#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1m70 s GLY 2 N 0.00 1.61 -0.57 0.00 0.00 -1.25 -4.82 107.32 102.29 1m70 s GLY 2 Ca 0.00 -0.95 -0.20 0.00 0.00 0.00 0.00 44.72 43.57 1m70 s GLY 2 CO 0.00 -0.92 0.72 -0.35 0.00 0.00 0.00 173.10 172.55 1m70 s ASP 3 N -3.44 6.20 0.31 1.64 -1.08 -1.26 -4.82 116.67 114.22 1m70 s ASP 3 Ca 0.37 -1.19 0.02 0.00 -0.52 0.00 0.00 52.55 51.23 1m70 s ASP 3 Cb -0.10 -2.32 0.57 0.00 -1.46 0.00 0.00 42.92 39.61 1m70 s ASP 3 CO 0.30 -1.09 1.91 0.00 0.52 0.00 0.00 175.17 176.80 1m70 h ALA 4 N 9.18 1.56 -0.52 3.66 0.00 -1.83 -0.92 119.26 130.38 1m70 h ALA 4 Ca -0.29 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.58 1m70 h ALA 4 Cb 1.09 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.61 1m70 h ALA 4 CO 1.07 0.29 0.20 1.49 0.00 0.00 0.00 179.25 182.31 1m70 h GLU 5 N 0.98 0.78 -0.72 0.00 4.81 -1.93 -1.30 114.58 117.20 1m70 h GLU 5 Ca 0.40 -0.15 -0.04 0.00 -0.13 0.00 0.00 59.36 59.44 1m70 h GLU 5 Cb 0.27 -0.13 -0.03 0.00 0.63 0.00 0.00 28.75 29.49 1m70 h GLU 5 CO -0.16 0.69 0.30 0.00 -0.73 0.00 0.00 179.01 179.12 1m70 h ALA 6 N 1.05 0.94 -0.04 2.92 0.00 -1.75 -2.86 119.26 119.53 1m70 h ALA 6 Ca 0.17 -0.18 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 1m70 h ALA 6 Cb 0.21 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 1m70 h ALA 6 CO -0.01 0.55 -0.17 0.78 0.00 0.00 0.00 179.25 180.40 1m70 h GLY 7 N 1.04 0.06 1.45 0.00 0.00 -0.53 -1.79 103.07 103.30 1m70 h GLY 7 Ca 0.24 -0.03 0.08 0.00 0.00 0.00 0.00 47.33 47.61 1m70 h GLY 7 CO -0.02 0.03 0.20 -1.61 0.00 0.00 0.00 176.54 175.14 1m70 h GLN 8 N 0.05 0.04 -0.32 4.80 4.15 -1.01 -0.58 115.11 122.24 1m70 h GLN 8 Ca 0.01 -0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.43 1m70 h GLN 8 Cb 0.34 -0.01 0.00 0.00 0.21 0.00 0.00 27.48 28.02 1m70 h GLN 8 CO 0.02 0.03 0.00 0.41 -1.93 0.00 0.00 178.83 177.36 1m70 n GLY 9 N -1.58 0.73 0.07 2.39 0.00 -0.67 -4.19 105.19 101.93 1m70 n GLY 9 Ca 0.04 -0.44 0.09 0.00 0.00 0.00 0.00 46.02 45.71 1m70 n GLY 9 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1m70 n LYS 10 N 0.60 1.37 -0.28 1.61 5.02 -0.22 -4.71 118.16 121.54 1m70 n LYS 10 Ca 0.15 -2.50 0.07 0.00 -2.02 0.00 0.00 58.31 54.00 1m70 n LYS 10 Cb 0.35 -1.46 0.11 0.00 -0.02 0.00 0.00 35.03 34.00 1m70 n LYS 10 CO 0.00 0.00 0.00 1.33 -0.52 0.00 0.00 177.40 178.21 1m70 n VAL 11 N -1.37 1.38 -0.10 -0.18 0.24 -1.24 -4.85 118.33 112.21 1m70 n VAL 11 Ca 0.15 -1.75 -0.06 0.00 -2.04 0.00 0.00 64.34 60.64 1m70 n VAL 11 Cb 0.62 -0.01 0.02 0.00 -1.47 0.00 0.00 33.84 33.00 1m70 n VAL 11 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1m70 h ALA 12 N 0.14 0.39 0.00 2.33 0.00 -1.87 -1.33 119.26 118.91 1m70 h ALA 12 Ca -0.01 0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 1m70 h ALA 12 Cb 1.13 0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.99 1m70 h ALA 12 CO 0.00 -0.31 -0.12 -0.24 0.00 0.00 0.00 179.25 178.58 1m70 h VAL 13 N 0.22 0.51 0.00 0.00 3.04 -2.00 -2.94 116.25 115.08 1m70 h VAL 13 Ca 0.17 -0.57 -0.07 0.00 -1.01 0.00 0.00 66.70 65.21 1m70 h VAL 13 Cb 0.17 1.38 -0.01 0.00 -2.01 0.00 0.00 31.29 30.82 1m70 h VAL 13 CO -0.20 0.12 -0.35 0.00 -1.01 0.00 0.00 177.57 176.13 1m70 h GLY 15 N 2.91 0.49 0.85 0.00 0.00 -1.47 -0.66 103.07 105.20 1m70 h GLY 15 Ca -0.00 -0.40 0.07 0.00 0.00 0.00 0.00 47.33 46.99 1m70 h GLY 15 CO 0.05 0.37 0.58 0.00 0.00 0.00 0.00 176.54 177.53 1m70 h ALA 16 N 1.33 1.54 0.05 3.60 0.00 -1.80 0.63 119.26 124.61 1m70 h ALA 16 Ca 0.06 -0.02 -0.34 0.00 0.00 0.00 0.00 54.91 54.60 1m70 h ALA 16 Cb 0.67 -0.26 -0.04 0.00 0.00 0.00 0.00 17.79 18.16 1m70 h ALA 16 CO 0.05 0.32 -1.93 0.00 0.00 0.00 0.00 179.25 177.69 1m70 n HIS 18 N -3.87 0.01 0.00 0.00 -0.00 -0.29 -4.68 115.22 106.39 1m70 n HIS 18 Ca -0.38 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.34 1m70 n HIS 18 Cb 0.90 -0.10 0.00 0.00 -0.00 0.00 0.00 29.99 30.79 1m70 n HIS 18 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 1m70 n GLY 19 N 1.49 -1.30 0.35 -1.41 0.00 0.21 -1.99 105.19 102.54 1m70 n GLY 19 Ca 0.04 -1.44 0.11 0.00 0.00 0.00 0.00 46.02 44.73 1m70 n GLY 19 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1m70 h VAL 20 N 0.00 0.93 -0.28 1.61 2.07 -1.92 -2.39 116.25 116.27 1m70 h VAL 20 Ca 0.00 -0.15 0.00 0.00 0.82 0.00 0.00 66.70 67.37 1m70 h VAL 20 Cb 0.00 0.46 0.00 0.00 -1.52 0.00 0.00 31.29 30.23 1m70 h VAL 20 CO 0.00 0.08 0.00 -0.90 0.02 0.00 0.00 177.57 176.77 1m70 n ASP 21 N -4.47 2.86 0.00 0.57 5.75 -1.26 -4.97 116.55 115.03 1m70 n ASP 21 Ca 0.09 -1.84 0.00 0.00 -0.01 0.00 0.00 54.79 53.02 1m70 n ASP 21 Cb 0.33 -0.18 0.00 0.00 -1.03 0.00 0.00 41.12 40.24 1m70 n ASP 21 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1m70 n GLY 22 N 0.93 0.58 0.71 6.12 0.00 -0.90 -4.16 105.19 108.45 1m70 n GLY 22 Ca 0.13 -0.81 0.06 0.00 0.00 0.00 0.00 46.02 45.40 1m70 n GLY 22 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1m70 n ASN 23 N 1.56 1.62 -4.77 1.61 3.02 -0.92 -0.93 115.26 116.45 1m70 n ASN 23 Ca 0.00 -3.56 -0.40 0.00 -0.03 0.00 0.00 54.58 50.58 1m70 n ASN 23 Cb 0.11 -0.49 0.01 0.00 -0.61 0.00 0.00 39.78 38.80 1m70 n ASN 23 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 1m70 s SER 24 N -3.01 6.04 0.00 6.41 0.15 -0.84 -4.87 113.70 117.58 1m70 s SER 24 Ca 0.37 3.00 0.21 0.00 0.70 0.00 0.00 55.95 60.22 1m70 s SER 24 Cb 0.36 -2.66 1.09 0.00 -1.71 0.00 0.00 66.02 63.10 1m70 s SER 24 CO -0.08 -1.07 1.65 -0.81 1.20 0.00 0.00 173.24 174.13 1m70 n PRO 25 N 0.06 0.38 -1.62 5.44 -0.04 -1.26 -4.81 135.00 133.14 1m70 n PRO 25 Ca 0.03 0.07 -0.46 0.00 -0.04 0.00 0.00 63.50 63.10 1m70 n PRO 25 Cb 0.41 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 32.32 1m70 n PRO 25 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1m70 n ALA 26 N -1.22 1.24 0.31 0.55 0.00 -1.26 -4.83 120.51 115.30 1m70 n ALA 26 Ca 0.11 0.10 0.16 0.00 0.00 0.00 0.00 53.44 53.81 1m70 n ALA 26 Cb 0.14 -2.64 0.68 0.00 0.00 0.00 0.00 19.45 17.64 1m70 n ALA 26 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1m70 h PRO 27 N 11.27 0.00 -0.01 0.00 0.13 -1.98 -2.81 132.00 138.60 1m70 h PRO 27 Ca -0.44 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 1m70 h PRO 27 Cb 1.27 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.40 1m70 h PRO 27 CO 0.96 0.00 -0.57 0.09 -0.23 0.00 0.00 178.00 178.25 1m70 n ASN 28 N -2.83 1.61 -4.55 1.44 4.13 -1.26 -3.29 115.26 110.50 1m70 n ASN 28 Ca 0.01 -1.30 -0.37 0.00 1.68 0.00 0.00 54.58 54.59 1m70 n ASN 28 Cb 0.25 0.63 -0.11 0.00 -1.54 0.00 0.00 39.78 39.01 1m70 n ASN 28 CO 0.00 0.00 0.00 -0.36 0.28 0.00 0.00 177.26 177.18 1m70 s PHE 29 N -2.44 3.18 0.34 3.10 0.08 -1.06 -4.70 117.98 116.48 1m70 s PHE 29 Ca 0.14 -0.05 -0.28 0.00 0.12 0.00 0.00 56.93 56.86 1m70 s PHE 29 Cb 0.16 -2.32 -0.10 0.00 -0.57 0.00 0.00 43.02 40.19 1m70 s PHE 29 CO 0.60 -0.20 1.31 -1.25 -0.10 0.00 0.00 175.22 175.58 1m70 s PRO 30 N 1.63 4.29 0.24 0.24 0.04 -1.26 -4.81 135.00 135.37 1m70 s PRO 30 Ca 0.07 2.22 -0.30 0.00 0.04 0.00 0.00 61.00 63.02 1m70 s PRO 30 Cb -0.15 -3.02 -0.09 0.00 0.04 0.00 0.00 34.50 31.27 1m70 s PRO 30 CO 0.08 -0.24 1.34 0.15 0.04 0.00 0.00 177.00 178.37 1m70 s LYS 31 N -1.87 4.35 -0.02 4.56 1.02 -1.26 -4.93 119.74 121.59 1m70 s LYS 31 Ca 0.50 2.15 0.15 0.00 0.02 0.00 0.00 55.97 58.79 1m70 s LYS 31 Cb -0.40 -3.15 -0.23 0.00 -0.52 0.00 0.00 37.83 33.54 1m70 s LYS 31 CO 0.53 -0.28 0.32 1.28 -0.92 0.00 0.00 175.35 176.28 1m70 n LEU 32 N 2.20 0.00 -4.69 3.17 4.77 -0.10 -4.90 117.00 117.45 1m70 n LEU 32 Ca 0.05 0.00 -0.42 0.00 -0.03 0.00 0.00 56.01 55.61 1m70 n LEU 32 Cb 0.42 0.01 -0.03 0.00 -2.33 0.00 0.00 43.42 41.49 1m70 n LEU 32 CO 0.59 0.01 1.51 0.00 -1.33 0.00 0.00 177.39 178.16 1m70 s ALA 33 N -3.02 3.75 0.00 -1.18 0.00 -0.51 -2.04 121.76 118.76 1m70 s ALA 33 Ca -0.06 1.46 0.00 0.00 0.00 0.00 0.00 51.96 53.36 1m70 s ALA 33 Cb 0.09 -3.78 0.00 0.00 0.00 0.00 0.00 23.12 19.43 1m70 s ALA 33 CO 0.62 -1.29 0.00 0.41 0.00 0.00 0.00 175.76 175.50 1m70 n GLY 34 N 4.30 0.86 3.75 0.00 0.00 -0.52 -3.64 105.19 109.95 1m70 n GLY 34 Ca 0.18 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.87 1m70 n GLY 34 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1m70 s GLN 35 N -0.14 2.48 0.34 1.61 2.00 -0.86 -4.90 119.66 120.19 1m70 s GLN 35 Ca 0.00 1.46 -0.29 0.00 -2.00 0.00 0.00 55.36 54.54 1m70 s GLN 35 Cb 0.00 -1.90 -0.11 0.00 0.80 0.00 0.00 33.01 31.80 1m70 s GLN 35 CO 0.00 -1.51 1.43 0.20 -0.50 0.00 0.00 175.29 174.91 1m70 s GLY 36 N -2.55 2.85 0.17 2.59 0.00 -1.26 -4.15 107.32 104.97 1m70 s GLY 36 Ca 0.68 1.45 -0.14 0.00 0.00 0.00 0.00 44.72 46.71 1m70 s GLY 36 CO 0.45 2.16 1.80 -2.09 0.00 0.00 0.00 173.10 175.42 1m70 h GLU 37 N 3.43 0.70 -0.56 2.90 4.81 -1.93 -0.65 114.58 123.28 1m70 h GLU 37 Ca -0.50 -0.07 0.00 0.00 -0.13 0.00 0.00 59.36 58.67 1m70 h GLU 37 Cb 1.23 -0.15 -0.03 0.00 0.63 0.00 0.00 28.75 30.44 1m70 h GLU 37 CO 0.67 0.51 0.36 -0.09 -0.73 0.00 0.00 179.01 179.73 1m70 h ARG 38 N 0.69 0.75 -0.21 1.92 2.43 -1.91 0.23 114.38 118.28 1m70 h ARG 38 Ca 0.19 -0.05 -0.02 0.00 -0.81 0.00 0.00 59.98 59.28 1m70 h ARG 38 Cb -0.01 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 29.37 1m70 h ARG 38 CO -0.03 0.52 0.06 -0.92 -1.51 0.00 0.00 179.97 178.08 1m70 h TYR 39 N 0.76 0.34 -0.60 2.20 3.20 -1.79 -1.46 116.97 119.62 1m70 h TYR 39 Ca 0.20 -0.04 0.06 0.00 3.14 0.00 0.00 58.73 62.10 1m70 h TYR 39 Cb -0.06 -0.10 -0.05 0.00 1.54 0.00 0.00 36.73 38.06 1m70 h TYR 39 CO -0.03 0.42 0.32 -0.07 -1.64 0.00 0.00 178.16 177.16 1m70 h LEU 40 N 0.17 0.46 -0.39 2.82 3.38 -0.86 -0.50 115.31 120.39 1m70 h LEU 40 Ca 0.07 0.03 -0.01 0.00 0.09 0.00 0.00 57.88 58.06 1m70 h LEU 40 Cb 0.24 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 40.92 1m70 h LEU 40 CO -0.00 0.30 0.20 0.25 0.09 0.00 0.00 178.44 179.28 1m70 h LEU 41 N 0.60 0.49 -0.62 1.67 5.85 -0.77 0.44 115.31 122.96 1m70 h LEU 41 Ca 0.27 -0.10 0.03 0.00 0.84 0.00 0.00 57.88 58.92 1m70 h LEU 41 Cb 0.18 -0.12 -0.04 0.00 0.37 0.00 0.00 40.66 41.05 1m70 h LEU 41 CO -0.18 0.45 0.38 0.50 -0.34 0.00 0.00 178.44 179.25 1m70 h LYS 42 N 0.49 0.72 -0.61 1.25 3.64 -0.96 -0.19 116.57 120.91 1m70 h LYS 42 Ca 0.13 -0.04 -0.08 0.00 -1.27 0.00 0.00 60.65 59.39 1m70 h LYS 42 Cb 0.08 -0.16 -0.02 0.00 -0.41 0.00 0.00 32.23 31.71 1m70 h LYS 42 CO -0.02 0.48 0.07 1.96 -2.27 0.00 0.00 179.45 179.66 1m70 h GLN 43 N 0.74 1.03 -0.42 1.90 1.08 -0.69 -0.25 115.11 118.50 1m70 h GLN 43 Ca 0.25 -0.29 0.02 0.00 -1.45 0.00 0.00 58.65 57.18 1m70 h GLN 43 Cb 0.04 -0.11 -0.03 0.00 -0.05 0.00 0.00 27.48 27.33 1m70 h GLN 43 CO -0.11 0.98 0.25 -0.07 -0.95 0.00 0.00 178.83 178.93 1m70 h LEU 44 N 0.93 0.40 -0.59 1.46 3.38 -0.50 0.27 115.31 120.66 1m70 h LEU 44 Ca 0.18 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.16 1m70 h LEU 44 Cb 0.47 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 41.11 1m70 h LEU 44 CO 0.02 0.29 0.38 1.56 0.09 0.00 0.00 178.44 180.78 1m70 h GLN 45 N 0.50 0.78 -0.38 1.13 4.20 -0.78 -0.22 115.11 120.33 1m70 h GLN 45 Ca 0.17 -0.05 -0.12 0.00 0.06 0.00 0.00 58.65 58.71 1m70 h GLN 45 Cb 0.01 -0.17 -0.01 0.00 0.30 0.00 0.00 27.48 27.61 1m70 h GLN 45 CO -0.08 0.53 -0.22 -0.44 -0.67 0.00 0.00 178.83 177.95 1m70 h ASP 46 N 0.80 0.85 -0.40 1.46 3.32 -0.69 -1.71 116.42 120.05 1m70 h ASP 46 Ca 0.21 -0.42 -0.04 0.00 0.02 0.00 0.00 57.03 56.80 1m70 h ASP 46 Cb -0.07 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.22 1m70 h ASP 46 CO -0.04 1.09 0.08 0.40 -1.72 0.00 0.00 179.24 179.04 1m70 h ILE 47 N 0.62 1.24 -0.16 0.35 2.04 -0.36 0.30 117.51 121.55 1m70 h ILE 47 Ca 0.08 -0.84 0.02 0.00 1.00 0.00 0.00 64.86 65.12 1m70 h ILE 47 Cb 0.78 1.02 -0.02 0.00 -0.74 0.00 0.00 36.82 37.86 1m70 h ILE 47 CO 0.06 0.29 0.04 0.50 0.00 0.00 0.00 178.15 179.05 1m70 h LYS 48 N 0.51 0.11 -0.47 2.37 3.64 -0.93 0.06 116.57 121.87 1m70 h LYS 48 Ca 0.12 -0.01 -0.08 0.00 -1.27 0.00 0.00 60.65 59.41 1m70 h LYS 48 Cb 0.35 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 32.12 1m70 h LYS 48 CO 0.01 0.07 -0.05 0.00 -2.27 0.00 0.00 179.45 177.21 1m70 h ALA 49 N 1.10 1.05 0.00 5.00 0.00 -1.12 -3.05 119.26 122.25 1m70 h ALA 49 Ca 0.07 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.69 1m70 h ALA 49 Cb 0.05 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.65 1m70 h ALA 49 CO -0.08 0.59 -0.50 0.78 0.00 0.00 0.00 179.25 180.04 1m70 h GLY 50 N 0.98 0.00 -1.33 0.00 0.00 -0.78 -3.35 103.07 98.58 1m70 h GLY 50 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.47 1m70 h GLY 50 CO 0.03 0.00 0.00 1.44 0.00 0.00 0.00 176.54 178.01 1m70 n SER 51 N -2.39 2.94 -4.81 0.19 7.64 -0.01 -4.30 113.62 112.88 1m70 n SER 51 Ca 0.03 -1.98 -0.35 0.00 1.01 0.00 0.00 58.87 57.58 1m70 n SER 51 Cb 0.47 -0.23 -0.06 0.00 -1.01 0.00 0.00 64.21 63.37 1m70 n SER 51 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 1m70 s THR 52 N -1.00 4.46 0.35 0.44 -1.32 -1.16 -1.54 115.64 115.88 1m70 s THR 52 Ca 0.24 1.41 -0.28 0.00 -1.21 0.00 0.00 61.69 61.84 1m70 s THR 52 Cb 0.13 -3.83 -0.12 0.00 -1.51 0.00 0.00 72.50 67.17 1m70 s THR 52 CO 0.17 0.05 1.46 -2.65 -2.21 0.00 0.00 174.62 171.44 1m70 n PRO 53 N 0.32 2.53 -0.94 7.08 -0.02 -1.26 -2.02 135.00 140.68 1m70 n PRO 53 Ca 0.01 0.89 0.00 0.00 -2.02 0.00 0.00 63.50 62.38 1m70 n PRO 53 Cb 0.51 -2.59 0.00 0.00 -0.02 0.00 0.00 33.50 31.40 1m70 n PRO 53 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1m70 n GLY 54 N 0.89 0.60 3.61 -1.23 0.00 -1.26 -5.00 105.19 102.80 1m70 n GLY 54 Ca 0.04 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.61 1m70 n GLY 54 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1m70 n ALA 55 N 1.00 0.08 -1.75 4.61 0.00 -0.86 -4.90 120.51 118.69 1m70 n ALA 55 Ca 0.00 0.40 -0.38 0.00 0.00 0.00 0.00 53.44 53.46 1m70 n ALA 55 Cb 0.05 -2.08 0.03 0.00 0.00 0.00 0.00 19.45 17.45 1m70 n ALA 55 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 1m70 s PRO 56 N -1.33 3.26 0.20 0.00 0.02 -1.26 -4.89 135.00 131.00 1m70 s PRO 56 Ca 0.61 2.14 -0.31 0.00 0.02 0.00 0.00 61.00 63.47 1m70 s PRO 56 Cb -0.69 -2.29 -0.10 0.00 0.02 0.00 0.00 34.50 31.44 1m70 s PRO 56 CO 0.58 -1.06 1.44 -2.00 -0.33 0.00 0.00 177.00 175.63 1m70 s GLU 57 N -2.87 4.28 0.00 5.54 2.12 -1.26 -2.61 118.70 123.91 1m70 s GLU 57 Ca 0.70 2.24 0.00 0.00 0.36 0.00 0.00 54.97 58.27 1m70 s GLU 57 Cb -0.38 -3.15 0.00 0.00 0.26 0.00 0.00 34.13 30.86 1m70 s GLU 57 CO 0.45 -0.44 0.00 0.41 -0.54 0.00 0.00 175.26 175.14 1m70 n GLY 58 N 2.79 0.72 3.81 -1.50 0.00 -1.26 -5.05 105.19 104.70 1m70 n GLY 58 Ca 0.09 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.75 1m70 n GLY 58 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1m70 s VAL 59 N -2.78 4.56 0.00 1.61 1.01 -1.07 -4.94 120.40 118.78 1m70 s VAL 59 Ca 0.00 1.29 0.00 0.00 0.00 0.00 0.00 61.98 63.27 1m70 s VAL 59 Cb 0.00 -3.86 0.00 0.00 0.00 0.00 0.00 36.38 32.52 1m70 s VAL 59 CO 0.00 0.21 0.00 0.61 0.00 0.00 0.00 175.10 175.92 1m70 n GLY 60 N 0.73 2.44 2.86 4.51 0.00 -1.26 -4.05 105.19 110.42 1m70 n GLY 60 Ca -0.02 -0.42 -0.27 0.00 0.00 0.00 0.00 46.02 45.31 1m70 n GLY 60 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1m70 s ARG 61 N 0.00 1.23 -0.42 1.61 3.52 -0.23 -4.26 118.95 120.40 1m70 s ARG 61 Ca 0.00 -0.41 -0.19 0.00 -0.13 0.00 0.00 55.73 55.00 1m70 s ARG 61 Cb 0.00 -1.86 0.02 0.00 -1.56 0.00 0.00 34.95 31.55 1m70 s ARG 61 CO 0.00 -0.43 0.54 0.21 -0.81 0.00 0.00 175.30 174.81 1m70 s LYS 62 N 1.71 3.28 -0.37 5.12 2.20 -1.26 -3.81 119.74 126.61 1m70 s LYS 62 Ca 0.01 -0.47 -0.06 0.00 -0.36 0.00 0.00 55.97 55.09 1m70 s LYS 62 Cb -0.15 -3.93 0.07 0.00 -1.51 0.00 0.00 37.83 32.31 1m70 s LYS 62 CO -0.07 -0.88 0.16 0.08 -0.36 0.00 0.00 175.35 174.28 1m70 s VAL 63 N 2.49 3.74 0.36 4.02 1.01 -1.26 -4.97 120.40 125.78 1m70 s VAL 63 Ca 0.18 -1.43 0.06 0.00 0.00 0.00 0.00 61.98 60.78 1m70 s VAL 63 Cb -0.15 -3.26 0.29 0.00 0.00 0.00 0.00 36.38 33.25 1m70 s VAL 63 CO 0.16 -0.38 1.96 -0.07 0.00 0.00 0.00 175.10 176.77 1m70 h LEU 64 N 8.22 0.67 0.00 3.92 3.38 -1.97 -0.74 115.31 128.79 1m70 h LEU 64 Ca -0.21 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.76 1m70 h LEU 64 Cb 1.07 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.68 1m70 h LEU 64 CO 0.66 0.44 0.00 -0.62 0.09 0.00 0.00 178.44 179.01 1m70 n GLU 65 N -4.48 0.28 -0.42 1.13 4.71 -1.26 -3.00 120.64 117.61 1m70 n GLU 65 Ca 0.10 0.10 0.05 0.00 -0.01 0.00 0.00 57.16 57.40 1m70 n GLU 65 Cb 0.22 -1.50 0.07 0.00 -1.01 0.00 0.00 31.44 29.22 1m70 n GLU 65 CO 0.00 0.00 0.00 -1.33 0.09 0.00 0.00 177.13 175.89 1m70 n MET 66 N -1.28 0.61 -1.66 3.49 2.81 -0.31 -5.04 117.12 115.73 1m70 n MET 66 Ca 0.09 -1.85 -0.50 0.00 -1.81 0.00 0.00 57.70 53.63 1m70 n MET 66 Cb 0.16 -0.93 -0.05 0.00 -0.71 0.00 0.00 33.22 31.69 1m70 n MET 66 CO 0.00 0.00 0.00 2.41 1.51 0.00 0.00 175.97 179.89 1m70 n THR 67 N -0.60 0.24 -0.06 2.03 -1.04 -1.05 -1.81 114.28 111.99 1m70 n THR 67 Ca 0.08 -0.04 0.00 0.00 -2.04 0.00 0.00 64.05 62.05 1m70 n THR 67 Cb 0.71 -1.44 0.00 0.00 -1.82 0.00 0.00 70.33 67.78 1m70 n THR 67 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1m70 n GLY 68 N 3.68 2.11 0.27 3.41 0.00 -0.59 -4.86 105.19 109.21 1m70 n GLY 68 Ca 0.21 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.16 1m70 n GLY 68 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 1m70 h MET 69 N 1.53 0.76 -0.00 1.61 -1.53 -1.66 -2.70 114.93 112.93 1m70 h MET 69 Ca 0.00 -0.27 0.00 0.00 -3.44 0.00 0.00 59.70 55.99 1m70 h MET 69 Cb 0.00 -0.05 0.00 0.00 -0.55 0.00 0.00 31.60 31.00 1m70 h MET 69 CO 0.00 0.87 -0.20 1.28 0.14 0.00 0.00 176.91 179.00 1m70 n LEU 70 N -4.15 0.39 -0.33 3.39 4.77 -1.26 -4.37 117.00 115.44 1m70 n LEU 70 Ca 0.01 0.11 0.09 0.00 -0.03 0.00 0.00 56.01 56.19 1m70 n LEU 70 Cb 0.39 -0.28 0.28 0.00 -2.33 0.00 0.00 43.42 41.48 1m70 n LEU 70 CO 0.43 0.08 1.23 0.44 -1.33 0.00 0.00 177.39 178.25 1m70 h ASP 71 N 0.31 0.84 -0.13 -1.43 3.32 -1.82 -1.35 116.42 116.16 1m70 h ASP 71 Ca 0.00 0.05 0.00 0.00 0.02 0.00 0.00 57.03 57.10 1m70 h ASP 71 Cb 0.44 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 39.87 1m70 h ASP 71 CO 0.00 0.44 0.00 -0.81 -1.72 0.00 0.00 179.24 177.15 1m70 n PRO 72 N -4.60 1.41 -3.55 3.56 -0.05 -1.26 -4.84 135.00 125.66 1m70 n PRO 72 Ca 0.18 -0.62 -0.37 0.00 -0.05 0.00 0.00 63.50 62.64 1m70 n PRO 72 Cb 0.39 -1.26 -0.06 0.00 -0.05 0.00 0.00 33.50 32.51 1m70 n PRO 72 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 175.50 174.94 1m70 s LEU 73 N -1.34 4.36 0.83 1.53 1.43 -0.51 -5.08 118.68 119.90 1m70 s LEU 73 Ca 0.23 0.71 -0.12 0.00 -1.03 0.00 0.00 54.13 53.92 1m70 s LEU 73 Cb 0.12 -2.44 0.09 0.00 0.03 0.00 0.00 46.19 43.98 1m70 s LEU 73 CO 0.18 0.22 1.13 -0.94 0.23 0.00 0.00 176.35 177.17 1m70 s SER 74 N -0.32 4.23 0.24 2.29 1.04 -1.26 -4.85 113.70 115.06 1m70 s SER 74 Ca 0.20 1.05 -0.06 0.00 0.48 0.00 0.00 55.95 57.61 1m70 s SER 74 Cb -0.14 -1.68 0.29 0.00 0.10 0.00 0.00 66.02 64.59 1m70 s SER 74 CO 0.08 -2.11 1.87 0.44 0.98 0.00 0.00 173.24 174.51 1m70 h ASP 75 N -1.19 0.92 -0.83 7.02 3.32 -1.98 -1.06 116.42 122.62 1m70 h ASP 75 Ca -0.48 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 56.56 1m70 h ASP 75 Cb 1.30 -0.20 -0.04 0.00 0.22 0.00 0.00 39.33 40.62 1m70 h ASP 75 CO 0.62 0.62 0.48 -0.61 -1.72 0.00 0.00 179.24 178.63 1m70 h GLN 76 N 1.07 1.16 -0.52 3.56 5.75 -1.99 -1.70 115.11 122.44 1m70 h GLN 76 Ca 0.36 -0.12 0.03 0.00 -0.15 0.00 0.00 58.65 58.77 1m70 h GLN 76 Cb 0.06 -0.23 -0.04 0.00 1.07 0.00 0.00 27.48 28.34 1m70 h GLN 76 CO -0.13 0.83 0.30 -0.44 -2.65 0.00 0.00 178.83 176.74 1m70 h ASP 77 N 1.17 0.48 -0.72 -0.69 3.32 -1.66 -0.01 116.42 118.31 1m70 h ASP 77 Ca 0.30 0.01 -0.05 0.00 0.02 0.00 0.00 57.03 57.31 1m70 h ASP 77 Cb -0.00 -0.09 -0.03 0.00 0.22 0.00 0.00 39.33 39.43 1m70 h ASP 77 CO -0.05 0.33 0.27 -0.07 -1.72 0.00 0.00 179.24 178.00 1m70 h LEU 78 N 0.60 1.01 -0.66 1.55 3.38 -0.77 -1.18 115.31 119.23 1m70 h LEU 78 Ca 0.21 -0.18 0.02 0.00 0.09 0.00 0.00 57.88 58.02 1m70 h LEU 78 Cb 0.05 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.50 1m70 h LEU 78 CO -0.11 0.92 0.42 -0.33 0.09 0.00 0.00 178.44 179.44 1m70 h GLU 79 N 1.04 0.81 -0.75 1.13 5.08 -0.72 0.21 114.58 121.38 1m70 h GLU 79 Ca 0.24 -0.05 -0.02 0.00 -1.00 0.00 0.00 59.36 58.53 1m70 h GLU 79 Cb 0.24 -0.18 -0.04 0.00 0.50 0.00 0.00 28.75 29.27 1m70 h GLU 79 CO -0.02 0.54 0.40 -0.44 -1.00 0.00 0.00 179.01 178.49 1m70 h ASP 80 N 0.84 0.96 -0.52 1.42 3.32 -0.61 0.14 116.42 121.96 1m70 h ASP 80 Ca 0.26 -0.11 -0.03 0.00 0.02 0.00 0.00 57.03 57.17 1m70 h ASP 80 Cb -0.02 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.26 1m70 h ASP 80 CO -0.09 0.79 0.20 0.40 -1.72 0.00 0.00 179.24 178.83 1m70 h ILE 81 N 1.05 1.22 -0.43 0.35 2.04 -0.87 -0.45 117.51 120.41 1m70 h ILE 81 Ca 0.26 -0.68 0.02 0.00 1.00 0.00 0.00 64.86 65.46 1m70 h ILE 81 Cb 0.06 0.69 -0.03 0.00 -0.74 0.00 0.00 36.82 36.81 1m70 h ILE 81 CO -0.04 0.26 0.26 0.00 0.00 0.00 0.00 178.15 178.63 1m70 h ALA 82 N 1.05 0.54 -0.55 1.87 0.00 -0.65 -1.41 119.26 120.12 1m70 h ALA 82 Ca 0.17 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1m70 h ALA 82 Cb 0.20 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.84 1m70 h ALA 82 CO -0.01 -0.06 0.35 0.00 0.00 0.00 0.00 179.25 179.53 1m70 h ALA 83 N 1.18 0.70 0.40 0.00 0.00 -0.73 -0.86 119.26 119.96 1m70 h ALA 83 Ca 0.17 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 1m70 h ALA 83 Cb -0.00 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 1m70 h ALA 83 CO -0.07 0.16 -0.31 -0.92 0.00 0.00 0.00 179.25 178.11 1m70 h TYR 84 N 0.74 -0.83 -0.39 0.00 3.20 -0.62 -1.87 116.97 117.20 1m70 h TYR 84 Ca 0.20 -0.00 -0.08 0.00 3.14 0.00 0.00 58.73 61.99 1m70 h TYR 84 Cb -0.05 0.31 -0.02 0.00 1.54 0.00 0.00 36.73 38.51 1m70 h TYR 84 CO -0.03 -0.46 -0.09 0.74 -1.64 0.00 0.00 178.16 176.68 1m70 h PHE 85 N -0.71 0.73 0.00 -3.82 0.04 -1.20 -2.46 116.94 109.52 1m70 h PHE 85 Ca -0.04 -0.12 -0.03 0.00 2.80 0.00 0.00 57.97 60.59 1m70 h PHE 85 Cb 0.61 -0.19 -0.00 0.00 2.20 0.00 0.00 35.95 38.56 1m70 h PHE 85 CO -0.15 0.74 -0.14 1.03 -0.60 0.00 0.00 178.31 179.20 1m70 h SER 86 N 0.62 0.00 1.00 2.17 0.87 -1.04 -1.14 113.55 116.04 1m70 h SER 86 Ca 0.11 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.67 1m70 h SER 86 Cb 0.52 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.48 1m70 h SER 86 CO 0.03 0.14 0.00 -1.54 -0.53 0.00 0.00 176.83 174.93 1m70 n SER 87 N -4.32 0.65 -4.89 6.23 3.41 -0.72 -3.84 113.62 110.14 1m70 n SER 87 Ca -0.03 0.61 -0.30 0.00 -0.26 0.00 0.00 58.87 58.90 1m70 n SER 87 Cb 0.21 -0.77 0.04 0.00 -0.26 0.00 0.00 64.21 63.43 1m70 n SER 87 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 1m70 s GLN 88 N -3.20 2.99 -0.26 4.33 -1.52 -0.70 -4.92 119.66 116.38 1m70 s GLN 88 Ca 0.07 0.45 -0.14 0.00 -1.95 0.00 0.00 55.36 53.80 1m70 s GLN 88 Cb 0.11 -2.06 -0.04 0.00 -0.22 0.00 0.00 33.01 30.80 1m70 s GLN 88 CO 0.47 -0.92 0.33 0.21 -0.25 0.00 0.00 175.29 175.13 1m70 s LYS 89 N -5.28 4.03 0.90 2.91 2.20 -1.26 -2.06 119.74 121.17 1m70 s LYS 89 Ca 0.57 -0.02 -0.11 0.00 -0.36 0.00 0.00 55.97 56.05 1m70 s LYS 89 Cb -0.11 -3.64 0.13 0.00 -1.51 0.00 0.00 37.83 32.71 1m70 s LYS 89 CO 0.51 -0.21 1.10 0.20 -0.36 0.00 0.00 175.35 176.59 1m70 s GLY 90 N 1.55 1.65 0.24 5.54 0.00 -1.24 -4.74 107.32 110.33 1m70 s GLY 90 Ca 0.14 0.23 0.08 0.00 0.00 0.00 0.00 44.72 45.17 1m70 s GLY 90 CO 0.09 0.69 -0.12 -1.35 0.00 0.00 0.00 173.10 172.41 1m70 s SER 91 N -3.06 2.80 0.02 1.64 1.04 -1.26 -5.04 113.70 109.83 1m70 s SER 91 Ca 0.64 -1.08 0.06 0.00 0.48 0.00 0.00 55.95 56.05 1m70 s SER 91 Cb -0.20 -0.17 -0.03 0.00 0.10 0.00 0.00 66.02 65.71 1m70 s SER 91 CO 0.58 -0.20 -0.15 -0.69 0.98 0.00 0.00 173.24 173.76 1m70 s VAL 92 N -2.92 3.01 0.00 5.02 1.01 -1.26 -4.51 120.40 120.75 1m70 s VAL 92 Ca 0.26 -1.01 0.00 0.00 0.00 0.00 0.00 61.98 61.23 1m70 s VAL 92 Cb 0.00 -2.26 0.00 0.00 0.00 0.00 0.00 36.38 34.12 1m70 s VAL 92 CO 0.10 0.40 0.00 0.61 0.00 0.00 0.00 175.10 176.21 1m70 n GLY 93 N 1.70 6.61 3.73 4.51 0.00 -0.42 -5.03 105.19 116.30 1m70 n GLY 93 Ca -0.16 -2.01 -0.38 0.00 0.00 0.00 0.00 46.02 43.46 1m70 n GLY 93 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1m70 s TYR 94 N 1.26 3.55 -0.39 1.61 5.04 -1.26 -3.89 117.35 123.27 1m70 s TYR 94 Ca 0.00 0.95 -0.02 0.00 -2.44 0.00 0.00 57.07 55.55 1m70 s TYR 94 Cb 0.00 -2.55 0.10 0.00 0.35 0.00 0.00 41.96 39.86 1m70 s TYR 94 CO 0.00 0.22 0.17 0.00 -1.34 0.00 0.00 175.55 174.60 1m70 s ALA 95 N 0.43 3.10 -0.11 3.97 0.00 -1.26 -4.25 121.76 123.64 1m70 s ALA 95 Ca 0.27 -2.44 -0.29 0.00 0.00 0.00 0.00 51.96 49.49 1m70 s ALA 95 Cb -0.16 -2.34 -0.06 0.00 0.00 0.00 0.00 23.12 20.57 1m70 s ALA 95 CO 0.12 -1.73 1.93 0.34 0.00 0.00 0.00 175.76 176.41 1m70 s ASP 96 N 1.70 6.16 0.63 0.00 -1.08 -1.26 -4.87 116.67 117.96 1m70 s ASP 96 Ca 0.07 2.15 0.38 0.00 -0.52 0.00 0.00 52.55 54.63 1m70 s ASP 96 Cb -0.22 -2.53 2.14 0.00 -1.46 0.00 0.00 42.92 40.85 1m70 s ASP 96 CO -0.04 -1.35 2.32 -0.65 0.52 0.00 0.00 175.17 175.96 1m70 h PRO 97 N 11.82 0.00 0.00 4.34 0.11 -1.97 0.10 132.00 146.40 1m70 h PRO 97 Ca -0.42 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.69 1m70 h PRO 97 Cb 1.21 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.32 1m70 h PRO 97 CO 0.96 0.00 -0.00 0.00 -0.21 0.00 0.00 178.00 178.75 1m70 h ALA 98 N 2.00 1.70 0.00 -0.75 0.00 -2.03 -2.66 119.26 117.52 1m70 h ALA 98 Ca -0.00 -0.00 -0.24 0.00 0.00 0.00 0.00 54.91 54.66 1m70 h ALA 98 Cb 0.01 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 17.76 1m70 h ALA 98 CO 0.00 0.00 -1.90 1.28 0.00 0.00 0.00 179.25 178.63 1m70 n LEU 99 N -4.11 2.67 0.19 0.00 4.77 -0.48 -4.76 117.00 115.28 1m70 n LEU 99 Ca -0.03 -0.03 0.07 0.00 -0.03 0.00 0.00 56.01 55.98 1m70 n LEU 99 Cb 0.09 -0.54 0.27 0.00 -2.33 0.00 0.00 43.42 40.91 1m70 n LEU 99 CO 0.30 0.69 0.66 0.00 -1.33 0.00 0.00 177.39 177.72 1m70 h ALA 100 N -0.10 0.89 -0.42 -1.18 0.00 -0.83 -2.02 119.26 115.61 1m70 h ALA 100 Ca -0.36 -0.31 -0.08 0.00 0.00 0.00 0.00 54.91 54.16 1m70 h ALA 100 Cb 1.51 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 19.23 1m70 h ALA 100 CO -0.09 0.43 -0.05 -0.22 0.00 0.00 0.00 179.25 179.32 1m70 h LYS 101 N 0.00 0.77 -0.16 0.00 3.64 -1.70 0.20 116.57 119.31 1m70 h LYS 101 Ca -0.00 -0.27 -0.11 0.00 -1.27 0.00 0.00 60.65 59.00 1m70 h LYS 101 Cb 1.01 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.76 1m70 h LYS 101 CO 0.04 0.87 -0.37 0.37 -2.27 0.00 0.00 179.45 178.09 1m70 h GLN 102 N 0.59 0.36 -0.80 1.90 4.15 -1.80 -2.70 115.11 116.81 1m70 h GLN 102 Ca 0.11 -0.16 0.01 0.00 0.77 0.00 0.00 58.65 59.38 1m70 h GLN 102 Cb 0.55 -0.01 -0.04 0.00 0.21 0.00 0.00 27.48 28.20 1m70 h GLN 102 CO 0.03 0.68 0.53 0.78 -1.93 0.00 0.00 178.83 178.92 1m70 h GLY 103 N 1.14 1.12 1.01 2.39 0.00 -0.97 -1.99 103.07 105.77 1m70 h GLY 103 Ca 0.03 -0.42 -0.00 0.00 0.00 0.00 0.00 47.33 46.94 1m70 h GLY 103 CO 0.06 0.41 0.47 -2.09 0.00 0.00 0.00 176.54 175.39 1m70 h GLU 104 N 1.08 1.04 -0.65 4.80 4.81 -0.40 0.52 114.58 125.79 1m70 h GLU 104 Ca 0.29 -0.09 -0.06 0.00 -0.13 0.00 0.00 59.36 59.37 1m70 h GLU 104 Cb -0.12 -0.22 -0.03 0.00 0.63 0.00 0.00 28.75 29.01 1m70 h GLU 104 CO -0.06 0.73 0.15 0.87 -0.73 0.00 0.00 179.01 179.96 1m70 h LYS 105 N 1.05 1.02 -0.38 1.92 1.57 -1.12 -0.50 116.57 120.13 1m70 h LYS 105 Ca 0.28 -0.24 -0.07 0.00 -1.87 0.00 0.00 60.65 58.75 1m70 h LYS 105 Cb -0.04 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.11 1m70 h LYS 105 CO -0.05 0.91 -0.03 -0.07 -0.57 0.00 0.00 179.45 179.65 1m70 h LEU 106 N 0.97 0.67 -0.85 2.94 3.38 -1.07 -0.16 115.31 121.20 1m70 h LEU 106 Ca 0.20 -0.32 -0.06 0.00 0.09 0.00 0.00 57.88 57.79 1m70 h LEU 106 Cb 0.36 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.90 1m70 h LEU 106 CO 0.00 0.84 0.17 0.15 0.09 0.00 0.00 178.44 179.69 1m70 h PHE 107 N 0.49 1.06 0.00 1.13 3.57 -0.47 0.49 116.94 123.22 1m70 h PHE 107 Ca 0.10 -0.11 -0.19 0.00 3.53 0.00 0.00 57.97 61.31 1m70 h PHE 107 Cb 0.51 -0.31 -0.03 0.00 2.79 0.00 0.00 35.95 38.91 1m70 h PHE 107 CO 0.04 0.87 -1.34 0.00 -2.23 0.00 0.00 178.31 175.65 1m70 h ARG 108 N 0.98 0.00 0.00 1.11 3.08 -1.09 -0.56 114.38 117.89 1m70 h ARG 108 Ca 0.21 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.26 1m70 h ARG 108 Cb 0.33 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.38 1m70 h ARG 108 CO -0.00 0.39 -0.42 0.41 -1.07 0.00 0.00 179.97 179.28 1m70 n GLY 109 N 1.40 0.48 7.00 0.04 0.00 -0.08 -4.79 105.19 109.25 1m70 n GLY 109 Ca -0.09 -0.08 0.00 0.00 0.00 0.00 0.00 46.02 45.85 1m70 n GLY 109 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1m70 n GLY 110 N 1.42 0.05 2.56 -0.02 0.00 0.16 -4.37 105.19 104.98 1m70 n GLY 110 Ca 0.00 -0.97 -0.27 0.00 0.00 0.00 0.00 46.02 44.78 1m70 n GLY 110 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1m70 n LYS 111 N 0.00 0.79 0.23 1.61 5.02 -0.26 -4.65 118.16 120.91 1m70 n LYS 111 Ca 0.00 -3.64 0.10 0.00 -2.02 0.00 0.00 58.31 52.74 1m70 n LYS 111 Cb 0.00 -1.88 0.56 0.00 -0.02 0.00 0.00 35.03 33.69 1m70 n LYS 111 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 1m70 h LEU 112 N 5.50 0.00 -2.17 -0.35 3.38 -1.76 -0.34 115.31 119.56 1m70 h LEU 112 Ca 0.22 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.18 1m70 h LEU 112 Cb 0.85 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.60 1m70 h LEU 112 CO 0.50 0.21 -0.05 -2.24 0.09 0.00 0.00 178.44 176.95 1m70 h ASP 113 N 0.00 0.00 -0.31 -0.43 2.03 -1.94 -1.77 116.42 114.00 1m70 h ASP 113 Ca -0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 1m70 h ASP 113 Cb 0.55 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.05 1m70 h ASP 113 CO 0.03 0.05 0.00 0.00 -1.03 0.00 0.00 179.24 178.29 1m70 n GLN 114 N -3.36 2.23 -0.99 4.15 6.02 -0.26 -4.98 117.38 120.19 1m70 n GLN 114 Ca -0.02 -1.93 0.00 0.00 -0.01 0.00 0.00 57.00 55.05 1m70 n GLN 114 Cb 0.19 -1.32 0.00 0.00 1.02 0.00 0.00 30.24 30.13 1m70 n GLN 114 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1m70 n GLY 115 N 0.80 0.49 3.67 1.08 0.00 -0.67 -5.00 105.19 105.56 1m70 n GLY 115 Ca 0.13 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.75 1m70 n GLY 115 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1m70 s MET 116 N -0.21 4.23 0.80 1.61 0.00 -0.51 -4.96 119.30 120.26 1m70 s MET 116 Ca 0.00 0.54 -0.11 0.00 0.00 0.00 0.00 55.69 56.11 1m70 s MET 116 Cb 0.00 -3.55 0.07 0.00 0.00 0.00 0.00 34.83 31.36 1m70 s MET 116 CO 0.00 -0.14 1.09 -1.25 0.00 0.00 0.00 175.02 174.72 1m70 s PRO 117 N 1.59 2.02 0.84 4.11 0.04 -1.26 -1.10 135.00 141.24 1m70 s PRO 117 Ca 0.27 0.86 -0.11 0.00 0.04 0.00 0.00 61.00 62.07 1m70 s PRO 117 Cb -0.16 -1.89 0.10 0.00 0.04 0.00 0.00 34.50 32.59 1m70 s PRO 117 CO 0.11 -1.72 1.14 0.00 0.04 0.00 0.00 177.00 176.56 1m70 s ALA 118 N -3.02 1.82 -0.21 8.56 0.00 -1.26 -4.34 121.76 123.32 1m70 s ALA 118 Ca 0.61 0.52 0.20 0.00 0.00 0.00 0.00 51.96 53.29 1m70 s ALA 118 Cb -0.16 -3.39 -0.01 0.00 0.00 0.00 0.00 23.12 19.56 1m70 s ALA 118 CO 0.56 -2.30 1.06 0.00 0.00 0.00 0.00 175.76 175.08 1m70 h THR 120 N 0.00 0.57 0.00 0.00 1.35 -1.79 -0.69 112.91 112.34 1m70 h THR 120 Ca -0.06 -0.75 -0.07 0.00 -0.55 0.00 0.00 66.41 64.98 1m70 h THR 120 Cb 1.25 1.50 -0.01 0.00 -1.73 0.00 0.00 68.15 69.15 1m70 h THR 120 CO 0.02 0.16 -0.32 1.23 -0.25 0.00 0.00 175.52 176.37 1m70 h GLY 121 N 1.28 0.00 0.00 5.82 0.00 -1.90 -1.11 103.07 107.15 1m70 h GLY 121 Ca -0.00 0.00 -0.29 0.00 0.00 0.00 0.00 47.33 47.04 1m70 h GLY 121 CO 0.02 0.00 -2.07 0.00 0.00 0.00 0.00 176.54 174.49 1m70 n HIS 123 N -3.14 0.00 0.00 0.00 8.25 -0.28 -4.15 115.22 115.90 1m70 n HIS 123 Ca -0.34 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.12 1m70 n HIS 123 Cb 0.84 -0.04 0.00 0.00 1.12 0.00 0.00 29.99 31.92 1m70 n HIS 123 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1m70 n ALA 124 N 0.09 -0.44 0.18 -1.41 0.00 -0.42 -0.71 120.51 117.80 1m70 n ALA 124 Ca 0.13 0.00 0.17 0.00 0.00 0.00 0.00 53.44 53.74 1m70 n ALA 124 Cb 0.43 -0.44 0.80 0.00 0.00 0.00 0.00 19.45 20.24 1m70 n ALA 124 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1m70 h PRO 125 N 0.00 0.00 -0.42 0.00 0.11 -1.93 -0.85 132.00 128.91 1m70 h PRO 125 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 1m70 h PRO 125 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 1m70 h PRO 125 CO 0.00 0.00 0.00 0.27 -0.21 0.00 0.00 178.00 178.06 1m70 n ASN 126 N -3.88 3.58 -0.05 -2.05 6.94 -1.26 -4.96 115.26 113.59 1m70 n ASN 126 Ca 0.02 -2.31 -0.01 0.00 -0.02 0.00 0.00 54.58 52.27 1m70 n ASN 126 Cb 0.36 -0.39 -0.00 0.00 -2.36 0.00 0.00 39.78 37.39 1m70 n ASN 126 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1m70 n GLY 127 N 0.52 0.43 0.02 4.83 0.00 -0.32 -4.02 105.19 106.65 1m70 n GLY 127 Ca 0.18 -0.10 0.12 0.00 0.00 0.00 0.00 46.02 46.21 1m70 n GLY 127 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1m70 n VAL 128 N -2.77 0.45 -4.11 1.61 0.24 -0.97 -0.67 118.33 112.10 1m70 n VAL 128 Ca -0.01 0.06 0.00 0.00 -2.04 0.00 0.00 64.34 62.35 1m70 n VAL 128 Cb 0.13 -0.72 0.00 0.00 -1.47 0.00 0.00 33.84 31.78 1m70 n VAL 128 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1m70 n GLY 129 N 0.90 -1.30 2.99 7.63 0.00 0.11 -3.92 105.19 111.61 1m70 n GLY 129 Ca 0.05 -1.27 -0.06 0.00 0.00 0.00 0.00 46.02 44.74 1m70 n GLY 129 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1m70 s ASN 130 N -4.00 -0.27 0.29 1.61 3.84 0.12 -4.66 114.94 111.87 1m70 s ASN 130 Ca 0.00 -0.75 0.07 0.00 0.21 0.00 0.00 52.86 52.39 1m70 s ASN 130 Cb 0.00 1.35 0.43 0.00 -0.55 0.00 0.00 41.25 42.48 1m70 s ASN 130 CO 0.00 -0.27 1.67 -0.78 -2.79 0.00 0.00 177.10 174.94 1m70 h ASP 131 N 7.49 0.19 0.87 -4.21 3.58 -1.87 -0.87 116.42 121.59 1m70 h ASP 131 Ca 0.00 -0.09 -0.02 0.00 0.42 0.00 0.00 57.03 57.35 1m70 h ASP 131 Cb 1.13 -0.05 -0.00 0.00 1.72 0.00 0.00 39.33 42.12 1m70 h ASP 131 CO 0.18 0.64 -0.08 -0.07 -2.88 0.00 0.00 179.24 177.03 1m70 h LEU 132 N 0.14 0.00 -0.95 2.28 3.38 -1.96 -2.71 115.31 115.50 1m70 h LEU 132 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1m70 h LEU 132 Cb 0.89 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.64 1m70 h LEU 132 CO 0.07 0.08 -0.19 0.00 0.09 0.00 0.00 178.44 178.49 1m70 n ALA 133 N -2.15 2.93 -0.54 1.53 0.00 -0.51 -4.95 120.51 116.82 1m70 n ALA 133 Ca -0.00 -0.51 0.00 0.00 0.00 0.00 0.00 53.44 52.93 1m70 n ALA 133 Cb 0.32 -1.03 0.00 0.00 0.00 0.00 0.00 19.45 18.74 1m70 n ALA 133 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1m70 n GLY 134 N 1.31 0.74 3.56 0.00 0.00 -0.80 -5.03 105.19 104.96 1m70 n GLY 134 Ca 0.14 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.76 1m70 n GLY 134 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1m70 s PHE 135 N -2.17 3.22 0.57 1.61 0.08 -0.45 -4.93 117.98 115.91 1m70 s PHE 135 Ca 0.00 0.01 -0.19 0.00 0.12 0.00 0.00 56.93 56.88 1m70 s PHE 135 Cb 0.00 -2.55 -0.05 0.00 -0.57 0.00 0.00 43.02 39.86 1m70 s PHE 135 CO 0.00 -0.33 1.13 -1.25 -0.10 0.00 0.00 175.22 174.67 1m70 s PRO 136 N 1.89 3.23 0.22 0.24 0.04 -1.26 -0.71 135.00 138.66 1m70 s PRO 136 Ca 0.10 1.58 -0.30 0.00 0.04 0.00 0.00 61.00 62.42 1m70 s PRO 136 Cb -0.17 -1.99 -0.10 0.00 0.04 0.00 0.00 34.50 32.29 1m70 s PRO 136 CO 0.11 -0.94 1.45 0.21 0.04 0.00 0.00 177.00 177.86 1m70 s LYS 137 N -3.44 4.27 -0.08 4.56 2.20 -1.25 -4.06 119.74 121.94 1m70 s LYS 137 Ca 0.72 2.27 0.05 0.00 -0.36 0.00 0.00 55.97 58.65 1m70 s LYS 137 Cb -0.24 -3.13 -0.08 0.00 -1.51 0.00 0.00 37.83 32.87 1m70 s LYS 137 CO 0.30 -0.44 -0.01 1.28 -0.36 0.00 0.00 175.35 176.12 1m70 n LEU 138 N 2.76 0.86 -4.64 5.43 4.77 0.16 -4.93 117.00 121.41 1m70 n LEU 138 Ca 0.08 -0.01 -0.49 0.00 -0.03 0.00 0.00 56.01 55.56 1m70 n LEU 138 Cb 0.40 0.03 -0.05 0.00 -2.33 0.00 0.00 43.42 41.48 1m70 n LEU 138 CO 0.60 0.32 1.07 0.61 -1.33 0.00 0.00 177.39 178.66 1m70 n GLY 139 N 2.69 0.85 1.98 -0.72 0.00 -0.65 -1.31 105.19 108.04 1m70 n GLY 139 Ca -0.13 0.68 0.00 0.00 0.00 0.00 0.00 46.02 46.56 1m70 n GLY 139 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1m70 n GLY 140 N 3.04 1.71 3.77 -0.02 0.00 -0.13 -4.93 105.19 108.63 1m70 n GLY 140 Ca 0.18 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.84 1m70 n GLY 140 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1m70 s GLN 141 N -0.34 3.34 0.18 1.61 2.00 -0.43 -4.30 119.66 121.73 1m70 s GLN 141 Ca 0.00 1.70 -0.33 0.00 -2.00 0.00 0.00 55.36 54.73 1m70 s GLN 141 Cb 0.00 -2.06 -0.13 0.00 0.80 0.00 0.00 33.01 31.62 1m70 s GLN 141 CO 0.00 -0.88 1.65 0.72 -0.50 0.00 0.00 175.29 176.29 1m70 n HIS 142 N -1.21 2.50 -0.27 1.67 8.25 -1.26 -3.94 115.22 120.96 1m70 n HIS 142 Ca 0.11 0.15 -0.03 0.00 -0.26 0.00 0.00 57.72 57.69 1m70 n HIS 142 Cb 0.50 -2.61 0.08 0.00 1.12 0.00 0.00 29.99 29.08 1m70 n HIS 142 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1m70 h ALA 143 N 6.41 0.96 -0.25 -1.41 0.00 -1.82 -1.59 119.26 121.56 1m70 h ALA 143 Ca -0.44 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 54.36 1m70 h ALA 143 Cb 1.23 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 1m70 h ALA 143 CO 0.92 0.28 -0.16 0.00 0.00 0.00 0.00 179.25 180.29 1m70 h ALA 144 N 1.30 1.26 0.37 0.00 0.00 -1.91 0.17 119.26 120.45 1m70 h ALA 144 Ca 0.29 -0.28 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 1m70 h ALA 144 Cb -0.01 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.66 1m70 h ALA 144 CO -0.10 0.49 -0.18 -0.92 0.00 0.00 0.00 179.25 178.54 1m70 h TYR 145 N 0.39 -0.46 -0.77 0.00 3.20 -1.40 -1.87 116.97 116.06 1m70 h TYR 145 Ca 0.07 -0.01 0.07 0.00 3.14 0.00 0.00 58.73 62.00 1m70 h TYR 145 Cb 0.52 0.15 -0.06 0.00 1.54 0.00 0.00 36.73 38.88 1m70 h TYR 145 CO 0.01 -0.17 0.45 1.15 -1.64 0.00 0.00 178.16 177.97 1m70 h THR 146 N -0.71 0.96 -0.67 1.81 2.02 -1.04 -1.03 112.91 114.25 1m70 h THR 146 Ca -0.05 -0.27 -0.03 0.00 0.77 0.00 0.00 66.41 66.83 1m70 h THR 146 Cb 0.49 0.10 -0.03 0.00 -1.74 0.00 0.00 68.15 66.97 1m70 h THR 146 CO 0.08 0.14 0.31 0.00 0.37 0.00 0.00 175.52 176.43 1m70 h ALA 147 N 1.41 0.87 -0.87 6.16 0.00 -0.96 -1.05 119.26 124.81 1m70 h ALA 147 Ca 0.36 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 55.10 1m70 h ALA 147 Cb 0.26 -0.27 -0.04 0.00 0.00 0.00 0.00 17.79 17.74 1m70 h ALA 147 CO -0.21 0.45 0.47 -0.22 0.00 0.00 0.00 179.25 179.74 1m70 h LYS 148 N 0.94 1.21 -0.32 0.00 3.64 -0.67 -0.92 116.57 120.45 1m70 h LYS 148 Ca 0.23 -0.14 -0.03 0.00 -1.27 0.00 0.00 60.65 59.43 1m70 h LYS 148 Cb 0.14 -0.24 -0.01 0.00 -0.41 0.00 0.00 32.23 31.71 1m70 h LYS 148 CO -0.03 0.89 0.07 1.96 -2.27 0.00 0.00 179.45 180.07 1m70 h GLN 149 N 1.21 0.52 -0.80 1.90 1.08 -0.58 0.11 115.11 118.54 1m70 h GLN 149 Ca 0.30 -0.13 -0.03 0.00 -1.45 0.00 0.00 58.65 57.35 1m70 h GLN 149 Cb 0.03 -0.07 -0.04 0.00 -0.05 0.00 0.00 27.48 27.36 1m70 h GLN 149 CO -0.05 0.59 0.40 -0.07 -0.95 0.00 0.00 178.83 178.75 1m70 h LEU 150 N 0.36 1.03 -0.51 1.46 3.38 -1.04 0.14 115.31 120.13 1m70 h LEU 150 Ca 0.10 -0.12 -0.04 0.00 0.09 0.00 0.00 57.88 57.90 1m70 h LEU 150 Cb 0.31 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.78 1m70 h LEU 150 CO 0.00 0.86 0.14 0.74 0.09 0.00 0.00 178.44 180.28 1m70 h THR 151 N 1.13 1.24 -0.37 0.22 2.02 -1.04 -0.86 112.91 115.25 1m70 h THR 151 Ca 0.28 -0.81 -0.12 0.00 0.77 0.00 0.00 66.41 66.53 1m70 h THR 151 Cb 0.09 0.80 -0.01 0.00 -1.74 0.00 0.00 68.15 67.29 1m70 h THR 151 CO -0.04 0.30 -0.25 0.44 0.37 0.00 0.00 175.52 176.33 1m70 h ASP 152 N 0.70 0.78 -0.43 4.18 3.32 -0.28 -0.25 116.42 124.43 1m70 h ASP 152 Ca 0.16 -0.29 -0.06 0.00 0.02 0.00 0.00 57.03 56.86 1m70 h ASP 152 Cb 0.30 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.62 1m70 h ASP 152 CO -0.00 1.00 0.05 -0.26 -1.72 0.00 0.00 179.24 178.30 1m70 h PHE 153 N 0.65 0.78 -0.92 4.55 0.04 -0.57 0.54 116.94 122.02 1m70 h PHE 153 Ca 0.08 -0.12 0.04 0.00 2.80 0.00 0.00 57.97 60.78 1m70 h PHE 153 Cb 0.77 -0.21 -0.06 0.00 2.20 0.00 0.00 35.95 38.65 1m70 h PHE 153 CO 0.04 0.75 0.59 -0.09 -0.60 0.00 0.00 178.31 179.01 1m70 h ARG 154 N 0.58 1.11 -0.02 1.51 2.43 -0.72 -2.99 114.38 116.29 1m70 h ARG 154 Ca 0.13 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 59.23 1m70 h ARG 154 Cb 0.41 -0.25 0.00 0.00 -0.42 0.00 0.00 29.97 29.71 1m70 h ARG 154 CO 0.01 0.73 -0.08 0.39 -1.51 0.00 0.00 179.97 179.52 1m70 n GLU 155 N -4.51 1.58 -1.02 0.20 -0.58 -0.14 -4.76 120.64 111.39 1m70 n GLU 155 Ca 0.12 -1.02 -0.01 0.00 -0.42 0.00 0.00 57.16 55.83 1m70 n GLU 155 Cb 0.11 -1.48 -0.00 0.00 -0.57 0.00 0.00 31.44 29.49 1m70 n GLU 155 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1m70 n GLY 156 N 1.25 0.48 0.14 0.62 0.00 -0.56 -4.93 105.19 102.20 1m70 n GLY 156 Ca 0.16 -0.52 0.04 0.00 0.00 0.00 0.00 46.02 45.71 1m70 n GLY 156 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1m70 h ASN 157 N 0.00 0.00 -3.31 1.61 -0.26 -1.22 -3.43 115.58 108.96 1m70 h ASN 157 Ca -0.02 0.00 -0.67 0.00 -0.56 0.00 0.00 56.30 55.05 1m70 h ASN 157 Cb 0.09 0.00 -0.34 0.00 -1.06 0.00 0.00 38.32 37.02 1m70 h ASN 157 CO 0.03 0.40 -0.81 -0.60 -1.06 0.00 0.00 177.43 175.38 1m70 s ARG 158 N -3.02 2.90 -0.04 0.81 3.52 -0.96 -4.87 118.95 117.28 1m70 s ARG 158 Ca 0.03 -0.91 0.06 0.00 -0.13 0.00 0.00 55.73 54.78 1m70 s ARG 158 Cb 0.07 -2.76 0.09 0.00 -1.56 0.00 0.00 34.95 30.79 1m70 s ARG 158 CO 0.75 -0.30 0.95 0.25 -0.81 0.00 0.00 175.30 176.14 1m70 n THR 159 N 4.63 0.71 0.12 4.11 -2.24 -1.26 -4.43 114.28 115.91 1m70 n THR 159 Ca -0.19 -0.82 -0.04 0.00 -2.27 0.00 0.00 64.05 60.74 1m70 n THR 159 Cb 0.48 0.37 0.12 0.00 -2.10 0.00 0.00 70.33 69.21 1m70 n THR 159 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 1m70 n ASN 160 N -0.50 3.17 -0.95 3.42 6.94 -1.26 -3.15 115.26 122.92 1m70 n ASN 160 Ca 0.05 -2.54 0.08 0.00 -0.02 0.00 0.00 54.58 52.15 1m70 n ASN 160 Cb 0.58 -0.61 0.23 0.00 -2.36 0.00 0.00 39.78 37.62 1m70 n ASN 160 CO 0.00 0.00 0.00 -0.90 -1.03 0.00 0.00 177.26 175.33 1m70 n ASP 161 N 0.03 2.76 0.31 0.53 5.75 -1.26 -4.67 116.55 120.00 1m70 n ASP 161 Ca 0.19 -2.00 0.21 0.00 -0.01 0.00 0.00 54.79 53.17 1m70 n ASP 161 Cb 0.83 -0.34 1.05 0.00 -1.03 0.00 0.00 41.12 41.62 1m70 n ASP 161 CO 0.00 0.00 0.00 1.23 -0.11 0.00 0.00 177.20 178.32 1m70 h GLY 162 N 4.87 0.00 2.00 6.12 0.00 -1.96 0.23 103.07 114.34 1m70 h GLY 162 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.30 1m70 h GLY 162 CO 0.00 0.00 -0.13 -0.55 0.00 0.00 0.00 176.54 175.86 1m70 h ASP 163 N 0.00 0.00 0.00 0.19 3.32 -1.92 -3.34 116.42 114.67 1m70 h ASP 163 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1m70 h ASP 163 Cb 0.12 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.67 1m70 h ASP 163 CO 0.00 0.13 -0.95 0.35 -1.72 0.00 0.00 179.24 177.04 1m70 n THR 164 N -3.31 0.00 -1.65 0.35 -2.24 -0.45 -5.04 114.28 101.95 1m70 n THR 164 Ca -0.00 0.00 -0.20 0.00 -2.27 0.00 0.00 64.05 61.58 1m70 n THR 164 Cb 0.35 -0.82 -0.08 0.00 -2.10 0.00 0.00 70.33 67.69 1m70 n THR 164 CO 0.00 0.00 0.00 0.23 -0.57 0.00 0.00 175.07 174.73 1m70 n MET 165 N -1.88 -1.46 0.03 -0.78 2.81 0.70 -4.93 117.12 111.61 1m70 n MET 165 Ca 0.00 1.15 -0.02 0.00 -1.81 0.00 0.00 57.70 57.01 1m70 n MET 165 Cb 0.43 -5.54 -0.01 0.00 -0.71 0.00 0.00 33.22 27.39 1m70 n MET 165 CO 0.00 0.00 0.00 0.82 1.51 0.00 0.00 175.97 178.30 1m70 h ILE 166 N 0.00 0.00 0.00 2.02 2.04 -1.96 -3.34 117.51 116.27 1m70 h ILE 166 Ca -0.41 -0.69 -0.14 0.00 1.00 0.00 0.00 64.86 64.62 1m70 h ILE 166 Cb 1.29 0.00 -0.02 0.00 -0.74 0.00 0.00 36.82 37.35 1m70 h ILE 166 CO 0.59 0.00 -0.68 0.24 0.00 0.00 0.00 178.15 178.30 1m70 h MET 167 N -0.85 0.00 -0.99 2.37 2.86 -1.91 -2.06 114.93 114.34 1m70 h MET 167 Ca -0.02 0.00 0.05 0.00 -2.06 0.00 0.00 59.70 57.67 1m70 h MET 167 Cb 0.12 0.00 -0.06 0.00 0.06 0.00 0.00 31.60 31.72 1m70 h MET 167 CO 0.03 0.68 0.65 0.07 1.06 0.00 0.00 176.91 179.40 1m70 h ARG 168 N 0.00 1.18 -0.11 1.72 0.11 -1.82 0.26 114.38 115.72 1m70 h ARG 168 Ca -0.01 -0.07 -0.17 0.00 0.10 0.00 0.00 59.98 59.84 1m70 h ARG 168 Cb 1.23 -0.27 -0.01 0.00 1.11 0.00 0.00 29.97 32.04 1m70 h ARG 168 CO 0.09 0.78 -0.64 0.78 0.10 0.00 0.00 179.97 181.08 1m70 h GLY 169 N 1.22 0.44 0.60 0.08 0.00 -1.51 -2.43 103.07 101.47 1m70 h GLY 169 Ca 0.41 -0.57 -0.01 0.00 0.00 0.00 0.00 47.33 47.16 1m70 h GLY 169 CO -0.14 0.51 -0.07 -2.08 0.00 0.00 0.00 176.54 174.75 1m70 h VAL 170 N 0.29 1.00 0.00 4.60 2.07 -1.06 -3.27 116.25 119.88 1m70 h VAL 170 Ca -0.01 -0.82 -0.02 0.00 0.82 0.00 0.00 66.70 66.66 1m70 h VAL 170 Cb 1.18 1.50 -0.00 0.00 -1.52 0.00 0.00 31.29 32.45 1m70 h VAL 170 CO 0.11 0.19 -0.11 0.00 0.02 0.00 0.00 177.57 177.78 1m70 h ALA 171 N 0.16 1.07 -0.41 1.67 0.00 -1.00 -2.45 119.26 118.29 1m70 h ALA 171 Ca -0.02 -0.10 0.12 0.00 0.00 0.00 0.00 54.91 54.91 1m70 h ALA 171 Cb 0.46 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.22 1m70 h ALA 171 CO 0.03 0.13 0.42 0.00 0.00 0.00 0.00 179.25 179.83 1m70 h ALA 172 N 1.89 2.14 -0.31 0.00 0.00 -1.48 -2.18 119.26 119.31 1m70 h ALA 172 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1m70 h ALA 172 Cb 0.52 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.34 1m70 h ALA 172 CO 0.01 -0.63 0.00 1.63 0.00 0.00 0.00 179.25 180.27 1m70 n LYS 173 N -3.80 2.35 -3.69 0.00 4.76 -0.92 -4.93 118.16 111.92 1m70 n LYS 173 Ca 0.07 -2.03 -0.35 0.00 -2.87 0.00 0.00 58.31 53.13 1m70 n LYS 173 Cb 0.59 -1.49 -0.08 0.00 -1.84 0.00 0.00 35.03 32.21 1m70 n LYS 173 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1m70 s LEU 174 N -1.56 4.20 0.79 -0.35 1.43 -0.82 -5.07 118.68 117.30 1m70 s LEU 174 Ca 0.37 0.26 -0.12 0.00 -1.03 0.00 0.00 54.13 53.61 1m70 s LEU 174 Cb 0.22 -2.13 0.07 0.00 0.03 0.00 0.00 46.19 44.37 1m70 s LEU 174 CO 0.31 0.15 1.16 -0.94 0.23 0.00 0.00 176.35 177.26 1m70 s SER 175 N 0.45 4.66 0.21 2.29 1.04 -1.26 -4.89 113.70 116.21 1m70 s SER 175 Ca 0.09 0.88 -0.09 0.00 0.48 0.00 0.00 55.95 57.32 1m70 s SER 175 Cb -0.12 -1.46 0.27 0.00 0.10 0.00 0.00 66.02 64.82 1m70 s SER 175 CO -0.00 -1.82 1.79 0.78 0.98 0.00 0.00 173.24 174.97 1m70 h ASN 176 N -0.99 0.46 -0.63 7.02 2.35 -1.99 -0.76 115.58 121.05 1m70 h ASN 176 Ca -0.46 0.05 -0.03 0.00 -0.55 0.00 0.00 56.30 55.30 1m70 h ASN 176 Cb 1.31 -0.04 -0.03 0.00 0.05 0.00 0.00 38.32 39.61 1m70 h ASN 176 CO 0.65 0.29 0.27 0.50 -1.65 0.00 0.00 177.43 177.48 1m70 h LYS 177 N 0.61 0.92 -0.79 0.81 1.63 -1.99 -1.29 116.57 116.47 1m70 h LYS 177 Ca 0.31 -0.16 0.03 0.00 -0.85 0.00 0.00 60.65 59.98 1m70 h LYS 177 Cb 0.27 -0.15 -0.05 0.00 -0.60 0.00 0.00 32.23 31.69 1m70 h LYS 177 CO -0.22 0.77 0.50 -0.44 -3.45 0.00 0.00 179.45 176.61 1m70 h ASP 178 N 0.87 0.84 -0.44 4.20 3.32 -1.79 -0.93 116.42 122.49 1m70 h ASP 178 Ca 0.21 -0.00 -0.06 0.00 0.02 0.00 0.00 57.03 57.20 1m70 h ASP 178 Cb 0.18 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 39.53 1m70 h ASP 178 CO -0.02 0.58 0.05 0.40 -1.72 0.00 0.00 179.24 178.53 1m70 h ILE 179 N 0.99 1.25 -0.69 0.35 2.04 -0.82 0.47 117.51 121.09 1m70 h ILE 179 Ca 0.31 -0.93 -0.02 0.00 1.00 0.00 0.00 64.86 65.23 1m70 h ILE 179 Cb 0.00 1.00 -0.03 0.00 -0.74 0.00 0.00 36.82 37.05 1m70 h ILE 179 CO -0.11 0.32 0.37 -0.08 0.00 0.00 0.00 178.15 178.65 1m70 h GLU 180 N 0.60 0.97 0.04 2.37 4.81 -0.95 -1.14 114.58 121.27 1m70 h GLU 180 Ca 0.13 -0.12 -0.00 0.00 -0.13 0.00 0.00 59.36 59.24 1m70 h GLU 180 Cb 0.41 -0.19 0.00 0.00 0.63 0.00 0.00 28.75 29.60 1m70 h GLU 180 CO 0.01 0.74 -0.02 0.00 -0.73 0.00 0.00 179.01 179.01 1m70 h ALA 181 N 1.18 -0.05 -0.62 2.92 0.00 -0.89 -2.17 119.26 119.63 1m70 h ALA 181 Ca 0.24 -0.15 0.05 0.00 0.00 0.00 0.00 54.91 55.05 1m70 h ALA 181 Cb 0.06 0.02 -0.05 0.00 0.00 0.00 0.00 17.79 17.82 1m70 h ALA 181 CO -0.04 -0.38 0.35 -0.07 0.00 0.00 0.00 179.25 179.12 1m70 h LEU 182 N -0.34 0.54 -0.99 0.00 3.38 -0.82 -1.83 115.31 115.25 1m70 h LEU 182 Ca -0.00 0.02 -0.07 0.00 0.09 0.00 0.00 57.88 57.92 1m70 h LEU 182 Cb 0.32 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 40.96 1m70 h LEU 182 CO 0.01 0.36 0.00 0.28 0.09 0.00 0.00 178.44 179.19 1m70 h SER 183 N 0.68 0.70 -0.16 -0.43 0.02 -1.10 0.19 113.55 113.44 1m70 h SER 183 Ca 0.27 -0.16 -0.04 0.00 -0.84 0.00 0.00 61.79 61.02 1m70 h SER 183 Cb 0.12 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 62.47 1m70 h SER 183 CO -0.15 0.77 -0.04 -1.28 -1.14 0.00 0.00 176.83 174.99 1m70 h SER 184 N 0.69 0.32 -0.45 3.07 0.87 -1.10 -2.04 113.55 114.92 1m70 h SER 184 Ca 0.14 -0.36 0.03 0.00 -1.23 0.00 0.00 61.79 60.37 1m70 h SER 184 Cb 0.42 -0.09 -0.03 0.00 -0.44 0.00 0.00 62.40 62.26 1m70 h SER 184 CO 0.02 0.61 0.24 0.22 -0.53 0.00 0.00 176.83 177.39 1m70 h TYR 185 N 0.02 0.45 -0.63 2.24 3.20 -1.01 -2.53 116.97 118.71 1m70 h TYR 185 Ca 0.04 0.02 -0.02 0.00 3.14 0.00 0.00 58.73 61.91 1m70 h TYR 185 Cb 0.47 -0.14 -0.03 0.00 1.54 0.00 0.00 36.73 38.57 1m70 h TYR 185 CO 0.05 0.24 0.32 0.82 -1.64 0.00 0.00 178.16 177.96 1m70 h ILE 186 N 0.49 1.20 -0.11 1.81 2.04 -0.89 -2.35 117.51 119.69 1m70 h ILE 186 Ca 0.19 -0.53 -0.01 0.00 1.00 0.00 0.00 64.86 65.51 1m70 h ILE 186 Cb 0.06 0.37 -0.01 0.00 -0.74 0.00 0.00 36.82 36.50 1m70 h ILE 186 CO -0.11 0.23 0.03 -0.61 0.00 0.00 0.00 178.15 177.68 1m70 h GLN 187 N 0.88 0.15 -0.11 2.37 4.15 -0.91 -0.10 115.11 121.53 1m70 h GLN 187 Ca 0.22 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.63 1m70 h GLN 187 Cb 0.06 -0.03 0.00 0.00 0.21 0.00 0.00 27.48 27.71 1m70 h GLN 187 CO -0.03 0.15 0.00 0.41 -1.93 0.00 0.00 178.83 177.43 1m70 n GLY 188 N -1.38 0.78 3.70 2.39 0.00 -0.90 -1.30 105.19 108.46 1m70 n GLY 188 Ca -0.01 -0.60 -0.41 0.00 0.00 0.00 0.00 46.02 45.00 1m70 n GLY 188 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1m70 s LEU 189 N -1.84 4.27 0.00 0.99 2.96 -0.71 -4.84 118.68 119.51 1m70 s LEU 189 Ca 0.33 1.23 0.00 0.00 -0.22 0.00 0.00 54.13 55.47 1m70 s LEU 189 Cb 0.20 -3.19 0.00 0.00 0.50 0.00 0.00 46.19 43.71 1m70 s LEU 189 CO 0.31 -0.23 0.00 0.00 -1.32 0.00 0.00 176.35 175.10