#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yua n ASN 2 N 0.00 0.00 0.00 3.17 0.23 -1.26 -5.12 115.26 112.28 1yua n ASN 2 Ca 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 54.05 1yua n ASN 2 Cb 0.00 0.05 0.00 0.00 -2.08 0.00 0.00 39.78 37.75 1yua n ASN 2 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1yua n GLY 3 N 0.97 1.54 3.52 4.83 0.00 -1.26 -4.70 105.19 110.08 1yua n GLY 3 Ca 0.00 -0.40 -0.06 0.00 0.00 0.00 0.00 46.02 45.56 1yua n GLY 3 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1yua s GLU 4 N 0.00 0.56 -0.38 1.61 2.02 -1.26 -5.07 118.70 116.18 1yua s GLU 4 Ca 0.00 1.18 0.12 0.00 0.02 0.00 0.00 54.97 56.28 1yua s GLU 4 Cb 0.00 0.34 0.35 0.00 0.10 0.00 0.00 34.13 34.92 1yua s GLU 4 CO 0.00 -0.18 0.79 1.33 0.02 0.00 0.00 175.26 177.22 1yua n VAL 5 N 4.77 -0.10 -2.01 2.63 0.24 -1.26 -4.98 118.33 117.62 1yua n VAL 5 Ca -0.17 -4.14 -0.01 0.00 -2.04 0.00 0.00 64.34 57.98 1yua n VAL 5 Cb 0.54 -0.01 0.00 0.00 -1.47 0.00 0.00 33.84 32.91 1yua n VAL 5 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1yua n ALA 6 N 0.27 -2.41 -0.19 2.33 0.00 -1.26 -4.92 120.51 114.33 1yua n ALA 6 Ca 0.22 0.20 0.00 0.00 0.00 0.00 0.00 53.44 53.86 1yua n ALA 6 Cb 0.67 -0.91 0.09 0.00 0.00 0.00 0.00 19.45 19.30 1yua n ALA 6 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1yua h PRO 7 N 0.42 0.16 0.00 0.00 0.11 -1.99 -3.35 132.00 127.35 1yua h PRO 7 Ca 0.00 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.10 1yua h PRO 7 Cb 0.68 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 31.76 1yua h PRO 7 CO 0.09 0.11 0.00 -0.35 -0.21 0.00 0.00 178.00 177.63 1yua n PRO 8 N -5.21 0.00 0.00 1.05 -0.04 -1.26 -5.05 135.00 124.49 1yua n PRO 8 Ca 0.08 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.54 1yua n PRO 8 Cb 0.32 -0.08 0.00 0.00 -0.04 0.00 0.00 33.50 33.71 1yua n PRO 8 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1yua n LYS 9 N 0.00 0.00 0.00 0.54 4.01 -1.26 -5.08 118.16 116.37 1yua n LYS 9 Ca 0.00 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.80 1yua n LYS 9 Cb 0.00 0.00 0.00 0.00 -0.51 0.00 0.00 35.03 34.52 1yua n LYS 9 CO 0.00 0.00 0.00 0.39 -1.11 0.00 0.00 177.40 176.68 1yua n GLU 10 N -0.07 0.00 -3.94 1.97 -0.58 -1.26 -4.75 120.64 112.02 1yua n GLU 10 Ca 0.00 0.00 -0.41 0.00 -0.42 0.00 0.00 57.16 56.33 1yua n GLU 10 Cb 0.00 -0.32 0.03 0.00 -0.57 0.00 0.00 31.44 30.57 1yua n GLU 10 CO 0.00 0.00 0.00 -3.47 -0.48 0.00 0.00 177.13 173.18 1yua n ASP 11 N -1.43 -4.58 -2.53 1.62 2.03 -1.26 -4.86 116.55 105.55 1yua n ASP 11 Ca 0.00 -1.19 -0.08 0.00 0.52 0.00 0.00 54.79 54.04 1yua n ASP 11 Cb 0.00 -2.17 0.05 0.00 -0.72 0.00 0.00 41.12 38.28 1yua n ASP 11 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 1yua n PRO 12 N -4.60 -0.32 -3.82 -0.67 -0.04 -1.26 -5.02 135.00 119.27 1yua n PRO 12 Ca -0.12 -0.57 -0.31 0.00 -0.04 0.00 0.00 63.50 62.46 1yua n PRO 12 Cb 0.58 -0.36 -0.10 0.00 -0.04 0.00 0.00 33.50 33.57 1yua n PRO 12 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1yua s VAL 13 N -1.74 3.36 -0.02 0.52 1.01 -0.84 -4.90 120.40 117.79 1yua s VAL 13 Ca 0.20 -3.98 -0.38 0.00 0.00 0.00 0.00 61.98 57.83 1yua s VAL 13 Cb -0.01 -3.17 -0.16 0.00 0.00 0.00 0.00 36.38 33.04 1yua s VAL 13 CO 0.14 -1.00 1.45 -2.65 0.00 0.00 0.00 175.10 173.04 1yua n PRO 14 N 2.29 1.12 -2.44 2.72 -0.02 -1.26 -1.62 135.00 135.78 1yua n PRO 14 Ca 0.18 0.41 -0.27 0.00 -2.02 0.00 0.00 63.50 61.79 1yua n PRO 14 Cb 0.35 -2.06 0.00 0.00 -0.02 0.00 0.00 33.50 31.78 1yua n PRO 14 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1yua n LEU 15 N 3.31 4.83 -0.14 2.45 4.77 -0.49 -4.85 117.00 126.88 1yua n LEU 15 Ca 0.21 -5.19 0.21 0.00 -0.03 0.00 0.00 56.01 51.21 1yua n LEU 15 Cb 0.17 -0.48 0.32 0.00 -2.33 0.00 0.00 43.42 41.10 1yua n LEU 15 CO 0.68 2.22 0.99 -2.65 -1.33 0.00 0.00 177.39 177.29 1yua n PRO 16 N -0.49 0.01 0.00 3.23 -0.02 -1.26 0.61 135.00 137.08 1yua n PRO 16 Ca 0.40 0.81 0.00 0.00 -2.02 0.00 0.00 63.50 62.69 1yua n PRO 16 Cb 0.65 -2.03 0.00 0.00 -0.02 0.00 0.00 33.50 32.10 1yua n PRO 16 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 1yua n GLU 17 N -2.79 0.93 -3.29 -0.52 2.13 -1.26 -4.25 120.64 111.59 1yua n GLU 17 Ca 0.17 0.00 -0.19 0.00 0.66 0.00 0.00 57.16 57.80 1yua n GLU 17 Cb 1.20 -1.39 -0.07 0.00 0.27 0.00 0.00 31.44 31.44 1yua n GLU 17 CO 0.00 0.00 0.00 -1.17 -0.41 0.00 0.00 177.13 175.55 1yua s LEU 18 N 0.00 0.25 0.23 4.31 2.96 0.20 -5.03 118.68 121.60 1yua s LEU 18 Ca 0.00 -2.11 -0.30 0.00 -0.22 0.00 0.00 54.13 51.50 1yua s LEU 18 Cb 0.00 0.39 -0.15 0.00 0.50 0.00 0.00 46.19 46.93 1yua s LEU 18 CO 0.00 -0.20 0.96 -2.65 -1.32 0.00 0.00 176.35 173.14 1yua n PRO 19 N 3.59 0.99 0.00 0.98 -0.02 -1.26 -1.21 135.00 138.08 1yua n PRO 19 Ca 0.18 0.35 0.00 0.00 -2.02 0.00 0.00 63.50 62.01 1yua n PRO 19 Cb 0.47 -1.69 0.00 0.00 -0.02 0.00 0.00 33.50 32.26 1yua n PRO 19 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1yua n GLU 21 N 0.00 0.00 -0.64 0.00 2.13 -1.26 -4.64 120.64 116.22 1yua n GLU 21 Ca 0.00 0.73 -0.03 0.00 0.66 0.00 0.00 57.16 58.52 1yua n GLU 21 Cb 0.00 -1.39 -0.03 0.00 0.27 0.00 0.00 31.44 30.29 1yua n GLU 21 CO 0.00 0.00 0.00 1.17 -0.41 0.00 0.00 177.13 177.89 1yua n LYS 22 N -2.28 0.00 0.00 5.31 3.00 -1.26 -5.14 118.16 117.79 1yua n LYS 22 Ca 0.00 -0.40 0.00 0.00 -0.00 0.00 0.00 58.31 57.91 1yua n LYS 22 Cb 0.00 0.26 0.00 0.00 0.00 0.00 0.00 35.03 35.29 1yua n LYS 22 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 1yua n SER 23 N 0.00 0.92 -1.67 3.14 2.88 -1.26 -4.98 113.62 112.65 1yua n SER 23 Ca -0.11 0.00 -0.13 0.00 -1.33 0.00 0.00 58.87 57.30 1yua n SER 23 Cb 0.49 0.00 0.08 0.00 -0.75 0.00 0.00 64.21 64.03 1yua n SER 23 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 1yua n ASP 24 N 0.00 4.09 -4.44 -3.46 8.00 -1.26 -4.65 116.55 114.83 1yua n ASP 24 Ca 0.00 -2.85 -0.19 0.00 0.71 0.00 0.00 54.79 52.46 1yua n ASP 24 Cb 0.00 -0.76 0.03 0.00 -0.02 0.00 0.00 41.12 40.38 1yua n ASP 24 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1yua n ALA 25 N -0.15 0.90 -3.00 2.24 0.00 -1.26 -4.99 120.51 114.24 1yua n ALA 25 Ca 0.29 -1.82 0.00 0.00 0.00 0.00 0.00 53.44 51.92 1yua n ALA 25 Cb 0.96 0.61 0.00 0.00 0.00 0.00 0.00 19.45 21.02 1yua n ALA 25 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.50 179.98 1yua n TYR 26 N -1.85 -0.27 -3.46 0.00 4.11 -1.26 -1.65 117.16 112.77 1yua n TYR 26 Ca 0.07 0.00 -0.42 0.00 -0.00 0.00 0.00 57.90 57.54 1yua n TYR 26 Cb 0.52 0.00 -0.03 0.00 -0.00 0.00 0.00 39.34 39.82 1yua n TYR 26 CO 0.00 0.00 0.00 -0.06 -0.00 0.00 0.00 176.86 176.80 1yua s PHE 27 N -3.91 3.91 -0.76 -3.48 0.40 -0.35 -1.33 117.98 112.47 1yua s PHE 27 Ca 0.00 -2.56 -0.26 0.00 -0.60 0.00 0.00 56.93 53.51 1yua s PHE 27 Cb 0.00 -3.61 0.04 0.00 0.51 0.00 0.00 43.02 39.96 1yua s PHE 27 CO 0.00 -0.90 1.27 0.08 0.70 0.00 0.00 175.22 176.37 1yua s VAL 28 N -0.68 3.79 -0.58 -0.44 1.01 -0.51 -1.40 120.40 121.59 1yua s VAL 28 Ca 0.24 0.23 -0.40 0.00 0.00 0.00 0.00 61.98 62.05 1yua s VAL 28 Cb -0.11 -4.91 -0.18 0.00 0.00 0.00 0.00 36.38 31.17 1yua s VAL 28 CO -0.09 -1.83 2.27 -0.11 0.00 0.00 0.00 175.10 175.34 1yua n LEU 29 N 9.18 0.87 -4.93 3.92 0.00 -0.64 -3.40 117.00 122.01 1yua n LEU 29 Ca 0.05 0.51 -0.25 0.00 0.00 0.00 0.00 56.01 56.32 1yua n LEU 29 Cb 0.49 -0.97 -0.03 0.00 0.00 0.00 0.00 43.42 42.91 1yua n LEU 29 CO 0.70 -0.77 -0.10 -0.13 0.00 0.00 0.00 177.39 177.08 1yua s ARG 30 N 6.70 3.37 -0.28 1.96 0.52 0.83 -1.99 118.95 130.06 1yua s ARG 30 Ca 1.21 -0.66 0.00 0.00 -0.52 0.00 0.00 55.73 55.77 1yua s ARG 30 Cb -1.34 -2.91 0.05 0.00 0.52 0.00 0.00 34.95 31.27 1yua s ARG 30 CO 0.59 0.50 -0.05 0.16 0.02 0.00 0.00 175.30 176.53 1yua s ASP 31 N -3.33 4.71 0.00 0.23 -4.77 -1.26 -1.07 116.67 111.17 1yua s ASP 31 Ca 0.34 -1.33 0.00 0.00 -3.30 0.00 0.00 52.55 48.26 1yua s ASP 31 Cb -0.11 -1.65 0.00 0.00 -1.09 0.00 0.00 42.92 40.08 1yua s ASP 31 CO 0.28 -0.23 0.00 0.61 0.70 0.00 0.00 175.17 176.53 1yua n GLY 32 N 4.54 0.89 5.76 2.12 0.00 0.90 -4.96 105.19 114.44 1yua n GLY 32 Ca -0.13 -0.73 0.00 0.00 0.00 0.00 0.00 46.02 45.15 1yua n GLY 32 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yua n ALA 33 N -3.00 0.00 0.00 4.61 0.00 -1.26 -1.48 120.51 119.38 1yua n ALA 33 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1yua n ALA 33 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1yua n ALA 33 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1yua n ALA 34 N 5.87 1.80 -2.00 0.00 0.00 -1.26 -5.10 120.51 119.82 1yua n ALA 34 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1yua n ALA 34 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1yua n ALA 34 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1yua n GLY 35 N 2.06 0.28 3.66 0.00 0.00 -0.55 -4.96 105.19 105.68 1yua n GLY 35 Ca 0.00 0.51 -0.25 0.00 0.00 0.00 0.00 46.02 46.28 1yua n GLY 35 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1yua s VAL 36 N 2.46 2.48 -0.01 1.61 0.11 -1.26 -0.07 120.40 125.72 1yua s VAL 36 Ca 0.00 -1.90 -0.26 0.00 -2.93 0.00 0.00 61.98 56.88 1yua s VAL 36 Cb 0.00 -2.87 0.09 0.00 -1.53 0.00 0.00 36.38 32.06 1yua s VAL 36 CO 0.00 -0.13 1.19 2.22 -3.33 0.00 0.00 175.10 175.06 1yua n PHE 37 N -1.03 -0.42 -3.72 1.54 -1.74 -0.23 -4.87 117.46 106.99 1yua n PHE 37 Ca -0.03 -0.71 -0.37 0.00 -0.56 0.00 0.00 57.45 55.78 1yua n PHE 37 Cb 0.63 0.32 -0.10 0.00 1.52 0.00 0.00 39.48 41.86 1yua n PHE 37 CO 0.00 0.00 0.00 -0.51 -0.56 0.00 0.00 176.76 175.69 1yua s LEU 38 N 0.00 5.26 0.23 5.98 1.02 -1.09 -0.12 118.68 129.95 1yua s LEU 38 Ca 0.28 -2.74 -0.12 0.00 0.02 0.00 0.00 54.13 51.57 1yua s LEU 38 Cb -0.01 -1.86 -0.07 0.00 0.02 0.00 0.00 46.19 44.27 1yua s LEU 38 CO -0.00 -0.40 0.58 0.00 0.02 0.00 0.00 176.35 176.56 1yua s ALA 39 N 0.11 3.52 0.35 4.21 0.00 -1.22 -3.84 121.76 124.90 1yua s ALA 39 Ca 0.16 -0.18 -0.27 0.00 0.00 0.00 0.00 51.96 51.67 1yua s ALA 39 Cb -0.21 -2.52 -0.09 0.00 0.00 0.00 0.00 23.12 20.31 1yua s ALA 39 CO -0.03 0.46 1.19 0.00 0.00 0.00 0.00 175.76 177.38 1yua s ALA 40 N -1.76 3.30 -1.48 0.00 0.00 -1.25 -1.42 121.76 119.15 1yua s ALA 40 Ca 0.46 1.02 0.16 0.00 0.00 0.00 0.00 51.96 53.61 1yua s ALA 40 Cb -0.12 -3.39 0.82 0.00 0.00 0.00 0.00 23.12 20.43 1yua s ALA 40 CO 0.20 -0.46 1.45 -1.71 0.00 0.00 0.00 175.76 175.24 1yua n ASN 41 N 0.54 0.00 -0.85 0.00 2.85 -0.44 -1.68 115.26 115.67 1yua n ASN 41 Ca 0.02 0.01 0.12 0.00 -0.11 0.00 0.00 54.58 54.62 1yua n ASN 41 Cb 0.45 -0.26 0.17 0.00 1.24 0.00 0.00 39.78 41.38 1yua n ASN 41 CO 0.00 0.00 0.00 0.35 -2.11 0.00 0.00 177.26 175.50 1yua n THR 42 N -1.26 0.00 -1.29 -0.44 -2.24 -1.26 -4.93 114.28 102.86 1yua n THR 42 Ca 0.08 -0.44 -0.43 0.00 -2.27 0.00 0.00 64.05 60.98 1yua n THR 42 Cb 0.12 1.31 -0.02 0.00 -2.10 0.00 0.00 70.33 69.64 1yua n THR 42 CO 0.00 0.00 0.00 0.33 -0.57 0.00 0.00 175.07 174.83 1yua n PHE 43 N 1.07 -0.90 1.19 4.78 -0.00 -0.68 -0.69 117.46 122.23 1yua n PHE 43 Ca 0.15 0.82 0.14 0.00 -0.00 0.00 0.00 57.45 58.56 1yua n PHE 43 Cb 0.55 -1.79 0.66 0.00 -0.00 0.00 0.00 39.48 38.89 1yua n PHE 43 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 176.76 176.41 1yua n PRO 44 N 1.03 0.20 -0.44 -7.13 -0.04 -1.26 -4.81 135.00 122.56 1yua n PRO 44 Ca 0.15 -0.01 0.40 0.00 -0.04 0.00 0.00 63.50 64.00 1yua n PRO 44 Cb 0.28 -1.50 0.67 0.00 -0.04 0.00 0.00 33.50 32.90 1yua n PRO 44 CO 0.00 0.00 0.00 -0.22 -0.04 0.00 0.00 175.50 175.24 1yua h LYS 45 N 0.03 0.00 -3.57 0.54 3.64 -1.30 -3.09 116.57 112.82 1yua h LYS 45 Ca 0.00 0.00 -0.60 0.00 -1.27 0.00 0.00 60.65 58.78 1yua h LYS 45 Cb 0.41 0.00 -0.40 0.00 -0.41 0.00 0.00 32.23 31.83 1yua h LYS 45 CO 0.00 0.00 -0.75 -1.12 -2.27 0.00 0.00 179.45 175.31 1yua s SER 46 N -3.91 4.04 -0.24 4.20 0.01 -1.25 -4.89 113.70 111.66 1yua s SER 46 Ca -0.04 -1.92 0.01 0.00 1.31 0.00 0.00 55.95 55.31 1yua s SER 46 Cb 0.21 -1.00 0.31 0.00 0.21 0.00 0.00 66.02 65.75 1yua s SER 46 CO 0.71 -0.38 1.56 0.54 0.41 0.00 0.00 173.24 176.08 1yua n ARG 47 N 4.48 1.65 -1.34 12.44 1.74 -1.17 -3.85 116.66 130.61 1yua n ARG 47 Ca 0.01 -1.49 -0.23 0.00 -0.77 0.00 0.00 57.85 55.37 1yua n ARG 47 Cb 0.40 -1.58 -0.09 0.00 -1.02 0.00 0.00 32.46 30.16 1yua n ARG 47 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 1yua n GLU 48 N -0.18 2.44 -3.94 5.56 4.71 -1.26 -4.88 120.64 123.08 1yua n GLU 48 Ca 0.30 -1.93 -0.35 0.00 -0.01 0.00 0.00 57.16 55.16 1yua n GLU 48 Cb 0.98 -2.15 -0.11 0.00 -1.01 0.00 0.00 31.44 29.15 1yua n GLU 48 CO 0.00 0.00 0.00 0.95 0.09 0.00 0.00 177.13 178.17 1yua s THR 49 N -0.86 4.55 0.00 2.62 -4.23 -1.25 -4.54 115.64 111.92 1yua s THR 49 Ca 0.62 -0.11 0.00 0.00 -1.18 0.00 0.00 61.69 61.02 1yua s THR 49 Cb 0.34 -3.08 0.00 0.00 1.34 0.00 0.00 72.50 71.10 1yua s THR 49 CO -0.13 0.41 0.00 -1.14 -0.54 0.00 0.00 174.62 173.22 1yua n ARG 50 N 4.13 0.00 -2.66 3.99 0.63 -1.25 -4.90 116.66 116.60 1yua n ARG 50 Ca -0.16 0.00 -0.41 0.00 -0.92 0.00 0.00 57.85 56.36 1yua n ARG 50 Cb 0.52 0.00 -0.05 0.00 0.45 0.00 0.00 32.46 33.38 1yua n ARG 50 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1yua s ALA 51 N -1.00 3.33 -0.22 5.13 0.00 -1.26 -2.68 121.76 125.05 1yua s ALA 51 Ca 0.00 0.69 -0.27 0.00 0.00 0.00 0.00 51.96 52.37 1yua s ALA 51 Cb 0.00 -3.28 0.00 0.00 0.00 0.00 0.00 23.12 19.85 1yua s ALA 51 CO 0.00 0.01 0.96 -1.25 0.00 0.00 0.00 175.76 175.48 1yua s PRO 52 N -0.71 4.25 0.10 0.00 0.04 -1.26 -4.72 135.00 132.70 1yua s PRO 52 Ca 0.45 1.22 -0.36 0.00 0.04 0.00 0.00 61.00 62.35 1yua s PRO 52 Cb -0.27 -3.63 -0.17 0.00 0.04 0.00 0.00 34.50 30.47 1yua s PRO 52 CO 0.33 -0.56 1.16 -0.11 0.04 0.00 0.00 177.00 177.87 1yua n LEU 53 N 6.07 1.00 0.02 -3.56 -0.00 -1.26 -2.64 117.00 116.63 1yua n LEU 53 Ca 0.09 1.14 0.22 0.00 -0.00 0.00 0.00 56.01 57.46 1yua n LEU 53 Cb 0.47 -1.11 0.73 0.00 -0.00 0.00 0.00 43.42 43.50 1yua n LEU 53 CO 0.50 -1.47 1.19 0.58 -0.00 0.00 0.00 177.39 178.20 1yua h VAL 54 N 2.89 0.51 -0.16 1.96 2.07 -1.75 0.71 116.25 122.48 1yua h VAL 54 Ca -0.46 0.00 -0.11 0.00 0.82 0.00 0.00 66.70 66.95 1yua h VAL 54 Cb 1.37 0.66 0.00 0.00 -1.52 0.00 0.00 31.29 31.80 1yua h VAL 54 CO 0.71 0.00 -0.32 1.05 0.02 0.00 0.00 177.57 179.03 1yua h GLU 55 N 0.00 0.49 -0.48 1.57 4.11 -1.83 -2.14 114.58 116.31 1yua h GLU 55 Ca 0.25 -0.32 -0.04 0.00 0.07 0.00 0.00 59.36 59.32 1yua h GLU 55 Cb 1.14 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 30.41 1yua h GLU 55 CO -0.00 0.93 0.15 0.93 0.07 0.00 0.00 179.01 181.08 1yua h GLU 56 N 0.12 0.70 -0.09 1.06 3.07 -1.22 -1.39 114.58 116.82 1yua h GLU 56 Ca 0.00 -0.12 -0.09 0.00 -0.50 0.00 0.00 59.36 58.65 1yua h GLU 56 Cb 0.92 -0.12 -0.01 0.00 -0.84 0.00 0.00 28.75 28.70 1yua h GLU 56 CO 0.07 0.61 -0.36 1.25 -1.40 0.00 0.00 179.01 179.18 1yua h LEU 57 N 0.69 0.19 -0.24 1.33 5.85 -1.20 -2.18 115.31 119.74 1yua h LEU 57 Ca 0.16 -0.07 -0.12 0.00 0.84 0.00 0.00 57.88 58.69 1yua h LEU 57 Cb 0.21 -0.05 -0.00 0.00 0.37 0.00 0.00 40.66 41.19 1yua h LEU 57 CO -0.01 0.55 -0.31 0.22 -0.34 0.00 0.00 178.44 178.55 1yua h TYR 58 N 0.16 0.78 0.00 1.25 5.03 -0.59 -2.78 116.97 120.82 1yua h TYR 58 Ca 0.02 -0.25 -0.03 0.00 2.58 0.00 0.00 58.73 61.04 1yua h TYR 58 Cb 0.72 -0.16 -0.00 0.00 1.55 0.00 0.00 36.73 38.84 1yua h TYR 58 CO 0.01 0.99 -0.16 -0.09 -1.32 0.00 0.00 178.16 177.59 1yua h ARG 59 N 0.35 0.00 -0.82 1.82 2.43 -1.14 -0.89 114.38 116.13 1yua h ARG 59 Ca 0.03 0.00 -0.14 0.00 -0.81 0.00 0.00 59.98 59.06 1yua h ARG 59 Cb 0.89 0.00 -0.09 0.00 -0.42 0.00 0.00 29.97 30.35 1yua h ARG 59 CO 0.07 0.16 0.18 1.19 -1.51 0.00 0.00 179.97 180.07 1yua n PHE 60 N -4.02 1.78 -0.03 2.20 3.01 -0.84 -4.33 117.46 115.23 1yua n PHE 60 Ca -0.02 -0.89 -0.02 0.00 1.01 0.00 0.00 57.45 57.53 1yua n PHE 60 Cb 0.25 -0.54 0.24 0.00 -0.01 0.00 0.00 39.48 39.42 1yua n PHE 60 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1yua h ARG 61 N 2.04 0.59 0.00 -1.08 2.47 -0.94 0.63 114.38 118.09 1yua h ARG 61 Ca 0.18 -0.15 0.00 0.00 -1.26 0.00 0.00 59.98 58.75 1yua h ARG 61 Cb 1.87 -0.07 0.00 0.00 -1.65 0.00 0.00 29.97 30.12 1yua h ARG 61 CO 0.53 0.64 0.00 -0.25 0.56 0.00 0.00 179.97 181.45 1yua n ASP 62 N -4.24 0.26 -0.00 7.04 9.92 -1.26 -1.55 116.55 126.72 1yua n ASP 62 Ca 0.02 0.61 0.02 0.00 -0.53 0.00 0.00 54.79 54.90 1yua n ASP 62 Cb 0.28 -0.65 -0.02 0.00 -0.64 0.00 0.00 41.12 40.10 1yua n ASP 62 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 1yua n ARG 63 N -1.83 1.87 -1.50 -1.24 1.74 -0.52 -4.98 116.66 110.20 1yua n ARG 63 Ca -0.00 -0.02 -0.47 0.00 -0.77 0.00 0.00 57.85 56.59 1yua n ARG 63 Cb 0.05 -0.95 -0.06 0.00 -1.02 0.00 0.00 32.46 30.48 1yua n ARG 63 CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00 1yua n LEU 64 N -1.45 2.44 0.00 0.55 0.00 0.10 -4.85 117.00 113.79 1yua n LEU 64 Ca -0.00 0.25 0.00 0.00 0.00 0.00 0.00 56.01 56.26 1yua n LEU 64 Cb 0.07 -1.37 0.00 0.00 0.00 0.00 0.00 43.42 42.12 1yua n LEU 64 CO 0.06 -0.80 0.46 -2.65 0.00 0.00 0.00 177.39 174.47 1yua n PRO 65 N 8.47 0.00 0.00 1.96 -0.02 -1.26 -4.91 135.00 139.24 1yua n PRO 65 Ca 0.38 0.63 0.00 0.00 -2.02 0.00 0.00 63.50 62.49 1yua n PRO 65 Cb 0.32 -1.42 0.00 0.00 -0.02 0.00 0.00 33.50 32.38 1yua n PRO 65 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 1yua n GLU 66 N -2.15 0.00 0.00 -0.52 4.07 -1.26 -4.95 120.64 115.83 1yua n GLU 66 Ca 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.10 1yua n GLU 66 Cb 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.38 1yua n GLU 66 CO 0.00 0.00 0.00 1.17 -0.06 0.00 0.00 177.13 178.24 1yua n LYS 67 N 0.00 0.62 0.00 5.31 4.81 -1.26 -2.56 118.16 125.08 1yua n LYS 67 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 1yua n LYS 67 Cb 0.00 -1.00 0.00 0.00 0.02 0.00 0.00 35.03 34.05 1yua n LYS 67 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 1yua n LEU 68 N -0.50 0.02 0.15 3.14 4.32 -1.26 -4.91 117.00 117.96 1yua n LEU 68 Ca 0.00 -0.02 -0.15 0.00 -0.02 0.00 0.00 56.01 55.82 1yua n LEU 68 Cb 0.00 0.00 -0.09 0.00 -1.62 0.00 0.00 43.42 41.71 1yua n LEU 68 CO 0.00 0.01 0.52 -0.09 -1.22 0.00 0.00 177.39 176.60 1yua h ARG 69 N 0.00 -0.73 -1.11 3.23 9.65 -1.86 -0.17 114.38 123.40 1yua h ARG 69 Ca 0.00 0.05 0.30 0.00 -1.10 0.00 0.00 59.98 59.23 1yua h ARG 69 Cb 0.92 0.16 -0.09 0.00 -1.39 0.00 0.00 29.97 29.57 1yua h ARG 69 CO 0.00 -0.48 0.72 0.10 2.80 0.00 0.00 179.97 183.11 1yua h TYR 70 N -0.75 0.54 -0.29 2.20 -0.00 -1.91 0.27 116.97 117.03 1yua h TYR 70 Ca -0.02 0.02 -0.04 0.00 0.00 0.00 0.00 58.73 58.69 1yua h TYR 70 Cb 0.72 -0.15 -0.01 0.00 0.00 0.00 0.00 36.73 37.28 1yua h TYR 70 CO -0.38 0.01 0.02 -0.07 -0.00 0.00 0.00 178.16 177.74 1yua h LEU 71 N 0.29 0.48 0.00 0.10 3.38 -1.43 -1.70 115.31 116.43 1yua h LEU 71 Ca 0.63 -0.28 0.00 0.00 0.09 0.00 0.00 57.88 58.31 1yua h LEU 71 Cb 1.79 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 42.41 1yua h LEU 71 CO -0.28 0.65 0.00 0.00 0.09 0.00 0.00 178.44 178.90 1yua n ALA 72 N -2.35 1.85 0.21 1.53 0.00 0.80 -2.20 120.51 120.36 1yua n ALA 72 Ca -0.03 -0.07 0.11 0.00 0.00 0.00 0.00 53.44 53.46 1yua n ALA 72 Cb 0.23 -1.28 -0.06 0.00 0.00 0.00 0.00 19.45 18.34 1yua n ALA 72 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1yua n ASP 73 N -1.43 0.47 -4.32 0.00 8.00 -0.39 -4.36 116.55 114.52 1yua n ASP 73 Ca 0.06 0.02 -0.34 0.00 0.71 0.00 0.00 54.79 55.23 1yua n ASP 73 Cb 0.18 1.15 0.10 0.00 -0.02 0.00 0.00 41.12 42.54 1yua n ASP 73 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1yua n ALA 74 N -2.10 -3.23 -0.05 2.24 0.00 -0.74 -4.86 120.51 111.77 1yua n ALA 74 Ca -0.01 -0.62 -0.07 0.00 0.00 0.00 0.00 53.44 52.74 1yua n ALA 74 Cb 0.52 -1.65 -0.05 0.00 0.00 0.00 0.00 19.45 18.27 1yua n ALA 74 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1yua h PRO 75 N -1.41 -0.22 0.00 0.00 0.11 -1.93 -3.47 132.00 125.08 1yua h PRO 75 Ca -0.44 0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.69 1yua h PRO 75 Cb 1.29 0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.45 1yua h PRO 75 CO 0.32 -0.15 0.00 0.00 -0.21 0.00 0.00 178.00 177.96 1yua n GLN 76 N -4.06 0.00 0.00 1.05 10.64 -1.26 -4.58 117.38 119.17 1yua n GLN 76 Ca -0.02 0.02 0.00 0.00 -1.83 0.00 0.00 57.00 55.17 1yua n GLN 76 Cb 0.18 -2.68 0.00 0.00 -0.86 0.00 0.00 30.24 26.88 1yua n GLN 76 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 1yua n GLN 77 N -1.10 0.00 -0.12 2.61 10.64 -1.26 -2.05 117.38 126.09 1yua n GLN 77 Ca 0.00 0.00 0.02 0.00 -1.83 0.00 0.00 57.00 55.19 1yua n GLN 77 Cb 0.36 0.00 -0.01 0.00 -0.86 0.00 0.00 30.24 29.73 1yua n GLN 77 CO 0.00 0.00 0.00 -0.25 -1.83 0.00 0.00 177.06 174.98 1yua n ASP 78 N 0.00 -0.71 0.18 2.61 8.00 -1.26 -2.12 116.55 123.25 1yua n ASP 78 Ca 0.00 0.10 0.08 0.00 0.71 0.00 0.00 54.79 55.69 1yua n ASP 78 Cb 0.00 -0.41 0.44 0.00 -0.02 0.00 0.00 41.12 41.13 1yua n ASP 78 CO 0.00 0.00 0.00 -0.65 -0.39 0.00 0.00 177.20 176.16 1yua h PRO 79 N -0.12 0.00 0.00 -0.24 0.11 -2.00 -2.92 132.00 126.83 1yua h PRO 79 Ca -0.01 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.10 1yua h PRO 79 Cb 0.12 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.23 1yua h PRO 79 CO 0.01 0.00 -0.17 1.49 -0.21 0.00 0.00 178.00 179.11 1yua h GLU 80 N 0.00 0.00 0.00 1.05 4.81 -2.04 -3.50 114.58 114.91 1yua h GLU 80 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1yua h GLU 80 Cb 0.51 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.89 1yua h GLU 80 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 179.01 178.69 1yua n GLY 81 N 1.72 0.59 1.25 1.92 0.00 -1.05 -5.02 105.19 104.61 1yua n GLY 81 Ca -0.02 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.06 1yua n GLY 81 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1yua n ASN 82 N 0.00 3.65 -1.76 1.61 3.02 -0.90 -5.01 115.26 115.87 1yua n ASN 82 Ca 0.00 -2.39 0.00 0.00 -0.03 0.00 0.00 54.58 52.16 1yua n ASN 82 Cb 0.00 -0.52 0.00 0.00 -0.61 0.00 0.00 39.78 38.65 1yua n ASN 82 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1yua n LYS 83 N 0.63 -5.03 -3.79 3.52 5.02 -1.24 -2.81 118.16 114.46 1yua n LYS 83 Ca 0.18 3.73 -0.17 0.00 -2.02 0.00 0.00 58.31 60.04 1yua n LYS 83 Cb 0.72 -4.19 -0.16 0.00 -0.02 0.00 0.00 35.03 31.38 1yua n LYS 83 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1yua s THR 84 N -3.32 -0.01 0.23 -0.18 2.01 -0.87 -1.14 115.64 112.36 1yua s THR 84 Ca 0.00 0.22 0.07 0.00 0.31 0.00 0.00 61.69 62.29 1yua s THR 84 Cb 0.00 -0.15 -0.04 0.00 0.01 0.00 0.00 72.50 72.33 1yua s THR 84 CO 0.00 0.12 0.16 0.00 -0.69 0.00 0.00 174.62 174.21 1yua s MET 85 N 1.28 2.85 0.72 4.92 0.23 -1.02 -2.30 119.30 125.98 1yua s MET 85 Ca -0.06 -1.04 -0.13 0.00 -1.03 0.00 0.00 55.69 53.43 1yua s MET 85 Cb -0.13 -2.54 0.03 0.00 -1.53 0.00 0.00 34.83 30.66 1yua s MET 85 CO -0.03 0.42 1.11 0.08 -2.03 0.00 0.00 175.02 174.58 1yua s VAL 86 N -2.03 3.13 0.05 5.16 1.01 -1.08 -1.43 120.40 125.20 1yua s VAL 86 Ca 0.32 0.46 0.01 0.00 0.00 0.00 0.00 61.98 62.77 1yua s VAL 86 Cb -0.08 -2.95 -0.00 0.00 0.00 0.00 0.00 36.38 33.34 1yua s VAL 86 CO 0.24 -0.38 0.05 0.54 0.00 0.00 0.00 175.10 175.54 1yua n ARG 87 N -2.90 0.07 -3.67 2.72 5.12 0.17 -4.54 116.66 113.63 1yua n ARG 87 Ca 0.10 -0.44 -0.16 0.00 -1.93 0.00 0.00 57.85 55.42 1yua n ARG 87 Cb 0.52 0.38 -0.15 0.00 -1.16 0.00 0.00 32.46 32.05 1yua n ARG 87 CO 0.00 0.00 0.00 0.12 -1.93 0.00 0.00 177.63 175.82 1yua s PHE 88 N -2.74 -0.23 -0.14 -1.55 2.19 -1.26 -2.26 117.98 111.99 1yua s PHE 88 Ca 0.05 0.68 -0.12 0.00 0.33 0.00 0.00 56.93 57.88 1yua s PHE 88 Cb 0.00 -0.21 -0.05 0.00 -1.31 0.00 0.00 43.02 41.45 1yua s PHE 88 CO 0.04 -0.28 0.24 -1.12 1.83 0.00 0.00 175.22 175.92 1yua s SER 89 N 2.28 6.42 0.14 6.13 0.01 -0.88 -4.94 113.70 122.87 1yua s SER 89 Ca 0.02 0.49 0.24 0.00 1.31 0.00 0.00 55.95 58.01 1yua s SER 89 Cb -0.12 -2.14 0.25 0.00 0.21 0.00 0.00 66.02 64.22 1yua s SER 89 CO -0.06 0.22 1.25 0.03 0.41 0.00 0.00 173.24 175.08 1yua h ARG 90 N 6.05 0.00 0.00 12.44 -0.00 -1.94 0.14 114.38 131.07 1yua h ARG 90 Ca -0.46 0.00 -0.02 0.00 -0.50 0.00 0.00 59.98 59.01 1yua h ARG 90 Cb 1.18 0.00 -0.00 0.00 0.00 0.00 0.00 29.97 31.15 1yua h ARG 90 CO 0.70 0.00 -0.08 0.87 0.00 0.00 0.00 179.97 181.46 1yua h LYS 91 N 0.00 0.00 0.00 0.04 6.56 -1.98 -3.20 116.57 117.99 1yua h LYS 91 Ca 0.00 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.59 1yua h LYS 91 Cb 0.80 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.46 1yua h LYS 91 CO 0.00 0.08 0.00 0.25 -2.06 0.00 0.00 179.45 177.72 1yua n THR 92 N -3.67 0.02 -3.58 -0.16 -2.24 -1.24 -5.04 114.28 98.36 1yua n THR 92 Ca -0.02 -0.03 -0.25 0.00 -2.27 0.00 0.00 64.05 61.48 1yua n THR 92 Cb 0.19 1.49 0.03 0.00 -2.10 0.00 0.00 70.33 69.94 1yua n THR 92 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1yua n LYS 93 N -0.01 -1.31 -2.19 -0.78 5.02 0.44 -4.98 118.16 114.34 1yua n LYS 93 Ca 0.00 0.68 -0.03 0.00 -2.02 0.00 0.00 58.31 56.95 1yua n LYS 93 Cb 0.36 -4.17 -0.01 0.00 -0.02 0.00 0.00 35.03 31.19 1yua n LYS 93 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 1yua n GLN 94 N -3.54 0.07 -4.39 1.97 6.02 -0.96 -4.96 117.38 111.59 1yua n GLN 94 Ca -0.11 -0.44 -0.34 0.00 -0.01 0.00 0.00 57.00 56.09 1yua n GLN 94 Cb 0.59 0.38 -0.11 0.00 1.02 0.00 0.00 30.24 32.13 1yua n GLN 94 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 1yua s GLN 95 N -2.17 3.28 -0.04 -1.09 -1.52 -1.26 -2.07 119.66 114.79 1yua s GLN 95 Ca 0.05 -0.46 -0.00 0.00 -1.95 0.00 0.00 55.36 52.99 1yua s GLN 95 Cb 0.00 -2.84 0.03 0.00 -0.22 0.00 0.00 33.01 29.98 1yua s GLN 95 CO 0.04 0.50 0.01 1.52 -0.25 0.00 0.00 175.29 177.10 1yua s TYR 96 N -0.32 0.41 0.01 0.91 -0.85 -0.96 -2.56 117.35 113.99 1yua s TYR 96 Ca 0.06 -0.02 -0.20 0.00 -0.52 0.00 0.00 57.07 56.39 1yua s TYR 96 Cb -0.12 -0.56 -0.06 0.00 0.38 0.00 0.00 41.96 41.60 1yua s TYR 96 CO 0.02 -0.20 0.57 0.14 -1.52 0.00 0.00 175.55 174.56 1yua s VAL 97 N 1.48 4.87 -0.06 -3.49 -7.23 -0.14 0.43 120.40 116.27 1yua s VAL 97 Ca -0.03 1.20 0.03 0.00 -1.81 0.00 0.00 61.98 61.37 1yua s VAL 97 Cb -0.13 -3.90 0.01 0.00 0.56 0.00 0.00 36.38 32.92 1yua s VAL 97 CO -0.03 0.47 -0.14 -0.44 -0.31 0.00 0.00 175.10 174.65 1yua s SER 98 N -0.49 1.88 0.95 4.85 0.01 -0.51 0.83 113.70 121.22 1yua s SER 98 Ca 0.30 -0.32 -0.10 0.00 1.31 0.00 0.00 55.95 57.14 1yua s SER 98 Cb -0.18 -0.80 0.16 0.00 0.21 0.00 0.00 66.02 65.41 1yua s SER 98 CO 0.17 0.06 1.14 -0.94 0.41 0.00 0.00 173.24 174.08 1yua s SER 99 N 0.52 2.65 -0.29 2.44 1.04 -0.26 -2.42 113.70 117.38 1yua s SER 99 Ca -0.13 2.13 0.01 0.00 0.48 0.00 0.00 55.95 58.45 1yua s SER 99 Cb -0.15 -2.55 0.15 0.00 0.10 0.00 0.00 66.02 63.58 1yua s SER 99 CO 0.04 -3.26 0.37 -1.61 0.98 0.00 0.00 173.24 169.75 1yua s GLU 100 N -4.62 0.38 0.00 4.02 2.02 -0.30 -4.01 118.70 116.20 1yua s GLU 100 Ca 0.67 0.04 0.00 0.00 0.02 0.00 0.00 54.97 55.70 1yua s GLU 100 Cb -0.23 -0.42 0.00 0.00 0.10 0.00 0.00 34.13 33.58 1yua s GLU 100 CO 0.59 -1.04 0.00 1.17 0.02 0.00 0.00 175.26 176.00 1yua n LYS 101 N 5.34 -0.22 0.23 1.61 4.81 -1.26 -4.63 118.16 124.04 1yua n LYS 101 Ca -0.00 0.00 0.12 0.00 -0.87 0.00 0.00 58.31 57.56 1yua n LYS 101 Cb 0.48 0.00 0.65 0.00 0.02 0.00 0.00 35.03 36.19 1yua n LYS 101 CO 0.00 0.00 0.00 -0.44 1.17 0.00 0.00 177.40 178.13 1yua h ASP 102 N -1.26 0.00 0.00 3.14 3.32 -2.00 -3.39 116.42 116.22 1yua h ASP 102 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1yua h ASP 102 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 1yua h ASP 102 CO 0.00 0.00 0.00 0.61 -1.72 0.00 0.00 179.24 178.13 1yua n GLY 103 N -1.24 -0.94 0.29 2.75 0.00 -1.26 -5.04 105.19 99.74 1yua n GLY 103 Ca -0.02 0.28 0.00 0.00 0.00 0.00 0.00 46.02 46.29 1yua n GLY 103 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1yua n LYS 104 N 0.00 0.00 -3.53 1.61 2.85 -1.26 -5.05 118.16 112.78 1yua n LYS 104 Ca 0.00 -0.48 -0.27 0.00 -1.05 0.00 0.00 58.31 56.51 1yua n LYS 104 Cb 0.00 -0.30 0.02 0.00 -0.65 0.00 0.00 35.03 34.10 1yua n LYS 104 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1yua n ALA 105 N 0.00 -2.59 -0.31 0.58 0.00 -1.26 -4.76 120.51 112.17 1yua n ALA 105 Ca 0.00 0.13 0.01 0.00 0.00 0.00 0.00 53.44 53.58 1yua n ALA 105 Cb 0.57 -1.67 0.08 0.00 0.00 0.00 0.00 19.45 18.43 1yua n ALA 105 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 1yua h THR 106 N 0.94 0.11 0.00 0.00 1.35 -1.89 -3.46 112.91 109.96 1yua h THR 106 Ca -0.50 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.36 1yua h THR 106 Cb 1.34 0.11 0.00 0.00 -1.73 0.00 0.00 68.15 67.86 1yua h THR 106 CO 0.29 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 176.17 1yua n GLY 107 N -1.53 0.97 3.47 5.82 0.00 -1.26 -5.04 105.19 107.62 1yua n GLY 107 Ca 0.11 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.68 1yua n GLY 107 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 173.32 175.19 1yua n TRP 108 N 0.00 0.03 -3.88 1.61 -0.00 -1.26 -4.51 117.44 109.43 1yua n TRP 108 Ca 0.00 0.80 -0.09 0.00 -0.00 0.00 0.00 57.50 58.21 1yua n TRP 108 Cb 0.00 -2.06 -0.08 0.00 -0.00 0.00 0.00 31.31 29.17 1yua n TRP 108 CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 177.69 176.15 1yua s SER 109 N -0.84 0.13 -0.11 5.87 1.04 -1.26 -1.10 113.70 117.43 1yua s SER 109 Ca 0.62 -0.56 -0.13 0.00 0.48 0.00 0.00 55.95 56.36 1yua s SER 109 Cb -0.78 0.29 0.03 0.00 0.10 0.00 0.00 66.02 65.67 1yua s SER 109 CO 0.58 -0.62 0.36 0.00 0.98 0.00 0.00 173.24 174.53 1yua s ALA 110 N -3.21 -0.89 -0.08 5.32 0.00 0.25 -2.92 121.76 120.24 1yua s ALA 110 Ca -0.00 0.91 0.04 0.00 0.00 0.00 0.00 51.96 52.91 1yua s ALA 110 Cb 0.02 -0.48 -0.01 0.00 0.00 0.00 0.00 23.12 22.65 1yua s ALA 110 CO -0.07 -0.19 -0.20 -0.06 0.00 0.00 0.00 175.76 175.24 1yua s PHE 111 N -0.08 2.60 -0.58 0.00 0.40 -0.83 -0.97 117.98 118.52 1yua s PHE 111 Ca -0.02 -0.60 -0.26 0.00 -0.60 0.00 0.00 56.93 55.45 1yua s PHE 111 Cb -0.03 -1.67 0.04 0.00 0.51 0.00 0.00 43.02 41.87 1yua s PHE 111 CO 0.01 -0.14 1.07 -0.47 0.70 0.00 0.00 175.22 176.40 1yua s TYR 112 N -0.14 2.67 0.00 0.36 5.04 -1.06 0.38 117.35 124.60 1yua s TYR 112 Ca -0.03 0.15 0.00 0.00 -2.44 0.00 0.00 57.07 54.75 1yua s TYR 112 Cb -0.14 -4.31 0.00 0.00 0.35 0.00 0.00 41.96 37.86 1yua s TYR 112 CO 0.04 -1.51 0.00 0.28 -1.34 0.00 0.00 175.55 173.01 1yua n VAL 113 N 6.40 0.00 -2.01 3.14 0.31 -0.54 -4.81 118.33 120.82 1yua n VAL 113 Ca 0.04 0.00 -0.26 0.00 -0.01 0.00 0.00 64.34 64.11 1yua n VAL 113 Cb 0.48 0.00 -0.06 0.00 -0.91 0.00 0.00 33.84 33.35 1yua n VAL 113 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1yua s ASP 114 N -1.00 4.97 -0.96 4.52 2.15 -1.26 -2.87 116.67 122.22 1yua s ASP 114 Ca 0.00 -1.02 0.00 0.00 0.43 0.00 0.00 52.55 51.96 1yua s ASP 114 Cb 0.00 -2.57 0.00 0.00 -0.30 0.00 0.00 42.92 40.05 1yua s ASP 114 CO 0.00 -3.01 0.00 0.61 -0.17 0.00 0.00 175.17 172.60 1yua n GLY 115 N 6.44 -0.04 2.67 2.66 0.00 -1.26 -4.83 105.19 110.82 1yua n GLY 115 Ca 0.42 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 46.17 1yua n GLY 115 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1yua n LYS 116 N -2.43 1.53 -1.14 1.61 4.01 -1.14 -5.10 118.16 115.50 1yua n LYS 116 Ca -0.12 -4.16 -0.36 0.00 -0.51 0.00 0.00 58.31 53.17 1yua n LYS 116 Cb 0.52 -2.08 0.08 0.00 -0.51 0.00 0.00 35.03 33.03 1yua n LYS 116 CO 0.00 0.00 0.00 0.91 -1.11 0.00 0.00 177.40 177.20 1yua n TRP 117 N 1.92 -1.24 -4.23 2.13 7.02 -1.26 -1.46 117.44 120.33 1yua n TRP 117 Ca 0.24 0.31 -0.17 0.00 -1.02 0.00 0.00 57.50 56.86 1yua n TRP 117 Cb 0.40 -1.85 -0.08 0.00 -2.42 0.00 0.00 31.31 27.36 1yua n TRP 117 CO 0.00 0.00 0.00 0.14 -2.02 0.00 0.00 177.69 175.81 1yua s VAL 118 N -2.03 0.00 -0.14 -0.99 -7.23 0.16 -4.75 120.40 105.42 1yua s VAL 118 Ca 0.62 -1.93 -0.01 0.00 -1.81 0.00 0.00 61.98 58.85 1yua s VAL 118 Cb -0.31 -2.51 0.04 0.00 0.56 0.00 0.00 36.38 34.15 1yua s VAL 118 CO 0.62 0.00 -0.04 -1.61 -0.31 0.00 0.00 175.10 173.75 1yua s GLU 119 N -3.59 1.28 -0.80 4.82 8.01 -1.26 -1.96 118.70 125.20 1yua s GLU 119 Ca 0.38 -0.36 0.02 0.00 0.01 0.00 0.00 54.97 55.03 1yua s GLU 119 Cb 0.03 -1.77 0.26 0.00 -4.31 0.00 0.00 34.13 28.34 1yua s GLU 119 CO 0.22 -0.39 0.95 0.41 0.01 0.00 0.00 175.26 176.46 1yua n GLY 120 N 4.94 4.81 3.55 -1.39 0.00 -1.15 -5.00 105.19 110.97 1yua n GLY 120 Ca -0.11 -2.72 -0.52 0.00 0.00 0.00 0.00 46.02 42.66 1yua n GLY 120 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1yua n LYS 121 N 1.18 0.81 0.00 1.61 4.81 -1.26 -4.62 118.16 120.69 1yua n LYS 121 Ca 0.27 0.29 0.00 0.00 -0.87 0.00 0.00 58.31 58.00 1yua n LYS 121 Cb 0.38 -1.82 0.00 0.00 0.02 0.00 0.00 35.03 33.61 1yua n LYS 121 CO 0.00 0.00 0.00 1.17 1.17 0.00 0.00 177.40 179.74