#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k6m h LEU 11 N 0.00 0.78 -0.82 -0.89 4.07 -2.10 -3.07 115.31 113.27 2k6m h LEU 11 Ca 0.00 -0.39 -0.10 0.00 0.08 0.00 0.00 57.88 57.47 2k6m h LEU 11 Cb 0.00 -0.21 -0.01 0.00 1.08 0.00 0.00 40.66 41.51 2k6m h LEU 11 CO 0.00 0.99 -0.22 0.00 -1.08 0.00 0.00 178.44 178.13 2k6m h ALA 12 N 0.81 1.00 -2.30 1.53 0.00 -2.14 -3.44 119.26 114.71 2k6m h ALA 12 Ca 0.09 -0.35 -0.49 0.00 0.00 0.00 0.00 54.91 54.15 2k6m h ALA 12 Cb 0.68 -0.14 0.06 0.00 0.00 0.00 0.00 17.79 18.39 2k6m h ALA 12 CO 0.05 0.59 0.38 0.15 0.00 0.00 0.00 179.25 180.42 2k6m s LYS 13 N -4.57 3.47 0.22 0.00 -0.14 -1.16 -5.08 119.74 112.48 2k6m s LYS 13 Ca -0.08 1.00 0.10 0.00 -1.36 0.00 0.00 55.97 55.62 2k6m s LYS 13 Cb 0.13 -2.06 -0.05 0.00 -1.68 0.00 0.00 37.83 34.18 2k6m s LYS 13 CO 0.81 -0.67 -0.18 -0.51 -0.76 0.00 0.00 175.35 174.04 2k6m s LEU 14 N -4.72 2.54 -0.10 3.17 1.02 -1.26 -4.92 118.68 114.41 2k6m s LEU 14 Ca 0.59 -0.99 0.03 0.00 0.02 0.00 0.00 54.13 53.79 2k6m s LEU 14 Cb -0.13 -0.88 0.00 0.00 0.02 0.00 0.00 46.19 45.21 2k6m s LEU 14 CO 0.42 -0.06 -0.22 0.00 0.02 0.00 0.00 176.35 176.52 2k6m s LYS 16 N 0.48 4.63 -0.09 0.00 -0.14 -1.26 -5.05 119.74 118.31 2k6m s LYS 16 Ca -0.16 1.47 -0.02 0.00 -1.36 0.00 0.00 55.97 55.90 2k6m s LYS 16 Cb -0.17 -3.40 -0.03 0.00 -1.68 0.00 0.00 37.83 32.55 2k6m s LYS 16 CO 0.06 0.09 -0.01 0.99 -0.76 0.00 0.00 175.35 175.73 2k6m s THR 17 N 0.38 4.20 -0.06 2.17 2.01 -1.26 -5.10 115.64 117.99 2k6m s THR 17 Ca 0.49 -0.29 -0.20 0.00 0.31 0.00 0.00 61.69 62.00 2k6m s THR 17 Cb -0.23 -2.76 -0.05 0.00 0.01 0.00 0.00 72.50 69.47 2k6m s THR 17 CO 0.29 0.60 0.58 -0.63 -0.69 0.00 0.00 174.62 174.77 2k6m s ILE 18 N -0.80 5.04 0.04 1.82 1.09 -1.26 -4.89 121.20 122.24 2k6m s ILE 18 Ca 0.12 1.18 -0.18 0.00 -1.10 0.00 0.00 60.65 60.68 2k6m s ILE 18 Cb -0.11 -3.91 -0.06 0.00 -1.06 0.00 0.00 42.46 37.31 2k6m s ILE 18 CO 0.02 0.35 0.52 -0.31 -0.10 0.00 0.00 174.94 175.42 2k6m s TYR 19 N 0.30 3.77 -0.57 3.97 1.51 -1.06 -4.97 117.35 120.31 2k6m s TYR 19 Ca 0.31 1.17 -0.30 0.00 -1.01 0.00 0.00 57.07 57.24 2k6m s TYR 19 Cb -0.17 -2.43 -0.12 0.00 -0.11 0.00 0.00 41.96 39.12 2k6m s TYR 19 CO 0.15 0.59 2.42 -0.35 -1.11 0.00 0.00 175.55 177.25 2k6m n PRO 20 N 1.82 0.80 -0.37 -1.71 -0.04 -1.26 -4.80 135.00 129.45 2k6m n PRO 20 Ca -0.11 0.10 0.34 0.00 -0.04 0.00 0.00 63.50 63.80 2k6m n PRO 20 Cb 0.51 -2.62 0.62 0.00 -0.04 0.00 0.00 33.50 31.97 2k6m n PRO 20 CO 0.00 0.00 0.00 1.37 -0.04 0.00 0.00 175.50 176.83 2k6m h LEU 21 N 15.22 0.29 -0.20 1.53 8.10 -1.93 0.45 115.31 138.76 2k6m h LEU 21 Ca -0.20 0.22 -0.04 0.00 0.11 0.00 0.00 57.88 57.97 2k6m h LEU 21 Cb 1.30 0.23 -0.01 0.00 -0.44 0.00 0.00 40.66 41.74 2k6m h LEU 21 CO 1.17 -0.37 -0.03 0.00 -4.11 0.00 0.00 178.44 175.10 2k6m h ALA 22 N 1.86 0.28 0.00 0.17 0.00 -1.97 1.10 119.26 120.71 2k6m h ALA 22 Ca 0.86 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 55.53 2k6m h ALA 22 Cb 2.43 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 20.14 2k6m h ALA 22 CO -0.66 0.04 0.00 -0.44 0.00 0.00 0.00 179.25 178.19 2k6m h ASP 23 N 0.12 0.00 0.00 0.00 3.32 -0.46 -2.49 116.42 116.91 2k6m h ASP 23 Ca 0.05 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.10 2k6m h ASP 23 Cb 0.47 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.02 2k6m h ASP 23 CO 0.02 0.00 -1.18 0.00 -1.72 0.00 0.00 179.24 176.36 2k6m n LEU 24 N -2.69 0.03 0.00 1.55 -0.00 -0.92 -2.76 117.00 112.21 2k6m n LEU 24 Ca -0.02 -0.05 0.09 0.00 -0.00 0.00 0.00 56.01 56.03 2k6m n LEU 24 Cb 0.09 0.00 0.40 0.00 -0.00 0.00 0.00 43.42 43.92 2k6m n LEU 24 CO 0.17 0.01 0.80 -0.11 -0.00 0.00 0.00 177.39 178.25 2k6m n LEU 25 N -1.65 0.00 0.00 1.47 7.94 0.38 -4.47 117.00 120.67 2k6m n LEU 25 Ca -0.01 0.49 0.00 0.00 -1.11 0.00 0.00 56.01 55.38 2k6m n LEU 25 Cb 0.15 -0.49 0.00 0.00 0.53 0.00 0.00 43.42 43.61 2k6m n LEU 25 CO 0.13 -0.18 0.00 0.00 -1.11 0.00 0.00 177.39 176.23 2k6m n ALA 26 N -1.49 0.00 -3.06 1.96 0.00 -1.20 -4.95 120.51 111.76 2k6m n ALA 26 Ca 0.05 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.37 2k6m n ALA 26 Cb 0.22 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.59 2k6m n ALA 26 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 2k6m s ARG 27 N 0.00 0.83 -0.03 0.00 1.04 -1.23 -5.04 118.95 114.52 2k6m s ARG 27 Ca 0.00 -0.45 -0.05 0.00 -1.04 0.00 0.00 55.73 54.19 2k6m s ARG 27 Cb 0.00 0.36 -0.06 0.00 -2.04 0.00 0.00 34.95 33.21 2k6m s ARG 27 CO 0.00 -0.27 0.78 -0.35 -0.04 0.00 0.00 175.30 175.42 2k6m n PRO 28 N 0.59 0.00 -1.37 3.89 -0.04 -1.26 -4.33 135.00 132.49 2k6m n PRO 28 Ca -0.19 -0.20 -0.31 0.00 -0.04 0.00 0.00 63.50 62.76 2k6m n PRO 28 Cb 0.59 -1.31 0.08 0.00 -0.04 0.00 0.00 33.50 32.83 2k6m n PRO 28 CO 0.00 0.00 0.00 -0.48 -0.04 0.00 0.00 175.50 174.98 2k6m s LEU 29 N 0.55 3.11 0.00 1.53 0.05 -1.11 -5.00 118.68 117.81 2k6m s LEU 29 Ca 0.12 1.85 0.00 0.00 0.05 0.00 0.00 54.13 56.15 2k6m s LEU 29 Cb 0.02 -4.53 0.00 0.00 -2.05 0.00 0.00 46.19 39.63 2k6m s LEU 29 CO 0.06 -1.93 0.00 -0.81 -0.55 0.00 0.00 176.35 173.11 2k6m n PRO 30 N -3.29 0.10 -0.12 1.48 -0.04 -1.26 -5.01 135.00 126.87 2k6m n PRO 30 Ca 0.09 0.00 -0.15 0.00 -0.04 0.00 0.00 63.50 63.40 2k6m n PRO 30 Cb 0.53 0.00 -0.13 0.00 -0.04 0.00 0.00 33.50 33.86 2k6m n PRO 30 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 2k6m n GLU 31 N -0.64 0.68 -0.09 0.54 4.07 -1.26 -4.17 120.64 119.77 2k6m n GLU 31 Ca 0.00 0.09 0.26 0.00 -0.06 0.00 0.00 57.16 57.45 2k6m n GLU 31 Cb 0.00 -1.51 0.69 0.00 -0.06 0.00 0.00 31.44 30.56 2k6m n GLU 31 CO 0.00 0.00 0.00 0.78 -0.06 0.00 0.00 177.13 177.85 2k6m h GLY 32 N 2.67 0.00 -6.67 8.31 0.00 -2.03 -3.34 103.07 102.02 2k6m h GLY 32 Ca -0.56 0.00 -0.56 0.00 0.00 0.00 0.00 47.33 46.21 2k6m h GLY 32 CO -0.05 0.00 0.95 0.14 0.00 0.00 0.00 176.54 177.58 2k6m s VAL 33 N -4.68 4.16 -0.22 4.60 1.01 -1.26 -5.01 120.40 119.01 2k6m s VAL 33 Ca -0.04 1.19 -0.19 0.00 0.00 0.00 0.00 61.98 62.95 2k6m s VAL 33 Cb 0.17 -4.53 -0.03 0.00 0.00 0.00 0.00 36.38 32.00 2k6m s VAL 33 CO 0.61 -0.94 0.54 -1.81 0.00 0.00 0.00 175.10 173.50 2k6m s ASP 34 N 2.69 6.55 0.48 3.32 1.01 -1.25 -4.91 116.67 124.56 2k6m s ASP 34 Ca 0.50 0.67 0.19 0.00 0.71 0.00 0.00 52.55 54.62 2k6m s ASP 34 Cb -0.08 -2.30 1.20 0.00 1.01 0.00 0.00 42.92 42.74 2k6m s ASP 34 CO 0.31 -0.22 2.04 1.55 0.21 0.00 0.00 175.17 179.06 2k6m h PRO 35 N 7.60 0.00 -0.11 8.23 0.13 -1.95 -2.13 132.00 143.78 2k6m h PRO 35 Ca -0.32 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.81 2k6m h PRO 35 Cb 1.15 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.28 2k6m h PRO 35 CO 0.74 0.14 0.00 1.47 -0.23 0.00 0.00 178.00 180.12 2k6m n LEU 36 N -4.12 0.94 -3.01 1.56 -0.00 -1.26 -4.55 117.00 106.55 2k6m n LEU 36 Ca -0.02 -0.40 0.02 0.00 -0.00 0.00 0.00 56.01 55.60 2k6m n LEU 36 Cb 0.22 -0.07 -0.00 0.00 -0.00 0.00 0.00 43.42 43.57 2k6m n LEU 36 CO 0.34 0.20 0.27 -1.59 -0.00 0.00 0.00 177.39 176.61 2k6m s LYS 37 N -1.86 0.51 -0.13 1.47 -2.85 -0.80 -5.07 119.74 111.00 2k6m s LYS 37 Ca 0.28 -0.13 -0.08 0.00 -1.00 0.00 0.00 55.97 55.04 2k6m s LYS 37 Cb 0.14 0.07 -0.03 0.00 -2.06 0.00 0.00 37.83 35.95 2k6m s LYS 37 CO 0.22 -0.75 -0.10 -0.07 0.10 0.00 0.00 175.35 174.75 2k6m h LEU 38 N 6.36 0.00 -1.50 2.77 3.38 -1.80 -3.38 115.31 121.15 2k6m h LEU 38 Ca 0.01 -0.04 0.40 0.00 0.09 0.00 0.00 57.88 58.34 2k6m h LEU 38 Cb 1.20 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.90 2k6m h LEU 38 CO 0.02 0.73 1.25 1.05 0.09 0.00 0.00 178.44 181.58 2k6m h GLU 39 N -1.00 0.00 -0.16 1.13 4.11 -1.93 0.52 114.58 117.25 2k6m h GLU 39 Ca -0.02 0.00 -0.09 0.00 0.07 0.00 0.00 59.36 59.32 2k6m h GLU 39 Cb 0.44 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.67 2k6m h GLU 39 CO -0.01 0.00 -0.29 -0.84 0.07 0.00 0.00 179.01 177.94 2k6m h ILE 40 N 0.00 1.26 -0.77 -1.06 -0.00 -1.97 -3.02 117.51 111.95 2k6m h ILE 40 Ca 0.65 -1.26 -0.37 0.00 -0.00 0.00 0.00 64.86 63.89 2k6m h ILE 40 Cb 3.15 1.46 -0.22 0.00 -0.00 0.00 0.00 36.82 41.21 2k6m h ILE 40 CO -0.01 0.38 0.47 0.00 -0.00 0.00 0.00 178.15 179.00 2k6m n TYR 41 N -4.12 2.40 -3.75 0.16 0.18 0.18 -4.85 117.16 107.37 2k6m n TYR 41 Ca -0.01 -1.48 -0.20 0.00 1.88 0.00 0.00 57.90 58.09 2k6m n TYR 41 Cb 0.40 -0.77 -0.17 0.00 -0.38 0.00 0.00 39.34 38.41 2k6m n TYR 41 CO 0.00 0.00 0.00 -0.48 -2.08 0.00 0.00 176.86 174.30 2k6m s LEU 42 N -2.62 0.49 0.00 -3.48 0.05 -1.14 -2.55 118.68 109.42 2k6m s LEU 42 Ca 0.46 0.01 0.00 0.00 0.05 0.00 0.00 54.13 54.65 2k6m s LEU 42 Cb 0.38 -0.25 0.00 0.00 -2.05 0.00 0.00 46.19 44.27 2k6m s LEU 42 CO 0.09 -0.20 0.00 1.07 -0.55 0.00 0.00 176.35 176.76 2k6m n THR 43 N 5.02 0.00 -0.13 5.48 5.66 -1.26 -4.29 114.28 124.75 2k6m n THR 43 Ca -0.09 0.00 -0.08 0.00 -3.05 0.00 0.00 64.05 60.83 2k6m n THR 43 Cb 0.50 -0.35 0.08 0.00 -1.55 0.00 0.00 70.33 69.01 2k6m n THR 43 CO 0.00 0.00 0.00 -2.24 -3.05 0.00 0.00 175.07 169.78 2k6m h ASP 44 N -1.30 0.88 0.20 1.09 2.03 -1.95 1.17 116.42 118.53 2k6m h ASP 44 Ca 0.00 -0.28 -0.01 0.00 -0.73 0.00 0.00 57.03 56.01 2k6m h ASP 44 Cb 0.00 -0.24 0.00 0.00 -0.83 0.00 0.00 39.33 38.26 2k6m h ASP 44 CO 0.00 1.00 -0.10 -0.33 -1.03 0.00 0.00 179.24 178.79 2k6m h GLU 45 N 0.79 -0.26 -0.21 4.15 5.08 -1.90 1.59 114.58 123.82 2k6m h GLU 45 Ca 0.13 0.02 -0.07 0.00 -1.00 0.00 0.00 59.36 58.44 2k6m h GLU 45 Cb 0.63 0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.92 2k6m h GLU 45 CO 0.04 -0.00 -0.16 0.22 -1.00 0.00 0.00 179.01 178.11 2k6m h ASP 46 N -0.50 0.34 -0.29 1.42 1.82 -1.85 -2.07 116.42 115.30 2k6m h ASP 46 Ca -0.03 -0.09 -0.04 0.00 -0.39 0.00 0.00 57.03 56.49 2k6m h ASP 46 Cb 0.38 -0.09 -0.01 0.00 0.68 0.00 0.00 39.33 40.28 2k6m h ASP 46 CO 0.05 0.53 0.03 -0.26 -1.61 0.00 0.00 179.24 177.97 2k6m h PHE 47 N 0.33 0.52 -0.37 0.28 0.04 0.18 0.16 116.94 118.08 2k6m h PHE 47 Ca 0.06 -0.08 0.06 0.00 2.80 0.00 0.00 57.97 60.81 2k6m h PHE 47 Cb 0.48 -0.14 -0.06 0.00 2.20 0.00 0.00 35.95 38.43 2k6m h PHE 47 CO 0.01 0.61 0.01 0.93 -0.60 0.00 0.00 178.31 179.27 2k6m h GLU 48 N 0.29 0.12 0.00 1.51 5.08 0.30 1.71 114.58 123.58 2k6m h GLU 48 Ca 0.08 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.44 2k6m h GLU 48 Cb 0.38 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.60 2k6m h GLU 48 CO 0.01 0.08 -0.09 0.34 -1.00 0.00 0.00 179.01 178.34 2k6m n PHE 49 N -5.17 0.21 -0.08 4.33 -0.00 -0.87 -1.74 117.46 114.14 2k6m n PHE 49 Ca 0.02 0.06 -0.08 0.00 -0.00 0.00 0.00 57.45 57.45 2k6m n PHE 49 Cb 0.19 -0.56 -0.03 0.00 -0.00 0.00 0.00 39.48 39.08 2k6m n PHE 49 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 2k6m n ALA 50 N -1.57 0.79 0.11 3.13 0.00 0.55 -4.79 120.51 118.72 2k6m n ALA 50 Ca 0.06 -0.74 0.02 0.00 0.00 0.00 0.00 53.44 52.78 2k6m n ALA 50 Cb 0.36 0.03 0.02 0.00 0.00 0.00 0.00 19.45 19.86 2k6m n ALA 50 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2k6m n LEU 51 N -4.21 1.49 -0.57 0.00 4.77 0.50 -4.83 117.00 114.15 2k6m n LEU 51 Ca -0.12 -1.20 -0.07 0.00 -0.03 0.00 0.00 56.01 54.58 2k6m n LEU 51 Cb 0.45 -0.01 -0.03 0.00 -2.33 0.00 0.00 43.42 41.49 2k6m n LEU 51 CO 0.18 0.34 -0.07 0.47 -1.33 0.00 0.00 177.39 176.98 2k6m n ASP 52 N 0.12 -5.48 -0.10 -1.43 9.92 0.34 -4.92 116.55 115.00 2k6m n ASP 52 Ca 0.02 0.19 0.00 0.00 -0.53 0.00 0.00 54.79 54.47 2k6m n ASP 52 Cb 0.13 -3.64 0.00 0.00 -0.64 0.00 0.00 41.12 36.97 2k6m n ASP 52 CO 0.00 0.00 0.00 0.80 0.13 0.00 0.00 177.20 178.13 2k6m n MET 53 N -0.68 3.80 -4.14 -1.24 1.56 -1.20 -4.78 117.12 110.43 2k6m n MET 53 Ca -0.07 0.00 -0.14 0.00 -0.27 0.00 0.00 57.70 57.21 2k6m n MET 53 Cb 0.51 0.00 -0.11 0.00 2.15 0.00 0.00 33.22 35.77 2k6m n MET 53 CO 0.00 0.00 0.00 0.95 -0.73 0.00 0.00 175.97 176.19 2k6m s THR 54 N 1.00 0.83 0.55 1.12 -4.23 -1.26 -3.27 115.64 110.38 2k6m s THR 54 Ca 0.00 -1.48 0.23 0.00 -1.18 0.00 0.00 61.69 59.26 2k6m s THR 54 Cb 0.00 -1.15 0.33 0.00 1.34 0.00 0.00 72.50 73.02 2k6m s THR 54 CO 0.00 -0.50 2.13 -0.09 -0.54 0.00 0.00 174.62 175.62 2k6m h ARG 55 N 3.84 0.00 -0.00 3.99 1.12 -1.83 0.26 114.38 121.76 2k6m h ARG 55 Ca -0.37 0.00 0.00 0.00 -1.11 0.00 0.00 59.98 58.50 2k6m h ARG 55 Cb 1.19 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 31.15 2k6m h ARG 55 CO 0.49 0.00 -0.36 -0.25 -3.11 0.00 0.00 179.97 176.74 2k6m n ASP 56 N -4.22 0.47 -0.08 -3.80 8.00 -1.26 -2.33 116.55 113.33 2k6m n ASP 56 Ca 0.00 -0.22 -0.07 0.00 0.71 0.00 0.00 54.79 55.22 2k6m n ASP 56 Cb 0.24 0.09 -0.02 0.00 -0.02 0.00 0.00 41.12 41.40 2k6m n ASP 56 CO 0.00 0.00 0.00 1.21 -0.39 0.00 0.00 177.20 178.02 2k6m n GLU 57 N -1.37 0.49 0.21 -1.24 2.13 0.73 -4.25 120.64 117.34 2k6m n GLU 57 Ca 0.07 0.39 0.11 0.00 0.66 0.00 0.00 57.16 58.39 2k6m n GLU 57 Cb 0.33 -1.58 0.66 0.00 0.27 0.00 0.00 31.44 31.13 2k6m n GLU 57 CO 0.00 0.00 0.00 1.88 -0.41 0.00 0.00 177.13 178.60 2k6m h TYR 58 N -1.00 0.00 -0.96 4.31 -1.99 -1.25 -0.77 116.97 115.31 2k6m h TYR 58 Ca -0.01 0.00 0.28 0.00 2.00 0.00 0.00 58.73 60.99 2k6m h TYR 58 Cb 0.75 0.00 -0.04 0.00 2.00 0.00 0.00 36.73 39.44 2k6m h TYR 58 CO -0.30 0.00 0.70 -0.91 -0.00 0.00 0.00 178.16 177.64 2k6m h ASN 59 N 0.00 0.00 0.00 3.88 -0.26 -1.63 -2.52 115.58 115.04 2k6m h ASN 59 Ca 0.05 0.00 -0.15 0.00 -0.56 0.00 0.00 56.30 55.64 2k6m h ASN 59 Cb 0.21 0.00 -0.03 0.00 -1.06 0.00 0.00 38.32 37.44 2k6m h ASN 59 CO -0.00 0.00 -1.58 0.00 -1.06 0.00 0.00 177.43 174.79 2k6m n ALA 60 N -2.72 1.81 -1.24 -0.83 0.00 -0.42 -5.03 120.51 112.08 2k6m n ALA 60 Ca 0.20 -0.55 -0.34 0.00 0.00 0.00 0.00 53.44 52.75 2k6m n ALA 60 Cb 1.03 0.06 0.11 0.00 0.00 0.00 0.00 19.45 20.65 2k6m n ALA 60 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2k6m s LEU 61 N -4.59 3.23 0.49 0.00 1.43 -0.49 -4.91 118.68 113.85 2k6m s LEU 61 Ca -0.04 2.40 -0.20 0.00 -1.03 0.00 0.00 54.13 55.26 2k6m s LEU 61 Cb 0.03 -4.59 -0.11 0.00 0.03 0.00 0.00 46.19 41.54 2k6m s LEU 61 CO 0.35 -2.51 0.50 -2.65 0.23 0.00 0.00 176.35 172.27 2k6m n PRO 62 N -3.00 0.53 0.21 1.29 -0.02 -1.26 -4.80 135.00 127.95 2k6m n PRO 62 Ca 0.14 0.20 0.14 0.00 -2.02 0.00 0.00 63.50 61.96 2k6m n PRO 62 Cb 0.50 -1.57 0.47 0.00 -0.02 0.00 0.00 33.50 32.88 2k6m n PRO 62 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2k6m h ALA 63 N 0.52 1.00 0.05 3.55 0.00 -1.90 -1.87 119.26 120.60 2k6m h ALA 63 Ca -0.43 0.00 -0.29 0.00 0.00 0.00 0.00 54.91 54.19 2k6m h ALA 63 Cb 1.40 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 19.16 2k6m h ALA 63 CO 0.49 0.00 -1.60 -2.67 0.00 0.00 0.00 179.25 175.47 2k6m n TRP 64 N -2.83 1.06 -0.29 0.00 4.27 -1.26 -2.86 117.44 115.54 2k6m n TRP 64 Ca 0.03 0.36 -0.05 0.00 -3.89 0.00 0.00 57.50 53.94 2k6m n TRP 64 Cb 0.37 -1.12 0.07 0.00 -1.36 0.00 0.00 31.31 29.27 2k6m n TRP 64 CO 0.00 0.00 0.00 -0.22 -2.29 0.00 0.00 177.69 175.18 2k6m h LYS 65 N -0.59 1.09 -0.72 -2.67 3.64 -1.93 2.10 116.57 117.48 2k6m h LYS 65 Ca -0.39 -0.12 -0.04 0.00 -1.27 0.00 0.00 60.65 58.82 2k6m h LYS 65 Cb 1.59 -0.22 -0.03 0.00 -0.41 0.00 0.00 32.23 33.17 2k6m h LYS 65 CO -0.11 0.80 0.29 -0.56 -2.27 0.00 0.00 179.45 177.60 2k6m h GLN 66 N 1.08 1.08 -0.46 1.90 3.07 -1.50 -1.80 115.11 118.48 2k6m h GLN 66 Ca 0.28 -0.19 -0.13 0.00 0.09 0.00 0.00 58.65 58.69 2k6m h GLN 66 Cb 0.02 -0.18 -0.01 0.00 0.08 0.00 0.00 27.48 27.39 2k6m h GLN 66 CO -0.05 0.88 -0.22 0.28 0.09 0.00 0.00 178.83 179.82 2k6m h VAL 67 N 1.03 1.27 -0.89 1.86 2.07 -1.08 -2.59 116.25 117.93 2k6m h VAL 67 Ca 0.24 -1.38 0.15 0.00 0.82 0.00 0.00 66.70 66.53 2k6m h VAL 67 Cb 0.21 1.15 -0.15 0.00 -1.52 0.00 0.00 31.29 30.98 2k6m h VAL 67 CO -0.02 0.47 -0.35 -1.13 0.02 0.00 0.00 177.57 176.56 2k6m h ASN 68 N 0.81 -1.29 1.80 0.57 -1.24 0.43 0.72 115.58 117.36 2k6m h ASN 68 Ca 0.10 0.29 0.00 0.00 0.71 0.00 0.00 56.30 57.40 2k6m h ASN 68 Cb 0.78 0.69 0.00 0.00 0.73 0.00 0.00 38.32 40.52 2k6m h ASN 68 CO 0.07 -0.29 0.00 0.25 -1.29 0.00 0.00 177.43 176.16 2k6m h LEU 69 N -0.04 0.00 -0.03 0.34 5.85 -1.49 -3.11 115.31 116.82 2k6m h LEU 69 Ca 0.33 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 59.04 2k6m h LEU 69 Cb 0.60 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.62 2k6m h LEU 69 CO -0.91 0.00 -0.02 0.50 -0.34 0.00 0.00 178.44 177.67 2k6m h LYS 70 N 0.00 0.07 -0.39 1.25 3.64 0.71 -2.92 116.57 118.94 2k6m h LYS 70 Ca 0.00 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.33 2k6m h LYS 70 Cb 0.90 -0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.70 2k6m h LYS 70 CO 0.00 0.51 0.19 0.87 -2.27 0.00 0.00 179.45 178.75 2k6m h LYS 71 N -0.36 0.56 -0.45 1.90 1.57 -0.84 0.67 116.57 119.62 2k6m h LYS 71 Ca 0.01 -0.08 0.13 0.00 -1.87 0.00 0.00 60.65 58.84 2k6m h LYS 71 Cb 0.50 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.69 2k6m h LYS 71 CO 0.01 0.49 0.38 0.00 -0.57 0.00 0.00 179.45 179.75 2k6m h ALA 72 N 1.04 2.29 0.00 3.86 0.00 -1.56 0.20 119.26 125.10 2k6m h ALA 72 Ca 0.13 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.03 2k6m h ALA 72 Cb 0.11 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.93 2k6m h ALA 72 CO -0.02 -0.61 -0.89 -0.22 0.00 0.00 0.00 179.25 177.51 2k6m h LYS 73 N 0.00 0.00 0.00 0.00 1.63 -1.23 -3.48 116.57 113.50 2k6m h LYS 73 Ca 0.21 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 60.01 2k6m h LYS 73 Cb 0.97 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.60 2k6m h LYS 73 CO -0.00 0.00 0.00 0.41 -3.45 0.00 0.00 179.45 176.41 2k6m n GLY 74 N 1.24 0.83 0.00 5.01 0.00 0.71 -4.99 105.19 108.00 2k6m n GLY 74 Ca 0.01 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.03 2k6m n GLY 74 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2k6m h LEU 75 N 0.00 0.00 0.00 0.99 3.38 -1.34 -3.48 115.31 114.86 2k6m h LEU 75 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2k6m h LEU 75 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 2k6m h LEU 75 CO 0.00 0.01 0.00 2.22 0.09 0.00 0.00 178.44 180.76