#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2w2w s GLN 8 N 0.00 4.05 -0.29 -1.58 2.00 -1.26 -5.05 119.66 117.53 2w2w s GLN 8 Ca 0.00 -0.26 -0.26 0.00 -2.00 0.00 0.00 55.36 52.84 2w2w s GLN 8 Cb 0.00 -3.33 0.19 0.00 0.80 0.00 0.00 33.01 30.67 2w2w s GLN 8 CO 0.00 0.33 1.40 -1.14 -0.50 0.00 0.00 175.29 175.38 2w2w s GLN 9 N 0.24 0.09 0.00 1.67 -0.44 -1.26 -1.50 119.66 118.45 2w2w s GLN 9 Ca 0.07 0.07 0.00 0.00 -2.50 0.00 0.00 55.36 53.00 2w2w s GLN 9 Cb -0.11 0.04 0.00 0.00 -1.64 0.00 0.00 33.01 31.30 2w2w s GLN 9 CO -0.01 -0.02 0.00 0.41 0.50 0.00 0.00 175.29 176.18 2w2w n GLY 10 N 1.27 -1.26 3.81 2.59 0.00 -0.77 -5.02 105.19 105.81 2w2w n GLY 10 Ca -0.07 -0.86 -0.35 0.00 0.00 0.00 0.00 46.02 44.74 2w2w n GLY 10 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2w2w s GLU 11 N -0.29 4.30 0.05 1.61 -1.05 -1.26 -1.39 118.70 120.67 2w2w s GLU 11 Ca 0.00 1.06 -0.01 0.00 -0.15 0.00 0.00 54.97 55.86 2w2w s GLU 11 Cb 0.00 -2.53 -0.04 0.00 -0.44 0.00 0.00 34.13 31.12 2w2w s GLU 11 CO 0.00 0.17 -0.02 -0.51 0.95 0.00 0.00 175.26 175.85 2w2w s LEU 12 N -2.60 2.42 0.07 1.83 1.43 0.13 -4.92 118.68 117.05 2w2w s LEU 12 Ca 0.54 -0.97 -0.12 0.00 -1.03 0.00 0.00 54.13 52.55 2w2w s LEU 12 Cb -0.13 0.24 -0.06 0.00 0.03 0.00 0.00 46.19 46.27 2w2w s LEU 12 CO 0.18 -0.60 0.44 -0.31 0.23 0.00 0.00 176.35 176.29 2w2w s TYR 13 N -3.85 3.63 0.04 0.29 1.51 0.54 -0.92 117.35 118.59 2w2w s TYR 13 Ca 0.06 0.91 0.07 0.00 -1.01 0.00 0.00 57.07 57.10 2w2w s TYR 13 Cb 0.07 -2.24 -0.02 0.00 -0.11 0.00 0.00 41.96 39.66 2w2w s TYR 13 CO -0.10 0.53 -0.19 -1.64 -1.11 0.00 0.00 175.55 173.05 2w2w s MET 14 N -1.69 1.29 -0.38 -0.62 -1.94 0.52 -1.39 119.30 115.09 2w2w s MET 14 Ca 0.32 -0.86 -0.20 0.00 -1.71 0.00 0.00 55.69 53.23 2w2w s MET 14 Cb -0.15 -1.36 0.01 0.00 2.01 0.00 0.00 34.83 35.33 2w2w s MET 14 CO 0.17 0.35 0.62 -0.46 -0.01 0.00 0.00 175.02 175.69 2w2w s TRP 15 N -0.77 3.13 -0.49 -0.03 -0.00 -0.72 -1.27 118.94 118.80 2w2w s TRP 15 Ca 0.06 0.22 -0.21 0.00 -0.00 0.00 0.00 56.10 56.17 2w2w s TRP 15 Cb -0.08 -3.17 0.04 0.00 -0.00 0.00 0.00 33.47 30.26 2w2w s TRP 15 CO 0.01 -0.68 0.72 0.34 -0.00 0.00 0.00 176.95 177.34 2w2w s ASP 16 N 1.85 6.29 0.00 5.86 2.15 -0.85 -4.75 116.67 127.22 2w2w s ASP 16 Ca 0.23 -0.56 0.11 0.00 0.43 0.00 0.00 52.55 52.76 2w2w s ASP 16 Cb -0.14 -2.34 0.61 0.00 -0.30 0.00 0.00 42.92 40.75 2w2w s ASP 16 CO 0.16 -0.94 1.12 -1.54 -0.17 0.00 0.00 175.17 173.79 2w2w n SER 17 N 6.55 0.00 -0.01 -0.34 3.41 -1.26 -1.67 113.62 120.29 2w2w n SER 17 Ca -0.03 -0.21 -0.01 0.00 -0.26 0.00 0.00 58.87 58.37 2w2w n SER 17 Cb 0.47 -0.08 -0.00 0.00 -0.26 0.00 0.00 64.21 64.34 2w2w n SER 17 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 2w2w n ILE 18 N -1.08 0.15 1.13 -1.33 -0.00 -1.26 -4.39 119.36 112.58 2w2w n ILE 18 Ca 0.07 0.47 0.09 0.00 -0.00 0.00 0.00 62.75 63.38 2w2w n ILE 18 Cb 0.05 -1.59 0.54 0.00 -0.00 0.00 0.00 39.64 38.64 2w2w n ILE 18 CO 0.00 0.00 0.00 0.47 -0.00 0.00 0.00 176.55 177.02 2w2w n ASP 19 N -2.57 0.00 -3.99 4.38 10.43 -1.22 -4.85 116.55 118.73 2w2w n ASP 19 Ca -0.01 -0.56 -0.28 0.00 2.57 0.00 0.00 54.79 56.52 2w2w n ASP 19 Cb 0.04 -0.00 -0.02 0.00 1.84 0.00 0.00 41.12 42.97 2w2w n ASP 19 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 2w2w n GLN 20 N -1.00 -3.51 -3.97 -1.24 1.13 -0.67 -4.96 117.38 103.15 2w2w n GLN 20 Ca 0.14 0.42 -0.08 0.00 -1.94 0.00 0.00 57.00 55.54 2w2w n GLN 20 Cb 0.06 -4.74 -0.09 0.00 0.11 0.00 0.00 30.24 25.59 2w2w n GLN 20 CO 0.00 0.00 0.00 0.15 -1.44 0.00 0.00 177.06 175.77 2w2w s LYS 21 N -6.60 0.69 0.10 -1.09 -0.14 -1.21 -5.02 119.74 106.47 2w2w s LYS 21 Ca 0.19 -1.04 -0.19 0.00 -1.36 0.00 0.00 55.97 53.57 2w2w s LYS 21 Cb -0.10 0.26 -0.07 0.00 -1.68 0.00 0.00 37.83 36.24 2w2w s LYS 21 CO 0.89 -0.18 0.59 -1.58 -0.76 0.00 0.00 175.35 174.31 2w2w s TRP 22 N -3.67 3.76 0.06 3.18 0.52 -1.26 -2.01 118.94 119.52 2w2w s TRP 22 Ca 0.04 1.25 0.05 0.00 0.02 0.00 0.00 56.10 57.46 2w2w s TRP 22 Cb 0.05 -2.49 -0.03 0.00 -1.15 0.00 0.00 33.47 29.85 2w2w s TRP 22 CO -0.09 0.53 -0.13 0.95 0.02 0.00 0.00 176.95 178.22 2w2w s THR 23 N -1.22 1.04 -0.25 2.01 -4.23 -0.40 -4.93 115.64 107.66 2w2w s THR 23 Ca 0.32 -1.24 -0.17 0.00 -1.18 0.00 0.00 61.69 59.42 2w2w s THR 23 Cb -0.18 -1.00 -0.03 0.00 1.34 0.00 0.00 72.50 72.62 2w2w s THR 23 CO 0.19 -0.22 0.48 -0.13 -0.54 0.00 0.00 174.62 174.40 2w2w s ARG 24 N -1.66 4.08 0.04 3.99 0.52 -1.26 -0.35 118.95 124.31 2w2w s ARG 24 Ca -0.03 0.27 0.06 0.00 -0.52 0.00 0.00 55.73 55.51 2w2w s ARG 24 Cb -0.10 -3.63 -0.02 0.00 0.52 0.00 0.00 34.95 31.72 2w2w s ARG 24 CO 0.02 -0.28 -0.17 -1.01 0.02 0.00 0.00 175.30 173.88 2w2w s HIS 25 N 2.09 1.47 -0.15 -0.53 3.76 -0.09 -0.98 115.29 120.86 2w2w s HIS 25 Ca 0.20 -0.36 -0.22 0.00 -0.15 0.00 0.00 55.06 54.53 2w2w s HIS 25 Cb -0.16 -0.87 -0.03 0.00 1.11 0.00 0.00 32.58 32.63 2w2w s HIS 25 CO 0.09 0.06 0.65 0.12 -0.85 0.00 0.00 174.74 174.82 2w2w s PHE 26 N -0.83 3.45 0.17 1.40 5.36 -1.26 -0.69 117.98 125.57 2w2w s PHE 26 Ca 0.04 1.04 0.08 0.00 -0.96 0.00 0.00 56.93 57.14 2w2w s PHE 26 Cb -0.08 -2.80 -0.04 0.00 -0.34 0.00 0.00 43.02 39.76 2w2w s PHE 26 CO 0.02 -0.08 -0.17 0.00 -1.46 0.00 0.00 175.22 173.53 2w2w s ALA 28 N -2.27 -0.59 -0.20 0.00 0.00 -0.81 -1.86 121.76 116.03 2w2w s ALA 28 Ca 0.16 -0.03 0.01 0.00 0.00 0.00 0.00 51.96 52.11 2w2w s ALA 28 Cb -0.04 0.26 0.03 0.00 0.00 0.00 0.00 23.12 23.36 2w2w s ALA 28 CO 0.06 -0.36 -0.16 0.42 0.00 0.00 0.00 175.76 175.72 2w2w s ILE 29 N -2.28 1.97 -0.02 0.00 1.01 -0.56 -0.96 121.20 120.36 2w2w s ILE 29 Ca -0.07 -1.06 0.04 0.00 0.00 0.00 0.00 60.65 59.56 2w2w s ILE 29 Cb -0.02 -1.88 -0.01 0.00 0.01 0.00 0.00 42.46 40.56 2w2w s ILE 29 CO -0.02 0.36 -0.12 0.00 0.00 0.00 0.00 174.94 175.16 2w2w s ALA 30 N 1.29 1.07 0.00 9.38 0.00 -0.81 -4.29 121.76 128.40 2w2w s ALA 30 Ca 0.01 -0.52 0.00 0.00 0.00 0.00 0.00 51.96 51.45 2w2w s ALA 30 Cb -0.15 -0.31 0.00 0.00 0.00 0.00 0.00 23.12 22.66 2w2w s ALA 30 CO -0.10 0.24 0.00 -0.25 0.00 0.00 0.00 175.76 175.64 2w2w n ASP 31 N 2.92 0.00 -1.23 0.00 10.43 -1.26 -0.71 116.55 126.71 2w2w n ASP 31 Ca -0.15 0.00 -0.07 0.00 2.57 0.00 0.00 54.79 57.13 2w2w n ASP 31 Cb 0.55 0.00 0.13 0.00 1.84 0.00 0.00 41.12 43.64 2w2w n ASP 31 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 2w2w n ALA 32 N 11.88 4.31 -2.72 2.24 0.00 -1.26 -5.02 120.51 129.94 2w2w n ALA 32 Ca 0.00 -3.48 -0.28 0.00 0.00 0.00 0.00 53.44 49.68 2w2w n ALA 32 Cb 0.00 -0.41 -0.16 0.00 0.00 0.00 0.00 19.45 18.88 2w2w n ALA 32 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.50 175.91 2w2w s LYS 33 N -3.39 1.96 -0.23 0.00 0.00 0.12 -0.98 119.74 117.21 2w2w s LYS 33 Ca 0.44 -0.73 -0.04 0.00 0.00 0.00 0.00 55.97 55.65 2w2w s LYS 33 Cb 0.39 -1.74 0.00 0.00 0.00 0.00 0.00 37.83 36.49 2w2w s LYS 33 CO -0.02 0.34 -0.03 -1.17 0.00 0.00 0.00 175.35 174.46 2w2w s LEU 34 N -0.17 3.05 -0.00 2.77 0.20 -0.02 -1.93 118.68 122.58 2w2w s LEU 34 Ca -0.00 -0.52 0.00 0.00 0.69 0.00 0.00 54.13 54.29 2w2w s LEU 34 Cb -0.11 -1.74 -0.04 0.00 -0.43 0.00 0.00 46.19 43.88 2w2w s LEU 34 CO 0.02 -0.06 0.06 -0.94 -0.29 0.00 0.00 176.35 175.13 2w2w s SER 35 N 1.45 5.50 -0.01 3.68 1.04 -0.13 -0.72 113.70 124.51 2w2w s SER 35 Ca 0.04 0.10 0.01 0.00 0.48 0.00 0.00 55.95 56.58 2w2w s SER 35 Cb -0.15 -1.54 0.01 0.00 0.10 0.00 0.00 66.02 64.44 2w2w s SER 35 CO -0.03 0.27 -0.02 0.72 0.98 0.00 0.00 173.24 175.16 2w2w s PHE 36 N -1.16 0.31 0.70 5.02 -0.12 -0.75 -1.93 117.98 120.04 2w2w s PHE 36 Ca 0.22 -0.04 -0.07 0.00 -0.05 0.00 0.00 56.93 56.99 2w2w s PHE 36 Cb -0.12 -0.27 0.15 0.00 -0.63 0.00 0.00 43.02 42.15 2w2w s PHE 36 CO 0.13 -0.05 0.95 -1.13 -0.05 0.00 0.00 175.22 175.07 2w2w n SER 37 N 3.40 0.57 -4.85 1.98 3.41 -0.74 -1.86 113.62 115.54 2w2w n SER 37 Ca -0.18 -1.65 -0.30 0.00 -0.26 0.00 0.00 58.87 56.49 2w2w n SER 37 Cb 0.56 -0.68 0.07 0.00 -0.26 0.00 0.00 64.21 63.89 2w2w n SER 37 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 2w2w s ASP 38 N -4.64 4.96 -0.50 4.04 1.01 -0.88 -4.61 116.67 116.04 2w2w s ASP 38 Ca 0.58 1.18 -0.36 0.00 0.71 0.00 0.00 52.55 54.65 2w2w s ASP 38 Cb -0.02 -1.93 -0.15 0.00 1.01 0.00 0.00 42.92 41.84 2w2w s ASP 38 CO 0.39 -1.66 2.27 -0.67 0.21 0.00 0.00 175.17 175.72 2w2w n ASP 39 N -3.21 1.50 0.00 0.27 -0.08 -1.26 -4.64 116.55 109.12 2w2w n ASP 39 Ca 0.07 0.37 0.09 0.00 -1.51 0.00 0.00 54.79 53.81 2w2w n ASP 39 Cb 0.57 -1.14 0.53 0.00 2.34 0.00 0.00 41.12 43.42 2w2w n ASP 39 CO 0.00 0.00 0.00 2.30 0.12 0.00 0.00 177.20 179.62 2w2w n ILE 40 N 7.13 0.15 -0.01 5.18 -5.35 -0.15 -1.65 119.36 124.66 2w2w n ILE 40 Ca 0.48 0.04 -0.08 0.00 -0.27 0.00 0.00 62.75 62.92 2w2w n ILE 40 Cb 0.15 -0.74 -0.14 0.00 -1.74 0.00 0.00 39.64 37.18 2w2w n ILE 40 CO 0.00 0.00 0.00 -0.33 -1.76 0.00 0.00 176.55 174.46 2w2w h GLU 41 N 0.00 0.00 0.00 6.28 5.08 -1.86 -3.51 114.58 120.57 2w2w h GLU 41 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2w2w h GLU 41 Cb 0.06 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.31 2w2w h GLU 41 CO 0.00 0.53 0.00 1.04 -1.00 0.00 0.00 179.01 179.58 2w2w n GLN 42 N -3.07 0.00 0.00 2.33 6.02 -0.66 -5.20 117.38 116.81 2w2w n GLN 42 Ca -0.15 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.84 2w2w n GLN 42 Cb 1.04 0.00 0.00 0.00 1.02 0.00 0.00 30.24 32.30 2w2w n GLN 42 CO 0.00 0.00 0.00 1.47 -1.01 0.00 0.00 177.06 177.52 2w2w n LEU 50 N 0.00 0.00 -4.69 1.08 -0.00 -1.26 -5.09 117.00 107.03 2w2w n LEU 50 Ca 0.00 0.00 -0.36 0.00 -0.00 0.00 0.00 56.01 55.65 2w2w n LEU 50 Cb 0.00 0.00 -0.09 0.00 -0.00 0.00 0.00 43.42 43.33 2w2w n LEU 50 CO 0.00 0.00 -0.18 -0.83 -0.00 0.00 0.00 177.39 176.38 2w2w s GLY 51 N 0.00 2.01 0.15 1.47 0.00 -1.26 -5.11 107.32 104.58 2w2w s GLY 51 Ca 0.00 -0.78 0.05 0.00 0.00 0.00 0.00 44.72 43.99 2w2w s GLY 51 CO 0.00 0.24 0.08 -0.45 0.00 0.00 0.00 173.10 172.97 2w2w s SER 52 N 0.65 5.27 -0.03 1.64 0.15 -1.26 -5.00 113.70 115.13 2w2w s SER 52 Ca 0.07 -0.19 0.12 0.00 0.70 0.00 0.00 55.95 56.65 2w2w s SER 52 Cb -0.12 -1.31 0.38 0.00 -1.71 0.00 0.00 66.02 63.26 2w2w s SER 52 CO 0.01 0.10 1.28 -0.11 1.20 0.00 0.00 173.24 175.71 2w2w n LEU 53 N -0.08 2.48 -2.71 3.45 0.00 -1.26 -2.08 117.00 116.80 2w2w n LEU 53 Ca -0.09 -1.24 -0.07 0.00 0.00 0.00 0.00 56.01 54.60 2w2w n LEU 53 Cb 0.54 -0.34 0.09 0.00 0.00 0.00 0.00 43.42 43.71 2w2w n LEU 53 CO 0.42 0.53 0.46 0.00 0.00 0.00 0.00 177.39 178.79 2w2w n ARG 55 N 0.10 0.04 -3.53 0.00 1.74 -0.77 -4.75 116.66 109.48 2w2w n ARG 55 Ca -0.00 0.35 -0.14 0.00 -0.77 0.00 0.00 57.85 57.29 2w2w n ARG 55 Cb 0.74 -1.59 -0.05 0.00 -1.02 0.00 0.00 32.46 30.54 2w2w n ARG 55 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 2w2w s GLY 56 N -3.13 -0.45 -0.03 -0.13 0.00 -1.07 -5.03 107.32 97.48 2w2w s GLY 56 Ca 0.05 1.52 0.01 0.00 0.00 0.00 0.00 44.72 46.29 2w2w s GLY 56 CO 0.23 0.88 -0.02 -0.42 0.00 0.00 0.00 173.10 173.76 2w2w s ILE 57 N -1.51 0.35 -0.12 0.90 1.01 -1.26 -1.82 121.20 118.75 2w2w s ILE 57 Ca -0.05 -0.04 -0.01 0.00 0.00 0.00 0.00 60.65 60.56 2w2w s ILE 57 Cb -0.00 -0.40 -0.02 0.00 0.01 0.00 0.00 42.46 42.04 2w2w s ILE 57 CO 0.03 0.18 -0.09 -0.76 0.00 0.00 0.00 174.94 174.30 2w2w s LEU 58 N 0.85 3.00 -0.57 2.97 1.43 0.10 -4.95 118.68 121.51 2w2w s LEU 58 Ca -0.10 -0.18 -0.22 0.00 -1.03 0.00 0.00 54.13 52.60 2w2w s LEU 58 Cb -0.13 -1.68 0.06 0.00 0.03 0.00 0.00 46.19 44.47 2w2w s LEU 58 CO -0.01 0.22 0.83 -0.62 0.23 0.00 0.00 176.35 177.00 2w2w s ASP 59 N 0.04 6.25 0.57 2.29 -1.08 -1.26 -0.84 116.67 122.63 2w2w s ASP 59 Ca -0.02 -0.79 0.26 0.00 -0.52 0.00 0.00 52.55 51.47 2w2w s ASP 59 Cb -0.14 -2.37 1.64 0.00 -1.46 0.00 0.00 42.92 40.58 2w2w s ASP 59 CO 0.03 -1.17 2.20 -0.07 0.52 0.00 0.00 175.17 176.69 2w2w h LEU 60 N 10.59 0.00 -2.08 -1.34 3.38 -1.42 0.24 115.31 124.67 2w2w h LEU 60 Ca -0.28 0.00 0.05 0.00 0.09 0.00 0.00 57.88 57.75 2w2w h LEU 60 Cb 1.08 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.82 2w2w h LEU 60 CO 1.08 0.00 0.15 0.78 0.09 0.00 0.00 178.44 180.53 2w2w h ASN 61 N 0.00 0.00 0.66 -0.43 2.35 -1.89 -1.22 115.58 115.04 2w2w h ASN 61 Ca 0.02 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.77 2w2w h ASN 61 Cb 0.08 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.45 2w2w h ASN 61 CO -0.00 0.00 -0.64 0.35 -1.65 0.00 0.00 177.43 175.49 2w2w n THR 62 N -4.31 0.19 -3.83 2.81 -2.24 0.07 -4.96 114.28 102.01 2w2w n THR 62 Ca 0.02 -0.16 -0.23 0.00 -2.27 0.00 0.00 64.05 61.41 2w2w n THR 62 Cb 0.28 0.07 -0.05 0.00 -2.10 0.00 0.00 70.33 68.53 2w2w n THR 62 CO 0.00 0.00 0.00 -0.31 -0.57 0.00 0.00 175.07 174.19 2w2w s TYR 63 N -3.11 2.63 0.11 4.78 1.51 -0.46 -4.60 117.35 118.21 2w2w s TYR 63 Ca 0.08 -0.55 0.04 0.00 -1.01 0.00 0.00 57.07 55.63 2w2w s TYR 63 Cb 0.15 -2.07 -0.04 0.00 -0.11 0.00 0.00 41.96 39.89 2w2w s TYR 63 CO 0.72 0.01 -0.11 -0.80 -1.11 0.00 0.00 175.55 174.27 2w2w s ASN 64 N -4.03 1.56 -0.23 2.29 0.02 0.16 -4.94 114.94 109.76 2w2w s ASN 64 Ca 0.44 -0.83 -0.05 0.00 -1.02 0.00 0.00 52.86 51.40 2w2w s ASN 64 Cb 0.00 -0.00 -0.01 0.00 0.02 0.00 0.00 41.25 41.26 2w2w s ASN 64 CO 0.25 -0.26 -0.01 0.68 0.02 0.00 0.00 177.10 177.79 2w2w s VAL 65 N -2.50 3.58 0.09 1.60 -7.23 -1.26 -0.89 120.40 113.79 2w2w s VAL 65 Ca 0.07 -0.47 0.06 0.00 -1.81 0.00 0.00 61.98 59.84 2w2w s VAL 65 Cb -0.02 -2.67 -0.04 0.00 0.56 0.00 0.00 36.38 34.21 2w2w s VAL 65 CO 0.00 0.37 -0.08 -0.69 -0.31 0.00 0.00 175.10 174.39 2w2w s VAL 66 N 1.50 3.48 0.06 1.32 1.01 -0.40 -4.96 120.40 122.41 2w2w s VAL 66 Ca 0.05 -1.19 0.00 0.00 0.00 0.00 0.00 61.98 60.85 2w2w s VAL 66 Cb -0.15 -2.62 -0.04 0.00 0.00 0.00 0.00 36.38 33.57 2w2w s VAL 66 CO -0.02 0.14 0.20 -0.75 0.00 0.00 0.00 175.10 174.68 2w2w s LYS 67 N -2.15 3.40 -0.50 2.72 2.20 -1.26 -0.42 119.74 123.73 2w2w s LYS 67 Ca 0.22 -0.46 -0.06 0.00 -0.36 0.00 0.00 55.97 55.30 2w2w s LYS 67 Cb -0.11 -3.01 0.13 0.00 -1.51 0.00 0.00 37.83 33.32 2w2w s LYS 67 CO 0.14 0.60 0.34 0.00 -0.36 0.00 0.00 175.35 176.08 2w2w s ALA 68 N -1.51 3.40 0.14 3.13 0.00 -1.08 -4.94 121.76 120.89 2w2w s ALA 68 Ca 0.35 -2.72 -0.25 0.00 0.00 0.00 0.00 51.96 49.34 2w2w s ALA 68 Cb -0.13 -2.71 -0.01 0.00 0.00 0.00 0.00 23.12 20.27 2w2w s ALA 68 CO 0.28 -1.93 1.61 -1.35 0.00 0.00 0.00 175.76 174.37 2w2w h PRO 69 N 8.03 -0.35 0.00 0.00 0.11 -1.95 -0.06 132.00 137.78 2w2w h PRO 69 Ca -0.13 0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.00 2w2w h PRO 69 Cb 1.04 0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.23 2w2w h PRO 69 CO 0.78 -0.23 0.00 0.00 -0.21 0.00 0.00 178.00 178.34 2w2w n GLN 70 N -5.40 0.05 0.00 1.05 0.00 -1.26 -5.00 117.38 106.82 2w2w n GLN 70 Ca -0.03 0.32 0.00 0.00 0.00 0.00 0.00 57.00 57.29 2w2w n GLN 70 Cb 0.32 -1.60 0.00 0.00 0.00 0.00 0.00 30.24 28.97 2w2w n GLN 70 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2w2w n GLY 71 N -0.13 -1.76 3.58 2.61 0.00 -0.04 -4.97 105.19 104.48 2w2w n GLY 71 Ca 0.03 -1.53 -0.15 0.00 0.00 0.00 0.00 46.02 44.37 2w2w n GLY 71 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2w2w s LYS 72 N 0.00 0.88 -1.52 1.61 2.20 -1.00 -4.92 119.74 116.98 2w2w s LYS 72 Ca 0.00 0.53 -0.02 0.00 -0.36 0.00 0.00 55.97 56.12 2w2w s LYS 72 Cb 0.00 0.42 0.02 0.00 -1.51 0.00 0.00 37.83 36.76 2w2w s LYS 72 CO 0.00 -0.21 0.20 0.09 -0.36 0.00 0.00 175.35 175.08 2w2w n ASN 73 N 1.61 0.21 -0.30 1.43 3.02 -1.26 -0.97 115.26 119.01 2w2w n ASN 73 Ca -0.16 -1.17 -0.04 0.00 -0.03 0.00 0.00 54.58 53.18 2w2w n ASN 73 Cb 0.56 -2.14 -0.02 0.00 -0.61 0.00 0.00 39.78 37.58 2w2w n ASN 73 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2w2w n GLN 74 N -4.49 -0.96 -4.60 3.52 10.64 -1.26 -4.99 117.38 115.23 2w2w n GLN 74 Ca -0.28 0.48 -0.33 0.00 -1.83 0.00 0.00 57.00 55.04 2w2w n GLN 74 Cb 0.67 -4.34 -0.13 0.00 -0.86 0.00 0.00 30.24 25.58 2w2w n GLN 74 CO 0.00 0.00 0.00 0.15 -1.83 0.00 0.00 177.06 175.38 2w2w s LYS 75 N -1.71 3.52 0.17 2.61 -0.14 -0.14 -5.05 119.74 119.00 2w2w s LYS 75 Ca 0.00 -0.61 -0.05 0.00 -1.36 0.00 0.00 55.97 53.95 2w2w s LYS 75 Cb 0.00 -2.77 0.03 0.00 -1.68 0.00 0.00 37.83 33.42 2w2w s LYS 75 CO 0.00 0.23 1.44 0.77 -0.76 0.00 0.00 175.35 177.03 2w2w h SER 76 N 6.69 0.68 -3.66 2.83 0.02 -1.88 -2.65 113.55 115.58 2w2w h SER 76 Ca -0.28 -0.39 -0.63 0.00 -0.84 0.00 0.00 61.79 59.64 2w2w h SER 76 Cb 1.20 -0.20 -0.38 0.00 0.14 0.00 0.00 62.40 63.16 2w2w h SER 76 CO 0.59 1.14 -0.77 -0.36 -1.14 0.00 0.00 176.83 176.29 2w2w s PHE 77 N -3.88 2.86 0.03 3.45 0.08 -1.26 -4.39 117.98 114.88 2w2w s PHE 77 Ca -0.08 -2.19 0.02 0.00 0.12 0.00 0.00 56.93 54.80 2w2w s PHE 77 Cb 0.11 -2.00 -0.02 0.00 -0.57 0.00 0.00 43.02 40.54 2w2w s PHE 77 CO 0.86 -0.85 -0.07 0.14 -0.10 0.00 0.00 175.22 175.20 2w2w s VAL 78 N 1.23 0.46 0.24 -0.44 -7.23 -1.26 -1.58 120.40 111.82 2w2w s VAL 78 Ca -0.01 -0.98 0.11 0.00 -1.81 0.00 0.00 61.98 59.29 2w2w s VAL 78 Cb -0.19 -0.53 -0.05 0.00 0.56 0.00 0.00 36.38 36.17 2w2w s VAL 78 CO -0.08 -0.36 -0.20 0.72 -0.31 0.00 0.00 175.10 174.87 2w2w s PHE 79 N -1.28 2.17 -0.06 2.82 -0.71 -0.83 -2.65 117.98 117.44 2w2w s PHE 79 Ca -0.10 -0.38 0.03 0.00 -1.04 0.00 0.00 56.93 55.43 2w2w s PHE 79 Cb -0.09 -0.99 0.01 0.00 -1.21 0.00 0.00 43.02 40.74 2w2w s PHE 79 CO 0.00 0.58 -0.13 0.42 -1.34 0.00 0.00 175.22 174.75 2w2w s ILE 80 N -2.33 1.18 -0.70 -4.49 1.01 0.45 -1.84 121.20 114.48 2w2w s ILE 80 Ca 0.25 -0.52 -0.19 0.00 0.00 0.00 0.00 60.65 60.19 2w2w s ILE 80 Cb -0.05 -1.06 0.12 0.00 0.01 0.00 0.00 42.46 41.47 2w2w s ILE 80 CO 0.12 0.36 0.83 -0.76 0.00 0.00 0.00 174.94 175.49 2w2w s LEU 81 N 0.52 5.38 -0.17 2.97 1.02 -0.39 -1.27 118.68 126.74 2w2w s LEU 81 Ca -0.12 -1.67 -0.08 0.00 0.02 0.00 0.00 54.13 52.28 2w2w s LEU 81 Cb -0.15 -2.32 -0.04 0.00 0.02 0.00 0.00 46.19 43.70 2w2w s LEU 81 CO 0.03 -1.08 0.09 -1.83 0.02 0.00 0.00 176.35 173.59 2w2w s GLU 82 N 2.53 3.92 0.00 1.70 -1.05 -0.07 -1.94 118.70 123.79 2w2w s GLU 82 Ca 0.18 -0.27 0.00 0.00 -0.15 0.00 0.00 54.97 54.73 2w2w s GLU 82 Cb -0.18 -3.26 0.00 0.00 -0.44 0.00 0.00 34.13 30.26 2w2w s GLU 82 CO 0.02 0.38 0.02 -2.30 0.95 0.00 0.00 175.26 174.33 2w2w n PRO 83 N 3.21 0.00 -1.02 -4.83 -0.02 -1.26 -0.67 135.00 130.42 2w2w n PRO 83 Ca -0.17 0.00 -0.36 0.00 -2.02 0.00 0.00 63.50 60.95 2w2w n PRO 83 Cb 0.53 -0.21 0.04 0.00 -0.02 0.00 0.00 33.50 33.84 2w2w n PRO 83 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 2w2w n PRO 89 N -0.12 -0.02 -2.67 0.52 -0.02 -1.26 -4.80 135.00 126.62 2w2w n PRO 89 Ca 0.00 -0.00 -0.38 0.00 -2.02 0.00 0.00 63.50 61.10 2w2w n PRO 89 Cb 0.00 -1.08 -0.05 0.00 -0.02 0.00 0.00 33.50 32.34 2w2w n PRO 89 CO 0.00 0.00 0.00 -2.14 1.98 0.00 0.00 175.50 175.34 2w2w s PRO 90 N -2.03 4.56 -0.21 0.52 0.02 -1.26 -5.05 135.00 131.54 2w2w s PRO 90 Ca 0.44 1.48 -0.08 0.00 0.02 0.00 0.00 61.00 62.85 2w2w s PRO 90 Cb -0.22 -2.90 -0.04 0.00 0.02 0.00 0.00 34.50 31.36 2w2w s PRO 90 CO 0.80 0.23 0.09 0.08 -0.33 0.00 0.00 177.00 177.87 2w2w s VAL 91 N -1.47 4.89 -0.27 3.83 1.01 -0.82 -4.99 120.40 122.60 2w2w s VAL 91 Ca 0.49 0.01 -0.04 0.00 0.00 0.00 0.00 61.98 62.44 2w2w s VAL 91 Cb -0.23 -3.24 0.01 0.00 0.00 0.00 0.00 36.38 32.92 2w2w s VAL 91 CO 0.29 0.40 0.01 -1.61 0.00 0.00 0.00 175.10 174.19 2w2w s GLU 92 N 0.79 3.02 0.19 2.72 2.02 -1.26 -1.26 118.70 124.92 2w2w s GLU 92 Ca 0.05 -0.88 0.05 0.00 0.02 0.00 0.00 54.97 54.22 2w2w s GLU 92 Cb -0.13 -3.17 -0.04 0.00 0.10 0.00 0.00 34.13 30.89 2w2w s GLU 92 CO 0.02 -0.39 0.16 -0.06 0.02 0.00 0.00 175.26 175.01 2w2w s PHE 93 N 1.42 3.15 0.02 1.61 0.40 -0.76 -1.75 117.98 122.07 2w2w s PHE 93 Ca 0.02 -0.04 -0.17 0.00 -0.60 0.00 0.00 56.93 56.14 2w2w s PHE 93 Cb -0.17 -1.49 0.03 0.00 0.51 0.00 0.00 43.02 41.91 2w2w s PHE 93 CO -0.01 0.52 0.37 0.00 0.70 0.00 0.00 175.22 176.80 2w2w s ALA 94 N -1.85 -0.92 0.28 5.36 0.00 -0.49 -1.97 121.76 122.17 2w2w s ALA 94 Ca 0.32 0.33 0.04 0.00 0.00 0.00 0.00 51.96 52.65 2w2w s ALA 94 Cb -0.09 0.22 -0.06 0.00 0.00 0.00 0.00 23.12 23.18 2w2w s ALA 94 CO 0.24 -0.37 0.01 0.95 0.00 0.00 0.00 175.76 176.59 2w2w s THR 95 N -1.98 1.19 -0.07 0.00 -4.23 -0.61 -0.34 115.64 109.60 2w2w s THR 95 Ca -0.09 -2.04 -0.12 0.00 -1.18 0.00 0.00 61.69 58.27 2w2w s THR 95 Cb -0.02 -2.55 -0.08 0.00 1.34 0.00 0.00 72.50 71.19 2w2w s THR 95 CO 0.01 -0.18 0.46 0.44 -0.54 0.00 0.00 174.62 174.81 2w2w h ASP 96 N 2.29 -0.20 -2.92 3.99 3.32 -1.93 -3.39 116.42 117.58 2w2w h ASP 96 Ca -0.40 -0.14 -0.62 0.00 0.02 0.00 0.00 57.03 55.89 2w2w h ASP 96 Cb 1.23 0.05 -0.05 0.00 0.22 0.00 0.00 39.33 40.79 2w2w h ASP 96 CO 0.67 0.32 -0.38 -0.54 -1.72 0.00 0.00 179.24 177.59 2w2w s LYS 97 N -2.63 3.58 0.33 3.56 -0.14 -1.26 -4.89 119.74 118.29 2w2w s LYS 97 Ca -0.07 -0.08 0.01 0.00 -1.36 0.00 0.00 55.97 54.47 2w2w s LYS 97 Cb 0.00 -3.06 0.57 0.00 -1.68 0.00 0.00 37.83 33.66 2w2w s LYS 97 CO 0.24 0.63 1.96 -0.24 -0.76 0.00 0.00 175.35 177.18 2w2w h VAL 98 N 2.95 1.12 -1.00 3.17 3.04 -1.98 -2.16 116.25 121.39 2w2w h VAL 98 Ca -0.50 -0.33 0.04 0.00 -1.01 0.00 0.00 66.70 64.91 2w2w h VAL 98 Cb 1.19 0.08 -0.06 0.00 -2.01 0.00 0.00 31.29 30.49 2w2w h VAL 98 CO 0.67 0.18 0.66 1.05 -1.01 0.00 0.00 177.57 179.11 2w2w h GLU 99 N 0.96 1.22 0.25 4.17 9.09 -1.99 -2.27 114.58 126.01 2w2w h GLU 99 Ca 0.31 -0.07 -0.01 0.00 0.05 0.00 0.00 59.36 59.63 2w2w h GLU 99 Cb 0.04 -0.27 0.00 0.00 -1.65 0.00 0.00 28.75 26.87 2w2w h GLU 99 CO -0.09 0.81 -0.12 0.93 0.05 0.00 0.00 179.01 180.59 2w2w h GLU 100 N 1.25 -0.32 -1.03 1.06 5.08 -1.81 0.98 114.58 119.80 2w2w h GLU 100 Ca 0.41 0.02 0.37 0.00 -1.00 0.00 0.00 59.36 59.16 2w2w h GLU 100 Cb 0.03 0.07 -0.16 0.00 0.50 0.00 0.00 28.75 29.20 2w2w h GLU 100 CO -0.13 -0.18 0.58 1.25 -1.00 0.00 0.00 179.01 179.53 2w2w h LEU 101 N -0.38 0.42 0.35 1.33 5.85 -1.33 1.05 115.31 122.60 2w2w h LEU 101 Ca -0.03 0.21 -0.02 0.00 0.84 0.00 0.00 57.88 58.88 2w2w h LEU 101 Cb 0.29 0.18 0.00 0.00 0.37 0.00 0.00 40.66 41.51 2w2w h LEU 101 CO 0.06 -0.25 -0.17 0.15 -0.34 0.00 0.00 178.44 177.89 2w2w h PHE 102 N 0.18 -0.43 -0.92 1.25 3.57 -0.54 0.51 116.94 120.57 2w2w h PHE 102 Ca 0.78 -0.01 0.26 0.00 3.53 0.00 0.00 57.97 62.54 2w2w h PHE 102 Cb 1.96 0.14 -0.15 0.00 2.79 0.00 0.00 35.95 40.69 2w2w h PHE 102 CO -0.01 -0.14 0.27 0.93 -2.23 0.00 0.00 178.31 177.13 2w2w h GLU 103 N -1.02 0.17 0.01 1.11 5.08 0.29 -2.45 114.58 117.78 2w2w h GLU 103 Ca -0.05 -0.01 -0.05 0.00 -1.00 0.00 0.00 59.36 58.25 2w2w h GLU 103 Cb 0.49 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.70 2w2w h GLU 103 CO 0.08 0.11 -0.20 -1.49 -1.00 0.00 0.00 179.01 176.51 2w2w h TRP 104 N 0.17 0.17 -0.65 4.33 4.06 0.11 -3.33 115.95 120.83 2w2w h TRP 104 Ca 0.60 -0.10 -0.04 0.00 2.06 0.00 0.00 58.89 61.41 2w2w h TRP 104 Cb 1.28 -0.02 -0.03 0.00 -1.00 0.00 0.00 29.16 29.40 2w2w h TRP 104 CO -0.25 0.95 0.25 0.35 -3.56 0.00 0.00 178.44 176.18 2w2w h PHE 105 N -0.65 0.97 0.32 0.49 3.57 0.50 -2.47 116.94 119.65 2w2w h PHE 105 Ca -0.03 -0.06 -0.01 0.00 3.53 0.00 0.00 57.97 61.40 2w2w h PHE 105 Cb 1.01 -0.29 -0.00 0.00 2.79 0.00 0.00 35.95 39.46 2w2w h PHE 105 CO 0.21 0.75 -0.18 1.96 -2.23 0.00 0.00 178.31 178.81 2w2w h GLN 106 N 0.94 -0.45 -0.46 1.11 1.08 -1.65 -2.96 115.11 112.72 2w2w h GLN 106 Ca 0.22 0.03 0.09 0.00 -1.45 0.00 0.00 58.65 57.54 2w2w h GLN 106 Cb 0.20 0.10 -0.10 0.00 -0.05 0.00 0.00 27.48 27.63 2w2w h GLN 106 CO -0.02 -0.30 -0.29 0.77 -0.95 0.00 0.00 178.83 178.04 2w2w h SER 107 N -0.47 -0.99 -0.53 1.46 0.02 -1.55 0.12 113.55 111.61 2w2w h SER 107 Ca -0.04 0.19 -0.04 0.00 -0.84 0.00 0.00 61.79 61.06 2w2w h SER 107 Cb 0.38 0.49 -0.03 0.00 0.14 0.00 0.00 62.40 63.38 2w2w h SER 107 CO 0.05 -0.29 0.18 0.40 -1.14 0.00 0.00 176.83 176.02 2w2w h ILE 108 N -0.19 1.22 0.02 3.27 2.04 -1.57 -2.77 117.51 119.53 2w2w h ILE 108 Ca 0.20 -0.77 -0.21 0.00 1.00 0.00 0.00 64.86 65.08 2w2w h ILE 108 Cb 0.52 0.59 -0.02 0.00 -0.74 0.00 0.00 36.82 37.16 2w2w h ILE 108 CO -0.57 0.29 -0.99 -0.09 0.00 0.00 0.00 178.15 176.79 2w2w h ARG 109 N 0.85 0.06 -0.17 2.37 2.43 -1.23 -1.69 114.38 117.00 2w2w h ARG 109 Ca 0.19 -0.09 0.00 0.00 -0.81 0.00 0.00 59.98 59.27 2w2w h ARG 109 Cb 0.25 0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.83 2w2w h ARG 109 CO -0.01 1.00 0.00 0.39 -1.51 0.00 0.00 179.97 179.84 2w2w n GLU 110 N -3.45 0.35 0.00 0.20 1.02 0.35 -2.38 120.64 116.73 2w2w n GLU 110 Ca -0.02 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.12 2w2w n GLU 110 Cb 0.91 -1.09 0.00 0.00 -0.02 0.00 0.00 31.44 31.24 2w2w n GLU 110 CO 0.00 0.00 0.00 -0.89 1.18 0.00 0.00 177.13 177.42 2w2w n ILE 111 N -0.09 0.00 1.61 -3.67 5.41 -1.00 -5.04 119.36 116.58 2w2w n ILE 111 Ca 0.00 0.00 0.14 0.00 1.00 0.00 0.00 62.75 63.89 2w2w n ILE 111 Cb 0.04 -0.14 0.62 0.00 -0.71 0.00 0.00 39.64 39.45 2w2w n ILE 111 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 176.55 176.90