#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 5at1 n VAL 9 N 0.00 0.00 0.00 1.61 0.31 -1.26 -5.08 118.33 113.91 5at1 n VAL 9 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 5at1 n VAL 9 Cb 0.00 -0.55 0.00 0.00 -0.91 0.00 0.00 33.84 32.38 5at1 n VAL 9 CO 0.00 0.00 0.00 -1.84 -1.32 0.00 0.00 176.83 173.67 5at1 n GLU 10 N -0.95 0.00 -4.02 5.55 0.00 -1.26 -5.19 120.64 114.77 5at1 n GLU 10 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 57.16 57.06 5at1 n GLU 10 Cb 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 31.44 31.33 5at1 n GLU 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 5at1 s ALA 11 N -1.00 0.30 0.18 -1.84 0.00 -1.26 -5.15 121.76 112.98 5at1 s ALA 11 Ca 0.00 -0.71 0.09 0.00 0.00 0.00 0.00 51.96 51.34 5at1 s ALA 11 Cb 0.00 0.13 -0.04 0.00 0.00 0.00 0.00 23.12 23.21 5at1 s ALA 11 CO 0.00 -0.14 -0.14 0.96 0.00 0.00 0.00 175.76 176.44 5at1 s ILE 12 N -1.70 2.95 -0.34 0.00 -4.36 -1.26 -5.07 121.20 111.42 5at1 s ILE 12 Ca -0.12 -1.72 -0.12 0.00 -0.26 0.00 0.00 60.65 58.43 5at1 s ILE 12 Cb -0.08 -2.44 -0.01 0.00 1.25 0.00 0.00 42.46 41.18 5at1 s ILE 12 CO -0.01 -0.09 0.22 -1.59 0.24 0.00 0.00 174.94 173.71 5at1 s LYS 13 N -2.71 3.34 0.18 0.37 -2.85 -1.26 -3.61 119.74 113.20 5at1 s LYS 13 Ca 0.23 -0.74 0.00 0.00 -1.00 0.00 0.00 55.97 54.46 5at1 s LYS 13 Cb -0.09 -3.74 0.00 0.00 -2.06 0.00 0.00 37.83 31.94 5at1 s LYS 13 CO 0.13 -0.49 0.00 -2.13 0.10 0.00 0.00 175.35 172.97 5at1 n ARG 14 N 5.06 -2.82 0.00 1.78 0.63 -1.24 -4.55 116.66 115.52 5at1 n ARG 14 Ca -0.13 2.09 0.00 0.00 -0.92 0.00 0.00 57.85 58.89 5at1 n ARG 14 Cb 0.49 -2.22 0.00 0.00 0.45 0.00 0.00 32.46 31.18 5at1 n ARG 14 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 5at1 n GLY 15 N 0.29 0.90 3.58 5.14 0.00 -0.11 -1.14 105.19 113.85 5at1 n GLY 15 Ca 0.00 -1.96 -0.34 0.00 0.00 0.00 0.00 46.02 43.72 5at1 n GLY 15 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 5at1 s THR 16 N -1.89 3.71 -0.19 2.61 2.01 0.30 -0.64 115.64 121.55 5at1 s THR 16 Ca 0.00 -0.48 0.01 0.00 0.31 0.00 0.00 61.69 61.53 5at1 s THR 16 Cb 0.00 -2.52 0.04 0.00 0.01 0.00 0.00 72.50 70.03 5at1 s THR 16 CO 0.00 0.60 -0.13 -0.69 -0.69 0.00 0.00 174.62 173.71 5at1 s VAL 17 N -0.81 1.77 -0.21 3.82 1.01 -0.28 -0.97 120.40 124.73 5at1 s VAL 17 Ca 0.12 -1.00 -0.13 0.00 0.00 0.00 0.00 61.98 60.97 5at1 s VAL 17 Cb -0.11 -1.77 -0.05 0.00 0.00 0.00 0.00 36.38 34.46 5at1 s VAL 17 CO 0.01 0.27 0.27 -0.63 0.00 0.00 0.00 175.10 175.03 5at1 s ILE 18 N 1.36 5.29 0.08 2.22 1.01 -0.23 -0.74 121.20 130.19 5at1 s ILE 18 Ca 0.00 0.45 0.04 0.00 0.00 0.00 0.00 60.65 61.15 5at1 s ILE 18 Cb -0.15 -3.61 -0.03 0.00 0.01 0.00 0.00 42.46 38.67 5at1 s ILE 18 CO -0.09 0.32 -0.11 -0.62 0.00 0.00 0.00 174.94 174.44 5at1 s ASP 19 N 0.89 1.50 -0.81 3.58 2.15 -0.22 -1.42 116.67 122.34 5at1 s ASP 19 Ca 0.14 -0.72 -0.01 0.00 0.43 0.00 0.00 52.55 52.39 5at1 s ASP 19 Cb -0.14 -0.01 -0.01 0.00 -0.30 0.00 0.00 42.92 42.46 5at1 s ASP 19 CO 0.05 -0.19 0.69 1.57 -0.17 0.00 0.00 175.17 177.12 5at1 n HIS 20 N 0.89 -1.58 -3.02 -5.34 -0.00 -0.97 -0.75 115.22 104.45 5at1 n HIS 20 Ca -0.18 0.64 -0.39 0.00 0.46 0.00 0.00 57.72 58.25 5at1 n HIS 20 Cb 0.56 -4.03 -0.06 0.00 -0.12 0.00 0.00 29.99 26.34 5at1 n HIS 20 CO 0.00 0.00 0.00 0.42 0.46 0.00 0.00 176.34 177.22 5at1 s ILE 21 N -3.26 4.42 0.00 3.57 1.01 -1.11 -3.15 121.20 122.69 5at1 s ILE 21 Ca 0.08 1.63 0.00 0.00 0.00 0.00 0.00 60.65 62.36 5at1 s ILE 21 Cb -0.01 -4.10 0.00 0.00 0.01 0.00 0.00 42.46 38.36 5at1 s ILE 21 CO 0.51 0.51 0.21 -2.65 0.00 0.00 0.00 174.94 173.52 5at1 n PRO 22 N 1.57 0.00 0.00 2.79 -0.02 -1.26 -1.10 135.00 136.98 5at1 n PRO 22 Ca -0.06 0.14 0.00 0.00 -2.02 0.00 0.00 63.50 61.56 5at1 n PRO 22 Cb 0.49 -0.71 0.00 0.00 -0.02 0.00 0.00 33.50 33.26 5at1 n PRO 22 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 5at1 n ALA 23 N -2.11 0.00 -0.09 3.55 0.00 -1.26 -3.61 120.51 116.99 5at1 n ALA 23 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 5at1 n ALA 23 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 5at1 n ALA 23 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 5at1 n GLN 24 N -0.32 0.00 0.12 0.00 1.13 -1.26 -4.73 117.38 112.32 5at1 n GLN 24 Ca 0.00 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.06 5at1 n GLN 24 Cb 0.00 -3.62 -0.01 0.00 0.11 0.00 0.00 30.24 26.72 5at1 n GLN 24 CO 0.00 0.00 0.00 0.82 -1.44 0.00 0.00 177.06 176.44 5at1 h ILE 25 N 0.00 1.00 -0.39 5.09 1.08 -1.93 -3.38 117.51 118.98 5at1 h ILE 25 Ca 0.00 -2.44 0.07 0.00 -0.39 0.00 0.00 64.86 62.10 5at1 h ILE 25 Cb 0.00 2.48 -0.06 0.00 -3.07 0.00 0.00 36.82 36.17 5at1 h ILE 25 CO 0.00 0.57 -0.00 1.23 -0.69 0.00 0.00 178.15 179.26 5at1 h GLY 26 N 3.42 0.38 0.97 5.37 0.00 -1.90 -0.05 103.07 111.25 5at1 h GLY 26 Ca -0.02 0.05 -0.06 0.00 0.00 0.00 0.00 47.33 47.31 5at1 h GLY 26 CO 0.08 -0.10 0.07 -2.75 0.00 0.00 0.00 176.54 173.85 5at1 h PHE 27 N 0.10 0.83 -0.14 5.60 3.57 -1.99 -2.03 116.94 122.87 5at1 h PHE 27 Ca 0.19 -0.12 0.05 0.00 3.53 0.00 0.00 57.97 61.62 5at1 h PHE 27 Cb 0.27 -0.23 -0.07 0.00 2.79 0.00 0.00 35.95 38.71 5at1 h PHE 27 CO -0.26 0.77 -0.37 -0.22 -2.23 0.00 0.00 178.31 175.99 5at1 h LYS 28 N 0.65 -0.43 -0.30 1.11 3.64 -1.66 0.60 116.57 120.18 5at1 h LYS 28 Ca 0.14 0.03 0.05 0.00 -1.27 0.00 0.00 60.65 59.60 5at1 h LYS 28 Cb 0.39 0.10 -0.04 0.00 -0.41 0.00 0.00 32.23 32.26 5at1 h LYS 28 CO 0.01 -0.28 0.04 -0.07 -2.27 0.00 0.00 179.45 176.87 5at1 h LEU 29 N -0.44 -0.04 -1.04 5.20 3.38 -0.86 0.13 115.31 121.65 5at1 h LEU 29 Ca 0.09 0.06 0.11 0.00 0.09 0.00 0.00 57.88 58.22 5at1 h LEU 29 Cb 0.59 0.09 -0.08 0.00 0.09 0.00 0.00 40.66 41.35 5at1 h LEU 29 CO -0.38 0.02 0.63 -0.07 0.09 0.00 0.00 178.44 178.72 5at1 h LEU 30 N 0.14 0.93 0.00 1.67 -0.00 -0.61 -2.70 115.31 114.73 5at1 h LEU 30 Ca 0.14 0.04 0.00 0.00 -0.00 0.00 0.00 57.88 58.06 5at1 h LEU 30 Cb 0.17 -0.15 0.00 0.00 -0.00 0.00 0.00 40.66 40.67 5at1 h LEU 30 CO -0.21 0.52 -0.08 0.77 -0.00 0.00 0.00 178.44 179.45 5at1 h SER 31 N 1.02 0.00 -0.77 -0.43 4.64 -0.12 -2.62 113.55 115.26 5at1 h SER 31 Ca 0.47 0.00 0.14 0.00 -0.47 0.00 0.00 61.79 61.93 5at1 h SER 31 Cb 0.42 0.00 -0.14 0.00 -0.31 0.00 0.00 62.40 62.37 5at1 h SER 31 CO -0.23 0.50 -0.30 -0.07 -0.87 0.00 0.00 176.83 175.86 5at1 h LEU 32 N -0.93 -1.07 -3.46 5.97 4.07 -0.82 -0.57 115.31 118.49 5at1 h LEU 32 Ca 0.00 0.25 -0.09 0.00 0.08 0.00 0.00 57.88 58.12 5at1 h LEU 32 Cb 0.08 0.59 -0.05 0.00 1.08 0.00 0.00 40.66 42.36 5at1 h LEU 32 CO 0.00 -0.29 0.11 0.49 -1.08 0.00 0.00 178.44 177.68 5at1 n PHE 33 N -5.48 2.11 -2.70 1.13 0.99 -1.02 -4.96 117.46 107.53 5at1 n PHE 33 Ca 0.08 -0.87 -0.10 0.00 -0.00 0.00 0.00 57.45 56.56 5at1 n PHE 33 Cb 0.39 -0.56 -0.01 0.00 -1.00 0.00 0.00 39.48 38.30 5at1 n PHE 33 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 176.76 178.39 5at1 n LYS 34 N 0.28 -2.65 0.30 -1.08 5.02 -0.22 -4.81 118.16 115.00 5at1 n LYS 34 Ca 0.31 0.29 0.17 0.00 -2.02 0.00 0.00 58.31 57.06 5at1 n LYS 34 Cb 1.22 -4.85 0.98 0.00 -0.02 0.00 0.00 35.03 32.36 5at1 n LYS 34 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 5at1 h LEU 35 N -0.17 0.00 0.00 -0.35 3.38 -1.69 -1.72 115.31 114.76 5at1 h LEU 35 Ca -0.19 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.78 5at1 h LEU 35 Cb 1.14 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.89 5at1 h LEU 35 CO 0.24 0.00 0.00 0.35 0.09 0.00 0.00 178.44 179.12 5at1 n THR 36 N -3.61 0.14 -1.30 0.22 -2.24 -1.26 -3.99 114.28 102.25 5at1 n THR 36 Ca -0.02 0.04 -0.34 0.00 -2.27 0.00 0.00 64.05 61.46 5at1 n THR 36 Cb 0.13 -0.61 0.08 0.00 -2.10 0.00 0.00 70.33 67.82 5at1 n THR 36 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 5at1 n GLU 37 N -1.25 2.63 -3.46 -0.78 1.02 -0.65 -4.94 120.64 113.21 5at1 n GLU 37 Ca 0.13 -3.17 -0.19 0.00 -0.02 0.00 0.00 57.16 53.91 5at1 n GLU 37 Cb 0.19 -2.24 -0.02 0.00 -0.02 0.00 0.00 31.44 29.35 5at1 n GLU 37 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 5at1 s THR 38 N -4.65 3.28 -1.81 2.62 2.01 -1.26 -5.04 115.64 110.80 5at1 s THR 38 Ca 0.63 -1.18 0.22 0.00 0.31 0.00 0.00 61.69 61.67 5at1 s THR 38 Cb 0.49 -3.14 -0.05 0.00 0.01 0.00 0.00 72.50 69.81 5at1 s THR 38 CO -0.01 -0.08 1.06 0.47 -0.69 0.00 0.00 174.62 175.37 5at1 n ASP 39 N -1.61 1.79 -4.82 3.53 10.43 -1.26 -5.00 116.55 119.62 5at1 n ASP 39 Ca 0.03 -1.39 -0.33 0.00 2.57 0.00 0.00 54.79 55.66 5at1 n ASP 39 Cb 0.60 0.59 -0.04 0.00 1.84 0.00 0.00 41.12 44.10 5at1 n ASP 39 CO 0.00 0.00 0.00 -1.10 -1.07 0.00 0.00 177.20 175.03 5at1 s GLN 40 N -2.60 3.89 -0.29 -1.24 -1.52 -1.26 -4.97 119.66 111.68 5at1 s GLN 40 Ca 0.16 1.16 -0.29 0.00 -1.95 0.00 0.00 55.36 54.44 5at1 s GLN 40 Cb 0.18 -2.12 -0.01 0.00 -0.22 0.00 0.00 33.01 30.83 5at1 s GLN 40 CO 0.64 -0.33 1.57 0.50 -0.25 0.00 0.00 175.29 177.42 5at1 s ARG 41 N -3.57 3.68 -0.19 2.91 3.52 -1.26 -4.83 118.95 119.22 5at1 s ARG 41 Ca 0.63 1.42 -0.09 0.00 -0.13 0.00 0.00 55.73 57.56 5at1 s ARG 41 Cb -0.12 -4.05 -0.05 0.00 -1.56 0.00 0.00 34.95 29.17 5at1 s ARG 41 CO 0.23 -1.44 0.12 0.42 -0.81 0.00 0.00 175.30 173.83 5at1 s ILE 42 N 5.48 5.31 0.14 4.11 1.01 -1.26 -3.07 121.20 132.92 5at1 s ILE 42 Ca 0.69 0.15 0.10 0.00 0.00 0.00 0.00 60.65 61.60 5at1 s ILE 42 Cb -0.21 -3.41 -0.04 0.00 0.01 0.00 0.00 42.46 38.81 5at1 s ILE 42 CO 0.30 0.47 -0.25 0.42 0.00 0.00 0.00 174.94 175.88 5at1 s THR 43 N 0.18 2.16 0.01 2.92 -4.23 -0.39 -5.00 115.64 111.29 5at1 s THR 43 Ca 0.08 -1.78 -0.00 0.00 -1.18 0.00 0.00 61.69 58.81 5at1 s THR 43 Cb -0.11 -1.94 -0.01 0.00 1.34 0.00 0.00 72.50 71.78 5at1 s THR 43 CO -0.01 0.01 -0.01 -0.63 -0.54 0.00 0.00 174.62 173.44 5at1 s ILE 44 N -1.24 0.05 -0.11 2.99 1.01 -1.26 -1.52 121.20 121.12 5at1 s ILE 44 Ca 0.14 -0.44 0.02 0.00 0.00 0.00 0.00 60.65 60.37 5at1 s ILE 44 Cb -0.09 -0.14 0.01 0.00 0.01 0.00 0.00 42.46 42.25 5at1 s ILE 44 CO 0.06 -0.24 -0.16 -0.83 0.00 0.00 0.00 174.94 173.78 5at1 s GLY 45 N -0.71 1.06 -0.17 6.18 0.00 -0.83 -5.02 107.32 107.83 5at1 s GLY 45 Ca -0.08 -0.75 0.01 0.00 0.00 0.00 0.00 44.72 43.90 5at1 s GLY 45 CO -0.00 0.20 -0.20 1.08 0.00 0.00 0.00 173.10 174.18 5at1 s LEU 46 N 0.96 2.07 -0.42 0.66 1.43 -1.26 -1.20 118.68 120.91 5at1 s LEU 46 Ca -0.07 -0.62 -0.06 0.00 -1.03 0.00 0.00 54.13 52.35 5at1 s LEU 46 Cb -0.15 -1.43 0.01 0.00 0.03 0.00 0.00 46.19 44.64 5at1 s LEU 46 CO -0.01 0.01 0.47 0.59 0.23 0.00 0.00 176.35 177.64 5at1 n ASN 47 N 4.51 -6.28 -4.96 2.29 3.02 -0.61 -5.01 115.26 108.22 5at1 n ASN 47 Ca -0.20 0.17 -0.22 0.00 -0.03 0.00 0.00 54.58 54.30 5at1 n ASN 47 Cb 0.50 -4.17 0.05 0.00 -0.61 0.00 0.00 39.78 35.55 5at1 n ASN 47 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 5at1 n LEU 48 N -0.95 0.00 -4.70 3.41 4.77 0.31 -4.84 117.00 115.01 5at1 n LEU 48 Ca 0.04 -2.66 -0.24 0.00 -0.03 0.00 0.00 56.01 53.12 5at1 n LEU 48 Cb 0.42 -0.31 -0.07 0.00 -2.33 0.00 0.00 43.42 41.13 5at1 n LEU 48 CO 0.37 -0.68 -0.29 -2.84 -1.33 0.00 0.00 177.39 172.62 5at1 s PRO 49 N -4.56 2.49 0.00 3.23 0.02 -1.25 -2.43 135.00 132.51 5at1 s PRO 49 Ca 0.53 -1.21 0.00 0.00 0.02 0.00 0.00 61.00 60.34 5at1 s PRO 49 Cb -0.04 -2.34 0.00 0.00 0.02 0.00 0.00 34.50 32.14 5at1 s PRO 49 CO 0.33 0.41 0.00 -1.13 -0.33 0.00 0.00 177.00 176.28 5at1 n SER 50 N -0.66 0.00 0.00 2.53 3.41 -1.26 -3.20 113.62 114.44 5at1 n SER 50 Ca -0.08 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.53 5at1 n SER 50 Cb 0.57 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.52 5at1 n SER 50 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 5at1 n GLY 51 N 0.00 -0.37 3.60 5.00 0.00 -1.26 -4.80 105.19 107.36 5at1 n GLY 51 Ca 0.00 0.77 -0.55 0.00 0.00 0.00 0.00 46.02 46.25 5at1 n GLY 51 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 5at1 n GLU 52 N 0.00 0.91 0.00 1.61 -0.58 -1.26 -4.48 120.64 116.84 5at1 n GLU 52 Ca 0.00 0.33 0.00 0.00 -0.42 0.00 0.00 57.16 57.07 5at1 n GLU 52 Cb 0.00 -1.95 0.00 0.00 -0.57 0.00 0.00 31.44 28.92 5at1 n GLU 52 CO 0.00 0.00 0.00 -0.12 -0.48 0.00 0.00 177.13 176.53 5at1 n MET 53 N 2.85 0.00 0.00 3.49 1.56 -1.26 -5.08 117.12 118.68 5at1 n MET 53 Ca 0.20 0.00 0.00 0.00 -0.27 0.00 0.00 57.70 57.63 5at1 n MET 53 Cb 0.15 0.00 0.00 0.00 2.15 0.00 0.00 33.22 35.52 5at1 n MET 53 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65 5at1 n GLY 54 N 0.00 -0.48 3.85 -5.12 0.00 -1.26 -5.11 105.19 97.07 5at1 n GLY 54 Ca 0.00 0.13 -0.35 0.00 0.00 0.00 0.00 46.02 45.80 5at1 n GLY 54 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 5at1 s ARG 55 N 0.00 3.92 0.34 1.61 1.04 -1.24 -3.85 118.95 120.76 5at1 s ARG 55 Ca 0.00 0.40 -0.06 0.00 -1.04 0.00 0.00 55.73 55.03 5at1 s ARG 55 Cb 0.00 -2.96 0.03 0.00 -2.04 0.00 0.00 34.95 29.98 5at1 s ARG 55 CO 0.00 0.51 0.56 0.36 -0.04 0.00 0.00 175.30 176.68 5at1 n LYS 56 N 0.85 0.80 -4.47 3.89 -0.00 -1.02 -4.72 118.16 113.49 5at1 n LYS 56 Ca -0.06 -2.39 -0.24 0.00 -0.00 0.00 0.00 58.31 55.63 5at1 n LYS 56 Cb 0.52 2.52 -0.10 0.00 -0.00 0.00 0.00 35.03 37.97 5at1 n LYS 56 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.40 176.89 5at1 s ASP 57 N -2.97 3.41 -0.11 -5.58 -0.00 -0.26 -0.53 116.67 110.64 5at1 s ASP 57 Ca 0.22 -1.09 -0.07 0.00 -0.00 0.00 0.00 52.55 51.61 5at1 s ASP 57 Cb -0.02 -0.28 0.04 0.00 -0.00 0.00 0.00 42.92 42.66 5at1 s ASP 57 CO 0.16 -0.09 0.26 -0.22 -0.00 0.00 0.00 175.17 175.28 5at1 s LEU 58 N -3.50 0.68 -0.13 1.23 0.20 -0.34 -2.28 118.68 114.54 5at1 s LEU 58 Ca 0.30 0.55 -0.00 0.00 0.69 0.00 0.00 54.13 55.66 5at1 s LEU 58 Cb -0.02 0.85 0.02 0.00 -0.43 0.00 0.00 46.19 46.62 5at1 s LEU 58 CO 0.14 -0.13 -0.10 -0.63 -0.29 0.00 0.00 176.35 175.34 5at1 s ILE 59 N 0.70 1.24 -0.26 6.68 1.01 -0.51 -1.97 121.20 128.09 5at1 s ILE 59 Ca -0.05 -0.42 -0.04 0.00 0.00 0.00 0.00 60.65 60.14 5at1 s ILE 59 Cb -0.06 -1.21 0.02 0.00 0.01 0.00 0.00 42.46 41.21 5at1 s ILE 59 CO -0.04 0.40 -0.02 -0.54 0.00 0.00 0.00 174.94 174.75 5at1 s LYS 60 N 1.61 3.00 -0.19 2.79 1.02 -0.58 -1.07 119.74 126.32 5at1 s LYS 60 Ca 0.05 -0.88 -0.00 0.00 0.02 0.00 0.00 55.97 55.15 5at1 s LYS 60 Cb -0.13 -3.11 0.01 0.00 -0.52 0.00 0.00 37.83 34.09 5at1 s LYS 60 CO -0.09 -0.38 -0.15 0.42 -0.92 0.00 0.00 175.35 174.23 5at1 s ILE 61 N 1.40 2.50 0.15 2.17 1.01 -0.14 -1.26 121.20 127.03 5at1 s ILE 61 Ca 0.02 -0.79 0.03 0.00 0.00 0.00 0.00 60.65 59.90 5at1 s ILE 61 Cb -0.16 -2.08 -0.04 0.00 0.01 0.00 0.00 42.46 40.19 5at1 s ILE 61 CO -0.02 0.50 0.25 -1.83 0.00 0.00 0.00 174.94 173.84 5at1 s GLU 62 N 1.29 3.30 -1.82 2.79 -1.05 -1.17 -0.54 118.70 121.50 5at1 s GLU 62 Ca 0.04 -0.66 0.00 0.00 -0.15 0.00 0.00 54.97 54.20 5at1 s GLU 62 Cb -0.14 -2.89 0.00 0.00 -0.44 0.00 0.00 34.13 30.67 5at1 s GLU 62 CO -0.09 0.51 0.00 0.09 0.95 0.00 0.00 175.26 176.73 5at1 n ASN 63 N -0.48 -5.13 -3.99 0.83 3.02 -0.29 -4.64 115.26 104.57 5at1 n ASN 63 Ca -0.07 0.38 -0.17 0.00 -0.03 0.00 0.00 54.58 54.68 5at1 n ASN 63 Cb 0.54 -4.19 -0.15 0.00 -0.61 0.00 0.00 39.78 35.38 5at1 n ASN 63 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 5at1 s THR 64 N -2.69 0.58 0.04 3.41 2.01 -1.26 -4.94 115.64 112.80 5at1 s THR 64 Ca 0.00 -0.31 0.04 0.00 0.31 0.00 0.00 61.69 61.73 5at1 s THR 64 Cb 0.00 -0.49 -0.02 0.00 0.01 0.00 0.00 72.50 72.00 5at1 s THR 64 CO 0.00 0.17 -0.12 -0.36 -0.69 0.00 0.00 174.62 173.61 5at1 s PHE 65 N -0.15 1.07 -0.09 4.92 0.40 -1.26 -1.74 117.98 121.12 5at1 s PHE 65 Ca 0.03 -0.38 -0.11 0.00 -0.60 0.00 0.00 56.93 55.86 5at1 s PHE 65 Cb -0.03 -0.63 -0.05 0.00 0.51 0.00 0.00 43.02 42.82 5at1 s PHE 65 CO -0.00 0.02 0.27 -0.51 0.70 0.00 0.00 175.22 175.69 5at1 s LEU 66 N -1.27 4.38 0.54 -0.37 1.43 -1.26 -5.04 118.68 117.09 5at1 s LEU 66 Ca -0.01 0.64 -0.20 0.00 -1.03 0.00 0.00 54.13 53.53 5at1 s LEU 66 Cb -0.08 -2.32 -0.05 0.00 0.03 0.00 0.00 46.19 43.77 5at1 s LEU 66 CO 0.01 0.30 1.18 -0.44 0.23 0.00 0.00 176.35 177.63 5at1 s SER 67 N -0.67 5.62 0.10 2.29 0.01 -1.26 -4.76 113.70 115.04 5at1 s SER 67 Ca 0.18 2.31 -0.06 0.00 1.31 0.00 0.00 55.95 59.70 5at1 s SER 67 Cb -0.14 -2.60 0.14 0.00 0.21 0.00 0.00 66.02 63.64 5at1 s SER 67 CO 0.07 -1.30 0.64 -0.62 0.41 0.00 0.00 173.24 172.45 5at1 n GLU 68 N -1.20 -0.07 0.06 12.44 4.71 -1.26 0.24 120.64 135.56 5at1 n GLU 68 Ca 0.11 0.64 -0.10 0.00 -0.01 0.00 0.00 57.16 57.80 5at1 n GLU 68 Cb 0.49 -0.96 0.01 0.00 -1.01 0.00 0.00 31.44 29.98 5at1 n GLU 68 CO 0.00 0.00 0.00 0.38 0.09 0.00 0.00 177.13 177.60 5at1 h ASP 69 N 0.00 0.47 -0.56 1.62 2.03 -1.99 -2.48 116.42 115.51 5at1 h ASP 69 Ca 0.17 -0.32 -0.06 0.00 -0.73 0.00 0.00 57.03 56.09 5at1 h ASP 69 Cb 0.27 -0.14 -0.03 0.00 -0.83 0.00 0.00 39.33 38.61 5at1 h ASP 69 CO -0.42 1.07 0.13 1.56 -1.03 0.00 0.00 179.24 180.55 5at1 h GLN 70 N 0.25 0.94 0.14 4.15 4.20 -0.56 0.11 115.11 124.34 5at1 h GLN 70 Ca -0.04 -0.21 0.00 0.00 0.06 0.00 0.00 58.65 58.46 5at1 h GLN 70 Cb 1.36 -0.13 -0.01 0.00 0.30 0.00 0.00 27.48 29.00 5at1 h GLN 70 CO 0.13 0.85 -0.13 0.28 -0.67 0.00 0.00 178.83 179.29 5at1 h VAL 71 N 0.90 0.70 0.00 -0.54 2.07 -1.17 -2.87 116.25 115.33 5at1 h VAL 71 Ca 0.19 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.68 5at1 h VAL 71 Cb 0.35 0.70 -0.00 0.00 -1.52 0.00 0.00 31.29 30.81 5at1 h VAL 71 CO 0.00 0.00 -0.14 0.44 0.02 0.00 0.00 177.57 177.90 5at1 h ASP 72 N -0.30 0.00 -0.88 0.57 5.19 -0.79 -1.57 116.42 118.65 5at1 h ASP 72 Ca 0.00 0.00 0.10 0.00 -0.62 0.00 0.00 57.03 56.51 5at1 h ASP 72 Cb 0.28 0.00 -0.06 0.00 0.18 0.00 0.00 39.33 39.73 5at1 h ASP 72 CO -0.03 0.14 0.57 1.56 -3.12 0.00 0.00 179.24 178.35 5at1 h GLN 73 N 0.00 0.84 0.00 3.56 1.08 -0.59 -1.14 115.11 118.86 5at1 h GLN 73 Ca -0.00 -0.05 -0.00 0.00 -1.45 0.00 0.00 58.65 57.15 5at1 h GLN 73 Cb 0.32 -0.19 -0.00 0.00 -0.05 0.00 0.00 27.48 27.56 5at1 h GLN 73 CO 0.02 0.56 -0.00 -0.07 -0.95 0.00 0.00 178.83 178.38 5at1 h LEU 74 N 0.87 0.00 -2.06 1.46 3.38 -1.30 -3.29 115.31 114.36 5at1 h LEU 74 Ca 0.40 0.00 0.11 0.00 0.09 0.00 0.00 57.88 58.48 5at1 h LEU 74 Cb 0.40 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.14 5at1 h LEU 74 CO -0.17 0.00 0.30 0.00 0.09 0.00 0.00 178.44 178.67 5at1 h ALA 75 N 2.00 2.22 0.00 1.53 0.00 -1.32 0.27 119.26 123.96 5at1 h ALA 75 Ca -0.00 -0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.78 5at1 h ALA 75 Cb 0.26 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 5at1 h ALA 75 CO 0.00 -0.49 -0.53 -0.07 0.00 0.00 0.00 179.25 178.15 5at1 h LEU 76 N 0.00 0.00 0.00 0.00 3.38 -1.79 -3.19 115.31 113.71 5at1 h LEU 76 Ca 0.18 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 58.05 5at1 h LEU 76 Cb 0.78 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.52 5at1 h LEU 76 CO -0.00 0.53 -1.19 -1.22 0.09 0.00 0.00 178.44 176.65 5at1 n TYR 77 N -3.56 0.23 -0.45 1.13 4.01 -0.39 -4.78 117.16 113.34 5at1 n TYR 77 Ca -0.00 0.10 0.09 0.00 -0.16 0.00 0.00 57.90 57.92 5at1 n TYR 77 Cb 0.62 -0.67 0.34 0.00 -0.31 0.00 0.00 39.34 39.31 5at1 n TYR 77 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 5at1 n ALA 78 N -4.21 3.08 0.19 -0.72 0.00 0.80 -4.85 120.51 114.80 5at1 n ALA 78 Ca -0.21 -1.47 0.02 0.00 0.00 0.00 0.00 53.44 51.78 5at1 n ALA 78 Cb 0.54 -1.03 0.13 0.00 0.00 0.00 0.00 19.45 19.09 5at1 n ALA 78 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 5at1 h PRO 79 N 3.83 0.00 0.00 0.00 0.13 -1.69 0.13 132.00 134.39 5at1 h PRO 79 Ca 0.00 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.11 5at1 h PRO 79 Cb 1.38 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.51 5at1 h PRO 79 CO 0.23 0.00 -0.57 0.37 -0.23 0.00 0.00 178.00 177.79 5at1 h GLN 80 N 0.00 0.00 -6.61 0.86 4.15 -1.90 -3.41 115.11 108.20 5at1 h GLN 80 Ca 0.00 0.00 -0.58 0.00 0.77 0.00 0.00 58.65 58.84 5at1 h GLN 80 Cb 1.30 0.00 0.09 0.00 0.21 0.00 0.00 27.48 29.08 5at1 h GLN 80 CO 0.00 0.06 0.50 0.00 -1.93 0.00 0.00 178.83 177.46 5at1 n ALA 81 N -2.16 0.90 -2.78 3.38 0.00 0.44 -4.93 120.51 115.35 5at1 n ALA 81 Ca 0.01 0.40 -0.33 0.00 0.00 0.00 0.00 53.44 53.52 5at1 n ALA 81 Cb 0.57 -2.22 -0.13 0.00 0.00 0.00 0.00 19.45 17.67 5at1 n ALA 81 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 5at1 s THR 82 N -0.50 3.46 -0.62 0.00 2.01 0.07 -4.01 115.64 116.05 5at1 s THR 82 Ca 0.63 -0.54 -0.07 0.00 0.31 0.00 0.00 61.69 62.02 5at1 s THR 82 Cb -0.64 -2.44 0.16 0.00 0.01 0.00 0.00 72.50 69.59 5at1 s THR 82 CO 0.55 0.55 0.48 -0.69 -0.69 0.00 0.00 174.62 174.82 5at1 s VAL 83 N -0.21 4.23 -0.18 3.82 1.01 0.25 -1.05 120.40 128.27 5at1 s VAL 83 Ca 0.02 -2.54 -0.26 0.00 0.00 0.00 0.00 61.98 59.20 5at1 s VAL 83 Cb -0.13 -3.73 -0.01 0.00 0.00 0.00 0.00 36.38 32.51 5at1 s VAL 83 CO 0.03 -0.88 0.87 0.20 0.00 0.00 0.00 175.10 175.32 5at1 s ASN 84 N 1.53 6.98 -0.35 3.32 0.01 0.08 -1.40 114.94 125.11 5at1 s ASN 84 Ca 0.14 1.21 -0.18 0.00 -0.71 0.00 0.00 52.86 53.32 5at1 s ASN 84 Cb -0.19 -2.47 -0.00 0.00 0.41 0.00 0.00 41.25 38.99 5at1 s ASN 84 CO -0.04 -0.45 0.50 -0.60 -1.51 0.00 0.00 177.10 175.00 5at1 s ARG 85 N 2.37 3.60 -0.17 -0.60 3.52 0.36 -1.13 118.95 126.89 5at1 s ARG 85 Ca 0.39 -0.20 -0.02 0.00 -0.13 0.00 0.00 55.73 55.77 5at1 s ARG 85 Cb -0.16 -3.82 -0.01 0.00 -1.56 0.00 0.00 34.95 29.40 5at1 s ARG 85 CO 0.11 -0.65 -0.08 0.42 -0.81 0.00 0.00 175.30 174.30 5at1 s ILE 86 N 2.36 3.32 -0.03 4.11 1.01 0.19 -1.59 121.20 130.57 5at1 s ILE 86 Ca 0.18 -0.54 0.03 0.00 0.00 0.00 0.00 60.65 60.32 5at1 s ILE 86 Cb -0.16 -2.45 0.00 0.00 0.01 0.00 0.00 42.46 39.87 5at1 s ILE 86 CO 0.13 0.48 -0.11 -0.62 0.00 0.00 0.00 174.94 174.82 5at1 s ASP 87 N 0.78 1.48 -1.31 3.58 -1.08 -0.55 -0.93 116.67 118.65 5at1 s ASP 87 Ca -0.03 -0.24 -0.18 0.00 -0.52 0.00 0.00 52.55 51.59 5at1 s ASP 87 Cb -0.15 -0.43 0.02 0.00 -1.46 0.00 0.00 42.92 40.91 5at1 s ASP 87 CO 0.01 0.08 0.33 -3.20 0.52 0.00 0.00 175.17 172.92 5at1 n ASN 88 N 3.30 -1.57 0.00 -0.34 5.15 -1.26 -1.39 115.26 119.16 5at1 n ASN 88 Ca -0.19 -1.24 0.00 0.00 -0.60 0.00 0.00 54.58 52.56 5at1 n ASN 88 Cb 0.54 -1.51 0.00 0.00 -0.53 0.00 0.00 39.78 38.28 5at1 n ASN 88 CO 0.00 0.00 0.00 -1.22 1.40 0.00 0.00 177.26 177.44 5at1 n TYR 89 N -4.67 0.00 -4.53 1.20 4.01 -1.24 -4.99 117.16 106.94 5at1 n TYR 89 Ca -0.21 0.00 -0.28 0.00 -0.16 0.00 0.00 57.90 57.26 5at1 n TYR 89 Cb 0.60 -0.67 -0.13 0.00 -0.31 0.00 0.00 39.34 38.82 5at1 n TYR 89 CO 0.00 0.00 0.00 -1.21 -0.46 0.00 0.00 176.86 175.19 5at1 s GLU 90 N -0.24 1.43 -0.78 -0.72 0.41 -0.49 -4.94 118.70 113.38 5at1 s GLU 90 Ca 0.00 -1.19 -0.25 0.00 -0.41 0.00 0.00 54.97 53.12 5at1 s GLU 90 Cb 0.00 -1.74 -0.02 0.00 -1.78 0.00 0.00 34.13 30.59 5at1 s GLU 90 CO 0.00 0.43 1.82 0.08 -0.49 0.00 0.00 175.26 177.09 5at1 s VAL 91 N -0.98 3.47 -2.05 2.63 1.01 -1.26 -1.48 120.40 121.74 5at1 s VAL 91 Ca 0.11 -0.10 0.13 0.00 0.00 0.00 0.00 61.98 62.11 5at1 s VAL 91 Cb -0.10 -4.14 0.35 0.00 0.00 0.00 0.00 36.38 32.50 5at1 s VAL 91 CO 0.04 -1.08 1.45 0.55 0.00 0.00 0.00 175.10 176.05 5at1 n VAL 92 N 7.40 0.09 -3.63 2.92 3.14 -0.62 -4.91 118.33 122.72 5at1 n VAL 92 Ca 0.28 -0.11 -0.04 0.00 -2.96 0.00 0.00 64.34 61.51 5at1 n VAL 92 Cb 0.50 -0.04 -0.05 0.00 -1.06 0.00 0.00 33.84 33.18 5at1 n VAL 92 CO 0.00 0.00 0.00 -0.83 -6.46 0.00 0.00 176.83 169.54 5at1 s GLY 93 N -1.36 0.06 -0.15 7.55 0.00 -1.02 -4.95 107.32 107.45 5at1 s GLY 93 Ca 0.21 2.83 -0.02 0.00 0.00 0.00 0.00 44.72 47.74 5at1 s GLY 93 CO 0.16 1.35 0.02 0.54 0.00 0.00 0.00 173.10 175.17 5at1 s LYS 94 N -0.68 0.68 0.30 2.90 1.02 -1.26 -0.49 119.74 122.21 5at1 s LYS 94 Ca 0.06 -0.23 0.08 0.00 0.02 0.00 0.00 55.97 55.90 5at1 s LYS 94 Cb -0.02 -1.70 -0.04 0.00 -0.52 0.00 0.00 37.83 35.56 5at1 s LYS 94 CO -0.08 -0.51 0.17 -1.12 -0.92 0.00 0.00 175.35 172.89 5at1 s SER 95 N 1.89 5.04 -0.07 2.83 0.01 -0.49 -4.90 113.70 118.02 5at1 s SER 95 Ca 0.01 -0.53 0.03 0.00 1.31 0.00 0.00 55.95 56.77 5at1 s SER 95 Cb -0.15 -1.00 0.01 0.00 0.21 0.00 0.00 66.02 65.08 5at1 s SER 95 CO -0.07 -0.18 -0.16 -0.13 0.41 0.00 0.00 173.24 173.11 5at1 s ARG 96 N -3.85 2.00 0.11 12.44 1.81 -1.26 -0.58 118.95 129.62 5at1 s ARG 96 Ca 0.36 -0.56 -0.35 0.00 -1.72 0.00 0.00 55.73 53.46 5at1 s ARG 96 Cb -0.06 -1.63 -0.17 0.00 -0.45 0.00 0.00 34.95 32.65 5at1 s ARG 96 CO 0.24 0.11 1.20 -0.35 -0.68 0.00 0.00 175.30 175.82 5at1 n PRO 97 N 3.58 0.91 -4.32 3.54 -0.04 -1.26 -4.86 135.00 132.55 5at1 n PRO 97 Ca -0.21 0.33 -0.17 0.00 -0.04 0.00 0.00 63.50 63.41 5at1 n PRO 97 Cb 0.52 -1.86 -0.10 0.00 -0.04 0.00 0.00 33.50 32.02 5at1 n PRO 97 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 5at1 s SER 98 N 0.16 1.98 -0.02 3.54 1.04 -1.26 -4.85 113.70 114.29 5at1 s SER 98 Ca 0.81 -1.15 -0.30 0.00 0.48 0.00 0.00 55.95 55.79 5at1 s SER 98 Cb -0.97 -0.03 -0.05 0.00 0.10 0.00 0.00 66.02 65.07 5at1 s SER 98 CO 0.51 -0.42 1.46 -0.22 0.98 0.00 0.00 173.24 175.55 5at1 s LEU 99 N -3.29 4.31 0.91 2.42 2.96 -1.26 -4.60 118.68 120.13 5at1 s LEU 99 Ca 0.25 2.13 -0.14 0.00 -0.22 0.00 0.00 54.13 56.15 5at1 s LEU 99 Cb 0.04 -3.55 0.15 0.00 0.50 0.00 0.00 46.19 43.33 5at1 s LEU 99 CO 0.07 -0.78 1.23 -2.16 -1.32 0.00 0.00 176.35 173.39 5at1 s PRO 100 N 2.84 1.08 0.00 0.98 0.04 -1.26 -5.00 135.00 133.68 5at1 s PRO 100 Ca 0.66 -0.11 0.25 0.00 0.04 0.00 0.00 61.00 61.83 5at1 s PRO 100 Cb -0.32 -1.87 0.39 0.00 0.04 0.00 0.00 34.50 32.75 5at1 s PRO 100 CO 0.26 -2.16 1.37 -0.85 0.04 0.00 0.00 177.00 175.66 5at1 n GLU 101 N -3.66 2.21 -3.74 4.56 0.00 -1.26 -4.66 120.64 114.09 5at1 n GLU 101 Ca 0.11 -1.77 -0.12 0.00 0.00 0.00 0.00 57.16 55.38 5at1 n GLU 101 Cb 0.60 -1.47 -0.11 0.00 0.00 0.00 0.00 31.44 30.46 5at1 n GLU 101 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.13 177.63 5at1 s ARG 102 N -1.93 0.36 -0.49 3.44 3.52 -1.26 -1.44 118.95 121.16 5at1 s ARG 102 Ca 0.31 0.54 0.03 0.00 -0.13 0.00 0.00 55.73 56.49 5at1 s ARG 102 Cb 0.20 0.10 0.13 0.00 -1.56 0.00 0.00 34.95 33.82 5at1 s ARG 102 CO 0.31 -0.09 0.24 0.42 -0.81 0.00 0.00 175.30 175.37 5at1 s ILE 103 N 0.59 2.28 0.46 4.11 1.01 -0.80 -4.95 121.20 123.91 5at1 s ILE 103 Ca -0.03 -3.05 -0.22 0.00 0.00 0.00 0.00 60.65 57.34 5at1 s ILE 103 Cb -0.05 -2.60 -0.08 0.00 0.01 0.00 0.00 42.46 39.75 5at1 s ILE 103 CO -0.04 -0.80 1.10 -1.81 0.00 0.00 0.00 174.94 173.39 5at1 s ASP 104 N -0.03 6.31 0.00 3.58 1.11 -1.26 -3.64 116.67 122.74 5at1 s ASP 104 Ca 0.17 2.12 0.00 0.00 0.18 0.00 0.00 52.55 55.01 5at1 s ASP 104 Cb -0.25 -2.58 0.00 0.00 1.07 0.00 0.00 42.92 41.16 5at1 s ASP 104 CO -0.01 -0.81 0.00 0.59 1.18 0.00 0.00 175.17 176.12 5at1 n ASN 105 N -0.61 0.00 -0.01 0.27 3.02 -0.05 -4.68 115.26 113.20 5at1 n ASN 105 Ca 0.08 0.00 0.10 0.00 -0.03 0.00 0.00 54.58 54.73 5at1 n ASN 105 Cb 0.50 -0.62 -0.15 0.00 -0.61 0.00 0.00 39.78 38.90 5at1 n ASN 105 CO 0.00 0.00 0.00 0.55 -2.62 0.00 0.00 177.26 175.19 5at1 n VAL 106 N -1.55 0.00 -4.22 2.41 3.14 -1.26 -4.70 118.33 112.14 5at1 n VAL 106 Ca 0.00 -0.32 -0.24 0.00 -2.96 0.00 0.00 64.34 60.82 5at1 n VAL 106 Cb 0.00 0.36 -0.06 0.00 -1.06 0.00 0.00 33.84 33.07 5at1 n VAL 106 CO 0.00 0.00 0.00 -0.76 -6.46 0.00 0.00 176.83 169.61 5at1 s LEU 107 N -3.94 3.41 -0.20 6.55 1.43 -1.26 -5.10 118.68 119.56 5at1 s LEU 107 Ca -0.02 -0.47 0.00 0.00 -1.03 0.00 0.00 54.13 52.61 5at1 s LEU 107 Cb 0.14 -1.96 0.02 0.00 0.03 0.00 0.00 46.19 44.42 5at1 s LEU 107 CO 0.85 0.01 -0.15 -0.69 0.23 0.00 0.00 176.35 176.60 5at1 s VAL 108 N -2.12 2.35 -0.03 -1.59 1.01 -1.26 -4.72 120.40 114.05 5at1 s VAL 108 Ca 0.31 -0.98 -0.37 0.00 0.00 0.00 0.00 61.98 60.94 5at1 s VAL 108 Cb -0.08 -2.08 -0.15 0.00 0.00 0.00 0.00 36.38 34.07 5at1 s VAL 108 CO 0.21 0.41 1.58 0.00 0.00 0.00 0.00 175.10 177.30 5at1 h PRO 110 N 6.28 0.00 -6.46 0.00 0.11 -1.89 -3.42 132.00 126.61 5at1 h PRO 110 Ca -0.47 0.00 -0.57 0.00 0.11 0.00 0.00 66.00 65.07 5at1 h PRO 110 Cb 1.30 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 32.37 5at1 h PRO 110 CO 0.88 0.00 1.08 1.21 -0.21 0.00 0.00 178.00 180.95 5at1 s ASN 111 N -6.69 6.35 0.58 -2.05 3.84 -1.26 -4.89 114.94 110.83 5at1 s ASN 111 Ca -0.05 0.98 0.33 0.00 0.21 0.00 0.00 52.86 54.33 5at1 s ASN 111 Cb 0.17 -2.54 1.80 0.00 -0.55 0.00 0.00 41.25 40.13 5at1 s ASN 111 CO 0.65 -1.39 2.20 0.77 -2.79 0.00 0.00 177.10 176.54 5at1 h SER 112 N 10.66 0.00 -0.63 -4.21 4.64 -2.02 -2.23 113.55 119.76 5at1 h SER 112 Ca -0.28 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.04 5at1 h SER 112 Cb 1.11 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.20 5at1 h SER 112 CO 1.07 0.04 0.00 -3.20 -0.87 0.00 0.00 176.83 173.87 5at1 n ASN 113 N -3.54 3.72 -4.77 4.97 5.15 -1.26 -4.92 115.26 114.62 5at1 n ASN 113 Ca -0.02 -2.00 -0.39 0.00 -0.60 0.00 0.00 54.58 51.58 5at1 n ASN 113 Cb 0.15 -0.42 -0.04 0.00 -0.53 0.00 0.00 39.78 38.95 5at1 n ASN 113 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 5at1 h ILE 115 N 2.67 0.00 -0.43 0.00 6.09 -1.91 -3.25 117.51 120.68 5at1 h ILE 115 Ca -0.48 -0.41 0.13 0.00 -1.37 0.00 0.00 64.86 62.73 5at1 h ILE 115 Cb 1.22 1.31 -0.02 0.00 0.47 0.00 0.00 36.82 39.80 5at1 h ILE 115 CO 0.65 0.00 0.44 0.77 -3.07 0.00 0.00 178.15 176.94 5at1 h SER 116 N 0.00 0.00 0.60 2.19 4.64 -1.93 -2.50 113.55 116.56 5at1 h SER 116 Ca 0.00 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.29 5at1 h SER 116 Cb 0.47 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.56 5at1 h SER 116 CO 0.00 0.00 -0.29 0.45 -0.87 0.00 0.00 176.83 176.12 5at1 h HIS 117 N 0.00 -0.75 0.00 4.77 3.86 -1.93 -3.29 115.15 117.81 5at1 h HIS 117 Ca 0.21 -0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.40 5at1 h HIS 117 Cb 1.09 0.25 0.00 0.00 1.06 0.00 0.00 27.41 29.81 5at1 h HIS 117 CO 0.00 -0.46 0.00 0.00 0.86 0.00 0.00 177.93 178.33 5at1 n ALA 118 N -2.71 1.45 -2.45 2.45 0.00 -0.94 -4.88 120.51 113.42 5at1 n ALA 118 Ca -0.10 0.12 -0.25 0.00 0.00 0.00 0.00 53.44 53.21 5at1 n ALA 118 Cb 0.32 -1.36 -0.11 0.00 0.00 0.00 0.00 19.45 18.31 5at1 n ALA 118 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 5at1 s GLU 119 N -3.39 1.61 0.00 0.00 0.41 -1.22 -5.02 118.70 111.10 5at1 s GLU 119 Ca 0.02 -1.67 -0.01 0.00 -0.41 0.00 0.00 54.97 52.90 5at1 s GLU 119 Cb 0.08 -1.79 -0.04 0.00 -1.78 0.00 0.00 34.13 30.60 5at1 s GLU 119 CO 0.32 0.36 0.93 -0.35 -0.49 0.00 0.00 175.26 176.03 5at1 n PRO 120 N -0.26 0.35 -4.66 0.39 -0.04 -1.26 -4.80 135.00 124.71 5at1 n PRO 120 Ca -0.08 -0.15 -0.28 0.00 -0.04 0.00 0.00 63.50 62.96 5at1 n PRO 120 Cb 0.58 -1.54 -0.14 0.00 -0.04 0.00 0.00 33.50 32.36 5at1 n PRO 120 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 5at1 s VAL 121 N 2.32 1.96 0.24 0.52 -7.23 -1.26 -5.12 120.40 111.83 5at1 s VAL 121 Ca 0.10 -1.41 -0.28 0.00 -1.81 0.00 0.00 61.98 58.58 5at1 s VAL 121 Cb 0.05 -1.70 -0.09 0.00 0.56 0.00 0.00 36.38 35.19 5at1 s VAL 121 CO 0.00 0.22 0.91 -0.44 -0.31 0.00 0.00 175.10 175.48 5at1 s SER 122 N -1.43 7.53 0.74 4.85 0.01 -1.26 -4.97 113.70 119.17 5at1 s SER 122 Ca 0.10 1.86 -0.12 0.00 1.31 0.00 0.00 55.95 59.10 5at1 s SER 122 Cb -0.10 -2.58 0.04 0.00 0.21 0.00 0.00 66.02 63.60 5at1 s SER 122 CO 0.03 0.12 1.10 -0.94 0.41 0.00 0.00 173.24 173.96 5at1 s SER 123 N -1.28 4.62 -0.26 2.44 1.04 -1.26 -4.81 113.70 114.19 5at1 s SER 123 Ca 0.42 1.91 -0.21 0.00 0.48 0.00 0.00 55.95 58.55 5at1 s SER 123 Cb -0.24 -2.54 0.07 0.00 0.10 0.00 0.00 66.02 63.42 5at1 s SER 123 CO 0.29 -1.96 0.67 -0.55 0.98 0.00 0.00 173.24 172.67 5at1 s SER 124 N -3.05 -0.75 0.05 7.02 0.15 -1.26 -0.87 113.70 114.98 5at1 s SER 124 Ca 0.64 1.38 0.04 0.00 0.70 0.00 0.00 55.95 58.71 5at1 s SER 124 Cb -0.19 1.36 -0.02 0.00 -1.71 0.00 0.00 66.02 65.46 5at1 s SER 124 CO 0.51 -0.23 -0.13 -0.36 1.20 0.00 0.00 173.24 174.23 5at1 s PHE 125 N 0.69 1.10 -0.24 3.44 0.40 -1.24 -1.93 117.98 120.21 5at1 s PHE 125 Ca -0.03 -0.39 -0.14 0.00 -0.60 0.00 0.00 56.93 55.77 5at1 s PHE 125 Cb -0.05 -0.64 -0.04 0.00 0.51 0.00 0.00 43.02 42.80 5at1 s PHE 125 CO -0.04 0.02 0.34 0.00 0.70 0.00 0.00 175.22 176.24 5at1 s ALA 126 N -1.02 3.57 0.08 5.36 0.00 0.89 -1.90 121.76 128.74 5at1 s ALA 126 Ca -0.01 -0.71 -0.18 0.00 0.00 0.00 0.00 51.96 51.06 5at1 s ALA 126 Cb -0.08 -2.60 -0.07 0.00 0.00 0.00 0.00 23.12 20.37 5at1 s ALA 126 CO 0.01 -0.42 0.54 0.08 0.00 0.00 0.00 175.76 175.97 5at1 s VAL 127 N 1.56 4.81 0.22 0.00 1.01 -0.52 -1.02 120.40 126.45 5at1 s VAL 127 Ca 0.15 1.07 -0.15 0.00 0.00 0.00 0.00 61.98 63.06 5at1 s VAL 127 Cb -0.15 -3.83 0.01 0.00 0.00 0.00 0.00 36.38 32.41 5at1 s VAL 127 CO 0.08 0.49 0.49 0.00 0.00 0.00 0.00 175.10 176.16 5at1 s ARG 128 N -1.30 1.45 1.63 2.72 1.70 -0.50 -4.80 118.95 119.85 5at1 s ARG 128 Ca 0.30 -1.06 0.00 0.00 -0.47 0.00 0.00 55.73 54.50 5at1 s ARG 128 Cb -0.18 0.49 0.00 0.00 -0.57 0.00 0.00 34.95 34.69 5at1 s ARG 128 CO 0.18 -0.61 0.00 1.17 -1.08 0.00 0.00 175.30 174.97 5at1 n LYS 129 N -0.35 0.00 -3.56 3.89 3.00 -1.26 -1.96 118.16 117.92 5at1 n LYS 129 Ca -0.06 0.00 -0.08 0.00 -0.00 0.00 0.00 58.31 58.18 5at1 n LYS 129 Cb 0.62 0.00 -0.03 0.00 0.00 0.00 0.00 35.03 35.62 5at1 n LYS 129 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.40 177.90 5at1 s ARG 130 N 0.00 0.57 0.00 1.64 3.52 -1.26 -4.98 118.95 118.44 5at1 s ARG 130 Ca 0.00 -0.11 0.00 0.00 -0.13 0.00 0.00 55.73 55.49 5at1 s ARG 130 Cb 0.00 0.27 0.00 0.00 -1.56 0.00 0.00 34.95 33.66 5at1 s ARG 130 CO 0.00 -0.23 0.00 0.00 -0.81 0.00 0.00 175.30 174.26 5at1 n ALA 131 N 0.11 0.00 0.15 6.12 0.00 -1.26 -4.37 120.51 121.26 5at1 n ALA 131 Ca -0.06 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.32 5at1 n ALA 131 Cb 0.60 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 20.02 5at1 n ALA 131 CO 0.00 0.00 0.00 -2.95 0.00 0.00 0.00 177.50 174.55 5at1 h ASN 132 N 0.00 -0.33 -3.66 0.00 7.08 -2.01 -3.46 115.58 113.20 5at1 h ASN 132 Ca 0.00 0.01 -0.25 0.00 -3.08 0.00 0.00 56.30 52.98 5at1 h ASN 132 Cb 0.00 0.09 -0.30 0.00 -2.08 0.00 0.00 38.32 36.03 5at1 h ASN 132 CO 0.00 -0.15 -0.72 -0.62 -2.08 0.00 0.00 177.43 173.86 5at1 s ASP 133 N -3.44 0.02 -0.20 6.14 3.68 -1.26 -5.11 116.67 116.49 5at1 s ASP 133 Ca -0.06 0.02 -0.03 0.00 2.13 0.00 0.00 52.55 54.61 5at1 s ASP 133 Cb 0.01 -0.02 -0.01 0.00 -1.45 0.00 0.00 42.92 41.45 5at1 s ASP 133 CO 0.17 -0.04 -0.06 -0.63 0.13 0.00 0.00 175.17 174.74 5at1 s ILE 134 N 0.36 3.35 -0.25 4.11 1.01 -1.26 -4.00 121.20 124.52 5at1 s ILE 134 Ca -0.03 -0.52 -0.11 0.00 0.00 0.00 0.00 60.65 60.00 5at1 s ILE 134 Cb -0.04 -2.50 -0.05 0.00 0.01 0.00 0.00 42.46 39.88 5at1 s ILE 134 CO -0.01 0.45 0.18 0.00 0.00 0.00 0.00 174.94 175.56 5at1 s ALA 135 N 1.15 3.59 -0.25 9.38 0.00 -0.83 -0.43 121.76 134.37 5at1 s ALA 135 Ca 0.02 -0.93 -0.02 0.00 0.00 0.00 0.00 51.96 51.02 5at1 s ALA 135 Cb -0.14 -2.38 0.02 0.00 0.00 0.00 0.00 23.12 20.62 5at1 s ALA 135 CO -0.01 -0.30 -0.05 -0.51 0.00 0.00 0.00 175.76 174.89 5at1 s LEU 136 N 1.27 3.27 -0.20 0.00 1.43 0.31 -1.40 118.68 123.35 5at1 s LEU 136 Ca 0.08 -0.86 -0.09 0.00 -1.03 0.00 0.00 54.13 52.23 5at1 s LEU 136 Cb -0.14 -1.69 -0.04 0.00 0.03 0.00 0.00 46.19 44.35 5at1 s LEU 136 CO 0.06 -0.14 0.10 -0.75 0.23 0.00 0.00 176.35 175.86 5at1 s LYS 137 N 1.34 4.05 0.26 1.70 2.20 -0.19 -0.95 119.74 128.16 5at1 s LYS 137 Ca 0.00 -0.30 -0.29 0.00 -0.36 0.00 0.00 55.97 55.02 5at1 s LYS 137 Cb -0.17 -3.33 -0.10 0.00 -1.51 0.00 0.00 37.83 32.73 5at1 s LYS 137 CO -0.04 0.24 1.29 0.00 -0.36 0.00 0.00 175.35 176.49 5at1 h LYS 139 N 4.40 0.77 0.00 0.00 3.64 -1.74 -1.82 116.57 121.83 5at1 h LYS 139 Ca -0.47 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 58.87 5at1 h LYS 139 Cb 1.22 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 32.86 5at1 h LYS 139 CO 0.72 0.51 -0.34 0.66 -2.27 0.00 0.00 179.45 178.72 5at1 n TYR 140 N -4.71 0.37 0.83 1.91 4.01 -1.26 -4.37 117.16 113.93 5at1 n TYR 140 Ca 0.09 0.16 0.10 0.00 -0.16 0.00 0.00 57.90 58.09 5at1 n TYR 140 Cb 0.15 -0.46 0.48 0.00 -0.31 0.00 0.00 39.34 39.20 5at1 n TYR 140 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 5at1 n GLU 142 N -1.42 -1.49 -3.09 0.00 1.02 -0.68 -4.97 120.64 110.01 5at1 n GLU 142 Ca 0.07 0.77 -0.34 0.00 -0.02 0.00 0.00 57.16 57.64 5at1 n GLU 142 Cb 0.22 -4.98 -0.06 0.00 -0.02 0.00 0.00 31.44 26.60 5at1 n GLU 142 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 5at1 s LYS 143 N -2.85 4.14 -0.06 3.49 -0.14 -1.26 -4.67 119.74 118.39 5at1 s LYS 143 Ca 0.00 0.81 0.00 0.00 -1.36 0.00 0.00 55.97 55.42 5at1 s LYS 143 Cb 0.00 -2.61 -0.03 0.00 -1.68 0.00 0.00 37.83 33.51 5at1 s LYS 143 CO 0.00 0.25 -0.03 -2.00 -0.76 0.00 0.00 175.35 172.80 5at1 s GLU 144 N -2.55 2.82 0.05 1.68 2.12 -1.26 -1.09 118.70 120.47 5at1 s GLU 144 Ca 0.50 -0.52 0.01 0.00 0.36 0.00 0.00 54.97 55.32 5at1 s GLU 144 Cb -0.13 -2.66 -0.03 0.00 0.26 0.00 0.00 34.13 31.56 5at1 s GLU 144 CO 0.19 0.67 -0.06 -0.06 -0.54 0.00 0.00 175.26 175.46 5at1 s PHE 145 N -0.89 0.61 0.27 5.30 0.40 -0.12 -4.96 117.98 118.58 5at1 s PHE 145 Ca 0.14 -0.72 -0.29 0.00 -0.60 0.00 0.00 56.93 55.46 5at1 s PHE 145 Cb -0.11 -0.38 -0.09 0.00 0.51 0.00 0.00 43.02 42.94 5at1 s PHE 145 CO 0.03 -0.18 1.17 0.45 0.70 0.00 0.00 175.22 177.39 5at1 s SER 146 N -2.18 7.11 0.62 1.36 0.15 -1.26 -0.53 113.70 118.97 5at1 s SER 146 Ca -0.03 2.36 0.29 0.00 0.70 0.00 0.00 55.95 59.28 5at1 s SER 146 Cb -0.03 -2.63 1.52 0.00 -1.71 0.00 0.00 66.02 63.17 5at1 s SER 146 CO -0.03 -0.28 1.90 1.12 1.20 0.00 0.00 173.24 177.15 5at1 h HIS 147 N 3.99 0.00 0.29 3.44 2.07 -1.10 -0.59 115.15 123.25 5at1 h HIS 147 Ca -0.47 0.00 -0.01 0.00 -2.85 0.00 0.00 60.37 57.04 5at1 h HIS 147 Cb 1.22 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 31.19 5at1 h HIS 147 CO 0.59 0.00 -0.17 -0.91 -3.07 0.00 0.00 177.93 174.36 5at1 h ASN 148 N 0.00 -0.43 0.08 3.10 2.35 -1.90 -2.00 115.58 116.78 5at1 h ASN 148 Ca 0.12 0.03 -0.11 0.00 -0.55 0.00 0.00 56.30 55.79 5at1 h ASN 148 Cb 0.95 0.13 -0.01 0.00 0.05 0.00 0.00 38.32 39.44 5at1 h ASN 148 CO -0.00 -0.28 -0.36 0.58 -1.65 0.00 0.00 177.43 175.72 5at1 h VAL 149 N -0.44 1.29 -0.42 2.81 2.07 -1.51 -2.75 116.25 117.30 5at1 h VAL 149 Ca -0.03 -1.44 -0.09 0.00 0.82 0.00 0.00 66.70 65.96 5at1 h VAL 149 Cb 0.37 1.55 -0.01 0.00 -1.52 0.00 0.00 31.29 31.67 5at1 h VAL 149 CO 0.03 0.44 -0.10 0.58 0.02 0.00 0.00 177.57 178.55 5at1 h VAL 150 N 0.32 1.27 -0.55 2.57 2.07 -1.27 -3.28 116.25 117.39 5at1 h VAL 150 Ca 0.04 -1.19 -0.72 0.00 0.82 0.00 0.00 66.70 65.64 5at1 h VAL 150 Cb 0.78 1.18 -0.08 0.00 -1.52 0.00 0.00 31.29 31.65 5at1 h VAL 150 CO 0.06 0.40 2.68 0.18 0.02 0.00 0.00 177.57 180.92 5at1 n LEU 151 N -4.31 6.65 0.01 2.57 4.77 -0.76 -4.37 117.00 121.56 5at1 n LEU 151 Ca -0.01 -4.30 0.00 0.00 -0.03 0.00 0.00 56.01 51.67 5at1 n LEU 151 Cb 0.37 -1.60 0.00 0.00 -2.33 0.00 0.00 43.42 39.85 5at1 n LEU 151 CO 0.43 1.14 0.00 0.00 -1.33 0.00 0.00 177.39 177.63 5at1 n ALA 152 N 5.49 3.00 -1.62 -1.18 0.00 -1.24 -4.88 120.51 120.08 5at1 n ALA 152 Ca 0.47 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.91 5at1 n ALA 152 Cb 0.39 0.01 0.00 0.00 0.00 0.00 0.00 19.45 19.84 5at1 n ALA 152 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79