#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qov h GLN 2 N 0.00 0.00 -2.59 0.03 1.08 -1.85 0.40 115.11 112.18 2qov h GLN 2 Ca 0.00 0.00 0.24 0.00 -1.45 0.00 0.00 58.65 57.44 2qov h GLN 2 Cb 0.00 0.00 -0.10 0.00 -0.05 0.00 0.00 27.48 27.33 2qov h GLN 2 CO 0.00 0.91 -0.66 1.33 -0.95 0.00 0.00 178.83 179.46 2qov n VAL 3 N -4.57 -0.19 -4.66 -0.54 0.24 -1.25 -2.21 118.33 105.16 2qov n VAL 3 Ca -0.16 0.41 -0.33 0.00 -2.04 0.00 0.00 64.34 62.22 2qov n VAL 3 Cb 0.51 -0.73 -0.12 0.00 -1.47 0.00 0.00 33.84 32.03 2qov n VAL 3 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 2qov s ILE 4 N -3.61 3.53 -1.24 1.34 1.09 0.15 -3.18 121.20 119.28 2qov s ILE 4 Ca 0.00 -0.60 -0.10 0.00 -1.10 0.00 0.00 60.65 58.85 2qov s ILE 4 Cb 0.00 -2.45 0.18 0.00 -1.06 0.00 0.00 42.46 39.13 2qov s ILE 4 CO 0.00 0.56 1.69 0.18 -0.10 0.00 0.00 174.94 177.27 2qov n LEU 5 N 2.11 6.17 -0.75 2.97 4.77 0.37 -3.03 117.00 129.61 2qov n LEU 5 Ca -0.17 -4.64 0.00 0.00 -0.03 0.00 0.00 56.01 51.16 2qov n LEU 5 Cb 0.53 -1.51 0.00 0.00 -2.33 0.00 0.00 43.42 40.11 2qov n LEU 5 CO 0.27 1.20 0.12 0.18 -1.33 0.00 0.00 177.39 177.83 2qov n LEU 6 N 4.18 0.64 0.00 2.23 4.32 -1.25 0.59 117.00 127.72 2qov n LEU 6 Ca 0.37 -0.32 0.00 0.00 -0.02 0.00 0.00 56.01 56.04 2qov n LEU 6 Cb 0.38 -0.16 0.00 0.00 -1.62 0.00 0.00 43.42 42.02 2qov n LEU 6 CO 0.74 0.12 0.00 -0.67 -1.22 0.00 0.00 177.39 176.36 2qov n ASP 7 N 0.59 0.00 0.01 -1.43 2.03 -1.26 -4.63 116.55 111.86 2qov n ASP 7 Ca 0.00 0.00 -0.02 0.00 0.52 0.00 0.00 54.79 55.29 2qov n ASP 7 Cb 0.12 0.00 -0.01 0.00 -0.72 0.00 0.00 41.12 40.51 2qov n ASP 7 CO 0.00 0.00 0.00 1.17 -1.92 0.00 0.00 177.20 176.45 2qov n LYS 8 N 0.00 0.11 -4.10 -0.67 4.81 -1.26 -0.71 118.16 116.35 2qov n LYS 8 Ca 0.00 0.05 -0.36 0.00 -0.87 0.00 0.00 58.31 57.12 2qov n LYS 8 Cb 0.00 -0.70 -0.02 0.00 0.02 0.00 0.00 35.03 34.33 2qov n LYS 8 CO 0.00 0.00 0.00 0.28 1.17 0.00 0.00 177.40 178.85 2qov n VAL 9 N -3.65 -2.56 0.00 3.15 0.31 -1.26 -1.69 118.33 112.62 2qov n VAL 9 Ca -0.04 -0.60 0.00 0.00 -0.01 0.00 0.00 64.34 63.69 2qov n VAL 9 Cb 0.17 -2.15 0.00 0.00 -0.91 0.00 0.00 33.84 30.94 2qov n VAL 9 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2qov n ALA 10 N -4.70 0.00 0.15 3.52 0.00 -1.26 -2.95 120.51 115.27 2qov n ALA 10 Ca -0.22 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.22 2qov n ALA 10 Cb 0.63 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.08 2qov n ALA 10 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2qov n ASN 11 N 4.29 1.42 -2.73 0.00 4.13 -1.26 -4.07 115.26 117.04 2qov n ASN 11 Ca 0.00 -1.03 -0.01 0.00 1.68 0.00 0.00 54.58 55.22 2qov n ASN 11 Cb 0.00 -0.27 0.02 0.00 -1.54 0.00 0.00 39.78 37.99 2qov n ASN 11 CO 0.00 0.00 0.00 -1.48 0.28 0.00 0.00 177.26 176.06 2qov s LEU 12 N 0.00 -0.34 0.02 3.41 2.34 -1.15 -5.17 118.68 117.78 2qov s LEU 12 Ca 0.00 -0.28 -0.27 0.00 0.06 0.00 0.00 54.13 53.64 2qov s LEU 12 Cb 0.00 0.44 0.07 0.00 -0.56 0.00 0.00 46.19 46.13 2qov s LEU 12 CO 0.00 -0.03 0.62 -0.83 -1.06 0.00 0.00 176.35 175.05 2qov s GLY 13 N 1.50 -0.55 0.00 -3.48 0.00 -0.68 -4.25 107.32 99.86 2qov s GLY 13 Ca 0.19 0.96 0.00 0.00 0.00 0.00 0.00 44.72 45.86 2qov s GLY 13 CO -0.13 0.62 0.00 1.44 0.00 0.00 0.00 173.10 175.04 2qov n SER 14 N 0.52 -0.00 -3.58 1.64 7.64 0.11 -4.87 113.62 115.08 2qov n SER 14 Ca -0.18 -0.01 -0.24 0.00 1.01 0.00 0.00 58.87 59.44 2qov n SER 14 Cb 0.59 0.00 0.01 0.00 -1.01 0.00 0.00 64.21 63.80 2qov n SER 14 CO 0.00 0.00 0.00 -0.11 -3.01 0.00 0.00 175.04 171.92 2qov n LEU 15 N 0.00 -1.68 0.00 -3.43 -0.00 0.20 -4.23 117.00 107.86 2qov n LEU 15 Ca -0.00 -0.75 0.00 0.00 -0.00 0.00 0.00 56.01 55.26 2qov n LEU 15 Cb 0.18 -1.41 0.00 0.00 -0.00 0.00 0.00 43.42 42.19 2qov n LEU 15 CO -0.00 0.31 0.00 0.61 -0.00 0.00 0.00 177.39 178.31 2qov n GLY 16 N -1.28 0.69 3.05 -3.96 0.00 0.13 -4.84 105.19 98.98 2qov n GLY 16 Ca -0.25 -0.36 -0.27 0.00 0.00 0.00 0.00 46.02 45.14 2qov n GLY 16 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2qov s ASP 17 N -0.92 2.20 -0.43 1.61 2.15 -1.24 -4.78 116.67 115.26 2qov s ASP 17 Ca 0.00 -0.38 -0.18 0.00 0.43 0.00 0.00 52.55 52.42 2qov s ASP 17 Cb 0.00 -0.99 0.02 0.00 -0.30 0.00 0.00 42.92 41.65 2qov s ASP 17 CO 0.00 0.04 0.51 -1.58 -0.17 0.00 0.00 175.17 173.96 2qov s GLN 18 N 0.79 3.15 -0.02 4.34 0.74 -1.25 0.14 119.66 127.55 2qov s GLN 18 Ca -0.11 -0.65 0.00 0.00 0.05 0.00 0.00 55.36 54.65 2qov s GLN 18 Cb -0.16 -3.97 0.02 0.00 1.10 0.00 0.00 33.01 30.01 2qov s GLN 18 CO 0.02 -0.92 0.01 0.14 -0.55 0.00 0.00 175.29 173.99 2qov s VAL 19 N 2.37 0.04 0.27 1.34 -7.23 -0.94 -5.00 120.40 111.25 2qov s VAL 19 Ca 0.15 0.11 -0.30 0.00 -1.81 0.00 0.00 61.98 60.13 2qov s VAL 19 Cb -0.16 -0.13 -0.11 0.00 0.56 0.00 0.00 36.38 36.54 2qov s VAL 19 CO 0.15 0.08 1.60 0.21 -0.31 0.00 0.00 175.10 176.84 2qov s ASN 20 N 0.74 6.40 -0.21 4.85 3.84 -1.26 -4.41 114.94 124.90 2qov s ASN 20 Ca -0.07 2.90 -0.20 0.00 0.21 0.00 0.00 52.86 55.71 2qov s ASN 20 Cb -0.09 -2.63 0.05 0.00 -0.55 0.00 0.00 41.25 38.03 2qov s ASN 20 CO -0.02 -0.91 0.56 0.54 -2.79 0.00 0.00 177.10 174.49 2qov s VAL 21 N 0.24 0.00 0.13 -5.21 0.11 0.13 -4.98 120.40 110.82 2qov s VAL 21 Ca 0.65 -0.00 -0.35 0.00 -2.93 0.00 0.00 61.98 59.35 2qov s VAL 21 Cb -0.48 -0.79 -0.16 0.00 -1.53 0.00 0.00 36.38 33.43 2qov s VAL 21 CO 0.44 -0.00 1.40 0.29 -3.33 0.00 0.00 175.10 173.90 2qov n LYS 22 N 2.74 1.52 0.25 1.54 4.76 -1.26 -3.89 118.16 123.81 2qov n LYS 22 Ca -0.14 0.55 0.09 0.00 -2.87 0.00 0.00 58.31 55.94 2qov n LYS 22 Cb 0.56 -2.21 0.48 0.00 -1.84 0.00 0.00 35.03 32.02 2qov n LYS 22 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2qov h ALA 23 N 4.85 1.34 -0.13 7.82 0.00 -1.90 0.13 119.26 131.35 2qov h ALA 23 Ca -0.46 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.41 2qov h ALA 23 Cb 1.31 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.09 2qov h ALA 23 CO 0.80 -0.34 -0.05 0.78 0.00 0.00 0.00 179.25 180.44 2qov h GLY 24 N 0.00 0.30 2.00 0.00 0.00 -1.91 -2.49 103.07 100.96 2qov h GLY 24 Ca 0.00 -0.26 -0.03 0.00 0.00 0.00 0.00 47.33 47.04 2qov h GLY 24 CO 0.00 0.24 -0.14 -1.82 0.00 0.00 0.00 176.54 174.81 2qov h TYR 25 N -0.06 0.00 -3.76 5.60 3.20 -1.09 -3.39 116.97 117.47 2qov h TYR 25 Ca 0.03 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.90 2qov h TYR 25 Cb 0.50 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.77 2qov h TYR 25 CO 0.06 0.14 0.00 0.00 -1.64 0.00 0.00 178.16 176.72 2qov n ALA 26 N -2.50 0.00 -2.90 1.82 0.00 -0.94 0.15 120.51 116.14 2qov n ALA 26 Ca -0.03 0.00 -0.15 0.00 0.00 0.00 0.00 53.44 53.26 2qov n ALA 26 Cb 0.21 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.63 2qov n ALA 26 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2qov n ARG 27 N -0.85 -0.92 0.00 0.00 5.12 -1.21 -3.63 116.66 115.17 2qov n ARG 27 Ca 0.00 0.05 0.00 0.00 -1.93 0.00 0.00 57.85 55.97 2qov n ARG 27 Cb 0.00 -1.68 0.00 0.00 -1.16 0.00 0.00 32.46 29.62 2qov n ARG 27 CO 0.00 0.00 0.00 0.09 -1.93 0.00 0.00 177.63 175.79 2qov n ASN 28 N -0.66 0.00 0.00 0.55 5.03 -1.26 -4.93 115.26 113.99 2qov n ASN 28 Ca -0.02 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.43 2qov n ASN 28 Cb 0.21 0.00 0.00 0.00 -1.02 0.00 0.00 39.78 38.97 2qov n ASN 28 CO 0.00 0.00 0.00 0.33 -1.83 0.00 0.00 177.26 175.76 2qov n PHE 29 N 0.00 -0.12 -0.22 3.10 7.35 -1.22 -4.93 117.46 121.43 2qov n PHE 29 Ca 0.00 0.00 0.04 0.00 -0.76 0.00 0.00 57.45 56.73 2qov n PHE 29 Cb 0.00 0.02 0.09 0.00 0.35 0.00 0.00 39.48 39.94 2qov n PHE 29 CO 0.00 0.00 0.00 1.28 -0.76 0.00 0.00 176.76 177.28 2qov n LEU 30 N -0.92 -0.21 0.00 -2.13 4.77 0.39 -3.16 117.00 115.74 2qov n LEU 30 Ca 0.00 1.04 0.00 0.00 -0.03 0.00 0.00 56.01 57.02 2qov n LEU 30 Cb 0.00 -0.32 0.00 0.00 -2.33 0.00 0.00 43.42 40.77 2qov n LEU 30 CO 0.00 -1.00 0.00 0.52 -1.33 0.00 0.00 177.39 175.58 2qov n VAL 31 N -4.97 0.00 -0.64 4.08 0.31 -1.26 -0.84 118.33 115.01 2qov n VAL 31 Ca 0.10 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.43 2qov n VAL 31 Cb 0.31 -0.19 0.00 0.00 -0.91 0.00 0.00 33.84 33.06 2qov n VAL 31 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 2qov n PRO 32 N -0.36 0.00 0.00 5.55 -0.02 -1.19 0.14 135.00 139.12 2qov n PRO 32 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 2qov n PRO 32 Cb 0.00 -0.64 0.00 0.00 -0.02 0.00 0.00 33.50 32.84 2qov n PRO 32 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 2qov n GLN 33 N 2.64 0.00 0.00 -0.52 6.02 -1.26 -4.69 117.38 119.57 2qov n GLN 33 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 2qov n GLN 33 Cb 0.26 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.52 2qov n GLN 33 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2qov n GLY 34 N 0.00 2.69 0.00 1.08 0.00 0.37 -4.95 105.19 104.38 2qov n GLY 34 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2qov n GLY 34 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2qov n LYS 35 N -0.79 0.00 -3.64 1.61 4.76 -1.09 -4.64 118.16 114.37 2qov n LYS 35 Ca 0.00 0.18 -0.06 0.00 -2.87 0.00 0.00 58.31 55.56 2qov n LYS 35 Cb 0.00 -1.57 -0.02 0.00 -1.84 0.00 0.00 35.03 31.61 2qov n LYS 35 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2qov s ALA 36 N -2.22 -1.73 -0.23 7.82 0.00 -0.02 -3.79 121.76 121.59 2qov s ALA 36 Ca 0.00 0.51 -0.11 0.00 0.00 0.00 0.00 51.96 52.35 2qov s ALA 36 Cb 0.00 0.55 0.08 0.00 0.00 0.00 0.00 23.12 23.75 2qov s ALA 36 CO 0.00 -0.89 0.54 0.54 0.00 0.00 0.00 175.76 175.95 2qov s VAL 37 N -3.22 -0.20 0.40 0.00 0.11 -1.17 -4.46 120.40 111.86 2qov s VAL 37 Ca 0.09 0.06 -0.23 0.00 -2.93 0.00 0.00 61.98 58.97 2qov s VAL 37 Cb -0.01 -0.80 -0.13 0.00 -1.53 0.00 0.00 36.38 33.91 2qov s VAL 37 CO -0.03 0.02 0.49 -2.65 -3.33 0.00 0.00 175.10 169.60 2qov n PRO 38 N 4.56 0.47 -1.49 1.54 -0.02 -1.26 0.30 135.00 139.10 2qov n PRO 38 Ca -0.19 0.17 -0.38 0.00 -2.02 0.00 0.00 63.50 61.08 2qov n PRO 38 Cb 0.55 -1.40 -0.03 0.00 -0.02 0.00 0.00 33.50 32.60 2qov n PRO 38 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2qov n ALA 39 N -0.80 7.32 0.39 3.55 0.00 -1.26 -4.72 120.51 125.00 2qov n ALA 39 Ca 0.12 -3.62 0.00 0.00 0.00 0.00 0.00 53.44 49.94 2qov n ALA 39 Cb 0.38 -3.16 0.00 0.00 0.00 0.00 0.00 19.45 16.67 2qov n ALA 39 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2qov n THR 40 N 3.00 0.71 0.00 0.00 -2.24 -1.26 -4.82 114.28 109.67 2qov n THR 40 Ca 0.73 -0.06 0.00 0.00 -2.27 0.00 0.00 64.05 62.45 2qov n THR 40 Cb 0.26 -0.90 0.00 0.00 -2.10 0.00 0.00 70.33 67.59 2qov n THR 40 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2qov n LYS 41 N 0.93 0.00 0.04 -0.78 4.01 -1.26 -4.16 118.16 116.94 2qov n LYS 41 Ca 0.00 0.00 0.02 0.00 -0.51 0.00 0.00 58.31 57.82 2qov n LYS 41 Cb 0.29 0.00 0.11 0.00 -0.51 0.00 0.00 35.03 34.92 2qov n LYS 41 CO 0.00 0.00 0.00 1.63 -1.11 0.00 0.00 177.40 177.92 2qov n LYS 42 N 0.00 0.03 0.00 1.97 5.02 -1.26 0.19 118.16 124.10 2qov n LYS 42 Ca 0.00 0.42 0.09 0.00 -2.02 0.00 0.00 58.31 56.80 2qov n LYS 42 Cb 0.00 -1.74 -0.10 0.00 -0.02 0.00 0.00 35.03 33.17 2qov n LYS 42 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2qov n ASN 43 N -1.55 0.99 0.00 4.39 3.02 -1.26 -4.02 115.26 116.83 2qov n ASN 43 Ca -0.00 -0.99 0.00 0.00 -0.03 0.00 0.00 54.58 53.55 2qov n ASN 43 Cb 0.16 0.96 0.00 0.00 -0.61 0.00 0.00 39.78 40.29 2qov n ASN 43 CO 0.00 0.00 0.00 -0.38 -2.62 0.00 0.00 177.26 174.26 2qov n ILE 44 N -1.36 0.00 0.21 2.41 5.41 0.50 -4.31 119.36 122.21 2qov n ILE 44 Ca 0.04 0.00 0.03 0.00 1.00 0.00 0.00 62.75 63.82 2qov n ILE 44 Cb 0.31 -0.94 0.12 0.00 -0.71 0.00 0.00 39.64 38.42 2qov n ILE 44 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 176.55 177.76 2qov n GLU 45 N -2.37 0.01 -0.06 0.38 4.07 0.27 0.22 120.64 123.16 2qov n GLU 45 Ca 0.00 0.37 0.02 0.00 -0.06 0.00 0.00 57.16 57.49 2qov n GLU 45 Cb 0.00 -1.50 0.05 0.00 -0.06 0.00 0.00 31.44 29.93 2qov n GLU 45 CO 0.00 0.00 0.00 0.34 -0.06 0.00 0.00 177.13 177.41 2qov n PHE 46 N -1.46 0.16 -0.59 4.31 -0.00 -1.10 -4.44 117.46 114.34 2qov n PHE 46 Ca 0.02 -0.48 0.00 0.00 -0.00 0.00 0.00 57.45 56.98 2qov n PHE 46 Cb 0.06 -0.04 0.00 0.00 -0.00 0.00 0.00 39.48 39.50 2qov n PHE 46 CO 0.00 0.00 0.00 1.19 -0.00 0.00 0.00 176.76 177.95 2qov n PHE 47 N -0.12 0.00 -0.21 -5.13 0.99 0.13 -4.79 117.46 108.33 2qov n PHE 47 Ca 0.04 -0.18 0.01 0.00 -0.00 0.00 0.00 57.45 57.32 2qov n PHE 47 Cb 0.31 -0.02 0.12 0.00 -1.00 0.00 0.00 39.48 38.89 2qov n PHE 47 CO 0.00 0.00 0.00 1.05 -0.00 0.00 0.00 176.76 177.81 2qov h GLU 48 N 0.00 0.39 0.00 -1.08 9.09 -0.97 0.68 114.58 122.70 2qov h GLU 48 Ca 0.00 -0.02 0.00 0.00 0.05 0.00 0.00 59.36 59.39 2qov h GLU 48 Cb 0.74 -0.09 0.00 0.00 -1.65 0.00 0.00 28.75 27.75 2qov h GLU 48 CO 0.00 0.26 -0.45 0.00 0.05 0.00 0.00 179.01 178.87 2qov n ALA 49 N -2.49 2.79 0.07 1.06 0.00 -1.26 -3.40 120.51 117.27 2qov n ALA 49 Ca 0.10 -0.20 0.01 0.00 0.00 0.00 0.00 53.44 53.35 2qov n ALA 49 Cb 0.30 -1.25 0.04 0.00 0.00 0.00 0.00 19.45 18.54 2qov n ALA 49 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2qov n ARG 50 N -2.09 0.02 0.00 0.00 3.00 0.23 -1.33 116.66 116.49 2qov n ARG 50 Ca 0.04 0.25 0.00 0.00 -0.01 0.00 0.00 57.85 58.14 2qov n ARG 50 Cb 0.43 -1.50 0.00 0.00 0.00 0.00 0.00 32.46 31.39 2qov n ARG 50 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.63 178.17 2qov n ARG 51 N -1.27 3.02 -0.10 5.56 1.74 -1.21 -4.66 116.66 119.75 2qov n ARG 51 Ca 0.01 0.00 0.01 0.00 -0.77 0.00 0.00 57.85 57.10 2qov n ARG 51 Cb 0.01 -0.89 0.05 0.00 -1.02 0.00 0.00 32.46 30.61 2qov n ARG 51 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2qov n ALA 52 N -1.71 2.64 -0.57 7.54 0.00 -0.45 -4.13 120.51 123.84 2qov n ALA 52 Ca 0.00 -0.23 -0.14 0.00 0.00 0.00 0.00 53.44 53.08 2qov n ALA 52 Cb 0.39 -1.01 0.05 0.00 0.00 0.00 0.00 19.45 18.88 2qov n ALA 52 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2qov n GLU 53 N 0.02 1.67 0.00 0.00 1.02 -0.65 -3.63 120.64 119.06 2qov n GLU 53 Ca 0.03 -1.37 0.00 0.00 -0.02 0.00 0.00 57.16 55.80 2qov n GLU 53 Cb 0.31 -1.54 0.00 0.00 -0.02 0.00 0.00 31.44 30.19 2qov n GLU 53 CO 0.00 0.00 0.00 1.47 1.18 0.00 0.00 177.13 179.78 2qov n LEU 54 N 0.25 0.00 0.06 -4.62 -0.00 -1.26 -4.59 117.00 106.83 2qov n LEU 54 Ca 0.27 0.00 -0.12 0.00 -0.00 0.00 0.00 56.01 56.16 2qov n LEU 54 Cb 0.71 0.29 -0.06 0.00 -0.00 0.00 0.00 43.42 44.36 2qov n LEU 54 CO 0.32 -0.29 0.83 -0.33 -0.00 0.00 0.00 177.39 177.92 2qov h GLU 55 N 0.00 -0.10 -0.66 1.47 4.39 -1.77 1.43 114.58 119.34 2qov h GLU 55 Ca 0.00 0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.71 2qov h GLU 55 Cb 0.00 0.02 0.00 0.00 -0.10 0.00 0.00 28.75 28.67 2qov h GLU 55 CO 0.00 -0.07 0.00 0.00 -1.16 0.00 0.00 179.01 177.78 2qov n ALA 56 N -2.22 2.96 0.00 3.43 0.00 -1.24 -3.94 120.51 119.50 2qov n ALA 56 Ca -0.07 -1.56 0.00 0.00 0.00 0.00 0.00 53.44 51.82 2qov n ALA 56 Cb 0.09 -0.99 0.00 0.00 0.00 0.00 0.00 19.45 18.56 2qov n ALA 56 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 2qov n LYS 57 N 1.21 0.00 0.01 0.00 -0.00 -1.09 -4.86 118.16 113.43 2qov n LYS 57 Ca 0.26 0.00 -0.15 0.00 -0.00 0.00 0.00 58.31 58.42 2qov n LYS 57 Cb 0.84 -0.52 -0.04 0.00 -0.00 0.00 0.00 35.03 35.31 2qov n LYS 57 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.40 178.65 2qov h LEU 58 N 0.00 0.78 0.00 -5.58 5.85 0.17 0.20 115.31 116.72 2qov h LEU 58 Ca 0.00 -0.52 0.00 0.00 0.84 0.00 0.00 57.88 58.20 2qov h LEU 58 Cb 0.09 -0.23 0.00 0.00 0.37 0.00 0.00 40.66 40.89 2qov h LEU 58 CO 0.00 1.31 0.00 0.00 -0.34 0.00 0.00 178.44 179.41 2qov n ALA 59 N -2.58 1.70 0.00 1.25 0.00 -0.44 -1.62 120.51 118.83 2qov n ALA 59 Ca -0.07 -0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.35 2qov n ALA 59 Cb 0.75 -1.07 0.00 0.00 0.00 0.00 0.00 19.45 19.13 2qov n ALA 59 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2qov n GLU 60 N -0.88 3.86 0.12 0.00 1.02 -1.10 -4.77 120.64 118.89 2qov n GLU 60 Ca 0.03 0.00 -0.00 0.00 -0.02 0.00 0.00 57.16 57.17 2qov n GLU 60 Cb 0.02 -0.56 0.06 0.00 -0.02 0.00 0.00 31.44 30.94 2qov n GLU 60 CO 0.00 0.00 0.00 -0.24 1.18 0.00 0.00 177.13 178.07 2qov h VAL 61 N 0.00 1.22 0.00 2.62 3.04 0.02 -3.16 116.25 120.00 2qov h VAL 61 Ca 0.00 -2.46 0.00 0.00 -1.01 0.00 0.00 66.70 63.23 2qov h VAL 61 Cb 0.00 2.42 0.00 0.00 -2.01 0.00 0.00 31.29 31.70 2qov h VAL 61 CO 0.00 0.64 0.00 0.00 -1.01 0.00 0.00 177.57 177.20 2qov n LEU 62 N -3.41 1.27 -0.30 3.16 -0.00 -1.01 -4.19 117.00 112.53 2qov n LEU 62 Ca 0.00 -0.64 0.34 0.00 -0.00 0.00 0.00 56.01 55.71 2qov n LEU 62 Cb 0.74 -0.39 0.74 0.00 -0.00 0.00 0.00 43.42 44.51 2qov n LEU 62 CO 0.42 0.26 1.31 0.00 -0.00 0.00 0.00 177.39 179.38 2qov h ALA 63 N 1.85 3.05 -0.53 1.47 0.00 -1.86 0.21 119.26 123.45 2qov h ALA 63 Ca 0.00 -0.04 0.10 0.00 0.00 0.00 0.00 54.91 54.98 2qov h ALA 63 Cb 0.51 0.08 -0.11 0.00 0.00 0.00 0.00 17.79 18.28 2qov h ALA 63 CO 0.00 -1.37 -0.25 0.00 0.00 0.00 0.00 179.25 177.63 2qov h ALA 64 N 1.44 0.11 -0.04 0.00 0.00 -1.91 -3.00 119.26 115.86 2qov h ALA 64 Ca 0.54 0.18 -0.08 0.00 0.00 0.00 0.00 54.91 55.54 2qov h ALA 64 Cb 2.14 0.61 -0.15 0.00 0.00 0.00 0.00 17.79 20.39 2qov h ALA 64 CO -0.02 -0.58 -0.70 0.00 0.00 0.00 0.00 179.25 177.95 2qov n ALA 65 N -3.04 3.26 1.62 0.00 0.00 -0.36 -4.75 120.51 117.23 2qov n ALA 65 Ca 0.04 -2.99 0.05 0.00 0.00 0.00 0.00 53.44 50.54 2qov n ALA 65 Cb 0.33 -0.49 0.23 0.00 0.00 0.00 0.00 19.45 19.52 2qov n ALA 65 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 2qov n ASN 66 N -0.55 0.70 0.00 0.00 2.04 0.60 -4.29 115.26 113.76 2qov n ASN 66 Ca 0.15 -1.81 0.00 0.00 -0.44 0.00 0.00 54.58 52.48 2qov n ASN 66 Cb 0.86 -0.07 0.00 0.00 -2.53 0.00 0.00 39.78 38.03 2qov n ASN 66 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 2qov n ALA 67 N -0.20 0.00 0.25 -2.53 0.00 -1.26 -4.77 120.51 112.00 2qov n ALA 67 Ca 0.09 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.65 2qov n ALA 67 Cb 0.14 0.00 0.63 0.00 0.00 0.00 0.00 19.45 20.22 2qov n ALA 67 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2qov h ARG 68 N 0.00 0.00 -0.80 0.00 2.47 -1.75 -3.00 114.38 111.31 2qov h ARG 68 Ca 0.00 0.00 0.18 0.00 -1.26 0.00 0.00 59.98 58.90 2qov h ARG 68 Cb 0.00 0.00 -0.12 0.00 -1.65 0.00 0.00 29.97 28.20 2qov h ARG 68 CO 0.00 0.16 0.25 0.00 0.56 0.00 0.00 179.97 180.93 2qov h ALA 69 N 1.84 1.11 0.23 0.04 0.00 -0.90 1.29 119.26 122.87 2qov h ALA 69 Ca -0.00 0.17 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 2qov h ALA 69 Cb 0.50 0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.50 2qov h ALA 69 CO 0.02 -0.34 -0.11 0.93 0.00 0.00 0.00 179.25 179.75 2qov h GLU 70 N 0.31 -0.29 -0.87 0.00 4.39 -1.82 -3.35 114.58 112.95 2qov h GLU 70 Ca 0.47 0.02 0.13 0.00 0.34 0.00 0.00 59.36 60.32 2qov h GLU 70 Cb 0.83 0.07 -0.07 0.00 -0.10 0.00 0.00 28.75 29.48 2qov h GLU 70 CO -0.52 -0.19 0.56 0.87 -1.16 0.00 0.00 179.01 178.56 2qov h LYS 71 N -0.99 0.69 -4.85 2.33 6.56 -1.50 -3.40 116.57 115.41 2qov h LYS 71 Ca -0.03 -0.04 -0.62 0.00 -1.06 0.00 0.00 60.65 58.90 2qov h LYS 71 Cb 0.23 -0.15 -0.35 0.00 -0.57 0.00 0.00 32.23 31.39 2qov h LYS 71 CO 0.05 0.45 -0.84 -1.50 -2.06 0.00 0.00 179.45 175.55 2qov s ILE 72 N -5.68 1.70 0.02 1.86 2.07 0.44 -4.86 121.20 116.76 2qov s ILE 72 Ca -0.10 -0.74 0.00 0.00 -1.41 0.00 0.00 60.65 58.40 2qov s ILE 72 Cb 0.22 -1.55 0.00 0.00 0.13 0.00 0.00 42.46 41.25 2qov s ILE 72 CO 0.79 0.48 0.00 -0.46 -1.91 0.00 0.00 174.94 173.84 2qov n ASN 73 N 4.41 -0.22 -4.24 4.50 2.04 -1.23 -3.04 115.26 117.48 2qov n ASN 73 Ca -0.19 0.49 -0.42 0.00 -0.44 0.00 0.00 54.58 54.02 2qov n ASN 73 Cb 0.51 0.65 -0.04 0.00 -2.53 0.00 0.00 39.78 38.36 2qov n ASN 73 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 2qov s ALA 74 N -1.93 4.07 0.00 -2.53 0.00 -1.26 -4.47 121.76 115.63 2qov s ALA 74 Ca 0.00 -3.46 0.00 0.00 0.00 0.00 0.00 51.96 48.50 2qov s ALA 74 Cb 0.00 -3.20 0.00 0.00 0.00 0.00 0.00 23.12 19.92 2qov s ALA 74 CO 0.00 -2.21 0.00 1.28 0.00 0.00 0.00 175.76 174.83 2qov n LEU 75 N 3.42 0.00 -0.94 0.00 4.77 -1.26 -4.88 117.00 118.12 2qov n LEU 75 Ca 0.15 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.13 2qov n LEU 75 Cb 0.42 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.51 2qov n LEU 75 CO 0.36 0.00 0.47 -0.62 -1.33 0.00 0.00 177.39 176.26 2qov n GLU 76 N 0.00 1.00 -2.63 3.23 1.02 -1.26 -4.86 120.64 117.13 2qov n GLU 76 Ca 0.00 0.00 -0.04 0.00 -0.02 0.00 0.00 57.16 57.10 2qov n GLU 76 Cb 0.00 -1.07 -0.03 0.00 -0.02 0.00 0.00 31.44 30.32 2qov n GLU 76 CO 0.00 0.00 0.00 2.41 1.18 0.00 0.00 177.13 180.72 2qov n THR 77 N 0.44-12.65 -2.15 2.62 -1.04 -1.26 -4.85 114.28 95.39 2qov n THR 77 Ca 0.00 2.47 -0.43 0.00 -2.04 0.00 0.00 64.05 64.05 2qov n THR 77 Cb 0.47 -6.71 -0.03 0.00 -1.82 0.00 0.00 70.33 62.25 2qov n THR 77 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 2qov s VAL 78 N -1.01 3.81 -0.47 12.58 1.01 -1.26 -4.93 120.40 130.12 2qov s VAL 78 Ca -0.19 0.96 0.06 0.00 0.00 0.00 0.00 61.98 62.81 2qov s VAL 78 Cb 0.01 -3.67 0.19 0.00 0.00 0.00 0.00 36.38 32.91 2qov s VAL 78 CO 0.79 -0.14 0.57 0.35 0.00 0.00 0.00 175.10 176.68 2qov n THR 79 N 5.66 -0.52 -3.55 3.92 -2.24 -1.26 -1.51 114.28 114.78 2qov n THR 79 Ca 0.17 -2.14 -0.41 0.00 -2.27 0.00 0.00 64.05 59.40 2qov n THR 79 Cb 0.44 -0.17 -0.10 0.00 -2.10 0.00 0.00 70.33 68.40 2qov n THR 79 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 2qov s ILE 80 N 0.44 4.59 -0.47 2.28 1.01 -1.26 -4.55 121.20 123.25 2qov s ILE 80 Ca 0.32 -1.16 -0.24 0.00 0.00 0.00 0.00 60.65 59.56 2qov s ILE 80 Cb 0.04 -3.72 0.03 0.00 0.01 0.00 0.00 42.46 38.81 2qov s ILE 80 CO -0.12 -0.45 0.88 0.00 0.00 0.00 0.00 174.94 175.25 2qov s ALA 81 N 1.52 3.24 -0.01 9.38 0.00 -1.00 -4.26 121.76 130.64 2qov s ALA 81 Ca 0.03 -0.92 -0.04 0.00 0.00 0.00 0.00 51.96 51.03 2qov s ALA 81 Cb -0.22 -3.60 -0.18 0.00 0.00 0.00 0.00 23.12 19.12 2qov s ALA 81 CO 0.05 -2.06 3.11 0.43 0.00 0.00 0.00 175.76 177.29 2qov n SER 82 N 7.06 5.31 -2.54 0.00 7.64 -1.26 -4.76 113.62 125.07 2qov n SER 82 Ca 0.04 -2.48 -0.05 0.00 1.01 0.00 0.00 58.87 57.40 2qov n SER 82 Cb 0.48 -1.33 -0.04 0.00 -1.01 0.00 0.00 64.21 62.32 2qov n SER 82 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 2qov n LYS 83 N 2.15 -4.80 -3.84 1.43 4.76 -1.26 -3.66 118.16 112.94 2qov n LYS 83 Ca 0.30 3.57 -0.29 0.00 -2.87 0.00 0.00 58.31 59.03 2qov n LYS 83 Cb 0.78 -5.03 -0.11 0.00 -1.84 0.00 0.00 35.03 28.83 2qov n LYS 83 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2qov n ALA 84 N 1.75 3.52 -2.73 7.82 0.00 0.21 0.97 120.51 132.04 2qov n ALA 84 Ca -0.34 -4.56 0.00 0.00 0.00 0.00 0.00 53.44 48.54 2qov n ALA 84 Cb 0.52 -1.09 0.00 0.00 0.00 0.00 0.00 19.45 18.88 2qov n ALA 84 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qov n GLY 85 N 1.89 3.63 3.11 0.00 0.00 -1.25 -4.03 105.19 108.53 2qov n GLY 85 Ca 0.21 -1.23 -0.15 0.00 0.00 0.00 0.00 46.02 44.86 2qov n GLY 85 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2qov n ASP 86 N 0.00 -2.78 -1.06 1.61 8.00 -1.26 0.72 116.55 121.78 2qov n ASP 86 Ca 0.00 -0.56 -0.13 0.00 0.71 0.00 0.00 54.79 54.81 2qov n ASP 86 Cb 0.00 -4.56 -0.06 0.00 -0.02 0.00 0.00 41.12 36.48 2qov n ASP 86 CO 0.00 0.00 0.00 1.21 -0.39 0.00 0.00 177.20 178.02 2qov n GLU 87 N -3.61 -1.60 0.00 -1.24 4.07 -1.26 -4.18 120.64 112.82 2qov n GLU 87 Ca -0.22 0.91 0.00 0.00 -0.06 0.00 0.00 57.16 57.80 2qov n GLU 87 Cb 0.64 -5.26 0.00 0.00 -0.06 0.00 0.00 31.44 26.76 2qov n GLU 87 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2qov n GLY 88 N 0.05 0.65 0.00 8.31 0.00 -1.02 -5.14 105.19 108.03 2qov n GLY 88 Ca -0.13 -0.60 0.00 0.00 0.00 0.00 0.00 46.02 45.29 2qov n GLY 88 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2qov n LYS 89 N 0.00 0.00 -3.85 1.61 0.00 0.22 -5.00 118.16 111.14 2qov n LYS 89 Ca 0.00 0.00 0.02 0.00 0.00 0.00 0.00 58.31 58.33 2qov n LYS 89 Cb 0.00 0.00 0.01 0.00 0.00 0.00 0.00 35.03 35.04 2qov n LYS 89 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.40 176.23 2qov s LEU 90 N 0.00 -0.01 -0.01 3.14 0.20 -1.12 -3.94 118.68 116.95 2qov s LEU 90 Ca 0.00 -0.17 0.06 0.00 0.69 0.00 0.00 54.13 54.71 2qov s LEU 90 Cb 0.00 1.31 -0.08 0.00 -0.43 0.00 0.00 46.19 46.99 2qov s LEU 90 CO 0.00 -0.27 0.15 0.49 -0.29 0.00 0.00 176.35 176.43 2qov n PHE 91 N -0.75 0.00 0.00 5.38 3.01 0.27 -4.44 117.46 120.93 2qov n PHE 91 Ca -0.01 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.45 2qov n PHE 91 Cb 0.60 -0.10 0.00 0.00 -0.01 0.00 0.00 39.48 39.97 2qov n PHE 91 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2qov n GLY 92 N 1.92 3.95 3.55 1.37 0.00 -1.24 -5.08 105.19 109.66 2qov n GLY 92 Ca -0.01 -0.35 -0.08 0.00 0.00 0.00 0.00 46.02 45.59 2qov n GLY 92 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2qov s SER 93 N 1.39 -0.30 0.26 1.61 0.01 -1.26 -4.41 113.70 110.99 2qov s SER 93 Ca 0.00 0.11 0.07 0.00 1.31 0.00 0.00 55.95 57.44 2qov s SER 93 Cb 0.00 0.29 -0.03 0.00 0.21 0.00 0.00 66.02 66.49 2qov s SER 93 CO 0.00 -0.44 0.22 -0.63 0.41 0.00 0.00 173.24 172.81 2qov s ILE 94 N -2.36 4.43 0.00 1.44 -1.09 -1.23 -4.95 121.20 117.44 2qov s ILE 94 Ca 0.04 -1.36 0.00 0.00 -2.23 0.00 0.00 60.65 57.10 2qov s ILE 94 Cb -0.01 -3.42 0.00 0.00 -1.58 0.00 0.00 42.46 37.45 2qov s ILE 94 CO -0.05 -0.33 0.00 0.61 -1.23 0.00 0.00 174.94 173.94 2qov n GLY 95 N -1.22 -0.21 0.00 6.18 0.00 -1.26 -4.43 105.19 104.24 2qov n GLY 95 Ca -0.07 0.56 0.00 0.00 0.00 0.00 0.00 46.02 46.51 2qov n GLY 95 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2qov n THR 96 N 0.00 0.00 0.00 2.61 -2.24 -1.26 -3.88 114.28 109.51 2qov n THR 96 Ca 0.00 0.49 0.00 0.00 -2.27 0.00 0.00 64.05 62.27 2qov n THR 96 Cb 0.00 -1.49 0.00 0.00 -2.10 0.00 0.00 70.33 66.74 2qov n THR 96 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 2qov n ARG 97 N -2.08 0.00 -0.24 -0.78 0.63 -1.26 -0.86 116.66 112.07 2qov n ARG 97 Ca 0.00 0.27 0.05 0.00 -0.92 0.00 0.00 57.85 57.25 2qov n ARG 97 Cb 0.00 -0.85 0.11 0.00 0.45 0.00 0.00 32.46 32.17 2qov n ARG 97 CO 0.00 0.00 0.00 -0.40 -2.51 0.00 0.00 177.63 174.72 2qov n ASP 98 N -0.62 -0.22 0.00 6.15 3.85 -1.26 0.13 116.55 124.58 2qov n ASP 98 Ca 0.00 1.14 0.00 0.00 -0.71 0.00 0.00 54.79 55.22 2qov n ASP 98 Cb 0.00 -0.35 0.00 0.00 -1.35 0.00 0.00 41.12 39.42 2qov n ASP 98 CO 0.00 0.00 0.00 -0.38 -1.01 0.00 0.00 177.20 175.81 2qov n ILE 99 N -5.05 0.00 -0.22 2.12 2.08 -1.05 -3.95 119.36 113.28 2qov n ILE 99 Ca 0.11 0.63 0.19 0.00 0.56 0.00 0.00 62.75 64.24 2qov n ILE 99 Cb 0.36 -1.26 0.52 0.00 -0.75 0.00 0.00 39.64 38.51 2qov n ILE 99 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2qov h ALA 100 N -2.00 2.22 -2.57 -1.39 0.00 -0.82 -3.27 119.26 111.43 2qov h ALA 100 Ca 0.00 0.01 -0.77 0.00 0.00 0.00 0.00 54.91 54.16 2qov h ALA 100 Cb 0.00 -0.03 -0.24 0.00 0.00 0.00 0.00 17.79 17.52 2qov h ALA 100 CO 0.00 -0.49 0.34 0.34 0.00 0.00 0.00 179.25 179.43 2qov s ASP 101 N -5.69 6.80 0.00 0.00 2.15 0.35 -4.48 116.67 115.80 2qov s ASP 101 Ca -0.08 -2.66 0.00 0.00 0.43 0.00 0.00 52.55 50.25 2qov s ASP 101 Cb 0.22 -2.26 0.00 0.00 -0.30 0.00 0.00 42.92 40.59 2qov s ASP 101 CO 0.78 -0.66 0.07 0.00 -0.17 0.00 0.00 175.17 175.19 2qov n ALA 102 N 4.46 0.92 -2.80 3.66 0.00 -1.24 -4.34 120.51 121.17 2qov n ALA 102 Ca 0.18 -0.07 -0.32 0.00 0.00 0.00 0.00 53.44 53.23 2qov n ALA 102 Cb 0.47 0.00 -0.16 0.00 0.00 0.00 0.00 19.45 19.76 2qov n ALA 102 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 2qov s VAL 103 N -0.29 2.41 0.20 0.00 -7.23 -1.26 -4.93 120.40 109.29 2qov s VAL 103 Ca 0.00 -0.93 0.00 0.00 -1.81 0.00 0.00 61.98 59.24 2qov s VAL 103 Cb 0.00 -1.92 0.00 0.00 0.56 0.00 0.00 36.38 35.02 2qov s VAL 103 CO 0.00 0.56 0.00 1.07 -0.31 0.00 0.00 175.10 176.42 2qov n THR 104 N 3.00 0.00 1.50 5.32 5.66 -1.20 -4.30 114.28 124.27 2qov n THR 104 Ca -0.18 0.00 0.15 0.00 -3.05 0.00 0.00 64.05 60.97 2qov n THR 104 Cb 0.52 0.00 0.78 0.00 -1.55 0.00 0.00 70.33 70.08 2qov n THR 104 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2qov n ALA 105 N -2.90 2.50 -0.65 1.79 0.00 -1.26 -2.85 120.51 117.14 2qov n ALA 105 Ca 0.00 -0.15 0.09 0.00 0.00 0.00 0.00 53.44 53.38 2qov n ALA 105 Cb 0.00 -1.49 0.32 0.00 0.00 0.00 0.00 19.45 18.28 2qov n ALA 105 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2qov n ALA 106 N -1.24 3.01 0.00 0.00 0.00 -1.26 -4.96 120.51 116.06 2qov n ALA 106 Ca 0.16 -1.69 0.00 0.00 0.00 0.00 0.00 53.44 51.90 2qov n ALA 106 Cb 0.22 -0.88 0.00 0.00 0.00 0.00 0.00 19.45 18.78 2qov n ALA 106 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qov n GLY 107 N 0.70 1.50 3.47 0.00 0.00 -1.13 -4.97 105.19 104.77 2qov n GLY 107 Ca 0.23 -0.11 -0.29 0.00 0.00 0.00 0.00 46.02 45.85 2qov n GLY 107 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2qov n VAL 108 N 0.00 0.00 -3.64 1.61 0.31 -1.26 -4.86 118.33 110.49 2qov n VAL 108 Ca 0.00 -0.39 -0.05 0.00 -0.01 0.00 0.00 64.34 63.89 2qov n VAL 108 Cb 0.00 -0.96 -0.07 0.00 -0.91 0.00 0.00 33.84 31.90 2qov n VAL 108 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 2qov s GLU 109 N -4.34 0.21 -0.19 5.55 2.02 -1.26 -3.21 118.70 117.48 2qov s GLU 109 Ca 0.67 0.24 -0.08 0.00 0.02 0.00 0.00 54.97 55.83 2qov s GLU 109 Cb -0.24 0.10 0.08 0.00 0.10 0.00 0.00 34.13 34.16 2qov s GLU 109 CO 0.65 -0.03 0.43 0.14 0.02 0.00 0.00 175.26 176.47 2qov s VAL 110 N 0.08 -0.34 0.31 2.63 -7.23 -1.26 -5.06 120.40 109.54 2qov s VAL 110 Ca 0.06 0.13 -0.29 0.00 -1.81 0.00 0.00 61.98 60.06 2qov s VAL 110 Cb -0.05 -0.65 -0.12 0.00 0.56 0.00 0.00 36.38 36.12 2qov s VAL 110 CO -0.12 0.05 1.44 0.00 -0.31 0.00 0.00 175.10 176.16 2qov n ALA 111 N 4.83 1.84 1.37 1.32 0.00 -1.26 -4.07 120.51 124.54 2qov n ALA 111 Ca -0.16 0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.65 2qov n ALA 111 Cb 0.52 -2.35 0.00 0.00 0.00 0.00 0.00 19.45 17.62 2qov n ALA 111 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 2qov n LYS 112 N 1.30 0.90 -0.06 0.00 -0.00 -1.26 -3.36 118.16 115.69 2qov n LYS 112 Ca 0.07 0.00 0.10 0.00 -0.00 0.00 0.00 58.31 58.47 2qov n LYS 112 Cb 0.36 -1.21 0.42 0.00 -0.00 0.00 0.00 35.03 34.59 2qov n LYS 112 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.40 177.83 2qov n SER 113 N -0.24 1.17 -3.98 -5.58 7.64 -1.26 -4.29 113.62 107.08 2qov n SER 113 Ca 0.00 -1.63 -0.30 0.00 1.01 0.00 0.00 58.87 57.94 2qov n SER 113 Cb 0.11 -0.08 -0.16 0.00 -1.01 0.00 0.00 64.21 63.07 2qov n SER 113 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 2qov s GLU 114 N -1.85 1.95 0.21 1.43 0.41 -1.21 -4.98 118.70 114.65 2qov s GLU 114 Ca 0.30 -0.83 -0.01 0.00 -0.41 0.00 0.00 54.97 54.02 2qov s GLU 114 Cb 0.16 -2.40 -0.04 0.00 -1.78 0.00 0.00 34.13 30.07 2qov s GLU 114 CO 0.24 -0.44 0.15 0.14 -0.49 0.00 0.00 175.26 174.86 2qov s VAL 115 N 1.41 0.00 -0.40 2.63 -7.23 -1.20 -4.13 120.40 111.48 2qov s VAL 115 Ca -0.02 -1.99 0.10 0.00 -1.81 0.00 0.00 61.98 58.27 2qov s VAL 115 Cb -0.16 -2.49 0.32 0.00 0.56 0.00 0.00 36.38 34.60 2qov s VAL 115 CO -0.08 0.00 0.68 -1.14 -0.31 0.00 0.00 175.10 174.25 2qov n ARG 116 N -0.30 1.07 -3.48 4.82 3.00 -0.76 -4.44 116.66 116.58 2qov n ARG 116 Ca 0.02 -3.45 -0.16 0.00 -0.00 0.00 0.00 57.85 54.26 2qov n ARG 116 Cb 0.66 -1.60 -0.12 0.00 0.00 0.00 0.00 32.46 31.39 2qov n ARG 116 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 2qov s LEU 117 N -2.11 -0.25 0.14 6.15 1.43 -1.26 -4.17 118.68 118.61 2qov s LEU 117 Ca 0.39 -0.02 -0.29 0.00 -1.03 0.00 0.00 54.13 53.18 2qov s LEU 117 Cb 0.29 0.58 -0.04 0.00 0.03 0.00 0.00 46.19 47.05 2qov s LEU 117 CO -0.09 -0.31 1.58 -0.65 0.23 0.00 0.00 176.35 177.11 2qov h PRO 118 N 8.28 -0.41 0.00 1.29 0.11 -1.97 -3.37 132.00 135.93 2qov h PRO 118 Ca -0.17 0.03 -0.05 0.00 0.11 0.00 0.00 66.00 65.91 2qov h PRO 118 Cb 1.15 0.09 -0.01 0.00 0.11 0.00 0.00 31.00 32.34 2qov h PRO 118 CO 0.26 -0.27 -0.91 0.09 -0.21 0.00 0.00 178.00 176.95 2qov n ASN 119 N -5.42 1.63 0.00 -2.05 4.13 -1.26 -5.15 115.26 107.14 2qov n ASN 119 Ca -0.03 0.26 0.00 0.00 1.68 0.00 0.00 54.58 56.50 2qov n ASN 119 Cb 0.36 -0.61 0.00 0.00 -1.54 0.00 0.00 39.78 37.99 2qov n ASN 119 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2qov n GLY 120 N 2.05 3.89 3.60 7.41 0.00 -1.26 -5.03 105.19 115.86 2qov n GLY 120 Ca -0.14 -1.51 -0.43 0.00 0.00 0.00 0.00 46.02 43.94 2qov n GLY 120 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2qov s VAL 121 N -1.73 4.18 0.00 1.61 1.01 -1.26 -5.00 120.40 119.20 2qov s VAL 121 Ca 0.00 1.21 0.00 0.00 0.00 0.00 0.00 61.98 63.19 2qov s VAL 121 Cb 0.00 -4.57 0.00 0.00 0.00 0.00 0.00 36.38 31.81 2qov s VAL 121 CO 0.00 -0.99 0.00 0.18 0.00 0.00 0.00 175.10 174.29 2qov n LEU 122 N 7.92 0.00 -4.48 3.92 4.32 -1.26 -3.57 117.00 123.85 2qov n LEU 122 Ca 0.12 0.00 -0.43 0.00 -0.02 0.00 0.00 56.01 55.69 2qov n LEU 122 Cb 0.49 0.00 -0.03 0.00 -1.62 0.00 0.00 43.42 42.26 2qov n LEU 122 CO 0.72 0.00 0.97 -0.13 -1.22 0.00 0.00 177.39 177.73 2qov s ARG 123 N 0.00 3.35 0.00 3.23 0.52 -1.26 -4.29 118.95 120.50 2qov s ARG 123 Ca 0.00 -1.12 0.00 0.00 -0.52 0.00 0.00 55.73 54.09 2qov s ARG 123 Cb 0.00 -4.61 0.00 0.00 0.52 0.00 0.00 34.95 30.86 2qov s ARG 123 CO 0.00 -1.89 0.00 2.41 0.02 0.00 0.00 175.30 175.84 2qov n THR 124 N 5.97 0.00 -0.05 0.02 -1.04 -1.26 -4.73 114.28 113.19 2qov n THR 124 Ca 0.11 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.12 2qov n THR 124 Cb 0.48 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.99 2qov n THR 124 CO 0.00 0.00 0.00 1.07 -0.64 0.00 0.00 175.07 175.50 2qov n THR 125 N 0.00 0.00 -1.19 12.58 5.66 -1.26 -4.59 114.28 125.48 2qov n THR 125 Ca 0.00 0.00 -0.34 0.00 -3.05 0.00 0.00 64.05 60.66 2qov n THR 125 Cb 0.00 0.00 0.11 0.00 -1.55 0.00 0.00 70.33 68.89 2qov n THR 125 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2qov n GLY 126 N 0.00 -0.48 3.44 1.09 0.00 -1.26 -3.69 105.19 104.29 2qov n GLY 126 Ca 0.00 -0.44 -0.49 0.00 0.00 0.00 0.00 46.02 45.08 2qov n GLY 126 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2qov n GLU 127 N -2.38 0.84 -1.32 1.61 2.13 -1.26 -4.64 120.64 115.61 2qov n GLU 127 Ca 0.12 0.20 -0.34 0.00 0.66 0.00 0.00 57.16 57.80 2qov n GLU 127 Cb 0.50 -2.35 0.11 0.00 0.27 0.00 0.00 31.44 29.97 2qov n GLU 127 CO 0.00 0.00 0.00 -1.58 -0.41 0.00 0.00 177.13 175.14 2qov s HIS 128 N 7.82 1.93 -0.43 4.31 2.46 0.15 -4.82 115.29 126.71 2qov s HIS 128 Ca 1.12 1.62 0.05 0.00 0.47 0.00 0.00 55.06 58.32 2qov s HIS 128 Cb -0.91 -3.51 0.19 0.00 -0.13 0.00 0.00 32.58 28.22 2qov s HIS 128 CO 0.49 -2.77 0.45 0.39 -2.47 0.00 0.00 174.74 170.83 2qov n GLU 129 N -2.89 0.35 -3.02 2.88 1.02 -1.25 -3.81 120.64 113.93 2qov n GLU 129 Ca 0.14 -2.95 -0.26 0.00 -0.02 0.00 0.00 57.16 54.06 2qov n GLU 129 Cb 0.50 -1.55 -0.04 0.00 -0.02 0.00 0.00 31.44 30.33 2qov n GLU 129 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 2qov n VAL 130 N 2.54 2.67 -0.86 2.62 0.31 -0.65 -4.45 118.33 120.51 2qov n VAL 130 Ca 0.26 -5.44 -0.28 0.00 -0.01 0.00 0.00 64.34 58.87 2qov n VAL 130 Cb 0.51 -1.39 -0.01 0.00 -0.91 0.00 0.00 33.84 32.04 2qov n VAL 130 CO 0.00 0.00 0.00 -1.20 -1.32 0.00 0.00 176.83 174.31 2qov n SER 131 N -0.05 -1.50 -4.45 4.52 7.64 -1.25 -3.35 113.62 115.18 2qov n SER 131 Ca 0.30 0.59 -0.44 0.00 1.01 0.00 0.00 58.87 60.33 2qov n SER 131 Cb 0.42 -0.58 -0.01 0.00 -1.01 0.00 0.00 64.21 63.02 2qov n SER 131 CO 0.00 0.00 0.00 0.12 -3.01 0.00 0.00 175.04 172.15 2qov s PHE 132 N -0.93 3.37 -0.82 1.43 5.36 -1.26 -1.82 117.98 123.31 2qov s PHE 132 Ca 0.39 -1.84 -0.25 0.00 -0.96 0.00 0.00 56.93 54.27 2qov s PHE 132 Cb -0.47 -4.27 -0.07 0.00 -0.34 0.00 0.00 43.02 37.87 2qov s PHE 132 CO 0.39 -1.41 2.06 -1.14 -1.46 0.00 0.00 175.22 173.66 2qov s GLN 133 N 1.91 2.32 0.43 10.12 0.74 -1.26 -3.98 119.66 129.94 2qov s GLN 133 Ca 0.37 0.09 0.11 0.00 0.05 0.00 0.00 55.36 55.98 2qov s GLN 133 Cb -0.04 -4.89 0.92 0.00 1.10 0.00 0.00 33.01 30.11 2qov s GLN 133 CO -0.04 -3.53 2.00 -0.24 -0.55 0.00 0.00 175.29 172.92 2qov h VAL 134 N 7.33 1.12 -3.24 1.34 3.04 -1.74 -3.43 116.25 120.67 2qov h VAL 134 Ca 0.01 -0.50 -0.12 0.00 -1.01 0.00 0.00 66.70 65.08 2qov h VAL 134 Cb 1.04 1.06 -0.20 0.00 -2.01 0.00 0.00 31.29 31.18 2qov h VAL 134 CO 1.16 0.16 -0.34 -1.00 -1.01 0.00 0.00 177.57 176.54 2qov s HIS 135 N -4.92 -0.09 0.46 3.17 0.09 -1.05 -5.03 115.29 107.91 2qov s HIS 135 Ca -0.06 0.07 0.22 0.00 -0.00 0.00 0.00 55.06 55.30 2qov s HIS 135 Cb 0.16 0.05 1.21 0.00 -0.00 0.00 0.00 32.58 34.00 2qov s HIS 135 CO 0.71 -0.38 1.87 0.77 -0.00 0.00 0.00 174.74 177.71 2qov h SER 136 N 3.85 0.27 0.23 1.40 0.02 -1.96 -2.78 113.55 114.59 2qov h SER 136 Ca -0.30 0.03 -0.01 0.00 -0.84 0.00 0.00 61.79 60.66 2qov h SER 136 Cb 1.18 -0.02 0.00 0.00 0.14 0.00 0.00 62.40 63.71 2qov h SER 136 CO 0.42 0.10 -0.11 -0.08 -1.14 0.00 0.00 176.83 176.02 2qov h GLU 137 N 0.27 -0.30 -5.44 3.45 4.57 -1.96 -3.45 114.58 111.73 2qov h GLU 137 Ca 0.45 0.02 -0.63 0.00 -1.18 0.00 0.00 59.36 58.02 2qov h GLU 137 Cb 1.33 0.07 -0.12 0.00 -0.16 0.00 0.00 28.75 29.87 2qov h GLU 137 CO -0.12 -0.20 -0.52 0.14 -1.18 0.00 0.00 179.01 177.13 2qov s VAL 138 N -2.58 5.18 0.00 0.32 -7.23 -1.05 -5.09 120.40 109.95 2qov s VAL 138 Ca -0.04 0.10 0.00 0.00 -1.81 0.00 0.00 61.98 60.22 2qov s VAL 138 Cb 0.00 -3.31 0.00 0.00 0.56 0.00 0.00 36.38 33.63 2qov s VAL 138 CO 0.13 0.51 0.00 0.49 -0.31 0.00 0.00 175.10 175.93 2qov n PHE 139 N 2.96 0.00 -1.91 2.82 0.99 -1.26 -2.53 117.46 118.53 2qov n PHE 139 Ca -0.18 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.27 2qov n PHE 139 Cb 0.53 0.00 0.00 0.00 -1.00 0.00 0.00 39.48 39.01 2qov n PHE 139 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 2qov n ALA 140 N -3.00 0.00 -3.62 4.37 0.00 -1.26 -0.38 120.51 116.63 2qov n ALA 140 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.34 2qov n ALA 140 Cb 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.35 2qov n ALA 140 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2qov s LYS 141 N -0.04 0.48 -0.01 0.00 3.01 -1.17 -4.45 119.74 117.56 2qov s LYS 141 Ca 0.00 0.83 -0.14 0.00 -1.01 0.00 0.00 55.97 55.65 2qov s LYS 141 Cb 0.00 0.06 0.02 0.00 -1.01 0.00 0.00 37.83 36.90 2qov s LYS 141 CO 0.00 -0.14 0.30 0.08 0.51 0.00 0.00 175.35 176.10 2qov s VAL 142 N 1.20 0.06 0.00 3.17 1.01 -1.26 -3.55 120.40 121.03 2qov s VAL 142 Ca -0.08 -0.51 0.00 0.00 0.00 0.00 0.00 61.98 61.39 2qov s VAL 142 Cb -0.07 -0.64 0.00 0.00 0.00 0.00 0.00 36.38 35.67 2qov s VAL 142 CO -0.11 -0.28 0.00 2.30 0.00 0.00 0.00 175.10 177.01 2qov n ILE 143 N 1.20 0.00 0.00 2.22 -5.35 -1.25 -1.64 119.36 114.53 2qov n ILE 143 Ca -0.21 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.27 2qov n ILE 143 Cb 0.56 0.00 0.00 0.00 -1.74 0.00 0.00 39.64 38.46 2qov n ILE 143 CO 0.00 0.00 0.00 0.52 -1.76 0.00 0.00 176.55 175.31 2qov n VAL 144 N 0.00 0.00 -3.74 7.28 0.31 -0.57 -4.47 118.33 117.14 2qov n VAL 144 Ca 0.00 0.00 -0.22 0.00 -0.01 0.00 0.00 64.34 64.11 2qov n VAL 144 Cb 0.00 0.00 -0.18 0.00 -0.91 0.00 0.00 33.84 32.75 2qov n VAL 144 CO 0.00 0.00 0.00 0.20 -1.32 0.00 0.00 176.83 175.71 2qov s ASN 145 N 0.00 1.47 -0.23 4.52 -0.87 -1.26 0.32 114.94 118.89 2qov s ASN 145 Ca 0.00 -0.04 -0.14 0.00 -1.57 0.00 0.00 52.86 51.11 2qov s ASN 145 Cb 0.00 -0.36 -0.04 0.00 -0.02 0.00 0.00 41.25 40.83 2qov s ASN 145 CO 0.00 -0.21 0.34 -0.69 -2.57 0.00 0.00 177.10 173.97 2qov s VAL 146 N 2.02 5.23 0.00 1.60 1.01 -1.24 -2.37 120.40 126.65 2qov s VAL 146 Ca 0.05 0.55 0.00 0.00 0.00 0.00 0.00 61.98 62.58 2qov s VAL 146 Cb -0.12 -3.67 0.00 0.00 0.00 0.00 0.00 36.38 32.59 2qov s VAL 146 CO -0.05 0.25 0.00 0.52 0.00 0.00 0.00 175.10 175.82 2qov n VAL 147 N 4.53 0.00 -4.15 2.92 0.31 -1.26 -4.07 118.33 116.60 2qov n VAL 147 Ca -0.10 0.00 -0.16 0.00 -0.01 0.00 0.00 64.34 64.07 2qov n VAL 147 Cb 0.51 0.00 -0.02 0.00 -0.91 0.00 0.00 33.84 33.42 2qov n VAL 147 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2qov n ALA 148 N -3.00 0.30 0.73 3.52 0.00 -1.26 0.64 120.51 121.44 2qov n ALA 148 Ca 0.00 -1.19 0.09 0.00 0.00 0.00 0.00 53.44 52.34 2qov n ALA 148 Cb 0.00 0.60 0.07 0.00 0.00 0.00 0.00 19.45 20.12 2qov n ALA 148 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65