#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 2.38 0.00 7.83 6.94 -1.26 -3.14 115.26 128.01 1yua n ASN 2 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 54.58 54.56 1yua n ASN 2 Cb 0.00 -1.44 0.00 0.00 -2.36 0.00 0.00 39.78 35.98 1yua n ASN 2 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1yua n GLY 3 N 6.13 0.78 3.71 4.83 0.00 -1.26 -5.10 105.19 114.28 1yua n GLY 3 Ca 0.39 -0.01 -0.42 0.00 0.00 0.00 0.00 46.02 45.98 1yua n GLY 3 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1yua s GLU 4 N 0.00 4.53 -0.27 1.61 2.12 -1.19 -5.01 118.70 120.49 1yua s GLU 4 Ca 0.00 1.57 -0.00 0.00 0.36 0.00 0.00 54.97 56.89 1yua s GLU 4 Cb 0.00 -3.40 0.16 0.00 0.26 0.00 0.00 34.13 31.15 1yua s GLU 4 CO 0.00 -0.09 0.48 0.14 -0.54 0.00 0.00 175.26 175.25 1yua s VAL 5 N 0.85 -0.78 -0.36 3.70 -7.23 -1.26 -5.01 120.40 110.30 1yua s VAL 5 Ca 0.54 -0.08 -0.08 0.00 -1.81 0.00 0.00 61.98 60.54 1yua s VAL 5 Cb -0.25 -0.92 0.01 0.00 0.56 0.00 0.00 36.38 35.78 1yua s VAL 5 CO 0.29 -0.10 0.30 0.00 -0.31 0.00 0.00 175.10 175.29 1yua n ALA 6 N 5.39 -3.24 -1.28 1.32 0.00 -1.26 -4.98 120.51 116.46 1yua n ALA 6 Ca -0.01 0.84 -0.29 0.00 0.00 0.00 0.00 53.44 53.98 1yua n ALA 6 Cb 0.51 -2.40 0.18 0.00 0.00 0.00 0.00 19.45 17.73 1yua n ALA 6 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1yua s PRO 7 N -2.10 0.36 0.50 0.00 0.04 -1.26 -4.93 135.00 127.60 1yua s PRO 7 Ca 0.13 0.33 0.29 0.00 0.04 0.00 0.00 61.00 61.79 1yua s PRO 7 Cb -0.04 -1.74 1.14 0.00 0.04 0.00 0.00 34.50 33.90 1yua s PRO 7 CO 0.76 -2.74 1.91 -1.00 0.04 0.00 0.00 177.00 175.97 1yua h PRO 8 N -1.89 0.00 -5.23 0.56 0.13 -2.07 -3.41 132.00 120.09 1yua h PRO 8 Ca -0.52 0.00 -0.64 0.00 -0.87 0.00 0.00 66.00 63.97 1yua h PRO 8 Cb 1.33 0.00 -0.22 0.00 0.13 0.00 0.00 31.00 32.24 1yua h PRO 8 CO 0.56 0.11 -0.66 0.21 -0.23 0.00 0.00 178.00 177.98 1yua s LYS 9 N -3.67 3.65 -0.01 0.86 2.47 -1.26 -5.10 119.74 116.69 1yua s LYS 9 Ca 0.01 -0.52 -0.03 0.00 -1.56 0.00 0.00 55.97 53.88 1yua s LYS 9 Cb 0.10 -2.99 -0.00 0.00 -1.46 0.00 0.00 37.83 33.48 1yua s LYS 9 CO 0.59 0.15 0.06 -1.21 0.16 0.00 0.00 175.35 175.10 1yua s GLU 10 N 0.62 0.20 -0.45 4.03 8.01 -1.26 -5.07 118.70 124.78 1yua s GLU 10 Ca -0.02 -0.15 0.09 0.00 0.01 0.00 0.00 54.97 54.91 1yua s GLU 10 Cb -0.14 0.08 0.33 0.00 -4.31 0.00 0.00 34.13 30.09 1yua s GLU 10 CO 0.02 -0.04 0.76 -3.47 0.01 0.00 0.00 175.26 172.55 1yua n ASP 11 N 2.46 1.91 -2.91 -0.19 -0.08 -1.26 -5.08 116.55 111.39 1yua n ASP 11 Ca -0.17 -3.18 0.00 0.00 -1.51 0.00 0.00 54.79 49.94 1yua n ASP 11 Cb 0.58 -0.61 0.00 0.00 2.34 0.00 0.00 41.12 43.43 1yua n ASP 11 CO 0.00 0.00 0.00 -0.81 0.12 0.00 0.00 177.20 176.51 1yua n PRO 12 N 0.32 1.57 -3.50 -0.67 -0.04 -1.26 -4.99 135.00 126.42 1yua n PRO 12 Ca 0.26 0.00 -0.42 0.00 -0.04 0.00 0.00 63.50 63.30 1yua n PRO 12 Cb 0.56 0.00 -0.06 0.00 -0.04 0.00 0.00 33.50 33.96 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 0.07 4.69 0.23 0.52 1.01 -1.10 -5.00 120.40 120.82 1yua s VAL 13 Ca 0.00 -2.53 -0.30 0.00 0.00 0.00 0.00 61.98 59.16 1yua s VAL 13 Cb 0.00 -3.98 -0.09 0.00 0.00 0.00 0.00 36.38 32.31 1yua s VAL 13 CO 0.00 -0.93 1.27 -2.16 0.00 0.00 0.00 175.10 173.28 1yua s PRO 14 N 0.30 4.43 -0.56 2.72 0.04 -1.26 -0.60 135.00 140.06 1yua s PRO 14 Ca 0.15 2.03 0.04 0.00 0.04 0.00 0.00 61.00 63.27 1yua s PRO 14 Cb -0.17 -3.18 0.37 0.00 0.04 0.00 0.00 34.50 31.57 1yua s PRO 14 CO -0.05 -0.16 1.12 1.28 0.04 0.00 0.00 177.00 179.22 1yua n LEU 15 N 2.08 4.89 -0.39 -3.56 7.99 -0.76 -4.81 117.00 122.43 1yua n LEU 15 Ca 0.04 -5.44 -0.03 0.00 -0.01 0.00 0.00 56.01 50.57 1yua n LEU 15 Cb 0.43 -0.58 0.01 0.00 -0.11 0.00 0.00 43.42 43.17 1yua n LEU 15 CO 0.57 2.26 0.56 -2.65 -1.51 0.00 0.00 177.39 176.63 1yua n PRO 16 N -0.35 -0.28 -0.34 3.23 -0.02 -1.26 0.16 135.00 136.14 1yua n PRO 16 Ca 0.36 1.53 0.32 0.00 -2.02 0.00 0.00 63.50 63.70 1yua n PRO 16 Cb 0.49 -2.27 0.58 0.00 -0.02 0.00 0.00 33.50 32.28 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 -5.42 -0.05 -2.90 -0.52 4.07 -1.26 -3.58 120.64 110.97 1yua n GLU 17 Ca 0.08 1.29 -0.43 0.00 -0.06 0.00 0.00 57.16 58.04 1yua n GLU 17 Cb 0.37 -2.36 -0.05 0.00 -0.06 0.00 0.00 31.44 29.34 1yua n GLU 17 CO 0.00 0.00 0.00 -1.17 -0.06 0.00 0.00 177.13 175.90 1yua s LEU 18 N -10.05 4.16 0.63 4.31 2.96 0.12 -5.02 118.68 115.79 1yua s LEU 18 Ca -0.08 -0.07 -0.16 0.00 -0.22 0.00 0.00 54.13 53.60 1yua s LEU 18 Cb 0.32 -3.02 -0.02 0.00 0.50 0.00 0.00 46.19 43.97 1yua s LEU 18 CO 0.75 -1.00 1.11 -2.16 -1.32 0.00 0.00 176.35 173.73 1yua s PRO 19 N 3.52 2.96 0.00 0.98 0.04 -1.23 -1.98 135.00 139.29 1yua s PRO 19 Ca 0.32 1.42 0.00 0.00 0.04 0.00 0.00 61.00 62.78 1yua s PRO 19 Cb -0.11 -1.97 0.00 0.00 0.04 0.00 0.00 34.50 32.46 1yua s PRO 19 CO 0.23 -1.13 0.00 0.00 0.04 0.00 0.00 177.00 176.15 1yua n GLU 21 N 0.00 3.86 -1.53 0.00 2.13 -1.26 -4.81 120.64 119.04 1yua n GLU 21 Ca 0.00 -4.42 -0.13 0.00 0.66 0.00 0.00 57.16 53.27 1yua n GLU 21 Cb 0.00 -2.32 -0.05 0.00 0.27 0.00 0.00 31.44 29.34 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 -0.30 -1.41 -1.16 5.31 3.00 -1.26 -4.90 118.16 117.44 1yua n LYS 22 Ca 0.43 0.77 0.00 0.00 -0.00 0.00 0.00 58.31 59.51 1yua n LYS 22 Cb 0.36 -5.06 0.00 0.00 0.00 0.00 0.00 35.03 30.33 1yua n LYS 22 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.40 176.27 1yua n SER 23 N -0.69 0.99 -0.08 3.14 3.41 -1.26 -4.98 113.62 114.15 1yua n SER 23 Ca -0.14 -0.77 0.07 0.00 -0.26 0.00 0.00 58.87 57.77 1yua n SER 23 Cb 0.46 0.00 0.39 0.00 -0.26 0.00 0.00 64.21 64.80 1yua n SER 23 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1yua n ASP 24 N -1.55 0.24 -4.89 4.04 9.92 -1.26 -4.70 116.55 118.34 1yua n ASP 24 Ca 0.00 -1.61 -0.22 0.00 -0.53 0.00 0.00 54.79 52.43 1yua n ASP 24 Cb 0.00 -0.02 0.06 0.00 -0.64 0.00 0.00 41.12 40.52 1yua n ASP 24 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1yua s ALA 25 N -1.96 3.79 0.00 2.24 0.00 -1.26 -5.01 121.76 119.56 1yua s ALA 25 Ca 0.22 -1.41 0.00 0.00 0.00 0.00 0.00 51.96 50.77 1yua s ALA 25 Cb 0.10 -2.10 0.00 0.00 0.00 0.00 0.00 23.12 21.12 1yua s ALA 25 CO 0.17 -1.00 0.00 2.48 0.00 0.00 0.00 175.76 177.41 1yua n TYR 26 N -2.53 -0.30 -3.33 0.00 4.11 -1.26 -2.60 117.16 111.24 1yua n TYR 26 Ca 0.10 0.00 -0.44 0.00 -0.00 0.00 0.00 57.90 57.56 1yua n TYR 26 Cb 0.60 0.00 -0.00 0.00 -0.00 0.00 0.00 39.34 39.94 1yua n TYR 26 CO 0.00 0.00 0.00 1.19 -0.00 0.00 0.00 176.86 178.05 1yua n PHE 27 N 0.00 5.04 -2.20 -3.48 3.01 -0.84 -1.14 117.46 117.85 1yua n PHE 27 Ca 0.00 -3.84 -0.33 0.00 1.01 0.00 0.00 57.45 54.29 1yua n PHE 27 Cb 0.00 -1.65 -0.04 0.00 -0.01 0.00 0.00 39.48 37.78 1yua n PHE 27 CO 0.00 0.00 0.00 0.08 1.01 0.00 0.00 176.76 177.85 1yua s VAL 28 N -1.41 3.56 -0.42 -4.37 1.01 -0.56 -1.83 120.40 116.37 1yua s VAL 28 Ca 0.31 -0.29 -0.40 0.00 0.00 0.00 0.00 61.98 61.59 1yua s VAL 28 Cb -0.09 -4.30 -0.16 0.00 0.00 0.00 0.00 36.38 31.83 1yua s VAL 28 CO -0.07 -1.24 2.12 -0.11 0.00 0.00 0.00 175.10 175.80 1yua n LEU 29 N 12.24 1.43 -4.89 3.92 0.00 0.24 -3.62 117.00 126.31 1yua n LEU 29 Ca 0.32 0.61 -0.23 0.00 0.00 0.00 0.00 56.01 56.70 1yua n LEU 29 Cb 0.49 -1.06 -0.01 0.00 0.00 0.00 0.00 43.42 42.83 1yua n LEU 29 CO 0.64 -0.74 0.05 -0.13 0.00 0.00 0.00 177.39 177.21 1yua s ARG 30 N 5.85 2.36 -0.23 1.96 0.52 -0.46 -2.71 118.95 126.24 1yua s ARG 30 Ca 1.14 -1.79 0.00 0.00 -0.52 0.00 0.00 55.73 54.56 1yua s ARG 30 Cb -1.21 -2.25 0.06 0.00 0.52 0.00 0.00 34.95 32.08 1yua s ARG 30 CO 0.60 -0.45 -0.02 0.16 0.02 0.00 0.00 175.30 175.60 1yua s ASP 31 N -4.24 3.70 0.00 0.23 1.47 -1.26 -1.65 116.67 114.92 1yua s ASP 31 Ca 0.42 -1.16 0.00 0.00 1.18 0.00 0.00 52.55 52.99 1yua s ASP 31 Cb -0.02 -1.05 0.00 0.00 -0.34 0.00 0.00 42.92 41.50 1yua s ASP 31 CO 0.26 -0.27 0.00 0.61 0.68 0.00 0.00 175.17 176.45 1yua n GLY 32 N 4.75 -0.59 5.40 2.12 0.00 -1.25 -4.93 105.19 110.68 1yua n GLY 32 Ca -0.10 -0.75 0.00 0.00 0.00 0.00 0.00 46.02 45.17 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 0.00 0.00 -2.77 4.61 0.00 -1.26 -1.64 120.51 119.46 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 0.05 0.00 0.00 0.00 0.00 19.45 19.50 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 6.08 2.61 0.00 0.00 0.00 -1.26 -5.11 120.51 122.83 1yua n ALA 34 Ca 0.00 -2.48 0.00 0.00 0.00 0.00 0.00 53.44 50.96 1yua n ALA 34 Cb 0.00 -0.85 0.00 0.00 0.00 0.00 0.00 19.45 18.60 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 -0.56 3.55 3.11 0.00 0.00 -0.65 -4.90 105.19 105.73 1yua n GLY 35 Ca 0.04 -1.81 -0.36 0.00 0.00 0.00 0.00 46.02 43.88 1yua n GLY 35 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1yua n VAL 36 N -1.22 0.00 -2.07 1.61 3.14 -1.26 -3.93 118.33 114.60 1yua n VAL 36 Ca 0.00 -0.21 0.00 0.00 -2.96 0.00 0.00 64.34 61.17 1yua n VAL 36 Cb 0.00 -0.21 0.00 0.00 -1.06 0.00 0.00 33.84 32.57 1yua n VAL 36 CO 0.00 0.00 0.00 2.22 -6.46 0.00 0.00 176.83 172.59 1yua n PHE 37 N -3.49 0.00 -3.95 1.45 -1.74 -0.66 -4.83 117.46 104.24 1yua n PHE 37 Ca -0.00 0.00 -0.30 0.00 -0.56 0.00 0.00 57.45 56.58 1yua n PHE 37 Cb 0.66 0.00 -0.15 0.00 1.52 0.00 0.00 39.48 41.51 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 4.26 0.20 5.98 1.02 -1.26 -1.36 118.68 127.53 1yua s LEU 38 Ca 0.00 -2.43 -0.09 0.00 0.02 0.00 0.00 54.13 51.63 1yua s LEU 38 Cb 0.00 -1.53 -0.07 0.00 0.02 0.00 0.00 46.19 44.61 1yua s LEU 38 CO 0.00 -0.33 0.50 0.00 0.02 0.00 0.00 176.35 176.55 1yua s ALA 39 N 0.52 3.62 0.30 4.21 0.00 -1.24 -3.99 121.76 125.19 1yua s ALA 39 Ca 0.13 -0.33 -0.29 0.00 0.00 0.00 0.00 51.96 51.47 1yua s ALA 39 Cb -0.22 -2.36 -0.10 0.00 0.00 0.00 0.00 23.12 20.44 1yua s ALA 39 CO -0.06 0.55 1.20 0.00 0.00 0.00 0.00 175.76 177.44 1yua s ALA 40 N -1.75 3.45 -1.46 0.00 0.00 -1.26 -1.50 121.76 119.25 1yua s ALA 40 Ca 0.45 1.07 0.16 0.00 0.00 0.00 0.00 51.96 53.64 1yua s ALA 40 Cb -0.12 -3.40 0.82 0.00 0.00 0.00 0.00 23.12 20.42 1yua s ALA 40 CO 0.22 -0.39 1.46 -1.71 0.00 0.00 0.00 175.76 175.33 1yua n ASN 41 N 1.07 0.00 -1.04 0.00 2.85 -0.30 -1.63 115.26 116.21 1yua n ASN 41 Ca -0.00 0.03 0.11 0.00 -0.11 0.00 0.00 54.58 54.61 1yua n ASN 41 Cb 0.43 -0.27 0.17 0.00 1.24 0.00 0.00 39.78 41.35 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 -1.27 0.33 -1.25 -0.44 -2.24 -1.26 -4.92 114.28 103.23 1yua n THR 42 Ca 0.08 -0.67 -0.42 0.00 -2.27 0.00 0.00 64.05 60.77 1yua n THR 42 Cb 0.13 1.15 -0.02 0.00 -2.10 0.00 0.00 70.33 69.49 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 1.38 -0.90 1.51 4.78 -0.00 -0.64 -0.79 117.46 122.80 1yua n PHE 43 Ca 0.17 0.79 0.15 0.00 -0.00 0.00 0.00 57.45 58.55 1yua n PHE 43 Cb 0.58 -1.73 0.71 0.00 -0.00 0.00 0.00 39.48 39.04 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 1.01 0.69 -0.51 -7.13 -0.04 -1.26 -4.83 135.00 122.92 1yua n PRO 44 Ca 0.14 -0.14 0.44 0.00 -0.04 0.00 0.00 63.50 63.90 1yua n PRO 44 Cb 0.27 -1.50 0.69 0.00 -0.04 0.00 0.00 33.50 32.92 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 0.35 0.00 -3.85 0.54 3.64 -1.35 -3.18 116.57 112.72 1yua h LYS 45 Ca 0.00 0.00 -0.58 0.00 -1.27 0.00 0.00 60.65 58.80 1yua h LYS 45 Cb 0.28 0.00 -0.40 0.00 -0.41 0.00 0.00 32.23 31.70 1yua h LYS 45 CO 0.00 0.00 -0.76 -1.12 -2.27 0.00 0.00 179.45 175.30 1yua s SER 46 N -3.82 3.82 -0.25 4.20 0.01 -1.25 -4.98 113.70 111.43 1yua s SER 46 Ca -0.04 -1.40 0.01 0.00 1.31 0.00 0.00 55.95 55.83 1yua s SER 46 Cb 0.22 -0.95 0.29 0.00 0.21 0.00 0.00 66.02 65.79 1yua s SER 46 CO 0.74 -0.35 1.61 0.54 0.41 0.00 0.00 173.24 176.19 1yua n ARG 47 N 4.79 1.67 -1.71 12.44 1.74 -1.20 -4.04 116.66 130.34 1yua n ARG 47 Ca -0.05 -1.50 -0.39 0.00 -0.77 0.00 0.00 57.85 55.14 1yua n ARG 47 Cb 0.44 -1.59 -0.02 0.00 -1.02 0.00 0.00 32.46 30.27 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 -0.12 4.20 -4.48 5.56 1.02 -1.26 -4.91 120.64 120.63 1yua n GLU 48 Ca 0.30 -2.94 -0.32 0.00 -0.02 0.00 0.00 57.16 54.18 1yua n GLU 48 Cb 0.93 -2.68 -0.11 0.00 -0.02 0.00 0.00 31.44 29.57 1yua n GLU 48 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 1yua s THR 49 N 0.10 3.57 0.00 2.62 -4.23 -1.26 -4.43 115.64 112.02 1yua s THR 49 Ca 0.60 -0.80 0.00 0.00 -1.18 0.00 0.00 61.69 60.31 1yua s THR 49 Cb 0.19 -2.54 0.00 0.00 1.34 0.00 0.00 72.50 71.48 1yua s THR 49 CO -0.08 0.40 0.00 -1.14 -0.54 0.00 0.00 174.62 173.25 1yua n ARG 50 N 1.58 0.00 -3.62 3.99 3.00 -1.26 -4.95 116.66 115.40 1yua n ARG 50 Ca -0.16 0.00 -0.16 0.00 -0.00 0.00 0.00 57.85 57.54 1yua n ARG 50 Cb 0.52 0.00 -0.07 0.00 0.00 0.00 0.00 32.46 32.91 1yua n ARG 50 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1yua s ALA 51 N -1.00 -1.40 -0.04 5.13 0.00 -1.26 -4.22 121.76 118.97 1yua s ALA 51 Ca 0.00 1.01 -0.29 0.00 0.00 0.00 0.00 51.96 52.68 1yua s ALA 51 Cb 0.00 -0.07 -0.02 0.00 0.00 0.00 0.00 23.12 23.02 1yua s ALA 51 CO 0.00 -0.32 0.97 -1.25 0.00 0.00 0.00 175.76 175.16 1yua s PRO 52 N -1.08 4.51 0.61 0.00 0.04 -1.26 -4.60 135.00 133.21 1yua s PRO 52 Ca -0.11 1.38 -0.18 0.00 0.04 0.00 0.00 61.00 62.13 1yua s PRO 52 Cb -0.02 -3.49 -0.05 0.00 0.04 0.00 0.00 34.50 30.98 1yua s PRO 52 CO 0.07 -0.13 0.84 -0.11 0.04 0.00 0.00 177.00 177.70 1yua n LEU 53 N 4.26 2.91 0.34 -3.56 0.00 -1.26 -2.15 117.00 117.53 1yua n LEU 53 Ca 0.06 0.77 0.20 0.00 0.00 0.00 0.00 56.01 57.04 1yua n LEU 53 Cb 0.50 -1.33 1.05 0.00 0.00 0.00 0.00 43.42 43.64 1yua n LEU 53 CO 0.52 -2.23 1.16 0.58 0.00 0.00 0.00 177.39 177.42 1yua h VAL 54 N 0.33 0.01 0.18 1.96 2.07 -1.75 0.21 116.25 119.26 1yua h VAL 54 Ca -0.48 0.00 -0.34 0.00 0.82 0.00 0.00 66.70 66.71 1yua h VAL 54 Cb 1.37 0.86 0.01 0.00 -1.52 0.00 0.00 31.29 32.01 1yua h VAL 54 CO 0.49 0.00 -1.64 1.05 0.02 0.00 0.00 177.57 177.49 1yua h GLU 55 N 0.00 0.37 0.00 1.57 4.11 -1.86 -2.62 114.58 116.15 1yua h GLU 55 Ca 0.00 -0.64 -0.07 0.00 0.07 0.00 0.00 59.36 58.73 1yua h GLU 55 Cb 0.29 0.24 -0.01 0.00 0.50 0.00 0.00 28.75 29.77 1yua h GLU 55 CO -0.00 1.28 -0.31 0.93 0.07 0.00 0.00 179.01 180.97 1yua h GLU 56 N 0.10 0.00 0.11 1.06 5.08 -1.31 -2.17 114.58 117.45 1yua h GLU 56 Ca -0.30 0.00 -0.23 0.00 -1.00 0.00 0.00 59.36 57.83 1yua h GLU 56 Cb 2.09 0.00 0.02 0.00 0.50 0.00 0.00 28.75 31.36 1yua h GLU 56 CO 0.19 0.31 -0.96 1.25 -1.00 0.00 0.00 179.01 178.80 1yua h LEU 57 N 0.00 0.66 -0.73 1.33 5.85 -1.32 -2.43 115.31 118.66 1yua h LEU 57 Ca -0.00 -0.86 0.03 0.00 0.84 0.00 0.00 57.88 57.90 1yua h LEU 57 Cb 0.60 -0.21 -0.05 0.00 0.37 0.00 0.00 40.66 41.38 1yua h LEU 57 CO 0.04 1.45 0.46 0.22 -0.34 0.00 0.00 178.44 180.27 1yua h TYR 58 N -0.04 0.86 -0.43 1.25 3.20 -1.23 0.17 116.97 120.74 1yua h TYR 58 Ca -0.15 0.02 -0.11 0.00 3.14 0.00 0.00 58.73 61.64 1yua h TYR 58 Cb 1.69 -0.28 -0.02 0.00 1.54 0.00 0.00 36.73 39.67 1yua h TYR 58 CO 0.15 0.48 -0.16 -0.09 -1.64 0.00 0.00 178.16 176.91 1yua h ARG 59 N 0.89 0.82 -0.77 1.82 2.43 -1.45 -2.08 114.38 116.02 1yua h ARG 59 Ca 0.30 -0.30 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1yua h ARG 59 Cb 0.04 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 29.53 1yua h ARG 59 CO -0.12 0.92 0.00 1.19 -1.51 0.00 0.00 179.97 180.45 1yua n PHE 60 N -4.14 1.03 0.05 2.20 3.72 -0.61 -4.14 117.46 115.56 1yua n PHE 60 Ca 0.01 -0.36 -0.01 0.00 -0.05 0.00 0.00 57.45 57.04 1yua n PHE 60 Cb 0.40 -0.30 0.26 0.00 -0.94 0.00 0.00 39.48 38.90 1yua n PHE 60 CO 0.00 0.00 0.00 -0.09 -0.05 0.00 0.00 176.76 176.62 1yua h ARG 61 N 2.01 0.39 0.00 -1.08 1.12 0.03 -1.11 114.38 115.74 1yua h ARG 61 Ca 0.00 -0.13 0.00 0.00 -1.11 0.00 0.00 59.98 58.74 1yua h ARG 61 Cb 1.22 -0.03 0.00 0.00 -0.01 0.00 0.00 29.97 31.15 1yua h ARG 61 CO 0.24 0.60 0.00 -3.47 -3.11 0.00 0.00 179.97 174.22 1yua n ASP 62 N -4.15 0.42 -0.29 -3.80 -0.08 -1.26 -1.71 116.55 105.68 1yua n ASP 62 Ca -0.00 0.61 0.06 0.00 -1.51 0.00 0.00 54.79 53.95 1yua n ASP 62 Cb 0.37 -0.70 0.12 0.00 2.34 0.00 0.00 41.12 43.26 1yua n ASP 62 CO 0.00 0.00 0.00 -1.14 0.12 0.00 0.00 177.20 176.18 1yua n ARG 63 N -1.97 2.36 -3.17 -0.67 0.63 -0.50 -4.98 116.66 108.37 1yua n ARG 63 Ca 0.02 -2.22 -0.40 0.00 -0.92 0.00 0.00 57.85 54.33 1yua n ARG 63 Cb 0.18 -1.38 -0.07 0.00 0.45 0.00 0.00 32.46 31.65 1yua n ARG 63 CO 0.00 0.00 0.00 -1.17 -2.51 0.00 0.00 177.63 173.95 1yua s LEU 64 N -2.00 4.09 0.00 6.15 0.20 -0.69 -4.92 118.68 121.50 1yua s LEU 64 Ca 0.23 0.53 0.00 0.00 0.69 0.00 0.00 54.13 55.58 1yua s LEU 64 Cb 0.18 -2.75 0.00 0.00 -0.43 0.00 0.00 46.19 43.19 1yua s LEU 64 CO 0.05 -0.36 0.74 -2.65 -0.29 0.00 0.00 176.35 173.84 1yua n PRO 65 N 5.68 0.00 0.00 0.98 -0.02 -1.26 -4.91 135.00 135.46 1yua n PRO 65 Ca -0.02 0.49 0.00 0.00 -2.02 0.00 0.00 63.50 61.95 1yua n PRO 65 Cb 0.49 -1.24 0.00 0.00 -0.02 0.00 0.00 33.50 32.73 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 -1.60 0.00 0.00 -0.52 2.13 -1.26 -4.96 120.64 114.43 1yua n GLU 66 Ca 0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 1yua n GLU 66 Cb 0.00 0.00 0.00 0.00 0.27 0.00 0.00 31.44 31.71 1yua n GLU 66 CO 0.00 0.00 0.00 1.17 -0.41 0.00 0.00 177.13 177.89 1yua n LYS 67 N 0.00 0.63 -0.05 5.31 3.00 -1.26 -2.54 118.16 123.25 1yua n LYS 67 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.31 1yua n LYS 67 Cb 0.00 -1.05 0.00 0.00 0.00 0.00 0.00 35.03 33.98 1yua n LYS 67 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.40 178.68 1yua n LEU 68 N -0.38 0.03 0.09 3.14 4.32 -1.26 -4.89 117.00 118.05 1yua n LEU 68 Ca 0.00 -0.13 -0.14 0.00 -0.02 0.00 0.00 56.01 55.73 1yua n LEU 68 Cb 0.03 -0.00 -0.07 0.00 -1.62 0.00 0.00 43.42 41.76 1yua n LEU 68 CO 0.00 0.03 0.60 -0.09 -1.22 0.00 0.00 177.39 176.71 1yua h ARG 69 N 0.00 -0.58 -1.17 3.23 1.12 -1.88 0.44 114.38 115.55 1yua h ARG 69 Ca 0.00 0.04 0.39 0.00 -1.11 0.00 0.00 59.98 59.30 1yua h ARG 69 Cb 1.03 0.13 -0.14 0.00 -0.01 0.00 0.00 29.97 30.99 1yua h ARG 69 CO 0.00 -0.38 0.72 0.10 -3.11 0.00 0.00 179.97 177.30 1yua h TYR 70 N -0.60 0.67 -0.05 2.20 -0.00 -1.90 0.46 116.97 117.76 1yua h TYR 70 Ca 0.04 0.03 -0.02 0.00 -0.00 0.00 0.00 58.73 58.77 1yua h TYR 70 Cb 0.65 -0.17 -0.00 0.00 -0.00 0.00 0.00 36.73 37.21 1yua h TYR 70 CO -0.37 -0.20 -0.04 -0.07 -0.00 0.00 0.00 178.16 177.47 1yua h LEU 71 N 0.17 0.12 -1.31 0.10 3.38 -1.32 -0.18 115.31 116.27 1yua h LEU 71 Ca 0.78 -0.48 0.00 0.00 0.09 0.00 0.00 57.88 58.27 1yua h LEU 71 Cb 2.19 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 42.91 1yua h LEU 71 CO -0.49 0.57 0.00 0.00 0.09 0.00 0.00 178.44 178.61 1yua n ALA 72 N -2.36 1.10 -0.07 1.53 0.00 0.14 -1.26 120.51 119.60 1yua n ALA 72 Ca -0.08 0.18 -0.10 0.00 0.00 0.00 0.00 53.44 53.45 1yua n ALA 72 Cb 0.28 -1.31 -0.15 0.00 0.00 0.00 0.00 19.45 18.27 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 -2.23 0.46 -4.09 0.00 8.00 -0.18 -4.53 116.55 113.99 1yua n ASP 73 Ca -0.01 0.17 -0.36 0.00 0.71 0.00 0.00 54.79 55.30 1yua n ASP 73 Cb 0.05 0.48 0.07 0.00 -0.02 0.00 0.00 41.12 41.70 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 -2.69 -5.14 -1.23 2.24 0.00 -0.12 -4.91 120.51 108.66 1yua n ALA 74 Ca -0.27 -1.13 -0.29 0.00 0.00 0.00 0.00 53.44 51.76 1yua n ALA 74 Cb 1.11 -1.11 0.17 0.00 0.00 0.00 0.00 19.45 19.62 1yua n ALA 74 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1yua s PRO 75 N -2.43 0.56 -0.18 0.00 0.04 -1.26 -5.00 135.00 126.73 1yua s PRO 75 Ca 0.43 0.49 0.19 0.00 0.04 0.00 0.00 61.00 62.14 1yua s PRO 75 Cb -0.04 -1.76 0.46 0.00 0.04 0.00 0.00 34.50 33.21 1yua s PRO 75 CO 0.70 -2.63 1.16 0.00 0.04 0.00 0.00 177.00 176.27 1yua n GLN 76 N -4.10 1.59 -3.44 4.56 10.64 -1.26 -4.63 117.38 120.74 1yua n GLN 76 Ca 0.05 -3.18 0.00 0.00 -1.83 0.00 0.00 57.00 52.05 1yua n GLN 76 Cb 0.57 -1.29 0.00 0.00 -0.86 0.00 0.00 30.24 28.67 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 -0.39 -1.40 -4.38 2.61 -0.00 -1.26 -2.40 117.38 110.15 1yua n GLN 77 Ca 0.16 0.00 -0.19 0.00 -0.00 0.00 0.00 57.00 56.97 1yua n GLN 77 Cb 0.92 0.00 -0.10 0.00 -0.00 0.00 0.00 30.24 31.05 1yua n GLN 77 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.06 177.22 1yua s ASP 78 N -4.00 1.91 0.64 2.61 -4.77 -1.20 -4.55 116.67 107.31 1yua s ASP 78 Ca 0.00 -1.34 0.19 0.00 -3.30 0.00 0.00 52.55 48.09 1yua s ASP 78 Cb 0.00 0.01 0.91 0.00 -1.09 0.00 0.00 42.92 42.75 1yua s ASP 78 CO 0.00 -0.62 1.48 -0.65 0.70 0.00 0.00 175.17 176.08 1yua h PRO 79 N 2.27 0.00 0.14 2.11 0.11 -2.02 0.68 132.00 135.30 1yua h PRO 79 Ca -0.39 0.00 -0.36 0.00 0.11 0.00 0.00 66.00 65.35 1yua h PRO 79 Cb 1.24 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.34 1yua h PRO 79 CO 0.66 0.00 -1.92 1.49 -0.21 0.00 0.00 178.00 178.01 1yua h GLU 80 N 0.00 0.30 0.00 1.05 4.81 -2.05 -3.49 114.58 115.20 1yua h GLU 80 Ca 0.13 -0.51 0.00 0.00 -0.13 0.00 0.00 59.36 58.84 1yua h GLU 80 Cb 1.63 0.19 0.00 0.00 0.63 0.00 0.00 28.75 31.20 1yua h GLU 80 CO -0.00 1.24 0.00 0.41 -0.73 0.00 0.00 179.01 179.93 1yua n GLY 81 N 1.96 1.19 3.51 1.92 0.00 0.24 -5.06 105.19 108.95 1yua n GLY 81 Ca -0.30 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.38 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 0.32 -4.41 1.61 3.02 -1.26 -4.24 115.26 110.30 1yua n ASN 82 Ca 0.00 -0.22 -0.42 0.00 -0.03 0.00 0.00 54.58 53.91 1yua n ASN 82 Cb 0.00 -0.99 0.00 0.00 -0.61 0.00 0.00 39.78 38.18 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 7.91 0.39 -4.53 3.52 4.01 -1.24 -2.94 118.16 125.27 1yua n LYS 83 Ca 0.60 0.14 -0.33 0.00 -0.51 0.00 0.00 58.31 58.22 1yua n LYS 83 Cb 0.17 -1.35 -0.11 0.00 -0.51 0.00 0.00 35.03 33.23 1yua n LYS 83 CO 0.00 0.00 0.00 -0.08 -1.11 0.00 0.00 177.40 176.21 1yua s THR 84 N -1.53 3.67 0.58 -0.18 -1.32 -1.01 0.55 115.64 116.40 1yua s THR 84 Ca 0.62 -0.65 0.07 0.00 -1.21 0.00 0.00 61.69 60.52 1yua s THR 84 Cb -0.61 -2.56 0.07 0.00 -1.51 0.00 0.00 72.50 67.89 1yua s THR 84 CO 0.59 0.48 0.56 0.00 -2.21 0.00 0.00 174.62 174.04 1yua s MET 85 N -1.17 2.23 0.27 7.08 0.23 -0.96 -2.55 119.30 124.43 1yua s MET 85 Ca 0.15 -1.95 -0.21 0.00 -1.03 0.00 0.00 55.69 52.66 1yua s MET 85 Cb -0.11 -2.27 -0.09 0.00 -1.53 0.00 0.00 34.83 30.83 1yua s MET 85 CO 0.05 -0.78 0.80 0.08 -2.03 0.00 0.00 175.02 173.13 1yua s VAL 86 N -2.78 4.48 0.17 5.16 1.01 -0.91 -1.80 120.40 125.73 1yua s VAL 86 Ca 0.43 1.40 0.03 0.00 0.00 0.00 0.00 61.98 63.84 1yua s VAL 86 Cb -0.03 -3.86 -0.01 0.00 0.00 0.00 0.00 36.38 32.48 1yua s VAL 86 CO 0.27 0.12 0.11 0.54 0.00 0.00 0.00 175.10 176.13 1yua n ARG 87 N 0.48 0.43 -3.69 2.72 5.12 0.23 -4.44 116.66 117.50 1yua n ARG 87 Ca -0.00 -1.59 -0.12 0.00 -1.93 0.00 0.00 57.85 54.21 1yua n ARG 87 Cb 0.51 1.12 -0.13 0.00 -1.16 0.00 0.00 32.46 32.80 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 -2.48 -0.44 -0.16 -1.55 5.36 -1.26 -2.26 117.98 115.19 1yua s PHE 88 Ca 0.15 0.98 -0.08 0.00 -0.96 0.00 0.00 56.93 57.02 1yua s PHE 88 Cb 0.01 0.05 -0.04 0.00 -0.34 0.00 0.00 43.02 42.70 1yua s PHE 88 CO 0.11 -0.32 0.12 -1.12 -1.46 0.00 0.00 175.22 172.55 1yua s SER 89 N 1.89 6.20 0.21 6.13 0.01 -0.93 -4.93 113.70 122.28 1yua s SER 89 Ca -0.04 0.32 0.23 0.00 1.31 0.00 0.00 55.95 57.77 1yua s SER 89 Cb -0.11 -2.04 0.05 0.00 0.21 0.00 0.00 66.02 64.13 1yua s SER 89 CO -0.09 0.29 1.11 0.03 0.41 0.00 0.00 173.24 174.99 1yua h ARG 90 N 5.83 0.00 0.00 12.44 3.08 -1.95 0.53 114.38 134.31 1yua h ARG 90 Ca -0.48 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 59.57 1yua h ARG 90 Cb 1.19 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.24 1yua h ARG 90 CO 0.66 0.00 -0.03 0.87 -1.07 0.00 0.00 179.97 180.40 1yua h LYS 91 N 0.00 0.00 0.00 0.04 1.57 -1.98 -3.10 116.57 113.10 1yua h LYS 91 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1yua h LYS 91 Cb 0.98 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.29 1yua h LYS 91 CO 0.00 0.03 0.00 0.25 -0.57 0.00 0.00 179.45 179.16 1yua n THR 92 N -3.50 0.05 -3.77 -0.16 -2.24 -1.24 -5.03 114.28 98.39 1yua n THR 92 Ca -0.02 -0.08 -0.30 0.00 -2.27 0.00 0.00 64.05 61.38 1yua n THR 92 Cb 0.13 1.47 0.02 0.00 -2.10 0.00 0.00 70.33 69.85 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 -0.02 -2.00 -2.57 -0.78 5.02 0.14 -4.97 118.16 112.97 1yua n LYS 93 Ca 0.00 0.44 -0.06 0.00 -2.02 0.00 0.00 58.31 56.67 1yua n LYS 93 Cb 0.34 -4.25 -0.02 0.00 -0.02 0.00 0.00 35.03 31.08 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 -4.28 0.57 -4.75 1.97 6.02 -0.95 -4.97 117.38 111.00 1yua n GLN 94 Ca -0.17 -0.83 -0.33 0.00 -0.01 0.00 0.00 57.00 55.66 1yua n GLN 94 Cb 0.62 0.54 -0.15 0.00 1.02 0.00 0.00 30.24 32.27 1yua n GLN 94 CO 0.00 0.00 0.00 -1.14 -1.01 0.00 0.00 177.06 174.91 1yua s GLN 95 N -2.36 3.35 -0.01 -1.09 2.00 -1.26 -2.20 119.66 118.09 1yua s GLN 95 Ca 0.07 -0.70 0.03 0.00 -2.00 0.00 0.00 55.36 52.75 1yua s GLN 95 Cb 0.00 -2.62 -0.00 0.00 0.80 0.00 0.00 33.01 31.19 1yua s GLN 95 CO 0.05 0.17 -0.09 1.52 -0.50 0.00 0.00 175.29 176.45 1yua s TYR 96 N 0.44 0.82 0.51 1.67 -0.85 -0.96 -2.35 117.35 116.62 1yua s TYR 96 Ca -0.10 -0.16 -0.02 0.00 -0.52 0.00 0.00 57.07 56.26 1yua s TYR 96 Cb -0.16 -0.54 0.00 0.00 0.38 0.00 0.00 41.96 41.64 1yua s TYR 96 CO 0.05 -0.03 0.76 0.14 -1.52 0.00 0.00 175.55 174.95 1yua s VAL 97 N -0.11 3.84 -0.19 -3.49 -7.23 0.10 0.74 120.40 114.05 1yua s VAL 97 Ca 0.02 -0.31 -0.05 0.00 -1.81 0.00 0.00 61.98 59.83 1yua s VAL 97 Cb -0.05 -3.46 0.10 0.00 0.56 0.00 0.00 36.38 33.53 1yua s VAL 97 CO -0.00 -0.38 0.37 -0.44 -0.31 0.00 0.00 175.10 174.34 1yua s SER 98 N -4.25 0.03 1.04 4.85 0.01 -0.74 0.17 113.70 114.81 1yua s SER 98 Ca 0.51 0.70 -0.18 0.00 1.31 0.00 0.00 55.95 58.28 1yua s SER 98 Cb -0.10 1.13 0.01 0.00 0.21 0.00 0.00 66.02 67.27 1yua s SER 98 CO 0.41 -0.25 -0.24 -1.20 0.41 0.00 0.00 173.24 172.37 1yua n SER 99 N 5.37 -2.85 -3.71 2.44 7.64 0.48 -2.27 113.62 120.73 1yua n SER 99 Ca -0.07 0.06 -0.11 0.00 1.01 0.00 0.00 58.87 59.76 1yua n SER 99 Cb 0.50 -0.93 -0.11 0.00 -1.01 0.00 0.00 64.21 62.66 1yua n SER 99 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 1yua s GLU 100 N -3.09 0.38 -1.15 1.43 2.02 0.19 -3.39 118.70 115.09 1yua s GLU 100 Ca 0.51 0.72 -0.08 0.00 0.02 0.00 0.00 54.97 56.14 1yua s GLU 100 Cb -0.12 -0.00 0.25 0.00 0.10 0.00 0.00 34.13 34.36 1yua s GLU 100 CO 0.69 -0.14 1.45 1.17 0.02 0.00 0.00 175.26 178.45 1yua n LYS 101 N 4.05 3.88 -1.00 1.61 4.81 -1.26 -3.64 118.16 126.61 1yua n LYS 101 Ca -0.22 -4.21 -0.00 0.00 -0.87 0.00 0.00 58.31 53.00 1yua n LYS 101 Cb 0.55 -2.69 -0.00 0.00 0.02 0.00 0.00 35.03 32.91 1yua n LYS 101 CO 0.00 0.00 0.00 -3.47 1.17 0.00 0.00 177.40 175.10 1yua n ASP 102 N 2.88 -4.10 0.00 3.14 -0.08 -1.26 -3.86 116.55 113.27 1yua n ASP 102 Ca 0.30 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.58 1yua n ASP 102 Cb 0.37 -1.60 0.00 0.00 2.34 0.00 0.00 41.12 42.22 1yua n ASP 102 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1yua n GLY 103 N -1.54 0.68 0.33 0.27 0.00 -1.26 -5.05 105.19 98.63 1yua n GLY 103 Ca -0.00 -0.57 0.00 0.00 0.00 0.00 0.00 46.02 45.45 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 -3.55 1.61 2.85 -1.25 -5.05 118.16 112.77 1yua n LYS 104 Ca 0.00 -0.41 -0.24 0.00 -1.05 0.00 0.00 58.31 56.61 1yua n LYS 104 Cb 0.00 -0.25 0.01 0.00 -0.65 0.00 0.00 35.03 34.14 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 -2.65 -0.29 0.58 0.00 -1.26 -4.73 120.51 112.16 1yua n ALA 105 Ca 0.00 0.03 0.02 0.00 0.00 0.00 0.00 53.44 53.49 1yua n ALA 105 Cb 0.57 -1.44 0.09 0.00 0.00 0.00 0.00 19.45 18.67 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 0.62 0.16 0.00 0.00 1.35 -1.86 -3.46 112.91 109.72 1yua h THR 106 Ca -0.49 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.37 1yua h THR 106 Cb 1.32 0.16 0.00 0.00 -1.73 0.00 0.00 68.15 67.90 1yua h THR 106 CO 0.31 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 176.19 1yua n GLY 107 N -1.53 3.36 3.61 5.82 0.00 -1.26 -5.02 105.19 110.17 1yua n GLY 107 Ca 0.11 -0.47 -0.50 0.00 0.00 0.00 0.00 46.02 45.17 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 1.71 -3.52 1.61 -0.00 -1.26 -4.56 117.44 111.42 1yua n TRP 108 Ca 0.00 0.54 -0.26 0.00 -0.00 0.00 0.00 57.50 57.78 1yua n TRP 108 Cb 0.00 -2.39 -0.14 0.00 -0.00 0.00 0.00 31.31 28.78 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 0.52 2.87 0.27 5.87 1.04 -1.26 -0.39 113.70 122.62 1yua s SER 109 Ca 0.81 -1.02 -0.10 0.00 0.48 0.00 0.00 55.95 56.11 1yua s SER 109 Cb -0.85 -0.12 -0.07 0.00 0.10 0.00 0.00 66.02 65.07 1yua s SER 109 CO 0.45 -0.41 0.61 0.00 0.98 0.00 0.00 173.24 174.87 1yua s ALA 110 N 2.17 3.50 -0.04 5.32 0.00 0.13 -1.45 121.76 131.38 1yua s ALA 110 Ca 0.08 -0.22 0.06 0.00 0.00 0.00 0.00 51.96 51.88 1yua s ALA 110 Cb -0.16 -2.52 -0.01 0.00 0.00 0.00 0.00 23.12 20.43 1yua s ALA 110 CO -0.31 0.40 -0.23 -0.06 0.00 0.00 0.00 175.76 175.56 1yua s PHE 111 N -1.93 2.19 -0.51 0.00 0.40 -0.77 0.03 117.98 117.39 1yua s PHE 111 Ca 0.49 -0.57 -0.24 0.00 -0.60 0.00 0.00 56.93 56.01 1yua s PHE 111 Cb -0.11 -1.43 0.04 0.00 0.51 0.00 0.00 43.02 42.03 1yua s PHE 111 CO 0.22 -0.15 0.87 -0.47 0.70 0.00 0.00 175.22 176.39 1yua s TYR 112 N -0.25 2.89 0.00 0.36 5.04 -0.99 0.56 117.35 124.96 1yua s TYR 112 Ca 0.00 0.04 0.00 0.00 -2.44 0.00 0.00 57.07 54.67 1yua s TYR 112 Cb -0.12 -3.90 0.00 0.00 0.35 0.00 0.00 41.96 38.30 1yua s TYR 112 CO 0.02 -1.19 0.00 0.28 -1.34 0.00 0.00 175.55 173.32 1yua n VAL 113 N 6.16 0.00 -2.01 3.14 0.31 -0.92 -4.74 118.33 120.26 1yua n VAL 113 Ca 0.02 0.00 -0.26 0.00 -0.01 0.00 0.00 64.34 64.09 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 -1.81 -1.32 0.00 0.00 176.83 173.70 1yua s ASP 114 N -1.00 4.96 -0.97 4.52 1.11 -1.26 -2.86 116.67 121.17 1yua s ASP 114 Ca 0.00 -1.02 0.00 0.00 0.18 0.00 0.00 52.55 51.71 1yua s ASP 114 Cb 0.00 -2.57 0.00 0.00 1.07 0.00 0.00 42.92 41.42 1yua s ASP 114 CO 0.00 -3.02 0.00 0.61 1.18 0.00 0.00 175.17 173.94 1yua n GLY 115 N 6.43 0.01 2.46 0.21 0.00 -1.26 -4.81 105.19 108.22 1yua n GLY 115 Ca 0.42 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 46.18 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 -2.40 2.35 -0.85 1.61 4.01 -1.13 -5.10 118.16 116.65 1yua n LYS 116 Ca -0.12 -4.47 -0.34 0.00 -0.51 0.00 0.00 58.31 52.87 1yua n LYS 116 Cb 0.51 -2.09 0.10 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 0.73 -2.53 -3.80 2.13 7.02 -1.25 -2.17 117.44 117.56 1yua n TRP 117 Ca 0.29 0.17 -0.08 0.00 -1.02 0.00 0.00 57.50 56.85 1yua n TRP 117 Cb 0.43 -1.63 -0.01 0.00 -2.42 0.00 0.00 31.31 27.67 1yua n TRP 117 CO 0.00 0.00 0.00 1.33 -2.02 0.00 0.00 177.69 177.00 1yua n VAL 118 N -3.38 0.00 -3.46 -0.99 0.24 0.19 -4.74 118.33 106.20 1yua n VAL 118 Ca 0.03 -1.00 -0.23 0.00 -2.04 0.00 0.00 64.34 61.10 1yua n VAL 118 Cb 0.57 0.65 -0.12 0.00 -1.47 0.00 0.00 33.84 33.46 1yua n VAL 118 CO 0.00 0.00 0.00 -1.83 -2.14 0.00 0.00 176.83 172.86 1yua s GLU 119 N -2.42 0.31 0.21 7.34 -1.05 -1.26 -1.85 118.70 119.97 1yua s GLU 119 Ca 0.16 -0.44 -0.15 0.00 -0.15 0.00 0.00 54.97 54.39 1yua s GLU 119 Cb -0.01 -0.92 0.21 0.00 -0.44 0.00 0.00 34.13 32.97 1yua s GLU 119 CO 0.12 -1.05 1.62 0.78 0.95 0.00 0.00 175.26 177.67 1yua h GLY 120 N 8.15 0.32 -3.09 -3.83 0.00 -1.61 -3.48 103.07 99.52 1yua h GLY 120 Ca -0.13 0.26 0.00 0.00 0.00 0.00 0.00 47.33 47.46 1yua h GLY 120 CO 0.36 -0.24 -0.31 1.17 0.00 0.00 0.00 176.54 177.53 1yua n LYS 121 N -5.44 -1.11 0.00 4.80 3.00 -1.26 -5.03 118.16 113.12 1yua n LYS 121 Ca 0.07 1.21 0.01 0.00 -0.00 0.00 0.00 58.31 59.60 1yua n LYS 121 Cb 0.34 -1.73 0.01 0.00 0.00 0.00 0.00 35.03 33.65 1yua n LYS 121 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.40 178.57