#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hoy n ASN 2 N 0.00 0.63 -4.60 6.12 3.02 -1.26 -5.05 115.26 114.11 3hoy n ASN 2 Ca 0.00 -1.29 -0.43 0.00 -0.03 0.00 0.00 54.58 52.83 3hoy n ASN 2 Cb 0.00 0.00 -0.02 0.00 -0.61 0.00 0.00 39.78 39.15 3hoy n ASN 2 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3hoy s ALA 3 N -0.29 3.05 0.45 5.41 0.00 -1.26 -5.01 121.76 124.11 3hoy s ALA 3 Ca 0.00 -0.00 -0.24 0.00 0.00 0.00 0.00 51.96 51.71 3hoy s ALA 3 Cb 0.00 -3.94 -0.08 0.00 0.00 0.00 0.00 23.12 19.11 3hoy s ALA 3 CO 0.00 -2.36 1.30 -1.25 0.00 0.00 0.00 175.76 173.46 3hoy s PRO 4 N 5.00 3.72 -0.07 0.00 0.04 -1.26 -4.90 135.00 137.53 3hoy s PRO 4 Ca 0.65 2.13 -0.33 0.00 0.04 0.00 0.00 61.00 63.50 3hoy s PRO 4 Cb -0.16 -2.57 -0.11 0.00 0.04 0.00 0.00 34.50 31.69 3hoy s PRO 4 CO 0.32 -0.69 1.93 -0.25 0.04 0.00 0.00 177.00 178.35 3hoy n ASP 5 N -0.27 3.59 -0.44 6.66 8.00 -1.26 -4.85 116.55 127.98 3hoy n ASP 5 Ca 0.06 0.90 0.36 0.00 0.71 0.00 0.00 54.79 56.83 3hoy n ASP 5 Cb 0.44 -1.41 0.64 0.00 -0.02 0.00 0.00 41.12 40.77 3hoy n ASP 5 CO 0.00 0.00 0.00 0.03 -0.39 0.00 0.00 177.20 176.84 3hoy h ARG 6 N 9.93 0.10 0.00 -1.24 2.47 -2.05 0.86 114.38 124.45 3hoy h ARG 6 Ca -0.48 -0.01 0.00 0.00 -1.26 0.00 0.00 59.98 58.23 3hoy h ARG 6 Cb 1.26 -0.02 0.00 0.00 -1.65 0.00 0.00 29.97 29.56 3hoy h ARG 6 CO 0.95 0.06 0.00 1.97 0.56 0.00 0.00 179.97 183.51 3hoy n PHE 7 N -4.69 0.00 0.56 3.04 1.16 -1.26 -1.13 117.46 115.15 3hoy n PHE 7 Ca 0.37 0.00 0.10 0.00 -1.87 0.00 0.00 57.45 56.05 3hoy n PHE 7 Cb 1.41 -0.39 0.42 0.00 -1.61 0.00 0.00 39.48 39.31 3hoy n PHE 7 CO 0.00 0.00 0.00 0.39 -1.87 0.00 0.00 176.76 175.28 3hoy n GLU 8 N -1.39 0.09 0.24 3.97 1.02 0.30 -1.61 120.64 123.26 3hoy n GLU 8 Ca 0.03 0.26 0.14 0.00 -0.02 0.00 0.00 57.16 57.57 3hoy n GLU 8 Cb 0.08 -1.65 0.41 0.00 -0.02 0.00 0.00 31.44 30.26 3hoy n GLU 8 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 3hoy h LEU 9 N 0.00 0.00 0.00 -4.62 3.38 -1.31 -3.38 115.31 109.37 3hoy h LEU 9 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3hoy h LEU 9 Cb 0.38 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.13 3hoy h LEU 9 CO 0.00 0.02 -0.17 2.22 0.09 0.00 0.00 178.44 180.59 3hoy n PHE 10 N -3.11 0.00 -3.60 1.13 1.16 -1.05 -4.27 117.46 107.72 3hoy n PHE 10 Ca 0.02 0.00 -0.38 0.00 -1.87 0.00 0.00 57.45 55.23 3hoy n PHE 10 Cb 0.43 0.00 -0.11 0.00 -1.61 0.00 0.00 39.48 38.19 3hoy n PHE 10 CO 0.00 0.00 0.00 -0.51 -1.87 0.00 0.00 176.76 174.38 3hoy s LEU 11 N -0.86 4.01 0.51 5.98 1.43 -0.63 -4.95 118.68 124.16 3hoy s LEU 11 Ca 0.00 -0.00 -0.23 0.00 -1.03 0.00 0.00 54.13 52.87 3hoy s LEU 11 Cb 0.00 -2.11 -0.06 0.00 0.03 0.00 0.00 46.19 44.05 3hoy s LEU 11 CO 0.00 -0.04 1.39 -0.76 0.23 0.00 0.00 176.35 177.18 3hoy s LEU 12 N 1.67 3.95 0.00 1.79 1.02 -1.26 -4.75 118.68 121.11 3hoy s LEU 12 Ca 0.07 2.84 -0.07 0.00 0.02 0.00 0.00 54.13 57.00 3hoy s LEU 12 Cb -0.16 -4.14 0.14 0.00 0.02 0.00 0.00 46.19 42.06 3hoy s LEU 12 CO 0.10 -1.43 0.90 0.61 0.02 0.00 0.00 176.35 176.55 3hoy n GLY 13 N 0.67 -0.39 3.68 -3.19 0.00 -1.26 -4.93 105.19 99.76 3hoy n GLY 13 Ca 0.08 -1.85 -0.55 0.00 0.00 0.00 0.00 46.02 43.70 3hoy n GLY 13 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3hoy n GLU 14 N -2.81 1.30 -2.82 1.61 1.02 -1.26 -2.36 120.64 115.32 3hoy n GLU 14 Ca 0.13 0.48 -0.19 0.00 -0.02 0.00 0.00 57.16 57.56 3hoy n GLU 14 Cb 0.45 -2.17 0.00 0.00 -0.02 0.00 0.00 31.44 29.70 3hoy n GLU 14 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3hoy n GLY 15 N 3.82 -0.50 3.96 0.62 0.00 -1.26 -4.99 105.19 106.83 3hoy n GLY 15 Ca 0.24 0.05 -0.19 0.00 0.00 0.00 0.00 46.02 46.12 3hoy n GLY 15 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3hoy s GLU 16 N -5.45 3.02 -0.01 1.61 2.02 -0.99 -5.13 118.70 113.76 3hoy s GLU 16 Ca 0.18 -1.09 0.03 0.00 0.02 0.00 0.00 54.97 54.11 3hoy s GLU 16 Cb -0.09 -2.73 -0.01 0.00 0.10 0.00 0.00 34.13 31.40 3hoy s GLU 16 CO 0.22 0.07 -0.10 -1.12 0.02 0.00 0.00 175.26 174.35 3hoy s SER 17 N -4.13 1.15 0.15 -0.19 0.01 -1.26 -4.86 113.70 104.57 3hoy s SER 17 Ca 0.44 -0.19 -0.27 0.00 1.31 0.00 0.00 55.95 57.24 3hoy s SER 17 Cb -0.09 -0.12 -0.01 0.00 0.21 0.00 0.00 66.02 66.01 3hoy s SER 17 CO 0.30 0.11 1.58 0.11 0.41 0.00 0.00 173.24 175.76 3hoy h LYS 18 N 5.86 -0.36 -6.23 12.44 1.79 -1.89 -3.34 116.57 124.83 3hoy h LYS 18 Ca -0.31 0.02 -0.61 0.00 -2.18 0.00 0.00 60.65 57.57 3hoy h LYS 18 Cb 1.18 0.08 -0.09 0.00 -1.58 0.00 0.00 32.23 31.82 3hoy h LYS 18 CO 0.49 -0.24 -0.60 -0.51 -1.08 0.00 0.00 179.45 177.51 3hoy s LEU 19 N -10.47 3.69 -0.14 2.94 1.43 -1.26 0.13 118.68 115.00 3hoy s LEU 19 Ca -0.15 -0.14 -0.07 0.00 -1.03 0.00 0.00 54.13 52.74 3hoy s LEU 19 Cb 0.11 -2.34 0.05 0.00 0.03 0.00 0.00 46.19 44.04 3hoy s LEU 19 CO 0.65 0.12 0.33 -0.75 0.23 0.00 0.00 176.35 176.93 3hoy s LYS 20 N -2.77 0.30 -0.15 1.70 2.20 -1.05 -4.96 119.74 115.02 3hoy s LYS 20 Ca 0.29 0.67 0.00 0.00 -0.36 0.00 0.00 55.97 56.58 3hoy s LYS 20 Cb -0.11 -0.07 0.02 0.00 -1.51 0.00 0.00 37.83 36.17 3hoy s LYS 20 CO 0.22 -0.16 -0.14 0.42 -0.36 0.00 0.00 175.35 175.32 3hoy s ILE 21 N 1.36 1.54 -0.04 5.43 1.01 -1.26 -1.00 121.20 128.23 3hoy s ILE 21 Ca -0.09 -0.61 0.05 0.00 0.00 0.00 0.00 60.65 60.00 3hoy s ILE 21 Cb -0.09 -1.45 -0.01 0.00 0.01 0.00 0.00 42.46 40.92 3hoy s ILE 21 CO -0.11 0.45 -0.20 -1.81 0.00 0.00 0.00 174.94 173.27 3hoy s ASP 22 N 1.49 2.51 0.02 3.58 1.01 -0.46 -5.00 116.67 119.83 3hoy s ASP 22 Ca 0.05 -0.41 -0.30 0.00 0.71 0.00 0.00 52.55 52.60 3hoy s ASP 22 Cb -0.13 -0.63 -0.05 0.00 1.01 0.00 0.00 42.92 43.13 3hoy s ASP 22 CO -0.11 0.20 1.15 -2.16 0.21 0.00 0.00 175.17 174.47 3hoy s PRO 23 N -0.11 4.44 -0.16 8.23 0.04 -1.26 -0.33 135.00 145.85 3hoy s PRO 23 Ca -0.02 1.67 -0.29 0.00 0.04 0.00 0.00 61.00 62.40 3hoy s PRO 23 Cb -0.12 -3.42 -0.02 0.00 0.04 0.00 0.00 34.50 30.99 3hoy s PRO 23 CO 0.02 -0.26 1.29 0.34 0.04 0.00 0.00 177.00 178.43 3hoy s ASP 24 N 1.14 6.93 0.06 6.66 -1.08 -0.86 -4.88 116.67 124.64 3hoy s ASP 24 Ca 0.57 1.73 -0.02 0.00 -0.52 0.00 0.00 52.55 54.31 3hoy s ASP 24 Cb -0.27 -2.54 -0.27 0.00 -1.46 0.00 0.00 42.92 38.39 3hoy s ASP 24 CO 0.27 -0.77 1.09 0.71 0.52 0.00 0.00 175.17 176.99 3hoy h THR 25 N 5.50 1.44 -0.97 1.71 1.35 -1.94 -3.36 112.91 116.64 3hoy h THR 25 Ca -0.27 -3.06 0.17 0.00 -0.55 0.00 0.00 66.41 62.70 3hoy h THR 25 Cb 1.11 2.88 -0.17 0.00 -1.73 0.00 0.00 68.15 70.23 3hoy h THR 25 CO 0.97 0.88 -0.31 0.29 -0.25 0.00 0.00 175.52 177.09 3hoy n LYS 26 N -3.47 -0.16 -4.35 4.72 4.76 -1.26 -4.59 118.16 113.81 3hoy n LYS 26 Ca -0.09 1.50 -0.23 0.00 -2.87 0.00 0.00 58.31 56.62 3hoy n LYS 26 Cb 1.02 -2.24 -0.12 0.00 -1.84 0.00 0.00 35.03 31.86 3hoy n LYS 26 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3hoy s ALA 27 N -6.06 2.11 0.44 7.82 0.00 -1.26 -5.14 121.76 119.68 3hoy s ALA 27 Ca -0.14 -1.50 -0.24 0.00 0.00 0.00 0.00 51.96 50.09 3hoy s ALA 27 Cb 0.23 -0.23 -0.08 0.00 0.00 0.00 0.00 23.12 23.04 3hoy s ALA 27 CO 0.72 0.30 1.16 -1.25 0.00 0.00 0.00 175.76 176.69 3hoy s PRO 28 N -2.65 3.88 -0.66 0.00 0.04 -1.26 -4.19 135.00 130.16 3hoy s PRO 28 Ca 0.16 1.77 -0.17 0.00 0.04 0.00 0.00 61.00 62.79 3hoy s PRO 28 Cb -0.07 -2.50 0.03 0.00 0.04 0.00 0.00 34.50 32.00 3hoy s PRO 28 CO 0.07 -0.45 0.63 -1.71 0.04 0.00 0.00 177.00 175.58 3hoy n ASN 29 N -0.29 -5.13 -3.61 6.66 2.85 -1.26 -4.87 115.26 109.61 3hoy n ASN 29 Ca 0.06 -0.62 -0.14 0.00 -0.11 0.00 0.00 54.58 53.77 3hoy n ASN 29 Cb 0.48 -1.65 -0.06 0.00 1.24 0.00 0.00 39.78 39.78 3hoy n ASN 29 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 3hoy s ALA 30 N -2.32 -1.26 0.16 5.20 0.00 -1.26 -3.20 121.76 119.07 3hoy s ALA 30 Ca 0.17 0.62 -0.05 0.00 0.00 0.00 0.00 51.96 52.71 3hoy s ALA 30 Cb -0.02 0.26 -0.03 0.00 0.00 0.00 0.00 23.12 23.34 3hoy s ALA 30 CO 0.89 -0.44 0.17 0.08 0.00 0.00 0.00 175.76 176.46 3hoy s VAL 31 N -2.07 0.07 -0.14 0.00 1.01 0.11 -2.03 120.40 117.35 3hoy s VAL 31 Ca -0.07 -1.70 -0.00 0.00 0.00 0.00 0.00 61.98 60.20 3hoy s VAL 31 Cb -0.01 -2.02 0.03 0.00 0.00 0.00 0.00 36.38 34.37 3hoy s VAL 31 CO 0.01 -0.33 -0.09 -0.69 0.00 0.00 0.00 175.10 174.00 3hoy s VAL 32 N -4.03 1.24 -0.18 2.92 1.01 0.55 -1.20 120.40 120.70 3hoy s VAL 32 Ca 0.23 -0.49 -0.04 0.00 0.00 0.00 0.00 61.98 61.69 3hoy s VAL 32 Cb 0.05 -1.25 -0.02 0.00 0.00 0.00 0.00 36.38 35.16 3hoy s VAL 32 CO 0.02 0.35 -0.03 -0.63 0.00 0.00 0.00 175.10 174.81 3hoy s ILE 33 N 1.61 3.73 -0.38 2.22 1.01 0.56 -1.35 121.20 128.60 3hoy s ILE 33 Ca 0.04 -0.40 -0.14 0.00 0.00 0.00 0.00 60.65 60.15 3hoy s ILE 33 Cb -0.13 -2.66 0.00 0.00 0.01 0.00 0.00 42.46 39.68 3hoy s ILE 33 CO -0.09 0.46 0.28 -0.89 0.00 0.00 0.00 174.94 174.70 3hoy s THR 34 N 0.84 5.26 -0.19 2.92 2.01 -0.17 -0.48 115.64 125.82 3hoy s THR 34 Ca -0.01 -0.45 -0.18 0.00 0.31 0.00 0.00 61.69 61.35 3hoy s THR 34 Cb -0.14 -3.84 -0.03 0.00 0.01 0.00 0.00 72.50 68.49 3hoy s THR 34 CO 0.02 -0.19 0.52 -0.36 -0.69 0.00 0.00 174.62 173.92 3hoy s PHE 35 N 1.72 3.38 -0.12 4.92 0.40 -0.14 -2.51 117.98 125.62 3hoy s PHE 35 Ca 0.06 0.78 -0.09 0.00 -0.60 0.00 0.00 56.93 57.08 3hoy s PHE 35 Cb -0.18 -2.66 -0.04 0.00 0.51 0.00 0.00 43.02 40.64 3hoy s PHE 35 CO 0.10 -0.08 0.19 -1.21 0.70 0.00 0.00 175.22 174.92 3hoy s GLU 36 N 1.56 3.71 -0.46 0.44 0.41 0.34 -2.16 118.70 122.56 3hoy s GLU 36 Ca 0.24 -0.04 -0.19 0.00 -0.41 0.00 0.00 54.97 54.57 3hoy s GLU 36 Cb -0.15 -3.26 0.02 0.00 -1.78 0.00 0.00 34.13 28.97 3hoy s GLU 36 CO 0.10 0.63 0.62 1.63 -0.49 0.00 0.00 175.26 177.75 3hoy n LYS 37 N 2.37 -2.24 -3.65 1.61 4.76 0.58 -4.63 118.16 116.96 3hoy n LYS 37 Ca -0.18 1.96 -0.04 0.00 -2.87 0.00 0.00 58.31 57.19 3hoy n LYS 37 Cb 0.54 -5.07 -0.07 0.00 -1.84 0.00 0.00 35.03 28.59 3hoy n LYS 37 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 3hoy s GLU 38 N -2.64 0.12 0.00 1.97 0.41 -0.56 -4.87 118.70 113.13 3hoy s GLU 38 Ca 0.25 0.14 0.00 0.00 -0.41 0.00 0.00 54.97 54.95 3hoy s GLU 38 Cb -0.06 0.06 0.00 0.00 -1.78 0.00 0.00 34.13 32.35 3hoy s GLU 38 CO 0.79 -0.01 0.00 -0.40 -0.49 0.00 0.00 175.26 175.14 3hoy n ASP 39 N 1.64 0.82 -0.05 -0.19 5.68 -1.26 -3.67 116.55 119.52 3hoy n ASP 39 Ca -0.10 0.00 -0.09 0.00 -0.50 0.00 0.00 54.79 54.10 3hoy n ASP 39 Cb 0.57 0.00 -0.02 0.00 -1.14 0.00 0.00 41.12 40.53 3hoy n ASP 39 CO 0.00 0.00 0.00 0.45 -1.33 0.00 0.00 177.20 176.32 3hoy h HIS 40 N 0.00 -0.70 -0.31 2.11 3.86 -1.97 -2.04 115.15 116.10 3hoy h HIS 40 Ca 0.00 0.04 0.06 0.00 -1.16 0.00 0.00 60.37 59.31 3hoy h HIS 40 Cb 0.00 0.35 -0.05 0.00 1.06 0.00 0.00 27.41 28.76 3hoy h HIS 40 CO 0.00 -0.34 -0.10 2.41 0.86 0.00 0.00 177.93 180.77 3hoy n THR 41 N -5.39 -0.14 0.63 2.45 -1.04 -1.26 0.19 114.28 109.73 3hoy n THR 41 Ca -0.01 0.72 0.11 0.00 -2.04 0.00 0.00 64.05 62.82 3hoy n THR 41 Cb 0.30 -0.97 -0.09 0.00 -1.82 0.00 0.00 70.33 67.75 3hoy n THR 41 CO 0.00 0.00 0.00 -0.11 -0.64 0.00 0.00 175.07 174.32 3hoy n LEU 42 N -4.48 0.63 -0.08 -4.42 0.00 -1.02 -4.19 117.00 103.43 3hoy n LEU 42 Ca 0.04 -0.24 -0.16 0.00 0.00 0.00 0.00 56.01 55.65 3hoy n LEU 42 Cb 0.14 -0.03 -0.11 0.00 0.00 0.00 0.00 43.42 43.42 3hoy n LEU 42 CO -0.04 0.13 -0.05 1.23 0.00 0.00 0.00 177.39 178.66 3hoy h GLY 43 N 4.63 0.00 2.00 -3.96 0.00 0.29 -2.96 103.07 103.07 3hoy h GLY 43 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.32 3hoy h GLY 43 CO 0.00 0.00 -0.06 -0.57 0.00 0.00 0.00 176.54 175.91 3hoy h ASN 44 N -1.00 0.00 0.12 0.19 -1.24 -1.13 -0.66 115.58 111.87 3hoy h ASN 44 Ca -0.15 0.00 -0.01 0.00 0.71 0.00 0.00 56.30 56.86 3hoy h ASN 44 Cb 1.05 0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.10 3hoy h ASN 44 CO -0.09 0.06 -0.06 0.25 -1.29 0.00 0.00 177.43 176.30 3hoy h LEU 45 N 0.00 -0.14 -2.02 0.34 5.85 -1.72 -1.91 115.31 115.70 3hoy h LEU 45 Ca -0.00 -0.37 -0.01 0.00 0.84 0.00 0.00 57.88 58.35 3hoy h LEU 45 Cb 0.30 0.04 -0.00 0.00 0.37 0.00 0.00 40.66 41.37 3hoy h LEU 45 CO 0.01 0.47 -0.04 0.40 -0.34 0.00 0.00 178.44 178.93 3hoy h ILE 46 N -0.93 0.91 -0.22 4.05 2.04 -1.35 -1.94 117.51 120.07 3hoy h ILE 46 Ca -0.02 -0.14 -0.11 0.00 1.00 0.00 0.00 64.86 65.59 3hoy h ILE 46 Cb 0.50 1.08 -0.00 0.00 -0.74 0.00 0.00 36.82 37.66 3hoy h ILE 46 CO 0.03 0.04 -0.28 -0.09 0.00 0.00 0.00 178.15 177.85 3hoy h ARG 47 N 0.00 0.57 0.26 2.37 1.12 -1.12 -3.01 114.38 114.57 3hoy h ARG 47 Ca -0.00 -0.33 -0.01 0.00 -1.11 0.00 0.00 59.98 58.53 3hoy h ARG 47 Cb 0.08 0.02 -0.00 0.00 -0.01 0.00 0.00 29.97 30.06 3hoy h ARG 47 CO 0.01 0.93 -0.17 0.00 -3.11 0.00 0.00 179.97 177.62 3hoy h ALA 48 N 0.64 -1.00 -0.64 2.80 0.00 -0.58 -2.98 119.26 117.49 3hoy h ALA 48 Ca 0.03 -0.08 0.07 0.00 0.00 0.00 0.00 54.91 54.92 3hoy h ALA 48 Cb 0.85 0.31 -0.10 0.00 0.00 0.00 0.00 17.79 18.85 3hoy h ALA 48 CO 0.07 -0.99 -0.55 0.93 0.00 0.00 0.00 179.25 178.71 3hoy h GLU 49 N -0.41 -0.22 -1.66 0.00 4.39 -1.57 0.94 114.58 116.04 3hoy h GLU 49 Ca -0.03 0.02 0.48 0.00 0.34 0.00 0.00 59.36 60.16 3hoy h GLU 49 Cb 0.33 0.05 -0.07 0.00 -0.10 0.00 0.00 28.75 28.97 3hoy h GLU 49 CO 0.03 -0.15 1.28 -0.07 -1.16 0.00 0.00 179.01 178.94 3hoy h LEU 50 N -0.23 0.00 0.00 1.33 3.38 -1.54 1.24 115.31 119.50 3hoy h LEU 50 Ca 0.13 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.10 3hoy h LEU 50 Cb 0.53 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.28 3hoy h LEU 50 CO -0.73 0.00 0.00 0.18 0.09 0.00 0.00 178.44 177.98 3hoy n LEU 51 N -3.85 0.00 -0.08 1.67 4.32 0.33 -3.11 117.00 116.28 3hoy n LEU 51 Ca 0.37 0.00 -0.14 0.00 -0.02 0.00 0.00 56.01 56.23 3hoy n LEU 51 Cb 1.79 0.00 -0.06 0.00 -1.62 0.00 0.00 43.42 43.52 3hoy n LEU 51 CO 0.40 0.00 -1.01 0.59 -1.22 0.00 0.00 177.39 176.15 3hoy n ASN 52 N -0.62 1.94 -4.49 -1.43 3.02 0.43 -4.87 115.26 109.24 3hoy n ASN 52 Ca 0.05 0.06 -0.49 0.00 -0.03 0.00 0.00 54.58 54.17 3hoy n ASN 52 Cb 0.02 -0.35 -0.06 0.00 -0.61 0.00 0.00 39.78 38.78 3hoy n ASN 52 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 3hoy n ASP 53 N -3.33 2.44 0.00 6.41 -0.08 -1.18 -4.75 116.55 116.07 3hoy n ASP 53 Ca -0.28 0.40 0.12 0.00 -1.51 0.00 0.00 54.79 53.52 3hoy n ASP 53 Cb 0.75 -1.33 0.59 0.00 2.34 0.00 0.00 41.12 43.47 3hoy n ASP 53 CO 0.00 0.00 0.00 -1.14 0.12 0.00 0.00 177.20 176.18 3hoy n ARG 54 N 8.20 0.28 -0.17 -0.67 0.63 -1.26 -2.29 116.66 121.38 3hoy n ARG 54 Ca 0.38 0.06 0.02 0.00 -0.92 0.00 0.00 57.85 57.39 3hoy n ARG 54 Cb 0.28 -1.50 0.09 0.00 0.45 0.00 0.00 32.46 31.77 3hoy n ARG 54 CO 0.00 0.00 0.00 1.63 -2.51 0.00 0.00 177.63 176.75 3hoy n LYS 55 N -1.33 1.74 -3.71 -0.14 5.02 -1.26 -4.64 118.16 113.85 3hoy n LYS 55 Ca 0.10 -0.68 -0.38 0.00 -2.02 0.00 0.00 58.31 55.33 3hoy n LYS 55 Cb 0.21 -1.52 -0.12 0.00 -0.02 0.00 0.00 35.03 33.58 3hoy n LYS 55 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3hoy s VAL 56 N -1.50 3.94 0.16 -0.18 1.01 -0.97 -0.76 120.40 122.10 3hoy s VAL 56 Ca 0.12 -1.17 -0.03 0.00 0.00 0.00 0.00 61.98 60.90 3hoy s VAL 56 Cb 0.08 -3.27 -0.12 0.00 0.00 0.00 0.00 36.38 33.07 3hoy s VAL 56 CO 0.05 -0.26 1.40 -0.07 0.00 0.00 0.00 175.10 176.22 3hoy h LEU 57 N 8.27 0.53 -7.23 3.92 3.38 0.75 -3.47 115.31 121.46 3hoy h LEU 57 Ca -0.23 -0.36 -0.09 0.00 0.09 0.00 0.00 57.88 57.29 3hoy h LEU 57 Cb 1.08 -0.16 -0.21 0.00 0.09 0.00 0.00 40.66 41.47 3hoy h LEU 57 CO 0.64 1.11 -0.06 0.12 0.09 0.00 0.00 178.44 180.34 3hoy s PHE 58 N -3.58 -0.48 -0.30 1.13 5.36 -0.62 -4.96 117.98 114.53 3hoy s PHE 58 Ca -0.06 0.97 -0.11 0.00 -0.96 0.00 0.00 56.93 56.77 3hoy s PHE 58 Cb 0.10 0.23 0.17 0.00 -0.34 0.00 0.00 43.02 43.18 3hoy s PHE 58 CO 0.85 -0.42 0.88 0.00 -1.46 0.00 0.00 175.22 175.07 3hoy s ALA 59 N -0.68 -2.73 0.33 11.12 0.00 -1.25 -0.21 121.76 128.34 3hoy s ALA 59 Ca -0.08 1.88 0.06 0.00 0.00 0.00 0.00 51.96 53.82 3hoy s ALA 59 Cb -0.03 -2.16 -0.02 0.00 0.00 0.00 0.00 23.12 20.90 3hoy s ALA 59 CO 0.05 -1.17 0.31 0.00 0.00 0.00 0.00 175.76 174.95 3hoy s ALA 60 N 2.73 1.69 0.05 0.00 0.00 -0.88 -4.96 121.76 120.39 3hoy s ALA 60 Ca 0.02 -1.99 -0.27 0.00 0.00 0.00 0.00 51.96 49.73 3hoy s ALA 60 Cb -0.10 1.43 0.08 0.00 0.00 0.00 0.00 23.12 24.53 3hoy s ALA 60 CO -0.17 -0.68 0.69 1.52 0.00 0.00 0.00 175.76 177.12 3hoy s TYR 61 N -3.37 -0.54 0.10 0.00 -0.85 -1.26 -1.41 117.35 110.02 3hoy s TYR 61 Ca 0.39 0.57 -0.15 0.00 -0.52 0.00 0.00 57.07 57.37 3hoy s TYR 61 Cb 0.02 0.50 0.03 0.00 0.38 0.00 0.00 41.96 42.89 3hoy s TYR 61 CO 0.27 -0.70 0.35 -1.59 -1.52 0.00 0.00 175.55 172.36 3hoy s LYS 62 N -2.71 0.99 -0.76 -3.49 -2.85 -0.70 -4.98 119.74 105.24 3hoy s LYS 62 Ca -0.02 -0.71 -0.04 0.00 -1.00 0.00 0.00 55.97 54.21 3hoy s LYS 62 Cb -0.01 0.43 0.19 0.00 -2.06 0.00 0.00 37.83 36.39 3hoy s LYS 62 CO -0.04 -0.36 0.62 0.14 0.10 0.00 0.00 175.35 175.80 3hoy s VAL 63 N -3.58 4.21 0.09 1.79 -7.23 -1.26 -1.75 120.40 112.68 3hoy s VAL 63 Ca 0.02 -3.29 -0.03 0.00 -1.81 0.00 0.00 61.98 56.87 3hoy s VAL 63 Cb 0.02 -3.67 0.15 0.00 0.56 0.00 0.00 36.38 33.44 3hoy s VAL 63 CO -0.10 -0.98 0.52 -0.62 -0.31 0.00 0.00 175.10 173.60 3hoy n GLU 64 N 3.05 -0.03 -3.70 4.82 -0.58 -1.26 -4.39 120.64 118.56 3hoy n GLU 64 Ca 0.14 0.52 -0.14 0.00 -0.42 0.00 0.00 57.16 57.26 3hoy n GLU 64 Cb 0.38 -0.77 -0.09 0.00 -0.57 0.00 0.00 31.44 30.40 3hoy n GLU 64 CO 0.00 0.00 0.00 -1.58 -0.48 0.00 0.00 177.13 175.07 3hoy s HIS 65 N -5.42 -0.45 0.34 -0.32 5.04 -1.26 -5.08 115.29 108.15 3hoy s HIS 65 Ca -0.05 1.00 0.09 0.00 -1.54 0.00 0.00 55.06 54.55 3hoy s HIS 65 Cb 0.09 0.19 0.63 0.00 0.04 0.00 0.00 32.58 33.53 3hoy s HIS 65 CO 0.26 -0.34 1.81 -1.00 -2.34 0.00 0.00 174.74 173.13 3hoy h PRO 66 N 4.67 0.20 -0.75 2.88 0.13 -1.98 -3.00 132.00 134.15 3hoy h PRO 66 Ca -0.28 -0.07 0.18 0.00 -0.87 0.00 0.00 66.00 64.96 3hoy h PRO 66 Cb 1.17 -0.01 -0.04 0.00 0.13 0.00 0.00 31.00 32.25 3hoy h PRO 66 CO 0.28 0.48 0.51 0.74 -0.23 0.00 0.00 178.00 179.78 3hoy h PHE 67 N 0.18 0.26 -3.29 1.56 0.05 -1.98 -3.41 116.94 110.30 3hoy h PHE 67 Ca 0.03 0.01 -0.59 0.00 3.82 0.00 0.00 57.97 61.23 3hoy h PHE 67 Cb 0.62 -0.08 -0.11 0.00 2.00 0.00 0.00 35.95 38.38 3hoy h PHE 67 CO 0.01 0.09 -0.38 -0.06 -0.18 0.00 0.00 178.31 177.79 3hoy s PHE 68 N -5.21 3.44 0.00 -0.55 2.99 -1.13 -4.99 117.98 112.52 3hoy s PHE 68 Ca -0.07 0.51 -0.03 0.00 0.00 0.00 0.00 56.93 57.34 3hoy s PHE 68 Cb 0.21 -2.29 -0.14 0.00 0.00 0.00 0.00 43.02 40.80 3hoy s PHE 68 CO 0.76 0.25 2.31 0.00 -0.00 0.00 0.00 175.22 178.54 3hoy n ALA 69 N 3.59 4.27 -2.86 5.36 0.00 -1.26 -4.81 120.51 124.80 3hoy n ALA 69 Ca -0.13 -0.96 -0.12 0.00 0.00 0.00 0.00 53.44 52.23 3hoy n ALA 69 Cb 0.52 -2.09 -0.06 0.00 0.00 0.00 0.00 19.45 17.82 3hoy n ALA 69 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 3hoy s ARG 70 N 1.46 1.64 0.25 0.00 1.70 -1.24 -0.30 118.95 122.46 3hoy s ARG 70 Ca 0.35 -1.55 -0.19 0.00 -0.47 0.00 0.00 55.73 53.87 3hoy s ARG 70 Cb 0.17 0.42 0.02 0.00 -0.57 0.00 0.00 34.95 34.99 3hoy s ARG 70 CO 0.00 -0.66 0.65 -0.59 -1.08 0.00 0.00 175.30 173.62 3hoy s PHE 71 N -3.63 -0.13 0.07 5.89 -0.12 -0.92 -4.55 117.98 114.59 3hoy s PHE 71 Ca 0.29 -0.28 0.09 0.00 -0.05 0.00 0.00 56.93 56.99 3hoy s PHE 71 Cb 0.01 0.57 -0.03 0.00 -0.63 0.00 0.00 43.02 42.94 3hoy s PHE 71 CO 0.15 -1.12 -0.24 0.15 -0.05 0.00 0.00 175.22 174.10 3hoy s LYS 72 N -3.91 1.76 -0.08 1.99 1.02 -0.72 -0.97 119.74 118.83 3hoy s LYS 72 Ca 0.12 -1.14 0.02 0.00 0.02 0.00 0.00 55.97 54.98 3hoy s LYS 72 Cb -0.04 -2.01 0.01 0.00 -0.52 0.00 0.00 37.83 35.27 3hoy s LYS 72 CO 0.04 0.50 -0.13 -1.17 -0.92 0.00 0.00 175.35 173.67 3hoy s LEU 73 N -1.53 1.65 -0.16 3.17 2.96 0.36 -1.71 118.68 123.42 3hoy s LEU 73 Ca 0.13 -0.34 -0.01 0.00 -0.22 0.00 0.00 54.13 53.70 3hoy s LEU 73 Cb -0.10 -0.91 -0.01 0.00 0.50 0.00 0.00 46.19 45.67 3hoy s LEU 73 CO 0.04 0.03 -0.12 -0.60 -1.32 0.00 0.00 176.35 174.37 3hoy s ARG 74 N 0.78 3.31 -0.04 1.98 3.52 -0.50 -0.32 118.95 127.68 3hoy s ARG 74 Ca -0.12 -0.70 0.05 0.00 -0.13 0.00 0.00 55.73 54.83 3hoy s ARG 74 Cb -0.16 -2.70 -0.01 0.00 -1.56 0.00 0.00 34.95 30.53 3hoy s ARG 74 CO 0.02 0.05 -0.19 0.42 -0.81 0.00 0.00 175.30 174.80 3hoy s ILE 75 N 0.76 1.54 -0.02 4.11 1.01 -0.34 -2.06 121.20 126.20 3hoy s ILE 75 Ca -0.05 -0.79 0.01 0.00 0.00 0.00 0.00 60.65 59.82 3hoy s ILE 75 Cb -0.15 -1.31 0.01 0.00 0.01 0.00 0.00 42.46 41.02 3hoy s ILE 75 CO 0.01 0.44 -0.04 -1.58 0.00 0.00 0.00 174.94 173.77 3hoy s GLN 76 N -0.11 0.48 0.22 2.79 0.74 0.70 0.08 119.66 124.56 3hoy s GLN 76 Ca -0.01 -0.11 0.05 0.00 0.05 0.00 0.00 55.36 55.35 3hoy s GLN 76 Cb -0.11 -0.51 -0.05 0.00 1.10 0.00 0.00 33.01 33.44 3hoy s GLN 76 CO 0.02 0.01 -0.06 0.95 -0.55 0.00 0.00 175.29 175.66 3hoy s THR 77 N 0.36 1.31 0.12 -0.34 -4.23 -1.20 0.13 115.64 111.80 3hoy s THR 77 Ca -0.04 -2.09 -0.31 0.00 -1.18 0.00 0.00 61.69 58.07 3hoy s THR 77 Cb -0.07 -2.20 -0.10 0.00 1.34 0.00 0.00 72.50 71.46 3hoy s THR 77 CO -0.00 -0.46 1.85 0.42 -0.54 0.00 0.00 174.62 175.88 3hoy s THR 78 N -3.24 2.53 0.23 3.99 -4.23 0.06 -4.72 115.64 110.26 3hoy s THR 78 Ca 0.25 0.02 -0.07 0.00 -1.18 0.00 0.00 61.69 60.71 3hoy s THR 78 Cb 0.03 -3.01 -0.06 0.00 1.34 0.00 0.00 72.50 70.80 3hoy s THR 78 CO 0.07 -0.00 -0.09 1.21 -0.54 0.00 0.00 174.62 175.27 3hoy n GLU 79 N 5.80 0.00 0.00 3.99 2.13 -1.26 -2.04 120.64 129.27 3hoy n GLU 79 Ca 0.18 0.00 0.00 0.00 0.66 0.00 0.00 57.16 58.00 3hoy n GLU 79 Cb 0.38 -0.39 0.00 0.00 0.27 0.00 0.00 31.44 31.70 3hoy n GLU 79 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3hoy n GLY 80 N 1.05 1.69 3.68 8.31 0.00 -1.26 -4.93 105.19 113.73 3hoy n GLY 80 Ca 0.03 -0.12 -0.42 0.00 0.00 0.00 0.00 46.02 45.50 3hoy n GLY 80 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3hoy s TYR 81 N -0.01 2.68 -0.10 1.61 6.04 -0.86 -4.99 117.35 121.72 3hoy s TYR 81 Ca 0.00 0.71 -0.22 0.00 0.04 0.00 0.00 57.07 57.60 3hoy s TYR 81 Cb 0.00 -3.71 -0.04 0.00 -1.04 0.00 0.00 41.96 37.18 3hoy s TYR 81 CO 0.00 -2.68 0.64 0.34 -1.54 0.00 0.00 175.55 172.31 3hoy s ASP 82 N 2.16 6.87 0.29 4.32 -1.08 -1.26 -4.67 116.67 123.30 3hoy s ASP 82 Ca 0.65 1.05 -0.02 0.00 -0.52 0.00 0.00 52.55 53.70 3hoy s ASP 82 Cb -0.31 -2.37 0.42 0.00 -1.46 0.00 0.00 42.92 39.20 3hoy s ASP 82 CO 0.26 -0.12 1.95 1.55 0.52 0.00 0.00 175.17 179.34 3hoy h PRO 83 N 6.86 1.12 -0.99 4.34 0.13 -1.93 -1.95 132.00 139.58 3hoy h PRO 83 Ca -0.39 -0.07 0.21 0.00 -0.87 0.00 0.00 66.00 64.88 3hoy h PRO 83 Cb 1.18 -0.25 -0.09 0.00 0.13 0.00 0.00 31.00 31.97 3hoy h PRO 83 CO 0.76 0.74 0.62 0.87 -0.23 0.00 0.00 178.00 180.76 3hoy h LYS 84 N 1.15 0.56 0.20 0.86 1.57 -1.96 0.24 116.57 119.19 3hoy h LYS 84 Ca 0.33 -0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 59.07 3hoy h LYS 84 Cb -0.08 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.10 3hoy h LYS 84 CO -0.08 0.37 -0.10 -0.44 -0.57 0.00 0.00 179.45 178.63 3hoy h ASP 85 N 0.58 -0.23 -0.96 0.86 3.32 -1.77 -2.17 116.42 116.04 3hoy h ASP 85 Ca 0.56 -0.27 0.31 0.00 0.02 0.00 0.00 57.03 57.64 3hoy h ASP 85 Cb 1.13 0.06 -0.16 0.00 0.22 0.00 0.00 39.33 40.58 3hoy h ASP 85 CO -0.31 0.19 0.33 0.00 -1.72 0.00 0.00 179.24 177.72 3hoy h ALA 86 N -0.06 1.61 -0.31 3.45 0.00 -0.50 1.23 119.26 124.68 3hoy h ALA 86 Ca -0.03 0.26 -0.04 0.00 0.00 0.00 0.00 54.91 55.10 3hoy h ALA 86 Cb 0.49 0.36 -0.01 0.00 0.00 0.00 0.00 17.79 18.62 3hoy h ALA 86 CO 0.05 -0.63 0.04 1.25 0.00 0.00 0.00 179.25 179.95 3hoy h LEU 87 N 0.13 0.49 -0.25 0.00 5.85 -0.54 -0.66 115.31 120.34 3hoy h LEU 87 Ca 0.67 -0.27 0.05 0.00 0.84 0.00 0.00 57.88 59.17 3hoy h LEU 87 Cb 1.53 -0.13 -0.04 0.00 0.37 0.00 0.00 40.66 42.39 3hoy h LEU 87 CO -0.74 0.64 -0.04 0.11 -0.34 0.00 0.00 178.44 178.07 3hoy h LYS 88 N 0.33 0.03 0.00 1.25 1.57 0.20 -0.77 116.57 119.18 3hoy h LYS 88 Ca 0.09 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.87 3hoy h LYS 88 Cb 0.36 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.66 3hoy h LYS 88 CO 0.01 0.02 0.00 0.09 -0.57 0.00 0.00 179.45 179.00 3hoy n ASN 89 N -5.19 0.00 -0.46 0.86 3.02 0.63 -0.90 115.26 113.21 3hoy n ASN 89 Ca -0.01 0.82 0.36 0.00 -0.03 0.00 0.00 54.58 55.72 3hoy n ASN 89 Cb 0.14 -0.32 0.58 0.00 -0.61 0.00 0.00 39.78 39.57 3hoy n ASN 89 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3hoy n ALA 90 N -1.57 1.27 0.22 5.41 0.00 -0.27 0.18 120.51 125.75 3hoy n ALA 90 Ca 0.00 0.60 -0.12 0.00 0.00 0.00 0.00 53.44 53.92 3hoy n ALA 90 Cb 0.00 -0.86 -0.07 0.00 0.00 0.00 0.00 19.45 18.52 3hoy n ALA 90 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3hoy h ASN 92 N -1.01 -0.52 -0.63 0.00 2.35 0.38 -1.32 115.58 114.84 3hoy h ASN 92 Ca -0.06 0.12 0.10 0.00 -0.55 0.00 0.00 56.30 55.91 3hoy h ASN 92 Cb 0.56 0.28 -0.11 0.00 0.05 0.00 0.00 38.32 39.10 3hoy h ASN 92 CO 0.10 -0.19 -0.42 -1.28 -1.65 0.00 0.00 177.43 173.99 3hoy h SER 93 N -0.11 -1.47 -0.75 5.81 0.87 -1.19 0.17 113.55 116.88 3hoy h SER 93 Ca 0.16 0.25 0.13 0.00 -1.23 0.00 0.00 61.79 61.10 3hoy h SER 93 Cb 0.35 0.68 -0.13 0.00 -0.44 0.00 0.00 62.40 62.86 3hoy h SER 93 CO -0.38 -0.32 -0.34 0.40 -0.53 0.00 0.00 176.83 175.66 3hoy h ILE 94 N -0.19 0.11 0.40 2.23 2.04 -1.01 -0.23 117.51 120.85 3hoy h ILE 94 Ca 0.20 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 66.04 3hoy h ILE 94 Cb 0.56 0.11 0.00 0.00 -0.74 0.00 0.00 36.82 36.75 3hoy h ILE 94 CO -0.72 0.00 -0.21 0.40 0.00 0.00 0.00 178.15 177.62 3hoy h ILE 95 N -0.10 0.57 -0.26 -0.67 2.04 -0.66 -0.09 117.51 118.35 3hoy h ILE 95 Ca 0.28 0.00 0.05 0.00 1.00 0.00 0.00 64.86 66.19 3hoy h ILE 95 Cb 0.57 0.57 -0.08 0.00 -0.74 0.00 0.00 36.82 37.14 3hoy h ILE 95 CO -0.80 0.00 -0.46 0.78 0.00 0.00 0.00 178.15 177.67 3hoy h ASN 96 N -0.56 -1.49 -0.97 1.72 2.35 -0.16 0.97 115.58 117.45 3hoy h ASN 96 Ca -0.05 0.20 0.20 0.00 -0.55 0.00 0.00 56.30 56.11 3hoy h ASN 96 Cb 0.44 0.62 -0.09 0.00 0.05 0.00 0.00 38.32 39.34 3hoy h ASN 96 CO 0.07 -0.41 0.62 0.11 -1.65 0.00 0.00 177.43 176.16 3hoy h LYS 97 N -0.44 0.55 -0.15 0.81 1.57 -0.94 0.97 116.57 118.94 3hoy h LYS 97 Ca 0.09 -0.03 -0.16 0.00 -1.87 0.00 0.00 60.65 58.67 3hoy h LYS 97 Cb 0.62 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.80 3hoy h LYS 97 CO -0.49 0.37 -0.59 -0.07 -0.57 0.00 0.00 179.45 178.09 3hoy h LEU 98 N 0.57 0.56 0.01 2.94 3.38 0.21 -1.15 115.31 121.83 3hoy h LEU 98 Ca 0.53 -0.31 -0.00 0.00 0.09 0.00 0.00 57.88 58.19 3hoy h LEU 98 Cb 1.08 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.67 3hoy h LEU 98 CO -0.28 1.03 -0.01 1.23 0.09 0.00 0.00 178.44 180.50 3hoy h GLY 99 N 1.13 -0.02 0.06 0.83 0.00 0.30 -0.51 103.07 104.87 3hoy h GLY 99 Ca -0.00 0.01 0.04 0.00 0.00 0.00 0.00 47.33 47.37 3hoy h GLY 99 CO 0.11 -0.01 -0.43 0.00 0.00 0.00 0.00 176.54 176.21 3hoy h ALA 100 N 0.72 -0.64 -0.55 3.60 0.00 -1.05 -0.72 119.26 120.63 3hoy h ALA 100 Ca -0.00 -0.03 0.10 0.00 0.00 0.00 0.00 54.91 54.99 3hoy h ALA 100 Cb 0.26 0.78 -0.11 0.00 0.00 0.00 0.00 17.79 18.72 3hoy h ALA 100 CO 0.00 -0.95 -0.28 1.25 0.00 0.00 0.00 179.25 179.27 3hoy h LEU 101 N -0.53 -0.98 0.02 0.00 6.46 -0.97 -0.76 115.31 118.54 3hoy h LEU 101 Ca 0.06 0.21 0.01 0.00 -0.12 0.00 0.00 57.88 58.04 3hoy h LEU 101 Cb 0.64 0.51 -0.04 0.00 -0.73 0.00 0.00 40.66 41.04 3hoy h LEU 101 CO -0.37 -0.28 -0.42 0.50 -0.62 0.00 0.00 178.44 177.25 3hoy h LYS 102 N -0.15 -0.52 0.00 1.25 3.64 -0.09 -1.27 116.57 119.44 3hoy h LYS 102 Ca 0.23 0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.65 3hoy h LYS 102 Cb 0.52 0.12 0.00 0.00 -0.41 0.00 0.00 32.23 32.46 3hoy h LYS 102 CO -0.63 -0.35 0.00 2.41 -2.27 0.00 0.00 179.45 178.61 3hoy n THR 103 N -4.81 0.00 -0.57 1.00 -1.04 -0.37 -0.49 114.28 108.00 3hoy n THR 103 Ca -0.06 1.19 0.46 0.00 -2.04 0.00 0.00 64.05 63.60 3hoy n THR 103 Cb 0.31 -1.65 0.79 0.00 -1.82 0.00 0.00 70.33 67.96 3hoy n THR 103 CO 0.00 0.00 0.00 0.78 -0.64 0.00 0.00 175.07 175.21 3hoy h ASN 104 N 0.00 0.02 1.02 8.00 4.21 -0.99 0.51 115.58 128.36 3hoy h ASN 104 Ca 0.00 0.01 -0.18 0.00 1.21 0.00 0.00 56.30 57.34 3hoy h ASN 104 Cb 0.00 0.01 -0.03 0.00 -1.12 0.00 0.00 38.32 37.18 3hoy h ASN 104 CO 0.00 -0.01 -0.85 0.15 -1.29 0.00 0.00 177.43 175.43 3hoy h PHE 105 N 0.01 0.00 0.10 1.19 3.57 0.43 -2.48 116.94 119.76 3hoy h PHE 105 Ca 0.81 0.00 -0.13 0.00 3.53 0.00 0.00 57.97 62.18 3hoy h PHE 105 Cb 3.20 0.00 0.01 0.00 2.79 0.00 0.00 35.95 41.96 3hoy h PHE 105 CO -0.00 0.85 -0.59 0.93 -2.23 0.00 0.00 178.31 177.27 3hoy h GLU 106 N 0.00 0.20 -0.16 1.11 5.08 0.68 -1.64 114.58 119.85 3hoy h GLU 106 Ca -0.01 -0.35 0.03 0.00 -1.00 0.00 0.00 59.36 58.03 3hoy h GLU 106 Cb 1.59 0.13 -0.06 0.00 0.50 0.00 0.00 28.75 30.91 3hoy h GLU 106 CO 0.11 1.17 -0.48 1.15 -1.00 0.00 0.00 179.01 179.95 3hoy h THR 107 N -0.57 0.00 -0.38 1.13 2.02 -1.34 0.24 112.91 114.00 3hoy h THR 107 Ca -0.11 0.00 0.10 0.00 0.77 0.00 0.00 66.41 67.17 3hoy h THR 107 Cb 1.45 0.00 -0.02 0.00 -1.74 0.00 0.00 68.15 67.84 3hoy h THR 107 CO 0.10 0.00 0.27 -0.33 0.37 0.00 0.00 175.52 175.93 3hoy h GLU 108 N -0.49 0.08 -0.05 6.66 4.39 -1.55 -2.71 114.58 120.91 3hoy h GLU 108 Ca 0.03 -0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.70 3hoy h GLU 108 Cb 0.59 -0.02 -0.00 0.00 -0.10 0.00 0.00 28.75 29.22 3hoy h GLU 108 CO -0.41 0.05 -0.07 2.35 -1.16 0.00 0.00 179.01 179.77 3hoy h TRP 109 N 0.08 0.17 -0.71 4.33 2.91 0.28 -3.22 115.95 119.79 3hoy h TRP 109 Ca 0.18 -0.06 0.15 0.00 1.13 0.00 0.00 58.89 60.29 3hoy h TRP 109 Cb 0.62 -0.03 -0.10 0.00 -0.51 0.00 0.00 29.16 29.13 3hoy h TRP 109 CO -0.00 0.63 0.18 -0.91 -1.03 0.00 0.00 178.44 177.31 3hoy h ASN 110 N -0.34 0.03 0.00 2.65 2.35 -0.34 -2.00 115.58 117.93 3hoy h ASN 110 Ca 0.01 0.14 -0.04 0.00 -0.55 0.00 0.00 56.30 55.85 3hoy h ASN 110 Cb 0.61 0.18 -0.01 0.00 0.05 0.00 0.00 38.32 39.15 3hoy h ASN 110 CO 0.02 -0.01 0.08 0.18 -1.65 0.00 0.00 177.43 176.04 3hoy n LEU 111 N -5.14 2.11 -4.37 1.61 4.77 -1.18 -4.77 117.00 110.03 3hoy n LEU 111 Ca 0.13 -1.28 -0.19 0.00 -0.03 0.00 0.00 56.01 54.65 3hoy n LEU 111 Cb 0.42 -0.51 -0.10 0.00 -2.33 0.00 0.00 43.42 40.90 3hoy n LEU 111 CO 0.14 0.39 -0.34 -1.10 -1.33 0.00 0.00 177.39 175.15 3hoy s GLN 112 N 1.72 1.41 -0.05 3.23 -1.52 -0.75 -5.05 119.66 118.66 3hoy s GLN 112 Ca 0.14 -1.71 -0.02 0.00 -1.95 0.00 0.00 55.36 51.82 3hoy s GLN 112 Cb 0.07 -0.82 0.03 0.00 -0.22 0.00 0.00 33.01 32.07 3hoy s GLN 112 CO 0.00 -0.04 0.09 0.99 -0.25 0.00 0.00 175.29 176.07 3hoy s THR 113 N -3.26 -0.10 0.00 -0.19 2.01 -1.26 -5.15 115.64 107.69 3hoy s THR 113 Ca 0.28 0.28 0.00 0.00 0.31 0.00 0.00 61.69 62.57 3hoy s THR 113 Cb 0.05 -0.17 0.00 0.00 0.01 0.00 0.00 72.50 72.39 3hoy s THR 113 CO 0.10 0.12 0.00 0.18 -0.69 0.00 0.00 174.62 174.32