#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1onb s SER 2 N 0.00 7.05 -0.37 1.61 0.15 -1.26 -5.00 113.70 115.88 1onb s SER 2 Ca 0.00 2.43 -0.03 0.00 0.70 0.00 0.00 55.95 59.05 1onb s SER 2 Cb 0.00 -2.63 0.08 0.00 -1.71 0.00 0.00 66.02 61.76 1onb s SER 2 CO 0.00 -0.33 0.14 -0.69 1.20 0.00 0.00 173.24 173.56 1onb s VAL 3 N -1.00 3.31 0.28 4.45 1.01 -1.26 -5.05 120.40 122.14 1onb s VAL 3 Ca 0.47 -1.72 -0.29 0.00 0.00 0.00 0.00 61.98 60.44 1onb s VAL 3 Cb -0.35 -3.11 -0.10 0.00 0.00 0.00 0.00 36.38 32.83 1onb s VAL 3 CO 0.45 -0.45 1.27 0.42 0.00 0.00 0.00 175.10 176.79 1onb s THR 4 N 1.22 3.01 0.47 3.92 -4.23 -1.26 -4.97 115.64 113.80 1onb s THR 4 Ca 0.03 0.95 -0.23 0.00 -1.18 0.00 0.00 61.69 61.26 1onb s THR 4 Cb -0.22 -3.61 -0.07 0.00 1.34 0.00 0.00 72.50 69.95 1onb s THR 4 CO -0.02 0.20 1.21 0.54 -0.54 0.00 0.00 174.62 176.01 1onb s VAL 5 N -0.75 2.89 0.51 2.29 0.11 -1.26 -5.02 120.40 119.17 1onb s VAL 5 Ca 0.51 0.67 -0.09 0.00 -2.93 0.00 0.00 61.98 60.14 1onb s VAL 5 Cb -0.37 -3.34 0.12 0.00 -1.53 0.00 0.00 36.38 31.26 1onb s VAL 5 CO 0.46 -0.00 0.51 -0.81 -3.33 0.00 0.00 175.10 171.92 1onb n PRO 6 N -0.57 -1.56 0.00 1.54 -0.04 -1.26 -4.99 135.00 128.12 1onb n PRO 6 Ca 0.08 -0.80 0.00 0.00 -0.04 0.00 0.00 63.50 62.73 1onb n PRO 6 Cb 0.47 -0.68 0.00 0.00 -0.04 0.00 0.00 33.50 33.25 1onb n PRO 6 CO 0.00 0.00 0.00 -2.39 -0.04 0.00 0.00 175.50 173.07 1onb n HIS 7 N -3.33 0.00 -0.86 0.54 1.44 -1.26 -5.04 115.22 106.71 1onb n HIS 7 Ca 0.07 0.00 -0.17 0.00 -2.01 0.00 0.00 57.72 55.60 1onb n HIS 7 Cb 0.26 0.00 -0.09 0.00 0.12 0.00 0.00 29.99 30.28 1onb n HIS 7 CO 0.00 0.00 0.00 -0.35 -2.81 0.00 0.00 176.34 173.18 1onb n PRO 8 N 0.00 2.04 0.00 -1.40 -0.04 -1.26 -3.63 135.00 130.71 1onb n PRO 8 Ca 0.00 -1.17 0.00 0.00 -0.04 0.00 0.00 63.50 62.29 1onb n PRO 8 Cb 0.00 -2.17 0.00 0.00 -0.04 0.00 0.00 33.50 31.29 1onb n PRO 8 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1onb n ASN 9 N 3.14 0.14 -4.11 3.54 3.02 -1.26 -5.07 115.26 114.66 1onb n ASN 9 Ca 0.44 -1.06 -0.24 0.00 -0.03 0.00 0.00 54.58 53.69 1onb n ASN 9 Cb 0.49 0.00 -0.15 0.00 -0.61 0.00 0.00 39.78 39.51 1onb n ASN 9 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1onb s ILE 10 N -0.06 1.22 -0.05 2.41 1.01 -1.24 -2.28 121.20 122.20 1onb s ILE 10 Ca 0.00 -0.63 -0.28 0.00 0.00 0.00 0.00 60.65 59.74 1onb s ILE 10 Cb 0.00 -1.03 -0.03 0.00 0.01 0.00 0.00 42.46 41.41 1onb s ILE 10 CO 0.00 0.35 0.91 -0.70 0.00 0.00 0.00 174.94 175.50 1onb s GLU 11 N -0.16 4.48 -0.04 2.79 2.12 0.43 -4.85 118.70 123.47 1onb s GLU 11 Ca 0.02 1.25 -0.21 0.00 0.36 0.00 0.00 54.97 56.39 1onb s GLU 11 Cb -0.08 -3.48 -0.05 0.00 0.26 0.00 0.00 34.13 30.78 1onb s GLU 11 CO 0.00 -0.10 0.59 -1.21 -0.54 0.00 0.00 175.26 174.00 1onb s GLU 12 N 1.27 4.34 0.14 4.30 2.02 -1.26 0.24 118.70 129.75 1onb s GLU 12 Ca 0.47 0.70 0.06 0.00 0.02 0.00 0.00 54.97 56.22 1onb s GLU 12 Cb -0.19 -3.38 -0.04 0.00 0.10 0.00 0.00 34.13 30.62 1onb s GLU 12 CO 0.22 0.27 -0.14 0.08 0.02 0.00 0.00 175.26 175.71 1onb s VAL 13 N 0.15 1.43 -0.32 2.63 1.01 0.49 -4.91 120.40 120.89 1onb s VAL 13 Ca 0.31 -1.86 -0.05 0.00 0.00 0.00 0.00 61.98 60.38 1onb s VAL 13 Cb -0.17 -1.68 0.04 0.00 0.00 0.00 0.00 36.38 34.56 1onb s VAL 13 CO 0.16 -0.47 0.07 0.00 0.00 0.00 0.00 175.10 174.87 1onb s ALA 14 N -2.39 2.99 0.27 5.51 0.00 -1.26 -2.67 121.76 124.21 1onb s ALA 14 Ca 0.13 -1.69 -0.31 0.00 0.00 0.00 0.00 51.96 50.09 1onb s ALA 14 Cb -0.04 -2.16 -0.12 0.00 0.00 0.00 0.00 23.12 20.80 1onb s ALA 14 CO 0.04 -1.24 1.59 -0.11 0.00 0.00 0.00 175.76 176.03 1onb n LEU 15 N 4.78 4.09 0.00 0.00 7.94 -0.19 -4.89 117.00 128.73 1onb n LEU 15 Ca -0.13 1.13 -0.11 0.00 -1.11 0.00 0.00 56.01 55.79 1onb n LEU 15 Cb 0.45 -1.56 -0.04 0.00 0.53 0.00 0.00 43.42 42.80 1onb n LEU 15 CO 0.30 0.05 -0.06 -1.54 -1.11 0.00 0.00 177.39 175.04 1onb n SER 16 N 2.45 -0.19 -4.58 1.96 3.41 -1.26 -4.74 113.62 110.67 1onb n SER 16 Ca 0.10 -2.17 -0.39 0.00 -0.26 0.00 0.00 58.87 56.15 1onb n SER 16 Cb 0.35 0.85 -0.02 0.00 -0.26 0.00 0.00 64.21 65.14 1onb n SER 16 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1onb s THR 17 N -2.68 3.97 -0.26 6.66 -4.23 -1.26 -1.95 115.64 115.89 1onb s THR 17 Ca 0.20 -1.57 -0.02 0.00 -1.18 0.00 0.00 61.69 59.12 1onb s THR 17 Cb 0.01 -5.03 0.15 0.00 1.34 0.00 0.00 72.50 68.96 1onb s THR 17 CO 0.14 -1.79 0.44 -0.89 -0.54 0.00 0.00 174.62 171.98 1onb s THR 18 N 5.78 -0.71 -5.00 3.99 2.01 -0.96 -4.80 115.64 115.95 1onb s THR 18 Ca 0.56 -0.06 0.00 0.00 0.31 0.00 0.00 61.69 62.50 1onb s THR 18 Cb 0.02 -0.87 0.00 0.00 0.01 0.00 0.00 72.50 71.66 1onb s THR 18 CO 0.07 -0.10 0.00 0.61 -0.69 0.00 0.00 174.62 174.51 1onb n GLY 19 N 5.38 0.43 0.00 4.40 0.00 -1.23 -0.17 105.19 114.01 1onb n GLY 19 Ca -0.03 -1.69 0.01 0.00 0.00 0.00 0.00 46.02 44.31 1onb n GLY 19 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1onb n GLU 20 N 0.00 0.72 -3.30 1.61 -0.58 -1.21 -4.86 120.64 113.01 1onb n GLU 20 Ca 0.00 -0.02 -0.43 0.00 -0.42 0.00 0.00 57.16 56.29 1onb n GLU 20 Cb 0.00 -1.06 -0.09 0.00 -0.57 0.00 0.00 31.44 29.72 1onb n GLU 20 CO 0.00 0.00 0.00 -1.50 -0.48 0.00 0.00 177.13 175.15 1onb s ILE 21 N -2.15 5.07 0.73 -3.67 2.07 -1.20 -4.95 121.20 117.10 1onb s ILE 21 Ca -0.01 -0.24 -0.14 0.00 -1.41 0.00 0.00 60.65 58.84 1onb s ILE 21 Cb 0.01 -4.03 0.04 0.00 0.13 0.00 0.00 42.46 38.61 1onb s ILE 21 CO 0.10 -0.40 1.17 -2.16 -1.91 0.00 0.00 174.94 171.74 1onb s PRO 22 N 2.20 2.19 -0.33 3.50 0.04 -1.26 0.29 135.00 141.63 1onb s PRO 22 Ca 0.13 1.60 -0.03 0.00 0.04 0.00 0.00 61.00 62.74 1onb s PRO 22 Cb -0.17 -1.86 0.19 0.00 0.04 0.00 0.00 34.50 32.70 1onb s PRO 22 CO 0.14 -1.76 0.88 0.12 0.04 0.00 0.00 177.00 176.42 1onb s PHE 23 N -2.21 -0.94 -0.81 0.56 5.36 0.37 -4.70 117.98 115.60 1onb s PHE 23 Ca 0.71 0.31 -0.02 0.00 -0.96 0.00 0.00 56.93 56.97 1onb s PHE 23 Cb -0.25 0.17 -0.01 0.00 -0.34 0.00 0.00 43.02 42.58 1onb s PHE 23 CO 0.46 -0.60 0.74 0.66 -1.46 0.00 0.00 175.22 175.02 1onb n TYR 24 N 4.49 -2.80 -1.15 10.12 4.01 -1.26 -2.13 117.16 128.44 1onb n TYR 24 Ca 0.08 1.05 -0.08 0.00 -0.16 0.00 0.00 57.90 58.78 1onb n TYR 24 Cb 0.59 -4.01 -0.04 0.00 -0.31 0.00 0.00 39.34 35.57 1onb n TYR 24 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1onb n GLY 25 N -1.66 0.78 3.23 2.72 0.00 -1.26 -4.91 105.19 104.09 1onb n GLY 25 Ca -0.04 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.82 1onb n GLY 25 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1onb s LYS 26 N -2.51 1.01 -0.32 1.61 -0.14 -0.91 -4.76 119.74 113.72 1onb s LYS 26 Ca 0.00 -1.31 -0.02 0.00 -1.36 0.00 0.00 55.97 53.29 1onb s LYS 26 Cb 0.00 -0.74 0.06 0.00 -1.68 0.00 0.00 37.83 35.48 1onb s LYS 26 CO 0.00 0.12 0.04 0.00 -0.76 0.00 0.00 175.35 174.75 1onb s ALA 27 N -2.63 2.89 -0.24 5.17 0.00 -0.82 0.14 121.76 126.26 1onb s ALA 27 Ca 0.11 -1.96 -0.29 0.00 0.00 0.00 0.00 51.96 49.82 1onb s ALA 27 Cb -0.02 -2.04 -0.02 0.00 0.00 0.00 0.00 23.12 21.04 1onb s ALA 27 CO 0.02 -1.40 1.64 0.42 0.00 0.00 0.00 175.76 176.43 1onb s ILE 28 N 1.21 3.66 0.10 0.00 1.01 0.14 -2.28 121.20 125.05 1onb s ILE 28 Ca -0.02 0.73 -0.31 0.00 0.00 0.00 0.00 60.65 61.06 1onb s ILE 28 Cb -0.20 -3.71 -0.07 0.00 0.01 0.00 0.00 42.46 38.48 1onb s ILE 28 CO -0.02 -0.33 1.35 -2.16 0.00 0.00 0.00 174.94 173.78 1onb s PRO 29 N 4.85 4.34 0.55 2.79 0.04 0.76 -3.22 135.00 145.11 1onb s PRO 29 Ca 0.72 2.00 0.30 0.00 0.04 0.00 0.00 61.00 64.07 1onb s PRO 29 Cb -0.24 -3.29 1.64 0.00 0.04 0.00 0.00 34.50 32.65 1onb s PRO 29 CO 0.30 -0.41 1.91 -0.07 0.04 0.00 0.00 177.00 178.77 1onb h LEU 30 N 6.89 0.00 -1.89 -3.56 3.38 -1.93 -0.39 115.31 117.82 1onb h LEU 30 Ca -0.42 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.55 1onb h LEU 30 Cb 1.21 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.96 1onb h LEU 30 CO 0.86 0.00 0.02 1.05 0.09 0.00 0.00 178.44 180.46 1onb h GLU 31 N 0.00 0.00 0.00 1.13 4.11 -1.89 1.61 114.58 119.54 1onb h GLU 31 Ca 0.00 0.00 -0.16 0.00 0.07 0.00 0.00 59.36 59.27 1onb h GLU 31 Cb 0.33 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.55 1onb h GLU 31 CO 0.00 0.00 -1.68 1.33 0.07 0.00 0.00 179.01 178.73 1onb n VAL 32 N -2.51 0.94 -0.00 -1.06 0.24 -0.15 -4.53 118.33 111.26 1onb n VAL 32 Ca -0.02 -0.67 0.00 0.00 -2.04 0.00 0.00 64.34 61.61 1onb n VAL 32 Cb 0.07 -0.51 -0.02 0.00 -1.47 0.00 0.00 33.84 31.91 1onb n VAL 32 CO 0.00 0.00 0.00 2.30 -2.14 0.00 0.00 176.83 176.99 1onb n ILE 33 N -2.72 0.04 -3.52 1.34 -5.35 -0.44 -4.77 119.36 103.93 1onb n ILE 33 Ca -0.12 -0.06 -0.33 0.00 -0.27 0.00 0.00 62.75 61.97 1onb n ILE 33 Cb 0.82 0.06 -0.05 0.00 -1.74 0.00 0.00 39.64 38.73 1onb n ILE 33 CO 0.00 0.00 0.00 -0.75 -1.76 0.00 0.00 176.55 174.04 1onb s LYS 34 N -2.11 3.76 0.00 6.28 2.47 0.54 -4.10 119.74 126.57 1onb s LYS 34 Ca -0.01 0.17 0.00 0.00 -1.56 0.00 0.00 55.97 54.57 1onb s LYS 34 Cb 0.01 -2.82 0.00 0.00 -1.46 0.00 0.00 37.83 33.56 1onb s LYS 34 CO 0.08 0.44 0.00 0.41 0.16 0.00 0.00 175.35 176.44 1onb n GLY 35 N 0.28 0.33 0.00 5.54 0.00 -1.26 -4.63 105.19 105.44 1onb n GLY 35 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.99 1onb n GLY 35 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1onb n GLY 36 N -2.00 0.92 3.72 -0.02 0.00 -1.26 -4.97 105.19 101.57 1onb n GLY 36 Ca 0.00 -0.67 -0.36 0.00 0.00 0.00 0.00 46.02 44.99 1onb n GLY 36 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1onb s ARG 37 N 0.23 4.23 0.01 1.61 0.52 -1.26 -3.53 118.95 120.75 1onb s ARG 37 Ca 0.00 0.00 0.01 0.00 -0.52 0.00 0.00 55.73 55.22 1onb s ARG 37 Cb 0.00 -3.44 -0.01 0.00 0.52 0.00 0.00 34.95 32.02 1onb s ARG 37 CO 0.00 0.22 -0.03 -1.01 0.02 0.00 0.00 175.30 174.50 1onb s HIS 38 N 0.54 0.26 -0.27 -0.53 3.76 -1.12 -2.05 115.29 115.88 1onb s HIS 38 Ca 0.14 -0.30 -0.07 0.00 -0.15 0.00 0.00 55.06 54.68 1onb s HIS 38 Cb -0.13 -0.17 -0.01 0.00 1.11 0.00 0.00 32.58 33.39 1onb s HIS 38 CO 0.03 -0.09 0.06 -1.17 -0.85 0.00 0.00 174.74 172.72 1onb s LEU 39 N -0.85 3.59 -0.19 0.89 2.96 -1.08 0.53 118.68 124.53 1onb s LEU 39 Ca -0.08 -0.50 -0.16 0.00 -0.22 0.00 0.00 54.13 53.17 1onb s LEU 39 Cb -0.06 -1.88 -0.04 0.00 0.50 0.00 0.00 46.19 44.72 1onb s LEU 39 CO -0.00 -0.12 0.41 -0.63 -1.32 0.00 0.00 176.35 174.69 1onb s ILE 40 N 1.54 5.19 -0.24 6.68 -1.09 0.40 -2.70 121.20 130.98 1onb s ILE 40 Ca 0.04 0.74 -0.16 0.00 -2.23 0.00 0.00 60.65 59.04 1onb s ILE 40 Cb -0.16 -3.74 -0.03 0.00 -1.58 0.00 0.00 42.46 36.94 1onb s ILE 40 CO 0.02 0.26 0.43 -0.36 -1.23 0.00 0.00 174.94 174.05 1onb s PHE 41 N 1.26 3.30 0.14 3.97 0.08 -0.35 -0.26 117.98 126.11 1onb s PHE 41 Ca 0.20 0.55 0.10 0.00 0.12 0.00 0.00 56.93 57.90 1onb s PHE 41 Cb -0.15 -2.60 -0.04 0.00 -0.57 0.00 0.00 43.02 39.66 1onb s PHE 41 CO 0.08 -0.17 -0.23 0.00 -0.10 0.00 0.00 175.22 174.80 1onb n HIS 43 N 0.76 0.29 -4.36 0.00 1.44 -1.26 -3.96 115.22 108.13 1onb n HIS 43 Ca -0.16 -0.18 -0.20 0.00 -2.01 0.00 0.00 57.72 55.17 1onb n HIS 43 Cb 0.53 -0.00 -0.15 0.00 0.12 0.00 0.00 29.99 30.48 1onb n HIS 43 CO 0.00 0.00 0.00 -1.54 -2.81 0.00 0.00 176.34 171.99 1onb s SER 44 N -1.40 1.16 0.17 4.39 1.04 -1.26 -4.64 113.70 113.16 1onb s SER 44 Ca 0.29 -0.18 -0.05 0.00 0.48 0.00 0.00 55.95 56.49 1onb s SER 44 Cb 0.18 -0.33 0.06 0.00 0.10 0.00 0.00 66.02 66.03 1onb s SER 44 CO 0.26 0.05 1.48 0.50 0.98 0.00 0.00 173.24 176.51 1onb h LYS 45 N 6.45 0.64 -0.68 4.02 3.64 -1.99 -2.94 116.57 125.71 1onb h LYS 45 Ca -0.33 -0.41 -0.00 0.00 -1.27 0.00 0.00 60.65 58.64 1onb h LYS 45 Cb 1.17 0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 33.01 1onb h LYS 45 CO 0.49 1.02 0.41 0.87 -2.27 0.00 0.00 179.45 179.97 1onb h LYS 46 N 0.49 0.92 -0.13 1.90 1.57 -2.01 -2.36 116.57 116.94 1onb h LYS 46 Ca 0.01 -0.08 -0.18 0.00 -1.87 0.00 0.00 60.65 58.53 1onb h LYS 46 Cb 1.11 -0.19 -0.00 0.00 0.08 0.00 0.00 32.23 33.23 1onb h LYS 46 CO 0.11 0.64 -0.67 -0.22 -0.57 0.00 0.00 179.45 178.74 1onb h LYS 47 N 0.93 0.53 -0.42 3.15 1.63 -1.98 -2.99 116.57 117.43 1onb h LYS 47 Ca 0.24 -0.39 -0.00 0.00 -0.85 0.00 0.00 60.65 59.65 1onb h LYS 47 Cb -0.04 0.07 -0.02 0.00 -0.60 0.00 0.00 32.23 31.64 1onb h LYS 47 CO -0.05 1.02 0.25 0.00 -3.45 0.00 0.00 179.45 177.22 1onb h ASP 49 N 0.57 0.09 -0.24 0.00 5.19 -1.35 -2.75 116.42 117.93 1onb h ASP 49 Ca 0.15 -0.48 -0.16 0.00 -0.62 0.00 0.00 57.03 55.92 1onb h ASP 49 Cb -0.03 -0.02 0.00 0.00 0.18 0.00 0.00 39.33 39.46 1onb h ASP 49 CO -0.03 0.55 -0.47 -0.33 -3.12 0.00 0.00 179.24 175.85 1onb h GLU 50 N -0.38 0.73 -0.68 3.56 4.39 -1.36 -2.89 114.58 117.96 1onb h GLU 50 Ca 0.01 -0.47 0.06 0.00 0.34 0.00 0.00 59.36 59.29 1onb h GLU 50 Cb 0.53 0.06 -0.06 0.00 -0.10 0.00 0.00 28.75 29.18 1onb h GLU 50 CO 0.01 1.10 0.38 1.25 -1.16 0.00 0.00 179.01 180.58 1onb h LEU 51 N 0.46 0.56 0.06 1.33 7.12 -0.21 0.16 115.31 124.78 1onb h LEU 51 Ca 0.01 0.03 -0.00 0.00 0.13 0.00 0.00 57.88 58.05 1onb h LEU 51 Cb 1.07 -0.08 0.00 0.00 -0.53 0.00 0.00 40.66 41.13 1onb h LEU 51 CO 0.10 0.36 -0.03 0.00 -0.13 0.00 0.00 178.44 178.74 1onb h ALA 52 N 1.36 -0.07 -0.43 1.25 0.00 -1.52 -2.61 119.26 117.23 1onb h ALA 52 Ca 0.31 -0.22 0.09 0.00 0.00 0.00 0.00 54.91 55.08 1onb h ALA 52 Cb 0.20 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 1onb h ALA 52 CO -0.19 -0.31 0.30 0.00 0.00 0.00 0.00 179.25 179.04 1onb h ALA 53 N 0.37 2.14 -0.24 0.00 0.00 -1.30 -0.88 119.26 119.35 1onb h ALA 53 Ca -0.01 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 1onb h ALA 53 Cb 0.47 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 1onb h ALA 53 CO 0.01 -0.24 0.11 -0.22 0.00 0.00 0.00 179.25 178.91 1onb h LYS 54 N 0.20 0.36 -0.81 0.00 1.63 -0.48 -2.89 116.57 114.58 1onb h LYS 54 Ca 0.20 -0.06 -0.01 0.00 -0.85 0.00 0.00 60.65 59.93 1onb h LYS 54 Cb 0.53 -0.06 -0.04 0.00 -0.60 0.00 0.00 32.23 32.06 1onb h LYS 54 CO -0.03 0.38 0.48 -0.07 -3.45 0.00 0.00 179.45 176.76 1onb h LEU 55 N 0.25 0.98 -1.61 5.20 4.07 -0.80 -1.47 115.31 121.94 1onb h LEU 55 Ca 0.08 -0.07 0.10 0.00 0.08 0.00 0.00 57.88 58.07 1onb h LEU 55 Cb 0.15 -0.25 -0.04 0.00 1.08 0.00 0.00 40.66 41.60 1onb h LEU 55 CO -0.01 0.76 0.41 0.58 -1.08 0.00 0.00 178.44 179.11 1onb h VAL 56 N 1.12 0.90 -0.00 1.22 2.07 -0.82 0.26 116.25 120.99 1onb h VAL 56 Ca 0.29 -0.15 -0.21 0.00 0.82 0.00 0.00 66.70 67.45 1onb h VAL 56 Cb -0.03 0.42 -0.00 0.00 -1.52 0.00 0.00 31.29 30.16 1onb h VAL 56 CO -0.05 0.08 -0.91 0.00 0.02 0.00 0.00 177.57 176.71 1onb h ALA 57 N 1.69 0.43 0.00 1.67 0.00 -1.12 -3.15 119.26 118.78 1onb h ALA 57 Ca 0.28 -0.70 -0.07 0.00 0.00 0.00 0.00 54.91 54.42 1onb h ALA 57 Cb 0.53 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 1onb h ALA 57 CO -0.08 0.84 -0.32 -0.07 0.00 0.00 0.00 179.25 179.62 1onb h LEU 58 N 0.20 0.00 0.00 0.00 -0.00 -0.43 -3.46 115.31 111.62 1onb h LEU 58 Ca -0.07 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.81 1onb h LEU 58 Cb 1.53 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 42.19 1onb h LEU 58 CO 0.15 0.32 0.00 0.61 -0.00 0.00 0.00 178.44 179.52 1onb n GLY 59 N 0.12 1.41 3.66 0.83 0.00 -0.31 -5.10 105.19 105.80 1onb n GLY 59 Ca -0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 1onb n GLY 59 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1onb s ILE 60 N -1.97 4.07 -0.51 -0.61 1.01 0.77 -4.97 121.20 119.00 1onb s ILE 60 Ca 0.00 -0.57 -0.22 0.00 0.00 0.00 0.00 60.65 59.86 1onb s ILE 60 Cb 0.00 -2.79 0.04 0.00 0.01 0.00 0.00 42.46 39.73 1onb s ILE 60 CO 0.00 0.42 0.77 0.21 0.00 0.00 0.00 174.94 176.35 1onb s ASN 61 N -1.40 6.31 0.07 3.58 2.47 -1.06 -1.52 114.94 123.39 1onb s ASN 61 Ca 0.18 -0.52 0.10 0.00 0.42 0.00 0.00 52.86 53.04 1onb s ASN 61 Cb -0.11 -2.36 -0.03 0.00 -1.45 0.00 0.00 41.25 37.29 1onb s ASN 61 CO 0.08 -1.01 -0.26 0.00 -3.72 0.00 0.00 177.10 172.19 1onb s ALA 62 N 3.26 2.33 0.06 1.71 0.00 -1.26 0.10 121.76 127.95 1onb s ALA 62 Ca 0.24 -1.32 0.05 0.00 0.00 0.00 0.00 51.96 50.93 1onb s ALA 62 Cb -0.15 -0.48 -0.03 0.00 0.00 0.00 0.00 23.12 22.46 1onb s ALA 62 CO 0.17 0.54 -0.13 0.08 0.00 0.00 0.00 175.76 176.42 1onb s VAL 63 N -0.89 1.00 -0.15 0.00 1.01 -0.78 -4.61 120.40 115.98 1onb s VAL 63 Ca 0.13 -1.21 -0.01 0.00 0.00 0.00 0.00 61.98 60.88 1onb s VAL 63 Cb -0.10 -0.97 -0.01 0.00 0.00 0.00 0.00 36.38 35.30 1onb s VAL 63 CO 0.03 -0.22 -0.11 0.00 0.00 0.00 0.00 175.10 174.80 1onb s ALA 64 N -1.23 2.68 -0.06 5.51 0.00 -1.26 -0.02 121.76 127.38 1onb s ALA 64 Ca -0.03 -0.93 0.06 0.00 0.00 0.00 0.00 51.96 51.06 1onb s ALA 64 Cb -0.10 -1.32 -0.01 0.00 0.00 0.00 0.00 23.12 21.70 1onb s ALA 64 CO 0.02 0.13 -0.25 -0.47 0.00 0.00 0.00 175.76 175.19 1onb s TYR 65 N 0.53 2.45 0.17 0.00 5.04 -1.05 -4.85 117.35 119.65 1onb s TYR 65 Ca -0.07 -0.76 -0.18 0.00 -2.44 0.00 0.00 57.07 53.62 1onb s TYR 65 Cb -0.15 -1.61 0.06 0.00 0.35 0.00 0.00 41.96 40.61 1onb s TYR 65 CO 0.04 -0.24 0.85 2.48 -1.34 0.00 0.00 175.55 177.33 1onb n TYR 66 N 3.01 -1.32 -1.64 4.97 0.18 -1.26 -2.86 117.16 118.25 1onb n TYR 66 Ca -0.18 -1.11 -0.44 0.00 1.88 0.00 0.00 57.90 58.05 1onb n TYR 66 Cb 0.52 0.54 -0.04 0.00 -0.38 0.00 0.00 39.34 39.99 1onb n TYR 66 CO 0.00 0.00 0.00 -2.13 -2.08 0.00 0.00 176.86 172.65 1onb n ARG 67 N -0.59 2.35 -1.19 -3.48 3.00 -1.26 -1.90 116.66 113.58 1onb n ARG 67 Ca -0.02 0.81 0.00 0.00 -0.00 0.00 0.00 57.85 58.63 1onb n ARG 67 Cb 0.49 -2.94 0.00 0.00 0.00 0.00 0.00 32.46 30.00 1onb n ARG 67 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1onb n GLY 68 N 4.97 1.05 3.50 5.14 0.00 -1.26 -5.09 105.19 113.50 1onb n GLY 68 Ca 0.25 -0.39 -0.25 0.00 0.00 0.00 0.00 46.02 45.62 1onb n GLY 68 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1onb s LEU 69 N -0.32 2.72 0.09 0.99 1.98 -0.80 -5.13 118.68 118.21 1onb s LEU 69 Ca 0.00 -0.82 -0.03 0.00 -2.89 0.00 0.00 54.13 50.39 1onb s LEU 69 Cb 0.00 -1.34 -0.05 0.00 0.66 0.00 0.00 46.19 45.46 1onb s LEU 69 CO 0.00 0.07 0.30 -1.81 -1.89 0.00 0.00 176.35 173.02 1onb s ASP 70 N -3.11 6.45 -0.22 3.68 1.01 -1.26 -4.91 116.67 118.30 1onb s ASP 70 Ca 0.26 0.47 -0.28 0.00 0.71 0.00 0.00 52.55 53.71 1onb s ASP 70 Cb -0.07 -2.05 -0.05 0.00 1.01 0.00 0.00 42.92 41.77 1onb s ASP 70 CO 0.14 0.13 2.07 0.68 0.21 0.00 0.00 175.17 178.40 1onb s VAL 71 N -1.54 3.15 0.00 -1.27 -7.23 -1.26 -4.69 120.40 107.57 1onb s VAL 71 Ca 0.36 0.16 0.00 0.00 -1.81 0.00 0.00 61.98 60.70 1onb s VAL 71 Cb -0.13 -3.19 0.00 0.00 0.56 0.00 0.00 36.38 33.62 1onb s VAL 71 CO 0.24 -0.11 0.00 -1.20 -0.31 0.00 0.00 175.10 173.72 1onb n SER 72 N 10.80 2.24 -4.46 4.85 7.64 -1.26 -5.07 113.62 128.36 1onb n SER 72 Ca 0.27 0.00 -0.37 0.00 1.01 0.00 0.00 58.87 59.77 1onb n SER 72 Cb 0.45 0.14 0.05 0.00 -1.01 0.00 0.00 64.21 63.84 1onb n SER 72 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 1onb n VAL 73 N -1.57 2.03 -3.75 0.44 0.31 -1.26 -4.97 118.33 109.56 1onb n VAL 73 Ca 0.00 -0.46 -0.30 0.00 -0.01 0.00 0.00 64.34 63.58 1onb n VAL 73 Cb 0.25 -0.70 -0.15 0.00 -0.91 0.00 0.00 33.84 32.33 1onb n VAL 73 CO 0.00 0.00 0.00 0.27 -1.32 0.00 0.00 176.83 175.78 1onb s ILE 74 N -1.80 0.95 -1.55 2.52 -4.36 -1.26 -5.01 121.20 110.68 1onb s ILE 74 Ca 0.67 -1.43 -0.09 0.00 -0.26 0.00 0.00 60.65 59.54 1onb s ILE 74 Cb -0.40 -1.71 -0.06 0.00 1.25 0.00 0.00 42.46 41.54 1onb s ILE 74 CO 0.56 -0.66 2.88 -0.81 0.24 0.00 0.00 174.94 177.16 1onb n PRO 75 N 4.82 3.83 -3.16 0.37 -0.04 -1.26 -4.54 135.00 135.02 1onb n PRO 75 Ca -0.02 -2.39 -0.21 0.00 -0.04 0.00 0.00 63.50 60.84 1onb n PRO 75 Cb 0.42 -2.76 -0.04 0.00 -0.04 0.00 0.00 33.50 31.08 1onb n PRO 75 CO 0.00 0.00 0.00 -2.37 -0.04 0.00 0.00 175.50 173.09 1onb n THR 76 N 3.25 0.40 -4.86 0.52 5.66 -1.26 -5.11 114.28 112.89 1onb n THR 76 Ca 0.76 -4.70 0.00 0.00 -3.05 0.00 0.00 64.05 57.06 1onb n THR 76 Cb 0.24 -0.76 0.00 0.00 -1.55 0.00 0.00 70.33 68.26 1onb n THR 76 CO 0.00 0.00 0.00 0.59 -3.05 0.00 0.00 175.07 172.61 1onb n ASN 77 N 0.37 -1.07 -1.31 1.09 4.13 -1.26 -5.01 115.26 112.20 1onb n ASN 77 Ca 0.26 0.00 0.02 0.00 1.68 0.00 0.00 54.58 56.54 1onb n ASN 77 Cb 0.59 0.00 -0.01 0.00 -1.54 0.00 0.00 39.78 38.82 1onb n ASN 77 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1onb n GLY 78 N 0.00 -3.80 3.55 7.41 0.00 -1.26 -4.48 105.19 106.62 1onb n GLY 78 Ca 0.00 -0.95 -0.41 0.00 0.00 0.00 0.00 46.02 44.66 1onb n GLY 78 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1onb s ASP 79 N -5.25 6.37 -0.11 1.61 1.11 -1.26 -4.67 116.67 114.47 1onb s ASP 79 Ca 0.00 -1.07 0.02 0.00 0.18 0.00 0.00 52.55 51.68 1onb s ASP 79 Cb 0.00 -2.56 -0.01 0.00 1.07 0.00 0.00 42.92 41.42 1onb s ASP 79 CO 0.00 -1.62 -0.19 0.54 1.18 0.00 0.00 175.17 175.08 1onb s VAL 80 N 5.19 2.52 -0.20 -1.27 0.11 -1.23 -2.55 120.40 122.96 1onb s VAL 80 Ca 0.41 -0.86 -0.03 0.00 -2.93 0.00 0.00 61.98 58.57 1onb s VAL 80 Cb -0.04 -2.00 -0.01 0.00 -1.53 0.00 0.00 36.38 32.80 1onb s VAL 80 CO 0.00 0.55 -0.07 0.68 -3.33 0.00 0.00 175.10 172.93 1onb s VAL 81 N 0.23 3.21 -0.29 2.04 -7.23 0.12 -2.78 120.40 115.70 1onb s VAL 81 Ca -0.12 -0.55 -0.14 0.00 -1.81 0.00 0.00 61.98 59.35 1onb s VAL 81 Cb -0.16 -2.44 -0.03 0.00 0.56 0.00 0.00 36.38 34.31 1onb s VAL 81 CO 0.07 0.45 0.34 -0.69 -0.31 0.00 0.00 175.10 174.96 1onb s VAL 82 N 1.31 5.19 -0.44 1.32 1.01 0.19 -1.87 120.40 127.10 1onb s VAL 82 Ca 0.04 0.35 -0.07 0.00 0.00 0.00 0.00 61.98 62.30 1onb s VAL 82 Cb -0.14 -3.71 0.11 0.00 0.00 0.00 0.00 36.38 32.64 1onb s VAL 82 CO -0.03 0.09 0.28 0.68 0.00 0.00 0.00 175.10 176.12 1onb s VAL 83 N 2.01 3.83 0.09 2.92 -7.23 0.97 0.15 120.40 123.14 1onb s VAL 83 Ca 0.13 -1.87 -0.04 0.00 -1.81 0.00 0.00 61.98 58.38 1onb s VAL 83 Cb -0.16 -3.55 -0.02 0.00 0.56 0.00 0.00 36.38 33.21 1onb s VAL 83 CO 0.11 -0.72 0.09 0.00 -0.31 0.00 0.00 175.10 174.26 1onb s ALA 84 N 1.27 0.29 0.00 1.32 0.00 0.64 -2.54 121.76 122.75 1onb s ALA 84 Ca 0.06 -1.04 0.00 0.00 0.00 0.00 0.00 51.96 50.98 1onb s ALA 84 Cb -0.25 0.51 0.00 0.00 0.00 0.00 0.00 23.12 23.39 1onb s ALA 84 CO -0.02 -0.47 0.00 -2.37 0.00 0.00 0.00 175.76 172.90 1onb n THR 85 N -0.02 0.00 0.71 0.00 5.66 -1.13 -2.95 114.28 116.54 1onb n THR 85 Ca -0.12 0.00 0.13 0.00 -3.05 0.00 0.00 64.05 61.01 1onb n THR 85 Cb 0.62 0.00 0.38 0.00 -1.55 0.00 0.00 70.33 69.78 1onb n THR 85 CO 0.00 0.00 0.00 0.47 -3.05 0.00 0.00 175.07 172.49 1onb n ASP 86 N 0.00 0.62 -0.31 1.09 9.92 -1.26 -3.83 116.55 122.79 1onb n ASP 86 Ca 0.00 0.41 0.07 0.00 -0.53 0.00 0.00 54.79 54.74 1onb n ASP 86 Cb 0.00 -0.46 0.23 0.00 -0.64 0.00 0.00 41.12 40.25 1onb n ASP 86 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1onb h ALA 87 N 2.64 1.34 -0.16 2.24 0.00 -1.91 -1.49 119.26 121.92 1onb h ALA 87 Ca 0.00 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 1onb h ALA 87 Cb 0.68 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 1onb h ALA 87 CO 0.00 -0.03 0.05 1.25 0.00 0.00 0.00 179.25 180.52 1onb h LEU 88 N 0.70 0.23 1.10 0.00 5.85 -1.81 -3.46 115.31 117.93 1onb h LEU 88 Ca 0.47 -0.21 -0.31 0.00 0.84 0.00 0.00 57.88 58.68 1onb h LEU 88 Cb 0.64 -0.06 -0.11 0.00 0.37 0.00 0.00 40.66 41.49 1onb h LEU 88 CO -0.34 0.38 -0.28 0.23 -0.34 0.00 0.00 178.44 178.08 1onb n MET 89 N -4.83 -1.37 -3.92 1.25 2.81 -0.56 -2.34 117.12 108.15 1onb n MET 89 Ca -0.05 0.87 -0.31 0.00 -1.81 0.00 0.00 57.70 56.40 1onb n MET 89 Cb 0.15 -5.17 -0.00 0.00 -0.71 0.00 0.00 33.22 27.48 1onb n MET 89 CO 0.00 0.00 0.00 2.41 1.51 0.00 0.00 175.97 179.89 1onb n THR 90 N -2.08 -3.72 0.07 2.03 -1.04 -1.26 -4.90 114.28 103.37 1onb n THR 90 Ca -0.15 -0.67 -0.03 0.00 -2.04 0.00 0.00 64.05 61.16 1onb n THR 90 Cb 0.50 -2.99 -0.01 0.00 -1.82 0.00 0.00 70.33 66.00 1onb n THR 90 CO 0.00 0.00 0.00 1.23 -0.64 0.00 0.00 175.07 175.66 1onb h GLY 91 N -1.98 -0.20 -2.80 3.41 0.00 -1.84 -3.24 103.07 96.43 1onb h GLY 91 Ca -0.66 0.07 -0.06 0.00 0.00 0.00 0.00 47.33 46.69 1onb h GLY 91 CO 0.57 -0.07 0.07 1.97 0.00 0.00 0.00 176.54 179.08 1onb n PHE 92 N -2.70 1.49 -3.77 5.60 1.16 -1.26 -4.89 117.46 113.08 1onb n PHE 92 Ca -0.02 -0.63 0.00 0.00 -1.87 0.00 0.00 57.45 54.92 1onb n PHE 92 Cb 0.08 -0.43 0.00 0.00 -1.61 0.00 0.00 39.48 37.51 1onb n PHE 92 CO 0.00 0.00 0.00 0.25 -1.87 0.00 0.00 176.76 175.14 1onb n THR 93 N 0.24 0.00 0.00 1.97 -2.24 -1.22 -4.98 114.28 108.05 1onb n THR 93 Ca 0.22 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 62.00 1onb n THR 93 Cb 0.95 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 69.18 1onb n THR 93 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1onb n GLY 94 N 3.01 2.33 3.47 3.38 0.00 -1.26 -4.88 105.19 111.24 1onb n GLY 94 Ca 0.00 -0.27 -0.43 0.00 0.00 0.00 0.00 46.02 45.32 1onb n GLY 94 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1onb s ASP 95 N 0.00 6.28 0.14 1.61 -4.77 -1.26 -4.33 116.67 114.35 1onb s ASP 95 Ca 0.00 -1.19 0.09 0.00 -3.30 0.00 0.00 52.55 48.15 1onb s ASP 95 Cb 0.00 -2.43 -0.04 0.00 -1.09 0.00 0.00 42.92 39.35 1onb s ASP 95 CO 0.00 -1.40 -0.18 -0.36 0.70 0.00 0.00 175.17 173.94 1onb s PHE 96 N 3.96 2.51 0.28 2.11 0.08 -0.91 -5.02 117.98 120.99 1onb s PHE 96 Ca 0.27 -0.27 0.05 0.00 0.12 0.00 0.00 56.93 57.09 1onb s PHE 96 Cb -0.13 -1.29 0.39 0.00 -0.57 0.00 0.00 43.02 41.42 1onb s PHE 96 CO 0.05 0.43 1.66 -0.44 -0.10 0.00 0.00 175.22 176.83 1onb h ASP 97 N 3.46 0.30 -4.97 1.36 5.19 -1.73 -3.36 116.42 116.68 1onb h ASP 97 Ca -0.49 -0.13 0.05 0.00 -0.62 0.00 0.00 57.03 55.84 1onb h ASP 97 Cb 1.18 -0.09 -0.11 0.00 0.18 0.00 0.00 39.33 40.50 1onb h ASP 97 CO 0.48 0.71 0.31 -0.94 -3.12 0.00 0.00 179.24 176.68 1onb s SER 98 N -6.88 -0.41 -0.18 6.45 1.04 -1.26 -2.42 113.70 110.05 1onb s SER 98 Ca -0.05 -0.19 -0.01 0.00 0.48 0.00 0.00 55.95 56.18 1onb s SER 98 Cb 0.13 0.57 0.05 0.00 0.10 0.00 0.00 66.02 66.87 1onb s SER 98 CO 0.78 -0.97 -0.02 0.68 0.98 0.00 0.00 173.24 174.69 1onb s VAL 99 N -3.60 0.93 -0.34 5.02 -7.23 -0.95 -2.63 120.40 111.60 1onb s VAL 99 Ca 0.06 -0.65 -0.17 0.00 -1.81 0.00 0.00 61.98 59.41 1onb s VAL 99 Cb -0.02 -1.23 -0.01 0.00 0.56 0.00 0.00 36.38 35.68 1onb s VAL 99 CO -0.06 -0.01 0.47 -0.63 -0.31 0.00 0.00 175.10 174.57 1onb s ILE 100 N 1.69 5.06 0.20 -0.62 1.09 -1.10 -1.33 121.20 126.20 1onb s ILE 100 Ca -0.01 0.30 0.06 0.00 -1.10 0.00 0.00 60.65 59.91 1onb s ILE 100 Cb -0.16 -3.92 -0.05 0.00 -1.06 0.00 0.00 42.46 37.27 1onb s ILE 100 CO -0.07 -0.17 -0.11 -0.62 -0.10 0.00 0.00 174.94 173.87 1onb s ASP 101 N 1.74 2.36 0.00 3.58 -1.08 -0.00 -1.21 116.67 122.06 1onb s ASP 101 Ca 0.17 -1.06 0.25 0.00 -0.52 0.00 0.00 52.55 51.39 1onb s ASP 101 Cb -0.16 -0.10 0.48 0.00 -1.46 0.00 0.00 42.92 41.69 1onb s ASP 101 CO 0.13 -0.26 1.40 0.00 0.52 0.00 0.00 175.17 176.95 1onb n ASN 103 N -1.34 -5.05 -3.52 0.00 4.13 -1.26 -3.59 115.26 104.63 1onb n ASN 103 Ca 0.07 0.17 -0.20 0.00 1.68 0.00 0.00 54.58 56.30 1onb n ASN 103 Cb 0.34 -3.55 -0.14 0.00 -1.54 0.00 0.00 39.78 34.89 1onb n ASN 103 CO 0.00 0.00 0.00 -0.89 0.28 0.00 0.00 177.26 176.65 1onb s THR 104 N -1.49 -0.27 -0.09 3.41 2.01 -1.26 -0.35 115.64 117.59 1onb s THR 104 Ca 0.00 -0.13 -0.23 0.00 0.31 0.00 0.00 61.69 61.64 1onb s THR 104 Cb 0.00 -0.66 -0.03 0.00 0.01 0.00 0.00 72.50 71.82 1onb s THR 104 CO 0.00 -0.23 0.70 -0.94 -0.69 0.00 0.00 174.62 173.46 1onb s SER 105 N 2.29 6.94 -1.39 3.53 1.04 0.53 -4.01 113.70 122.63 1onb s SER 105 Ca 0.06 1.14 -0.06 0.00 0.48 0.00 0.00 55.95 57.57 1onb s SER 105 Cb -0.16 -2.41 0.03 0.00 0.10 0.00 0.00 66.02 63.59 1onb s SER 105 CO -0.12 -0.15 0.44 -0.67 0.98 0.00 0.00 173.24 173.73 1onb n ASP 106 N 4.03 -4.80 0.00 7.02 -0.08 -1.26 -0.18 116.55 121.29 1onb n ASP 106 Ca -0.01 -0.25 0.00 0.00 -1.51 0.00 0.00 54.79 53.02 1onb n ASP 106 Cb 0.51 -3.94 0.00 0.00 2.34 0.00 0.00 41.12 40.03 1onb n ASP 106 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1onb n GLY 107 N -1.25 2.58 3.94 0.27 0.00 -1.26 -5.01 105.19 104.46 1onb n GLY 107 Ca -0.08 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.69 1onb n GLY 107 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1onb s LYS 108 N -0.33 3.48 0.14 1.61 1.02 0.75 -5.01 119.74 121.39 1onb s LYS 108 Ca 0.00 -0.50 -0.31 0.00 0.02 0.00 0.00 55.97 55.17 1onb s LYS 108 Cb 0.00 -2.86 -0.10 0.00 -0.52 0.00 0.00 37.83 34.35 1onb s LYS 108 CO 0.00 0.41 1.70 -1.25 -0.92 0.00 0.00 175.35 175.28 1onb s PRO 109 N -3.58 4.17 0.87 -1.68 0.04 -1.26 0.20 135.00 133.76 1onb s PRO 109 Ca 0.37 2.47 -0.16 0.00 0.04 0.00 0.00 61.00 63.71 1onb s PRO 109 Cb -0.10 -3.38 -0.09 0.00 0.04 0.00 0.00 34.50 30.96 1onb s PRO 109 CO 0.30 -0.74 -0.22 0.94 0.04 0.00 0.00 177.00 177.32 1onb n GLN 110 N 4.90 -0.01 -1.45 4.56 -0.06 0.53 -4.52 117.38 121.33 1onb n GLN 110 Ca 0.16 0.01 -0.30 0.00 -2.00 0.00 0.00 57.00 54.87 1onb n GLN 110 Cb 0.38 -1.32 0.09 0.00 -4.06 0.00 0.00 30.24 25.33 1onb n GLN 110 CO 0.00 0.00 0.00 0.16 -0.20 0.00 0.00 177.06 177.02 1onb s ASP 111 N -1.29 4.61 0.21 1.69 -4.77 -1.26 -4.93 116.67 110.93 1onb s ASP 111 Ca 0.50 1.52 -0.09 0.00 -3.30 0.00 0.00 52.55 51.18 1onb s ASP 111 Cb -0.26 -2.29 0.19 0.00 -1.09 0.00 0.00 42.92 39.47 1onb s ASP 111 CO 0.73 -1.92 1.87 0.00 0.70 0.00 0.00 175.17 176.54 1onb h ALA 112 N -1.05 0.98 -0.02 2.11 0.00 -1.97 -2.93 119.26 116.38 1onb h ALA 112 Ca -0.46 -0.04 -0.14 0.00 0.00 0.00 0.00 54.91 54.28 1onb h ALA 112 Cb 1.25 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.75 1onb h ALA 112 CO 0.56 0.32 -0.63 -0.39 0.00 0.00 0.00 179.25 179.10 1onb h VAL 113 N 0.97 1.44 0.01 0.00 -1.51 -1.98 -3.04 116.25 112.13 1onb h VAL 113 Ca 0.29 -2.14 0.03 0.00 -1.23 0.00 0.00 66.70 63.66 1onb h VAL 113 Cb -0.04 2.14 -0.05 0.00 -2.13 0.00 0.00 31.29 31.21 1onb h VAL 113 CO -0.09 0.62 -0.34 0.77 -1.23 0.00 0.00 177.57 177.29 1onb h SER 114 N 0.05 -1.02 -0.31 4.19 4.64 -1.89 1.53 113.55 120.74 1onb h SER 114 Ca -0.01 0.13 -0.04 0.00 -0.47 0.00 0.00 61.79 61.41 1onb h SER 114 Cb 1.13 0.41 -0.02 0.00 -0.31 0.00 0.00 62.40 63.61 1onb h SER 114 CO 0.09 -0.40 0.09 0.08 -0.87 0.00 0.00 176.83 175.82 1onb h ARG 115 N -0.50 0.57 0.07 4.77 0.11 -1.67 2.07 114.38 119.80 1onb h ARG 115 Ca 0.06 -0.10 -0.00 0.00 0.10 0.00 0.00 59.98 60.04 1onb h ARG 115 Cb 0.58 -0.10 0.00 0.00 1.11 0.00 0.00 29.97 31.57 1onb h ARG 115 CO -0.27 0.53 -0.03 1.15 0.10 0.00 0.00 179.97 181.45 1onb h THR 116 N 0.56 0.98 -0.04 0.08 2.02 -0.74 0.94 112.91 116.71 1onb h THR 116 Ca 0.13 -0.16 -0.07 0.00 0.77 0.00 0.00 66.41 67.07 1onb h THR 116 Cb 0.22 1.09 0.00 0.00 -1.74 0.00 0.00 68.15 67.73 1onb h THR 116 CO -0.00 0.04 -0.26 -0.61 0.37 0.00 0.00 175.52 175.06 1onb h GLN 117 N -0.16 0.25 -0.50 6.66 4.15 0.26 -2.61 115.11 123.16 1onb h GLN 117 Ca -0.01 -0.21 0.01 0.00 0.77 0.00 0.00 58.65 59.21 1onb h GLN 117 Cb 0.14 0.05 -0.03 0.00 0.21 0.00 0.00 27.48 27.85 1onb h GLN 117 CO 0.01 0.87 0.32 0.00 -1.93 0.00 0.00 178.83 178.11 1onb h ARG 118 N -0.32 0.63 -0.39 1.69 3.08 0.34 -1.99 114.38 117.44 1onb h ARG 118 Ca -0.02 -0.04 -0.03 0.00 0.07 0.00 0.00 59.98 59.96 1onb h ARG 118 Cb 0.93 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 30.82 1onb h ARG 118 CO 0.05 0.42 0.10 -0.09 -1.07 0.00 0.00 179.97 179.38 1onb h ARG 119 N 0.65 0.56 0.00 0.04 2.43 0.85 -1.49 114.38 117.43 1onb h ARG 119 Ca 0.19 -0.09 0.00 0.00 -0.81 0.00 0.00 59.98 59.27 1onb h ARG 119 Cb -0.05 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 29.41 1onb h ARG 119 CO -0.06 0.51 0.00 0.41 -1.51 0.00 0.00 179.97 179.32 1onb n GLY 120 N -1.07 -0.61 0.19 2.80 0.00 -0.75 -2.12 105.19 103.64 1onb n GLY 120 Ca 0.02 -0.05 0.13 0.00 0.00 0.00 0.00 46.02 46.13 1onb n GLY 120 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1onb n ARG 121 N -1.27 0.77 -5.19 1.61 3.00 -0.56 -4.78 116.66 110.25 1onb n ARG 121 Ca 0.05 -0.39 -0.31 0.00 -0.01 0.00 0.00 57.85 57.19 1onb n ARG 121 Cb 0.08 -1.49 -0.15 0.00 0.00 0.00 0.00 32.46 30.89 1onb n ARG 121 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.63 177.55 1onb s THR 122 N -2.50 2.28 0.00 0.55 -1.32 -0.90 -2.13 115.64 111.62 1onb s THR 122 Ca 0.26 -1.05 0.00 0.00 -1.21 0.00 0.00 61.69 59.69 1onb s THR 122 Cb 0.20 -1.82 0.00 0.00 -1.51 0.00 0.00 72.50 69.37 1onb s THR 122 CO 0.50 0.56 0.00 0.61 -2.21 0.00 0.00 174.62 174.09 1onb n GLY 123 N 2.35 0.75 3.57 6.08 0.00 -1.26 -4.38 105.19 112.31 1onb n GLY 123 Ca -0.16 -0.42 -0.27 0.00 0.00 0.00 0.00 46.02 45.17 1onb n GLY 123 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1onb s ARG 124 N -0.79 2.49 0.00 1.61 1.81 -1.26 -2.16 118.95 120.65 1onb s ARG 124 Ca 0.00 -0.62 0.00 0.00 -1.72 0.00 0.00 55.73 53.39 1onb s ARG 124 Cb 0.00 -5.13 0.00 0.00 -0.45 0.00 0.00 34.95 29.37 1onb s ARG 124 CO 0.00 -3.68 0.00 0.41 -0.68 0.00 0.00 175.30 171.35 1onb n GLY 125 N 6.43 0.79 1.86 -3.53 0.00 -1.26 -4.94 105.19 104.54 1onb n GLY 125 Ca 0.42 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.42 1onb n GLY 125 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1onb n LYS 126 N -2.08 0.38 -2.77 1.61 2.85 -0.92 -5.10 118.16 112.13 1onb n LYS 126 Ca 0.00 -0.81 -0.43 0.00 -1.05 0.00 0.00 58.31 56.02 1onb n LYS 126 Cb 0.00 1.07 -0.04 0.00 -0.65 0.00 0.00 35.03 35.41 1onb n LYS 126 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 177.40 176.10 1onb s PRO 127 N -2.03 3.27 0.73 -1.58 0.04 -1.26 -4.09 135.00 130.08 1onb s PRO 127 Ca 0.10 -0.37 -0.06 0.00 0.04 0.00 0.00 61.00 60.72 1onb s PRO 127 Cb -0.02 -4.12 0.10 0.00 0.04 0.00 0.00 34.50 30.50 1onb s PRO 127 CO 0.03 -1.70 1.03 0.20 0.04 0.00 0.00 177.00 176.61 1onb s GLY 128 N 3.22 1.74 0.02 0.56 0.00 -0.97 -4.71 107.32 107.19 1onb s GLY 128 Ca 0.30 -1.22 0.08 0.00 0.00 0.00 0.00 44.72 43.88 1onb s GLY 128 CO 0.17 -0.72 -0.24 -0.42 0.00 0.00 0.00 173.10 171.89 1onb s ILE 129 N -3.28 1.88 -0.18 0.90 1.01 -1.02 0.16 121.20 120.69 1onb s ILE 129 Ca 0.64 -1.19 0.00 0.00 0.00 0.00 0.00 60.65 60.10 1onb s ILE 129 Cb -0.08 -1.60 0.04 0.00 0.01 0.00 0.00 42.46 40.83 1onb s ILE 129 CO 0.45 0.37 -0.08 -0.47 0.00 0.00 0.00 174.94 175.22 1onb s TYR 130 N -0.71 1.99 -0.13 3.97 6.14 0.14 -2.24 117.35 126.51 1onb s TYR 130 Ca 0.09 -1.28 -0.04 0.00 0.64 0.00 0.00 57.07 56.48 1onb s TYR 130 Cb -0.09 -1.45 -0.04 0.00 0.42 0.00 0.00 41.96 40.80 1onb s TYR 130 CO 0.01 -0.67 0.03 1.03 0.64 0.00 0.00 175.55 176.59 1onb s ARG 131 N 1.54 3.45 0.02 4.97 0.52 -0.44 -0.38 118.95 128.62 1onb s ARG 131 Ca 0.00 -0.38 0.01 0.00 -0.52 0.00 0.00 55.73 54.85 1onb s ARG 131 Cb -0.15 -2.98 -0.02 0.00 0.52 0.00 0.00 34.95 32.32 1onb s ARG 131 CO -0.08 0.50 -0.06 -0.59 0.02 0.00 0.00 175.30 175.10 1onb s PHE 132 N -0.31 0.48 -0.01 -0.53 -0.12 -1.09 -0.82 117.98 115.58 1onb s PHE 132 Ca 0.07 -0.37 -0.23 0.00 -0.05 0.00 0.00 56.93 56.35 1onb s PHE 132 Cb -0.12 -0.30 -0.15 0.00 -0.63 0.00 0.00 43.02 41.82 1onb s PHE 132 CO 0.02 -0.08 1.04 0.28 -0.05 0.00 0.00 175.22 176.43 1onb h VAL 133 N 4.70 0.60 -2.33 -2.49 2.07 -0.87 -0.48 116.25 117.44 1onb h VAL 133 Ca -0.32 -0.74 -0.61 0.00 0.82 0.00 0.00 66.70 65.85 1onb h VAL 133 Cb 1.20 0.93 -0.14 0.00 -1.52 0.00 0.00 31.29 31.76 1onb h VAL 133 CO 0.44 0.12 -0.75 0.00 0.02 0.00 0.00 177.57 177.40 1onb s ALA 134 N -4.38 2.79 0.08 1.67 0.00 -1.24 -4.59 121.76 116.09 1onb s ALA 134 Ca -0.13 -1.81 0.25 0.00 0.00 0.00 0.00 51.96 50.27 1onb s ALA 134 Cb 0.01 -0.35 0.92 0.00 0.00 0.00 0.00 23.12 23.70 1onb s ALA 134 CO 0.48 0.30 1.82 -1.00 0.00 0.00 0.00 175.76 177.36 1onb h PRO 135 N 2.33 0.00 0.00 0.00 0.13 -1.92 -3.43 132.00 129.11 1onb h PRO 135 Ca -0.41 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.72 1onb h PRO 135 Cb 1.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.38 1onb h PRO 135 CO 0.59 0.19 0.00 0.41 -0.23 0.00 0.00 178.00 178.96 1onb n GLY 136 N 0.24 2.53 0.09 1.56 0.00 -1.26 -4.79 105.19 103.56 1onb n GLY 136 Ca 0.01 -0.78 -0.18 0.00 0.00 0.00 0.00 46.02 45.07 1onb n GLY 136 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1onb h GLU 137 N 0.00 0.05 0.00 1.61 4.81 -1.95 -3.45 114.58 115.65 1onb h GLU 137 Ca 0.00 -0.08 0.00 0.00 -0.13 0.00 0.00 59.36 59.15 1onb h GLU 137 Cb 0.00 0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.41 1onb h GLU 137 CO 0.00 1.04 0.00 -2.13 -0.73 0.00 0.00 179.01 177.19