#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 6at1 n VAL 9 N 0.00 0.00 -4.63 1.61 0.24 -1.26 -4.89 118.33 109.40 6at1 n VAL 9 Ca 0.00 0.00 -0.28 0.00 -2.04 0.00 0.00 64.34 62.02 6at1 n VAL 9 Cb 0.00 0.00 -0.10 0.00 -1.47 0.00 0.00 33.84 32.27 6at1 n VAL 9 CO 0.00 0.00 0.00 -1.83 -2.14 0.00 0.00 176.83 172.86 6at1 s GLU 10 N 4.45 1.98 0.29 7.34 4.04 -1.26 -5.16 118.70 130.38 6at1 s GLU 10 Ca 0.00 -2.16 0.01 0.00 0.04 0.00 0.00 54.97 52.87 6at1 s GLU 10 Cb 0.00 -1.49 -0.03 0.00 0.02 0.00 0.00 34.13 32.62 6at1 s GLU 10 CO 0.00 -0.15 0.47 0.00 -1.84 0.00 0.00 175.26 173.74 6at1 s ALA 11 N -2.83 3.78 0.35 -0.84 0.00 -1.26 -5.13 121.76 115.83 6at1 s ALA 11 Ca 0.28 -0.97 0.05 0.00 0.00 0.00 0.00 51.96 51.32 6at1 s ALA 11 Cb 0.08 -1.99 -0.01 0.00 0.00 0.00 0.00 23.12 21.20 6at1 s ALA 11 CO 0.14 0.13 0.49 0.96 0.00 0.00 0.00 175.76 177.49 6at1 s ILE 12 N -2.14 4.15 -1.15 0.00 -5.25 -1.26 -5.03 121.20 110.51 6at1 s ILE 12 Ca 0.38 -0.92 -0.20 0.00 -0.99 0.00 0.00 60.65 58.93 6at1 s ILE 12 Cb -0.10 -3.45 0.07 0.00 2.95 0.00 0.00 42.46 41.93 6at1 s ILE 12 CO 0.33 -0.20 1.56 -0.54 -1.79 0.00 0.00 174.94 174.30 6at1 s LYS 13 N -4.22 3.81 -0.00 0.37 1.02 -1.26 -4.38 119.74 115.07 6at1 s LYS 13 Ca 0.45 -1.66 -0.01 0.00 0.02 0.00 0.00 55.97 54.76 6at1 s LYS 13 Cb -0.10 -5.39 0.00 0.00 -0.52 0.00 0.00 37.83 31.83 6at1 s LYS 13 CO 0.32 -2.17 0.03 -2.13 -0.92 0.00 0.00 175.35 170.48 6at1 n ARG 14 N 8.27 -4.19 -0.17 1.68 0.63 -1.26 -4.06 116.66 117.56 6at1 n ARG 14 Ca 0.40 3.05 0.00 0.00 -0.92 0.00 0.00 57.85 60.38 6at1 n ARG 14 Cb 0.48 -3.97 0.00 0.00 0.45 0.00 0.00 32.46 29.42 6at1 n ARG 14 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 6at1 n GLY 15 N 1.89 -0.75 3.74 5.14 0.00 -0.22 -0.47 105.19 114.52 6at1 n GLY 15 Ca -0.04 -0.36 -0.34 0.00 0.00 0.00 0.00 46.02 45.28 6at1 n GLY 15 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 6at1 s THR 16 N -3.95 4.52 -0.14 2.61 2.01 0.43 -1.05 115.64 120.07 6at1 s THR 16 Ca 0.00 -0.38 0.00 0.00 0.31 0.00 0.00 61.69 61.62 6at1 s THR 16 Cb 0.00 -3.01 0.02 0.00 0.01 0.00 0.00 72.50 69.53 6at1 s THR 16 CO 0.00 0.44 -0.13 -0.69 -0.69 0.00 0.00 174.62 173.55 6at1 s VAL 17 N -1.08 1.43 -0.26 3.82 1.01 -0.34 -0.44 120.40 124.54 6at1 s VAL 17 Ca 0.19 -0.55 -0.04 0.00 0.00 0.00 0.00 61.98 61.59 6at1 s VAL 17 Cb -0.12 -1.36 0.02 0.00 0.00 0.00 0.00 36.38 34.92 6at1 s VAL 17 CO 0.09 0.43 -0.01 -0.63 0.00 0.00 0.00 175.10 174.99 6at1 s ILE 18 N 1.51 3.30 0.34 2.22 1.01 0.15 -0.55 121.20 129.18 6at1 s ILE 18 Ca 0.04 -0.88 0.06 0.00 0.00 0.00 0.00 60.65 59.88 6at1 s ILE 18 Cb -0.13 -2.68 -0.07 0.00 0.01 0.00 0.00 42.46 39.60 6at1 s ILE 18 CO -0.10 0.16 -0.02 -0.62 0.00 0.00 0.00 174.94 174.37 6at1 s ASP 19 N 1.39 3.10 -1.26 3.58 2.15 -0.18 -1.34 116.67 124.12 6at1 s ASP 19 Ca 0.01 -1.29 -0.02 0.00 0.43 0.00 0.00 52.55 51.69 6at1 s ASP 19 Cb -0.17 -0.23 -0.01 0.00 -0.30 0.00 0.00 42.92 42.21 6at1 s ASP 19 CO -0.02 -0.42 0.78 1.57 -0.17 0.00 0.00 175.17 176.92 6at1 n HIS 20 N -0.74 -2.01 -3.32 -5.34 -0.00 -1.24 -0.59 115.22 101.98 6at1 n HIS 20 Ca -0.04 0.84 -0.38 0.00 0.46 0.00 0.00 57.72 58.60 6at1 n HIS 20 Cb 0.65 -4.47 -0.06 0.00 -0.12 0.00 0.00 29.99 25.99 6at1 n HIS 20 CO 0.00 0.00 0.00 0.42 0.46 0.00 0.00 176.34 177.22 6at1 s ILE 21 N -3.57 5.15 0.24 3.57 1.01 -1.24 -3.36 121.20 123.00 6at1 s ILE 21 Ca 0.06 0.97 -0.28 0.00 0.00 0.00 0.00 60.65 61.40 6at1 s ILE 21 Cb -0.01 -3.82 -0.16 0.00 0.01 0.00 0.00 42.46 38.48 6at1 s ILE 21 CO 0.79 0.36 0.74 -0.81 0.00 0.00 0.00 174.94 176.02 6at1 n PRO 22 N 3.43 0.62 -2.17 2.79 -0.04 -1.26 -1.39 135.00 136.98 6at1 n PRO 22 Ca -0.08 0.22 -0.42 0.00 -0.04 0.00 0.00 63.50 63.19 6at1 n PRO 22 Cb 0.52 -1.39 -0.03 0.00 -0.04 0.00 0.00 33.50 32.56 6at1 n PRO 22 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 6at1 s ALA 23 N -1.03 3.56 0.00 0.55 0.00 -1.25 -1.62 121.76 121.97 6at1 s ALA 23 Ca 0.61 1.15 0.00 0.00 0.00 0.00 0.00 51.96 53.72 6at1 s ALA 23 Cb -0.82 -3.51 0.00 0.00 0.00 0.00 0.00 23.12 18.79 6at1 s ALA 23 CO 0.58 -0.59 0.00 1.04 0.00 0.00 0.00 175.76 176.79 6at1 n GLN 24 N 2.98 0.00 0.03 0.00 1.13 -1.26 -4.86 117.38 115.40 6at1 n GLN 24 Ca 0.08 0.00 -0.15 0.00 -1.94 0.00 0.00 57.00 54.99 6at1 n GLN 24 Cb 0.42 -2.21 -0.14 0.00 0.11 0.00 0.00 30.24 28.42 6at1 n GLN 24 CO 0.00 0.00 0.00 0.82 -1.44 0.00 0.00 177.06 176.44 6at1 h ILE 25 N 0.00 0.98 -0.27 5.09 1.08 -1.66 -3.38 117.51 119.35 6at1 h ILE 25 Ca 0.00 -2.70 0.02 0.00 -0.39 0.00 0.00 64.86 61.79 6at1 h ILE 25 Cb 0.00 2.62 -0.03 0.00 -3.07 0.00 0.00 36.82 36.33 6at1 h ILE 25 CO 0.00 0.75 -0.16 0.61 -0.69 0.00 0.00 178.15 178.66 6at1 n GLY 26 N 1.69 -1.98 0.25 5.37 0.00 -1.21 -0.87 105.19 108.44 6at1 n GLY 26 Ca -0.19 0.56 -0.07 0.00 0.00 0.00 0.00 46.02 46.32 6at1 n GLY 26 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 6at1 h PHE 27 N 0.00 0.82 -0.84 1.61 3.57 -1.94 -1.90 116.94 118.27 6at1 h PHE 27 Ca 0.04 -0.04 0.17 0.00 3.53 0.00 0.00 57.97 61.68 6at1 h PHE 27 Cb 0.11 -0.26 -0.11 0.00 2.79 0.00 0.00 35.95 38.49 6at1 h PHE 27 CO -0.66 0.63 0.37 -0.22 -2.23 0.00 0.00 178.31 176.20 6at1 h LYS 28 N 0.78 0.47 -0.11 1.11 3.64 -1.53 0.21 116.57 121.14 6at1 h LYS 28 Ca 0.20 -0.03 -0.05 0.00 -1.27 0.00 0.00 60.65 59.50 6at1 h LYS 28 Cb 0.11 -0.11 -0.00 0.00 -0.41 0.00 0.00 32.23 31.82 6at1 h LYS 28 CO -0.03 0.31 -0.11 -0.07 -2.27 0.00 0.00 179.45 177.29 6at1 h LEU 29 N 0.49 0.28 -1.35 5.20 3.38 -0.47 -1.19 115.31 121.65 6at1 h LEU 29 Ca 0.48 -0.48 0.19 0.00 0.09 0.00 0.00 57.88 58.16 6at1 h LEU 29 Cb 0.78 -0.08 -0.08 0.00 0.09 0.00 0.00 40.66 41.38 6at1 h LEU 29 CO -0.44 0.71 0.60 -0.07 0.09 0.00 0.00 178.44 179.34 6at1 h LEU 30 N -0.14 0.54 0.00 1.67 -0.00 -0.52 -1.18 115.31 115.69 6at1 h LEU 30 Ca 0.02 0.05 -0.01 0.00 -0.00 0.00 0.00 57.88 57.94 6at1 h LEU 30 Cb 0.63 -0.05 -0.00 0.00 -0.00 0.00 0.00 40.66 41.24 6at1 h LEU 30 CO 0.03 0.22 -0.23 0.77 -0.00 0.00 0.00 178.44 179.22 6at1 h SER 31 N 0.55 0.00 -0.06 -0.43 4.64 -0.62 -2.45 113.55 115.18 6at1 h SER 31 Ca 0.49 -0.12 0.03 0.00 -0.47 0.00 0.00 61.79 61.72 6at1 h SER 31 Cb 1.03 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 63.08 6at1 h SER 31 CO -0.23 0.69 -0.17 0.25 -0.87 0.00 0.00 176.83 176.50 6at1 h LEU 32 N -1.00 -0.51 -0.49 5.97 5.85 -1.14 0.17 115.31 124.16 6at1 h LEU 32 Ca -0.02 0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.78 6at1 h LEU 32 Cb 0.33 0.23 0.00 0.00 0.37 0.00 0.00 40.66 41.59 6at1 h LEU 32 CO -0.01 -0.22 0.00 0.49 -0.34 0.00 0.00 178.44 178.35 6at1 n PHE 33 N -5.31 0.10 -3.69 1.25 3.01 -0.45 -4.92 117.46 107.45 6at1 n PHE 33 Ca -0.04 -0.05 -0.22 0.00 1.01 0.00 0.00 57.45 58.15 6at1 n PHE 33 Cb 0.22 0.00 0.04 0.00 -0.01 0.00 0.00 39.48 39.73 6at1 n PHE 33 CO 0.00 0.00 0.00 1.63 1.01 0.00 0.00 176.76 179.40 6at1 n LYS 34 N -0.29 -5.28 0.00 -1.08 5.02 0.04 -4.89 118.16 111.68 6at1 n LYS 34 Ca 0.14 0.65 0.12 0.00 -2.02 0.00 0.00 58.31 57.21 6at1 n LYS 34 Cb 0.18 -5.32 0.58 0.00 -0.02 0.00 0.00 35.03 30.45 6at1 n LYS 34 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 6at1 n LEU 35 N -4.33 0.00 -0.37 -0.35 4.77 -0.92 -3.71 117.00 112.09 6at1 n LEU 35 Ca -0.25 0.41 0.13 0.00 -0.03 0.00 0.00 56.01 56.26 6at1 n LEU 35 Cb 0.66 -0.41 0.35 0.00 -2.33 0.00 0.00 43.42 41.69 6at1 n LEU 35 CO 0.68 -0.06 0.66 0.35 -1.33 0.00 0.00 177.39 177.69 6at1 n THR 36 N -1.41 0.00 -1.59 -5.08 -2.24 -1.25 -4.34 114.28 98.37 6at1 n THR 36 Ca 0.09 -0.19 -0.29 0.00 -2.27 0.00 0.00 64.05 61.38 6at1 n THR 36 Cb 0.25 0.59 -0.05 0.00 -2.10 0.00 0.00 70.33 69.03 6at1 n THR 36 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 6at1 n GLU 37 N -0.27 2.75 -4.38 -0.78 1.02 -1.24 -4.87 120.64 112.86 6at1 n GLU 37 Ca 0.13 -2.56 -0.26 0.00 -0.02 0.00 0.00 57.16 54.45 6at1 n GLU 37 Cb 0.38 -2.22 -0.11 0.00 -0.02 0.00 0.00 31.44 29.48 6at1 n GLU 37 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 6at1 s THR 38 N -2.23 2.66 -1.09 2.62 2.01 -1.26 -5.02 115.64 113.33 6at1 s THR 38 Ca 0.58 -1.95 0.27 0.00 0.31 0.00 0.00 61.69 60.90 6at1 s THR 38 Cb 0.36 -2.31 0.16 0.00 0.01 0.00 0.00 72.50 70.72 6at1 s THR 38 CO -0.21 -0.15 1.68 0.47 -0.69 0.00 0.00 174.62 175.72 6at1 n ASP 39 N 0.07 0.30 -4.88 3.53 10.43 -1.26 -4.92 116.55 119.82 6at1 n ASP 39 Ca -0.11 0.00 -0.30 0.00 2.57 0.00 0.00 54.79 56.95 6at1 n ASP 39 Cb 0.56 -0.10 -0.04 0.00 1.84 0.00 0.00 41.12 43.39 6at1 n ASP 39 CO 0.00 0.00 0.00 -1.10 -1.07 0.00 0.00 177.20 175.03 6at1 s GLN 40 N -2.93 3.78 -0.27 -1.24 1.11 -1.26 -4.97 119.66 113.87 6at1 s GLN 40 Ca 0.15 0.34 -0.33 0.00 0.01 0.00 0.00 55.36 55.53 6at1 s GLN 40 Cb 0.18 -2.50 -0.09 0.00 -1.01 0.00 0.00 33.01 29.59 6at1 s GLN 40 CO 0.60 0.11 2.16 0.54 0.01 0.00 0.00 175.29 178.71 6at1 n ARG 41 N -0.88 1.50 -3.81 2.91 1.74 -1.26 -4.78 116.66 112.07 6at1 n ARG 41 Ca 0.01 0.43 -0.36 0.00 -0.77 0.00 0.00 57.85 57.16 6at1 n ARG 41 Cb 0.54 -2.74 -0.12 0.00 -1.02 0.00 0.00 32.46 29.11 6at1 n ARG 41 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 6at1 s ILE 42 N 7.23 4.29 -0.12 0.55 1.01 -1.26 -2.14 121.20 130.75 6at1 s ILE 42 Ca 1.05 -0.18 -0.04 0.00 0.00 0.00 0.00 60.65 61.48 6at1 s ILE 42 Cb -0.67 -2.99 -0.03 0.00 0.01 0.00 0.00 42.46 38.78 6at1 s ILE 42 CO 0.45 0.36 0.01 -0.89 0.00 0.00 0.00 174.94 174.87 6at1 s THR 43 N 1.45 4.38 -0.05 2.92 2.01 -0.53 -4.97 115.64 120.85 6at1 s THR 43 Ca 0.05 -0.21 0.02 0.00 0.31 0.00 0.00 61.69 61.87 6at1 s THR 43 Cb -0.15 -2.89 0.01 0.00 0.01 0.00 0.00 72.50 69.49 6at1 s THR 43 CO 0.03 0.55 -0.09 -0.63 -0.69 0.00 0.00 174.62 173.79 6at1 s ILE 44 N -0.38 0.88 -0.10 1.82 1.01 -1.26 -0.80 121.20 122.36 6at1 s ILE 44 Ca 0.08 -0.35 0.01 0.00 0.00 0.00 0.00 60.65 60.39 6at1 s ILE 44 Cb -0.12 -0.82 -0.02 0.00 0.01 0.00 0.00 42.46 41.51 6at1 s ILE 44 CO 0.02 0.29 -0.15 -0.83 0.00 0.00 0.00 174.94 174.28 6at1 s GLY 45 N 0.63 1.51 -0.07 6.18 0.00 -0.71 -5.02 107.32 109.85 6at1 s GLY 45 Ca -0.11 -0.92 0.04 0.00 0.00 0.00 0.00 44.72 43.72 6at1 s GLY 45 CO 0.02 -0.36 -0.19 1.08 0.00 0.00 0.00 173.10 173.65 6at1 s LEU 46 N 0.06 2.45 -1.16 0.66 1.43 -1.26 -1.59 118.68 119.26 6at1 s LEU 46 Ca -0.06 -0.35 -0.01 0.00 -1.03 0.00 0.00 54.13 52.68 6at1 s LEU 46 Cb -0.15 -1.49 -0.02 0.00 0.03 0.00 0.00 46.19 44.57 6at1 s LEU 46 CO 0.05 0.27 0.98 0.59 0.23 0.00 0.00 176.35 178.47 6at1 n ASN 47 N 2.78 -3.14 -4.80 2.29 3.02 -0.94 -4.98 115.26 109.49 6at1 n ASN 47 Ca -0.17 -0.64 -0.36 0.00 -0.03 0.00 0.00 54.58 53.37 6at1 n ASN 47 Cb 0.52 -5.15 -0.06 0.00 -0.61 0.00 0.00 39.78 34.48 6at1 n ASN 47 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 6at1 s LEU 48 N -6.13 4.31 0.00 3.41 1.43 -0.00 -4.79 118.68 116.91 6at1 s LEU 48 Ca 0.11 1.64 0.00 0.00 -1.03 0.00 0.00 54.13 54.85 6at1 s LEU 48 Cb -0.01 -3.87 0.00 0.00 0.03 0.00 0.00 46.19 42.34 6at1 s LEU 48 CO 0.73 -0.05 0.00 -0.81 0.23 0.00 0.00 176.35 176.46 6at1 n PRO 49 N 0.54 0.00 -3.52 1.29 -0.04 -1.26 -0.67 135.00 131.34 6at1 n PRO 49 Ca 0.01 0.00 -0.28 0.00 -0.04 0.00 0.00 63.50 63.19 6at1 n PRO 49 Cb 0.51 0.00 -0.05 0.00 -0.04 0.00 0.00 33.50 33.91 6at1 n PRO 49 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 6at1 n SER 50 N 0.00 -1.04 0.00 3.54 3.41 -1.26 -4.10 113.62 114.17 6at1 n SER 50 Ca 0.00 -0.82 0.00 0.00 -0.26 0.00 0.00 58.87 57.79 6at1 n SER 50 Cb 0.00 -1.05 0.00 0.00 -0.26 0.00 0.00 64.21 62.90 6at1 n SER 50 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 6at1 n GLY 51 N -0.97 0.86 3.92 5.00 0.00 -1.26 0.46 105.19 113.19 6at1 n GLY 51 Ca 0.05 -0.65 -0.26 0.00 0.00 0.00 0.00 46.02 45.16 6at1 n GLY 51 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 6at1 s GLU 52 N -2.00 3.43 -0.35 1.61 0.41 -1.26 -4.21 118.70 116.33 6at1 s GLU 52 Ca 0.00 0.02 -0.02 0.00 -0.41 0.00 0.00 54.97 54.56 6at1 s GLU 52 Cb 0.00 -2.44 0.00 0.00 -1.78 0.00 0.00 34.13 29.92 6at1 s GLU 52 CO 0.00 -0.19 0.30 -1.33 -0.49 0.00 0.00 175.26 173.55 6at1 n MET 53 N -2.18 -2.04 0.00 1.61 2.81 -1.26 -4.70 117.12 111.35 6at1 n MET 53 Ca -0.00 0.22 0.00 0.00 -1.81 0.00 0.00 57.70 56.11 6at1 n MET 53 Cb 0.56 -3.40 0.00 0.00 -0.71 0.00 0.00 33.22 29.67 6at1 n MET 53 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 6at1 n GLY 54 N -0.94 1.90 3.41 3.03 0.00 -1.26 -4.71 105.19 106.62 6at1 n GLY 54 Ca -0.02 -0.21 -0.35 0.00 0.00 0.00 0.00 46.02 45.44 6at1 n GLY 54 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 6at1 s ARG 55 N 0.00 3.55 0.44 1.61 1.04 -1.24 -4.03 118.95 120.33 6at1 s ARG 55 Ca 0.00 -0.55 0.05 0.00 -1.04 0.00 0.00 55.73 54.20 6at1 s ARG 55 Cb 0.00 -3.09 0.05 0.00 -2.04 0.00 0.00 34.95 29.87 6at1 s ARG 55 CO 0.00 -0.08 0.45 0.36 -0.04 0.00 0.00 175.30 176.00 6at1 n LYS 56 N 4.50 0.78 -4.63 3.89 2.85 0.16 -3.91 118.16 121.79 6at1 n LYS 56 Ca -0.17 -2.61 -0.29 0.00 -1.05 0.00 0.00 58.31 54.19 6at1 n LYS 56 Cb 0.51 0.09 -0.10 0.00 -0.65 0.00 0.00 35.03 34.88 6at1 n LYS 56 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 177.40 176.84 6at1 s ASP 57 N -3.67 3.84 -0.26 -5.58 -0.00 -0.49 -0.82 116.67 109.70 6at1 s ASP 57 Ca 0.34 -1.42 -0.18 0.00 -0.00 0.00 0.00 52.55 51.29 6at1 s ASP 57 Cb -0.03 -0.23 0.07 0.00 -0.00 0.00 0.00 42.92 42.74 6at1 s ASP 57 CO 0.22 -0.53 0.66 -0.22 -0.00 0.00 0.00 175.17 175.30 6at1 s LEU 58 N -3.73 -0.72 -0.02 1.23 0.20 -0.62 -3.64 118.68 111.37 6at1 s LEU 58 Ca 0.30 1.40 0.03 0.00 0.69 0.00 0.00 54.13 56.55 6at1 s LEU 58 Cb 0.09 2.26 -0.00 0.00 -0.43 0.00 0.00 46.19 48.11 6at1 s LEU 58 CO 0.15 -0.23 -0.11 -0.63 -0.29 0.00 0.00 176.35 175.24 6at1 s ILE 59 N 1.11 0.92 -0.22 6.68 1.01 -0.45 -1.74 121.20 128.50 6at1 s ILE 59 Ca -0.06 -0.45 0.02 0.00 0.00 0.00 0.00 60.65 60.15 6at1 s ILE 59 Cb -0.05 -0.80 0.05 0.00 0.01 0.00 0.00 42.46 41.67 6at1 s ILE 59 CO -0.11 0.28 -0.10 -0.54 0.00 0.00 0.00 174.94 174.46 6at1 s LYS 60 N 0.06 2.11 -0.25 2.79 1.02 0.02 -0.67 119.74 124.82 6at1 s LYS 60 Ca -0.01 -1.04 -0.11 0.00 0.02 0.00 0.00 55.97 54.83 6at1 s LYS 60 Cb -0.08 -2.62 -0.05 0.00 -0.52 0.00 0.00 37.83 34.55 6at1 s LYS 60 CO 0.01 -0.49 0.17 0.42 -0.92 0.00 0.00 175.35 174.53 6at1 s ILE 61 N 1.29 5.32 0.26 2.17 1.01 0.42 -1.45 121.20 130.23 6at1 s ILE 61 Ca -0.04 0.17 -0.20 0.00 0.00 0.00 0.00 60.65 60.58 6at1 s ILE 61 Cb -0.18 -3.50 -0.09 0.00 0.01 0.00 0.00 42.46 38.71 6at1 s ILE 61 CO -0.07 0.32 0.77 -0.70 0.00 0.00 0.00 174.94 175.25 6at1 s GLU 62 N 1.27 4.25 0.00 2.79 2.12 -0.91 -0.43 118.70 127.79 6at1 s GLU 62 Ca 0.07 0.90 0.00 0.00 0.36 0.00 0.00 54.97 56.31 6at1 s GLU 62 Cb -0.14 -2.76 0.00 0.00 0.26 0.00 0.00 34.13 31.49 6at1 s GLU 62 CO 0.06 0.32 0.00 0.09 -0.54 0.00 0.00 175.26 175.19 6at1 n ASN 63 N 0.44 0.00 -4.78 -1.70 5.03 0.38 -4.77 115.26 109.87 6at1 n ASN 63 Ca -0.00 0.00 -0.35 0.00 0.87 0.00 0.00 54.58 55.10 6at1 n ASN 63 Cb 0.51 0.00 -0.01 0.00 -1.02 0.00 0.00 39.78 39.27 6at1 n ASN 63 CO 0.00 0.00 0.00 -0.89 -1.83 0.00 0.00 177.26 174.54 6at1 s THR 64 N 0.00 3.28 -0.08 3.41 2.01 -1.26 -4.74 115.64 118.26 6at1 s THR 64 Ca 0.00 0.80 0.00 0.00 0.31 0.00 0.00 61.69 62.81 6at1 s THR 64 Cb 0.00 -3.33 0.02 0.00 0.01 0.00 0.00 72.50 69.20 6at1 s THR 64 CO 0.00 -0.16 -0.06 -0.36 -0.69 0.00 0.00 174.62 173.35 6at1 s PHE 65 N -1.80 1.11 -0.07 4.92 0.40 -1.26 -2.33 117.98 118.96 6at1 s PHE 65 Ca 0.71 -0.44 -0.28 0.00 -0.60 0.00 0.00 56.93 56.32 6at1 s PHE 65 Cb -0.23 -0.96 -0.02 0.00 0.51 0.00 0.00 43.02 42.32 6at1 s PHE 65 CO 0.26 -0.35 0.93 -0.51 0.70 0.00 0.00 175.22 176.25 6at1 s LEU 66 N 1.38 4.30 0.69 -0.37 1.43 -1.26 -5.02 118.68 119.83 6at1 s LEU 66 Ca -0.03 1.49 -0.16 0.00 -1.03 0.00 0.00 54.13 54.40 6at1 s LEU 66 Cb -0.14 -3.45 0.02 0.00 0.03 0.00 0.00 46.19 42.65 6at1 s LEU 66 CO -0.03 -0.32 1.25 -0.44 0.23 0.00 0.00 176.35 177.04 6at1 s SER 67 N 1.03 4.37 0.33 2.29 0.01 -1.26 -4.65 113.70 115.81 6at1 s SER 67 Ca 0.47 2.49 0.21 0.00 1.31 0.00 0.00 55.95 60.43 6at1 s SER 67 Cb -0.19 -2.60 1.14 0.00 0.21 0.00 0.00 66.02 64.58 6at1 s SER 67 CO 0.21 -2.15 1.27 -0.62 0.41 0.00 0.00 173.24 172.36 6at1 n GLU 68 N -2.34 -0.04 0.29 12.44 4.71 -1.26 0.34 120.64 134.78 6at1 n GLU 68 Ca 0.15 1.07 -0.14 0.00 -0.01 0.00 0.00 57.16 58.23 6at1 n GLU 68 Cb 0.49 -2.00 -0.07 0.00 -1.01 0.00 0.00 31.44 28.85 6at1 n GLU 68 CO 0.00 0.00 0.00 -0.44 0.09 0.00 0.00 177.13 176.78 6at1 h ASP 69 N 0.00 -0.65 -0.65 1.62 3.45 -2.00 -2.63 116.42 115.57 6at1 h ASP 69 Ca 0.70 -0.03 -0.03 0.00 0.43 0.00 0.00 57.03 58.10 6at1 h ASP 69 Cb 2.04 0.17 -0.03 0.00 -0.56 0.00 0.00 39.33 40.94 6at1 h ASP 69 CO -0.51 -0.27 0.31 1.56 -1.57 0.00 0.00 179.24 178.76 6at1 h GLN 70 N -1.10 0.96 -0.32 3.56 4.20 -0.45 -0.41 115.11 121.56 6at1 h GLN 70 Ca -0.08 -0.14 0.06 0.00 0.06 0.00 0.00 58.65 58.56 6at1 h GLN 70 Cb 0.64 -0.18 -0.06 0.00 0.30 0.00 0.00 27.48 28.19 6at1 h GLN 70 CO 0.13 0.75 -0.05 0.28 -0.67 0.00 0.00 178.83 179.27 6at1 h VAL 71 N 0.95 0.71 0.00 -0.54 2.07 -1.23 -1.14 116.25 117.08 6at1 h VAL 71 Ca 0.23 -0.01 -0.03 0.00 0.82 0.00 0.00 66.70 67.71 6at1 h VAL 71 Cb 0.12 0.68 -0.00 0.00 -1.52 0.00 0.00 31.29 30.57 6at1 h VAL 71 CO -0.03 0.01 -0.14 0.44 0.02 0.00 0.00 177.57 177.87 6at1 h ASP 72 N 0.03 0.00 0.64 0.57 5.19 -0.71 -2.93 116.42 119.21 6at1 h ASP 72 Ca 0.15 0.00 -0.01 0.00 -0.62 0.00 0.00 57.03 56.55 6at1 h ASP 72 Cb 0.23 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 39.73 6at1 h ASP 72 CO -0.30 0.14 -0.05 1.56 -3.12 0.00 0.00 179.24 177.46 6at1 h GLN 73 N 0.00 0.00 0.00 3.56 1.08 -0.34 -1.21 115.11 118.20 6at1 h GLN 73 Ca -0.00 0.00 -0.05 0.00 -1.45 0.00 0.00 58.65 57.15 6at1 h GLN 73 Cb 0.27 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.70 6at1 h GLN 73 CO 0.02 0.05 -0.22 -0.07 -0.95 0.00 0.00 178.83 177.65 6at1 h LEU 74 N 0.00 0.00 -1.13 1.46 3.38 -1.41 -3.37 115.31 114.24 6at1 h LEU 74 Ca -0.00 0.00 0.32 0.00 0.09 0.00 0.00 57.88 58.29 6at1 h LEU 74 Cb 0.39 0.00 -0.13 0.00 0.09 0.00 0.00 40.66 41.00 6at1 h LEU 74 CO 0.01 0.22 0.63 0.00 0.09 0.00 0.00 178.44 179.39 6at1 h ALA 75 N 1.78 2.10 0.00 1.53 0.00 -1.38 0.69 119.26 123.98 6at1 h ALA 75 Ca -0.00 0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.05 6at1 h ALA 75 Cb 0.75 0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.66 6at1 h ALA 75 CO 0.03 -0.66 0.00 -0.07 0.00 0.00 0.00 179.25 178.55 6at1 h LEU 76 N 0.34 0.00 0.00 0.00 3.38 -1.82 -3.05 115.31 114.16 6at1 h LEU 76 Ca 0.71 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 58.47 6at1 h LEU 76 Cb 1.72 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 42.44 6at1 h LEU 76 CO -0.50 0.00 -1.59 -1.22 0.09 0.00 0.00 178.44 175.22 6at1 n TYR 77 N -2.96 0.00 -0.95 1.13 4.01 -0.24 -4.83 117.16 113.32 6at1 n TYR 77 Ca 0.01 0.00 0.02 0.00 -0.16 0.00 0.00 57.90 57.78 6at1 n TYR 77 Cb 0.33 -0.61 0.37 0.00 -0.31 0.00 0.00 39.34 39.13 6at1 n TYR 77 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 6at1 n ALA 78 N -4.09 4.16 0.27 -0.72 0.00 0.07 -4.76 120.51 115.44 6at1 n ALA 78 Ca -0.29 -2.07 0.15 0.00 0.00 0.00 0.00 53.44 51.23 6at1 n ALA 78 Cb 0.63 -1.18 0.72 0.00 0.00 0.00 0.00 19.45 19.62 6at1 n ALA 78 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 6at1 h PRO 79 N 3.56 0.00 -0.64 0.00 0.13 -1.71 0.27 132.00 133.61 6at1 h PRO 79 Ca 0.10 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.23 6at1 h PRO 79 Cb 2.13 0.00 0.00 0.00 0.13 0.00 0.00 31.00 33.26 6at1 h PRO 79 CO 0.59 0.00 0.00 1.04 -0.23 0.00 0.00 178.00 179.40 6at1 n GLN 80 N -3.03 2.95 -1.44 0.86 6.02 -1.26 -4.21 117.38 117.27 6at1 n GLN 80 Ca 0.01 -2.60 -0.31 0.00 -0.01 0.00 0.00 57.00 54.09 6at1 n GLN 80 Cb 0.51 -1.58 0.08 0.00 1.02 0.00 0.00 30.24 30.27 6at1 n GLN 80 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 6at1 s ALA 81 N -1.20 2.34 -0.12 -1.58 0.00 0.95 -4.85 121.76 117.30 6at1 s ALA 81 Ca 0.45 0.05 0.01 0.00 0.00 0.00 0.00 51.96 52.47 6at1 s ALA 81 Cb 0.25 -3.19 0.02 0.00 0.00 0.00 0.00 23.12 20.20 6at1 s ALA 81 CO 0.28 -1.61 -0.15 0.99 0.00 0.00 0.00 175.76 175.26 6at1 s THR 82 N -3.02 1.54 -1.12 0.00 2.01 0.24 -4.00 115.64 111.29 6at1 s THR 82 Ca 0.60 -0.66 -0.09 0.00 0.31 0.00 0.00 61.69 61.85 6at1 s THR 82 Cb -0.15 -1.41 0.27 0.00 0.01 0.00 0.00 72.50 71.22 6at1 s THR 82 CO 0.55 0.45 1.15 0.52 -0.69 0.00 0.00 174.62 176.60 6at1 n VAL 83 N 4.32 4.58 -2.86 3.82 0.31 0.73 -1.01 118.33 128.22 6at1 n VAL 83 Ca -0.19 -5.37 -0.37 0.00 -0.01 0.00 0.00 64.34 58.40 6at1 n VAL 83 Cb 0.51 -2.57 -0.06 0.00 -0.91 0.00 0.00 33.84 30.81 6at1 n VAL 83 CO 0.00 0.00 0.00 0.20 -1.32 0.00 0.00 176.83 175.71 6at1 s ASN 84 N 1.31 7.33 -0.20 4.52 0.01 0.29 -1.22 114.94 126.98 6at1 s ASN 84 Ca 0.32 1.75 -0.02 0.00 -0.71 0.00 0.00 52.86 54.19 6at1 s ASN 84 Cb -0.09 -2.54 0.00 0.00 0.41 0.00 0.00 41.25 39.03 6at1 s ASN 84 CO -0.07 0.01 -0.10 -0.60 -1.51 0.00 0.00 177.10 174.83 6at1 s ARG 85 N -1.83 3.25 -0.09 -0.60 6.06 0.44 -1.20 118.95 124.99 6at1 s ARG 85 Ca 0.46 -0.69 0.04 0.00 -2.50 0.00 0.00 55.73 53.03 6at1 s ARG 85 Cb -0.20 -2.84 -0.01 0.00 0.06 0.00 0.00 34.95 31.96 6at1 s ARG 85 CO 0.25 -0.18 -0.20 0.42 -2.50 0.00 0.00 175.30 173.09 6at1 s ILE 86 N 1.35 2.45 -0.02 4.11 1.09 -0.22 -0.33 121.20 129.65 6at1 s ILE 86 Ca 0.05 -0.90 0.01 0.00 -1.10 0.00 0.00 60.65 58.70 6at1 s ILE 86 Cb -0.14 -1.96 0.01 0.00 -1.06 0.00 0.00 42.46 39.32 6at1 s ILE 86 CO -0.06 0.56 -0.02 -0.62 -0.10 0.00 0.00 174.94 174.70 6at1 s ASP 87 N 0.04 0.42 -1.38 3.58 -1.08 -0.51 -1.06 116.67 116.69 6at1 s ASP 87 Ca -0.08 -0.04 -0.04 0.00 -0.52 0.00 0.00 52.55 51.87 6at1 s ASP 87 Cb -0.15 -0.16 0.02 0.00 -1.46 0.00 0.00 42.92 41.18 6at1 s ASP 87 CO 0.05 -0.04 0.75 -3.20 0.52 0.00 0.00 175.17 173.26 6at1 n ASN 88 N 3.65 -2.05 -1.11 -0.34 5.15 -1.26 -1.91 115.26 117.38 6at1 n ASN 88 Ca -0.21 -0.82 -0.12 0.00 -0.60 0.00 0.00 54.58 52.82 6at1 n ASN 88 Cb 0.54 -3.93 -0.05 0.00 -0.53 0.00 0.00 39.78 35.81 6at1 n ASN 88 CO 0.00 0.00 0.00 -1.22 1.40 0.00 0.00 177.26 177.44 6at1 n TYR 89 N -4.39 -0.17 -4.17 1.20 4.01 -1.26 -4.94 117.16 107.43 6at1 n TYR 89 Ca -0.21 0.00 -0.16 0.00 -0.16 0.00 0.00 57.90 57.37 6at1 n TYR 89 Cb 0.64 -2.62 -0.13 0.00 -0.31 0.00 0.00 39.34 36.92 6at1 n TYR 89 CO 0.00 0.00 0.00 -1.21 -0.46 0.00 0.00 176.86 175.19 6at1 s GLU 90 N -2.93 0.60 -0.62 -0.72 2.02 -0.80 -4.98 118.70 111.26 6at1 s GLU 90 Ca 0.00 -0.57 -0.26 0.00 0.02 0.00 0.00 54.97 54.15 6at1 s GLU 90 Cb 0.00 -0.49 -0.03 0.00 0.10 0.00 0.00 34.13 33.71 6at1 s GLU 90 CO 0.00 0.12 1.94 0.08 0.02 0.00 0.00 175.26 177.42 6at1 s VAL 91 N -0.84 3.31 -0.13 2.63 1.01 -1.26 -1.43 120.40 123.69 6at1 s VAL 91 Ca -0.03 0.13 0.23 0.00 0.00 0.00 0.00 61.98 62.31 6at1 s VAL 91 Cb -0.07 -3.82 0.25 0.00 0.00 0.00 0.00 36.38 32.74 6at1 s VAL 91 CO 0.00 -0.79 1.69 1.62 0.00 0.00 0.00 175.10 177.62 6at1 h VAL 92 N 7.02 0.36 -3.28 2.92 3.04 -0.93 -3.47 116.25 121.91 6at1 h VAL 92 Ca -0.23 -1.25 -0.04 0.00 -1.01 0.00 0.00 66.70 64.17 6at1 h VAL 92 Cb 1.16 1.96 -0.13 0.00 -2.01 0.00 0.00 31.29 32.28 6at1 h VAL 92 CO 1.21 0.18 0.01 -0.83 -1.01 0.00 0.00 177.57 177.13 6at1 s GLY 93 N -4.29 -0.37 -0.11 3.17 0.00 -1.05 -5.01 107.32 99.65 6at1 s GLY 93 Ca 0.04 0.11 -0.02 0.00 0.00 0.00 0.00 44.72 44.84 6at1 s GLY 93 CO 0.66 -0.17 0.01 1.25 0.00 0.00 0.00 173.10 174.84 6at1 s LYS 94 N -3.78 0.67 -0.06 2.90 2.20 -1.26 -0.42 119.74 119.99 6at1 s LYS 94 Ca 0.02 -0.08 0.00 0.00 -0.36 0.00 0.00 55.97 55.55 6at1 s LYS 94 Cb 0.01 -1.38 -0.03 0.00 -1.51 0.00 0.00 37.83 34.92 6at1 s LYS 94 CO -0.12 -0.41 -0.04 -1.12 -0.36 0.00 0.00 175.35 173.30 6at1 s SER 95 N 1.92 4.90 -0.10 1.43 0.01 -0.36 -4.97 113.70 116.54 6at1 s SER 95 Ca 0.03 0.02 -0.00 0.00 1.31 0.00 0.00 55.95 57.31 6at1 s SER 95 Cb -0.14 -1.28 -0.02 0.00 0.21 0.00 0.00 66.02 64.79 6at1 s SER 95 CO -0.06 0.35 -0.09 -0.13 0.41 0.00 0.00 173.24 173.72 6at1 s ARG 96 N -1.02 3.12 -0.18 12.44 1.81 -1.26 -0.19 118.95 133.67 6at1 s ARG 96 Ca 0.14 -0.59 -0.35 0.00 -1.72 0.00 0.00 55.73 53.20 6at1 s ARG 96 Cb -0.11 -2.66 -0.12 0.00 -0.45 0.00 0.00 34.95 31.61 6at1 s ARG 96 CO 0.04 0.43 1.92 -2.30 -0.68 0.00 0.00 175.30 174.71 6at1 n PRO 97 N 2.91 1.77 -3.98 3.54 -0.02 -1.26 -4.93 135.00 133.03 6at1 n PRO 97 Ca -0.18 0.62 -0.29 0.00 -2.02 0.00 0.00 63.50 61.64 6at1 n PRO 97 Cb 0.53 -2.53 -0.04 0.00 -0.02 0.00 0.00 33.50 31.44 6at1 n PRO 97 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 6at1 s SER 98 N 4.69 6.04 0.09 2.55 0.01 -1.26 -4.84 113.70 120.99 6at1 s SER 98 Ca 0.97 0.12 -0.30 0.00 1.31 0.00 0.00 55.95 58.05 6at1 s SER 98 Cb -0.79 -1.76 -0.05 0.00 0.21 0.00 0.00 66.02 63.63 6at1 s SER 98 CO 0.54 0.12 1.02 -0.22 0.41 0.00 0.00 173.24 175.10 6at1 s LEU 99 N -2.78 4.45 0.00 2.44 2.96 -1.26 -4.50 118.68 119.99 6at1 s LEU 99 Ca 0.33 1.84 -0.15 0.00 -0.22 0.00 0.00 54.13 55.92 6at1 s LEU 99 Cb -0.12 -3.59 0.23 0.00 0.50 0.00 0.00 46.19 43.21 6at1 s LEU 99 CO 0.26 -0.18 0.85 -0.81 -1.32 0.00 0.00 176.35 175.15 6at1 n PRO 100 N 3.08 -2.49 0.00 0.98 -0.04 -1.26 -5.01 135.00 130.26 6at1 n PRO 100 Ca 0.04 -1.36 0.01 0.00 -0.04 0.00 0.00 63.50 62.15 6at1 n PRO 100 Cb 0.49 -1.23 -0.01 0.00 -0.04 0.00 0.00 33.50 32.71 6at1 n PRO 100 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 6at1 n GLU 101 N -3.97 4.77 -3.63 0.54 -0.00 -1.26 -4.74 120.64 112.35 6at1 n GLU 101 Ca 0.12 -0.14 -0.13 0.00 -0.00 0.00 0.00 57.16 57.00 6at1 n GLU 101 Cb 0.45 -0.70 -0.13 0.00 -0.00 0.00 0.00 31.44 31.06 6at1 n GLU 101 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.13 177.63 6at1 s ARG 102 N -1.00 0.18 -0.17 3.44 3.52 -1.26 -1.60 118.95 122.06 6at1 s ARG 102 Ca 0.01 0.70 -0.08 0.00 -0.13 0.00 0.00 55.73 56.24 6at1 s ARG 102 Cb 0.02 -0.15 -0.04 0.00 -1.56 0.00 0.00 34.95 33.21 6at1 s ARG 102 CO 0.08 -0.34 0.10 0.42 -0.81 0.00 0.00 175.30 174.75 6at1 s ILE 103 N 2.43 5.15 0.15 4.11 1.01 -1.05 -4.95 121.20 128.05 6at1 s ILE 103 Ca 0.02 0.09 0.11 0.00 0.00 0.00 0.00 60.65 60.87 6at1 s ILE 103 Cb -0.13 -3.30 -0.04 0.00 0.01 0.00 0.00 42.46 39.00 6at1 s ILE 103 CO -0.10 0.50 -0.25 -1.81 0.00 0.00 0.00 174.94 173.29 6at1 s ASP 104 N -0.07 3.42 0.00 3.58 1.11 -1.26 -1.76 116.67 121.69 6at1 s ASP 104 Ca 0.08 -0.76 0.00 0.00 0.18 0.00 0.00 52.55 52.06 6at1 s ASP 104 Cb -0.12 -0.27 0.00 0.00 1.07 0.00 0.00 42.92 43.61 6at1 s ASP 104 CO 0.00 0.16 0.00 -0.46 1.18 0.00 0.00 175.17 176.06 6at1 n ASN 105 N 0.72 0.00 -0.02 0.27 6.94 0.31 -4.48 115.26 119.00 6at1 n ASN 105 Ca -0.16 0.00 0.02 0.00 -0.02 0.00 0.00 54.58 54.41 6at1 n ASN 105 Cb 0.54 0.00 -0.07 0.00 -2.36 0.00 0.00 39.78 37.89 6at1 n ASN 105 CO 0.00 0.00 0.00 0.52 -1.03 0.00 0.00 177.26 176.75 6at1 n VAL 106 N -0.18 0.20 -3.20 3.53 0.31 -1.26 -4.81 118.33 112.93 6at1 n VAL 106 Ca 0.00 -0.26 -0.18 0.00 -0.01 0.00 0.00 64.34 63.89 6at1 n VAL 106 Cb 0.00 -0.08 0.00 0.00 -0.91 0.00 0.00 33.84 32.85 6at1 n VAL 106 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 6at1 s LEU 107 N -3.98 3.70 -0.06 7.52 1.43 -1.26 -5.12 118.68 120.91 6at1 s LEU 107 Ca -0.04 -0.40 -0.00 0.00 -1.03 0.00 0.00 54.13 52.66 6at1 s LEU 107 Cb 0.05 -2.61 0.03 0.00 0.03 0.00 0.00 46.19 43.69 6at1 s LEU 107 CO 0.37 -0.66 -0.02 -0.69 0.23 0.00 0.00 176.35 175.58 6at1 s VAL 108 N -2.32 0.48 0.10 -1.59 1.01 -1.26 -4.75 120.40 112.07 6at1 s VAL 108 Ca 0.52 0.00 -0.32 0.00 0.00 0.00 0.00 61.98 62.18 6at1 s VAL 108 Cb -0.09 -0.58 -0.11 0.00 0.00 0.00 0.00 36.38 35.60 6at1 s VAL 108 CO 0.32 0.25 1.81 0.00 0.00 0.00 0.00 175.10 177.48 6at1 h PRO 110 N 8.25 0.00 -6.29 0.00 0.11 -1.91 -3.42 132.00 128.74 6at1 h PRO 110 Ca -0.46 0.00 -0.55 0.00 0.11 0.00 0.00 66.00 65.09 6at1 h PRO 110 Cb 1.23 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.30 6at1 h PRO 110 CO 0.94 0.00 1.22 1.21 -0.21 0.00 0.00 178.00 181.15 6at1 s ASN 111 N -4.67 5.89 0.12 -2.05 3.84 -1.26 -4.84 114.94 111.97 6at1 s ASN 111 Ca 0.04 0.78 0.17 0.00 0.21 0.00 0.00 52.86 54.06 6at1 s ASN 111 Cb 0.09 -2.53 0.74 0.00 -0.55 0.00 0.00 41.25 39.00 6at1 s ASN 111 CO 0.45 -1.80 1.53 -1.54 -2.79 0.00 0.00 177.10 172.95 6at1 n SER 112 N 10.40 0.29 -1.00 -4.21 3.41 -1.26 -1.94 113.62 119.32 6at1 n SER 112 Ca 0.19 0.58 0.08 0.00 -0.26 0.00 0.00 58.87 59.46 6at1 n SER 112 Cb 0.49 -0.64 0.26 0.00 -0.26 0.00 0.00 64.21 64.06 6at1 n SER 112 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 6at1 n ASN 113 N -1.83 3.92 -4.74 4.04 5.15 -1.26 -4.94 115.26 115.60 6at1 n ASN 113 Ca 0.02 -2.70 -0.41 0.00 -0.60 0.00 0.00 54.58 50.89 6at1 n ASN 113 Cb 0.17 -0.49 -0.05 0.00 -0.53 0.00 0.00 39.78 38.89 6at1 n ASN 113 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 6at1 h ILE 115 N 3.79 0.01 -0.88 0.00 6.09 -1.92 -3.25 117.51 121.35 6at1 h ILE 115 Ca -0.44 -0.31 0.17 0.00 -1.37 0.00 0.00 64.86 62.92 6at1 h ILE 115 Cb 1.21 1.30 -0.10 0.00 0.47 0.00 0.00 36.82 39.69 6at1 h ILE 115 CO 0.71 0.00 0.44 0.77 -3.07 0.00 0.00 178.15 177.00 6at1 h SER 116 N 0.00 0.49 -0.58 2.19 4.64 -1.93 -2.89 113.55 115.47 6at1 h SER 116 Ca -0.00 0.11 0.07 0.00 -0.47 0.00 0.00 61.79 61.50 6at1 h SER 116 Cb 0.30 0.04 -0.10 0.00 -0.31 0.00 0.00 62.40 62.34 6at1 h SER 116 CO 0.00 0.16 -0.54 0.45 -0.87 0.00 0.00 176.83 176.03 6at1 h HIS 117 N 0.57 -1.66 -0.16 4.77 3.86 -1.93 -1.85 115.15 118.75 6at1 h HIS 117 Ca 0.50 0.09 0.00 0.00 -1.16 0.00 0.00 60.37 59.81 6at1 h HIS 117 Cb 0.81 0.80 0.00 0.00 1.06 0.00 0.00 27.41 30.08 6at1 h HIS 117 CO -0.10 -0.45 0.00 0.00 0.86 0.00 0.00 177.93 178.24 6at1 n ALA 118 N -3.14 2.50 -2.32 2.45 0.00 -1.09 -4.95 120.51 113.96 6at1 n ALA 118 Ca -0.01 -0.34 -0.17 0.00 0.00 0.00 0.00 53.44 52.92 6at1 n ALA 118 Cb 0.33 -1.06 -0.10 0.00 0.00 0.00 0.00 19.45 18.62 6at1 n ALA 118 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 6at1 s GLU 119 N -1.79 1.20 -0.04 0.00 0.41 -0.70 -5.02 118.70 112.75 6at1 s GLU 119 Ca 0.19 -1.51 -0.03 0.00 -0.41 0.00 0.00 54.97 53.21 6at1 s GLU 119 Cb 0.10 -0.91 -0.14 0.00 -1.78 0.00 0.00 34.13 31.40 6at1 s GLU 119 CO 0.14 0.14 2.14 -0.35 -0.49 0.00 0.00 175.26 176.84 6at1 n PRO 120 N -0.24 1.09 -4.47 0.39 -0.04 -1.26 -4.77 135.00 125.70 6at1 n PRO 120 Ca -0.09 -0.57 -0.30 0.00 -0.04 0.00 0.00 63.50 62.49 6at1 n PRO 120 Cb 0.60 -1.80 -0.12 0.00 -0.04 0.00 0.00 33.50 32.15 6at1 n PRO 120 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 6at1 s VAL 121 N 2.03 3.02 0.23 0.52 -7.23 -1.26 -5.13 120.40 112.59 6at1 s VAL 121 Ca 0.35 -1.22 -0.15 0.00 -1.81 0.00 0.00 61.98 59.15 6at1 s VAL 121 Cb 0.16 -2.33 -0.08 0.00 0.56 0.00 0.00 36.38 34.69 6at1 s VAL 121 CO -0.00 0.25 0.65 -0.44 -0.31 0.00 0.00 175.10 175.24 6at1 s SER 122 N -1.74 6.83 0.63 4.85 0.01 -1.26 -4.99 113.70 118.02 6at1 s SER 122 Ca 0.17 1.19 -0.13 0.00 1.31 0.00 0.00 55.95 58.49 6at1 s SER 122 Cb -0.11 -2.33 -0.02 0.00 0.21 0.00 0.00 66.02 63.77 6at1 s SER 122 CO 0.08 -0.04 1.05 -0.94 0.41 0.00 0.00 173.24 173.80 6at1 s SER 123 N -1.99 5.74 -0.07 2.44 1.04 -1.26 -4.82 113.70 114.78 6at1 s SER 123 Ca 0.46 1.67 -0.19 0.00 0.48 0.00 0.00 55.95 58.36 6at1 s SER 123 Cb -0.13 -2.51 0.04 0.00 0.10 0.00 0.00 66.02 63.52 6at1 s SER 123 CO 0.19 -1.19 0.45 -0.55 0.98 0.00 0.00 173.24 173.12 6at1 s SER 124 N -3.36 -0.40 -0.04 7.02 0.15 -1.26 -0.53 113.70 115.28 6at1 s SER 124 Ca 0.60 0.49 -0.02 0.00 0.70 0.00 0.00 55.95 57.72 6at1 s SER 124 Cb -0.14 0.56 0.02 0.00 -1.71 0.00 0.00 66.02 64.75 6at1 s SER 124 CO 0.45 -0.41 0.08 -0.36 1.20 0.00 0.00 173.24 174.21 6at1 s PHE 125 N -0.85 -0.08 -0.01 3.44 0.40 -0.72 -2.46 117.98 117.70 6at1 s PHE 125 Ca -0.09 0.27 -0.30 0.00 -0.60 0.00 0.00 56.93 56.20 6at1 s PHE 125 Cb -0.03 -0.07 -0.05 0.00 0.51 0.00 0.00 43.02 43.38 6at1 s PHE 125 CO 0.05 -0.09 1.29 0.00 0.70 0.00 0.00 175.22 177.17 6at1 s ALA 126 N 0.63 3.52 -0.01 5.36 0.00 0.35 -2.52 121.76 129.09 6at1 s ALA 126 Ca -0.05 0.78 -0.19 0.00 0.00 0.00 0.00 51.96 52.50 6at1 s ALA 126 Cb -0.07 -3.54 -0.05 0.00 0.00 0.00 0.00 23.12 19.46 6at1 s ALA 126 CO -0.02 -0.78 0.55 0.08 0.00 0.00 0.00 175.76 175.59 6at1 s VAL 127 N 2.10 4.94 -0.04 0.00 1.01 -0.63 -1.18 120.40 126.60 6at1 s VAL 127 Ca 0.60 1.14 -0.29 0.00 0.00 0.00 0.00 61.98 63.43 6at1 s VAL 127 Cb -0.29 -3.88 0.06 0.00 0.00 0.00 0.00 36.38 32.28 6at1 s VAL 127 CO 0.25 0.45 0.63 0.00 0.00 0.00 0.00 175.10 176.42 6at1 s ARG 128 N -0.33 1.01 0.54 2.72 1.70 -0.46 -4.83 118.95 119.31 6at1 s ARG 128 Ca 0.29 0.18 0.00 0.00 -0.47 0.00 0.00 55.73 55.73 6at1 s ARG 128 Cb -0.18 0.47 0.00 0.00 -0.57 0.00 0.00 34.95 34.68 6at1 s ARG 128 CO 0.16 -0.32 0.00 1.17 -1.08 0.00 0.00 175.30 175.23 6at1 n LYS 129 N 0.92 0.00 -3.71 3.89 4.81 -1.26 -1.60 118.16 121.22 6at1 n LYS 129 Ca -0.19 0.00 -0.12 0.00 -0.87 0.00 0.00 58.31 57.12 6at1 n LYS 129 Cb 0.57 0.00 -0.10 0.00 0.02 0.00 0.00 35.03 35.52 6at1 n LYS 129 CO 0.00 0.00 0.00 0.50 1.17 0.00 0.00 177.40 179.07 6at1 s ARG 130 N 0.00 0.52 0.00 1.64 3.52 -1.25 -4.94 118.95 118.45 6at1 s ARG 130 Ca 0.00 0.70 0.00 0.00 -0.13 0.00 0.00 55.73 56.30 6at1 s ARG 130 Cb 0.00 0.20 0.00 0.00 -1.56 0.00 0.00 34.95 33.59 6at1 s ARG 130 CO 0.00 -0.09 0.00 0.00 -0.81 0.00 0.00 175.30 174.40 6at1 n ALA 131 N 3.18 0.00 0.10 6.12 0.00 -1.26 -4.36 120.51 124.29 6at1 n ALA 131 Ca -0.16 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.16 6at1 n ALA 131 Cb 0.57 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.96 6at1 n ALA 131 CO 0.00 0.00 0.00 -2.95 0.00 0.00 0.00 177.50 174.55 6at1 h ASN 132 N 0.00 -0.54 -3.30 0.00 7.08 -2.01 -3.42 115.58 113.39 6at1 h ASN 132 Ca 0.00 0.07 -0.16 0.00 -3.08 0.00 0.00 56.30 53.12 6at1 h ASN 132 Cb 0.00 0.21 -0.29 0.00 -2.08 0.00 0.00 38.32 36.16 6at1 h ASN 132 CO 0.00 -0.27 -0.41 -0.62 -2.08 0.00 0.00 177.43 174.04 6at1 s ASP 133 N -4.90 -0.36 -0.19 6.14 3.68 -1.26 -5.11 116.67 114.67 6at1 s ASP 133 Ca -0.15 0.67 0.01 0.00 2.13 0.00 0.00 52.55 55.20 6at1 s ASP 133 Cb 0.08 0.55 0.04 0.00 -1.45 0.00 0.00 42.92 42.14 6at1 s ASP 133 CO 0.66 -0.18 -0.09 -0.63 0.13 0.00 0.00 175.17 175.06 6at1 s ILE 134 N 1.32 1.51 -0.13 4.11 1.01 -1.26 -3.79 121.20 123.97 6at1 s ILE 134 Ca -0.09 -0.90 -0.19 0.00 0.00 0.00 0.00 60.65 59.46 6at1 s ILE 134 Cb -0.10 -1.60 -0.04 0.00 0.01 0.00 0.00 42.46 40.73 6at1 s ILE 134 CO -0.10 0.17 0.52 0.00 0.00 0.00 0.00 174.94 175.53 6at1 s ALA 135 N 1.46 3.47 -0.16 9.38 0.00 -0.63 -0.29 121.76 134.99 6at1 s ALA 135 Ca -0.01 -0.19 -0.00 0.00 0.00 0.00 0.00 51.96 51.76 6at1 s ALA 135 Cb -0.16 -2.74 -0.00 0.00 0.00 0.00 0.00 23.12 20.22 6at1 s ALA 135 CO -0.08 -0.13 -0.14 -0.51 0.00 0.00 0.00 175.76 174.90 6at1 s LEU 136 N 0.92 2.55 -0.24 0.00 1.43 0.07 -1.35 118.68 122.06 6at1 s LEU 136 Ca 0.27 -0.45 -0.07 0.00 -1.03 0.00 0.00 54.13 52.85 6at1 s LEU 136 Cb -0.16 -1.59 -0.03 0.00 0.03 0.00 0.00 46.19 44.44 6at1 s LEU 136 CO 0.11 0.08 0.06 -0.75 0.23 0.00 0.00 176.35 176.08 6at1 s LYS 137 N 0.88 3.69 0.20 1.70 2.20 -0.32 -0.60 119.74 127.48 6at1 s LYS 137 Ca -0.04 -0.47 -0.30 0.00 -0.36 0.00 0.00 55.97 54.81 6at1 s LYS 137 Cb -0.15 -3.30 -0.09 0.00 -1.51 0.00 0.00 37.83 32.79 6at1 s LYS 137 CO -0.01 -0.12 1.28 0.00 -0.36 0.00 0.00 175.35 176.14 6at1 h LYS 139 N 5.28 1.22 0.00 0.00 3.64 -1.83 -0.50 116.57 124.37 6at1 h LYS 139 Ca -0.45 -0.07 -0.07 0.00 -1.27 0.00 0.00 60.65 58.79 6at1 h LYS 139 Cb 1.21 -0.27 -0.01 0.00 -0.41 0.00 0.00 32.23 32.75 6at1 h LYS 139 CO 0.76 0.81 -0.71 1.88 -2.27 0.00 0.00 179.45 179.92 6at1 h TYR 140 N 1.25 0.00 -0.00 1.91 0.05 -1.90 -3.39 116.97 114.89 6at1 h TYR 140 Ca 0.41 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.19 6at1 h TYR 140 Cb 0.03 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.77 6at1 h TYR 140 CO -0.00 0.49 -0.24 0.00 -1.05 0.00 0.00 178.16 177.36 6at1 n GLU 142 N -1.19 -1.59 -3.49 0.00 1.02 -0.20 -4.97 120.64 110.23 6at1 n GLU 142 Ca 0.10 0.96 -0.38 0.00 -0.02 0.00 0.00 57.16 57.81 6at1 n GLU 142 Cb 0.32 -5.41 -0.06 0.00 -0.02 0.00 0.00 31.44 26.27 6at1 n GLU 142 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 6at1 s LYS 143 N -4.10 3.94 -0.15 3.49 -0.14 -1.26 -4.74 119.74 116.77 6at1 s LYS 143 Ca 0.00 0.41 -0.07 0.00 -1.36 0.00 0.00 55.97 54.95 6at1 s LYS 143 Cb 0.00 -3.23 -0.04 0.00 -1.68 0.00 0.00 37.83 32.88 6at1 s LYS 143 CO 0.00 0.67 0.10 -2.00 -0.76 0.00 0.00 175.35 173.36 6at1 s GLU 144 N -1.00 3.71 0.20 1.68 2.12 -1.26 -1.62 118.70 122.53 6at1 s GLU 144 Ca 0.24 -0.24 0.06 0.00 0.36 0.00 0.00 54.97 55.39 6at1 s GLU 144 Cb -0.17 -3.21 -0.05 0.00 0.26 0.00 0.00 34.13 30.97 6at1 s GLU 144 CO 0.13 0.52 -0.10 -0.06 -0.54 0.00 0.00 175.26 175.21 6at1 s PHE 145 N -0.31 1.58 0.33 5.30 0.40 0.24 -4.95 117.98 120.56 6at1 s PHE 145 Ca 0.10 -0.69 -0.25 0.00 -0.60 0.00 0.00 56.93 55.49 6at1 s PHE 145 Cb -0.12 -0.80 -0.10 0.00 0.51 0.00 0.00 43.02 42.52 6at1 s PHE 145 CO 0.01 0.22 0.93 0.45 0.70 0.00 0.00 175.22 177.53 6at1 s SER 146 N -3.28 7.28 0.63 1.36 0.15 -1.26 -0.75 113.70 117.82 6at1 s SER 146 Ca 0.22 1.79 0.34 0.00 0.70 0.00 0.00 55.95 59.01 6at1 s SER 146 Cb 0.02 -2.56 1.93 0.00 -1.71 0.00 0.00 66.02 63.69 6at1 s SER 146 CO 0.06 -0.09 2.19 1.12 1.20 0.00 0.00 173.24 177.72 6at1 h HIS 147 N 3.06 0.00 -0.00 3.44 2.07 -1.01 0.62 115.15 123.33 6at1 h HIS 147 Ca -0.47 0.00 -0.11 0.00 -2.85 0.00 0.00 60.37 56.94 6at1 h HIS 147 Cb 1.19 0.00 -0.02 0.00 2.57 0.00 0.00 27.41 31.16 6at1 h HIS 147 CO 0.62 0.00 -0.51 -0.91 -3.07 0.00 0.00 177.93 174.06 6at1 h ASN 148 N 0.00 0.01 0.22 3.10 2.35 -1.91 -1.12 115.58 118.22 6at1 h ASN 148 Ca 0.03 -0.00 -0.33 0.00 -0.55 0.00 0.00 56.30 55.44 6at1 h ASN 148 Cb 0.27 -0.00 0.02 0.00 0.05 0.00 0.00 38.32 38.66 6at1 h ASN 148 CO -0.00 0.51 -1.55 0.58 -1.65 0.00 0.00 177.43 175.32 6at1 h VAL 149 N 0.01 1.14 -0.43 2.81 2.07 -1.30 -3.33 116.25 117.22 6at1 h VAL 149 Ca -0.00 -2.60 -0.11 0.00 0.82 0.00 0.00 66.70 64.81 6at1 h VAL 149 Cb 0.90 2.93 -0.02 0.00 -1.52 0.00 0.00 31.29 33.58 6at1 h VAL 149 CO 0.07 0.82 -0.17 0.58 0.02 0.00 0.00 177.57 178.89 6at1 h VAL 150 N 0.08 1.27 -0.49 2.57 2.07 -1.16 -3.14 116.25 117.45 6at1 h VAL 150 Ca -0.29 -1.27 -0.39 0.00 0.82 0.00 0.00 66.70 65.57 6at1 h VAL 150 Cb 2.09 1.11 -0.10 0.00 -1.52 0.00 0.00 31.29 32.87 6at1 h VAL 150 CO 0.22 0.43 0.50 0.18 0.02 0.00 0.00 177.57 178.92 6at1 n LEU 151 N -4.13 6.23 0.00 2.57 4.77 -0.44 -4.41 117.00 121.59 6at1 n LEU 151 Ca 0.01 -3.75 0.00 0.00 -0.03 0.00 0.00 56.01 52.24 6at1 n LEU 151 Cb 0.41 -1.36 0.00 0.00 -2.33 0.00 0.00 43.42 40.14 6at1 n LEU 151 CO 0.44 1.77 0.00 0.00 -1.33 0.00 0.00 177.39 178.28 6at1 n ALA 152 N 1.93 2.28 -1.15 -1.18 0.00 -1.19 -4.92 120.51 116.29 6at1 n ALA 152 Ca 0.50 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.94 6at1 n ALA 152 Cb 0.67 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.12 6at1 n ALA 152 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79