#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 0.93 -0.91 -0.89 3.38 -2.07 -3.23 115.31 112.51 2k6m h LEU 11 Ca 0.00 -0.67 -0.09 0.00 0.09 0.00 0.00 57.88 57.21 2k6m h LEU 11 Cb 0.00 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.45 2k6m h LEU 11 CO 0.00 1.47 -0.17 0.00 0.09 0.00 0.00 178.44 179.83 2k6m h ALA 12 N 0.48 1.08 -2.49 1.53 0.00 -2.15 -3.43 119.26 114.28 2k6m h ALA 12 Ca -0.09 -0.32 -0.49 0.00 0.00 0.00 0.00 54.91 54.02 2k6m h ALA 12 Cb 1.53 -0.15 0.04 0.00 0.00 0.00 0.00 17.79 19.21 2k6m h ALA 12 CO 0.18 0.56 0.42 0.15 0.00 0.00 0.00 179.25 180.56 2k6m s LYS 13 N -4.67 3.78 -0.24 0.00 1.02 -1.22 -5.04 119.74 113.36 2k6m s LYS 13 Ca -0.08 1.53 -0.02 0.00 0.02 0.00 0.00 55.97 57.42 2k6m s LYS 13 Cb 0.14 -2.24 0.07 0.00 -0.52 0.00 0.00 37.83 35.29 2k6m s LYS 13 CO 0.80 -0.48 0.05 -0.51 -0.92 0.00 0.00 175.35 174.29 2k6m s LEU 14 N -3.27 1.73 -0.05 3.17 1.43 -1.26 -4.88 118.68 115.54 2k6m s LEU 14 Ca 0.66 -1.17 0.05 0.00 -1.03 0.00 0.00 54.13 52.64 2k6m s LEU 14 Cb -0.22 -0.77 -0.02 0.00 0.03 0.00 0.00 46.19 45.22 2k6m s LEU 14 CO 0.26 -0.34 -0.21 0.00 0.23 0.00 0.00 176.35 176.30 2k6m s LYS 16 N -0.39 0.60 -0.18 0.00 -0.14 -1.26 -5.10 119.74 113.28 2k6m s LYS 16 Ca 0.03 -0.38 -0.03 0.00 -1.36 0.00 0.00 55.97 54.23 2k6m s LYS 16 Cb -0.12 -2.06 0.06 0.00 -1.68 0.00 0.00 37.83 34.02 2k6m s LYS 16 CO 0.02 -0.64 0.05 0.99 -0.76 0.00 0.00 175.35 175.01 2k6m s THR 17 N 1.88 0.34 0.33 2.17 2.01 -1.26 -5.14 115.64 115.97 2k6m s THR 17 Ca -0.01 -0.39 0.09 0.00 0.31 0.00 0.00 61.69 61.70 2k6m s THR 17 Cb -0.17 -0.86 -0.05 0.00 0.01 0.00 0.00 72.50 71.43 2k6m s THR 17 CO -0.08 -0.19 0.02 -0.51 -0.69 0.00 0.00 174.62 173.17 2k6m s ILE 18 N 1.95 2.77 -0.17 1.82 1.10 -1.26 -5.07 121.20 122.35 2k6m s ILE 18 Ca 0.00 -1.94 -0.20 0.00 -0.51 0.00 0.00 60.65 58.00 2k6m s ILE 18 Cb -0.16 -2.81 -0.03 0.00 0.15 0.00 0.00 42.46 39.61 2k6m s ILE 18 CO -0.08 -0.22 0.59 -0.31 -2.11 0.00 0.00 174.94 172.81 2k6m s TYR 19 N -2.48 3.43 0.11 3.50 1.51 -1.23 -4.99 117.35 117.20 2k6m s TYR 19 Ca 0.35 0.93 -0.34 0.00 -1.01 0.00 0.00 57.07 57.00 2k6m s TYR 19 Cb -0.01 -2.73 -0.18 0.00 -0.11 0.00 0.00 41.96 38.93 2k6m s TYR 19 CO 0.20 -0.06 0.99 -0.35 -1.11 0.00 0.00 175.55 175.22 2k6m n PRO 20 N 4.58 0.49 -0.31 -1.71 -0.04 -1.26 -4.68 135.00 132.07 2k6m n PRO 20 Ca -0.03 0.18 0.12 0.00 -0.04 0.00 0.00 63.50 63.73 2k6m n PRO 20 Cb 0.50 -1.57 0.30 0.00 -0.04 0.00 0.00 33.50 32.69 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 2.75 0.48 -0.31 1.53 8.10 -1.95 -0.18 115.31 125.73 2k6m h LEU 21 Ca -0.43 0.13 -0.05 0.00 0.11 0.00 0.00 57.88 57.65 2k6m h LEU 21 Cb 1.40 0.06 -0.01 0.00 -0.44 0.00 0.00 40.66 41.67 2k6m h LEU 21 CO 0.66 0.11 0.02 0.00 -4.11 0.00 0.00 178.44 175.11 2k6m h ALA 22 N 1.66 0.42 -0.94 0.17 0.00 -1.89 1.47 119.26 120.14 2k6m h ALA 22 Ca 0.55 -0.22 0.27 0.00 0.00 0.00 0.00 54.91 55.51 2k6m h ALA 22 Cb 0.95 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.58 2k6m h ALA 22 CO -0.46 0.15 0.89 -0.44 0.00 0.00 0.00 179.25 179.39 2k6m h ASP 23 N 0.35 0.00 0.00 0.00 5.19 -1.32 -0.95 116.42 119.68 2k6m h ASP 23 Ca 0.09 0.00 -0.10 0.00 -0.62 0.00 0.00 57.03 56.40 2k6m h ASP 23 Cb 0.40 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 39.89 2k6m h ASP 23 CO 0.01 0.00 -1.41 0.00 -3.12 0.00 0.00 179.24 174.72 2k6m n LEU 24 N -3.69 0.00 -2.07 1.55 -0.00 -0.94 -2.48 117.00 109.38 2k6m n LEU 24 Ca 0.20 0.00 -0.06 0.00 -0.00 0.00 0.00 56.01 56.15 2k6m n LEU 24 Cb 1.19 0.13 -0.08 0.00 -0.00 0.00 0.00 43.42 44.66 2k6m n LEU 24 CO 0.31 0.13 1.08 -0.11 -0.00 0.00 0.00 177.39 178.81 2k6m n LEU 25 N -2.17 3.34 -0.22 1.47 7.94 0.50 -4.17 117.00 123.70 2k6m n LEU 25 Ca -0.09 -2.05 0.00 0.00 -1.11 0.00 0.00 56.01 52.76 2k6m n LEU 25 Cb 0.63 -0.86 0.00 0.00 0.53 0.00 0.00 43.42 43.72 2k6m n LEU 25 CO 0.13 0.84 0.00 0.00 -1.11 0.00 0.00 177.39 177.26 2k6m n ALA 26 N 2.46 0.00 -3.34 1.96 0.00 -1.25 -4.88 120.51 115.47 2k6m n ALA 26 Ca 0.21 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.53 2k6m n ALA 26 Cb 0.53 -0.13 -0.10 0.00 0.00 0.00 0.00 19.45 19.74 2k6m n ALA 26 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 2k6m s ARG 27 N -0.61 0.44 0.00 0.00 3.00 -1.23 -5.03 118.95 115.53 2k6m s ARG 27 Ca 0.00 0.57 0.00 0.00 -1.00 0.00 0.00 55.73 55.30 2k6m s ARG 27 Cb 0.00 0.19 0.00 0.00 0.00 0.00 0.00 34.95 35.14 2k6m s ARG 27 CO 0.00 -0.07 0.70 -2.30 0.00 0.00 0.00 175.30 173.64 2k6m n PRO 28 N 3.05 0.00 -1.78 5.12 -0.02 -1.26 -4.20 135.00 135.91 2k6m n PRO 28 Ca -0.14 0.00 -0.32 0.00 -2.02 0.00 0.00 63.50 61.02 2k6m n PRO 28 Cb 0.57 -0.73 0.03 0.00 -0.02 0.00 0.00 33.50 33.35 2k6m n PRO 28 CO 0.00 0.00 0.00 -0.48 1.98 0.00 0.00 175.50 177.00 2k6m s LEU 29 N 0.00 3.28 0.00 2.45 -0.00 -1.03 -4.96 118.68 118.41 2k6m s LEU 29 Ca 0.00 1.65 0.00 0.00 -0.00 0.00 0.00 54.13 55.78 2k6m s LEU 29 Cb 0.00 -4.50 0.00 0.00 -0.00 0.00 0.00 46.19 41.69 2k6m s LEU 29 CO 0.00 -1.26 0.00 -0.81 -0.00 0.00 0.00 176.35 174.28 2k6m n PRO 30 N -2.69 1.24 -0.03 1.48 -0.04 -1.26 -5.00 135.00 128.71 2k6m n PRO 30 Ca 0.08 0.00 -0.21 0.00 -0.04 0.00 0.00 63.50 63.32 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 0.00 0.71 0.10 0.54 4.07 -1.26 -3.91 120.64 120.89 2k6m n GLU 31 Ca 0.00 0.31 0.20 0.00 -0.06 0.00 0.00 57.16 57.61 2k6m n GLU 31 Cb 0.00 -1.69 0.67 0.00 -0.06 0.00 0.00 31.44 30.35 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 0.74 0.00 -7.05 8.31 0.00 -2.05 -3.33 103.07 99.68 2k6m h GLY 32 Ca -0.43 0.00 -0.62 0.00 0.00 0.00 0.00 47.33 46.28 2k6m h GLY 32 CO 0.01 0.00 0.48 0.14 0.00 0.00 0.00 176.54 177.16 2k6m s VAL 33 N -4.45 4.51 -0.29 4.60 1.01 -1.25 -4.91 120.40 119.62 2k6m s VAL 33 Ca -0.04 0.38 -0.16 0.00 0.00 0.00 0.00 61.98 62.16 2k6m s VAL 33 Cb 0.13 -4.44 -0.02 0.00 0.00 0.00 0.00 36.38 32.05 2k6m s VAL 33 CO 0.45 -0.92 0.43 -1.81 0.00 0.00 0.00 175.10 173.25 2k6m s ASP 34 N 2.49 6.29 0.65 3.32 1.01 -1.25 -4.80 116.67 124.38 2k6m s ASP 34 Ca 0.31 0.20 0.39 0.00 0.71 0.00 0.00 52.55 54.16 2k6m s ASP 34 Cb -0.12 -2.24 2.19 0.00 1.01 0.00 0.00 42.92 43.77 2k6m s ASP 34 CO 0.21 -0.29 2.30 1.55 0.21 0.00 0.00 175.17 179.16 2k6m h PRO 35 N 8.24 0.00 0.00 8.23 0.13 -1.95 -1.57 132.00 145.07 2k6m h PRO 35 Ca -0.30 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.83 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 0.69 0.00 0.00 1.47 -0.23 0.00 0.00 178.00 179.93 2k6m n LEU 36 N -3.30 0.20 -3.20 1.56 -0.00 -1.26 -4.61 117.00 106.39 2k6m n LEU 36 Ca -0.03 0.55 0.04 0.00 -0.00 0.00 0.00 56.01 56.58 2k6m n LEU 36 Cb 0.11 -0.52 -0.03 0.00 -0.00 0.00 0.00 43.42 42.98 2k6m n LEU 36 CO 0.22 -0.35 0.67 -1.59 -0.00 0.00 0.00 177.39 176.33 2k6m s LYS 37 N -3.10 0.16 -0.09 1.47 -2.85 -0.59 -5.06 119.74 109.68 2k6m s LYS 37 Ca 0.06 0.34 -0.09 0.00 -1.00 0.00 0.00 55.97 55.28 2k6m s LYS 37 Cb 0.09 0.19 -0.28 0.00 -2.06 0.00 0.00 37.83 35.77 2k6m s LYS 37 CO 0.30 -0.14 0.50 -0.07 0.10 0.00 0.00 175.35 176.04 2k6m h LEU 38 N 7.75 0.50 -1.67 2.77 4.07 -1.82 -3.37 115.31 123.55 2k6m h LEU 38 Ca -0.14 -0.95 0.43 0.00 0.08 0.00 0.00 57.88 57.30 2k6m h LEU 38 Cb 1.16 -0.16 -0.06 0.00 1.08 0.00 0.00 40.66 42.67 2k6m h LEU 38 CO -0.05 1.83 1.23 1.05 -1.08 0.00 0.00 178.44 181.41 2k6m h GLU 39 N 0.07 0.00 -0.11 1.13 4.11 -1.93 0.53 114.58 118.37 2k6m h GLU 39 Ca -0.39 0.00 -0.14 0.00 0.07 0.00 0.00 59.36 58.90 2k6m h GLU 39 Cb 2.05 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 31.29 2k6m h GLU 39 CO 0.12 0.00 -0.55 -0.84 0.07 0.00 0.00 179.01 177.81 2k6m h ILE 40 N 0.00 1.36 -1.22 -1.06 3.07 -1.97 -3.28 117.51 114.42 2k6m h ILE 40 Ca 0.70 -1.85 -0.67 0.00 1.55 0.00 0.00 64.86 64.59 2k6m h ILE 40 Cb 3.15 1.88 -0.32 0.00 -0.27 0.00 0.00 36.82 41.26 2k6m h ILE 40 CO -0.01 0.56 0.46 0.00 -1.05 0.00 0.00 178.15 178.11 2k6m n TYR 41 N -3.92 3.10 -3.68 0.16 0.18 0.18 -4.89 117.16 108.29 2k6m n TYR 41 Ca -0.02 -2.73 -0.23 0.00 1.88 0.00 0.00 57.90 56.79 2k6m n TYR 41 Cb 0.59 -1.07 -0.17 0.00 -0.38 0.00 0.00 39.34 38.31 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 -3.82 0.42 0.76 -3.48 0.05 -1.24 -3.48 118.68 107.89 2k6m s LEU 42 Ca 0.58 -0.28 -0.13 0.00 0.05 0.00 0.00 54.13 54.35 2k6m s LEU 42 Cb 0.47 -0.28 0.06 0.00 -2.05 0.00 0.00 46.19 44.38 2k6m s LEU 42 CO -0.11 -0.28 1.15 0.28 -0.55 0.00 0.00 176.35 176.85 2k6m s THR 43 N 2.08 2.67 0.30 5.48 -1.32 -1.26 -3.91 115.64 119.69 2k6m s THR 43 Ca 0.03 0.28 0.23 0.00 -1.21 0.00 0.00 61.69 61.02 2k6m s THR 43 Cb -0.14 -2.70 0.35 0.00 -1.51 0.00 0.00 72.50 68.50 2k6m s THR 43 CO -0.06 -0.23 1.05 -0.90 -2.21 0.00 0.00 174.62 172.27 2k6m n ASP 44 N -3.13 0.13 0.04 8.08 5.75 -1.26 0.24 116.55 126.41 2k6m n ASP 44 Ca 0.12 0.91 -0.13 0.00 -0.01 0.00 0.00 54.79 55.68 2k6m n ASP 44 Cb 0.52 -0.45 -0.09 0.00 -1.03 0.00 0.00 41.12 40.07 2k6m n ASP 44 CO 0.00 0.00 0.00 -0.33 -0.11 0.00 0.00 177.20 176.76 2k6m h GLU 45 N 0.00 -0.13 -0.19 0.11 5.08 -1.90 1.71 114.58 119.28 2k6m h GLU 45 Ca 0.59 0.01 -0.11 0.00 -1.00 0.00 0.00 59.36 58.85 2k6m h GLU 45 Cb 1.95 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 31.22 2k6m h GLU 45 CO -0.29 0.26 -0.37 0.22 -1.00 0.00 0.00 179.01 177.83 2k6m h ASP 46 N -0.55 0.42 -0.37 1.42 1.82 0.28 0.38 116.42 119.82 2k6m h ASP 46 Ca -0.01 -0.17 -0.16 0.00 -0.39 0.00 0.00 57.03 56.30 2k6m h ASP 46 Cb 0.45 -0.12 -0.01 0.00 0.68 0.00 0.00 39.33 40.34 2k6m h ASP 46 CO 0.02 0.76 -0.39 0.15 -1.61 0.00 0.00 179.24 178.17 2k6m h PHE 47 N 0.34 1.12 0.00 0.28 3.04 0.26 0.95 116.94 122.92 2k6m h PHE 47 Ca 0.04 -0.33 -0.19 0.00 3.98 0.00 0.00 57.97 61.47 2k6m h PHE 47 Cb 0.81 -0.23 -0.03 0.00 2.56 0.00 0.00 35.95 39.06 2k6m h PHE 47 CO 0.02 1.16 -0.88 0.93 -2.02 0.00 0.00 178.31 177.52 2k6m h GLU 48 N 0.76 0.00 0.02 1.11 5.08 0.33 0.93 114.58 122.81 2k6m h GLU 48 Ca 0.06 0.00 -0.30 0.00 -1.00 0.00 0.00 59.36 58.12 2k6m h GLU 48 Cb 0.98 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 30.19 2k6m h GLU 48 CO 0.10 0.88 -1.76 0.34 -1.00 0.00 0.00 179.01 177.57 2k6m n PHE 49 N -3.34 1.03 -0.02 4.33 7.35 0.13 -1.91 117.46 125.03 2k6m n PHE 49 Ca 0.00 0.35 0.08 0.00 -0.76 0.00 0.00 57.45 57.12 2k6m n PHE 49 Cb 0.88 -1.18 -0.17 0.00 0.35 0.00 0.00 39.48 39.37 2k6m n PHE 49 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2k6m n ALA 50 N -2.62 2.62 -0.37 3.13 0.00 0.33 -4.65 120.51 118.95 2k6m n ALA 50 Ca -0.19 -0.63 0.00 0.00 0.00 0.00 0.00 53.44 52.62 2k6m n ALA 50 Cb 1.05 -0.66 0.00 0.00 0.00 0.00 0.00 19.45 19.84 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 -2.32 0.11 -0.49 0.00 4.77 0.92 -4.61 117.00 115.37 2k6m n LEU 51 Ca -0.08 -0.17 -0.06 0.00 -0.03 0.00 0.00 56.01 55.67 2k6m n LEU 51 Cb 0.65 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.71 2k6m n LEU 51 CO 0.45 0.03 -0.06 0.47 -1.33 0.00 0.00 177.39 176.95 2k6m n ASP 52 N -0.12 -5.66 -0.89 -1.43 8.00 0.28 -4.86 116.55 111.87 2k6m n ASP 52 Ca 0.00 0.16 0.00 0.00 0.71 0.00 0.00 54.79 55.66 2k6m n ASP 52 Cb 0.09 -3.73 0.00 0.00 -0.02 0.00 0.00 41.12 37.46 2k6m n ASP 52 CO 0.00 0.00 0.00 0.80 -0.39 0.00 0.00 177.20 177.61 2k6m n MET 53 N -0.30 1.17 -4.24 -1.24 1.56 -0.30 -4.79 117.12 108.98 2k6m n MET 53 Ca -0.06 0.00 -0.13 0.00 -0.27 0.00 0.00 57.70 57.23 2k6m n MET 53 Cb 0.53 0.00 -0.10 0.00 2.15 0.00 0.00 33.22 35.80 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 -1.04 0.88 0.52 1.12 -4.23 -1.26 -1.91 115.64 109.72 2k6m s THR 54 Ca 0.00 -2.00 0.27 0.00 -1.18 0.00 0.00 61.69 58.77 2k6m s THR 54 Cb 0.00 -1.96 0.32 0.00 1.34 0.00 0.00 72.50 72.19 2k6m s THR 54 CO 0.00 -0.63 2.18 -0.09 -0.54 0.00 0.00 174.62 175.53 2k6m h ARG 55 N 2.75 0.00 -0.00 3.99 2.43 -1.88 0.16 114.38 121.83 2k6m h ARG 55 Ca -0.37 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.80 2k6m h ARG 55 Cb 1.19 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.74 2k6m h ARG 55 CO 0.64 0.05 -0.45 -0.25 -1.51 0.00 0.00 179.97 178.44 2k6m n ASP 56 N -3.89 0.60 -0.10 -3.80 9.92 -1.26 -2.31 116.55 115.71 2k6m n ASP 56 Ca -0.03 -0.37 -0.14 0.00 -0.53 0.00 0.00 54.79 53.72 2k6m n ASP 56 Cb 0.14 0.23 -0.05 0.00 -0.64 0.00 0.00 41.12 40.79 2k6m n ASP 56 CO 0.00 0.00 0.00 1.21 0.13 0.00 0.00 177.20 178.54 2k6m n GLU 57 N -1.34 0.52 0.23 -1.24 4.07 0.31 -4.27 120.64 118.92 2k6m n GLU 57 Ca 0.07 0.39 0.06 0.00 -0.06 0.00 0.00 57.16 57.61 2k6m n GLU 57 Cb 0.34 -1.58 0.54 0.00 -0.06 0.00 0.00 31.44 30.67 2k6m n GLU 57 CO 0.00 0.00 0.00 1.88 -0.06 0.00 0.00 177.13 178.95 2k6m h TYR 58 N -1.00 0.00 -0.85 4.31 -1.99 -1.00 -1.02 116.97 115.42 2k6m h TYR 58 Ca -0.20 0.00 0.25 0.00 2.00 0.00 0.00 58.73 60.77 2k6m h TYR 58 Cb 1.03 0.00 -0.03 0.00 2.00 0.00 0.00 36.73 39.72 2k6m h TYR 58 CO -0.20 0.14 0.61 -0.91 -0.00 0.00 0.00 178.16 177.80 2k6m h ASN 59 N 0.00 0.00 0.00 3.88 -0.26 -1.63 -2.57 115.58 115.00 2k6m h ASN 59 Ca -0.00 0.00 -0.23 0.00 -0.56 0.00 0.00 56.30 55.50 2k6m h ASN 59 Cb 0.26 0.00 -0.04 0.00 -1.06 0.00 0.00 38.32 37.47 2k6m h ASN 59 CO 0.02 0.00 -1.88 0.00 -1.06 0.00 0.00 177.43 174.50 2k6m n ALA 60 N -2.70 1.68 -0.71 -0.83 0.00 -0.76 -5.02 120.51 112.16 2k6m n ALA 60 Ca 0.17 -0.77 -0.31 0.00 0.00 0.00 0.00 53.44 52.53 2k6m n ALA 60 Cb 0.92 0.04 0.17 0.00 0.00 0.00 0.00 19.45 20.58 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 -5.34 2.77 0.88 0.00 1.43 -0.46 -4.92 118.68 113.05 2k6m s LEU 61 Ca -0.12 2.15 -0.16 0.00 -1.03 0.00 0.00 54.13 54.97 2k6m s LEU 61 Cb 0.04 -4.52 -0.10 0.00 0.03 0.00 0.00 46.19 41.65 2k6m s LEU 61 CO 0.46 -3.12 -0.28 -0.81 0.23 0.00 0.00 176.35 172.83 2k6m n PRO 62 N -4.24 -0.02 0.04 1.29 -0.04 -1.26 -4.83 135.00 125.93 2k6m n PRO 62 Ca 0.11 0.01 -0.01 0.00 -0.04 0.00 0.00 63.50 63.57 2k6m n PRO 62 Cb 0.52 -1.29 -0.08 0.00 -0.04 0.00 0.00 33.50 32.62 2k6m n PRO 62 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2k6m h ALA 63 N -0.90 0.66 0.05 0.55 0.00 -1.91 -2.89 119.26 114.82 2k6m h ALA 63 Ca -0.44 -0.89 -0.29 0.00 0.00 0.00 0.00 54.91 53.28 2k6m h ALA 63 Cb 1.32 0.24 -0.03 0.00 0.00 0.00 0.00 17.79 19.32 2k6m h ALA 63 CO 0.31 1.00 -1.61 -2.67 0.00 0.00 0.00 179.25 176.28 2k6m n TRP 64 N -2.99 1.07 -0.32 0.00 4.27 -1.26 -2.93 117.44 115.28 2k6m n TRP 64 Ca -0.09 0.35 -0.04 0.00 -3.89 0.00 0.00 57.50 53.84 2k6m n TRP 64 Cb 0.86 -1.12 0.08 0.00 -1.36 0.00 0.00 31.31 29.77 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 -0.57 1.17 -0.53 -2.67 3.64 -1.96 1.91 116.57 117.58 2k6m h LYS 65 Ca -0.39 -0.11 -0.01 0.00 -1.27 0.00 0.00 60.65 58.86 2k6m h LYS 65 Cb 1.61 -0.25 -0.02 0.00 -0.41 0.00 0.00 32.23 33.16 2k6m h LYS 65 CO -0.10 0.82 0.27 -0.56 -2.27 0.00 0.00 179.45 177.62 2k6m h GLN 66 N 1.19 0.75 -0.68 1.90 3.07 -1.67 -1.58 115.11 118.10 2k6m h GLN 66 Ca 0.31 -0.10 -0.08 0.00 0.09 0.00 0.00 58.65 58.88 2k6m h GLN 66 Cb -0.05 -0.14 -0.03 0.00 0.08 0.00 0.00 27.48 27.34 2k6m h GLN 66 CO -0.06 0.60 0.12 0.28 0.09 0.00 0.00 178.83 179.87 2k6m h VAL 67 N 0.71 1.26 -0.95 1.86 2.07 -1.10 -2.52 116.25 117.59 2k6m h VAL 67 Ca 0.18 -1.02 0.27 0.00 0.82 0.00 0.00 66.70 66.95 2k6m h VAL 67 Cb 0.08 0.62 -0.17 0.00 -1.52 0.00 0.00 31.29 30.30 2k6m h VAL 67 CO -0.03 0.39 0.10 -1.13 0.02 0.00 0.00 177.57 176.92 2k6m h ASN 68 N 1.03 -0.33 0.94 0.57 -1.24 0.40 0.71 115.58 117.67 2k6m h ASN 68 Ca 0.21 0.26 -0.20 0.00 0.71 0.00 0.00 56.30 57.27 2k6m h ASN 68 Cb 0.42 0.42 -0.03 0.00 0.73 0.00 0.00 38.32 39.87 2k6m h ASN 68 CO 0.01 -0.31 -0.96 0.25 -1.29 0.00 0.00 177.43 175.13 2k6m h LEU 69 N 0.05 0.02 -0.09 0.34 5.85 -1.24 -3.08 115.31 117.16 2k6m h LEU 69 Ca 0.59 -0.02 0.03 0.00 0.84 0.00 0.00 57.88 59.32 2k6m h LEU 69 Cb 1.23 -0.01 -0.03 0.00 0.37 0.00 0.00 40.66 42.23 2k6m h LEU 69 CO -0.84 0.97 -0.09 0.11 -0.34 0.00 0.00 178.44 178.25 2k6m h LYS 70 N 0.00 -0.11 -0.65 1.25 1.57 0.81 -2.28 116.57 117.16 2k6m h LYS 70 Ca -0.01 0.01 -0.02 0.00 -1.87 0.00 0.00 60.65 58.76 2k6m h LYS 70 Cb 1.70 0.02 -0.03 0.00 0.08 0.00 0.00 32.23 34.00 2k6m h LYS 70 CO 0.13 -0.07 0.34 0.87 -0.57 0.00 0.00 179.45 180.14 2k6m h LYS 71 N -0.11 0.92 -1.14 3.15 1.57 -1.29 -0.08 116.57 119.58 2k6m h LYS 71 Ca 0.07 -0.12 0.32 0.00 -1.87 0.00 0.00 60.65 59.05 2k6m h LYS 71 Cb 0.21 -0.17 -0.10 0.00 0.08 0.00 0.00 32.23 32.25 2k6m h LYS 71 CO -0.16 0.71 0.75 0.00 -0.57 0.00 0.00 179.45 180.18 2k6m h ALA 72 N 1.16 2.51 0.00 3.86 0.00 -1.32 0.62 119.26 126.09 2k6m h ALA 72 Ca 0.23 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.19 2k6m h ALA 72 Cb 0.07 0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.95 2k6m h ALA 72 CO -0.03 -0.97 -1.01 -0.22 0.00 0.00 0.00 179.25 177.02 2k6m h LYS 73 N 0.25 0.00 0.00 0.00 1.63 -1.23 -3.48 116.57 113.75 2k6m h LYS 73 Ca 0.65 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 60.45 2k6m h LYS 73 Cb 1.92 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 33.55 2k6m h LYS 73 CO -0.28 0.01 0.00 0.41 -3.45 0.00 0.00 179.45 176.14 2k6m n GLY 74 N 1.19 1.47 0.39 5.01 0.00 0.22 -5.03 105.19 108.43 2k6m n GLY 74 Ca -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.01 2k6m n GLY 74 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2k6m n LEU 75 N 0.00 0.13 0.00 0.99 4.77 -0.14 -4.95 117.00 117.81 2k6m n LEU 75 Ca 0.00 0.02 0.00 0.00 -0.03 0.00 0.00 56.01 56.00 2k6m n LEU 75 Cb 0.00 -0.33 0.00 0.00 -2.33 0.00 0.00 43.42 40.76 2k6m n LEU 75 CO 0.00 -0.50 0.00 2.22 -1.33 0.00 0.00 177.39 177.78