#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 7at1 n VAL 9 N 0.00 0.00 -3.67 1.61 0.31 -1.26 -4.85 118.33 110.46 7at1 n VAL 9 Ca 0.00 0.00 -0.12 0.00 -0.01 0.00 0.00 64.34 64.21 7at1 n VAL 9 Cb 0.00 0.00 -0.06 0.00 -0.91 0.00 0.00 33.84 32.87 7at1 n VAL 9 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 7at1 s GLU 10 N 0.00 0.95 -0.17 5.55 0.41 -1.26 -5.15 118.70 119.03 7at1 s GLU 10 Ca 0.00 -0.52 -0.20 0.00 -0.41 0.00 0.00 54.97 53.84 7at1 s GLU 10 Cb 0.00 0.42 -0.03 0.00 -1.78 0.00 0.00 34.13 32.74 7at1 s GLU 10 CO 0.00 -0.34 0.58 0.00 -0.49 0.00 0.00 175.26 175.01 7at1 s ALA 11 N -2.98 3.51 0.17 5.21 0.00 -1.26 -5.06 121.76 121.35 7at1 s ALA 11 Ca -0.02 -0.26 0.10 0.00 0.00 0.00 0.00 51.96 51.78 7at1 s ALA 11 Cb 0.00 -2.88 -0.04 0.00 0.00 0.00 0.00 23.12 20.21 7at1 s ALA 11 CO -0.06 -0.40 -0.18 0.96 0.00 0.00 0.00 175.76 176.08 7at1 s ILE 12 N 1.53 2.73 0.00 0.00 -4.36 -1.26 -5.07 121.20 114.77 7at1 s ILE 12 Ca 0.28 -1.77 0.00 0.00 -0.26 0.00 0.00 60.65 58.90 7at1 s ILE 12 Cb -0.16 -2.30 0.00 0.00 1.25 0.00 0.00 42.46 41.25 7at1 s ILE 12 CO 0.11 -0.05 0.50 1.17 0.24 0.00 0.00 174.94 176.92 7at1 n LYS 13 N 0.37 0.00 -3.84 0.37 3.00 -1.26 -4.14 118.16 112.66 7at1 n LYS 13 Ca -0.13 0.23 -0.12 0.00 -0.00 0.00 0.00 58.31 58.29 7at1 n LYS 13 Cb 0.55 -1.08 -0.12 0.00 0.00 0.00 0.00 35.03 34.38 7at1 n LYS 13 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.40 177.90 7at1 s ARG 14 N -1.47 0.23 0.00 1.64 3.52 -1.26 -0.09 118.95 121.51 7at1 s ARG 14 Ca 0.00 0.04 0.00 0.00 -0.13 0.00 0.00 55.73 55.64 7at1 s ARG 14 Cb 0.00 0.10 0.00 0.00 -1.56 0.00 0.00 34.95 33.49 7at1 s ARG 14 CO 0.00 -0.04 0.00 0.41 -0.81 0.00 0.00 175.30 174.86 7at1 n GLY 15 N 2.64 -0.25 3.04 8.12 0.00 -0.13 0.87 105.19 119.49 7at1 n GLY 15 Ca -0.15 -0.86 -0.27 0.00 0.00 0.00 0.00 46.02 44.74 7at1 n GLY 15 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 7at1 s THR 16 N -4.00 1.31 -0.27 2.61 2.01 -0.68 -0.88 115.64 115.75 7at1 s THR 16 Ca 0.00 -0.56 -0.01 0.00 0.31 0.00 0.00 61.69 61.43 7at1 s THR 16 Cb 0.00 -1.20 0.04 0.00 0.01 0.00 0.00 72.50 71.35 7at1 s THR 16 CO 0.00 0.40 -0.06 -0.69 -0.69 0.00 0.00 174.62 173.58 7at1 s VAL 17 N 0.79 2.75 -0.37 3.82 1.01 -0.52 -0.89 120.40 127.00 7at1 s VAL 17 Ca -0.11 -1.26 -0.21 0.00 0.00 0.00 0.00 61.98 60.40 7at1 s VAL 17 Cb -0.16 -2.49 0.01 0.00 0.00 0.00 0.00 36.38 33.74 7at1 s VAL 17 CO 0.02 0.07 0.68 -0.63 0.00 0.00 0.00 175.10 175.23 7at1 s ILE 18 N 1.26 4.84 0.31 2.22 1.09 0.21 -0.59 121.20 130.54 7at1 s ILE 18 Ca -0.03 0.59 0.08 0.00 -1.10 0.00 0.00 60.65 60.19 7at1 s ILE 18 Cb -0.18 -4.13 -0.04 0.00 -1.06 0.00 0.00 42.46 37.05 7at1 s ILE 18 CO -0.04 -0.39 0.12 -0.62 -0.10 0.00 0.00 174.94 173.91 7at1 s ASP 19 N 1.84 4.77 -1.11 3.58 2.15 -0.22 -0.92 116.67 126.77 7at1 s ASP 19 Ca 0.26 -0.68 -0.04 0.00 0.43 0.00 0.00 52.55 52.52 7at1 s ASP 19 Cb -0.14 -0.83 0.00 0.00 -0.30 0.00 0.00 42.92 41.65 7at1 s ASP 19 CO 0.16 -0.21 0.95 1.41 -0.17 0.00 0.00 175.17 177.31 7at1 n HIS 20 N -1.11 -2.22 -3.02 -5.34 8.25 -1.25 -0.14 115.22 110.38 7at1 n HIS 20 Ca -0.04 0.85 -0.40 0.00 -0.26 0.00 0.00 57.72 57.86 7at1 n HIS 20 Cb 0.60 -4.56 -0.05 0.00 1.12 0.00 0.00 29.99 27.11 7at1 n HIS 20 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 7at1 s ILE 21 N -3.29 5.01 0.08 1.59 1.09 -0.71 -4.10 121.20 120.87 7at1 s ILE 21 Ca 0.28 1.44 -0.37 0.00 -1.10 0.00 0.00 60.65 60.90 7at1 s ILE 21 Cb -0.12 -4.04 -0.17 0.00 -1.06 0.00 0.00 42.46 37.06 7at1 s ILE 21 CO 0.63 0.18 1.30 -2.65 -0.10 0.00 0.00 174.94 174.29 7at1 n PRO 22 N 4.32 1.03 -1.67 2.79 -0.02 -1.26 0.57 135.00 140.76 7at1 n PRO 22 Ca -0.00 0.37 -0.44 0.00 -2.02 0.00 0.00 63.50 61.42 7at1 n PRO 22 Cb 0.50 -1.99 -0.01 0.00 -0.02 0.00 0.00 33.50 31.98 7at1 n PRO 22 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 7at1 n ALA 23 N 2.34 0.99 0.00 3.55 0.00 -1.25 -1.59 120.51 124.55 7at1 n ALA 23 Ca 0.18 0.38 0.00 0.00 0.00 0.00 0.00 53.44 54.01 7at1 n ALA 23 Cb 0.18 -2.22 0.00 0.00 0.00 0.00 0.00 19.45 17.41 7at1 n ALA 23 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 7at1 n GLN 24 N 1.07 0.00 0.29 0.00 3.00 -1.26 -4.85 117.38 115.62 7at1 n GLN 24 Ca 0.08 0.00 0.16 0.00 -0.01 0.00 0.00 57.00 57.23 7at1 n GLN 24 Cb 0.34 0.00 0.93 0.00 0.00 0.00 0.00 30.24 31.51 7at1 n GLN 24 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.06 177.88 7at1 h ILE 25 N 0.00 0.46 -0.90 5.09 2.04 -1.65 -2.81 117.51 119.75 7at1 h ILE 25 Ca 0.00 0.00 0.19 0.00 1.00 0.00 0.00 64.86 66.05 7at1 h ILE 25 Cb 0.00 0.97 -0.11 0.00 -0.74 0.00 0.00 36.82 36.94 7at1 h ILE 25 CO 0.00 0.00 0.45 1.23 0.00 0.00 0.00 178.15 179.83 7at1 h GLY 26 N 0.00 1.54 1.41 5.37 0.00 -1.88 -0.65 103.07 108.86 7at1 h GLY 26 Ca 0.01 -0.23 -0.22 0.00 0.00 0.00 0.00 47.33 46.89 7at1 h GLY 26 CO -0.00 -0.16 -0.87 -2.75 0.00 0.00 0.00 176.54 172.76 7at1 h PHE 27 N 0.54 0.78 -0.99 5.60 3.04 -1.87 -3.09 116.94 120.95 7at1 h PHE 27 Ca 0.53 -0.39 0.01 0.00 3.98 0.00 0.00 57.97 62.11 7at1 h PHE 27 Cb 0.91 -0.10 -0.05 0.00 2.56 0.00 0.00 35.95 39.26 7at1 h PHE 27 CO -0.09 1.20 0.65 0.87 -2.02 0.00 0.00 178.31 178.91 7at1 h LYS 28 N 0.34 1.30 -0.07 1.11 1.57 -1.39 -2.12 116.57 117.31 7at1 h LYS 28 Ca -0.07 -0.08 -0.00 0.00 -1.87 0.00 0.00 60.65 58.62 7at1 h LYS 28 Cb 1.49 -0.29 -0.00 0.00 0.08 0.00 0.00 32.23 33.51 7at1 h LYS 28 CO 0.16 0.87 0.03 -0.07 -0.57 0.00 0.00 179.45 179.86 7at1 h LEU 29 N 1.34 0.10 -2.66 2.94 3.38 -1.23 -0.30 115.31 118.89 7at1 h LEU 29 Ca 0.36 -0.17 0.00 0.00 0.09 0.00 0.00 57.88 58.16 7at1 h LEU 29 Cb -0.15 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 40.57 7at1 h LEU 29 CO -0.08 0.24 0.00 -0.07 0.09 0.00 0.00 178.44 178.62 7at1 h LEU 30 N -0.05 0.00 0.04 1.67 4.07 -1.35 -0.20 115.31 119.50 7at1 h LEU 30 Ca 0.02 0.00 -0.33 0.00 0.08 0.00 0.00 57.88 57.66 7at1 h LEU 30 Cb 0.17 0.00 -0.04 0.00 1.08 0.00 0.00 40.66 41.87 7at1 h LEU 30 CO -0.00 0.00 -1.82 -1.54 -1.08 0.00 0.00 178.44 174.00 7at1 n SER 31 N -3.58 1.98 0.06 -0.43 3.41 -0.84 -3.51 113.62 110.70 7at1 n SER 31 Ca -0.03 0.28 -0.13 0.00 -0.26 0.00 0.00 58.87 58.74 7at1 n SER 31 Cb 0.08 -0.86 -0.08 0.00 -0.26 0.00 0.00 64.21 63.09 7at1 n SER 31 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 7at1 h LEU 32 N -0.54 -0.08 -9.54 1.04 6.46 -0.79 -3.39 115.31 108.46 7at1 h LEU 32 Ca -0.45 -0.14 -0.64 0.00 -0.12 0.00 0.00 57.88 56.52 7at1 h LEU 32 Cb 1.66 0.02 -0.08 0.00 -0.73 0.00 0.00 40.66 41.52 7at1 h LEU 32 CO -0.13 0.10 -0.45 -0.36 -0.62 0.00 0.00 178.44 176.98 7at1 s PHE 33 N -5.53 3.56 0.00 1.25 0.40 -0.11 -4.95 117.98 112.60 7at1 s PHE 33 Ca -0.14 0.53 -0.02 0.00 -0.60 0.00 0.00 56.93 56.70 7at1 s PHE 33 Cb 0.04 -2.04 -0.07 0.00 0.51 0.00 0.00 43.02 41.46 7at1 s PHE 33 CO 0.65 0.60 1.30 1.63 0.70 0.00 0.00 175.22 180.11 7at1 n LYS 34 N 2.40 0.53 0.07 0.44 5.02 -1.26 -4.44 118.16 120.92 7at1 n LYS 34 Ca -0.18 -0.25 0.00 0.00 -2.02 0.00 0.00 58.31 55.86 7at1 n LYS 34 Cb 0.54 -1.62 0.31 0.00 -0.02 0.00 0.00 35.03 34.24 7at1 n LYS 34 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 7at1 h LEU 35 N 5.58 0.33 -0.07 -0.35 3.38 -1.83 0.66 115.31 123.01 7at1 h LEU 35 Ca 0.05 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.93 7at1 h LEU 35 Cb 0.41 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.07 7at1 h LEU 35 CO 0.40 0.52 0.00 0.41 0.09 0.00 0.00 178.44 179.86 7at1 n THR 36 N -4.21 0.40 -2.47 0.22 -1.04 -1.25 -4.44 114.28 101.49 7at1 n THR 36 Ca -0.00 -0.03 -0.43 0.00 -2.04 0.00 0.00 64.05 61.55 7at1 n THR 36 Cb 0.32 -0.66 0.00 0.00 -1.82 0.00 0.00 70.33 68.17 7at1 n THR 36 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 7at1 n GLU 37 N -1.80 3.23 -3.89 -2.82 1.02 0.22 -4.85 120.64 111.74 7at1 n GLU 37 Ca 0.06 -3.32 -0.09 0.00 -0.02 0.00 0.00 57.16 53.79 7at1 n GLU 37 Cb 0.33 -3.27 -0.02 0.00 -0.02 0.00 0.00 31.44 28.47 7at1 n GLU 37 CO 0.00 0.00 0.00 -0.08 1.18 0.00 0.00 177.13 178.23 7at1 s THR 38 N 2.85 0.00 -1.86 2.62 -1.32 -1.26 -5.03 115.64 111.64 7at1 s THR 38 Ca 0.48 -1.14 0.15 0.00 -1.21 0.00 0.00 61.69 59.97 7at1 s THR 38 Cb 0.05 -2.36 0.12 0.00 -1.51 0.00 0.00 72.50 68.80 7at1 s THR 38 CO 0.02 0.00 0.97 -0.67 -2.21 0.00 0.00 174.62 172.73 7at1 n ASP 39 N -0.81 2.23 -4.79 8.08 4.64 -1.26 -4.99 116.55 119.64 7at1 n ASP 39 Ca -0.04 -1.62 -0.33 0.00 -1.38 0.00 0.00 54.79 51.42 7at1 n ASP 39 Cb 0.60 0.01 0.01 0.00 -1.04 0.00 0.00 41.12 40.70 7at1 n ASP 39 CO 0.00 0.00 0.00 -1.10 -0.82 0.00 0.00 177.20 175.28 7at1 s GLN 40 N -1.26 3.33 0.07 -0.67 -1.52 -1.26 -5.00 119.66 113.34 7at1 s GLN 40 Ca 0.17 1.30 -0.30 0.00 -1.95 0.00 0.00 55.36 54.58 7at1 s GLN 40 Cb 0.12 -2.03 -0.06 0.00 -0.22 0.00 0.00 33.01 30.83 7at1 s GLN 40 CO 0.19 -0.81 1.16 0.50 -0.25 0.00 0.00 175.29 176.07 7at1 s ARG 41 N -3.85 4.47 0.05 2.91 3.52 -1.26 -4.93 118.95 119.86 7at1 s ARG 41 Ca 0.66 1.72 0.08 0.00 -0.13 0.00 0.00 55.73 58.05 7at1 s ARG 41 Cb -0.18 -3.35 -0.03 0.00 -1.56 0.00 0.00 34.95 29.84 7at1 s ARG 41 CO 0.34 -0.18 -0.21 0.42 -0.81 0.00 0.00 175.30 174.85 7at1 s ILE 42 N 0.85 1.72 -0.20 4.11 1.01 -1.26 -1.67 121.20 125.75 7at1 s ILE 42 Ca 0.56 -1.23 -0.02 0.00 0.00 0.00 0.00 60.65 59.96 7at1 s ILE 42 Cb -0.28 -1.50 0.06 0.00 0.01 0.00 0.00 42.46 40.75 7at1 s ILE 42 CO 0.30 0.21 0.01 -0.89 0.00 0.00 0.00 174.94 174.58 7at1 s THR 43 N -0.81 0.78 -0.14 2.92 2.01 -0.35 -4.98 115.64 115.06 7at1 s THR 43 Ca 0.08 -0.72 -0.06 0.00 0.31 0.00 0.00 61.69 61.30 7at1 s THR 43 Cb -0.09 -1.22 -0.04 0.00 0.01 0.00 0.00 72.50 71.16 7at1 s THR 43 CO 0.02 -0.18 0.08 -0.63 -0.69 0.00 0.00 174.62 173.22 7at1 s ILE 44 N 1.74 4.96 -0.34 1.82 1.09 -1.26 -2.13 121.20 127.08 7at1 s ILE 44 Ca -0.02 0.01 0.02 0.00 -1.10 0.00 0.00 60.65 59.56 7at1 s ILE 44 Cb -0.17 -3.17 0.09 0.00 -1.06 0.00 0.00 42.46 38.15 7at1 s ILE 44 CO -0.07 0.55 0.05 -0.83 -0.10 0.00 0.00 174.94 174.54 7at1 s GLY 45 N -0.47 1.90 0.03 6.18 0.00 -0.95 -5.01 107.32 109.00 7at1 s GLY 45 Ca 0.10 -2.39 -0.18 0.00 0.00 0.00 0.00 44.72 42.26 7at1 s GLY 45 CO 0.02 0.89 0.51 1.08 0.00 0.00 0.00 173.10 175.60 7at1 s LEU 46 N 0.99 4.48 -0.81 0.66 1.43 -1.26 -1.79 118.68 122.37 7at1 s LEU 46 Ca 0.07 1.12 -0.02 0.00 -1.03 0.00 0.00 54.13 54.27 7at1 s LEU 46 Cb -0.20 -2.78 -0.02 0.00 0.03 0.00 0.00 46.19 43.23 7at1 s LEU 46 CO -0.07 0.26 0.75 0.59 0.23 0.00 0.00 176.35 178.11 7at1 n ASN 47 N 1.97 -7.38 -4.67 2.29 4.13 -1.06 -5.01 115.26 105.54 7at1 n ASN 47 Ca -0.11 -0.25 -0.35 0.00 1.68 0.00 0.00 54.58 55.55 7at1 n ASN 47 Cb 0.51 -5.21 -0.09 0.00 -1.54 0.00 0.00 39.78 33.45 7at1 n ASN 47 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 7at1 s LEU 48 N -4.36 3.83 -0.08 3.41 1.43 0.18 -4.89 118.68 118.19 7at1 s LEU 48 Ca 0.13 0.14 -0.36 0.00 -1.03 0.00 0.00 54.13 53.01 7at1 s LEU 48 Cb -0.02 -1.94 -0.14 0.00 0.03 0.00 0.00 46.19 44.12 7at1 s LEU 48 CO 0.73 0.25 1.73 -0.81 0.23 0.00 0.00 176.35 178.48 7at1 n PRO 49 N 3.02 1.77 -0.05 1.29 -0.04 -1.26 -0.82 135.00 138.91 7at1 n PRO 49 Ca -0.17 0.65 -0.07 0.00 -0.04 0.00 0.00 63.50 63.86 7at1 n PRO 49 Cb 0.53 -2.41 -0.06 0.00 -0.04 0.00 0.00 33.50 31.52 7at1 n PRO 49 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 7at1 n SER 50 N 5.24 3.02 0.00 3.54 2.88 0.04 -4.87 113.62 123.48 7at1 n SER 50 Ca 0.22 -0.04 0.00 0.00 -1.33 0.00 0.00 58.87 57.72 7at1 n SER 50 Cb 0.24 0.08 0.00 0.00 -0.75 0.00 0.00 64.21 63.78 7at1 n SER 50 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 7at1 n GLY 51 N 2.81 1.73 0.34 0.46 0.00 -1.23 -4.43 105.19 104.86 7at1 n GLY 51 Ca -0.19 -0.09 0.11 0.00 0.00 0.00 0.00 46.02 45.86 7at1 n GLY 51 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 7at1 h GLU 52 N 0.00 0.67 -5.21 1.61 5.08 -2.00 -3.38 114.58 111.35 7at1 h GLU 52 Ca 0.00 -0.04 -0.38 0.00 -1.00 0.00 0.00 59.36 57.94 7at1 h GLU 52 Cb 0.00 -0.15 -0.20 0.00 0.50 0.00 0.00 28.75 28.90 7at1 h GLU 52 CO 0.00 0.44 -0.76 1.41 -1.00 0.00 0.00 179.01 179.10 7at1 s MET 53 N -5.89 0.85 0.04 2.33 0.00 -1.26 -5.08 119.30 110.29 7at1 s MET 53 Ca -0.12 -1.06 -0.14 0.00 0.00 0.00 0.00 55.69 54.38 7at1 s MET 53 Cb 0.24 -0.73 -0.06 0.00 0.00 0.00 0.00 34.83 34.28 7at1 s MET 53 CO 0.79 0.14 1.22 0.78 0.00 0.00 0.00 175.02 177.96 7at1 h GLY 54 N 3.94 -1.22 -4.08 2.11 0.00 -1.93 -3.21 103.07 98.67 7at1 h GLY 54 Ca -0.39 0.59 -0.58 0.00 0.00 0.00 0.00 47.33 46.94 7at1 h GLY 54 CO 0.46 -0.39 -0.83 1.09 0.00 0.00 0.00 176.54 176.86 7at1 s ARG 55 N -4.08 1.19 0.33 4.80 1.70 -1.26 -0.78 118.95 120.85 7at1 s ARG 55 Ca -0.06 -1.21 0.05 0.00 -0.47 0.00 0.00 55.73 54.03 7at1 s ARG 55 Cb 0.02 -1.49 -0.02 0.00 -0.57 0.00 0.00 34.95 32.89 7at1 s ARG 55 CO 0.24 0.35 0.19 0.36 -1.08 0.00 0.00 175.30 175.36 7at1 n LYS 56 N 1.01 0.49 -4.27 3.89 2.85 -0.00 -3.77 118.16 118.36 7at1 n LYS 56 Ca -0.19 -3.04 -0.15 0.00 -1.05 0.00 0.00 58.31 53.88 7at1 n LYS 56 Cb 0.54 2.06 -0.10 0.00 -0.65 0.00 0.00 35.03 36.88 7at1 n LYS 56 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 177.40 176.84 7at1 s ASP 57 N -3.17 1.86 -0.05 -5.58 -0.00 0.19 -0.65 116.67 109.27 7at1 s ASP 57 Ca 0.27 -1.04 -0.08 0.00 -0.00 0.00 0.00 52.55 51.70 7at1 s ASP 57 Cb 0.01 -0.02 0.02 0.00 -0.00 0.00 0.00 42.92 42.93 7at1 s ASP 57 CO 0.19 -0.34 0.20 -0.22 -0.00 0.00 0.00 175.17 175.00 7at1 s LEU 58 N -3.20 1.26 -0.07 1.23 0.20 -0.74 -1.73 118.68 115.63 7at1 s LEU 58 Ca 0.19 0.24 0.00 0.00 0.69 0.00 0.00 54.13 55.25 7at1 s LEU 58 Cb 0.03 0.75 0.02 0.00 -0.43 0.00 0.00 46.19 46.56 7at1 s LEU 58 CO 0.02 -0.17 -0.05 -0.63 -0.29 0.00 0.00 176.35 175.23 7at1 s ILE 59 N -0.36 0.69 -0.11 6.68 1.01 -0.10 -2.23 121.20 126.77 7at1 s ILE 59 Ca -0.05 -0.14 0.02 0.00 0.00 0.00 0.00 60.65 60.48 7at1 s ILE 59 Cb -0.03 -0.73 -0.01 0.00 0.01 0.00 0.00 42.46 41.70 7at1 s ILE 59 CO 0.01 0.28 -0.19 -0.54 0.00 0.00 0.00 174.94 174.51 7at1 s LYS 60 N 1.34 3.21 -0.28 2.79 1.02 -0.91 -0.62 119.74 126.31 7at1 s LYS 60 Ca -0.04 -0.78 0.02 0.00 0.02 0.00 0.00 55.97 55.19 7at1 s LYS 60 Cb -0.14 -2.46 0.06 0.00 -0.52 0.00 0.00 37.83 34.77 7at1 s LYS 60 CO -0.03 0.20 -0.07 0.42 -0.92 0.00 0.00 175.35 174.96 7at1 s ILE 61 N 0.34 2.37 -0.02 2.17 1.01 -0.06 -1.22 121.20 125.79 7at1 s ILE 61 Ca -0.15 -1.66 -0.28 0.00 0.00 0.00 0.00 60.65 58.56 7at1 s ILE 61 Cb -0.17 -2.43 -0.03 0.00 0.01 0.00 0.00 42.46 39.84 7at1 s ILE 61 CO 0.07 -0.12 0.89 -0.70 0.00 0.00 0.00 174.94 175.09 7at1 s GLU 62 N 1.11 4.52 -1.08 2.79 2.12 -0.67 -2.39 118.70 125.09 7at1 s GLU 62 Ca -0.06 1.24 -0.07 0.00 0.36 0.00 0.00 54.97 56.44 7at1 s GLU 62 Cb -0.20 -3.46 0.01 0.00 0.26 0.00 0.00 34.13 30.74 7at1 s GLU 62 CO -0.04 -0.02 0.89 0.09 -0.54 0.00 0.00 175.26 175.64 7at1 n ASN 63 N 3.88 -5.43 -4.04 -1.70 5.03 0.25 -4.35 115.26 108.91 7at1 n ASN 63 Ca 0.04 -0.40 -0.14 0.00 0.87 0.00 0.00 54.58 54.94 7at1 n ASN 63 Cb 0.51 -4.05 -0.12 0.00 -1.02 0.00 0.00 39.78 35.09 7at1 n ASN 63 CO 0.00 0.00 0.00 -0.89 -1.83 0.00 0.00 177.26 174.54 7at1 s THR 64 N -3.23 0.54 0.14 3.41 2.01 -1.25 -4.94 115.64 112.32 7at1 s THR 64 Ca 0.44 -0.82 0.07 0.00 0.31 0.00 0.00 61.69 61.69 7at1 s THR 64 Cb -0.19 -0.56 -0.04 0.00 0.01 0.00 0.00 72.50 71.72 7at1 s THR 64 CO 0.55 -0.20 -0.15 -0.36 -0.69 0.00 0.00 174.62 173.76 7at1 s PHE 65 N -0.96 1.54 0.19 4.92 0.40 -1.26 -1.69 117.98 121.12 7at1 s PHE 65 Ca -0.06 -0.53 0.06 0.00 -0.60 0.00 0.00 56.93 55.81 7at1 s PHE 65 Cb -0.07 -0.79 -0.04 0.00 0.51 0.00 0.00 43.02 42.63 7at1 s PHE 65 CO 0.00 0.21 0.11 -0.51 0.70 0.00 0.00 175.22 175.73 7at1 s LEU 66 N -2.55 3.65 0.35 -0.37 1.43 -1.26 -5.03 118.68 114.89 7at1 s LEU 66 Ca 0.12 -0.25 0.05 0.00 -1.03 0.00 0.00 54.13 53.02 7at1 s LEU 66 Cb -0.05 -2.25 -0.01 0.00 0.03 0.00 0.00 46.19 43.91 7at1 s LEU 66 CO 0.04 0.05 0.50 -0.94 0.23 0.00 0.00 176.35 176.23 7at1 s SER 67 N -3.25 6.00 0.27 2.29 1.04 -1.26 -4.93 113.70 113.87 7at1 s SER 67 Ca 0.31 -0.02 -0.00 0.00 0.48 0.00 0.00 55.95 56.71 7at1 s SER 67 Cb -0.09 -1.42 0.55 0.00 0.10 0.00 0.00 66.02 65.16 7at1 s SER 67 CO 0.22 -0.43 1.78 -0.08 0.98 0.00 0.00 173.24 175.71 7at1 h GLU 68 N 0.82 0.71 -0.61 4.02 4.81 -2.00 -0.26 114.58 122.07 7at1 h GLU 68 Ca -0.47 -0.04 -0.10 0.00 -0.13 0.00 0.00 59.36 58.62 7at1 h GLU 68 Cb 1.25 -0.16 -0.02 0.00 0.63 0.00 0.00 28.75 30.45 7at1 h GLU 68 CO 0.55 0.47 -0.01 0.38 -0.73 0.00 0.00 179.01 179.67 7at1 h ASP 69 N 0.73 1.06 -0.55 1.04 3.04 -1.99 -0.77 116.42 118.98 7at1 h ASP 69 Ca 0.48 -0.31 0.00 0.00 -3.24 0.00 0.00 57.03 53.96 7at1 h ASP 69 Cb 0.62 -0.28 -0.03 0.00 -1.04 0.00 0.00 39.33 38.60 7at1 h ASP 69 CO -0.33 1.11 0.36 1.56 -2.04 0.00 0.00 179.24 179.90 7at1 h GLN 70 N 0.98 0.73 -0.12 4.15 4.20 -1.50 -0.19 115.11 123.35 7at1 h GLN 70 Ca 0.17 -0.05 -0.01 0.00 0.06 0.00 0.00 58.65 58.83 7at1 h GLN 70 Cb 0.57 -0.16 -0.00 0.00 0.30 0.00 0.00 27.48 28.19 7at1 h GLN 70 CO 0.03 0.49 0.04 0.28 -0.67 0.00 0.00 178.83 179.00 7at1 h VAL 71 N 0.75 1.17 -0.73 -0.54 2.07 -0.93 -2.89 116.25 115.15 7at1 h VAL 71 Ca 0.20 -0.53 0.09 0.00 0.82 0.00 0.00 66.70 67.28 7at1 h VAL 71 Cb -0.08 1.31 -0.07 0.00 -1.52 0.00 0.00 31.29 30.93 7at1 h VAL 71 CO -0.04 0.16 0.37 0.44 0.02 0.00 0.00 177.57 178.51 7at1 h ASP 72 N 0.01 0.49 -0.95 0.57 3.45 -0.82 -1.59 116.42 117.58 7at1 h ASP 72 Ca 0.04 0.06 0.23 0.00 0.43 0.00 0.00 57.03 57.78 7at1 h ASP 72 Cb 0.21 -0.03 -0.07 0.00 -0.56 0.00 0.00 39.33 38.89 7at1 h ASP 72 CO -0.00 0.28 0.63 1.56 -1.57 0.00 0.00 179.24 180.14 7at1 h GLN 73 N 0.63 0.35 0.00 3.56 4.20 -0.83 0.20 115.11 123.22 7at1 h GLN 73 Ca 0.36 -0.02 -0.03 0.00 0.06 0.00 0.00 58.65 59.01 7at1 h GLN 73 Cb 0.37 -0.08 -0.00 0.00 0.30 0.00 0.00 27.48 28.06 7at1 h GLN 73 CO -0.27 0.23 -0.15 -0.07 -0.67 0.00 0.00 178.83 177.91 7at1 h LEU 74 N 0.36 0.00 -1.82 1.46 3.38 -1.18 -2.98 115.31 114.52 7at1 h LEU 74 Ca 0.50 0.00 0.16 0.00 0.09 0.00 0.00 57.88 58.63 7at1 h LEU 74 Cb 1.33 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 42.05 7at1 h LEU 74 CO -0.19 0.15 0.44 0.00 0.09 0.00 0.00 178.44 178.94 7at1 h ALA 75 N 1.85 2.35 0.00 1.53 0.00 -0.68 0.37 119.26 124.68 7at1 h ALA 75 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 7at1 h ALA 75 Cb 0.34 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.13 7at1 h ALA 75 CO 0.02 -0.53 0.00 1.25 0.00 0.00 0.00 179.25 179.99 7at1 h LEU 76 N 0.18 0.00 0.00 0.00 6.46 -1.69 -2.99 115.31 117.27 7at1 h LEU 76 Ca 0.31 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 58.07 7at1 h LEU 76 Cb 0.97 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.90 7at1 h LEU 76 CO -0.05 0.00 -0.51 -1.22 -0.62 0.00 0.00 178.44 176.04 7at1 n TYR 77 N -2.47 0.00 -3.28 1.25 4.01 -0.11 -4.98 117.16 111.59 7at1 n TYR 77 Ca -0.02 0.00 -0.23 0.00 -0.16 0.00 0.00 57.90 57.49 7at1 n TYR 77 Cb 0.05 0.00 -0.08 0.00 -0.31 0.00 0.00 39.34 39.00 7at1 n TYR 77 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 7at1 n ALA 78 N -1.35 2.09 0.23 -0.72 0.00 0.11 -4.92 120.51 115.95 7at1 n ALA 78 Ca 0.00 -2.80 0.10 0.00 0.00 0.00 0.00 53.44 50.73 7at1 n ALA 78 Cb 0.26 -0.87 0.56 0.00 0.00 0.00 0.00 19.45 19.40 7at1 n ALA 78 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 7at1 h PRO 79 N 5.40 0.00 -0.48 0.00 0.13 -1.70 -2.83 132.00 132.51 7at1 h PRO 79 Ca 0.22 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.35 7at1 h PRO 79 Cb 0.94 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.07 7at1 h PRO 79 CO 0.33 0.21 0.00 0.00 -0.23 0.00 0.00 178.00 178.31 7at1 n GLN 80 N -3.63 2.20 -2.81 0.86 10.64 -1.26 -4.46 117.38 118.92 7at1 n GLN 80 Ca -0.01 -1.62 -0.40 0.00 -1.83 0.00 0.00 57.00 53.14 7at1 n GLN 80 Cb 0.34 -1.43 -0.06 0.00 -0.86 0.00 0.00 30.24 28.23 7at1 n GLN 80 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 7at1 s ALA 81 N -1.50 3.36 -0.30 2.61 0.00 -1.07 -4.78 121.76 120.09 7at1 s ALA 81 Ca 0.30 0.55 -0.08 0.00 0.00 0.00 0.00 51.96 52.73 7at1 s ALA 81 Cb 0.17 -3.15 -0.00 0.00 0.00 0.00 0.00 23.12 20.14 7at1 s ALA 81 CO 0.18 0.22 0.11 0.99 0.00 0.00 0.00 175.76 177.26 7at1 s THR 82 N -1.13 4.24 -0.55 0.00 2.01 0.80 -4.27 115.64 116.75 7at1 s THR 82 Ca 0.40 -0.54 -0.24 0.00 0.31 0.00 0.00 61.69 61.63 7at1 s THR 82 Cb -0.25 -3.16 0.04 0.00 0.01 0.00 0.00 72.50 69.14 7at1 s THR 82 CO 0.30 0.10 0.91 -0.69 -0.69 0.00 0.00 174.62 174.55 7at1 s VAL 83 N 1.55 4.44 -0.19 3.82 1.01 0.23 -1.05 120.40 130.22 7at1 s VAL 83 Ca 0.04 0.19 -0.17 0.00 0.00 0.00 0.00 61.98 62.03 7at1 s VAL 83 Cb -0.17 -4.51 -0.04 0.00 0.00 0.00 0.00 36.38 31.66 7at1 s VAL 83 CO 0.04 -1.08 0.46 0.21 0.00 0.00 0.00 175.10 174.72 7at1 s ASN 84 N 2.83 6.53 -0.04 3.32 3.04 0.24 -0.47 114.94 130.39 7at1 s ASN 84 Ca 0.29 0.63 -0.21 0.00 0.04 0.00 0.00 52.86 53.61 7at1 s ASN 84 Cb -0.13 -2.26 -0.05 0.00 -1.54 0.00 0.00 41.25 37.26 7at1 s ASN 84 CO 0.18 -0.11 0.60 -0.60 -3.04 0.00 0.00 177.10 174.13 7at1 s ARG 85 N 1.33 4.34 -0.06 0.43 3.52 0.13 -1.43 118.95 127.21 7at1 s ARG 85 Ca 0.22 0.72 0.02 0.00 -0.13 0.00 0.00 55.73 56.55 7at1 s ARG 85 Cb -0.15 -3.38 0.02 0.00 -1.56 0.00 0.00 34.95 29.88 7at1 s ARG 85 CO 0.09 0.27 -0.08 0.42 -0.81 0.00 0.00 175.30 175.19 7at1 s ILE 86 N 0.14 0.84 -0.13 4.11 1.09 -0.06 -2.20 121.20 124.99 7at1 s ILE 86 Ca 0.32 -0.29 0.02 0.00 -1.10 0.00 0.00 60.65 59.59 7at1 s ILE 86 Cb -0.18 -0.81 0.01 0.00 -1.06 0.00 0.00 42.46 40.43 7at1 s ILE 86 CO 0.16 0.29 -0.17 -0.62 -0.10 0.00 0.00 174.94 174.50 7at1 s ASP 87 N 0.84 2.73 -0.43 3.58 -1.08 -0.66 -0.95 116.67 120.70 7at1 s ASP 87 Ca -0.12 -0.50 -0.03 0.00 -0.52 0.00 0.00 52.55 51.37 7at1 s ASP 87 Cb -0.15 -1.24 0.00 0.00 -1.46 0.00 0.00 42.92 40.08 7at1 s ASP 87 CO 0.01 0.03 0.34 -3.20 0.52 0.00 0.00 175.17 172.87 7at1 n ASN 88 N 4.26 -2.69 0.00 -0.34 5.15 -0.94 -1.03 115.26 119.67 7at1 n ASN 88 Ca -0.19 -0.48 0.00 0.00 -0.60 0.00 0.00 54.58 53.31 7at1 n ASN 88 Cb 0.51 -0.88 0.00 0.00 -0.53 0.00 0.00 39.78 38.88 7at1 n ASN 88 CO 0.00 0.00 0.00 -1.22 1.40 0.00 0.00 177.26 177.44 7at1 n TYR 89 N -1.46 0.00 -4.31 1.20 4.02 0.87 -4.95 117.16 112.52 7at1 n TYR 89 Ca -0.16 0.00 -0.35 0.00 -0.01 0.00 0.00 57.90 57.38 7at1 n TYR 89 Cb 0.39 -1.51 -0.10 0.00 -0.02 0.00 0.00 39.34 38.09 7at1 n TYR 89 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 176.86 174.64 7at1 s GLU 90 N -1.25 3.30 -0.77 -0.72 0.41 -0.19 -5.03 118.70 114.45 7at1 s GLU 90 Ca 0.00 -0.42 -0.26 0.00 -0.41 0.00 0.00 54.97 53.88 7at1 s GLU 90 Cb 0.00 -2.89 0.02 0.00 -1.78 0.00 0.00 34.13 29.48 7at1 s GLU 90 CO 0.00 0.53 1.44 0.08 -0.49 0.00 0.00 175.26 176.83 7at1 s VAL 91 N -0.41 3.67 -0.03 2.63 1.01 -1.26 -1.65 120.40 124.35 7at1 s VAL 91 Ca 0.08 0.15 0.12 0.00 0.00 0.00 0.00 61.98 62.33 7at1 s VAL 91 Cb -0.12 -4.72 -0.18 0.00 0.00 0.00 0.00 36.38 31.35 7at1 s VAL 91 CO 0.02 -1.66 0.90 0.58 0.00 0.00 0.00 175.10 174.94 7at1 h VAL 92 N 6.36 0.98 -2.73 2.92 2.07 -1.75 -3.49 116.25 120.61 7at1 h VAL 92 Ca -0.18 -2.69 -0.07 0.00 0.82 0.00 0.00 66.70 64.59 7at1 h VAL 92 Cb 1.06 2.44 -0.17 0.00 -1.52 0.00 0.00 31.29 33.10 7at1 h VAL 92 CO 1.29 0.56 0.01 -0.83 0.02 0.00 0.00 177.57 178.62 7at1 s GLY 93 N -4.90 -0.40 -0.23 2.17 0.00 -1.07 -4.97 107.32 97.91 7at1 s GLY 93 Ca -0.02 0.63 -0.02 0.00 0.00 0.00 0.00 44.72 45.30 7at1 s GLY 93 CO 0.81 0.33 0.06 0.54 0.00 0.00 0.00 173.10 174.85 7at1 s LYS 94 N -2.20 0.62 0.04 2.90 1.02 -1.26 0.17 119.74 121.02 7at1 s LYS 94 Ca -0.07 -0.59 0.02 0.00 0.02 0.00 0.00 55.97 55.36 7at1 s LYS 94 Cb -0.01 -1.99 -0.04 0.00 -0.52 0.00 0.00 37.83 35.28 7at1 s LYS 94 CO 0.00 -0.76 0.02 -1.12 -0.92 0.00 0.00 175.35 172.57 7at1 s SER 95 N 1.83 5.23 -0.04 2.83 0.01 0.38 -4.94 113.70 118.99 7at1 s SER 95 Ca 0.03 -0.04 0.02 0.00 1.31 0.00 0.00 55.95 57.27 7at1 s SER 95 Cb -0.17 -1.36 0.01 0.00 0.21 0.00 0.00 66.02 64.71 7at1 s SER 95 CO -0.15 0.23 -0.08 -0.13 0.41 0.00 0.00 173.24 173.52 7at1 s ARG 96 N -1.94 1.13 -0.07 12.44 0.52 -1.26 -0.60 118.95 129.17 7at1 s ARG 96 Ca 0.23 -0.27 -0.30 0.00 -0.52 0.00 0.00 55.73 54.88 7at1 s ARG 96 Cb -0.12 -1.02 -0.05 0.00 0.52 0.00 0.00 34.95 34.28 7at1 s ARG 96 CO 0.15 0.03 1.58 -2.14 0.02 0.00 0.00 175.30 174.94 7at1 s PRO 97 N 0.55 4.19 0.41 3.54 0.02 -1.26 -4.92 135.00 137.54 7at1 s PRO 97 Ca -0.09 2.10 0.01 0.00 0.02 0.00 0.00 61.00 63.03 7at1 s PRO 97 Cb -0.13 -3.93 -0.01 0.00 0.02 0.00 0.00 34.50 30.45 7at1 s PRO 97 CO 0.01 -0.81 0.63 -1.12 -0.33 0.00 0.00 177.00 175.38 7at1 s SER 98 N 3.06 5.99 0.25 2.53 0.01 -1.26 -4.70 113.70 119.57 7at1 s SER 98 Ca 0.70 0.32 -0.31 0.00 1.31 0.00 0.00 55.95 57.97 7at1 s SER 98 Cb -0.31 -1.68 -0.12 0.00 0.21 0.00 0.00 66.02 64.12 7at1 s SER 98 CO 0.27 -0.56 1.67 0.18 0.41 0.00 0.00 173.24 175.21 7at1 n LEU 99 N -1.97 4.20 -4.76 2.44 4.77 -1.26 -4.48 117.00 115.94 7at1 n LEU 99 Ca -0.01 1.10 -0.39 0.00 -0.03 0.00 0.00 56.01 56.68 7at1 n LEU 99 Cb 0.57 -1.59 -0.05 0.00 -2.33 0.00 0.00 43.42 40.03 7at1 n LEU 99 CO 0.48 0.18 0.74 -2.16 -1.33 0.00 0.00 177.39 175.30 7at1 s PRO 100 N 0.37 4.59 0.51 3.23 0.04 -1.26 -4.95 135.00 137.52 7at1 s PRO 100 Ca 0.70 1.63 0.30 0.00 0.04 0.00 0.00 61.00 63.67 7at1 s PRO 100 Cb -0.50 -3.04 1.16 0.00 0.04 0.00 0.00 34.50 32.17 7at1 s PRO 100 CO 0.40 0.21 1.91 1.05 0.04 0.00 0.00 177.00 180.61 7at1 h GLU 101 N 3.56 0.00 -3.05 4.56 4.11 -1.93 -3.41 114.58 118.42 7at1 h GLU 101 Ca -0.47 0.00 -0.13 0.00 0.07 0.00 0.00 59.36 58.84 7at1 h GLU 101 Cb 1.21 0.00 -0.21 0.00 0.50 0.00 0.00 28.75 30.24 7at1 h GLU 101 CO 0.66 0.08 -0.31 -0.98 0.07 0.00 0.00 179.01 178.53 7at1 s ARG 102 N -3.64 0.58 -0.13 1.06 1.70 -1.26 -1.14 118.95 116.12 7at1 s ARG 102 Ca 0.01 -0.05 0.02 0.00 -0.47 0.00 0.00 55.73 55.24 7at1 s ARG 102 Cb 0.09 0.26 0.01 0.00 -0.57 0.00 0.00 34.95 34.75 7at1 s ARG 102 CO 0.58 -0.14 -0.18 0.42 -1.08 0.00 0.00 175.30 174.89 7at1 s ILE 103 N -0.96 1.80 0.17 4.99 1.09 0.04 -4.93 121.20 123.41 7at1 s ILE 103 Ca -0.10 -0.81 0.08 0.00 -1.10 0.00 0.00 60.65 58.72 7at1 s ILE 103 Cb -0.05 -1.62 -0.04 0.00 -1.06 0.00 0.00 42.46 39.69 7at1 s ILE 103 CO 0.03 0.50 -0.06 -1.81 -0.10 0.00 0.00 174.94 173.50 7at1 s ASP 104 N 1.02 4.46 0.00 3.58 1.01 -1.26 -0.96 116.67 124.52 7at1 s ASP 104 Ca -0.04 -0.50 0.00 0.00 0.71 0.00 0.00 52.55 52.72 7at1 s ASP 104 Cb -0.15 -0.84 0.00 0.00 1.01 0.00 0.00 42.92 42.94 7at1 s ASP 104 CO -0.04 0.10 0.00 -3.20 0.21 0.00 0.00 175.17 172.24 7at1 n ASN 105 N 0.00 0.00 0.18 0.27 4.05 0.04 -4.80 115.26 115.00 7at1 n ASN 105 Ca -0.10 0.00 0.04 0.00 0.45 0.00 0.00 54.58 54.97 7at1 n ASN 105 Cb 0.55 0.00 0.29 0.00 1.23 0.00 0.00 39.78 41.85 7at1 n ASN 105 CO 0.00 0.00 0.00 -0.37 -3.05 0.00 0.00 177.26 173.84 7at1 h VAL 106 N 0.00 0.99 -3.12 3.44 -1.51 -1.87 -3.42 116.25 110.76 7at1 h VAL 106 Ca 0.00 -1.67 -0.63 0.00 -1.23 0.00 0.00 66.70 63.17 7at1 h VAL 106 Cb 0.00 2.00 -0.11 0.00 -2.13 0.00 0.00 31.29 31.05 7at1 h VAL 106 CO 0.00 0.42 -0.65 -0.76 -1.23 0.00 0.00 177.57 175.35 7at1 s LEU 107 N -7.13 3.47 0.05 4.19 1.43 -1.26 -5.11 118.68 114.30 7at1 s LEU 107 Ca 0.00 -0.23 0.04 0.00 -1.03 0.00 0.00 54.13 52.91 7at1 s LEU 107 Cb 0.11 -2.16 -0.04 0.00 0.03 0.00 0.00 46.19 44.13 7at1 s LEU 107 CO 0.70 0.13 -0.04 -0.69 0.23 0.00 0.00 176.35 176.69 7at1 s VAL 108 N -1.49 3.80 0.03 -1.59 1.01 -1.26 -4.71 120.40 116.18 7at1 s VAL 108 Ca 0.27 -0.89 -0.30 0.00 0.00 0.00 0.00 61.98 61.06 7at1 s VAL 108 Cb -0.11 -2.73 -0.04 0.00 0.00 0.00 0.00 36.38 33.50 7at1 s VAL 108 CO 0.19 0.26 1.08 0.00 0.00 0.00 0.00 175.10 176.63 7at1 n PRO 110 N 3.91 0.25 -2.60 0.00 -0.04 -1.26 -4.63 135.00 130.63 7at1 n PRO 110 Ca 0.07 0.10 -0.43 0.00 -0.04 0.00 0.00 63.50 63.21 7at1 n PRO 110 Cb 0.49 -1.50 -0.02 0.00 -0.04 0.00 0.00 33.50 32.43 7at1 n PRO 110 CO 0.00 0.00 0.00 1.21 -0.04 0.00 0.00 175.50 176.67 7at1 s ASN 111 N -2.33 6.51 0.41 3.54 3.84 -1.26 -4.86 114.94 120.79 7at1 s ASN 111 Ca 0.14 0.23 0.16 0.00 0.21 0.00 0.00 52.86 53.60 7at1 s ASN 111 Cb 0.08 -2.55 1.05 0.00 -0.55 0.00 0.00 41.25 39.27 7at1 s ASN 111 CO 0.16 -1.39 1.85 -1.28 -2.79 0.00 0.00 177.10 173.64 7at1 h SER 112 N 9.42 0.45 -0.76 -4.21 0.87 -2.04 -2.10 113.55 115.18 7at1 h SER 112 Ca -0.24 0.05 -0.43 0.00 -1.23 0.00 0.00 61.79 59.94 7at1 h SER 112 Cb 1.06 -0.04 -0.24 0.00 -0.44 0.00 0.00 62.40 62.74 7at1 h SER 112 CO 1.16 0.18 0.35 -3.20 -0.53 0.00 0.00 176.83 174.79 7at1 n ASN 113 N -4.53 3.90 -4.85 6.23 5.15 -1.26 -4.96 115.26 114.94 7at1 n ASN 113 Ca 0.20 -3.71 -0.34 0.00 -0.60 0.00 0.00 54.58 50.13 7at1 n ASN 113 Cb 0.68 -0.76 -0.06 0.00 -0.53 0.00 0.00 39.78 39.11 7at1 n ASN 113 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 7at1 h ILE 115 N 2.34 1.15 -0.80 0.00 6.09 -1.92 -2.83 117.51 121.53 7at1 h ILE 115 Ca -0.48 -1.36 0.22 0.00 -1.37 0.00 0.00 64.86 61.88 7at1 h ILE 115 Cb 1.18 1.76 -0.04 0.00 0.47 0.00 0.00 36.82 40.19 7at1 h ILE 115 CO 0.66 0.37 0.57 0.77 -3.07 0.00 0.00 178.15 177.45 7at1 h SER 116 N 0.00 0.06 0.03 2.19 4.64 -1.93 0.08 113.55 118.61 7at1 h SER 116 Ca -0.00 0.01 -0.16 0.00 -0.47 0.00 0.00 61.79 61.16 7at1 h SER 116 Cb 0.73 -0.01 -0.01 0.00 -0.31 0.00 0.00 62.40 62.80 7at1 h SER 116 CO 0.05 0.03 -0.55 0.45 -0.87 0.00 0.00 176.83 175.94 7at1 h HIS 117 N 0.06 0.69 0.00 4.77 3.86 -1.86 -3.32 115.15 119.35 7at1 h HIS 117 Ca 0.39 -0.24 0.00 0.00 -1.16 0.00 0.00 60.37 59.35 7at1 h HIS 117 Cb 1.44 -0.13 0.00 0.00 1.06 0.00 0.00 27.41 29.78 7at1 h HIS 117 CO -0.00 0.97 -1.19 0.00 0.86 0.00 0.00 177.93 178.58 7at1 n ALA 118 N -2.52 2.77 -2.70 2.45 0.00 -0.03 -4.96 120.51 115.51 7at1 n ALA 118 Ca -0.03 -0.32 -0.25 0.00 0.00 0.00 0.00 53.44 52.84 7at1 n ALA 118 Cb 0.60 -1.01 -0.07 0.00 0.00 0.00 0.00 19.45 18.97 7at1 n ALA 118 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 7at1 s GLU 119 N -3.35 2.53 -1.43 0.00 0.41 -0.93 -5.03 118.70 110.89 7at1 s GLU 119 Ca -0.01 -1.15 -0.09 0.00 -0.41 0.00 0.00 54.97 53.31 7at1 s GLU 119 Cb 0.12 -2.38 -0.07 0.00 -1.78 0.00 0.00 34.13 30.01 7at1 s GLU 119 CO 0.81 0.43 2.70 -0.35 -0.49 0.00 0.00 175.26 178.36 7at1 n PRO 120 N -0.54 3.23 -4.48 0.39 -0.04 -1.26 -4.86 135.00 127.45 7at1 n PRO 120 Ca -0.08 -2.03 -0.24 0.00 -0.04 0.00 0.00 63.50 61.11 7at1 n PRO 120 Cb 0.57 -2.74 -0.10 0.00 -0.04 0.00 0.00 33.50 31.18 7at1 n PRO 120 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 7at1 s VAL 121 N 2.57 2.27 0.16 0.52 -7.23 -1.26 -5.14 120.40 112.29 7at1 s VAL 121 Ca 0.61 -2.31 -0.09 0.00 -1.81 0.00 0.00 61.98 58.39 7at1 s VAL 121 Cb 0.16 -2.39 -0.06 0.00 0.56 0.00 0.00 36.38 34.65 7at1 s VAL 121 CO -0.05 -0.36 0.46 -0.44 -0.31 0.00 0.00 175.10 174.41 7at1 s SER 122 N -3.51 6.60 0.93 4.85 0.01 -1.26 -5.03 113.70 116.28 7at1 s SER 122 Ca 0.30 0.80 -0.12 0.00 1.31 0.00 0.00 55.95 58.24 7at1 s SER 122 Cb -0.02 -2.18 0.15 0.00 0.21 0.00 0.00 66.02 64.18 7at1 s SER 122 CO 0.14 0.04 1.09 -0.94 0.41 0.00 0.00 173.24 173.98 7at1 s SER 123 N -2.19 3.19 -0.28 2.44 1.04 -1.26 -4.78 113.70 111.86 7at1 s SER 123 Ca 0.41 1.42 -0.19 0.00 0.48 0.00 0.00 55.95 58.08 7at1 s SER 123 Cb -0.12 -2.10 0.09 0.00 0.10 0.00 0.00 66.02 63.98 7at1 s SER 123 CO 0.21 -2.81 0.76 -0.55 0.98 0.00 0.00 173.24 171.84 7at1 s SER 124 N -3.39 -0.79 -0.04 7.02 0.15 -1.26 -0.78 113.70 114.61 7at1 s SER 124 Ca 0.64 1.35 0.04 0.00 0.70 0.00 0.00 55.95 58.68 7at1 s SER 124 Cb -0.18 1.34 -0.00 0.00 -1.71 0.00 0.00 66.02 65.47 7at1 s SER 124 CO 0.57 -0.22 -0.15 -0.36 1.20 0.00 0.00 173.24 174.28 7at1 s PHE 125 N 1.12 1.54 0.12 3.44 0.40 -0.14 -1.99 117.98 122.47 7at1 s PHE 125 Ca -0.06 -0.43 -0.30 0.00 -0.60 0.00 0.00 56.93 55.55 7at1 s PHE 125 Cb -0.05 -1.04 -0.06 0.00 0.51 0.00 0.00 43.02 42.38 7at1 s PHE 125 CO -0.12 -0.14 1.01 0.00 0.70 0.00 0.00 175.22 176.67 7at1 s ALA 126 N 0.05 3.28 0.00 5.36 0.00 0.46 -0.78 121.76 130.14 7at1 s ALA 126 Ca -0.03 0.65 -0.12 0.00 0.00 0.00 0.00 51.96 52.47 7at1 s ALA 126 Cb -0.11 -3.31 -0.05 0.00 0.00 0.00 0.00 23.12 19.65 7at1 s ALA 126 CO 0.02 -0.11 0.35 0.08 0.00 0.00 0.00 175.76 176.10 7at1 s VAL 127 N 0.04 5.14 -0.09 0.00 1.01 -0.29 -1.01 120.40 125.20 7at1 s VAL 127 Ca 0.48 0.60 -0.04 0.00 0.00 0.00 0.00 61.98 63.03 7at1 s VAL 127 Cb -0.25 -3.64 0.05 0.00 0.00 0.00 0.00 36.38 32.54 7at1 s VAL 127 CO 0.31 0.50 0.21 -0.60 0.00 0.00 0.00 175.10 175.52 7at1 s ARG 128 N -1.32 0.14 -0.29 2.72 3.00 0.32 -4.88 118.95 118.65 7at1 s ARG 128 Ca 0.25 0.51 -0.29 0.00 -1.00 0.00 0.00 55.73 55.20 7at1 s ARG 128 Cb -0.15 -0.15 0.00 0.00 0.00 0.00 0.00 34.95 34.66 7at1 s ARG 128 CO 0.13 -0.20 1.25 0.21 0.00 0.00 0.00 175.30 176.69 7at1 s LYS 129 N 1.50 3.98 0.00 5.12 2.20 -1.26 -0.26 119.74 131.01 7at1 s LYS 129 Ca -0.07 1.25 0.00 0.00 -0.36 0.00 0.00 55.97 56.79 7at1 s LYS 129 Cb -0.11 -3.84 0.00 0.00 -1.51 0.00 0.00 37.83 32.37 7at1 s LYS 129 CO -0.07 -1.03 0.00 -2.13 -0.36 0.00 0.00 175.35 171.76 7at1 n ARG 130 N 7.15 0.00 -0.80 4.03 0.63 -1.17 -4.92 116.66 121.57 7at1 n ARG 130 Ca 0.14 0.00 -0.04 0.00 -0.92 0.00 0.00 57.85 57.03 7at1 n ARG 130 Cb 0.46 0.00 -0.04 0.00 0.45 0.00 0.00 32.46 33.34 7at1 n ARG 130 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 7at1 n ALA 131 N -1.65 2.97 0.01 5.13 0.00 -1.26 -5.01 120.51 120.71 7at1 n ALA 131 Ca 0.00 -0.45 0.00 0.00 0.00 0.00 0.00 53.44 52.99 7at1 n ALA 131 Cb 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 19.45 19.24 7at1 n ALA 131 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 7at1 n ASN 132 N 0.01 -0.21 -1.90 0.00 2.85 -1.26 -5.13 115.26 109.62 7at1 n ASN 132 Ca -0.15 0.42 0.00 0.00 -0.11 0.00 0.00 54.58 54.74 7at1 n ASN 132 Cb 0.63 0.58 0.00 0.00 1.24 0.00 0.00 39.78 42.22 7at1 n ASN 132 CO 0.00 0.00 0.00 -0.90 -2.11 0.00 0.00 177.26 174.25 7at1 n ASP 133 N -2.73 1.99 -4.82 1.20 5.75 -1.26 -5.14 116.55 111.53 7at1 n ASP 133 Ca 0.00 -0.95 -0.37 0.00 -0.01 0.00 0.00 54.79 53.45 7at1 n ASP 133 Cb 0.00 0.00 -0.06 0.00 -1.03 0.00 0.00 41.12 40.03 7at1 n ASP 133 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 7at1 s ILE 134 N -0.91 5.19 -0.15 2.12 1.09 -1.26 -3.07 121.20 124.22 7at1 s ILE 134 Ca 0.00 0.65 -0.07 0.00 -1.10 0.00 0.00 60.65 60.13 7at1 s ILE 134 Cb 0.00 -3.63 -0.04 0.00 -1.06 0.00 0.00 42.46 37.73 7at1 s ILE 134 CO 0.00 0.55 0.08 0.00 -0.10 0.00 0.00 174.94 175.47 7at1 s ALA 135 N -0.74 3.57 -0.17 9.38 0.00 0.63 0.17 121.76 134.60 7at1 s ALA 135 Ca 0.21 -0.72 0.01 0.00 0.00 0.00 0.00 51.96 51.46 7at1 s ALA 135 Cb -0.15 -1.89 0.02 0.00 0.00 0.00 0.00 23.12 21.10 7at1 s ALA 135 CO 0.09 0.39 -0.19 -0.51 0.00 0.00 0.00 175.76 175.54 7at1 s LEU 136 N -0.29 2.20 -0.25 0.00 1.43 0.19 -0.52 118.68 121.43 7at1 s LEU 136 Ca 0.09 -0.61 -0.12 0.00 -1.03 0.00 0.00 54.13 52.45 7at1 s LEU 136 Cb -0.12 -1.50 -0.05 0.00 0.03 0.00 0.00 46.19 44.56 7at1 s LEU 136 CO 0.01 0.02 0.25 -0.75 0.23 0.00 0.00 176.35 176.11 7at1 s LYS 137 N 1.20 4.04 0.26 1.70 2.20 -0.18 -1.47 119.74 127.48 7at1 s LYS 137 Ca 0.02 -0.15 -0.29 0.00 -0.36 0.00 0.00 55.97 55.19 7at1 s LYS 137 Cb -0.14 -3.59 -0.09 0.00 -1.51 0.00 0.00 37.83 32.50 7at1 s LYS 137 CO -0.10 -0.09 1.19 0.00 -0.36 0.00 0.00 175.35 175.99 7at1 h LYS 139 N 4.22 0.80 0.00 0.00 3.64 -1.75 -2.30 116.57 121.18 7at1 h LYS 139 Ca -0.46 -0.19 0.00 0.00 -1.27 0.00 0.00 60.65 58.72 7at1 h LYS 139 Cb 1.22 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.93 7at1 h LYS 139 CO 0.69 0.77 0.00 0.66 -2.27 0.00 0.00 179.45 179.31 7at1 n TYR 140 N -4.46 0.00 0.68 1.91 4.01 -1.26 -4.18 117.16 113.87 7at1 n TYR 140 Ca 0.01 0.00 0.11 0.00 -0.16 0.00 0.00 57.90 57.86 7at1 n TYR 140 Cb 0.22 -0.43 0.45 0.00 -0.31 0.00 0.00 39.34 39.27 7at1 n TYR 140 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 7at1 n GLU 142 N -1.64 -1.18 -3.01 0.00 1.02 -0.86 -5.00 120.64 109.97 7at1 n GLU 142 Ca 0.05 0.40 -0.34 0.00 -0.02 0.00 0.00 57.16 57.25 7at1 n GLU 142 Cb 0.26 -4.33 -0.06 0.00 -0.02 0.00 0.00 31.44 27.28 7at1 n GLU 142 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 7at1 s LYS 143 N -1.49 4.20 -0.08 3.49 -0.14 -1.26 -4.66 119.74 119.80 7at1 s LYS 143 Ca 0.00 0.92 -0.05 0.00 -1.36 0.00 0.00 55.97 55.47 7at1 s LYS 143 Cb 0.00 -2.54 -0.04 0.00 -1.68 0.00 0.00 37.83 33.57 7at1 s LYS 143 CO 0.00 0.19 0.14 -1.21 -0.76 0.00 0.00 175.35 173.71 7at1 s GLU 144 N -2.63 3.39 0.06 1.68 2.02 -1.26 -1.45 118.70 120.50 7at1 s GLU 144 Ca 0.52 -0.22 -0.00 0.00 0.02 0.00 0.00 54.97 55.29 7at1 s GLU 144 Cb -0.13 -3.12 -0.04 0.00 0.10 0.00 0.00 34.13 30.94 7at1 s GLU 144 CO 0.18 0.74 -0.04 -0.06 0.02 0.00 0.00 175.26 176.10 7at1 s PHE 145 N -1.11 0.57 0.43 1.61 0.40 -0.54 -4.94 117.98 114.39 7at1 s PHE 145 Ca 0.19 -1.01 -0.23 0.00 -0.60 0.00 0.00 56.93 55.28 7at1 s PHE 145 Cb -0.12 -0.40 -0.09 0.00 0.51 0.00 0.00 43.02 42.92 7at1 s PHE 145 CO 0.09 -0.33 1.05 0.45 0.70 0.00 0.00 175.22 177.18 7at1 s SER 146 N -2.85 6.59 0.42 1.36 0.15 -1.26 -0.64 113.70 117.46 7at1 s SER 146 Ca 0.06 2.02 0.29 0.00 0.70 0.00 0.00 55.95 59.02 7at1 s SER 146 Cb 0.06 -2.58 1.18 0.00 -1.71 0.00 0.00 66.02 62.98 7at1 s SER 146 CO -0.09 -0.61 1.86 1.12 1.20 0.00 0.00 173.24 176.72 7at1 h HIS 147 N 2.17 0.00 -0.07 3.44 2.07 -0.62 -1.13 115.15 121.01 7at1 h HIS 147 Ca -0.49 0.00 -0.00 0.00 -2.85 0.00 0.00 60.37 57.03 7at1 h HIS 147 Cb 1.22 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 31.20 7at1 h HIS 147 CO 0.57 0.00 0.03 -0.91 -3.07 0.00 0.00 177.93 174.55 7at1 h ASN 148 N 0.00 0.09 -0.54 3.10 2.35 -1.92 -3.10 115.58 115.55 7at1 h ASN 148 Ca 0.00 -0.14 -0.07 0.00 -0.55 0.00 0.00 56.30 55.54 7at1 h ASN 148 Cb 0.46 -0.02 -0.02 0.00 0.05 0.00 0.00 38.32 38.78 7at1 h ASN 148 CO 0.00 0.21 0.07 0.58 -1.65 0.00 0.00 177.43 176.63 7at1 h VAL 149 N -0.03 1.26 0.00 2.81 2.07 -1.60 -1.66 116.25 119.09 7at1 h VAL 149 Ca 0.02 -1.00 -0.02 0.00 0.82 0.00 0.00 66.70 66.52 7at1 h VAL 149 Cb 0.14 0.84 -0.00 0.00 -1.52 0.00 0.00 31.29 30.75 7at1 h VAL 149 CO -0.00 0.36 -0.09 0.58 0.02 0.00 0.00 177.57 178.43 7at1 h VAL 150 N 0.80 0.55 0.00 2.57 2.07 -1.46 0.64 116.25 121.42 7at1 h VAL 150 Ca 0.16 -0.42 0.00 0.00 0.82 0.00 0.00 66.70 67.26 7at1 h VAL 150 Cb 0.44 1.27 0.00 0.00 -1.52 0.00 0.00 31.29 31.49 7at1 h VAL 150 CO 0.02 0.09 0.00 0.18 0.02 0.00 0.00 177.57 177.88 7at1 n LEU 151 N -3.68 0.00 -1.45 2.57 4.77 -0.63 -4.63 117.00 113.96 7at1 n LEU 151 Ca -0.02 0.03 0.19 0.00 -0.03 0.00 0.00 56.01 56.18 7at1 n LEU 151 Cb 0.21 -0.03 -0.06 0.00 -2.33 0.00 0.00 43.42 41.21 7at1 n LEU 151 CO 0.29 -0.00 -0.38 0.00 -1.33 0.00 0.00 177.39 175.97 7at1 n ALA 152 N -1.03 -3.75 -1.63 -1.18 0.00 0.22 -5.12 120.51 108.02 7at1 n ALA 152 Ca 0.20 0.61 0.00 0.00 0.00 0.00 0.00 53.44 54.25 7at1 n ALA 152 Cb 0.11 -1.39 0.00 0.00 0.00 0.00 0.00 19.45 18.17 7at1 n ALA 152 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77