#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qqz s ASN 3 N 0.00 6.32 0.05 0.55 2.47 -1.26 -4.89 114.94 118.18 2qqz s ASN 3 Ca 0.00 -3.02 0.07 0.00 0.42 0.00 0.00 52.86 50.33 2qqz s ASN 3 Cb 0.00 -2.07 -0.23 0.00 -1.45 0.00 0.00 41.25 37.50 2qqz s ASN 3 CO 0.00 -0.42 1.03 1.88 -3.72 0.00 0.00 177.10 175.87 2qqz h TYR 4 N 7.15 0.08 -3.28 0.43 0.05 -2.14 -3.46 116.97 115.81 2qqz h TYR 4 Ca 0.09 -0.06 -0.56 0.00 0.05 0.00 0.00 58.73 58.25 2qqz h TYR 4 Cb 0.96 -0.00 -0.05 0.00 1.01 0.00 0.00 36.73 38.65 2qqz h TYR 4 CO 0.86 1.07 0.49 0.42 -1.05 0.00 0.00 178.16 179.95 2qqz s ILE 5 N -2.66 4.82 -0.03 -2.88 1.01 -1.26 -4.92 121.20 115.28 2qqz s ILE 5 Ca -0.02 1.91 0.16 0.00 0.00 0.00 0.00 60.65 62.70 2qqz s ILE 5 Cb 0.09 -4.26 -0.25 0.00 0.01 0.00 0.00 42.46 38.05 2qqz s ILE 5 CO 0.83 0.03 0.34 0.00 0.00 0.00 0.00 174.94 176.14 2qqz n GLN 6 N 4.96 0.51 -3.71 2.79 1.13 -1.26 -5.09 117.38 116.71 2qqz n GLN 6 Ca 0.07 -0.14 0.00 0.00 -1.94 0.00 0.00 57.00 54.99 2qqz n GLN 6 Cb 0.49 -1.38 0.00 0.00 0.11 0.00 0.00 30.24 29.46 2qqz n GLN 6 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2qqz n GLY 7 N 1.61 -1.80 3.65 1.08 0.00 -1.26 -5.09 105.19 103.39 2qqz n GLY 7 Ca -0.03 -1.32 -0.40 0.00 0.00 0.00 0.00 46.02 44.27 2qqz n GLY 7 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2qqz s ILE 8 N -2.53 5.05 -0.11 -0.61 1.01 -1.26 -4.95 121.20 117.80 2qqz s ILE 8 Ca 0.00 1.08 -0.21 0.00 0.00 0.00 0.00 60.65 61.52 2qqz s ILE 8 Cb 0.00 -3.90 -0.27 0.00 0.01 0.00 0.00 42.46 38.30 2qqz s ILE 8 CO 0.00 0.13 0.65 -0.78 0.00 0.00 0.00 174.94 174.94 2qqz h ASP 9 N 7.55 0.29 -5.11 3.58 3.58 -1.95 -3.46 116.42 120.90 2qqz h ASP 9 Ca -0.32 -0.87 0.09 0.00 0.42 0.00 0.00 57.03 56.36 2qqz h ASP 9 Cb 1.15 -0.09 -0.05 0.00 1.72 0.00 0.00 39.33 42.05 2qqz h ASP 9 CO 0.76 1.42 0.32 -1.38 -2.88 0.00 0.00 179.24 177.48 2qqz s HIS 10 N -2.40 -0.12 -0.04 0.28 -3.43 -1.26 -2.22 115.29 106.10 2qqz s HIS 10 Ca -0.19 -0.32 0.03 0.00 -0.80 0.00 0.00 55.06 53.78 2qqz s HIS 10 Cb 0.02 0.71 0.00 0.00 -1.43 0.00 0.00 32.58 31.88 2qqz s HIS 10 CO 0.75 -1.16 -0.14 0.54 -2.00 0.00 0.00 174.74 172.73 2qqz s VAL 11 N -3.46 1.18 -0.22 -5.38 0.11 -1.00 -4.98 120.40 106.65 2qqz s VAL 11 Ca 0.12 -0.57 -0.10 0.00 -2.93 0.00 0.00 61.98 58.51 2qqz s VAL 11 Cb -0.04 -1.03 -0.05 0.00 -1.53 0.00 0.00 36.38 33.73 2qqz s VAL 11 CO 0.06 0.35 0.14 -1.58 -3.33 0.00 0.00 175.10 170.74 2qqz s GLN 12 N 0.19 4.09 -0.08 1.54 0.74 -1.26 -1.02 119.66 123.87 2qqz s GLN 12 Ca -0.05 -0.26 0.02 0.00 0.05 0.00 0.00 55.36 55.11 2qqz s GLN 12 Cb -0.11 -3.46 -0.02 0.00 1.10 0.00 0.00 33.01 30.51 2qqz s GLN 12 CO 0.02 0.16 -0.14 0.08 -0.55 0.00 0.00 175.29 174.85 2qqz s VAL 13 N 0.77 3.03 0.47 1.34 1.01 0.23 -4.96 120.40 122.28 2qqz s VAL 13 Ca 0.07 -0.71 -0.06 0.00 0.00 0.00 0.00 61.98 61.29 2qqz s VAL 13 Cb -0.13 -2.22 -0.04 0.00 0.00 0.00 0.00 36.38 34.00 2qqz s VAL 13 CO 0.02 0.57 0.78 0.00 0.00 0.00 0.00 175.10 176.46 2qqz s ALA 14 N -0.32 3.40 0.08 5.51 0.00 -1.26 0.06 121.76 129.23 2qqz s ALA 14 Ca 0.03 -0.48 -0.26 0.00 0.00 0.00 0.00 51.96 51.25 2qqz s ALA 14 Cb -0.13 -2.59 0.08 0.00 0.00 0.00 0.00 23.12 20.48 2qqz s ALA 14 CO 0.02 -0.29 0.70 0.00 0.00 0.00 0.00 175.76 176.19 2qqz s ALA 15 N -2.68 -1.69 0.84 0.00 0.00 -0.48 -4.80 121.76 112.94 2qqz s ALA 15 Ca 0.48 0.78 -0.12 0.00 0.00 0.00 0.00 51.96 53.10 2qqz s ALA 15 Cb -0.10 0.58 0.09 0.00 0.00 0.00 0.00 23.12 23.69 2qqz s ALA 15 CO 0.43 -0.67 1.16 -1.25 0.00 0.00 0.00 175.76 175.42 2qqz s PRO 16 N -3.12 1.76 0.41 0.00 0.04 -1.26 -1.07 135.00 131.76 2qqz s PRO 16 Ca 0.00 0.21 -0.25 0.00 0.04 0.00 0.00 61.00 61.00 2qqz s PRO 16 Cb -0.01 -1.92 -0.10 0.00 0.04 0.00 0.00 34.50 32.51 2qqz s PRO 16 CO -0.08 -1.76 1.20 1.55 0.04 0.00 0.00 177.00 177.96 2qqz n VAL 17 N -3.45 2.48 -1.04 -0.36 3.14 -1.26 -2.23 118.33 115.61 2qqz n VAL 17 Ca 0.07 -0.50 -0.01 0.00 -2.96 0.00 0.00 64.34 60.94 2qqz n VAL 17 Cb 0.60 -1.45 -0.01 0.00 -1.06 0.00 0.00 33.84 31.92 2qqz n VAL 17 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 2qqz n GLY 18 N 0.91 0.51 0.00 7.55 0.00 -1.26 -4.95 105.19 107.95 2qqz n GLY 18 Ca 0.07 -0.44 0.09 0.00 0.00 0.00 0.00 46.02 45.75 2qqz n GLY 18 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qqz h GLU 20 N 0.00 0.21 -0.73 0.00 3.07 -1.92 0.11 114.58 115.33 2qqz h GLU 20 Ca 0.00 -0.05 0.02 0.00 -0.50 0.00 0.00 59.36 58.82 2qqz h GLU 20 Cb 0.20 -0.03 -0.04 0.00 -0.84 0.00 0.00 28.75 28.05 2qqz h GLU 20 CO 0.00 0.38 0.47 0.93 -1.40 0.00 0.00 179.01 179.39 2qqz h GLU 21 N 0.01 0.92 -0.23 2.33 5.08 -2.00 0.81 114.58 121.51 2qqz h GLU 21 Ca 0.04 -0.06 -0.15 0.00 -1.00 0.00 0.00 59.36 58.20 2qqz h GLU 21 Cb 0.26 -0.21 -0.01 0.00 0.50 0.00 0.00 28.75 29.30 2qqz h GLU 21 CO 0.00 0.61 -0.48 0.93 -1.00 0.00 0.00 179.01 179.07 2qqz h GLU 22 N 0.95 0.60 -0.46 2.33 5.08 -1.80 -1.83 114.58 119.44 2qqz h GLU 22 Ca 0.28 -0.34 -0.08 0.00 -1.00 0.00 0.00 59.36 58.22 2qqz h GLU 22 Cb -0.06 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.20 2qqz h GLU 22 CO -0.08 0.94 -0.02 0.00 -1.00 0.00 0.00 179.01 178.85 2qqz h ALA 23 N 1.00 0.62 -0.47 3.43 0.00 -0.22 -2.10 119.26 121.53 2qqz h ALA 23 Ca 0.03 -0.29 -0.06 0.00 0.00 0.00 0.00 54.91 54.59 2qqz h ALA 23 Cb 1.01 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.61 2qqz h ALA 23 CO 0.09 0.44 0.07 0.00 0.00 0.00 0.00 179.25 179.85 2qqz h ARG 24 N 0.67 0.78 0.00 0.00 3.08 -0.86 -0.52 114.38 117.54 2qqz h ARG 24 Ca 0.13 -0.22 -0.07 0.00 0.07 0.00 0.00 59.98 59.90 2qqz h ARG 24 Cb 0.53 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.48 2qqz h ARG 24 CO 0.03 0.80 -0.31 0.00 -1.07 0.00 0.00 179.97 179.42 2qqz h ALA 25 N 0.95 1.16 0.00 0.04 0.00 -1.11 -0.68 119.26 119.63 2qqz h ALA 25 Ca 0.14 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.77 2qqz h ALA 25 Cb 0.40 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.14 2qqz h ALA 25 CO 0.01 0.39 -0.64 0.34 0.00 0.00 0.00 179.25 179.35 2qqz n PHE 26 N -3.70 0.34 -0.28 0.00 7.35 -0.81 -1.87 117.46 118.48 2qqz n PHE 26 Ca -0.01 0.15 -0.05 0.00 -0.76 0.00 0.00 57.45 56.77 2qqz n PHE 26 Cb 0.42 -0.52 0.06 0.00 0.35 0.00 0.00 39.48 39.79 2qqz n PHE 26 CO 0.00 0.00 0.00 1.88 -0.76 0.00 0.00 176.76 177.88 2qqz h TYR 27 N -0.81 1.08 0.00 -5.13 0.05 -1.24 -0.52 116.97 110.39 2qqz h TYR 27 Ca 0.00 -0.03 0.00 0.00 0.05 0.00 0.00 58.73 58.75 2qqz h TYR 27 Cb 0.64 -0.34 0.00 0.00 1.01 0.00 0.00 36.73 38.03 2qqz h TYR 27 CO -0.27 0.77 -0.08 0.78 -1.05 0.00 0.00 178.16 178.30 2qqz h GLY 28 N 1.08 0.00 1.76 3.88 0.00 -1.25 -3.09 103.07 105.45 2qqz h GLY 28 Ca 0.27 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.56 2qqz h GLY 28 CO -0.04 0.00 -0.42 0.83 0.00 0.00 0.00 176.54 176.90 2qqz h GLU 29 N -0.43 0.00 0.00 4.80 4.39 -1.26 -1.66 114.58 120.42 2qqz h GLU 29 Ca 0.00 0.00 -0.42 0.00 0.34 0.00 0.00 59.36 59.28 2qqz h GLU 29 Cb 0.08 0.00 -0.06 0.00 -0.10 0.00 0.00 28.75 28.67 2qqz h GLU 29 CO 0.00 0.18 -2.36 2.41 -1.16 0.00 0.00 179.01 178.08 2qqz n THR 30 N -3.06 1.53 0.09 1.13 -1.04 -0.78 -4.57 114.28 107.58 2qqz n THR 30 Ca 0.02 -0.37 0.03 0.00 -2.04 0.00 0.00 64.05 61.68 2qqz n THR 30 Cb 0.62 -1.84 -0.02 0.00 -1.82 0.00 0.00 70.33 67.27 2qqz n THR 30 CO 0.00 0.00 0.00 0.40 -0.64 0.00 0.00 175.07 174.83 2qqz h ILE 31 N -0.85 0.58 -1.68 12.58 1.08 -1.24 -3.46 117.51 124.51 2qqz h ILE 31 Ca -0.64 -1.94 0.00 0.00 -0.39 0.00 0.00 64.86 61.89 2qqz h ILE 31 Cb 1.62 2.14 0.00 0.00 -3.07 0.00 0.00 36.82 37.51 2qqz h ILE 31 CO -0.35 0.33 0.00 0.61 -0.69 0.00 0.00 178.15 178.05 2qqz n GLY 32 N 1.29 -1.66 2.98 5.37 0.00 -0.62 -5.02 105.19 107.53 2qqz n GLY 32 Ca -0.03 -0.61 -0.29 0.00 0.00 0.00 0.00 46.02 45.09 2qqz n GLY 32 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2qqz s GLU 34 N -0.93 2.05 0.26 1.61 2.12 -1.24 -4.99 118.70 117.58 2qqz s GLU 34 Ca 0.00 -0.46 -0.30 0.00 0.36 0.00 0.00 54.97 54.57 2qqz s GLU 34 Cb 0.00 -1.94 -0.10 0.00 0.26 0.00 0.00 34.13 32.36 2qqz s GLU 34 CO 0.00 -0.25 1.35 -2.00 -0.54 0.00 0.00 175.26 173.82 2qqz s GLU 35 N 1.56 4.35 0.17 4.30 2.12 -1.26 -0.15 118.70 129.79 2qqz s GLU 35 Ca 0.05 2.18 0.11 0.00 0.36 0.00 0.00 54.97 57.67 2qqz s GLU 35 Cb -0.13 -3.12 -0.04 0.00 0.26 0.00 0.00 34.13 31.10 2qqz s GLU 35 CO -0.10 -0.27 -0.24 0.96 -0.54 0.00 0.00 175.26 175.07 2qqz s ILE 36 N -0.38 2.25 0.39 -3.70 -4.36 0.09 -4.88 121.20 110.61 2qqz s ILE 36 Ca 0.55 -1.93 -0.24 0.00 -0.26 0.00 0.00 60.65 58.76 2qqz s ILE 36 Cb -0.39 -2.04 -0.10 0.00 1.25 0.00 0.00 42.46 41.18 2qqz s ILE 36 CO 0.45 -0.08 1.00 -2.16 0.24 0.00 0.00 174.94 174.39 2qqz s PRO 37 N -2.50 4.28 0.40 0.37 0.05 -1.26 -4.10 135.00 132.25 2qqz s PRO 37 Ca 0.18 1.37 -0.16 0.00 0.05 0.00 0.00 61.00 62.44 2qqz s PRO 37 Cb -0.08 -2.52 -0.09 0.00 0.05 0.00 0.00 34.50 31.85 2qqz s PRO 37 CO 0.08 -0.01 0.84 0.15 0.05 0.00 0.00 177.00 178.11 2qqz s LYS 38 N -2.54 4.01 0.43 4.56 1.02 -1.26 -4.99 119.74 120.98 2qqz s LYS 38 Ca 0.57 0.80 -0.24 0.00 0.02 0.00 0.00 55.97 57.11 2qqz s LYS 38 Cb -0.18 -2.31 -0.10 0.00 -0.52 0.00 0.00 37.83 34.72 2qqz s LYS 38 CO 0.23 0.00 1.07 -2.30 -0.92 0.00 0.00 175.35 173.43 2qqz n PRO 39 N -0.81 1.46 -0.28 -1.68 -0.02 -1.26 -4.79 135.00 127.62 2qqz n PRO 39 Ca 0.05 0.52 0.09 0.00 -2.02 0.00 0.00 63.50 62.14 2qqz n PRO 39 Cb 0.54 -2.13 0.24 0.00 -0.02 0.00 0.00 33.50 32.13 2qqz n PRO 39 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 2qqz h GLU 40 N 1.61 0.29 0.00 -0.52 4.57 -2.02 -0.95 114.58 117.57 2qqz h GLU 40 Ca -0.45 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 57.71 2qqz h GLU 40 Cb 1.33 -0.07 0.00 0.00 -0.16 0.00 0.00 28.75 29.85 2qqz h GLU 40 CO 0.57 0.19 0.00 -0.85 -1.18 0.00 0.00 179.01 177.74 2qqz n GLU 41 N -5.14 0.30 0.00 1.92 0.00 -1.26 -2.65 120.64 113.82 2qqz n GLU 41 Ca 0.18 0.07 0.06 0.00 0.00 0.00 0.00 57.16 57.47 2qqz n GLU 41 Cb 0.56 -1.50 -0.04 0.00 0.00 0.00 0.00 31.44 30.46 2qqz n GLU 41 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.13 178.41 2qqz n LEU 42 N -1.30 0.85 -0.26 -1.84 4.77 -0.38 -4.66 117.00 114.18 2qqz n LEU 42 Ca 0.10 -0.60 0.00 0.00 -0.03 0.00 0.00 56.01 55.48 2qqz n LEU 42 Cb 0.19 0.00 0.13 0.00 -2.33 0.00 0.00 43.42 41.41 2qqz n LEU 42 CO 0.18 0.19 1.11 0.11 -1.33 0.00 0.00 177.39 177.65 2qqz h LYS 43 N 0.52 0.72 0.00 3.23 1.57 -1.26 -1.44 116.57 119.91 2qqz h LYS 43 Ca 0.00 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 2qqz h LYS 43 Cb 0.32 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 32.47 2qqz h LYS 43 CO 0.00 0.48 0.01 0.36 -0.57 0.00 0.00 179.45 179.73 2qqz n LYS 44 N -4.76 0.01 0.00 3.15 2.85 -1.26 -1.81 118.16 116.33 2qqz n LYS 44 Ca 0.11 0.50 0.13 0.00 -1.05 0.00 0.00 58.31 58.00 2qqz n LYS 44 Cb 0.21 -1.54 0.49 0.00 -0.65 0.00 0.00 35.03 33.54 2qqz n LYS 44 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 2qqz n ARG 45 N -1.55 0.33 -0.05 -1.58 1.74 -0.54 -5.07 116.66 109.95 2qqz n ARG 45 Ca -0.00 -0.13 0.01 0.00 -0.77 0.00 0.00 57.85 56.96 2qqz n ARG 45 Cb 0.01 -1.50 -0.00 0.00 -1.02 0.00 0.00 32.46 29.95 2qqz n ARG 45 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2qqz n GLY 46 N 1.40 -2.48 0.00 -0.13 0.00 -0.75 -4.53 105.19 98.71 2qqz n GLY 46 Ca 0.10 -1.45 0.00 0.00 0.00 0.00 0.00 46.02 44.67 2qqz n GLY 46 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qqz n GLY 47 N -2.20 0.52 3.15 -0.02 0.00 -1.26 -4.38 105.19 101.00 2qqz n GLY 47 Ca -0.00 -2.14 -0.12 0.00 0.00 0.00 0.00 46.02 43.76 2qqz n GLY 47 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qqz s TRP 49 N -1.48 2.50 0.05 0.00 0.52 -1.26 0.32 118.94 119.59 2qqz s TRP 49 Ca -0.14 -0.29 0.02 0.00 0.02 0.00 0.00 56.10 55.71 2qqz s TRP 49 Cb -0.06 -1.45 -0.03 0.00 -1.15 0.00 0.00 33.47 30.78 2qqz s TRP 49 CO 0.02 0.22 -0.07 -0.06 0.02 0.00 0.00 176.95 177.07 2qqz s PHE 50 N -0.89 0.68 -0.10 -1.98 0.08 0.18 -0.73 117.98 115.23 2qqz s PHE 50 Ca 0.14 -0.56 -0.08 0.00 0.12 0.00 0.00 56.93 56.55 2qqz s PHE 50 Cb -0.10 -0.41 -0.04 0.00 -0.57 0.00 0.00 43.02 41.89 2qqz s PHE 50 CO 0.04 -0.10 0.18 0.21 -0.10 0.00 0.00 175.22 175.45 2qqz s LYS 51 N -1.87 3.50 -0.29 0.44 2.20 0.79 -1.35 119.74 123.17 2qqz s LYS 51 Ca -0.07 -0.07 -0.04 0.00 -0.36 0.00 0.00 55.97 55.43 2qqz s LYS 51 Cb -0.08 -3.19 0.10 0.00 -1.51 0.00 0.00 37.83 33.15 2qqz s LYS 51 CO -0.00 0.76 0.13 0.00 -0.36 0.00 0.00 175.35 175.88 2qqz n GLY 53 N 5.19 2.41 0.25 0.00 0.00 -1.26 -1.40 105.19 110.38 2qqz n GLY 53 Ca -0.05 -0.46 0.03 0.00 0.00 0.00 0.00 46.02 45.53 2qqz n GLY 53 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2qqz n ASN 54 N 2.44 0.74 -4.64 1.61 3.02 -1.26 -4.87 115.26 112.30 2qqz n ASN 54 Ca 0.00 -1.96 -0.28 0.00 -0.03 0.00 0.00 54.58 52.31 2qqz n ASN 54 Cb 0.00 -0.09 -0.11 0.00 -0.61 0.00 0.00 39.78 38.98 2qqz n ASN 54 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 2qqz s GLN 55 N -1.82 1.99 0.21 3.52 1.11 -0.50 -4.96 119.66 119.21 2qqz s GLN 55 Ca 0.11 -2.13 0.05 0.00 0.01 0.00 0.00 55.36 53.40 2qqz s GLN 55 Cb 0.06 -1.64 -0.05 0.00 -1.01 0.00 0.00 33.01 30.37 2qqz s GLN 55 CO 0.08 -0.08 -0.06 -1.21 0.01 0.00 0.00 175.29 174.02 2qqz s GLU 56 N -3.73 1.30 -0.09 2.91 2.02 -0.94 -1.15 118.70 119.02 2qqz s GLU 56 Ca 0.32 -1.62 0.03 0.00 0.02 0.00 0.00 54.97 53.72 2qqz s GLU 56 Cb 0.09 -0.81 0.01 0.00 0.10 0.00 0.00 34.13 33.52 2qqz s GLU 56 CO 0.17 0.02 -0.18 -1.50 0.02 0.00 0.00 175.26 173.79 2qqz s ILE 57 N -3.24 1.62 -0.26 -1.63 2.07 -0.46 -2.36 121.20 116.94 2qqz s ILE 57 Ca 0.24 -0.76 -0.04 0.00 -1.41 0.00 0.00 60.65 58.68 2qqz s ILE 57 Cb 0.03 -1.43 0.01 0.00 0.13 0.00 0.00 42.46 41.21 2qqz s ILE 57 CO 0.07 0.46 0.00 -1.00 -1.91 0.00 0.00 174.94 172.56 2qqz s HIS 58 N 0.52 3.08 -0.41 3.50 3.76 -0.19 -0.65 115.29 124.91 2qqz s HIS 58 Ca -0.16 -1.20 -0.20 0.00 -0.15 0.00 0.00 55.06 53.34 2qqz s HIS 58 Cb -0.17 -2.15 0.02 0.00 1.11 0.00 0.00 32.58 31.39 2qqz s HIS 58 CO 0.06 -0.63 0.63 0.42 -0.85 0.00 0.00 174.74 174.37 2qqz s ILE 59 N 1.42 4.86 -0.10 0.60 -1.09 0.15 -0.60 121.20 126.44 2qqz s ILE 59 Ca 0.02 0.25 -0.01 0.00 -2.23 0.00 0.00 60.65 58.69 2qqz s ILE 59 Cb -0.16 -4.16 -0.03 0.00 -1.58 0.00 0.00 42.46 36.53 2qqz s ILE 59 CO -0.01 -0.50 -0.06 -0.83 -1.23 0.00 0.00 174.94 172.31 2qqz s GLY 60 N 1.93 1.70 0.15 6.18 0.00 0.11 -2.20 107.32 115.19 2qqz s GLY 60 Ca 0.23 -0.86 -0.30 0.00 0.00 0.00 0.00 44.72 43.79 2qqz s GLY 60 CO 0.18 -0.43 1.16 0.14 0.00 0.00 0.00 173.10 174.14 2qqz s VAL 61 N -0.35 3.81 0.07 1.40 1.01 -1.26 -1.38 120.40 123.70 2qqz s VAL 61 Ca 0.05 1.47 0.10 0.00 0.00 0.00 0.00 61.98 63.60 2qqz s VAL 61 Cb -0.12 -3.94 -0.03 0.00 0.00 0.00 0.00 36.38 32.28 2qqz s VAL 61 CO 0.02 0.21 -0.26 -1.61 0.00 0.00 0.00 175.10 173.47 2qqz s GLU 62 N 0.05 1.60 0.14 2.72 2.02 -0.23 -4.90 118.70 120.11 2qqz s GLU 62 Ca 0.53 -1.17 -0.15 0.00 0.02 0.00 0.00 54.97 54.21 2qqz s GLU 62 Cb -0.30 -1.87 0.02 0.00 0.10 0.00 0.00 34.13 32.07 2qqz s GLU 62 CO 0.34 0.47 1.69 0.37 0.02 0.00 0.00 175.26 178.15 2qqz h GLN 63 N 4.49 0.68 -2.89 1.61 5.75 -1.97 -3.36 115.11 119.43 2qqz h GLN 63 Ca -0.47 -0.12 -0.61 0.00 -0.15 0.00 0.00 58.65 57.29 2qqz h GLN 63 Cb 1.15 -0.11 -0.40 0.00 1.07 0.00 0.00 27.48 29.19 2qqz h GLN 63 CO 0.42 0.62 -0.73 -0.80 -2.65 0.00 0.00 178.83 175.69 2qqz s ASN 64 N -5.93 3.58 0.10 -0.69 -0.87 -1.26 -4.96 114.94 104.90 2qqz s ASN 64 Ca -0.13 -3.22 -0.30 0.00 -1.57 0.00 0.00 52.86 47.63 2qqz s ASN 64 Cb 0.11 -1.15 -0.06 0.00 -0.02 0.00 0.00 41.25 40.13 2qqz s ASN 64 CO 0.77 -0.17 1.14 0.12 -2.57 0.00 0.00 177.10 176.39 2qqz s PHE 65 N -0.44 3.51 -0.03 2.20 5.36 -1.26 -5.05 117.98 122.27 2qqz s PHE 65 Ca 0.24 1.44 0.04 0.00 -0.96 0.00 0.00 56.93 57.70 2qqz s PHE 65 Cb -0.10 -3.34 -0.01 0.00 -0.34 0.00 0.00 43.02 39.23 2qqz s PHE 65 CO -0.11 -0.93 -0.17 -0.80 -1.46 0.00 0.00 175.22 171.75 2qqz s ASN 66 N 0.64 2.09 0.69 6.13 0.01 -1.26 -5.00 114.94 118.23 2qqz s ASN 66 Ca 0.55 -0.34 -0.14 0.00 -0.71 0.00 0.00 52.86 52.22 2qqz s ASN 66 Cb -0.29 -0.49 0.01 0.00 0.41 0.00 0.00 41.25 40.90 2qqz s ASN 66 CO 0.31 0.17 1.11 -2.16 -1.51 0.00 0.00 177.10 175.02 2qqz s PRO 67 N -0.07 2.63 -0.41 -0.60 0.04 -1.26 -4.97 135.00 130.35 2qqz s PRO 67 Ca -0.01 1.38 -0.18 0.00 0.04 0.00 0.00 61.00 62.23 2qqz s PRO 67 Cb -0.10 -1.93 0.02 0.00 0.04 0.00 0.00 34.50 32.53 2qqz s PRO 67 CO 0.01 -1.38 0.50 0.00 0.04 0.00 0.00 177.00 176.17 2qqz s ALA 68 N -2.42 3.41 -0.11 8.56 0.00 -1.26 -4.91 121.76 125.03 2qqz s ALA 68 Ca 0.66 -1.36 0.21 0.00 0.00 0.00 0.00 51.96 51.47 2qqz s ALA 68 Cb -0.20 -3.10 -0.23 0.00 0.00 0.00 0.00 23.12 19.58 2qqz s ALA 68 CO 0.45 -1.58 0.61 1.63 0.00 0.00 0.00 175.76 176.87 2qqz n LYS 69 N 5.78 0.65 0.00 0.00 4.76 -1.26 -0.82 118.16 127.26 2qqz n LYS 69 Ca -0.06 -0.06 0.00 0.00 -2.87 0.00 0.00 58.31 55.32 2qqz n LYS 69 Cb 0.48 -1.62 0.00 0.00 -1.84 0.00 0.00 35.03 32.05 2qqz n LYS 69 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 2qqz n ARG 70 N -2.47 0.00 -1.98 1.97 1.74 -1.26 -4.74 116.66 109.92 2qqz n ARG 70 Ca -0.06 0.00 -0.38 0.00 -0.77 0.00 0.00 57.85 56.63 2qqz n ARG 70 Cb 0.65 -0.21 0.01 0.00 -1.02 0.00 0.00 32.46 31.89 2qqz n ARG 70 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2qqz s ALA 71 N -2.82 3.02 -0.20 7.54 0.00 -1.26 -5.00 121.76 123.04 2qqz s ALA 71 Ca 0.00 1.22 -0.33 0.00 0.00 0.00 0.00 51.96 52.85 2qqz s ALA 71 Cb 0.00 -3.50 0.15 0.00 0.00 0.00 0.00 23.12 19.77 2qqz s ALA 71 CO 0.00 -1.03 1.19 -3.38 0.00 0.00 0.00 175.76 172.54 2qqz s HIS 72 N -1.34 -0.16 0.38 0.00 -3.43 -1.26 -4.80 115.29 104.68 2qqz s HIS 72 Ca 0.65 0.18 -0.20 0.00 -0.80 0.00 0.00 55.06 54.88 2qqz s HIS 72 Cb -0.37 0.50 -0.10 0.00 -1.43 0.00 0.00 32.58 31.18 2qqz s HIS 72 CO 0.46 -0.20 0.88 -1.25 -2.00 0.00 0.00 174.74 172.62 2qqz s PRO 73 N -1.91 4.20 -0.17 -0.38 0.04 -1.26 -4.95 135.00 130.57 2qqz s PRO 73 Ca 0.07 1.01 0.01 0.00 0.04 0.00 0.00 61.00 62.13 2qqz s PRO 73 Cb -0.01 -2.34 0.02 0.00 0.04 0.00 0.00 34.50 32.21 2qqz s PRO 73 CO -0.05 0.07 -0.20 0.00 0.04 0.00 0.00 177.00 176.86 2qqz s ALA 74 N -2.04 2.33 -0.11 8.56 0.00 -1.26 -1.78 121.76 127.45 2qqz s ALA 74 Ca 0.58 -1.20 -0.09 0.00 0.00 0.00 0.00 51.96 51.25 2qqz s ALA 74 Cb -0.11 -1.16 -0.04 0.00 0.00 0.00 0.00 23.12 21.81 2qqz s ALA 74 CO 0.16 -0.30 0.18 -0.06 0.00 0.00 0.00 175.76 175.73 2qqz s PHE 75 N 1.22 3.60 0.02 0.00 0.08 0.10 -5.00 117.98 118.01 2qqz s PHE 75 Ca 0.03 0.58 -0.25 0.00 0.12 0.00 0.00 56.93 57.41 2qqz s PHE 75 Cb -0.13 -2.02 -0.05 0.00 -0.57 0.00 0.00 43.02 40.25 2qqz s PHE 75 CO -0.11 0.67 0.77 -0.47 -0.10 0.00 0.00 175.22 175.98 2qqz s TYR 76 N -0.87 3.70 -0.08 0.36 5.04 -1.26 -4.32 117.35 119.93 2qqz s TYR 76 Ca 0.16 1.45 0.03 0.00 -2.44 0.00 0.00 57.07 56.26 2qqz s TYR 76 Cb -0.13 -2.84 0.01 0.00 0.35 0.00 0.00 41.96 39.36 2qqz s TYR 76 CO 0.05 0.22 -0.16 0.08 -1.34 0.00 0.00 175.55 174.40 2qqz s VAL 77 N 0.16 1.46 0.19 3.14 1.01 -1.26 -5.04 120.40 120.06 2qqz s VAL 77 Ca 0.39 -0.67 -0.30 0.00 0.00 0.00 0.00 61.98 61.41 2qqz s VAL 77 Cb -0.20 -1.30 -0.08 0.00 0.00 0.00 0.00 36.38 34.80 2qqz s VAL 77 CO 0.22 0.43 0.99 -0.76 0.00 0.00 0.00 175.10 175.98 2qqz s LEU 78 N 0.57 4.57 -1.18 3.92 1.43 -1.26 -4.17 118.68 122.55 2qqz s LEU 78 Ca -0.16 1.95 -0.02 0.00 -1.03 0.00 0.00 54.13 54.88 2qqz s LEU 78 Cb -0.17 -3.60 -0.02 0.00 0.03 0.00 0.00 46.19 42.44 2qqz s LEU 78 CO 0.05 -0.00 0.93 0.29 0.23 0.00 0.00 176.35 177.85 2qqz n LYS 79 N 2.02 -5.23 -0.30 1.70 4.76 -1.26 -4.76 118.16 115.09 2qqz n LYS 79 Ca 0.00 0.81 0.10 0.00 -2.87 0.00 0.00 58.31 56.35 2qqz n LYS 79 Cb 0.47 -5.71 0.32 0.00 -1.84 0.00 0.00 35.03 28.28 2qqz n LYS 79 CO 0.00 0.00 0.00 0.97 -1.37 0.00 0.00 177.40 177.00 2qqz h ILE 80 N -1.71 0.87 -0.38 -0.18 2.10 -1.99 -1.80 117.51 114.42 2qqz h ILE 80 Ca -0.60 -0.28 -0.04 0.00 1.08 0.00 0.00 64.86 65.02 2qqz h ILE 80 Cb 1.34 -0.01 -0.02 0.00 -1.09 0.00 0.00 36.82 37.04 2qqz h ILE 80 CO 0.50 0.15 0.07 -0.78 -1.08 0.00 0.00 178.15 177.00 2qqz h ASP 81 N 0.81 0.61 -0.25 2.19 1.82 -1.96 0.97 116.42 120.61 2qqz h ASP 81 Ca 0.46 -0.26 0.02 0.00 -0.39 0.00 0.00 57.03 56.87 2qqz h ASP 81 Cb 0.61 -0.16 -0.03 0.00 0.68 0.00 0.00 39.33 40.44 2qqz h ASP 81 CO -0.23 0.71 0.09 -0.08 -1.61 0.00 0.00 179.24 178.12 2qqz h GLU 82 N 0.48 0.20 -0.44 0.28 4.81 -1.72 -1.59 114.58 116.60 2qqz h GLU 82 Ca 0.12 -0.01 0.05 0.00 -0.13 0.00 0.00 59.36 59.39 2qqz h GLU 82 Cb 0.36 -0.05 -0.05 0.00 0.63 0.00 0.00 28.75 29.64 2qqz h GLU 82 CO 0.01 0.13 0.18 0.35 -0.73 0.00 0.00 179.01 178.95 2qqz h PHE 83 N 0.21 0.32 -0.51 0.92 3.57 -1.06 -1.92 116.94 118.46 2qqz h PHE 83 Ca 0.11 0.02 0.03 0.00 3.53 0.00 0.00 57.97 61.66 2qqz h PHE 83 Cb 0.07 -0.08 -0.04 0.00 2.79 0.00 0.00 35.95 38.70 2qqz h PHE 83 CO -0.12 0.13 0.29 -0.22 -2.23 0.00 0.00 178.31 176.15 2qqz h LYS 84 N 0.36 0.55 -0.37 1.11 3.64 -0.38 -1.51 116.57 119.96 2qqz h LYS 84 Ca 0.20 -0.03 -0.06 0.00 -1.27 0.00 0.00 60.65 59.49 2qqz h LYS 84 Cb 0.18 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 31.85 2qqz h LYS 84 CO -0.19 0.36 -0.01 1.96 -2.27 0.00 0.00 179.45 179.30 2qqz h GLN 85 N 0.56 0.59 -0.84 1.90 1.08 -1.01 -0.46 115.11 116.93 2qqz h GLN 85 Ca 0.21 -0.14 0.00 0.00 -1.45 0.00 0.00 58.65 57.28 2qqz h GLN 85 Cb 0.07 -0.08 -0.04 0.00 -0.05 0.00 0.00 27.48 27.38 2qqz h GLN 85 CO -0.12 0.63 0.53 0.93 -0.95 0.00 0.00 178.83 179.85 2qqz h GLU 86 N 0.56 1.13 -0.07 1.46 4.39 -0.79 0.16 114.58 121.42 2qqz h GLU 86 Ca 0.12 -0.08 -0.01 0.00 0.34 0.00 0.00 59.36 59.72 2qqz h GLU 86 Cb 0.38 -0.25 -0.00 0.00 -0.10 0.00 0.00 28.75 28.78 2qqz h GLU 86 CO 0.01 0.77 -0.01 -0.07 -1.16 0.00 0.00 179.01 178.55 2qqz h LEU 87 N 1.15 0.12 -0.52 1.33 3.38 -0.40 -2.89 115.31 117.49 2qqz h LEU 87 Ca 0.31 -0.35 0.01 0.00 0.09 0.00 0.00 57.88 57.94 2qqz h LEU 87 Cb -0.09 -0.03 -0.03 0.00 0.09 0.00 0.00 40.66 40.60 2qqz h LEU 87 CO -0.06 0.44 0.34 0.40 0.09 0.00 0.00 178.44 179.64 2qqz h ILE 88 N -0.20 1.12 -0.97 1.22 2.04 -0.91 -0.55 117.51 119.26 2qqz h ILE 88 Ca 0.02 -0.23 0.18 0.00 1.00 0.00 0.00 64.86 65.82 2qqz h ILE 88 Cb 0.38 0.37 -0.09 0.00 -0.74 0.00 0.00 36.82 36.75 2qqz h ILE 88 CO 0.01 0.12 0.61 0.11 0.00 0.00 0.00 178.15 179.00 2qqz h LYS 89 N 0.68 0.69 -0.40 2.37 1.57 -0.74 -1.06 116.57 119.68 2qqz h LYS 89 Ca 0.19 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.93 2qqz h LYS 89 Cb -0.06 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 32.09 2qqz h LYS 89 CO -0.05 0.45 0.00 1.04 -0.57 0.00 0.00 179.45 180.32 2qqz n GLN 90 N -4.65 1.71 -0.88 3.15 6.02 -0.30 -4.88 117.38 117.55 2qqz n GLN 90 Ca 0.21 -0.86 0.00 0.00 -0.01 0.00 0.00 57.00 56.33 2qqz n GLN 90 Cb 0.56 -1.33 0.00 0.00 1.02 0.00 0.00 30.24 30.49 2qqz n GLN 90 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2qqz n GLY 91 N 0.69 0.75 3.73 1.08 0.00 -0.40 -5.01 105.19 106.03 2qqz n GLY 91 Ca 0.08 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.69 2qqz n GLY 91 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2qqz s ILE 92 N -2.91 3.71 -0.11 -0.61 -1.09 -0.68 -5.00 121.20 114.51 2qqz s ILE 92 Ca 0.00 1.39 -0.25 0.00 -2.23 0.00 0.00 60.65 59.56 2qqz s ILE 92 Cb 0.00 -3.89 -0.03 0.00 -1.58 0.00 0.00 42.46 36.97 2qqz s ILE 92 CO 0.00 0.20 0.79 -0.70 -1.23 0.00 0.00 174.94 174.00 2qqz s GLU 93 N 0.04 4.38 0.12 2.79 2.12 -1.26 -4.16 118.70 122.74 2qqz s GLU 93 Ca 0.54 0.99 0.10 0.00 0.36 0.00 0.00 54.97 56.96 2qqz s GLU 93 Cb -0.31 -3.51 -0.04 0.00 0.26 0.00 0.00 34.13 30.53 2qqz s GLU 93 CO 0.35 -0.13 -0.21 0.14 -0.54 0.00 0.00 175.26 174.87 2qqz s VAL 94 N 1.44 2.63 -0.24 3.70 -7.23 -1.26 -4.56 120.40 114.87 2qqz s VAL 94 Ca 0.39 -1.59 0.01 0.00 -1.81 0.00 0.00 61.98 58.98 2qqz s VAL 94 Cb -0.18 -2.19 0.06 0.00 0.56 0.00 0.00 36.38 34.64 2qqz s VAL 94 CO 0.17 0.10 -0.04 -0.63 -0.31 0.00 0.00 175.10 174.39 2qqz s ILE 95 N -1.11 1.52 0.58 -0.62 1.01 0.29 -4.94 121.20 117.93 2qqz s ILE 95 Ca 0.16 -1.26 -0.18 0.00 0.00 0.00 0.00 60.65 59.37 2qqz s ILE 95 Cb -0.10 -1.81 -0.04 0.00 0.01 0.00 0.00 42.46 40.51 2qqz s ILE 95 CO 0.08 -0.15 1.13 -1.81 0.00 0.00 0.00 174.94 174.20 2qqz s ASP 96 N 1.39 5.49 -0.05 3.58 1.01 -1.26 -0.74 116.67 126.09 2qqz s ASP 96 Ca -0.05 2.16 -0.02 0.00 0.71 0.00 0.00 52.55 55.35 2qqz s ASP 96 Cb -0.19 -2.58 0.04 0.00 1.01 0.00 0.00 42.92 41.20 2qqz s ASP 96 CO -0.07 -1.38 0.10 -0.62 0.21 0.00 0.00 175.17 173.41 2qqz s ASP 97 N -1.95 0.32 0.00 0.27 3.68 -0.73 -4.89 116.67 113.36 2qqz s ASP 97 Ca 0.72 0.19 0.10 0.00 2.13 0.00 0.00 52.55 55.69 2qqz s ASP 97 Cb -0.24 0.07 0.25 0.00 -1.45 0.00 0.00 42.92 41.55 2qqz s ASP 97 CO 0.31 -0.18 1.16 1.41 0.13 0.00 0.00 175.17 178.01 2qqz n HIS 98 N 4.60 0.35 0.01 -5.34 8.25 -1.26 -4.03 115.22 117.80 2qqz n HIS 98 Ca -0.19 -0.41 0.04 0.00 -0.26 0.00 0.00 57.72 56.90 2qqz n HIS 98 Cb 0.50 -0.02 0.43 0.00 1.12 0.00 0.00 29.99 32.02 2qqz n HIS 98 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2qqz h ALA 99 N 1.89 1.71 -2.78 -1.41 0.00 -1.96 -3.38 119.26 113.33 2qqz h ALA 99 Ca 0.00 -0.03 -0.69 0.00 0.00 0.00 0.00 54.91 54.19 2qqz h ALA 99 Cb 0.66 -0.16 -0.22 0.00 0.00 0.00 0.00 17.79 18.08 2qqz h ALA 99 CO 0.00 0.27 -0.51 0.50 0.00 0.00 0.00 179.25 179.50 2qqz s ARG 100 N -5.46 3.25 0.39 0.00 3.52 -1.26 -5.01 118.95 114.38 2qqz s ARG 100 Ca -0.08 -0.79 0.23 0.00 -0.13 0.00 0.00 55.73 54.96 2qqz s ARG 100 Cb 0.17 -3.71 0.35 0.00 -1.56 0.00 0.00 34.95 30.21 2qqz s ARG 100 CO 0.73 -0.51 1.56 -1.00 -0.81 0.00 0.00 175.30 175.28 2qqz h PRO 101 N 8.43 0.00 -0.04 5.12 0.13 -1.98 -3.17 132.00 140.49 2qqz h PRO 101 Ca -0.30 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.83 2qqz h PRO 101 Cb 1.14 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.27 2qqz h PRO 101 CO 0.64 0.00 0.00 -0.40 -0.23 0.00 0.00 178.00 178.01 2qqz n ASP 102 N -2.95 1.10 -3.83 1.44 5.75 -1.26 -4.90 116.55 111.89 2qqz n ASP 102 Ca 0.04 -1.43 -0.13 0.00 -0.01 0.00 0.00 54.79 53.27 2qqz n ASP 102 Cb 0.52 -0.02 -0.14 0.00 -1.03 0.00 0.00 41.12 40.45 2qqz n ASP 102 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 2qqz s VAL 103 N -1.96 -0.01 -0.19 2.12 1.01 -1.20 -1.51 120.40 118.66 2qqz s VAL 103 Ca 0.38 0.04 -0.15 0.00 0.00 0.00 0.00 61.98 62.26 2qqz s VAL 103 Cb 0.20 -0.11 -0.04 0.00 0.00 0.00 0.00 36.38 36.43 2qqz s VAL 103 CO 0.32 0.02 0.36 -0.63 0.00 0.00 0.00 175.10 175.17 2qqz s ILE 104 N 0.27 5.24 0.06 2.22 1.01 0.52 -4.82 121.20 125.70 2qqz s ILE 104 Ca -0.02 0.65 -0.10 0.00 0.00 0.00 0.00 60.65 61.17 2qqz s ILE 104 Cb -0.03 -3.69 0.01 0.00 0.01 0.00 0.00 42.46 38.75 2qqz s ILE 104 CO -0.01 0.30 0.22 0.00 0.00 0.00 0.00 174.94 175.45 2qqz s ARG 105 N 1.01 0.79 0.13 2.79 1.70 -1.26 -0.83 118.95 123.27 2qqz s ARG 105 Ca 0.18 -0.74 -0.10 0.00 -0.47 0.00 0.00 55.73 54.60 2qqz s ARG 105 Cb -0.14 0.33 0.00 0.00 -0.57 0.00 0.00 34.95 34.57 2qqz s ARG 105 CO 0.07 -0.25 0.27 -0.59 -1.08 0.00 0.00 175.30 173.72 2qqz s PHE 106 N -3.12 0.18 0.14 5.89 -0.12 -0.53 -1.78 117.98 118.64 2qqz s PHE 106 Ca -0.01 -0.57 0.09 0.00 -0.05 0.00 0.00 56.93 56.40 2qqz s PHE 106 Cb 0.01 0.01 -0.04 0.00 -0.63 0.00 0.00 43.02 42.37 2qqz s PHE 106 CO -0.07 -0.65 -0.18 0.71 -0.05 0.00 0.00 175.22 174.98 2qqz s TYR 107 N -3.89 2.50 0.20 3.49 2.02 0.08 -1.27 117.35 120.47 2qqz s TYR 107 Ca 0.09 -0.28 0.00 0.00 -0.37 0.00 0.00 57.07 56.52 2qqz s TYR 107 Cb 0.04 -1.30 -0.04 0.00 -0.40 0.00 0.00 41.96 40.25 2qqz s TYR 107 CO -0.07 0.41 0.08 0.14 -1.57 0.00 0.00 175.55 174.55 2qqz s VAL 108 N -1.27 0.32 -0.10 0.71 -7.23 -0.61 -0.55 120.40 111.68 2qqz s VAL 108 Ca 0.19 -1.98 -0.01 0.00 -1.81 0.00 0.00 61.98 58.37 2qqz s VAL 108 Cb -0.10 -2.38 -0.03 0.00 0.56 0.00 0.00 36.38 34.43 2qqz s VAL 108 CO 0.10 -0.18 -0.04 -0.44 -0.31 0.00 0.00 175.10 174.23 2qqz s SER 109 N -3.19 4.84 1.13 4.85 0.01 -1.26 -0.85 113.70 119.23 2qqz s SER 109 Ca 0.33 -0.01 -0.18 0.00 1.31 0.00 0.00 55.95 57.40 2qqz s SER 109 Cb 0.07 -1.43 0.26 0.00 0.21 0.00 0.00 66.02 65.13 2qqz s SER 109 CO 0.09 0.31 1.16 1.51 0.41 0.00 0.00 173.24 176.72 2qqz s ASP 110 N -0.48 1.58 0.24 2.44 1.47 0.01 -4.87 116.67 117.06 2qqz s ASP 110 Ca 0.08 0.58 0.18 0.00 1.18 0.00 0.00 52.55 54.57 2qqz s ASP 110 Cb -0.12 -0.80 0.92 0.00 -0.34 0.00 0.00 42.92 42.57 2qqz s ASP 110 CO 0.02 -3.71 1.55 -2.65 0.68 0.00 0.00 175.17 171.06 2qqz n PRO 111 N -4.48 0.12 0.00 2.11 -0.02 -1.26 -1.92 135.00 129.55 2qqz n PRO 111 Ca 0.13 0.55 0.09 0.00 -2.02 0.00 0.00 63.50 62.26 2qqz n PRO 111 Cb 0.59 -1.84 0.02 0.00 -0.02 0.00 0.00 33.50 32.24 2qqz n PRO 111 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 2qqz n PHE 112 N -2.09 0.00 0.00 6.00 3.72 -1.26 -4.95 117.46 118.88 2qqz n PHE 112 Ca -0.00 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 2qqz n PHE 112 Cb 0.07 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.61 2qqz n PHE 112 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2qqz n GLY 113 N 1.23 0.62 3.72 1.37 0.00 -0.81 -4.51 105.19 106.81 2qqz n GLY 113 Ca 0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.69 2qqz n GLY 113 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2qqz s ASN 114 N -2.59 6.93 0.15 1.61 0.02 -1.26 -4.54 114.94 115.26 2qqz s ASN 114 Ca 0.00 2.25 -0.30 0.00 -1.02 0.00 0.00 52.86 53.79 2qqz s ASN 114 Cb 0.00 -2.59 -0.07 0.00 0.02 0.00 0.00 41.25 38.61 2qqz s ASN 114 CO 0.00 -0.55 1.07 -0.60 0.02 0.00 0.00 177.10 177.04 2qqz s ARG 115 N 0.72 4.61 -0.06 -0.60 3.52 -0.00 -0.81 118.95 126.33 2qqz s ARG 115 Ca 0.60 1.65 0.05 0.00 -0.13 0.00 0.00 55.73 57.90 2qqz s ARG 115 Cb -0.34 -3.31 -0.00 0.00 -1.56 0.00 0.00 34.95 29.74 2qqz s ARG 115 CO 0.32 0.09 -0.21 0.42 -0.81 0.00 0.00 175.30 175.11 2qqz s ILE 116 N -0.11 1.74 -0.11 4.11 -1.09 -0.03 -4.42 121.20 121.30 2qqz s ILE 116 Ca 0.49 -0.88 -0.04 0.00 -2.23 0.00 0.00 60.65 57.99 2qqz s ILE 116 Cb -0.28 -1.50 -0.04 0.00 -1.58 0.00 0.00 42.46 39.07 2qqz s ILE 116 CO 0.33 0.49 0.05 -0.70 -1.23 0.00 0.00 174.94 173.89 2qqz s GLU 117 N 0.07 3.26 0.31 2.79 2.12 -0.73 -1.57 118.70 124.95 2qqz s GLU 117 Ca -0.07 -0.31 0.10 0.00 0.36 0.00 0.00 54.97 55.05 2qqz s GLU 117 Cb -0.14 -2.97 -0.05 0.00 0.26 0.00 0.00 34.13 31.22 2qqz s GLU 117 CO 0.04 0.67 -0.09 -0.06 -0.54 0.00 0.00 175.26 175.28 2qqz s PHE 118 N -0.76 2.43 -0.12 5.30 0.08 -0.40 -0.72 117.98 123.79 2qqz s PHE 118 Ca 0.12 -0.39 -0.30 0.00 0.12 0.00 0.00 56.93 56.48 2qqz s PHE 118 Cb -0.12 -1.25 0.10 0.00 -0.57 0.00 0.00 43.02 41.18 2qqz s PHE 118 CO 0.03 0.61 0.86 -2.00 -0.10 0.00 0.00 175.22 174.62 2qqz s GLU 120 N -3.61 0.79 0.45 0.44 2.12 -0.01 -1.45 118.70 117.43 2qqz s GLU 120 Ca 0.32 0.23 -0.23 0.00 0.36 0.00 0.00 54.97 55.65 2qqz s GLU 120 Cb -0.02 0.37 -0.08 0.00 0.26 0.00 0.00 34.13 34.67 2qqz s GLU 120 CO 0.17 -0.24 1.16 -0.80 -0.54 0.00 0.00 175.26 175.01 2qqz s ASN 121 N -1.05 6.22 0.00 -1.70 0.01 -1.26 -0.35 114.94 116.81 2qqz s ASN 121 Ca -0.05 2.29 0.31 0.00 -0.71 0.00 0.00 52.86 54.70 2qqz s ASN 121 Cb -0.01 -2.60 1.85 0.00 0.41 0.00 0.00 41.25 40.90 2qqz s ASN 121 CO 0.05 -0.88 2.17 0.29 -1.51 0.00 0.00 177.10 177.22