 -0.13 0.00 -0.02 0.00 0.00 33.50 30.30 1dvq n PRO 102 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1dvq s ARG 103 N 4.79 0.21 -0.08 -0.52 0.52 -1.26 -4.91 118.95 117.71 1dvq s ARG 103 Ca 0.91 0.55 0.02 0.00 -0.52 0.00 0.00 55.73 56.68 1dvq s ARG 103 Cb -0.42 -0.12 -0.02 0.00 0.52 0.00 0.00 34.95 34.91 1dvq s ARG 103 CO 0.41 -0.17 -0.11 1.03 0.02 0.00 0.00 175.30 176.48 1dvq s ARG 104 N 1.30 2.83 -0.19 3.54 1.81 0.03 -4.87 118.95 123.39 1dvq s ARG 104 Ca -0.09 -0.64 -0.06 0.00 -1.72 0.00 0.00 55.73 53.23 1dvq s ARG 104 Cb -0.10 -2.53 -0.03 0.00 -0.45 0.00 0.00 34.95 31.84 1dvq s ARG 104 CO -0.09 0.53 0.02 0.71 -0.68 0.00 0.00 175.30 175.79 1dvq s TYR 105 N -0.47 3.09 -0.20 -0.53 1.51 0.24 -2.60 117.35 118.39 1dvq s TYR 105 Ca 0.06 -0.29 -0.00 0.00 -1.01 0.00 0.00 57.07 55.83 1dvq s TYR 105 Cb -0.12 -2.08 0.02 0.00 -0.11 0.00 0.00 41.96 39.67 1dvq s TYR 105 CO 0.02 -0.12 -0.14 0.99 -1.11 0.00 0.00 175.55 175.19 1dvq s THR 106 N 0.81 2.46 -0.31 -0.71 2.01 -0.58 -0.44 115.64 118.88 1dvq s THR 106 Ca 0.01 -0.89 -0.10 0.00 0.31 0.00 0.00 61.69 61.03 1dvq s THR 106 Cb -0.14 -2.11 -0.01 0.00 0.01 0.00 0.00 72.50 70.25 1dvq s THR 106 CO 0.02 0.44 0.16 -0.63 -0.69 0.00 0.00 174.62 173.92 1dvq s ILE 107 N 1.33 4.61 -0.08 1.82 -1.09 0.40 -1.07 121.20 127.12 1dvq s ILE 107 Ca 0.04 -0.44 -0.01 0.00 -2.23 0.00 0.00 60.65 58.02 1dvq s ILE 107 Cb -0.14 -3.36 -0.03 0.00 -1.58 0.00 0.00 42.46 37.34 1dvq s ILE 107 CO -0.09 0.05 -0.03 0.00 -1.23 0.00 0.00 174.94 173.64 1dvq s ALA 108 N 1.61 3.17 -0.02 9.38 0.00 0.20 -0.82 121.76 135.28 1dvq s ALA 108 Ca 0.04 -0.84 0.03 0.00 0.00 0.00 0.00 51.96 51.19 1dvq s ALA 108 Cb -0.17 -1.38 -0.00 0.00 0.00 0.00 0.00 23.12 21.57 1dvq s ALA 108 CO 0.06 0.58 -0.09 0.00 0.00 0.00 0.00 175.76 176.31 1dvq s ALA 109 N -0.86 0.84 -0.21 0.00 0.00 0.10 -0.49 121.76 121.15 1dvq s ALA 109 Ca 0.13 -0.37 -0.01 0.00 0.00 0.00 0.00 51.96 51.71 1dvq s ALA 109 Cb -0.11 -0.27 0.01 0.00 0.00 0.00 0.00 23.12 22.75 1dvq s ALA 109 CO 0.02 0.17 -0.11 -1.17 0.00 0.00 0.00 175.76 174.66 1dvq s LEU 110 N 0.01 2.59 -0.11 0.00 2.96 0.25 -1.16 118.68 123.22 1dvq s LEU 110 Ca -0.00 -0.56 -0.03 0.00 -0.22 0.00 0.00 54.13 53.31 1dvq s LEU 110 Cb -0.06 -1.62 -0.03 0.00 0.50 0.00 0.00 46.19 44.98 1dvq s LEU 110 CO 0.00 -0.02 0.02 -0.76 -1.32 0.00 0.00 176.35 174.27 1dvq s LEU 111 N 1.38 3.68 0.07 -0.68 1.43 -0.02 -2.01 118.68 122.54 1dvq s LEU 111 Ca 0.05 0.15 0.01 0.00 -1.03 0.00 0.00 54.13 53.31 1dvq s LEU 111 Cb -0.14 -1.87 -0.04 0.00 0.03 0.00 0.00 46.19 44.18 1dvq s LEU 111 CO -0.08 0.34 -0.06 -0.44 0.23 0.00 0.00 176.35 176.34 1dvq s SER 112 N -0.61 0.91 0.26 2.29 0.01 0.15 -1.00 113.70 115.71 1dvq s SER 112 Ca 0.10 -0.87 -0.02 0.00 1.31 0.00 0.00 55.95 56.48 1dvq s SER 112 Cb -0.12 0.10 0.51 0.00 0.21 0.00 0.00 66.02 66.72 1dvq s SER 112 CO 0.02 -0.42 1.76 -0.65 0.41 0.00 0.00 173.24 174.37 1dvq h PRO 113 N 3.46 0.61 -0.17 12.44 0.11 -1.99 -2.86 132.00 143.60 1dvq h PRO 113 Ca -0.35 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 65.72 1dvq h PRO 113 Cb 1.17 -0.14 -0.00 0.00 0.11 0.00 0.00 31.00 32.14 1dvq h PRO 113 CO 0.58 0.40 -0.01 0.66 -0.21 0.00 0.00 178.00 179.42 1dvq n TYR 114 N -4.87 0.62 -3.50 0.65 4.02 -1.26 -1.11 117.16 111.71 1dvq n TYR 114 Ca 0.16 -0.95 -0.12 0.00 -0.01 0.00 0.00 57.90 56.98 1dvq n TYR 114 Cb 0.41 -0.26 -0.04 0.00 -0.02 0.00 0.00 39.34 39.43 1dvq n TYR 114 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 176.86 176.30 1dvq s SER 115 N -2.29 -0.50 0.02 7.72 0.15 -1.08 -4.98 113.70 112.74 1dvq s SER 115 Ca 0.39 0.26 -0.27 0.00 0.70 0.00 0.00 55.95 57.03 1dvq s SER 115 Cb 0.32 0.47 0.06 0.00 -1.71 0.00 0.00 66.02 65.17 1dvq s SER 115 CO 0.06 -0.66 0.61 -0.72 1.20 0.00 0.00 173.24 173.73 1dvq s TYR 116 N -2.43 -0.56 0.04 3.44 -0.85 -1.26 -0.67 117.35 115.06 1dvq s TYR 116 Ca -0.01 0.78 0.05 0.00 -0.52 0.00 0.00 57.07 57.36 1dvq s TYR 116 Cb -0.01 0.41 -0.02 0.00 0.38 0.00 0.00 41.96 42.73 1dvq s TYR 116 CO -0.03 -0.66 -0.13 -1.54 -1.52 0.00 0.00 175.55 171.67 1dvq s SER 117 N -1.70 1.56 0.00 -0.18 1.04 -0.85 -4.98 113.70 108.60 1dvq s SER 117 Ca -0.07 -0.48 0.02 0.00 0.48 0.00 0.00 55.95 55.90 1dvq s SER 117 Cb -0.01 -0.08 -0.01 0.00 0.10 0.00 0.00 66.02 66.02 1dvq s SER 117 CO 0.02 -0.00 -0.08 0.28 0.98 0.00 0.00 173.24 174.44 1dvq s THR 118 N -0.93 0.62 0.04 2.02 -1.32 -1.26 -0.59 115.64 114.22 1dvq s THR 118 Ca 0.00 -0.46 0.03 0.00 -1.21 0.00 0.00 61.69 60.05 1dvq s THR 118 Cb -0.08 -0.54 -0.02 0.00 -1.51 0.00 0.00 72.50 70.34 1dvq s THR 118 CO 0.01 0.09 -0.08 -0.89 -2.21 0.00 0.00 174.62 171.54 1dvq s THR 119 N -0.37 0.62 -0.14 5.08 2.01 0.36 -4.98 115.64 118.22 1dvq s THR 119 Ca 0.01 -0.94 0.00 0.00 0.31 0.00 0.00 61.69 61.07 1dvq s THR 119 Cb -0.04 -0.64 -0.01 0.00 0.01 0.00 0.00 72.50 71.82 1dvq s THR 119 CO -0.00 -0.25 -0.15 0.00 -0.69 0.00 0.00 174.62 173.54 1dvq s ALA 120 N -1.10 2.53 -0.26 7.40 0.00 -1.26 -0.63 121.76 128.43 1dvq s ALA 120 Ca -0.06 -0.97 -0.05 0.00 0.00 0.00 0.00 51.96 50.87 1dvq s ALA 120 Cb -0.08 -1.20 0.00 0.00 0.00 0.00 0.00 23.12 21.84 1dvq s ALA 120 CO 0.01 0.11 0.03 0.08 0.00 0.00 0.00 175.76 175.99 1dvq s VAL 121 N 0.58 3.71 -0.32 0.00 1.01 -0.23 -4.98 120.40 120.17 1dvq s VAL 121 Ca -0.09 -0.61 -0.03 0.00 0.00 0.00 0.00 61.98 61.25 1dvq s VAL 121 Cb -0.16 -2.83 0.05 0.00 0.00 0.00 0.00 36.38 33.44 1dvq s VAL 121 CO 0.03 0.22 0.04 -0.69 0.00 0.00 0.00 175.10 174.71 1dvq s VAL 122 N 1.49 3.26 0.00 2.92 1.01 -1.26 -1.53 120.40 126.29 1dvq s VAL 122 Ca 0.04 -1.34 0.00 0.00 0.00 0.00 0.00 61.98 60.68 1dvq s VAL 122 Cb -0.16 -2.88 0.00 0.00 0.00 0.00 0.00 36.38 33.34 1dvq s VAL 122 CO 0.00 -0.16 0.43 0.35 0.00 0.00 0.00 175.10 175.72