#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bef n ASN 7 N 0.00 0.00 -1.22 6.55 5.03 -1.26 -3.84 115.26 120.53 2bef n ASN 7 Ca 0.00 -0.79 0.05 0.00 0.87 0.00 0.00 54.58 54.71 2bef n ASN 7 Cb 0.00 0.00 0.23 0.00 -1.02 0.00 0.00 39.78 38.99 2bef n ASN 7 CO 0.00 0.00 0.00 0.29 -1.83 0.00 0.00 177.26 175.72 2bef n LYS 8 N -0.99 3.04 -2.62 3.52 4.76 -1.26 -2.20 118.16 122.40 2bef n LYS 8 Ca 0.18 -1.82 -0.38 0.00 -2.87 0.00 0.00 58.31 53.43 2bef n LYS 8 Cb 0.08 -1.82 -0.05 0.00 -1.84 0.00 0.00 35.03 31.40 2bef n LYS 8 CO 0.00 0.00 0.00 -2.00 -1.37 0.00 0.00 177.40 174.03 2bef s GLU 9 N -1.91 4.47 0.17 1.97 2.12 -1.25 -4.82 118.70 119.46 2bef s GLU 9 Ca 0.32 1.52 0.07 0.00 0.36 0.00 0.00 54.97 57.24 2bef s GLU 9 Cb 0.23 -2.85 -0.04 0.00 0.26 0.00 0.00 34.13 31.73 2bef s GLU 9 CO 0.12 0.14 -0.14 1.03 -0.54 0.00 0.00 175.26 175.86 2bef s ARG 10 N -1.98 1.23 0.07 4.30 0.52 -1.26 -1.30 118.95 120.52 2bef s ARG 10 Ca 0.51 -1.48 -0.03 0.00 -0.52 0.00 0.00 55.73 54.21 2bef s ARG 10 Cb -0.24 -1.04 -0.03 0.00 0.52 0.00 0.00 34.95 34.16 2bef s ARG 10 CO 0.30 0.18 0.04 -0.08 0.02 0.00 0.00 175.30 175.76 2bef s THR 11 N -2.72 0.19 -0.19 0.02 -1.32 -0.93 -4.72 115.64 105.97 2bef s THR 11 Ca 0.18 -1.67 -0.01 0.00 -1.21 0.00 0.00 61.69 58.98 2bef s THR 11 Cb -0.02 -1.54 0.00 0.00 -1.51 0.00 0.00 72.50 69.44 2bef s THR 11 CO 0.05 -0.85 -0.12 0.12 -2.21 0.00 0.00 174.62 171.61 2bef s PHE 12 N -3.92 2.85 0.04 9.09 5.36 -1.26 -2.64 117.98 127.49 2bef s PHE 12 Ca 0.08 -1.18 0.07 0.00 -0.96 0.00 0.00 56.93 54.95 2bef s PHE 12 Cb 0.07 -1.98 -0.03 0.00 -0.34 0.00 0.00 43.02 40.74 2bef s PHE 12 CO -0.09 -0.60 -0.20 -0.51 -1.46 0.00 0.00 175.22 172.37 2bef s LEU 13 N 1.20 2.52 -0.04 6.12 1.43 -0.37 -1.65 118.68 127.89 2bef s LEU 13 Ca 0.02 -0.45 -0.00 0.00 -1.03 0.00 0.00 54.13 52.67 2bef s LEU 13 Cb -0.14 -1.47 0.03 0.00 0.03 0.00 0.00 46.19 44.64 2bef s LEU 13 CO -0.05 0.26 0.00 0.00 0.23 0.00 0.00 176.35 176.79 2bef s ALA 14 N -0.89 0.45 -0.23 4.21 0.00 0.36 -0.98 121.76 124.69 2bef s ALA 14 Ca 0.14 0.07 -0.27 0.00 0.00 0.00 0.00 51.96 51.89 2bef s ALA 14 Cb -0.10 -0.47 0.00 0.00 0.00 0.00 0.00 23.12 22.55 2bef s ALA 14 CO 0.04 -0.20 0.95 0.08 0.00 0.00 0.00 175.76 176.64 2bef s VAL 15 N 1.35 4.75 1.03 0.00 1.01 -0.52 -0.15 120.40 127.86 2bef s VAL 15 Ca -0.05 1.85 -0.15 0.00 0.00 0.00 0.00 61.98 63.63 2bef s VAL 15 Cb -0.13 -4.23 0.20 0.00 0.00 0.00 0.00 36.38 32.22 2bef s VAL 15 CO -0.02 -0.13 1.15 -0.54 0.00 0.00 0.00 175.10 175.56 2bef s LYS 16 N 2.99 0.18 0.51 2.72 1.02 -0.20 -2.67 119.74 124.28 2bef s LYS 16 Ca 0.41 0.09 0.19 0.00 0.02 0.00 0.00 55.97 56.68 2bef s LYS 16 Cb -0.15 -1.75 1.27 0.00 -0.52 0.00 0.00 37.83 36.68 2bef s LYS 16 CO 0.07 -2.81 2.06 -1.35 -0.92 0.00 0.00 175.35 172.40 2bef h PRO 17 N -1.94 0.08 -0.21 -1.68 0.11 -1.86 -2.01 132.00 124.49 2bef h PRO 17 Ca -0.48 -0.00 -0.06 0.00 0.11 0.00 0.00 66.00 65.56 2bef h PRO 17 Cb 1.30 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.39 2bef h PRO 17 CO 0.49 0.05 -0.10 0.38 -0.21 0.00 0.00 178.00 178.61 2bef h ASP 18 N 0.08 0.46 0.26 -2.05 2.03 -1.89 -2.04 116.42 113.28 2bef h ASP 18 Ca 0.14 -0.41 -0.05 0.00 -0.73 0.00 0.00 57.03 55.98 2bef h ASP 18 Cb 0.46 -0.13 -0.01 0.00 -0.83 0.00 0.00 39.33 38.83 2bef h ASP 18 CO -0.01 0.77 -0.23 1.23 -1.03 0.00 0.00 179.24 179.96 2bef h GLY 19 N 0.15 0.00 1.12 7.15 0.00 -1.56 -1.17 103.07 108.76 2bef h GLY 19 Ca 0.05 0.00 -0.21 0.00 0.00 0.00 0.00 47.33 47.16 2bef h GLY 19 CO 0.03 0.00 -0.75 -2.08 0.00 0.00 0.00 176.54 173.74 2bef h VAL 20 N 0.00 1.29 0.00 4.60 2.07 -1.30 -1.15 116.25 121.77 2bef h VAL 20 Ca -0.00 -1.97 -0.09 0.00 0.82 0.00 0.00 66.70 65.46 2bef h VAL 20 Cb 0.43 2.06 -0.01 0.00 -1.52 0.00 0.00 31.29 32.24 2bef h VAL 20 CO 0.03 0.62 -0.44 0.00 0.02 0.00 0.00 177.57 177.80 2bef h ALA 21 N 0.52 0.92 -0.00 1.67 0.00 -0.99 -2.66 119.26 118.72 2bef h ALA 21 Ca -0.06 -0.40 0.00 0.00 0.00 0.00 0.00 54.91 54.45 2bef h ALA 21 Cb 1.39 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.11 2bef h ALA 21 CO 0.16 0.55 -0.05 0.54 0.00 0.00 0.00 179.25 180.44 2bef n ARG 22 N -3.50 0.83 -2.52 0.00 1.74 -0.48 -4.94 116.66 107.79 2bef n ARG 22 Ca 0.00 -0.21 -0.05 0.00 -0.77 0.00 0.00 57.85 56.83 2bef n ARG 22 Cb 0.57 -1.50 0.02 0.00 -1.02 0.00 0.00 32.46 30.53 2bef n ARG 22 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2bef n GLY 23 N 1.19 0.42 0.35 -0.13 0.00 -1.00 -4.99 105.19 101.03 2bef n GLY 23 Ca 0.17 -0.40 0.03 0.00 0.00 0.00 0.00 46.02 45.82 2bef n GLY 23 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2bef n LEU 24 N -1.62 2.40 0.09 0.99 4.77 -0.44 -4.75 117.00 118.44 2bef n LEU 24 Ca -0.03 -1.88 -0.13 0.00 -0.03 0.00 0.00 56.01 53.94 2bef n LEU 24 Cb 0.53 -0.12 -0.08 0.00 -2.33 0.00 0.00 43.42 41.43 2bef n LEU 24 CO 0.14 0.59 0.80 0.58 -1.33 0.00 0.00 177.39 178.18 2bef h VAL 25 N 1.16 0.91 -0.15 4.08 2.07 -1.88 -2.44 116.25 120.00 2bef h VAL 25 Ca 0.00 -0.11 -0.12 0.00 0.82 0.00 0.00 66.70 67.29 2bef h VAL 25 Cb 0.59 0.98 -0.01 0.00 -1.52 0.00 0.00 31.29 31.32 2bef h VAL 25 CO 0.00 0.03 -0.43 1.23 0.02 0.00 0.00 177.57 178.42 2bef h GLY 26 N -0.22 0.39 0.84 2.17 0.00 -1.97 -1.27 103.07 103.02 2bef h GLY 26 Ca -0.02 -0.39 0.03 0.00 0.00 0.00 0.00 47.33 46.96 2bef h GLY 26 CO 0.03 0.35 0.27 -2.09 0.00 0.00 0.00 176.54 175.09 2bef h GLU 27 N 0.29 0.51 -0.18 4.80 4.57 -1.85 -1.21 114.58 121.52 2bef h GLU 27 Ca 0.02 -0.03 -0.05 0.00 -1.18 0.00 0.00 59.36 58.12 2bef h GLU 27 Cb 0.88 -0.12 -0.00 0.00 -0.16 0.00 0.00 28.75 29.35 2bef h GLU 27 CO 0.07 0.34 -0.08 0.82 -1.18 0.00 0.00 179.01 178.98 2bef h ILE 28 N 0.53 1.31 -0.90 2.32 2.04 -1.23 -3.02 117.51 118.56 2bef h ILE 28 Ca 0.20 -1.13 0.01 0.00 1.00 0.00 0.00 64.86 64.93 2bef h ILE 28 Cb 0.05 1.68 -0.04 0.00 -0.74 0.00 0.00 36.82 37.76 2bef h ILE 28 CO -0.11 0.34 0.60 0.40 0.00 0.00 0.00 178.15 179.38 2bef h ILE 29 N 0.06 1.23 -0.04 -0.67 2.04 -1.07 -2.95 117.51 116.10 2bef h ILE 29 Ca 0.04 -0.42 -0.09 0.00 1.00 0.00 0.00 64.86 65.39 2bef h ILE 29 Cb 0.56 -0.09 -0.01 0.00 -0.74 0.00 0.00 36.82 36.53 2bef h ILE 29 CO 0.03 0.22 -0.38 0.00 0.00 0.00 0.00 178.15 178.02 2bef h ALA 30 N 1.43 1.29 -0.46 1.87 0.00 -1.17 -2.35 119.26 119.87 2bef h ALA 30 Ca 0.33 -0.36 -0.04 0.00 0.00 0.00 0.00 54.91 54.83 2bef h ALA 30 Cb -0.14 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 2bef h ALA 30 CO -0.07 0.51 0.11 0.00 0.00 0.00 0.00 179.25 179.80 2bef h ARG 31 N 0.07 0.69 0.02 0.00 3.08 -1.39 -1.21 114.38 115.64 2bef h ARG 31 Ca 0.01 -0.13 -0.23 0.00 0.07 0.00 0.00 59.98 59.70 2bef h ARG 31 Cb 0.71 -0.11 -0.03 0.00 0.08 0.00 0.00 29.97 30.62 2bef h ARG 31 CO 0.05 0.63 -1.14 1.88 -1.07 0.00 0.00 179.97 180.32 2bef h TYR 32 N 0.67 0.06 -0.37 3.04 0.05 -1.56 -2.82 116.97 116.05 2bef h TYR 32 Ca 0.15 -0.05 -0.13 0.00 0.05 0.00 0.00 58.73 58.76 2bef h TYR 32 Cb 0.25 -0.00 -0.01 0.00 1.01 0.00 0.00 36.73 37.98 2bef h TYR 32 CO 0.01 1.04 -0.27 0.93 -1.05 0.00 0.00 178.16 178.82 2bef h GLU 33 N 0.01 0.84 -0.18 4.88 5.08 -1.26 -1.58 114.58 122.36 2bef h GLU 33 Ca -0.07 -0.41 -0.08 0.00 -1.00 0.00 0.00 59.36 57.81 2bef h GLU 33 Cb 1.83 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 31.07 2bef h GLU 33 CO 0.13 1.04 -0.22 0.87 -1.00 0.00 0.00 179.01 179.83 2bef h LYS 34 N 0.63 0.32 -0.26 2.33 1.57 -1.28 -2.68 116.57 117.22 2bef h LYS 34 Ca 0.07 -0.10 -0.12 0.00 -1.87 0.00 0.00 60.65 58.63 2bef h LYS 34 Cb 0.85 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 33.11 2bef h LYS 34 CO 0.07 0.53 -0.35 -0.22 -0.57 0.00 0.00 179.45 178.92 2bef h LYS 35 N 0.29 0.56 0.00 3.15 1.63 -1.42 -3.47 116.57 117.30 2bef h LYS 35 Ca 0.05 -0.26 0.00 0.00 -0.85 0.00 0.00 60.65 59.59 2bef h LYS 35 Cb 0.56 -0.01 0.00 0.00 -0.60 0.00 0.00 32.23 32.18 2bef h LYS 35 CO 0.04 0.83 0.00 0.41 -3.45 0.00 0.00 179.45 177.27 2bef n GLY 36 N -0.13 0.99 3.81 5.01 0.00 -0.98 -5.10 105.19 108.79 2bef n GLY 36 Ca -0.01 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.64 2bef n GLY 36 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2bef s PHE 37 N -1.69 3.68 -0.15 1.61 0.08 -0.63 -4.86 117.98 116.02 2bef s PHE 37 Ca 0.00 1.45 -0.08 0.00 0.12 0.00 0.00 56.93 58.41 2bef s PHE 37 Cb 0.00 -2.66 -0.04 0.00 -0.57 0.00 0.00 43.02 39.75 2bef s PHE 37 CO 0.00 0.35 0.13 0.08 -0.10 0.00 0.00 175.22 175.68 2bef s VAL 38 N -1.49 5.44 -0.51 -0.44 1.01 -0.46 -4.40 120.40 119.55 2bef s VAL 38 Ca 0.43 0.19 -0.29 0.00 0.00 0.00 0.00 61.98 62.31 2bef s VAL 38 Cb -0.17 -3.42 0.03 0.00 0.00 0.00 0.00 36.38 32.82 2bef s VAL 38 CO 0.22 0.54 1.14 -0.22 0.00 0.00 0.00 175.10 176.78 2bef s LEU 39 N -0.42 3.60 0.00 3.92 2.96 -1.26 -0.38 118.68 127.09 2bef s LEU 39 Ca 0.12 0.35 0.21 0.00 -0.22 0.00 0.00 54.13 54.59 2bef s LEU 39 Cb -0.12 -3.43 0.04 0.00 0.50 0.00 0.00 46.19 43.18 2bef s LEU 39 CO 0.01 -1.31 1.07 1.33 -1.32 0.00 0.00 176.35 176.13 2bef n VAL 40 N 6.79 0.00 -3.63 1.68 0.24 0.08 -4.93 118.33 118.56 2bef n VAL 40 Ca 0.11 -0.34 -0.14 0.00 -2.04 0.00 0.00 64.34 61.93 2bef n VAL 40 Cb 0.49 1.30 -0.07 0.00 -1.47 0.00 0.00 33.84 34.09 2bef n VAL 40 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 2bef s GLY 41 N -2.19 -0.54 -0.22 7.63 0.00 -1.17 -0.84 107.32 109.99 2bef s GLY 41 Ca 0.19 2.03 -0.17 0.00 0.00 0.00 0.00 44.72 46.77 2bef s GLY 41 CO 0.46 1.76 0.57 -2.27 0.00 0.00 0.00 173.10 173.62 2bef s LEU 42 N 0.42 -0.38 0.04 0.66 2.96 -1.26 -2.55 118.68 118.56 2bef s LEU 42 Ca -0.00 1.20 -0.28 0.00 -0.22 0.00 0.00 54.13 54.82 2bef s LEU 42 Cb -0.05 1.95 0.09 0.00 0.50 0.00 0.00 46.19 48.68 2bef s LEU 42 CO 0.00 -0.21 0.97 -1.59 -1.32 0.00 0.00 176.35 174.20 2bef s LYS 43 N 0.91 0.88 -0.03 1.98 -2.85 -0.89 -5.03 119.74 114.71 2bef s LYS 43 Ca -0.05 -0.41 0.07 0.00 -1.00 0.00 0.00 55.97 54.59 2bef s LYS 43 Cb -0.05 0.35 -0.02 0.00 -2.06 0.00 0.00 37.83 36.05 2bef s LYS 43 CO -0.08 -0.40 -0.26 -1.14 0.10 0.00 0.00 175.35 173.58 2bef s GLN 44 N -3.07 2.26 0.15 1.78 0.74 -1.26 -1.52 119.66 118.74 2bef s GLN 44 Ca 0.09 -0.92 -0.20 0.00 0.05 0.00 0.00 55.36 54.37 2bef s GLN 44 Cb -0.01 -2.08 0.05 0.00 1.10 0.00 0.00 33.01 32.08 2bef s GLN 44 CO -0.04 0.50 0.52 -0.48 -0.55 0.00 0.00 175.29 175.24 2bef s LEU 45 N -0.46 -0.18 -0.39 3.68 2.34 -0.69 -4.98 118.68 118.00 2bef s LEU 45 Ca 0.06 -0.14 -0.14 0.00 0.06 0.00 0.00 54.13 53.96 2bef s LEU 45 Cb -0.11 2.30 0.02 0.00 -0.56 0.00 0.00 46.19 47.84 2bef s LEU 45 CO 0.01 -0.93 0.27 -0.69 -1.06 0.00 0.00 176.35 173.94 2bef s VAL 46 N -3.78 5.08 0.43 1.48 1.01 -1.26 -0.91 120.40 122.45 2bef s VAL 46 Ca 0.02 -0.65 -0.26 0.00 0.00 0.00 0.00 61.98 61.09 2bef s VAL 46 Cb -0.00 -3.80 -0.09 0.00 0.00 0.00 0.00 36.38 32.49 2bef s VAL 46 CO -0.12 -0.25 1.38 -2.65 0.00 0.00 0.00 175.10 173.46 2bef n PRO 47 N 5.11 2.18 -2.74 2.72 -0.02 -1.26 -5.00 135.00 135.99 2bef n PRO 47 Ca -0.11 0.78 -0.32 0.00 -2.02 0.00 0.00 63.50 61.82 2bef n PRO 47 Cb 0.47 -2.53 -0.04 0.00 -0.02 0.00 0.00 33.50 31.37 2bef n PRO 47 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 2bef s THR 48 N -1.18 4.62 0.45 3.45 2.01 -1.26 -4.63 115.64 119.10 2bef s THR 48 Ca 0.60 1.01 0.13 0.00 0.31 0.00 0.00 61.69 63.74 2bef s THR 48 Cb -0.48 -3.69 0.30 0.00 0.01 0.00 0.00 72.50 68.64 2bef s THR 48 CO 0.59 -0.49 2.05 0.50 -0.69 0.00 0.00 174.62 176.57 2bef h LYS 49 N 1.41 0.33 -0.07 4.92 3.64 -1.94 -1.89 116.57 122.96 2bef h LYS 49 Ca -0.47 -0.02 -0.14 0.00 -1.27 0.00 0.00 60.65 58.75 2bef h LYS 49 Cb 1.18 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 32.92 2bef h LYS 49 CO 0.63 0.22 -0.57 -0.44 -2.27 0.00 0.00 179.45 177.01 2bef h ASP 50 N 0.34 0.25 -0.11 4.20 3.32 -1.99 -2.74 116.42 119.69 2bef h ASP 50 Ca 0.16 -0.14 -0.08 0.00 0.02 0.00 0.00 57.03 56.99 2bef h ASP 50 Cb 0.23 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 39.71 2bef h ASP 50 CO -0.04 0.77 -0.25 0.25 -1.72 0.00 0.00 179.24 178.26 2bef h LEU 51 N 0.17 0.41 -1.25 1.55 5.85 -1.81 -2.54 115.31 117.69 2bef h LEU 51 Ca -0.00 -0.57 0.02 0.00 0.84 0.00 0.00 57.88 58.17 2bef h LEU 51 Cb 1.06 -0.12 -0.04 0.00 0.37 0.00 0.00 40.66 41.93 2bef h LEU 51 CO 0.09 0.90 0.52 0.00 -0.34 0.00 0.00 178.44 179.61 2bef h ALA 52 N 0.51 1.49 -0.02 1.25 0.00 -1.37 0.16 119.26 121.30 2bef h ALA 52 Ca 0.00 -0.04 -0.18 0.00 0.00 0.00 0.00 54.91 54.69 2bef h ALA 52 Cb 0.84 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 2bef h ALA 52 CO 0.05 0.44 -0.79 0.93 0.00 0.00 0.00 179.25 179.88 2bef h GLU 53 N 1.00 0.20 0.12 0.00 5.08 -1.47 -1.61 114.58 117.90 2bef h GLU 53 Ca 0.30 -0.19 -0.27 0.00 -1.00 0.00 0.00 59.36 58.20 2bef h GLU 53 Cb -0.02 0.05 0.03 0.00 0.50 0.00 0.00 28.75 29.30 2bef h GLU 53 CO -0.08 0.89 -1.15 0.77 -1.00 0.00 0.00 179.01 178.44 2bef h SER 54 N 0.12 0.80 -0.29 1.42 0.02 -1.15 -0.62 113.55 113.86 2bef h SER 54 Ca -0.03 -0.84 0.04 0.00 -0.84 0.00 0.00 61.79 60.12 2bef h SER 54 Cb 1.39 -0.25 -0.04 0.00 0.14 0.00 0.00 62.40 63.64 2bef h SER 54 CO 0.12 1.56 0.06 -0.74 -1.14 0.00 0.00 176.83 176.69 2bef h HIS 55 N 0.16 0.10 -0.85 3.45 -0.00 -0.67 -2.72 115.15 114.62 2bef h HIS 55 Ca -0.18 0.02 -0.34 0.00 -0.00 0.00 0.00 60.37 59.87 2bef h HIS 55 Cb 1.84 -0.00 -0.20 0.00 -0.00 0.00 0.00 27.41 29.04 2bef h HIS 55 CO 0.13 0.03 0.44 0.66 -0.00 0.00 0.00 177.93 179.18 2bef n TYR 56 N -5.08 2.71 -0.12 5.26 4.01 -0.61 -4.70 117.16 118.64 2bef n TYR 56 Ca -0.00 -1.46 0.23 0.00 -0.16 0.00 0.00 57.90 56.50 2bef n TYR 56 Cb 0.12 -0.80 0.67 0.00 -0.31 0.00 0.00 39.34 39.02 2bef n TYR 56 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2bef h ALA 57 N 2.00 2.57 0.00 -0.72 0.00 -0.77 -0.96 119.26 121.38 2bef h ALA 57 Ca 0.42 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.31 2bef h ALA 57 Cb 2.56 0.03 0.00 0.00 0.00 0.00 0.00 17.79 20.38 2bef h ALA 57 CO 0.89 -0.79 0.00 -0.85 0.00 0.00 0.00 179.25 178.51 2bef n GLU 58 N -4.36 0.01 -0.12 0.00 0.28 -1.26 -2.07 120.64 113.11 2bef n GLU 58 Ca 0.15 0.32 0.07 0.00 -0.16 0.00 0.00 57.16 57.53 2bef n GLU 58 Cb 0.76 -1.50 0.12 0.00 1.43 0.00 0.00 31.44 32.25 2bef n GLU 58 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 177.13 177.69 2bef n HIS 59 N -1.49 0.20 0.24 -1.84 8.25 -0.36 -4.73 115.22 115.48 2bef n HIS 59 Ca 0.03 -0.80 0.16 0.00 -0.26 0.00 0.00 57.72 56.84 2bef n HIS 59 Cb 0.12 -0.14 0.83 0.00 1.12 0.00 0.00 29.99 31.91 2bef n HIS 59 CO 0.00 0.00 0.00 1.57 0.64 0.00 0.00 176.34 178.55 2bef h LYS 60 N 0.47 0.00 -0.01 -0.41 2.10 -1.50 -1.37 116.57 115.85 2bef h LYS 60 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2bef h LYS 60 Cb 0.92 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.25 2bef h LYS 60 CO 0.04 0.00 -0.32 0.39 -2.00 0.00 0.00 179.45 177.56 2bef n GLU 61 N -2.59 1.60 -2.85 0.07 1.02 -1.26 -4.95 120.64 111.67 2bef n GLU 61 Ca -0.02 -0.91 -0.35 0.00 -0.02 0.00 0.00 57.16 55.86 2bef n GLU 61 Cb 0.07 -1.31 -0.07 0.00 -0.02 0.00 0.00 31.44 30.11 2bef n GLU 61 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 2bef s ARG 62 N -1.94 4.34 0.55 3.49 1.81 -0.52 -4.96 118.95 121.72 2bef s ARG 62 Ca 0.15 1.14 0.24 0.00 -1.72 0.00 0.00 55.73 55.54 2bef s ARG 62 Cb 0.14 -2.46 1.45 0.00 -0.45 0.00 0.00 34.95 33.63 2bef s ARG 62 CO 0.41 0.12 2.08 -1.00 -0.68 0.00 0.00 175.30 176.23 2bef h PRO 63 N 2.46 0.00 -0.04 3.54 0.13 -1.93 -2.68 132.00 133.48 2bef h PRO 63 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 2bef h PRO 63 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 2bef h PRO 63 CO 0.63 0.00 0.00 1.97 -0.23 0.00 0.00 178.00 180.37 2bef n PHE 64 N -4.24 0.04 0.16 1.56 1.16 -1.26 -4.37 117.46 110.50 2bef n PHE 64 Ca 0.03 -0.02 -0.14 0.00 -1.87 0.00 0.00 57.45 55.45 2bef n PHE 64 Cb 0.35 0.00 -0.08 0.00 -1.61 0.00 0.00 39.48 38.14 2bef n PHE 64 CO 0.00 0.00 0.00 0.35 -1.87 0.00 0.00 176.76 175.24 2bef h PHE 65 N 1.87 -0.30 -0.57 2.97 3.57 -1.70 0.19 116.94 122.96 2bef h PHE 65 Ca 0.00 -0.01 0.08 0.00 3.53 0.00 0.00 57.97 61.57 2bef h PHE 65 Cb 0.40 0.10 -0.06 0.00 2.79 0.00 0.00 35.95 39.18 2bef h PHE 65 CO 0.02 -0.18 0.24 0.78 -2.23 0.00 0.00 178.31 176.94 2bef h GLY 66 N -0.34 0.80 1.22 2.40 0.00 -1.82 0.63 103.07 105.96 2bef h GLY 66 Ca -0.03 -0.14 -0.10 0.00 0.00 0.00 0.00 47.33 47.05 2bef h GLY 66 CO 0.06 0.03 -0.09 -1.33 0.00 0.00 0.00 176.54 175.21 2bef h GLY 67 N 0.44 1.00 0.84 4.60 0.00 -1.77 -2.14 103.07 106.03 2bef h GLY 67 Ca 0.28 -0.77 -0.00 0.00 0.00 0.00 0.00 47.33 46.84 2bef h GLY 67 CO -0.25 0.70 0.01 -2.00 0.00 0.00 0.00 176.54 175.00 2bef h LEU 68 N 0.83 0.03 -1.44 3.11 5.85 0.02 -2.71 115.31 121.00 2bef h LEU 68 Ca 0.14 -0.17 -0.05 0.00 0.84 0.00 0.00 57.88 58.64 2bef h LEU 68 Cb 0.61 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.63 2bef h LEU 68 CO 0.04 0.19 -0.21 0.58 -0.34 0.00 0.00 178.44 178.69 2bef h VAL 69 N -0.14 1.18 -0.12 1.05 2.07 -0.88 -1.87 116.25 117.54 2bef h VAL 69 Ca 0.01 -0.86 -0.18 0.00 0.82 0.00 0.00 66.70 66.49 2bef h VAL 69 Cb 0.17 1.38 -0.00 0.00 -1.52 0.00 0.00 31.29 31.32 2bef h VAL 69 CO -0.00 0.25 -0.66 0.28 0.02 0.00 0.00 177.57 177.47 2bef h SER 70 N 0.09 0.56 -0.00 0.57 0.02 -1.22 -3.22 113.55 110.35 2bef h SER 70 Ca 0.02 -0.34 -0.00 0.00 -0.84 0.00 0.00 61.79 60.63 2bef h SER 70 Cb 0.43 -0.16 0.00 0.00 0.14 0.00 0.00 62.40 62.81 2bef h SER 70 CO 0.03 1.07 -0.00 0.15 -1.14 0.00 0.00 176.83 176.94 2bef h PHE 71 N 0.35 0.00 -0.26 3.45 3.57 -1.24 -2.92 116.94 119.89 2bef h PHE 71 Ca -0.02 -0.00 0.08 0.00 3.53 0.00 0.00 57.97 61.56 2bef h PHE 71 Cb 1.22 -0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.95 2bef h PHE 71 CO 0.05 0.78 0.33 0.82 -2.23 0.00 0.00 178.31 178.06 2bef h ILE 72 N -0.78 0.35 -0.46 1.41 5.03 -1.45 0.62 117.51 122.24 2bef h ILE 72 Ca -0.00 0.00 0.00 0.00 -0.12 0.00 0.00 64.86 64.74 2bef h ILE 72 Cb 0.78 0.73 0.00 0.00 -3.03 0.00 0.00 36.82 35.30 2bef h ILE 72 CO 0.00 0.00 0.00 0.35 -0.68 0.00 0.00 178.15 177.82 2bef n THR 73 N -3.63 0.92 1.07 -0.27 -2.24 -1.22 -4.47 114.28 104.45 2bef n THR 73 Ca 0.04 -0.96 0.14 0.00 -2.27 0.00 0.00 64.05 61.00 2bef n THR 73 Cb 0.47 0.57 0.55 0.00 -2.10 0.00 0.00 70.33 69.82 2bef n THR 73 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2bef n SER 74 N 0.94 0.15 -3.10 3.42 3.41 0.21 -4.84 113.62 113.80 2bef n SER 74 Ca 0.16 0.19 -0.02 0.00 -0.26 0.00 0.00 58.87 58.94 2bef n SER 74 Cb 0.49 -0.28 0.02 0.00 -0.26 0.00 0.00 64.21 64.18 2bef n SER 74 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2bef n GLY 75 N 1.46 0.60 3.73 5.00 0.00 -1.26 -5.11 105.19 109.61 2bef n GLY 75 Ca 0.08 -1.10 -0.35 0.00 0.00 0.00 0.00 46.02 44.65 2bef n GLY 75 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2bef s PRO 76 N -2.04 2.36 0.01 1.61 0.02 -1.26 -4.43 135.00 131.28 2bef s PRO 76 Ca 0.21 1.83 0.03 0.00 0.02 0.00 0.00 61.00 63.09 2bef s PRO 76 Cb -0.02 -1.85 -0.01 0.00 0.02 0.00 0.00 34.50 32.63 2bef s PRO 76 CO 0.04 -1.68 -0.08 0.08 -0.33 0.00 0.00 177.00 175.02 2bef s VAL 77 N -1.80 0.63 -0.30 3.83 1.01 -0.09 -3.78 120.40 119.90 2bef s VAL 77 Ca 0.76 -0.61 -0.03 0.00 0.00 0.00 0.00 61.98 62.11 2bef s VAL 77 Cb -0.31 -0.58 0.04 0.00 0.00 0.00 0.00 36.38 35.53 2bef s VAL 77 CO 0.42 -0.01 0.01 0.68 0.00 0.00 0.00 175.10 176.20 2bef s VAL 78 N -0.58 3.16 0.18 2.92 -7.23 -1.09 -1.70 120.40 116.06 2bef s VAL 78 Ca -0.01 -1.22 -0.14 0.00 -1.81 0.00 0.00 61.98 58.81 2bef s VAL 78 Cb -0.05 -2.76 -0.07 0.00 0.56 0.00 0.00 36.38 34.06 2bef s VAL 78 CO 0.00 -0.04 0.58 0.00 -0.31 0.00 0.00 175.10 175.33 2bef s ALA 79 N 1.31 3.54 0.12 1.32 0.00 -0.57 -1.44 121.76 126.04 2bef s ALA 79 Ca -0.03 -0.12 -0.19 0.00 0.00 0.00 0.00 51.96 51.62 2bef s ALA 79 Cb -0.19 -2.55 0.05 0.00 0.00 0.00 0.00 23.12 20.43 2bef s ALA 79 CO -0.01 0.45 0.47 0.00 0.00 0.00 0.00 175.76 176.66 2bef s MET 80 N -2.20 1.11 -0.06 0.00 0.23 -0.15 -2.10 119.30 116.13 2bef s MET 80 Ca 0.41 -0.58 0.00 0.00 -1.03 0.00 0.00 55.69 54.50 2bef s MET 80 Cb -0.14 0.50 0.02 0.00 -1.53 0.00 0.00 34.83 33.68 2bef s MET 80 CO 0.20 -0.44 -0.03 0.54 -2.03 0.00 0.00 175.02 173.25 2bef s VAL 81 N -3.57 0.55 0.12 5.16 0.11 -1.06 -1.24 120.40 120.47 2bef s VAL 81 Ca 0.01 -0.06 0.04 0.00 -2.93 0.00 0.00 61.98 59.04 2bef s VAL 81 Cb 0.01 -0.62 -0.04 0.00 -1.53 0.00 0.00 36.38 34.20 2bef s VAL 81 CO -0.11 0.26 0.11 -0.36 -3.33 0.00 0.00 175.10 171.67 2bef s PHE 82 N 1.38 3.18 0.09 1.54 0.08 -1.08 -0.74 117.98 122.43 2bef s PHE 82 Ca -0.04 0.04 0.08 0.00 0.12 0.00 0.00 56.93 57.13 2bef s PHE 82 Cb -0.13 -1.57 -0.03 0.00 -0.57 0.00 0.00 43.02 40.71 2bef s PHE 82 CO -0.03 0.52 -0.20 -2.00 -0.10 0.00 0.00 175.22 173.42 2bef s GLU 83 N -2.73 1.09 0.00 0.44 2.12 0.48 -2.20 118.70 117.90 2bef s GLU 83 Ca 0.30 -1.11 0.00 0.00 0.36 0.00 0.00 54.97 54.52 2bef s GLU 83 Cb -0.11 -1.30 0.00 0.00 0.26 0.00 0.00 34.13 32.98 2bef s GLU 83 CO 0.23 0.30 0.00 0.41 -0.54 0.00 0.00 175.26 175.66 2bef n GLY 84 N 1.17 3.72 3.64 -1.50 0.00 -0.42 -1.36 105.19 110.44 2bef n GLY 84 Ca -0.20 -1.05 -0.46 0.00 0.00 0.00 0.00 46.02 44.31 2bef n GLY 84 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2bef n LYS 85 N -1.38 1.75 -0.98 1.61 4.81 -1.23 -1.86 118.16 120.88 2bef n LYS 85 Ca 0.00 0.62 -0.05 0.00 -0.87 0.00 0.00 58.31 58.01 2bef n LYS 85 Cb 0.00 -2.22 -0.02 0.00 0.02 0.00 0.00 35.03 32.80 2bef n LYS 85 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2bef n GLY 86 N 2.09 0.48 0.41 3.14 0.00 -1.26 -4.82 105.19 105.23 2bef n GLY 86 Ca 0.13 0.00 0.22 0.00 0.00 0.00 0.00 46.02 46.37 2bef n GLY 86 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 2bef h VAL 87 N 0.00 0.56 0.59 1.61 3.04 -1.65 -1.87 116.25 118.52 2bef h VAL 87 Ca -0.10 -0.14 -0.03 0.00 -1.01 0.00 0.00 66.70 65.42 2bef h VAL 87 Cb 0.83 0.13 0.01 0.00 -2.01 0.00 0.00 31.29 30.25 2bef h VAL 87 CO 0.15 0.07 -0.28 0.58 -1.01 0.00 0.00 177.57 177.08 2bef h VAL 88 N 0.39 0.39 0.00 1.51 2.07 -1.85 -0.80 116.25 117.97 2bef h VAL 88 Ca 0.57 -0.15 -0.08 0.00 0.82 0.00 0.00 66.70 67.86 2bef h VAL 88 Cb 1.45 0.45 -0.01 0.00 -1.52 0.00 0.00 31.29 31.66 2bef h VAL 88 CO -0.27 0.02 -0.37 0.00 0.02 0.00 0.00 177.57 176.98 2bef h ALA 89 N -0.53 1.03 -0.18 1.67 0.00 -1.82 -3.00 119.26 116.42 2bef h ALA 89 Ca -0.08 -0.34 -0.11 0.00 0.00 0.00 0.00 54.91 54.38 2bef h ALA 89 Cb 0.64 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.37 2bef h ALA 89 CO 0.13 0.46 -0.34 1.03 0.00 0.00 0.00 179.25 180.54 2bef h SER 90 N 0.00 0.60 -0.31 0.00 0.87 -1.26 -2.64 113.55 110.82 2bef h SER 90 Ca -0.00 -0.55 0.02 0.00 -1.23 0.00 0.00 61.79 60.03 2bef h SER 90 Cb 0.86 -0.17 -0.02 0.00 -0.44 0.00 0.00 62.40 62.64 2bef h SER 90 CO 0.05 1.04 0.21 0.00 -0.53 0.00 0.00 176.83 177.59 2bef h ALA 91 N 0.58 1.87 -0.19 6.23 0.00 -1.16 0.16 119.26 126.76 2bef h ALA 91 Ca 0.01 -0.02 -0.19 0.00 0.00 0.00 0.00 54.91 54.71 2bef h ALA 91 Cb 0.93 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 18.63 2bef h ALA 91 CO 0.08 0.10 -0.64 0.00 0.00 0.00 0.00 179.25 178.78 2bef h ARG 92 N 0.34 0.77 -0.48 0.00 2.47 -1.43 -1.96 114.38 114.09 2bef h ARG 92 Ca 0.12 -0.57 -0.02 0.00 -1.26 0.00 0.00 59.98 58.24 2bef h ARG 92 Cb 0.07 0.10 -0.02 0.00 -1.65 0.00 0.00 29.97 28.47 2bef h ARG 92 CO -0.03 1.19 0.21 1.25 0.56 0.00 0.00 179.97 183.16 2bef h LEU 93 N 0.50 0.65 -1.35 3.04 5.85 -0.99 -2.43 115.31 120.58 2bef h LEU 93 Ca -0.03 -0.15 -0.05 0.00 0.84 0.00 0.00 57.88 58.49 2bef h LEU 93 Cb 1.27 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 42.12 2bef h LEU 93 CO 0.14 0.62 -0.26 0.24 -0.34 0.00 0.00 178.44 178.83 2bef h MET 94 N 0.63 0.00 0.04 1.25 2.86 -0.96 -3.25 114.93 115.50 2bef h MET 94 Ca 0.16 0.00 -0.27 0.00 -2.06 0.00 0.00 59.70 57.54 2bef h MET 94 Cb 0.16 0.00 0.02 0.00 0.06 0.00 0.00 31.60 31.84 2bef h MET 94 CO -0.02 0.26 -1.07 0.82 1.06 0.00 0.00 176.91 177.97 2bef h ILE 95 N 0.00 1.30 0.00 -1.22 2.04 -1.04 0.19 117.51 118.78 2bef h ILE 95 Ca -0.00 -2.30 0.00 0.00 1.00 0.00 0.00 64.86 63.55 2bef h ILE 95 Cb 0.64 2.52 0.00 0.00 -0.74 0.00 0.00 36.82 39.24 2bef h ILE 95 CO 0.03 0.70 0.00 0.61 0.00 0.00 0.00 178.15 179.50 2bef n GLY 96 N 1.19 0.18 3.82 5.37 0.00 -0.94 -0.85 105.19 113.96 2bef n GLY 96 Ca -0.12 -2.07 -0.32 0.00 0.00 0.00 0.00 46.02 43.51 2bef n GLY 96 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2bef s VAL 97 N 0.00 1.15 0.21 1.61 -7.23 -1.26 -4.74 120.40 110.14 2bef s VAL 97 Ca 0.00 -1.86 -0.09 0.00 -1.81 0.00 0.00 61.98 58.22 2bef s VAL 97 Cb 0.00 -2.01 0.15 0.00 0.56 0.00 0.00 36.38 35.08 2bef s VAL 97 CO 0.00 0.00 1.76 0.74 -0.31 0.00 0.00 175.10 177.29 2bef h THR 98 N 1.12 0.82 -3.47 5.32 2.02 -1.98 -3.39 112.91 113.35 2bef h THR 98 Ca -0.42 -0.17 -0.61 0.00 0.77 0.00 0.00 66.41 65.98 2bef h THR 98 Cb 1.32 0.28 -0.11 0.00 -1.74 0.00 0.00 68.15 67.90 2bef h THR 98 CO 0.69 0.09 0.33 0.21 0.37 0.00 0.00 175.52 177.20 2bef s ASN 99 N -5.45 6.61 0.52 4.18 3.04 -1.26 -4.71 114.94 117.87 2bef s ASN 99 Ca -0.13 0.57 0.21 0.00 0.04 0.00 0.00 52.86 53.56 2bef s ASN 99 Cb 0.17 -2.38 1.38 0.00 -1.54 0.00 0.00 41.25 38.88 2bef s ASN 99 CO 0.75 -0.58 2.13 -0.65 -3.04 0.00 0.00 177.10 175.70 2bef h PRO 100 N 8.16 0.00 0.00 0.43 0.11 -1.81 -2.00 132.00 136.89 2bef h PRO 100 Ca -0.25 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.82 2bef h PRO 100 Cb 1.10 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.21 2bef h PRO 100 CO 0.86 0.07 -0.18 -0.07 -0.21 0.00 0.00 178.00 178.46 2bef h LEU 101 N 0.00 0.00 -2.10 2.35 3.38 -1.80 -2.69 115.31 114.45 2bef h LEU 101 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2bef h LEU 101 Cb 0.14 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.89 2bef h LEU 101 CO 0.01 0.18 0.00 0.00 0.09 0.00 0.00 178.44 178.72 2bef n ALA 102 N -2.26 2.44 -2.46 1.53 0.00 -0.76 -4.92 120.51 114.07 2bef n ALA 102 Ca -0.01 -0.92 -0.39 0.00 0.00 0.00 0.00 53.44 52.12 2bef n ALA 102 Cb 0.34 -0.92 -0.05 0.00 0.00 0.00 0.00 19.45 18.81 2bef n ALA 102 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2bef s SER 103 N -1.46 7.07 0.45 0.00 0.01 -1.01 -4.87 113.70 113.89 2bef s SER 103 Ca 0.38 1.27 -0.24 0.00 1.31 0.00 0.00 55.95 58.67 2bef s SER 103 Cb 0.22 -2.41 -0.08 0.00 0.21 0.00 0.00 66.02 63.96 2bef s SER 103 CO 0.30 0.05 1.30 0.00 0.41 0.00 0.00 173.24 175.31 2bef s ALA 104 N -0.07 3.11 0.37 1.44 0.00 -1.26 -4.37 121.76 120.99 2bef s ALA 104 Ca 0.34 1.23 -0.28 0.00 0.00 0.00 0.00 51.96 53.25 2bef s ALA 104 Cb -0.19 -3.50 -0.10 0.00 0.00 0.00 0.00 23.12 19.33 2bef s ALA 104 CO 0.19 -0.96 1.42 -1.25 0.00 0.00 0.00 175.76 175.17 2bef s PRO 105 N -2.49 4.13 0.00 0.00 0.04 -1.26 -2.79 135.00 132.62 2bef s PRO 105 Ca 0.62 2.43 0.00 0.00 0.04 0.00 0.00 61.00 64.09 2bef s PRO 105 Cb -0.37 -2.95 0.00 0.00 0.04 0.00 0.00 34.50 31.21 2bef s PRO 105 CO 0.47 -0.46 0.00 0.41 0.04 0.00 0.00 177.00 177.46 2bef n GLY 106 N 0.58 2.54 3.95 0.56 0.00 -1.26 -4.98 105.19 106.57 2bef n GLY 106 Ca 0.01 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.80 2bef n GLY 106 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2bef s SER 107 N -1.74 6.27 0.07 1.61 1.04 -1.12 -4.94 113.70 114.88 2bef s SER 107 Ca 0.00 0.31 -0.24 0.00 0.48 0.00 0.00 55.95 56.50 2bef s SER 107 Cb 0.00 -1.94 -0.16 0.00 0.10 0.00 0.00 66.02 64.02 2bef s SER 107 CO 0.00 -0.25 1.64 0.40 0.98 0.00 0.00 173.24 176.02 2bef h ILE 108 N 0.87 0.98 -0.09 -1.02 2.04 -0.65 -1.24 117.51 118.40 2bef h ILE 108 Ca -0.50 -0.18 -0.11 0.00 1.00 0.00 0.00 64.86 65.07 2bef h ILE 108 Cb 1.22 1.10 -0.01 0.00 -0.74 0.00 0.00 36.82 38.39 2bef h ILE 108 CO 0.61 0.05 -0.42 0.03 0.00 0.00 0.00 178.15 178.42 2bef h ARG 109 N -0.18 0.21 -0.62 2.37 3.08 -1.25 -1.67 114.38 116.31 2bef h ARG 109 Ca -0.01 -0.10 -0.03 0.00 0.07 0.00 0.00 59.98 59.91 2bef h ARG 109 Cb 0.15 -0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.17 2bef h ARG 109 CO 0.02 0.59 0.26 0.78 -1.07 0.00 0.00 179.97 180.55 2bef h GLY 110 N 1.24 0.99 1.92 0.04 0.00 -1.66 0.12 103.07 105.72 2bef h GLY 110 Ca 0.01 -0.52 -0.07 0.00 0.00 0.00 0.00 47.33 46.75 2bef h GLY 110 CO 0.06 0.50 -0.40 -0.55 0.00 0.00 0.00 176.54 176.14 2bef h ASP 111 N 0.87 0.00 0.00 0.19 3.32 -1.03 -3.41 116.42 116.36 2bef h ASP 111 Ca 0.21 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.26 2bef h ASP 111 Cb 0.18 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.73 2bef h ASP 111 CO -0.02 0.34 -0.50 0.49 -1.72 0.00 0.00 179.24 177.83 2bef n PHE 112 N -3.16 0.00 -3.98 4.55 3.72 -0.65 -5.07 117.46 112.87 2bef n PHE 112 Ca 0.02 0.00 -0.21 0.00 -0.05 0.00 0.00 57.45 57.21 2bef n PHE 112 Cb 0.67 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 39.18 2bef n PHE 112 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 2bef s GLY 113 N -1.20 1.37 0.00 1.37 0.00 0.39 -5.00 107.32 104.26 2bef s GLY 113 Ca 0.00 -1.36 0.00 0.00 0.00 0.00 0.00 44.72 43.36 2bef s GLY 113 CO 0.00 -1.38 0.00 1.55 0.00 0.00 0.00 173.10 173.27 2bef n VAL 114 N -1.32 0.00 -4.98 1.40 3.14 -1.26 -4.25 118.33 111.05 2bef n VAL 114 Ca -0.07 0.00 -0.27 0.00 -2.96 0.00 0.00 64.34 61.03 2bef n VAL 114 Cb 0.58 0.06 -0.15 0.00 -1.06 0.00 0.00 33.84 33.26 2bef n VAL 114 CO 0.00 0.00 0.00 -0.62 -6.46 0.00 0.00 176.83 169.75 2bef s ASP 115 N 0.00 2.52 0.35 6.55 2.15 -1.26 -4.53 116.67 122.45 2bef s ASP 115 Ca 0.00 -0.42 0.03 0.00 0.43 0.00 0.00 52.55 52.59 2bef s ASP 115 Cb 0.00 -0.27 0.65 0.00 -0.30 0.00 0.00 42.92 43.00 2bef s ASP 115 CO 0.00 0.24 1.99 0.58 -0.17 0.00 0.00 175.17 177.81 2bef h VAL 116 N 4.55 1.12 0.00 1.11 2.07 -1.96 -1.86 116.25 121.28 2bef h VAL 116 Ca -0.40 -0.29 0.00 0.00 0.82 0.00 0.00 66.70 66.82 2bef h VAL 116 Cb 1.14 0.19 0.00 0.00 -1.52 0.00 0.00 31.29 31.10 2bef h VAL 116 CO 0.47 0.16 0.00 0.61 0.02 0.00 0.00 177.57 178.83 2bef n GLY 117 N -1.44 -1.60 2.44 2.17 0.00 -1.26 -3.87 105.19 101.62 2bef n GLY 117 Ca 0.08 0.01 -0.25 0.00 0.00 0.00 0.00 46.02 45.85 2bef n GLY 117 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2bef n ARG 118 N -2.27 2.09 -1.02 1.61 5.12 -0.71 -4.93 116.66 116.55 2bef n ARG 118 Ca 0.05 -4.25 -0.12 0.00 -1.93 0.00 0.00 57.85 51.60 2bef n ARG 118 Cb 0.38 -1.96 0.23 0.00 -1.16 0.00 0.00 32.46 29.95 2bef n ARG 118 CO 0.00 0.00 0.00 0.27 -1.93 0.00 0.00 177.63 175.97 2bef n ASN 119 N 0.74 3.77 0.00 0.55 0.23 -1.19 -4.14 115.26 115.23 2bef n ASN 119 Ca 0.28 -3.50 0.00 0.00 -0.53 0.00 0.00 54.58 50.82 2bef n ASN 119 Cb 0.46 -0.75 0.00 0.00 -2.08 0.00 0.00 39.78 37.41 2bef n ASN 119 CO 0.00 0.00 0.00 -0.38 -0.93 0.00 0.00 177.26 175.95 2bef n ILE 120 N -0.82 0.00 -3.73 1.53 5.41 -1.26 -4.81 119.36 115.68 2bef n ILE 120 Ca 0.46 0.00 -0.13 0.00 1.00 0.00 0.00 62.75 64.08 2bef n ILE 120 Cb 1.40 0.00 -0.08 0.00 -0.71 0.00 0.00 39.64 40.25 2bef n ILE 120 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 176.55 176.04 2bef s ILE 121 N 0.00 0.06 0.01 1.39 2.07 -1.26 -1.04 121.20 122.43 2bef s ILE 121 Ca 0.00 -0.51 0.07 0.00 -1.41 0.00 0.00 60.65 58.80 2bef s ILE 121 Cb 0.00 -0.79 -0.03 0.00 0.13 0.00 0.00 42.46 41.77 2bef s ILE 121 CO 0.00 -0.28 -0.21 -2.28 -1.91 0.00 0.00 174.94 170.26 2bef s HIS 122 N -1.88 2.49 -0.05 3.50 5.65 0.78 -4.89 115.29 120.89 2bef s HIS 122 Ca -0.09 -0.31 -0.02 0.00 0.25 0.00 0.00 55.06 54.89 2bef s HIS 122 Cb -0.03 -1.49 0.04 0.00 -1.18 0.00 0.00 32.58 29.92 2bef s HIS 122 CO 0.01 0.15 0.10 0.20 -0.65 0.00 0.00 174.74 174.55 2bef s GLY 123 N -1.07 0.05 0.41 1.59 0.00 -1.26 -0.48 107.32 106.55 2bef s GLY 123 Ca 0.12 0.49 -0.23 0.00 0.00 0.00 0.00 44.72 45.10 2bef s GLY 123 CO 0.02 0.98 0.69 1.44 0.00 0.00 0.00 173.10 176.23 2bef n SER 124 N 4.40 -0.23 -0.16 1.64 7.64 -0.66 -4.93 113.62 121.31 2bef n SER 124 Ca -0.23 0.96 0.11 0.00 1.01 0.00 0.00 58.87 60.72 2bef n SER 124 Cb 0.51 -1.18 0.10 0.00 -1.01 0.00 0.00 64.21 62.63 2bef n SER 124 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 2bef n ASP 125 N 1.06 1.11 -3.58 6.43 5.68 -1.26 -4.83 116.55 121.16 2bef n ASP 125 Ca 0.11 -0.90 -0.09 0.00 -0.50 0.00 0.00 54.79 53.41 2bef n ASP 125 Cb 0.39 0.51 -0.02 0.00 -1.14 0.00 0.00 41.12 40.86 2bef n ASP 125 CO 0.00 0.00 0.00 -0.94 -1.33 0.00 0.00 177.20 174.93 2bef s SER 126 N -2.78 -0.41 0.21 -1.12 1.04 -1.26 -4.95 113.70 104.43 2bef s SER 126 Ca 0.14 -0.19 -0.10 0.00 0.48 0.00 0.00 55.95 56.28 2bef s SER 126 Cb 0.18 0.58 0.17 0.00 0.10 0.00 0.00 66.02 67.04 2bef s SER 126 CO 0.69 -0.99 1.87 0.58 0.98 0.00 0.00 173.24 176.37 2bef h VAL 127 N 2.00 1.16 -0.60 5.02 2.07 -1.94 0.22 116.25 124.18 2bef h VAL 127 Ca -0.27 -0.33 -0.03 0.00 0.82 0.00 0.00 66.70 66.89 2bef h VAL 127 Cb 1.27 0.11 -0.03 0.00 -1.52 0.00 0.00 31.29 31.12 2bef h VAL 127 CO 0.32 0.18 0.25 -0.33 0.02 0.00 0.00 177.57 178.00 2bef h GLU 128 N 0.96 0.86 -0.35 1.57 3.07 -1.98 -0.80 114.58 117.91 2bef h GLU 128 Ca 0.28 -0.13 -0.15 0.00 -0.50 0.00 0.00 59.36 58.86 2bef h GLU 128 Cb -0.06 -0.16 -0.00 0.00 -0.84 0.00 0.00 28.75 27.69 2bef h GLU 128 CO -0.08 0.69 -0.37 0.77 -1.40 0.00 0.00 179.01 178.62 2bef h SER 129 N 0.85 0.93 0.06 1.42 0.02 -1.68 -3.04 113.55 112.11 2bef h SER 129 Ca 0.21 -0.47 -0.00 0.00 -0.84 0.00 0.00 61.79 60.68 2bef h SER 129 Cb 0.14 -0.26 0.00 0.00 0.14 0.00 0.00 62.40 62.42 2bef h SER 129 CO -0.02 1.22 -0.03 0.00 -1.14 0.00 0.00 176.83 176.85 2bef h ALA 130 N 0.74 -0.08 -0.17 3.77 0.00 0.03 -0.45 119.26 123.11 2bef h ALA 130 Ca 0.05 -0.05 0.05 0.00 0.00 0.00 0.00 54.91 54.97 2bef h ALA 130 Cb 0.96 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.78 2bef h ALA 130 CO 0.09 -0.52 0.16 -0.91 0.00 0.00 0.00 179.25 178.07 2bef h ASN 131 N -0.14 0.00 0.18 0.00 2.35 -1.23 0.19 115.58 116.92 2bef h ASN 131 Ca -0.01 0.00 -0.33 0.00 -0.55 0.00 0.00 56.30 55.41 2bef h ASN 131 Cb 0.12 0.00 0.01 0.00 0.05 0.00 0.00 38.32 38.50 2bef h ASN 131 CO 0.01 0.00 -1.64 -0.09 -1.65 0.00 0.00 177.43 174.06 2bef h ARG 132 N 0.00 0.38 -0.14 0.81 2.43 -1.34 -3.24 114.38 113.28 2bef h ARG 132 Ca 0.08 -0.65 -0.18 0.00 -0.81 0.00 0.00 59.98 58.42 2bef h ARG 132 Cb 0.40 0.24 -0.00 0.00 -0.42 0.00 0.00 29.97 30.19 2bef h ARG 132 CO -0.00 1.31 -0.65 0.93 -1.51 0.00 0.00 179.97 180.05 2bef h GLU 133 N 0.02 0.54 -0.02 0.20 5.08 -0.52 -2.21 114.58 117.67 2bef h GLU 133 Ca -0.32 -0.39 -0.00 0.00 -1.00 0.00 0.00 59.36 57.64 2bef h GLU 133 Cb 2.03 0.07 -0.00 0.00 0.50 0.00 0.00 28.75 31.34 2bef h GLU 133 CO 0.16 1.01 0.01 0.82 -1.00 0.00 0.00 179.01 180.01 2bef h ILE 134 N 0.39 1.13 0.00 3.13 2.04 -0.80 -1.23 117.51 122.17 2bef h ILE 134 Ca -0.02 -0.37 -0.02 0.00 1.00 0.00 0.00 64.86 65.46 2bef h ILE 134 Cb 1.22 1.34 -0.00 0.00 -0.74 0.00 0.00 36.82 38.64 2bef h ILE 134 CO 0.12 0.10 -0.07 0.00 0.00 0.00 0.00 178.15 178.30 2bef h ALA 135 N 0.86 1.24 0.11 1.87 0.00 -1.60 -0.11 119.26 121.62 2bef h ALA 135 Ca 0.01 -0.07 -0.21 0.00 0.00 0.00 0.00 54.91 54.64 2bef h ALA 135 Cb 0.15 -0.01 0.02 0.00 0.00 0.00 0.00 17.79 17.95 2bef h ALA 135 CO -0.00 0.09 -0.89 1.25 0.00 0.00 0.00 179.25 179.70 2bef h LEU 136 N 0.00 0.60 0.00 0.00 7.12 -0.81 -3.39 115.31 118.83 2bef h LEU 136 Ca -0.00 -0.87 -0.10 0.00 0.13 0.00 0.00 57.88 57.04 2bef h LEU 136 Cb 0.26 -0.19 -0.02 0.00 -0.53 0.00 0.00 40.66 40.18 2bef h LEU 136 CO 0.01 1.41 -1.54 0.79 -0.13 0.00 0.00 178.44 178.98 2bef n TRP 137 N -4.06 0.64 -5.08 1.25 7.02 -0.52 -4.93 117.44 111.77 2bef n TRP 137 Ca -0.13 0.20 -0.30 0.00 -1.02 0.00 0.00 57.50 56.25 2bef n TRP 137 Cb 0.83 -0.90 -0.17 0.00 -2.42 0.00 0.00 31.31 28.65 2bef n TRP 137 CO 0.00 0.00 0.00 -0.06 -2.02 0.00 0.00 177.69 175.61 2bef s PHE 138 N -3.15 2.31 0.54 -5.99 0.40 -0.07 -5.10 117.98 106.91 2bef s PHE 138 Ca -0.04 -0.93 -0.19 0.00 -0.60 0.00 0.00 56.93 55.18 2bef s PHE 138 Cb 0.10 -1.56 -0.06 0.00 0.51 0.00 0.00 43.02 42.01 2bef s PHE 138 CO 0.83 -0.38 1.07 0.15 0.70 0.00 0.00 175.22 177.58 2bef s LYS 139 N 0.40 3.51 0.44 0.44 -0.14 -1.26 -4.48 119.74 118.65 2bef s LYS 139 Ca -0.18 1.38 0.21 0.00 -1.36 0.00 0.00 55.97 56.01 2bef s LYS 139 Cb -0.17 -2.05 1.16 0.00 -1.68 0.00 0.00 37.83 35.09 2bef s LYS 139 CO 0.08 -0.68 1.84 -1.35 -0.76 0.00 0.00 175.35 174.48 2bef h PRO 140 N 1.08 0.32 0.00 -1.68 0.11 -1.95 -2.69 132.00 127.19 2bef h PRO 140 Ca -0.49 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.60 2bef h PRO 140 Cb 1.23 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.27 2bef h PRO 140 CO 0.58 0.21 0.00 -0.85 -0.21 0.00 0.00 178.00 177.73 2bef n GLU 141 N -4.49 0.68 -0.02 1.05 0.00 -1.26 -3.07 120.64 113.54 2bef n GLU 141 Ca 0.21 0.01 0.13 0.00 0.00 0.00 0.00 57.16 57.51 2bef n GLU 141 Cb 0.80 -1.50 0.32 0.00 0.00 0.00 0.00 31.44 31.06 2bef n GLU 141 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.13 177.52 2bef n GLU 142 N -1.11 2.00 -4.81 3.44 1.02 -1.02 -4.89 120.64 115.28 2bef n GLU 142 Ca 0.18 -1.46 -0.33 0.00 -0.02 0.00 0.00 57.16 55.53 2bef n GLU 142 Cb 0.14 -1.47 -0.14 0.00 -0.02 0.00 0.00 31.44 29.95 2bef n GLU 142 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2bef s LEU 143 N -1.94 2.77 0.57 -4.62 1.43 -1.17 -4.52 118.68 111.19 2bef s LEU 143 Ca 0.33 -0.25 -0.19 0.00 -1.03 0.00 0.00 54.13 53.00 2bef s LEU 143 Cb 0.20 -1.60 -0.05 0.00 0.03 0.00 0.00 46.19 44.78 2bef s LEU 143 CO 0.31 0.25 1.15 -0.76 0.23 0.00 0.00 176.35 177.54 2bef s LEU 144 N -0.18 3.70 -0.20 1.79 1.43 -0.02 -4.96 118.68 120.24 2bef s LEU 144 Ca 0.00 2.24 -0.07 0.00 -1.03 0.00 0.00 54.13 55.27 2bef s LEU 144 Cb -0.13 -4.59 -0.09 0.00 0.03 0.00 0.00 46.19 41.41 2bef s LEU 144 CO 0.03 -1.37 -0.23 0.35 0.23 0.00 0.00 176.35 175.36 2bef n THR 145 N -1.46 1.08 -3.08 5.49 -2.24 -1.26 -4.82 114.28 107.99 2bef n THR 145 Ca 0.12 -0.30 -0.44 0.00 -2.27 0.00 0.00 64.05 61.15 2bef n THR 145 Cb 0.51 -1.63 -0.05 0.00 -2.10 0.00 0.00 70.33 67.06 2bef n THR 145 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2bef s GLU 146 N -2.36 3.06 -0.03 -0.78 2.02 -1.26 -5.03 118.70 114.32 2bef s GLU 146 Ca -0.27 -1.19 -0.16 0.00 0.02 0.00 0.00 54.97 53.37 2bef s GLU 146 Cb 0.10 -4.24 -0.05 0.00 0.10 0.00 0.00 34.13 30.03 2bef s GLU 146 CO 0.36 -1.55 0.43 0.08 0.02 0.00 0.00 175.26 174.61 2bef s VAL 147 N 2.90 5.06 -0.39 2.63 1.01 -1.26 -5.07 120.40 125.27 2bef s VAL 147 Ca 0.14 0.89 0.03 0.00 0.00 0.00 0.00 61.98 63.03 2bef s VAL 147 Cb -0.22 -3.75 0.11 0.00 0.00 0.00 0.00 36.38 32.52 2bef s VAL 147 CO 0.07 0.50 0.12 -0.54 0.00 0.00 0.00 175.10 175.26 2bef s LYS 148 N -0.57 1.48 0.14 2.72 3.01 -1.26 -5.12 119.74 120.14 2bef s LYS 148 Ca 0.24 -1.96 -0.08 0.00 -1.01 0.00 0.00 55.97 53.17 2bef s LYS 148 Cb -0.16 -2.99 -0.06 0.00 -1.01 0.00 0.00 37.83 33.60 2bef s LYS 148 CO 0.13 -1.01 0.43 -1.25 0.51 0.00 0.00 175.35 174.16 2bef s PRO 149 N 0.67 3.72 0.03 -1.68 0.04 -1.26 -5.01 135.00 131.50 2bef s PRO 149 Ca 0.13 0.10 -0.39 0.00 0.04 0.00 0.00 61.00 60.87 2bef s PRO 149 Cb -0.21 -2.85 -0.19 0.00 0.04 0.00 0.00 34.50 31.30 2bef s PRO 149 CO -0.08 0.46 1.15 -1.71 0.04 0.00 0.00 177.00 176.86 2bef n ASN 150 N 0.30 0.48 0.00 6.66 2.85 -1.26 -4.75 115.26 119.53 2bef n ASN 150 Ca -0.03 1.15 0.02 0.00 -0.11 0.00 0.00 54.58 55.60 2bef n ASN 150 Cb 0.52 -1.00 0.12 0.00 1.24 0.00 0.00 39.78 40.66 2bef n ASN 150 CO 0.00 0.00 0.00 -0.81 -2.11 0.00 0.00 177.26 174.34 2bef n PRO 151 N 1.80 0.28 -0.03 1.20 -0.04 -1.26 -1.90 135.00 135.05 2bef n PRO 151 Ca 0.19 0.00 0.07 0.00 -0.04 0.00 0.00 63.50 63.73 2bef n PRO 151 Cb 0.11 -1.23 0.08 0.00 -0.04 0.00 0.00 33.50 32.42 2bef n PRO 151 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 2bef n ASN 152 N -0.73 2.30 0.04 3.54 3.02 -1.26 -4.60 115.26 117.56 2bef n ASN 152 Ca 0.03 -1.64 -0.08 0.00 -0.03 0.00 0.00 54.58 52.86 2bef n ASN 152 Cb 0.01 -0.04 -0.13 0.00 -0.61 0.00 0.00 39.78 39.02 2bef n ASN 152 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 2bef h LEU 153 N 2.76 0.03 -8.89 3.41 3.38 -1.72 -3.47 115.31 110.80 2bef h LEU 153 Ca 0.00 -0.04 -0.53 0.00 0.09 0.00 0.00 57.88 57.39 2bef h LEU 153 Cb 0.61 -0.01 -0.17 0.00 0.09 0.00 0.00 40.66 41.18 2bef h LEU 153 CO 0.00 1.04 -0.78 -0.31 0.09 0.00 0.00 178.44 178.48 2bef s TYR 154 N -2.67 1.90 -2.29 1.13 2.02 -1.26 -5.14 117.35 111.03 2bef s TYR 154 Ca -0.01 -0.46 0.30 0.00 -0.37 0.00 0.00 57.07 56.52 2bef s TYR 154 Cb 0.09 -0.92 1.41 0.00 -0.40 0.00 0.00 41.96 42.14 2bef s TYR 154 CO 0.83 0.39 1.95 -1.91 -1.57 0.00 0.00 175.55 175.23