#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1n8o s VAL 17 N 0.00 4.88 -0.61 1.39 1.01 -1.23 -3.91 120.40 121.92 1n8o s VAL 17 Ca 0.00 1.67 -0.01 0.00 0.00 0.00 0.00 61.98 63.64 1n8o s VAL 17 Cb 0.00 -4.15 0.00 0.00 0.00 0.00 0.00 36.38 32.23 1n8o s VAL 17 CO 0.00 0.03 0.11 0.59 0.00 0.00 0.00 175.10 175.83 1n8o n ASN 18 N 5.17 -2.99 -0.71 3.32 5.03 -1.25 -5.05 115.26 118.79 1n8o n ASN 18 Ca 0.05 -0.05 0.00 0.00 0.87 0.00 0.00 54.58 55.44 1n8o n ASN 18 Cb 0.49 -2.12 0.00 0.00 -1.02 0.00 0.00 39.78 37.13 1n8o n ASN 18 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1n8o n GLY 19 N -1.02 1.43 3.25 7.41 0.00 -1.26 -5.13 105.19 109.87 1n8o n GLY 19 Ca -0.07 -1.89 -0.09 0.00 0.00 0.00 0.00 46.02 43.97 1n8o n GLY 19 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1n8o s GLU 20 N 2.58 0.95 0.26 1.61 -1.05 -1.26 -5.12 118.70 116.67 1n8o s GLU 20 Ca 0.00 -1.05 -0.30 0.00 -0.15 0.00 0.00 54.97 53.48 1n8o s GLU 20 Cb 0.00 0.35 -0.09 0.00 -0.44 0.00 0.00 34.13 33.95 1n8o s GLU 20 CO 0.00 -0.32 1.23 -2.00 0.95 0.00 0.00 175.26 175.12 1n8o s GLU 21 N -3.90 4.47 0.62 -4.83 2.12 -1.26 -5.00 118.70 110.92 1n8o s GLU 21 Ca 0.10 1.99 -0.15 0.00 0.36 0.00 0.00 54.97 57.27 1n8o s GLU 21 Cb 0.04 -3.17 -0.03 0.00 0.26 0.00 0.00 34.13 31.24 1n8o s GLU 21 CO -0.07 -0.07 1.06 0.00 -0.54 0.00 0.00 175.26 175.64 1n8o s ALA 22 N -0.63 2.72 0.12 6.30 0.00 -1.26 -5.04 121.76 123.97 1n8o s ALA 22 Ca 0.50 0.33 -0.31 0.00 0.00 0.00 0.00 51.96 52.49 1n8o s ALA 22 Cb -0.35 -3.22 -0.08 0.00 0.00 0.00 0.00 23.12 19.47 1n8o s ALA 22 CO 0.43 -0.90 1.36 0.08 0.00 0.00 0.00 175.76 176.72 1n8o s VAL 23 N -2.57 3.36 0.07 0.00 1.01 -1.26 -4.95 120.40 116.07 1n8o s VAL 23 Ca 0.62 0.99 -0.35 0.00 0.00 0.00 0.00 61.98 63.24 1n8o s VAL 23 Cb -0.16 -3.64 -0.15 0.00 0.00 0.00 0.00 36.38 32.44 1n8o s VAL 23 CO 0.41 0.09 1.53 -2.65 0.00 0.00 0.00 175.10 174.47 1n8o n PRO 24 N 3.78 1.68 -0.97 2.72 -0.02 -1.26 -1.94 135.00 139.00 1n8o n PRO 24 Ca 0.11 0.61 0.00 0.00 -2.02 0.00 0.00 63.50 62.19 1n8o n PRO 24 Cb 0.43 -2.33 0.00 0.00 -0.02 0.00 0.00 33.50 31.58 1n8o n PRO 24 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1n8o n GLY 25 N 3.22 0.52 0.23 -1.23 0.00 -1.26 -4.91 105.19 101.77 1n8o n GLY 25 Ca 0.19 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.35 1n8o n GLY 25 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1n8o n SER 26 N -0.14 0.75 -3.38 1.61 3.41 -0.82 -4.06 113.62 110.99 1n8o n SER 26 Ca 0.00 -1.08 -0.26 0.00 -0.26 0.00 0.00 58.87 57.27 1n8o n SER 26 Cb 0.07 -0.01 -0.08 0.00 -0.26 0.00 0.00 64.21 63.92 1n8o n SER 26 CO 0.00 0.00 0.00 0.79 -0.16 0.00 0.00 175.04 175.67 1n8o n TRP 27 N -0.51 1.11 0.41 7.33 7.02 -1.26 -4.99 117.44 126.55 1n8o n TRP 27 Ca 0.19 -3.78 0.13 0.00 -1.02 0.00 0.00 57.50 53.03 1n8o n TRP 27 Cb 0.26 -0.33 0.48 0.00 -2.42 0.00 0.00 31.31 29.30 1n8o n TRP 27 CO 0.00 0.00 0.00 -1.00 -2.02 0.00 0.00 177.69 174.67 1n8o h PRO 28 N 4.53 0.00 0.00 -0.99 0.13 -1.80 -1.92 132.00 131.96 1n8o h PRO 28 Ca 0.15 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.28 1n8o h PRO 28 Cb 0.81 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.94 1n8o h PRO 28 CO 0.58 0.00 0.00 -2.67 -0.23 0.00 0.00 178.00 175.68 1n8o n TRP 29 N -2.53 0.30 -2.39 1.56 2.14 -0.88 -1.97 117.44 113.67 1n8o n TRP 29 Ca 0.03 0.09 -0.42 0.00 2.07 0.00 0.00 57.50 59.26 1n8o n TRP 29 Cb 0.33 -0.65 -0.03 0.00 -0.81 0.00 0.00 31.31 30.16 1n8o n TRP 29 CO 0.00 0.00 0.00 -1.14 2.07 0.00 0.00 177.69 178.62 1n8o s GLN 30 N -3.04 4.29 0.41 -2.67 2.00 -0.72 -1.06 119.66 118.87 1n8o s GLN 30 Ca 0.12 1.74 0.07 0.00 -2.00 0.00 0.00 55.36 55.30 1n8o s GLN 30 Cb 0.16 -3.65 -0.07 0.00 0.80 0.00 0.00 33.01 30.25 1n8o s GLN 30 CO 0.53 -0.57 0.03 0.14 -0.50 0.00 0.00 175.29 174.92 1n8o s VAL 31 N 2.75 2.06 -0.01 1.34 -7.23 -0.69 -4.55 120.40 114.07 1n8o s VAL 31 Ca 0.58 -1.96 0.08 0.00 -1.81 0.00 0.00 61.98 58.86 1n8o s VAL 31 Cb -0.25 -2.98 -0.02 0.00 0.56 0.00 0.00 36.38 33.68 1n8o s VAL 31 CO 0.21 -0.01 -0.25 -0.55 -0.31 0.00 0.00 175.10 174.19 1n8o s SER 32 N -3.73 2.93 -0.17 4.85 0.15 -0.90 -2.40 113.70 114.43 1n8o s SER 32 Ca 0.36 -0.47 -0.06 0.00 0.70 0.00 0.00 55.95 56.48 1n8o s SER 32 Cb 0.09 -0.32 -0.04 0.00 -1.71 0.00 0.00 66.02 64.04 1n8o s SER 32 CO 0.19 0.30 0.04 -0.76 1.20 0.00 0.00 173.24 174.20 1n8o s LEU 33 N -0.66 3.68 0.06 3.45 1.43 0.37 -0.64 118.68 126.36 1n8o s LEU 33 Ca 0.10 0.04 0.07 0.00 -1.03 0.00 0.00 54.13 53.31 1n8o s LEU 33 Cb -0.10 -1.91 -0.03 0.00 0.03 0.00 0.00 46.19 44.18 1n8o s LEU 33 CO -0.01 0.19 -0.20 0.00 0.23 0.00 0.00 176.35 176.57 1n8o s GLN 34 N 0.27 1.21 0.23 1.70 -2.07 -0.06 -2.14 119.66 118.80 1n8o s GLN 34 Ca 0.02 -0.99 -0.04 0.00 -1.82 0.00 0.00 55.36 52.53 1n8o s GLN 34 Cb -0.13 -1.36 0.05 0.00 -1.09 0.00 0.00 33.01 30.49 1n8o s GLN 34 CO 0.01 0.33 0.27 -0.40 -1.32 0.00 0.00 175.29 174.18 1n8o n ASP 35 N 1.56 -0.43 0.00 12.60 3.85 -0.43 -0.80 116.55 132.91 1n8o n ASP 35 Ca -0.18 -0.94 0.09 0.00 -0.71 0.00 0.00 54.79 53.04 1n8o n ASP 35 Cb 0.54 -0.22 0.41 0.00 -1.35 0.00 0.00 41.12 40.50 1n8o n ASP 35 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 177.20 177.36 1n8o n LYS 36 N -1.82 0.10 0.00 0.11 0.00 -1.24 -0.69 118.16 114.62 1n8o n LYS 36 Ca 0.03 0.17 0.13 0.00 0.00 0.00 0.00 58.31 58.64 1n8o n LYS 36 Cb 0.13 -1.50 0.31 0.00 0.00 0.00 0.00 35.03 33.96 1n8o n LYS 36 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.40 177.65 1n8o n THR 37 N -1.42 0.00 -0.05 3.15 -2.24 -1.26 -4.93 114.28 107.52 1n8o n THR 37 Ca 0.06 -0.14 0.00 0.00 -2.27 0.00 0.00 64.05 61.70 1n8o n THR 37 Cb 0.18 0.53 0.00 0.00 -2.10 0.00 0.00 70.33 68.94 1n8o n THR 37 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1n8o n GLY 38 N 1.36 0.70 3.68 3.38 0.00 0.14 -5.08 105.19 109.37 1n8o n GLY 38 Ca 0.11 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.71 1n8o n GLY 38 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1n8o s PHE 39 N -2.06 3.38 -0.14 1.61 5.36 -1.26 -4.76 117.98 120.11 1n8o s PHE 39 Ca 0.00 1.46 -0.29 0.00 -0.96 0.00 0.00 56.93 57.14 1n8o s PHE 39 Cb 0.00 -3.27 -0.03 0.00 -0.34 0.00 0.00 43.02 39.38 1n8o s PHE 39 CO 0.00 -0.59 1.50 -1.58 -1.46 0.00 0.00 175.22 173.09 1n8o s HIS 40 N 2.25 2.32 -0.01 10.12 5.65 -1.26 -1.31 115.29 133.06 1n8o s HIS 40 Ca 0.50 0.56 0.03 0.00 0.25 0.00 0.00 55.06 56.41 1n8o s HIS 40 Cb -0.20 -3.80 -0.05 0.00 -1.18 0.00 0.00 32.58 27.36 1n8o s HIS 40 CO 0.17 -2.86 0.07 1.97 -0.65 0.00 0.00 174.74 173.45 1n8o n PHE 41 N 7.27 0.00 -3.70 3.88 1.16 -0.91 -5.00 117.46 120.16 1n8o n PHE 41 Ca 0.16 0.00 -0.10 0.00 -1.87 0.00 0.00 57.45 55.64 1n8o n PHE 41 Cb 0.44 -0.08 -0.05 0.00 -1.61 0.00 0.00 39.48 38.18 1n8o n PHE 41 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 1n8o n GLY 43 N -0.14 1.77 3.93 0.00 0.00 -1.26 -0.48 105.19 109.00 1n8o n GLY 43 Ca -0.16 -2.12 0.01 0.00 0.00 0.00 0.00 46.02 43.75 1n8o n GLY 43 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1n8o s GLY 44 N -2.59 -0.08 -0.06 -0.02 0.00 -1.01 -4.69 107.32 98.87 1n8o s GLY 44 Ca 0.12 -0.02 -0.03 0.00 0.00 0.00 0.00 44.72 44.80 1n8o s GLY 44 CO 0.08 4.22 0.14 -0.56 0.00 0.00 0.00 173.10 176.98 1n8o s SER 45 N -3.62 -0.09 0.06 1.64 0.01 -0.78 -1.71 113.70 109.21 1n8o s SER 45 Ca 0.26 0.28 -0.31 0.00 1.31 0.00 0.00 55.95 57.49 1n8o s SER 45 Cb -0.01 0.17 -0.06 0.00 0.21 0.00 0.00 66.02 66.33 1n8o s SER 45 CO 0.01 -0.15 1.23 -0.76 0.41 0.00 0.00 173.24 173.98 1n8o s LEU 46 N 1.18 4.36 -0.01 2.44 1.43 -0.22 -0.84 118.68 127.03 1n8o s LEU 46 Ca -0.09 2.05 0.08 0.00 -1.03 0.00 0.00 54.13 55.13 1n8o s LEU 46 Cb -0.12 -3.58 -0.10 0.00 0.03 0.00 0.00 46.19 42.42 1n8o s LEU 46 CO -0.06 -0.51 0.23 2.30 0.23 0.00 0.00 176.35 178.54 1n8o n ILE 47 N 3.99 0.00 -3.12 -0.59 -5.35 -0.87 -1.31 119.36 112.12 1n8o n ILE 47 Ca 0.10 -0.23 0.00 0.00 -0.27 0.00 0.00 62.75 62.34 1n8o n ILE 47 Cb 0.46 0.59 0.00 0.00 -1.74 0.00 0.00 39.64 38.95 1n8o n ILE 47 CO 0.00 0.00 0.00 -0.46 -1.76 0.00 0.00 176.55 174.33 1n8o n ASN 48 N -1.53 0.00 0.25 7.28 2.04 -1.21 -4.67 115.26 117.42 1n8o n ASN 48 Ca -0.00 -0.87 0.14 0.00 -0.44 0.00 0.00 54.58 53.41 1n8o n ASN 48 Cb 0.17 0.00 0.50 0.00 -2.53 0.00 0.00 39.78 37.91 1n8o n ASN 48 CO 0.00 0.00 0.00 -0.33 -0.44 0.00 0.00 177.26 176.49 1n8o h GLU 49 N 0.00 0.00 -0.02 -3.83 5.08 -1.97 -3.16 114.58 110.68 1n8o h GLU 49 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1n8o h GLU 49 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1n8o h GLU 49 CO 0.00 0.04 -0.04 0.09 -1.00 0.00 0.00 179.01 178.11 1n8o n ASN 50 N -3.14 1.99 -3.88 1.42 3.02 -1.26 -0.55 115.26 112.87 1n8o n ASN 50 Ca 0.01 -1.49 -0.15 0.00 -0.03 0.00 0.00 54.58 52.92 1n8o n ASN 50 Cb 0.40 0.07 -0.15 0.00 -0.61 0.00 0.00 39.78 39.48 1n8o n ASN 50 CO 0.00 0.00 0.00 0.26 -2.62 0.00 0.00 177.26 174.90 1n8o s TRP 51 N -1.16 0.23 0.05 3.10 0.52 -1.20 -0.42 118.94 120.06 1n8o s TRP 51 Ca 0.15 -0.02 0.09 0.00 0.02 0.00 0.00 56.10 56.34 1n8o s TRP 51 Cb 0.11 -0.22 -0.03 0.00 -1.15 0.00 0.00 33.47 32.18 1n8o s TRP 51 CO 0.19 -0.04 -0.26 0.08 0.02 0.00 0.00 176.95 176.93 1n8o s VAL 52 N 0.32 2.10 -0.14 4.03 1.01 -0.69 -2.04 120.40 124.99 1n8o s VAL 52 Ca -0.03 -1.39 -0.03 0.00 0.00 0.00 0.00 61.98 60.53 1n8o s VAL 52 Cb -0.05 -1.80 -0.03 0.00 0.00 0.00 0.00 36.38 34.49 1n8o s VAL 52 CO -0.01 0.34 -0.03 -0.69 0.00 0.00 0.00 175.10 174.71 1n8o s VAL 53 N -0.82 3.95 0.02 2.92 1.01 -0.02 -0.90 120.40 126.57 1n8o s VAL 53 Ca 0.11 -0.35 0.00 0.00 0.00 0.00 0.00 61.98 61.75 1n8o s VAL 53 Cb -0.10 -2.72 -0.00 0.00 0.00 0.00 0.00 36.38 33.56 1n8o s VAL 53 CO 0.02 0.51 0.03 1.07 0.00 0.00 0.00 175.10 176.73 1n8o n THR 54 N 3.31 0.00 -3.52 3.92 5.66 -0.50 -1.87 114.28 121.28 1n8o n THR 54 Ca -0.17 -0.17 -0.38 0.00 -3.05 0.00 0.00 64.05 60.28 1n8o n THR 54 Cb 0.53 0.09 -0.06 0.00 -1.55 0.00 0.00 70.33 69.33 1n8o n THR 54 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1n8o s ALA 55 N -1.98 3.71 0.47 1.79 0.00 -1.26 -1.58 121.76 122.91 1n8o s ALA 55 Ca 0.03 -0.24 0.15 0.00 0.00 0.00 0.00 51.96 51.89 1n8o s ALA 55 Cb 0.00 -2.36 1.07 0.00 0.00 0.00 0.00 23.12 21.83 1n8o s ALA 55 CO 0.02 0.49 2.04 0.00 0.00 0.00 0.00 175.76 178.30 1n8o h ALA 56 N 4.74 1.78 0.00 0.00 0.00 -1.75 -1.87 119.26 122.16 1n8o h ALA 56 Ca -0.52 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.28 1n8o h ALA 56 Cb 1.22 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.99 1n8o h ALA 56 CO 0.61 0.17 0.00 -2.39 0.00 0.00 0.00 179.25 177.64 1n8o n HIS 57 N -4.39 0.41 0.29 0.00 1.44 -1.26 -2.28 115.22 109.43 1n8o n HIS 57 Ca -0.02 0.15 0.18 0.00 -2.01 0.00 0.00 57.72 56.01 1n8o n HIS 57 Cb 0.20 -0.74 0.81 0.00 0.12 0.00 0.00 29.99 30.37 1n8o n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1n8o n GLY 59 N -0.25 -0.02 3.75 0.00 0.00 -0.96 -4.94 105.19 102.77 1n8o n GLY 59 Ca -0.00 -0.37 -0.41 0.00 0.00 0.00 0.00 46.02 45.23 1n8o n GLY 59 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1n8o s VAL 60 N -2.70 2.20 0.23 1.61 1.01 -1.26 -5.02 120.40 116.48 1n8o s VAL 60 Ca 0.07 0.18 0.00 0.00 0.00 0.00 0.00 61.98 62.23 1n8o s VAL 60 Cb -0.03 -3.11 -0.00 0.00 0.00 0.00 0.00 36.38 33.23 1n8o s VAL 60 CO 0.09 0.03 0.01 0.35 0.00 0.00 0.00 175.10 175.59 1n8o n THR 61 N 1.99 0.00 1.43 3.92 -2.24 -1.26 -4.98 114.28 113.15 1n8o n THR 61 Ca 0.07 -1.15 0.14 0.00 -2.27 0.00 0.00 64.05 60.84 1n8o n THR 61 Cb 0.38 0.27 0.75 0.00 -2.10 0.00 0.00 70.33 69.63 1n8o n THR 61 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 1n8o n THR 62 N -0.57 0.05 0.06 4.28 -1.04 -1.26 -2.35 114.28 113.45 1n8o n THR 62 Ca -0.09 0.01 0.11 0.00 -2.04 0.00 0.00 64.05 62.04 1n8o n THR 62 Cb 0.30 -0.54 0.22 0.00 -1.82 0.00 0.00 70.33 68.50 1n8o n THR 62 CO 0.00 0.00 0.00 -1.54 -0.64 0.00 0.00 175.07 172.89 1n8o n SER 63 N -1.24 3.43 -4.94 8.00 3.41 -1.26 -4.47 113.62 116.55 1n8o n SER 63 Ca 0.15 -1.96 -0.24 0.00 -0.26 0.00 0.00 58.87 56.56 1n8o n SER 63 Cb 0.21 -0.30 0.01 0.00 -0.26 0.00 0.00 64.21 63.88 1n8o n SER 63 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 1n8o s ASP 64 N -1.25 5.82 0.00 4.04 -0.00 -0.99 -3.60 116.67 120.69 1n8o s ASP 64 Ca 0.38 0.47 0.05 0.00 -0.00 0.00 0.00 52.55 53.44 1n8o s ASP 64 Cb 0.21 -1.66 -0.01 0.00 -0.00 0.00 0.00 42.92 41.45 1n8o s ASP 64 CO 0.29 -0.78 -0.15 -0.69 -0.00 0.00 0.00 175.17 173.84 1n8o s VAL 65 N -2.69 1.16 -0.15 -1.27 1.01 0.02 -4.19 120.40 114.30 1n8o s VAL 65 Ca 0.49 -0.72 -0.17 0.00 0.00 0.00 0.00 61.98 61.58 1n8o s VAL 65 Cb -0.10 -0.99 -0.04 0.00 0.00 0.00 0.00 36.38 35.25 1n8o s VAL 65 CO 0.40 0.26 0.44 -0.69 0.00 0.00 0.00 175.10 175.51 1n8o s VAL 66 N -0.46 5.20 -0.25 2.92 1.01 -0.43 -0.88 120.40 127.51 1n8o s VAL 66 Ca 0.05 0.85 -0.05 0.00 0.00 0.00 0.00 61.98 62.83 1n8o s VAL 66 Cb -0.06 -3.78 -0.00 0.00 0.00 0.00 0.00 36.38 32.54 1n8o s VAL 66 CO -0.00 0.30 0.00 -0.69 0.00 0.00 0.00 175.10 174.71 1n8o s VAL 67 N 0.84 3.59 0.19 2.92 1.01 0.18 -0.92 120.40 128.22 1n8o s VAL 67 Ca 0.23 -0.56 0.07 0.00 0.00 0.00 0.00 61.98 61.72 1n8o s VAL 67 Cb -0.15 -2.72 -0.04 0.00 0.00 0.00 0.00 36.38 33.48 1n8o s VAL 67 CO 0.09 0.30 0.04 0.00 0.00 0.00 0.00 175.10 175.53 1n8o s ALA 68 N 1.48 3.30 0.00 5.51 0.00 -0.10 -2.11 121.76 129.85 1n8o s ALA 68 Ca 0.04 -1.38 0.00 0.00 0.00 0.00 0.00 51.96 50.62 1n8o s ALA 68 Cb -0.15 -1.06 0.00 0.00 0.00 0.00 0.00 23.12 21.90 1n8o s ALA 68 CO -0.01 0.44 0.00 0.41 0.00 0.00 0.00 175.76 176.59 1n8o n GLY 69 N -0.37 0.68 3.85 0.00 0.00 -1.26 -0.54 105.19 107.55 1n8o n GLY 69 Ca -0.09 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.59 1n8o n GLY 69 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1n8o s GLU 70 N -0.16 3.95 0.06 1.61 2.12 -1.26 -4.60 118.70 120.42 1n8o s GLU 70 Ca 0.00 0.46 0.00 0.00 0.36 0.00 0.00 54.97 55.79 1n8o s GLU 70 Cb 0.00 -2.86 0.00 0.00 0.26 0.00 0.00 34.13 31.53 1n8o s GLU 70 CO 0.00 0.43 0.00 0.34 -0.54 0.00 0.00 175.26 175.49 1n8o n PHE 71 N 0.58 -0.29 -3.58 5.30 7.35 -1.26 -4.86 117.46 120.70 1n8o n PHE 71 Ca -0.04 0.05 -0.41 0.00 -0.76 0.00 0.00 57.45 56.30 1n8o n PHE 71 Cb 0.52 0.14 -0.10 0.00 0.35 0.00 0.00 39.48 40.39 1n8o n PHE 71 CO 0.00 0.00 0.00 0.34 -0.76 0.00 0.00 176.76 176.34 1n8o s ASP 72 N -5.31 5.72 0.60 -2.13 3.68 -1.26 -4.93 116.67 113.04 1n8o s ASP 72 Ca 0.00 -1.39 0.30 0.00 2.13 0.00 0.00 52.55 53.59 1n8o s ASP 72 Cb 0.00 -2.02 1.81 0.00 -1.45 0.00 0.00 42.92 41.26 1n8o s ASP 72 CO 0.00 -0.52 2.21 1.56 0.13 0.00 0.00 175.17 178.54 1n8o h GLN 73 N 8.46 0.00 -0.00 4.34 4.20 -2.02 -2.08 115.11 128.00 1n8o h GLN 73 Ca -0.24 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.47 1n8o h GLN 73 Cb 1.09 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.87 1n8o h GLN 73 CO 0.76 0.00 -0.10 0.41 -0.67 0.00 0.00 178.83 179.22 1n8o n GLY 74 N -1.33 -1.08 3.85 3.46 0.00 -1.26 -4.85 105.19 103.98 1n8o n GLY 74 Ca -0.01 -0.23 -0.36 0.00 0.00 0.00 0.00 46.02 45.42 1n8o n GLY 74 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1n8o s SER 75 N -2.57 6.72 -0.23 1.61 0.15 -0.78 -4.95 113.70 113.64 1n8o s SER 75 Ca 0.26 0.89 0.13 0.00 0.70 0.00 0.00 55.95 57.94 1n8o s SER 75 Cb 0.20 -2.22 0.55 0.00 -1.71 0.00 0.00 66.02 62.84 1n8o s SER 75 CO 0.49 0.20 1.49 -1.20 1.20 0.00 0.00 173.24 175.42 1n8o n SER 76 N 1.12 3.57 -0.07 5.45 7.64 -1.26 -4.60 113.62 125.47 1n8o n SER 76 Ca -0.09 -3.28 0.03 0.00 1.01 0.00 0.00 58.87 56.54 1n8o n SER 76 Cb 0.52 -0.60 0.04 0.00 -1.01 0.00 0.00 64.21 63.16 1n8o n SER 76 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1n8o n SER 77 N -0.68 1.60 -4.87 6.43 7.64 -1.26 -5.04 113.62 117.44 1n8o n SER 77 Ca 0.28 -2.16 -0.24 0.00 1.01 0.00 0.00 58.87 57.76 1n8o n SER 77 Cb 1.01 -0.14 -0.04 0.00 -1.01 0.00 0.00 64.21 64.02 1n8o n SER 77 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 1n8o s GLU 78 N -1.29 3.13 -1.01 1.43 2.02 -1.26 -5.02 118.70 116.70 1n8o s GLU 78 Ca 0.09 -0.83 -0.16 0.00 0.02 0.00 0.00 54.97 54.09 1n8o s GLU 78 Cb 0.08 -2.74 0.16 0.00 0.10 0.00 0.00 34.13 31.73 1n8o s GLU 78 CO 0.01 0.46 1.17 0.15 0.02 0.00 0.00 175.26 177.08 1n8o s LYS 79 N -3.47 3.77 0.20 1.61 1.02 -1.26 -4.98 119.74 116.62 1n8o s LYS 79 Ca 0.33 -2.15 0.04 0.00 0.02 0.00 0.00 55.97 54.21 1n8o s LYS 79 Cb -0.10 -4.89 -0.03 0.00 -0.52 0.00 0.00 37.83 32.29 1n8o s LYS 79 CO 0.26 -1.69 0.30 0.96 -0.92 0.00 0.00 175.35 174.26 1n8o s ILE 80 N 1.89 5.20 -0.10 2.17 -4.36 -1.26 -4.70 121.20 120.03 1n8o s ILE 80 Ca 0.34 -0.88 0.02 0.00 -0.26 0.00 0.00 60.65 59.87 1n8o s ILE 80 Cb -0.05 -3.75 -0.01 0.00 1.25 0.00 0.00 42.46 39.90 1n8o s ILE 80 CO -0.07 -0.21 -0.18 -1.10 0.24 0.00 0.00 174.94 173.62 1n8o s GLN 81 N -3.59 3.06 -0.27 0.37 -0.21 0.30 -4.97 119.66 114.35 1n8o s GLN 81 Ca 0.34 -0.78 -0.06 0.00 0.02 0.00 0.00 55.36 54.89 1n8o s GLN 81 Cb -0.10 -2.43 0.00 0.00 1.00 0.00 0.00 33.01 31.48 1n8o s GLN 81 CO 0.28 0.28 0.04 0.15 -2.12 0.00 0.00 175.29 173.92 1n8o s LYS 82 N 0.14 3.21 -0.11 2.91 1.02 -1.26 -0.92 119.74 124.73 1n8o s LYS 82 Ca -0.10 -0.76 0.02 0.00 0.02 0.00 0.00 55.97 55.15 1n8o s LYS 82 Cb -0.16 -3.25 -0.01 0.00 -0.52 0.00 0.00 37.83 33.89 1n8o s LYS 82 CO 0.06 -0.35 -0.17 -0.51 -0.92 0.00 0.00 175.35 173.46 1n8o s LEU 83 N 1.49 2.50 0.52 3.17 1.43 -0.09 -4.96 118.68 122.74 1n8o s LEU 83 Ca 0.04 -0.39 -0.10 0.00 -1.03 0.00 0.00 54.13 52.64 1n8o s LEU 83 Cb -0.16 -1.53 -0.05 0.00 0.03 0.00 0.00 46.19 44.47 1n8o s LEU 83 CO 0.01 0.19 0.90 -0.54 0.23 0.00 0.00 176.35 177.13 1n8o s LYS 84 N 0.21 3.67 -0.23 1.70 1.02 -1.26 -1.32 119.74 123.54 1n8o s LYS 84 Ca -0.11 0.56 -0.08 0.00 0.02 0.00 0.00 55.97 56.36 1n8o s LYS 84 Cb -0.16 -2.24 -0.04 0.00 -0.52 0.00 0.00 37.83 34.87 1n8o s LYS 84 CO 0.06 -0.31 0.09 0.42 -0.92 0.00 0.00 175.35 174.70 1n8o s ILE 85 N -2.80 4.75 -0.08 2.17 1.01 -1.26 -0.27 121.20 124.73 1n8o s ILE 85 Ca 0.53 -0.03 -0.06 0.00 0.00 0.00 0.00 60.65 61.08 1n8o s ILE 85 Cb -0.10 -3.20 -0.28 0.00 0.01 0.00 0.00 42.46 38.89 1n8o s ILE 85 CO 0.43 0.38 0.54 0.00 0.00 0.00 0.00 174.94 176.29 1n8o h ALA 86 N 7.55 0.35 -2.76 9.38 0.00 -0.83 -3.43 119.26 129.52 1n8o h ALA 86 Ca -0.37 -1.28 -0.12 0.00 0.00 0.00 0.00 54.91 53.13 1n8o h ALA 86 Cb 1.17 0.56 -0.24 0.00 0.00 0.00 0.00 17.79 19.29 1n8o h ALA 86 CO 0.63 1.22 -0.25 0.21 0.00 0.00 0.00 179.25 181.06 1n8o s LYS 87 N -2.57 0.47 -0.12 0.00 2.20 -0.96 -4.99 119.74 113.77 1n8o s LYS 87 Ca -0.17 0.54 -0.02 0.00 -0.36 0.00 0.00 55.97 55.95 1n8o s LYS 87 Cb 0.06 0.23 -0.03 0.00 -1.51 0.00 0.00 37.83 36.59 1n8o s LYS 87 CO 0.81 -0.06 -0.06 0.08 -0.36 0.00 0.00 175.35 175.77 1n8o s VAL 88 N 0.17 3.76 -0.38 4.02 1.01 -1.26 -0.91 120.40 126.81 1n8o s VAL 88 Ca -0.00 -0.42 0.02 0.00 0.00 0.00 0.00 61.98 61.58 1n8o s VAL 88 Cb -0.03 -2.60 0.11 0.00 0.00 0.00 0.00 36.38 33.86 1n8o s VAL 88 CO 0.01 0.53 0.13 -0.36 0.00 0.00 0.00 175.10 175.41 1n8o s PHE 89 N -0.06 2.75 0.03 5.22 0.40 0.62 -4.99 117.98 121.95 1n8o s PHE 89 Ca 0.01 -2.56 -0.28 0.00 -0.60 0.00 0.00 56.93 53.50 1n8o s PHE 89 Cb -0.13 -2.37 -0.04 0.00 0.51 0.00 0.00 43.02 40.98 1n8o s PHE 89 CO 0.03 -0.86 0.88 0.21 0.70 0.00 0.00 175.22 176.17 1n8o s LYS 90 N 0.81 4.56 -0.01 0.44 2.20 -1.26 -0.67 119.74 125.81 1n8o s LYS 90 Ca 0.13 1.26 -0.37 0.00 -0.36 0.00 0.00 55.97 56.62 1n8o s LYS 90 Cb -0.21 -3.42 -0.16 0.00 -1.51 0.00 0.00 37.83 32.54 1n8o s LYS 90 CO -0.10 0.11 1.49 -1.71 -0.36 0.00 0.00 175.35 174.78 1n8o n ASN 91 N 3.35 2.06 0.31 1.43 2.85 -0.58 -4.88 115.26 119.80 1n8o n ASN 91 Ca 0.02 1.10 0.19 0.00 -0.11 0.00 0.00 54.58 55.78 1n8o n ASN 91 Cb 0.50 -1.21 0.96 0.00 1.24 0.00 0.00 39.78 41.28 1n8o n ASN 91 CO 0.00 0.00 0.00 0.28 -2.11 0.00 0.00 177.26 175.43 1n8o h SER 92 N 5.60 0.00 -0.74 1.20 0.02 -1.92 -2.17 113.55 115.54 1n8o h SER 92 Ca -0.47 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.48 1n8o h SER 92 Cb 1.32 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.86 1n8o h SER 92 CO 0.84 0.02 0.00 1.17 -1.14 0.00 0.00 176.83 177.72 1n8o n LYS 93 N -3.21 2.71 -1.91 3.45 4.81 -1.26 -4.97 118.16 117.78 1n8o n LYS 93 Ca -0.02 -2.65 -0.41 0.00 -0.87 0.00 0.00 58.31 54.36 1n8o n LYS 93 Cb 0.17 -1.57 -0.02 0.00 0.02 0.00 0.00 35.03 33.63 1n8o n LYS 93 CO 0.00 0.00 0.00 -0.47 1.17 0.00 0.00 177.40 178.10 1n8o s TYR 94 N -1.02 2.87 -0.18 5.64 5.04 -0.82 -4.68 117.35 124.20 1n8o s TYR 94 Ca 0.49 0.99 0.00 0.00 -2.44 0.00 0.00 57.07 56.12 1n8o s TYR 94 Cb 0.26 -3.92 0.04 0.00 0.35 0.00 0.00 41.96 38.69 1n8o s TYR 94 CO 0.33 -2.96 -0.08 1.21 -1.34 0.00 0.00 175.55 172.71 1n8o s ASN 95 N 0.27 3.11 0.43 4.32 3.84 -0.41 -4.97 114.94 121.53 1n8o s ASN 95 Ca 0.59 -0.77 0.16 0.00 0.21 0.00 0.00 52.86 53.05 1n8o s ASN 95 Cb -0.44 -1.07 0.96 0.00 -0.55 0.00 0.00 41.25 40.14 1n8o s ASN 95 CO 0.48 -0.16 1.93 0.77 -2.79 0.00 0.00 177.10 177.33 1n8o h SER 96 N 8.05 0.00 -0.29 -4.21 4.64 -1.94 0.35 113.55 120.15 1n8o h SER 96 Ca -0.26 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 60.94 1n8o h SER 96 Cb 1.10 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.19 1n8o h SER 96 CO 0.44 0.25 -0.26 -0.07 -0.87 0.00 0.00 176.83 176.31 1n8o h LEU 97 N 0.00 0.73 -0.11 5.97 4.07 -1.97 -3.28 115.31 120.72 1n8o h LEU 97 Ca -0.00 -0.46 0.00 0.00 0.08 0.00 0.00 57.88 57.49 1n8o h LEU 97 Cb 0.47 -0.21 0.00 0.00 1.08 0.00 0.00 40.66 42.00 1n8o h LEU 97 CO 0.03 1.04 -0.87 0.35 -1.08 0.00 0.00 178.44 177.91 1n8o n THR 98 N -4.28 0.00 -3.68 0.22 -2.24 -1.15 -4.98 114.28 98.16 1n8o n THR 98 Ca -0.04 -0.03 -0.21 0.00 -2.27 0.00 0.00 64.05 61.50 1n8o n THR 98 Cb 0.46 0.92 0.04 0.00 -2.10 0.00 0.00 70.33 69.65 1n8o n THR 98 CO 0.00 0.00 0.00 -0.38 -0.57 0.00 0.00 175.07 174.12 1n8o n ILE 99 N -1.33 -4.51 -4.21 2.28 5.41 0.12 -4.99 119.36 112.11 1n8o n ILE 99 Ca 0.05 -0.48 -0.28 0.00 1.00 0.00 0.00 62.75 63.04 1n8o n ILE 99 Cb 0.35 -3.85 -0.09 0.00 -0.71 0.00 0.00 39.64 35.33 1n8o n ILE 99 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 176.55 176.76 1n8o s ASN 100 N -4.33 4.59 -1.07 4.38 2.47 -0.92 -4.53 114.94 115.53 1n8o s ASN 100 Ca 0.03 -0.39 -0.00 0.00 0.42 0.00 0.00 52.86 52.91 1n8o s ASN 100 Cb -0.01 -0.93 -0.00 0.00 -1.45 0.00 0.00 41.25 38.85 1n8o s ASN 100 CO 0.81 0.13 0.90 0.59 -3.72 0.00 0.00 177.10 175.81 1n8o n ASN 101 N 0.28 -2.36 -4.31 -4.21 3.02 -1.26 -1.29 115.26 105.13 1n8o n ASN 101 Ca -0.11 -0.57 -0.44 0.00 -0.03 0.00 0.00 54.58 53.43 1n8o n ASN 101 Cb 0.54 -4.69 0.00 0.00 -0.61 0.00 0.00 39.78 35.02 1n8o n ASN 101 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1n8o n ASP 102 N -2.93 5.35 -3.73 6.41 4.64 -1.26 -4.12 116.55 120.90 1n8o n ASP 102 Ca -0.25 -3.04 -0.12 0.00 -1.38 0.00 0.00 54.79 50.00 1n8o n ASP 102 Cb 0.65 -1.50 -0.12 0.00 -1.04 0.00 0.00 41.12 39.12 1n8o n ASP 102 CO 0.00 0.00 0.00 -0.51 -0.82 0.00 0.00 177.20 175.87 1n8o s ILE 103 N 0.48 -0.03 -0.00 5.18 2.07 -1.26 -3.31 121.20 124.34 1n8o s ILE 103 Ca 0.39 0.09 0.05 0.00 -1.41 0.00 0.00 60.65 59.77 1n8o s ILE 103 Cb -0.02 -0.47 -0.01 0.00 0.13 0.00 0.00 42.46 42.09 1n8o s ILE 103 CO -0.01 0.04 -0.16 -0.89 -1.91 0.00 0.00 174.94 172.01 1n8o s THR 104 N 1.02 1.29 -0.05 4.00 2.01 -0.61 -1.53 115.64 121.76 1n8o s THR 104 Ca -0.07 -0.77 -0.01 0.00 0.31 0.00 0.00 61.69 61.15 1n8o s THR 104 Cb -0.08 -1.09 -0.03 0.00 0.01 0.00 0.00 72.50 71.31 1n8o s THR 104 CO -0.08 0.30 0.00 -0.76 -0.69 0.00 0.00 174.62 173.40 1n8o s LEU 105 N -0.54 3.56 -0.08 4.42 1.43 0.15 -1.40 118.68 126.21 1n8o s LEU 105 Ca 0.06 0.09 0.04 0.00 -1.03 0.00 0.00 54.13 53.29 1n8o s LEU 105 Cb -0.07 -1.90 -0.01 0.00 0.03 0.00 0.00 46.19 44.25 1n8o s LEU 105 CO -0.00 0.34 -0.23 -0.76 0.23 0.00 0.00 176.35 175.94 1n8o s LEU 106 N -1.13 2.20 -0.20 1.79 1.43 -0.08 -0.28 118.68 122.41 1n8o s LEU 106 Ca 0.16 -0.49 -0.09 0.00 -1.03 0.00 0.00 54.13 52.68 1n8o s LEU 106 Cb -0.11 -1.43 -0.05 0.00 0.03 0.00 0.00 46.19 44.63 1n8o s LEU 106 CO 0.05 0.21 0.10 -0.75 0.23 0.00 0.00 176.35 176.20 1n8o s LYS 107 N 0.05 4.08 0.26 1.70 2.20 -0.09 -1.70 119.74 126.25 1n8o s LYS 107 Ca -0.09 -0.28 -0.23 0.00 -0.36 0.00 0.00 55.97 55.00 1n8o s LYS 107 Cb -0.15 -3.34 -0.09 0.00 -1.51 0.00 0.00 37.83 32.73 1n8o s LYS 107 CO 0.06 0.26 0.83 -0.51 -0.36 0.00 0.00 175.35 175.62 1n8o s LEU 108 N 0.46 4.37 0.49 5.43 1.43 0.44 -0.22 118.68 131.07 1n8o s LEU 108 Ca 0.06 1.63 0.27 0.00 -1.03 0.00 0.00 54.13 55.05 1n8o s LEU 108 Cb -0.12 -3.75 1.19 0.00 0.03 0.00 0.00 46.19 43.54 1n8o s LEU 108 CO -0.00 0.01 1.94 0.28 0.23 0.00 0.00 176.35 178.80 1n8o h SER 109 N 3.40 0.00 -3.68 2.29 0.02 -0.90 -3.41 113.55 111.27 1n8o h SER 109 Ca -0.47 0.00 -0.35 0.00 -0.84 0.00 0.00 61.79 60.13 1n8o h SER 109 Cb 1.19 0.00 -0.31 0.00 0.14 0.00 0.00 62.40 63.42 1n8o h SER 109 CO 0.65 0.17 -0.76 0.42 -1.14 0.00 0.00 176.83 176.17 1n8o s THR 110 N -3.86 0.38 0.32 -2.27 -4.23 -1.26 -4.99 115.64 99.74 1n8o s THR 110 Ca -0.01 -0.11 -0.29 0.00 -1.18 0.00 0.00 61.69 60.10 1n8o s THR 110 Cb 0.11 -0.38 -0.10 0.00 1.34 0.00 0.00 72.50 73.47 1n8o s THR 110 CO 0.60 0.15 1.29 0.00 -0.54 0.00 0.00 174.62 176.13 1n8o s ALA 111 N 0.45 3.49 0.42 3.99 0.00 -1.26 -4.82 121.76 124.04 1n8o s ALA 111 Ca -0.05 1.24 -0.26 0.00 0.00 0.00 0.00 51.96 52.89 1n8o s ALA 111 Cb -0.09 -3.47 -0.09 0.00 0.00 0.00 0.00 23.12 19.48 1n8o s ALA 111 CO -0.00 -0.61 1.33 0.00 0.00 0.00 0.00 175.76 176.48 1n8o s ALA 112 N -1.11 3.25 -0.30 0.00 0.00 0.29 -5.00 121.76 118.89 1n8o s ALA 112 Ca 0.49 1.29 -0.19 0.00 0.00 0.00 0.00 51.96 53.55 1n8o s ALA 112 Cb -0.39 -3.51 -0.01 0.00 0.00 0.00 0.00 23.12 19.20 1n8o s ALA 112 CO 0.52 -0.92 0.58 -1.12 0.00 0.00 0.00 175.76 174.82 1n8o s SER 113 N -0.69 6.45 0.61 0.00 0.01 -1.26 -4.82 113.70 114.00 1n8o s SER 113 Ca 0.58 0.38 -0.17 0.00 1.31 0.00 0.00 55.95 58.05 1n8o s SER 113 Cb -0.39 -2.31 -0.02 0.00 0.21 0.00 0.00 66.02 63.51 1n8o s SER 113 CO 0.51 -0.43 1.11 -0.36 0.41 0.00 0.00 173.24 174.48 1n8o s PHE 114 N 2.49 2.66 0.00 2.43 0.40 -1.26 -4.78 117.98 119.93 1n8o s PHE 114 Ca 0.23 1.55 0.00 0.00 -0.60 0.00 0.00 56.93 58.11 1n8o s PHE 114 Cb -0.15 -3.20 0.00 0.00 0.51 0.00 0.00 43.02 40.18 1n8o s PHE 114 CO 0.11 -1.61 0.00 -1.13 0.70 0.00 0.00 175.22 173.30 1n8o n SER 115 N -1.99 0.00 0.09 1.36 3.41 -0.34 -4.92 113.62 111.22 1n8o n SER 115 Ca 0.11 0.00 -0.01 0.00 -0.26 0.00 0.00 58.87 58.71 1n8o n SER 115 Cb 0.52 0.00 0.27 0.00 -0.26 0.00 0.00 64.21 64.74 1n8o n SER 115 CO 0.00 0.00 0.00 1.56 -0.16 0.00 0.00 175.04 176.44 1n8o h GLN 116 N 0.00 0.28 -0.05 4.33 4.20 -1.98 -3.23 115.11 118.67 1n8o h GLN 116 Ca 0.00 -0.10 0.00 0.00 0.06 0.00 0.00 58.65 58.61 1n8o h GLN 116 Cb 0.00 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 27.76 1n8o h GLN 116 CO 0.00 0.55 0.00 0.25 -0.67 0.00 0.00 178.83 178.96 1n8o n THR 117 N -4.12 0.09 -3.82 -0.54 -2.24 -1.26 -4.87 114.28 97.52 1n8o n THR 117 Ca -0.01 -0.54 -0.29 0.00 -2.27 0.00 0.00 64.05 60.94 1n8o n THR 117 Cb 0.40 1.19 -0.16 0.00 -2.10 0.00 0.00 70.33 69.65 1n8o n THR 117 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1n8o s VAL 118 N -1.01 0.95 0.19 2.28 1.01 -1.22 -4.36 120.40 118.24 1n8o s VAL 118 Ca 0.15 -0.83 -0.06 0.00 0.00 0.00 0.00 61.98 61.25 1n8o s VAL 118 Cb 0.10 -1.35 0.02 0.00 0.00 0.00 0.00 36.38 35.16 1n8o s VAL 118 CO 0.15 -0.15 0.35 -1.54 0.00 0.00 0.00 175.10 173.91 1n8o n SER 119 N 4.89 -1.01 -4.81 3.32 3.41 -0.83 -1.20 113.62 117.39 1n8o n SER 119 Ca -0.10 -1.81 -0.29 0.00 -0.26 0.00 0.00 58.87 56.41 1n8o n SER 119 Cb 0.46 1.71 -0.06 0.00 -0.26 0.00 0.00 64.21 66.07 1n8o n SER 119 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1n8o s ALA 120 N -1.67 3.64 0.25 7.33 0.00 -1.26 -2.07 121.76 127.97 1n8o s ALA 120 Ca 0.09 -1.06 -0.08 0.00 0.00 0.00 0.00 51.96 50.92 1n8o s ALA 120 Cb -0.02 -1.48 -0.06 0.00 0.00 0.00 0.00 23.12 21.56 1n8o s ALA 120 CO 0.07 0.67 0.55 0.54 0.00 0.00 0.00 175.76 177.59 1n8o s VAL 121 N -1.53 4.97 0.38 0.00 0.11 -0.42 -4.86 120.40 119.04 1n8o s VAL 121 Ca 0.31 0.33 -0.19 0.00 -2.93 0.00 0.00 61.98 59.50 1n8o s VAL 121 Cb -0.12 -3.66 -0.10 0.00 -1.53 0.00 0.00 36.38 30.98 1n8o s VAL 121 CO 0.23 -0.16 0.87 0.00 -3.33 0.00 0.00 175.10 172.71 1n8o s LEU 123 N -3.00 4.38 0.88 0.00 2.96 -1.26 -5.10 118.68 117.54 1n8o s LEU 123 Ca 0.58 0.51 -0.12 0.00 -0.22 0.00 0.00 54.13 54.88 1n8o s LEU 123 Cb -0.10 -2.49 0.12 0.00 0.50 0.00 0.00 46.19 44.22 1n8o s LEU 123 CO 0.15 0.30 1.11 -2.16 -1.32 0.00 0.00 176.35 174.43 1n8o s PRO 124 N -1.57 1.37 0.42 0.98 0.04 -1.26 -5.08 135.00 129.90 1n8o s PRO 124 Ca 0.24 0.55 -0.09 0.00 0.04 0.00 0.00 61.00 61.74 1n8o s PRO 124 Cb -0.13 -1.84 -0.06 0.00 0.04 0.00 0.00 34.50 32.51 1n8o s PRO 124 CO 0.13 -2.10 0.78 0.45 0.04 0.00 0.00 177.00 176.30 1n8o s SER 125 N -3.77 6.46 0.55 6.66 0.15 -1.26 -4.97 113.70 117.52 1n8o s SER 125 Ca 0.63 1.09 0.29 0.00 0.70 0.00 0.00 55.95 58.67 1n8o s SER 125 Cb -0.16 -2.31 1.63 0.00 -1.71 0.00 0.00 66.02 63.47 1n8o s SER 125 CO 0.55 -0.44 2.15 0.00 1.20 0.00 0.00 173.24 176.69 1n8o h ALA 126 N 1.02 1.33 -0.00 5.45 0.00 -2.08 -1.79 119.26 123.19 1n8o h ALA 126 Ca -0.47 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.38 1n8o h ALA 126 Cb 1.19 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.97 1n8o h ALA 126 CO 0.63 0.09 -0.04 -1.13 0.00 0.00 0.00 179.25 178.80 1n8o n SER 127 N -3.65 0.48 -4.77 0.00 3.41 -1.26 -4.90 113.62 102.92 1n8o n SER 127 Ca -0.02 -0.90 -0.39 0.00 -0.26 0.00 0.00 58.87 57.30 1n8o n SER 127 Cb 0.18 -0.05 -0.03 0.00 -0.26 0.00 0.00 64.21 64.05 1n8o n SER 127 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 1n8o s ASP 128 N -2.20 6.90 -0.14 4.04 -0.00 -0.68 -5.01 116.67 119.57 1n8o s ASP 128 Ca 0.38 2.35 0.02 0.00 -0.00 0.00 0.00 52.55 55.30 1n8o s ASP 128 Cb 0.21 -2.62 0.01 0.00 -0.00 0.00 0.00 42.92 40.51 1n8o s ASP 128 CO 0.41 -0.41 -0.21 -0.62 -0.00 0.00 0.00 175.17 174.33 1n8o s ASP 129 N -0.95 3.22 -0.36 0.27 2.15 -1.26 -4.98 116.67 114.76 1n8o s ASP 129 Ca 0.50 -0.58 -0.02 0.00 0.43 0.00 0.00 52.55 52.89 1n8o s ASP 129 Cb -0.32 -1.47 0.08 0.00 -0.30 0.00 0.00 42.92 40.92 1n8o s ASP 129 CO 0.41 0.09 0.11 -0.36 -0.17 0.00 0.00 175.17 175.24 1n8o s PHE 130 N 0.79 3.48 0.51 -5.34 0.40 -1.26 -5.09 117.98 111.47 1n8o s PHE 130 Ca -0.07 -2.25 -0.21 0.00 -0.60 0.00 0.00 56.93 53.79 1n8o s PHE 130 Cb -0.16 -2.75 -0.06 0.00 0.51 0.00 0.00 43.02 40.57 1n8o s PHE 130 CO -0.01 -0.90 1.20 0.00 0.70 0.00 0.00 175.22 176.21 1n8o s ALA 131 N 1.16 2.83 0.38 5.36 0.00 -1.26 -4.97 121.76 125.27 1n8o s ALA 131 Ca 0.03 0.99 -0.27 0.00 0.00 0.00 0.00 51.96 52.71 1n8o s ALA 131 Cb -0.21 -3.42 -0.10 0.00 0.00 0.00 0.00 23.12 19.39 1n8o s ALA 131 CO -0.03 -0.87 1.41 0.00 0.00 0.00 0.00 175.76 176.26 1n8o s ALA 132 N -1.55 3.45 0.00 0.00 0.00 -1.26 -1.40 121.76 121.01 1n8o s ALA 132 Ca 0.69 1.43 0.00 0.00 0.00 0.00 0.00 51.96 54.08 1n8o s ALA 132 Cb -0.30 -3.56 0.00 0.00 0.00 0.00 0.00 23.12 19.26 1n8o s ALA 132 CO 0.35 -0.95 0.00 0.41 0.00 0.00 0.00 175.76 175.57 1n8o n GLY 133 N 0.59 2.99 3.67 0.00 0.00 -1.26 -5.04 105.19 106.14 1n8o n GLY 133 Ca 0.02 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.59 1n8o n GLY 133 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1n8o n THR 134 N -0.21 0.82 -3.10 2.61 -1.04 -0.49 -4.94 114.28 107.93 1n8o n THR 134 Ca 0.00 -0.20 -0.40 0.00 -2.04 0.00 0.00 64.05 61.40 1n8o n THR 134 Cb 0.00 -1.51 -0.06 0.00 -1.82 0.00 0.00 70.33 66.94 1n8o n THR 134 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 1n8o s THR 135 N 0.08 5.00 0.53 12.58 2.01 -1.26 -5.04 115.64 129.53 1n8o s THR 135 Ca 0.69 1.20 0.01 0.00 0.31 0.00 0.00 61.69 63.90 1n8o s THR 135 Cb -0.65 -3.95 0.01 0.00 0.01 0.00 0.00 72.50 67.92 1n8o s THR 135 CO 0.48 0.08 0.04 0.00 -0.69 0.00 0.00 174.62 174.53 1n8o s VAL 137 N -2.88 0.86 0.10 0.00 1.01 -1.26 -5.14 120.40 113.09 1n8o s VAL 137 Ca 0.03 -0.55 0.09 0.00 0.00 0.00 0.00 61.98 61.55 1n8o s VAL 137 Cb -0.00 -0.74 -0.04 0.00 0.00 0.00 0.00 36.38 35.61 1n8o s VAL 137 CO 0.02 0.18 -0.23 0.28 0.00 0.00 0.00 175.10 175.35 1n8o s THR 138 N -0.38 1.89 0.05 3.92 -1.32 -1.26 -5.16 115.64 113.39 1n8o s THR 138 Ca 0.03 -1.56 0.00 0.00 -1.21 0.00 0.00 61.69 58.95 1n8o s THR 138 Cb -0.05 -1.69 -0.03 0.00 -1.51 0.00 0.00 72.50 69.22 1n8o s THR 138 CO -0.00 0.03 -0.04 0.42 -2.21 0.00 0.00 174.62 172.82 1n8o s THR 139 N -1.07 0.33 -3.85 5.08 -4.23 -1.26 -5.09 115.64 105.54 1n8o s THR 139 Ca 0.09 -1.54 0.00 0.00 -1.18 0.00 0.00 61.69 59.06 1n8o s THR 139 Cb -0.10 -1.15 0.00 0.00 1.34 0.00 0.00 72.50 72.59 1n8o s THR 139 CO 0.04 -0.79 0.00 0.61 -0.54 0.00 0.00 174.62 173.95 1n8o n GLY 140 N 0.59 -2.45 1.45 3.99 0.00 -1.26 -4.99 105.19 102.52 1n8o n GLY 140 Ca -0.17 -1.25 -0.09 0.00 0.00 0.00 0.00 46.02 44.51 1n8o n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1n8o n TRP 141 N -0.23 1.62 -2.07 1.61 8.01 -1.26 -4.66 117.44 120.46 1n8o n TRP 141 Ca 0.00 -1.65 -0.27 0.00 -1.31 0.00 0.00 57.50 54.27 1n8o n TRP 141 Cb 0.00 -0.61 0.07 0.00 -2.01 0.00 0.00 31.31 28.76 1n8o n TRP 141 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.69 176.88 1n8o s GLY 142 N -2.18 1.64 0.29 6.99 0.00 -1.26 -4.92 107.32 107.88 1n8o s GLY 142 Ca 0.48 -0.76 -0.28 0.00 0.00 0.00 0.00 44.72 44.15 1n8o s GLY 142 CO 0.03 -0.33 1.04 1.04 0.00 0.00 0.00 173.10 174.88 1n8o n LEU 143 N -3.08 1.94 -0.32 0.66 4.77 -1.26 -1.69 117.00 118.02 1n8o n LEU 143 Ca 0.08 1.18 0.10 0.00 -0.03 0.00 0.00 56.01 57.34 1n8o n LEU 143 Cb 0.60 -1.30 -0.04 0.00 -2.33 0.00 0.00 43.42 40.35 1n8o n LEU 143 CO 0.55 -1.31 0.19 0.35 -1.33 0.00 0.00 177.39 175.83 1n8o n THR 144 N 0.27 0.00 -3.71 -5.08 -2.24 -1.25 -0.79 114.28 101.48 1n8o n THR 144 Ca 0.09 -0.20 -0.12 0.00 -2.27 0.00 0.00 64.05 61.56 1n8o n THR 144 Cb 0.32 1.17 -0.10 0.00 -2.10 0.00 0.00 70.33 69.61 1n8o n THR 144 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 1n8o s ARG 145 N -2.53 0.43 0.00 -0.78 3.52 -1.26 -3.94 118.95 114.39 1n8o s ARG 145 Ca 0.14 0.69 0.31 0.00 -0.13 0.00 0.00 55.73 56.74 1n8o s ARG 145 Cb 0.16 0.09 1.84 0.00 -1.56 0.00 0.00 34.95 35.48 1n8o s ARG 145 CO 0.63 -0.11 2.17 0.98 -0.81 0.00 0.00 175.30 178.15