#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yhi h LYS 3 N 0.00 0.23 0.00 4.33 3.64 -1.93 -3.18 116.57 119.66 1yhi h LYS 3 Ca 0.00 -0.12 -0.01 0.00 -1.27 0.00 0.00 60.65 59.25 1yhi h LYS 3 Cb 0.00 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 31.82 1yhi h LYS 3 CO 0.00 0.65 -0.03 0.78 -2.27 0.00 0.00 179.45 178.58 1yhi h GLY 4 N 1.30 0.00 1.65 5.01 0.00 -1.74 -3.29 103.07 106.01 1yhi h GLY 4 Ca 0.01 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.31 1yhi h GLY 4 CO 0.07 0.00 0.05 -2.09 0.00 0.00 0.00 176.54 174.57 1yhi h GLU 5 N 0.00 0.45 0.00 4.80 4.81 -1.71 -2.94 114.58 119.99 1yhi h GLU 5 Ca -0.00 -0.07 0.00 0.00 -0.13 0.00 0.00 59.36 59.16 1yhi h GLU 5 Cb 0.74 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 30.04 1yhi h GLU 5 CO 0.00 0.44 0.00 -0.85 -0.73 0.00 0.00 179.01 177.87 1yhi n GLU 6 N -4.35 0.17 0.02 1.92 0.28 -1.24 -2.54 120.64 114.91 1yhi n GLU 6 Ca 0.01 0.45 0.14 0.00 -0.16 0.00 0.00 57.16 57.60 1yhi n GLU 6 Cb 0.19 -1.87 0.57 0.00 1.43 0.00 0.00 31.44 31.76 1yhi n GLU 6 CO 0.00 0.00 0.00 1.28 -0.16 0.00 0.00 177.13 178.25 1yhi n LEU 7 N -2.20 0.18 -0.90 -1.84 4.77 -1.11 -3.85 117.00 112.04 1yhi n LEU 7 Ca 0.02 0.52 0.06 0.00 -0.03 0.00 0.00 56.01 56.57 1yhi n LEU 7 Cb 0.19 -0.46 0.24 0.00 -2.33 0.00 0.00 43.42 41.06 1yhi n LEU 7 CO 0.17 -0.05 0.70 0.49 -1.33 0.00 0.00 177.39 177.38 1yhi n PHE 8 N -1.67 0.93 0.70 -1.77 3.01 -1.05 -4.72 117.46 112.89 1yhi n PHE 8 Ca 0.07 -1.02 0.12 0.00 1.01 0.00 0.00 57.45 57.63 1yhi n PHE 8 Cb 0.36 -0.34 0.48 0.00 -0.01 0.00 0.00 39.48 39.96 1yhi n PHE 8 CO 0.00 0.00 0.00 0.25 1.01 0.00 0.00 176.76 178.02 1yhi n THR 9 N -0.68 0.51 -2.53 4.37 -2.24 -1.25 -4.46 114.28 107.99 1yhi n THR 9 Ca 0.23 0.02 0.00 0.00 -2.27 0.00 0.00 64.05 62.04 1yhi n THR 9 Cb 0.91 -0.74 0.00 0.00 -2.10 0.00 0.00 70.33 68.40 1yhi n THR 9 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1yhi n GLY 10 N 0.87 5.71 3.69 3.38 0.00 -1.26 -4.95 105.19 112.63 1yhi n GLY 10 Ca 0.05 -1.50 -0.39 0.00 0.00 0.00 0.00 46.02 44.18 1yhi n GLY 10 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1yhi s VAL 11 N 0.44 5.13 -0.10 1.61 1.01 -1.26 -4.51 120.40 122.71 1yhi s VAL 11 Ca 0.00 1.01 0.03 0.00 0.00 0.00 0.00 61.98 63.02 1yhi s VAL 11 Cb 0.00 -3.86 -0.01 0.00 0.00 0.00 0.00 36.38 32.52 1yhi s VAL 11 CO 0.00 0.23 -0.20 -0.69 0.00 0.00 0.00 175.10 174.44 1yhi s VAL 12 N 1.21 2.45 0.45 2.92 1.01 -0.82 -4.97 120.40 122.66 1yhi s VAL 12 Ca 0.26 -0.89 -0.22 0.00 0.00 0.00 0.00 61.98 61.13 1yhi s VAL 12 Cb -0.15 -1.97 -0.08 0.00 0.00 0.00 0.00 36.38 34.18 1yhi s VAL 12 CO 0.10 0.55 1.09 -2.16 0.00 0.00 0.00 175.10 174.68 1yhi s PRO 13 N 0.23 3.87 0.02 2.72 0.04 -1.26 -1.78 135.00 138.85 1yhi s PRO 13 Ca -0.13 1.56 0.08 0.00 0.04 0.00 0.00 61.00 62.55 1yhi s PRO 13 Cb -0.16 -2.34 -0.02 0.00 0.04 0.00 0.00 34.50 32.02 1yhi s PRO 13 CO 0.07 -0.40 -0.25 0.42 0.04 0.00 0.00 177.00 176.88 1yhi s ILE 14 N -1.72 1.98 -0.04 0.56 1.01 -0.57 -2.32 121.20 120.10 1yhi s ILE 14 Ca 0.63 -1.23 0.01 0.00 0.00 0.00 0.00 60.65 60.06 1yhi s ILE 14 Cb -0.23 -1.68 0.02 0.00 0.01 0.00 0.00 42.46 40.59 1yhi s ILE 14 CO 0.28 0.41 -0.02 -0.22 0.00 0.00 0.00 174.94 175.38 1yhi s LEU 15 N -0.98 1.18 0.02 2.97 0.20 -0.96 -2.55 118.68 118.56 1yhi s LEU 15 Ca 0.10 -0.07 0.05 0.00 0.69 0.00 0.00 54.13 54.90 1yhi s LEU 15 Cb -0.10 -0.33 -0.02 0.00 -0.43 0.00 0.00 46.19 45.32 1yhi s LEU 15 CO 0.01 -0.09 -0.14 -0.69 -0.29 0.00 0.00 176.35 175.15 1yhi s VAL 16 N 1.05 1.13 -0.06 1.68 1.01 -0.81 -1.84 120.40 122.57 1yhi s VAL 16 Ca -0.09 -0.81 -0.02 0.00 0.00 0.00 0.00 61.98 61.05 1yhi s VAL 16 Cb -0.14 -0.98 0.04 0.00 0.00 0.00 0.00 36.38 35.30 1yhi s VAL 16 CO -0.01 0.16 0.12 -0.70 0.00 0.00 0.00 175.10 174.67 1yhi s GLU 17 N -0.75 0.04 0.01 2.72 2.12 -0.82 -1.69 118.70 120.33 1yhi s GLU 17 Ca 0.04 0.36 0.04 0.00 0.36 0.00 0.00 54.97 55.77 1yhi s GLU 17 Cb -0.07 -0.24 -0.01 0.00 0.26 0.00 0.00 34.13 34.07 1yhi s GLU 17 CO 0.00 -0.20 -0.12 -1.17 -0.54 0.00 0.00 175.26 173.23 1yhi s LEU 18 N 1.43 2.08 -0.07 2.70 0.20 -0.69 -1.46 118.68 122.86 1yhi s LEU 18 Ca -0.06 -0.30 0.03 0.00 0.69 0.00 0.00 54.13 54.49 1yhi s LEU 18 Cb -0.12 -0.59 0.01 0.00 -0.43 0.00 0.00 46.19 45.06 1yhi s LEU 18 CO -0.05 0.10 -0.16 -1.81 -0.29 0.00 0.00 176.35 174.14 1yhi s ASP 19 N -0.58 2.22 0.21 3.68 -0.00 -0.99 -1.77 116.67 119.45 1yhi s ASP 19 Ca 0.03 -0.39 -0.00 0.00 -0.00 0.00 0.00 52.55 52.20 1yhi s ASP 19 Cb -0.06 -0.99 -0.04 0.00 -0.00 0.00 0.00 42.92 41.83 1yhi s ASP 19 CO 0.00 0.08 0.11 -0.83 -0.00 0.00 0.00 175.17 174.53 1yhi s GLY 20 N 0.51 1.50 -0.26 0.21 0.00 -0.58 -1.80 107.32 106.90 1yhi s GLY 20 Ca -0.15 -1.74 -0.02 0.00 0.00 0.00 0.00 44.72 42.81 1yhi s GLY 20 CO 0.05 -1.48 0.45 -0.35 0.00 0.00 0.00 173.10 171.78 1yhi s ASP 21 N -3.21 -0.29 -0.20 1.64 3.68 -0.95 -2.35 116.67 114.99 1yhi s ASP 21 Ca 0.37 0.40 0.01 0.00 2.13 0.00 0.00 52.55 55.46 1yhi s ASP 21 Cb 0.07 1.46 0.03 0.00 -1.45 0.00 0.00 42.92 43.03 1yhi s ASP 21 CO 0.11 -0.29 -0.15 -0.69 0.13 0.00 0.00 175.17 174.28 1yhi s VAL 22 N 2.65 1.97 -1.24 1.11 1.01 -0.92 -0.87 120.40 124.11 1yhi s VAL 22 Ca 0.15 -1.11 -0.08 0.00 0.00 0.00 0.00 61.98 60.94 1yhi s VAL 22 Cb -0.15 -1.91 0.06 0.00 0.00 0.00 0.00 36.38 34.38 1yhi s VAL 22 CO -0.18 0.32 0.43 0.59 0.00 0.00 0.00 175.10 176.25 1yhi n ASN 23 N 4.59 -3.76 0.00 3.32 4.13 -1.06 -1.98 115.26 120.51 1yhi n ASN 23 Ca -0.18 -0.30 0.00 0.00 1.68 0.00 0.00 54.58 55.78 1yhi n ASN 23 Cb 0.47 -3.12 0.00 0.00 -1.54 0.00 0.00 39.78 35.59 1yhi n ASN 23 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1yhi n GLY 24 N -1.13 0.22 3.45 7.41 0.00 -1.26 -5.07 105.19 108.81 1yhi n GLY 24 Ca -0.03 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.59 1yhi n GLY 24 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1yhi s HIS 25 N -2.04 3.20 0.11 1.61 3.76 -0.84 -5.10 115.29 115.99 1yhi s HIS 25 Ca 0.00 -0.57 -0.13 0.00 -0.15 0.00 0.00 55.06 54.21 1yhi s HIS 25 Cb 0.00 -2.40 -0.06 0.00 1.11 0.00 0.00 32.58 31.22 1yhi s HIS 25 CO 0.00 -0.48 0.48 0.15 -0.85 0.00 0.00 174.74 174.05 1yhi s LYS 26 N 1.63 3.90 0.23 1.40 1.02 -1.26 -2.16 119.74 124.49 1yhi s LYS 26 Ca 0.04 0.37 -0.16 0.00 0.02 0.00 0.00 55.97 56.24 1yhi s LYS 26 Cb -0.18 -2.98 0.01 0.00 -0.52 0.00 0.00 37.83 34.16 1yhi s LYS 26 CO 0.07 0.53 0.54 -0.59 -0.92 0.00 0.00 175.35 174.98 1yhi s PHE 27 N -1.41 0.07 -0.00 3.18 -0.71 -0.99 -5.01 117.98 113.12 1yhi s PHE 27 Ca 0.35 -0.45 -0.01 0.00 -1.04 0.00 0.00 56.93 55.78 1yhi s PHE 27 Cb -0.15 0.37 -0.00 0.00 -1.21 0.00 0.00 43.02 42.03 1yhi s PHE 27 CO 0.18 -1.02 0.01 -1.12 -1.34 0.00 0.00 175.22 171.94 1yhi s SER 28 N -2.95 0.02 0.01 1.98 0.01 -1.26 -1.53 113.70 109.97 1yhi s SER 28 Ca 0.15 -0.04 0.05 0.00 1.31 0.00 0.00 55.95 57.42 1yhi s SER 28 Cb -0.02 0.05 -0.01 0.00 0.21 0.00 0.00 66.02 66.25 1yhi s SER 28 CO 0.04 -0.05 -0.15 -0.69 0.41 0.00 0.00 173.24 172.80 1yhi s VAL 29 N -0.22 1.17 -0.02 3.43 1.01 -0.73 -1.99 120.40 123.04 1yhi s VAL 29 Ca -0.03 -0.75 0.07 0.00 0.00 0.00 0.00 61.98 61.27 1yhi s VAL 29 Cb -0.02 -1.00 -0.02 0.00 0.00 0.00 0.00 36.38 35.35 1yhi s VAL 29 CO -0.00 0.23 -0.22 -0.55 0.00 0.00 0.00 175.10 174.56 1yhi s SER 30 N -0.60 2.61 0.04 3.32 0.15 -0.74 -1.71 113.70 116.77 1yhi s SER 30 Ca 0.05 -0.40 0.00 0.00 0.70 0.00 0.00 55.95 56.30 1yhi s SER 30 Cb -0.06 -0.33 -0.03 0.00 -1.71 0.00 0.00 66.02 63.89 1yhi s SER 30 CO 0.00 0.27 -0.05 -0.83 1.20 0.00 0.00 173.24 173.83 1yhi s GLY 31 N -0.48 0.43 -0.05 9.45 0.00 -0.68 -1.23 107.32 114.76 1yhi s GLY 31 Ca 0.07 -0.89 -0.17 0.00 0.00 0.00 0.00 44.72 43.74 1yhi s GLY 31 CO -0.00 -0.97 0.38 1.85 0.00 0.00 0.00 173.10 174.36 1yhi s GLU 32 N -2.43 0.68 0.00 2.90 2.12 -1.06 -1.92 118.70 118.98 1yhi s GLU 32 Ca -0.05 0.04 0.00 0.00 0.36 0.00 0.00 54.97 55.32 1yhi s GLU 32 Cb -0.03 0.31 0.00 0.00 0.26 0.00 0.00 34.13 34.66 1yhi s GLU 32 CO -0.03 -0.17 0.00 0.41 -0.54 0.00 0.00 175.26 174.92 1yhi n GLY 33 N 1.59 -0.67 3.23 -1.50 0.00 -1.06 -2.21 105.19 104.57 1yhi n GLY 33 Ca -0.19 -0.46 -0.12 0.00 0.00 0.00 0.00 46.02 45.25 1yhi n GLY 33 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1yhi s GLU 34 N -0.14 0.76 0.01 1.61 -1.05 -0.99 -1.52 118.70 117.39 1yhi s GLU 34 Ca 0.00 -0.48 0.02 0.00 -0.15 0.00 0.00 54.97 54.35 1yhi s GLU 34 Cb 0.00 0.33 -0.01 0.00 -0.44 0.00 0.00 34.13 34.00 1yhi s GLU 34 CO 0.00 -0.23 -0.06 0.20 0.95 0.00 0.00 175.26 176.12 1yhi s GLY 35 N -1.95 0.32 -0.37 -3.83 0.00 -0.73 -2.64 107.32 98.12 1yhi s GLY 35 Ca -0.06 -0.42 0.01 0.00 0.00 0.00 0.00 44.72 44.25 1yhi s GLY 35 CO -0.02 -0.42 0.15 -0.35 0.00 0.00 0.00 173.10 172.46 1yhi s ASP 36 N -0.71 3.94 0.53 1.64 -1.08 -0.66 -1.94 116.67 118.40 1yhi s ASP 36 Ca -0.04 -2.10 0.27 0.00 -0.52 0.00 0.00 52.55 50.17 1yhi s ASP 36 Cb -0.05 -1.01 1.48 0.00 -1.46 0.00 0.00 42.92 41.88 1yhi s ASP 36 CO -0.00 -0.35 2.09 0.00 0.52 0.00 0.00 175.17 177.43 1yhi h ALA 37 N 7.48 1.33 -0.05 3.66 0.00 -1.78 -1.88 119.26 128.01 1yhi h ALA 37 Ca -0.07 -0.10 -0.05 0.00 0.00 0.00 0.00 54.91 54.69 1yhi h ALA 37 Cb 0.98 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.74 1yhi h ALA 37 CO 0.48 0.13 -0.19 1.15 0.00 0.00 0.00 179.25 180.82 1yhi h THR 38 N 0.00 1.17 -0.01 0.00 2.02 -1.89 -3.02 112.91 111.18 1yhi h THR 38 Ca -0.00 -0.78 0.00 0.00 0.77 0.00 0.00 66.41 66.40 1yhi h THR 38 Cb 0.29 1.35 0.00 0.00 -1.74 0.00 0.00 68.15 68.05 1yhi h THR 38 CO 0.01 0.23 -0.01 -1.22 0.37 0.00 0.00 175.52 174.90 1yhi n TYR 39 N -4.27 0.00 -3.68 3.16 4.01 -1.09 -4.99 117.16 110.30 1yhi n TYR 39 Ca -0.02 0.00 -0.25 0.00 -0.16 0.00 0.00 57.90 57.47 1yhi n TYR 39 Cb 0.28 0.00 0.07 0.00 -0.31 0.00 0.00 39.34 39.37 1yhi n TYR 39 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1yhi n GLY 40 N 0.50 -0.53 3.43 2.72 0.00 -0.73 -4.86 105.19 105.72 1yhi n GLY 40 Ca 0.05 0.24 -0.33 0.00 0.00 0.00 0.00 46.02 45.98 1yhi n GLY 40 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1yhi s LYS 41 N -6.37 2.68 -0.00 1.61 2.20 -1.04 -2.03 119.74 116.79 1yhi s LYS 41 Ca 0.59 -0.72 0.01 0.00 -0.36 0.00 0.00 55.97 55.49 1yhi s LYS 41 Cb -0.27 -2.40 -0.00 0.00 -1.51 0.00 0.00 37.83 33.64 1yhi s LYS 41 CO 0.76 0.52 -0.03 -0.51 -0.36 0.00 0.00 175.35 175.72 1yhi s LEU 42 N -0.45 2.01 -0.06 5.43 1.43 -0.98 -1.65 118.68 124.41 1yhi s LEU 42 Ca 0.06 -0.06 -0.01 0.00 -1.03 0.00 0.00 54.13 53.09 1yhi s LEU 42 Cb -0.12 -0.15 0.03 0.00 0.03 0.00 0.00 46.19 45.98 1yhi s LEU 42 CO 0.02 0.03 -0.01 0.42 0.23 0.00 0.00 176.35 177.04 1yhi s THR 43 N -0.09 0.35 0.03 5.49 -4.23 -1.08 -2.27 115.64 113.83 1yhi s THR 43 Ca 0.01 0.08 -0.01 0.00 -1.18 0.00 0.00 61.69 60.58 1yhi s THR 43 Cb -0.01 -0.47 -0.02 0.00 1.34 0.00 0.00 72.50 73.33 1yhi s THR 43 CO -0.00 0.23 -0.01 -0.76 -0.54 0.00 0.00 174.62 173.54 1yhi s LEU 44 N 1.59 2.20 -0.08 4.79 1.43 -0.78 -2.33 118.68 125.49 1yhi s LEU 44 Ca -0.01 -0.59 0.01 0.00 -1.03 0.00 0.00 54.13 52.51 1yhi s LEU 44 Cb -0.13 0.21 0.02 0.00 0.03 0.00 0.00 46.19 46.32 1yhi s LEU 44 CO -0.03 -0.39 -0.09 -0.75 0.23 0.00 0.00 176.35 175.31 1yhi s LYS 45 N -2.11 1.50 -0.07 1.70 2.20 -0.94 -1.40 119.74 120.63 1yhi s LYS 45 Ca -0.10 -0.30 0.02 0.00 -0.36 0.00 0.00 55.97 55.23 1yhi s LYS 45 Cb -0.05 -1.40 -0.03 0.00 -1.51 0.00 0.00 37.83 34.84 1yhi s LYS 45 CO -0.03 -0.11 -0.11 -0.06 -0.36 0.00 0.00 175.35 174.67 1yhi s PHE 46 N 1.15 2.80 -0.04 4.03 0.40 -0.47 -2.58 117.98 123.29 1yhi s PHE 46 Ca -0.06 -0.17 0.03 0.00 -0.60 0.00 0.00 56.93 56.13 1yhi s PHE 46 Cb -0.14 -1.70 0.00 0.00 0.51 0.00 0.00 43.02 41.69 1yhi s PHE 46 CO -0.02 0.17 -0.11 0.42 0.70 0.00 0.00 175.22 176.38 1yhi s ILE 47 N -0.56 0.99 -0.36 0.64 1.01 -0.36 -2.22 121.20 120.34 1yhi s ILE 47 Ca 0.08 -0.46 -0.25 0.00 0.00 0.00 0.00 60.65 60.02 1yhi s ILE 47 Cb -0.12 -0.88 0.01 0.00 0.01 0.00 0.00 42.46 41.49 1yhi s ILE 47 CO 0.02 0.30 0.90 0.00 0.00 0.00 0.00 174.94 176.16 1yhi n THR 49 N 5.89 0.00 0.73 0.00 -2.24 -0.84 -3.97 114.28 113.85 1yhi n THR 49 Ca 0.07 -0.02 0.08 0.00 -2.27 0.00 0.00 64.05 61.91 1yhi n THR 49 Cb 0.48 -0.19 0.03 0.00 -2.10 0.00 0.00 70.33 68.55 1yhi n THR 49 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1yhi n THR 50 N -1.27 0.00 0.00 4.28 -2.24 -1.26 -5.02 114.28 108.78 1yhi n THR 50 Ca 0.10 -0.41 0.00 0.00 -2.27 0.00 0.00 64.05 61.48 1yhi n THR 50 Cb 0.31 1.27 0.00 0.00 -2.10 0.00 0.00 70.33 69.81 1yhi n THR 50 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1yhi n GLY 51 N 1.08 0.48 3.90 3.38 0.00 -1.25 -5.04 105.19 107.73 1yhi n GLY 51 Ca 0.08 -0.97 -0.32 0.00 0.00 0.00 0.00 46.02 44.81 1yhi n GLY 51 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1yhi s LYS 52 N 0.00 3.55 0.02 1.61 1.02 -1.26 -4.59 119.74 120.09 1yhi s LYS 52 Ca 0.00 -0.20 -0.30 0.00 0.02 0.00 0.00 55.97 55.49 1yhi s LYS 52 Cb 0.00 -2.97 -0.04 0.00 -0.52 0.00 0.00 37.83 34.30 1yhi s LYS 52 CO 0.00 0.56 0.97 -1.17 -0.92 0.00 0.00 175.35 174.79 1yhi s LEU 53 N -2.37 4.40 0.00 3.17 2.96 -1.26 -4.97 118.68 120.61 1yhi s LEU 53 Ca 0.35 1.68 0.29 0.00 -0.22 0.00 0.00 54.13 56.23 1yhi s LEU 53 Cb -0.13 -3.57 1.50 0.00 0.50 0.00 0.00 46.19 44.50 1yhi s LEU 53 CO 0.23 -0.21 2.01 -0.81 -1.32 0.00 0.00 176.35 176.25 1yhi n PRO 54 N 3.65 0.49 -4.23 0.98 -0.04 -1.26 -4.86 135.00 129.73 1yhi n PRO 54 Ca 0.05 0.01 -0.14 0.00 -0.04 0.00 0.00 63.50 63.39 1yhi n PRO 54 Cb 0.51 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.37 1yhi n PRO 54 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1yhi s VAL 55 N -2.48 1.09 0.43 0.52 -7.23 -1.26 -4.85 120.40 106.62 1yhi s VAL 55 Ca 0.30 -2.01 -0.24 0.00 -1.81 0.00 0.00 61.98 58.21 1yhi s VAL 55 Cb 0.19 -1.79 -0.08 0.00 0.56 0.00 0.00 36.38 35.27 1yhi s VAL 55 CO 0.42 -0.75 1.20 -2.84 -0.31 0.00 0.00 175.10 172.82 1yhi s PRO 56 N -3.68 3.89 0.25 4.82 0.02 -1.26 -4.97 135.00 134.07 1yhi s PRO 56 Ca 0.15 1.88 -0.04 0.00 0.02 0.00 0.00 61.00 63.01 1yhi s PRO 56 Cb 0.02 -2.57 0.41 0.00 0.02 0.00 0.00 34.50 32.38 1yhi s PRO 56 CO -0.00 -0.47 1.82 -1.49 -0.33 0.00 0.00 177.00 176.53 1yhi h TRP 57 N 2.37 0.91 0.00 6.54 4.06 -1.98 -2.71 115.95 125.15 1yhi h TRP 57 Ca -0.49 0.03 -0.00 0.00 2.06 0.00 0.00 58.89 60.49 1yhi h TRP 57 Cb 1.24 -0.28 -0.00 0.00 -1.00 0.00 0.00 29.16 29.12 1yhi h TRP 57 CO 0.54 0.38 -0.01 -1.35 -3.56 0.00 0.00 178.44 174.44 1yhi h PRO 58 N 0.84 0.00 0.00 0.49 0.11 -1.91 -2.59 132.00 128.94 1yhi h PRO 58 Ca 0.41 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.52 1yhi h PRO 58 Cb 0.35 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.46 1yhi h PRO 58 CO -0.24 0.01 0.00 0.25 -0.21 0.00 0.00 178.00 177.81 1yhi n THR 59 N -3.27 0.72 0.91 -1.15 -2.24 -1.02 -3.04 114.28 105.19 1yhi n THR 59 Ca -0.03 0.08 0.11 0.00 -2.27 0.00 0.00 64.05 61.94 1yhi n THR 59 Cb 0.10 -0.93 0.08 0.00 -2.10 0.00 0.00 70.33 67.49 1yhi n THR 59 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1yhi n LEU 60 N -2.06 2.74 -0.29 3.22 4.77 -0.98 -4.60 117.00 119.81 1yhi n LEU 60 Ca 0.04 -0.98 -0.05 0.00 -0.03 0.00 0.00 56.01 54.98 1yhi n LEU 60 Cb 0.28 0.00 0.08 0.00 -2.33 0.00 0.00 43.42 41.45 1yhi n LEU 60 CO 0.22 0.47 1.07 0.58 -1.33 0.00 0.00 177.39 178.39 1yhi h VAL 61 N 4.11 1.26 -0.06 4.08 2.07 -1.65 -2.61 116.25 123.44 1yhi h VAL 61 Ca 0.00 -0.79 -0.09 0.00 0.82 0.00 0.00 66.70 66.63 1yhi h VAL 61 Cb 0.89 0.29 -0.01 0.00 -1.52 0.00 0.00 31.29 30.94 1yhi h VAL 61 CO 0.00 0.33 -0.40 0.71 0.02 0.00 0.00 177.57 178.23 1yhi h THR 62 N 1.15 1.30 -0.14 2.57 1.35 -1.83 -0.77 112.91 116.56 1yhi h THR 62 Ca 0.27 -1.44 -0.06 0.00 -0.55 0.00 0.00 66.41 64.63 1yhi h THR 62 Cb 0.19 1.70 -0.00 0.00 -1.73 0.00 0.00 68.15 68.31 1yhi h THR 62 CO -0.02 0.42 -0.14 0.74 -0.25 0.00 0.00 175.52 176.26 1yhi h THR 63 N 0.11 1.35 -0.29 6.82 2.02 -1.84 -2.65 112.91 118.44 1yhi h THR 63 Ca 0.01 -1.32 -0.13 0.00 0.77 0.00 0.00 66.41 65.75 1yhi h THR 63 Cb 0.76 1.91 -0.00 0.00 -1.74 0.00 0.00 68.15 69.07 1yhi h THR 63 CO 0.06 0.38 -0.32 -0.26 0.37 0.00 0.00 175.52 175.76 1yhi h PHE 64 N -0.04 0.87 0.00 3.16 0.05 -1.36 -3.29 116.94 116.32 1yhi h PHE 64 Ca 0.02 -0.27 -0.09 0.00 3.82 0.00 0.00 57.97 61.45 1yhi h PHE 64 Cb 0.68 -0.18 -0.01 0.00 2.00 0.00 0.00 35.95 38.44 1yhi h PHE 64 CO 0.09 1.02 -0.44 0.00 -0.18 0.00 0.00 178.31 178.80 1yhi h ALA 65 N 0.70 1.15 -0.29 2.45 0.00 -1.23 -3.18 119.26 118.86 1yhi h ALA 65 Ca 0.04 -0.40 -0.07 0.00 0.00 0.00 0.00 54.91 54.48 1yhi h ALA 65 Cb 0.89 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.60 1yhi h ALA 65 CO 0.08 0.55 -0.14 0.77 0.00 0.00 0.00 179.25 180.51 1yhi h SER 66 N 0.00 0.48 0.72 0.00 0.02 -1.53 -2.94 113.55 110.30 1yhi h SER 66 Ca -0.00 -0.13 0.00 0.00 -0.84 0.00 0.00 61.79 60.82 1yhi h SER 66 Cb 0.84 -0.13 0.00 0.00 0.14 0.00 0.00 62.40 63.25 1yhi h SER 66 CO 0.06 0.65 0.00 0.61 -1.14 0.00 0.00 176.83 177.01 1yhi n GLY 67 N -0.61 -1.22 0.75 -3.77 0.00 -1.20 -3.16 105.19 95.98 1yhi n GLY 67 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.06 1yhi n GLY 67 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1yhi n VAL 68 N -1.86 2.29 0.37 1.61 0.24 -1.11 -4.73 118.33 115.15 1yhi n VAL 68 Ca 0.03 -2.83 0.07 0.00 -2.04 0.00 0.00 64.34 59.57 1yhi n VAL 68 Cb 0.23 -0.27 0.31 0.00 -1.47 0.00 0.00 33.84 32.64 1yhi n VAL 68 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1yhi n GLN 69 N -1.12 0.05 0.11 7.34 6.02 -1.19 -2.46 117.38 126.13 1yhi n GLN 69 Ca 0.24 0.35 0.12 0.00 -0.01 0.00 0.00 57.00 57.69 1yhi n GLN 69 Cb 0.82 -1.60 0.46 0.00 1.02 0.00 0.00 30.24 30.95 1yhi n GLN 69 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1yhi n PHE 71 N -2.17 0.75 -2.28 0.00 3.72 -1.03 -4.80 117.46 111.65 1yhi n PHE 71 Ca 0.03 -0.34 -0.37 0.00 -0.05 0.00 0.00 57.45 56.72 1yhi n PHE 71 Cb 0.27 -0.06 -0.01 0.00 -0.94 0.00 0.00 39.48 38.74 1yhi n PHE 71 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 176.76 175.59 1yhi s SER 72 N -0.92 6.13 -0.37 4.37 0.01 -1.16 -4.34 113.70 117.42 1yhi s SER 72 Ca 0.33 2.25 -0.19 0.00 1.31 0.00 0.00 55.95 59.65 1yhi s SER 72 Cb 0.18 -2.60 0.00 0.00 0.21 0.00 0.00 66.02 63.82 1yhi s SER 72 CO 0.20 -0.94 0.54 -0.60 0.41 0.00 0.00 173.24 172.85 1yhi s ARG 73 N -2.81 3.55 -0.25 12.44 3.52 -1.09 -4.88 118.95 129.41 1yhi s ARG 73 Ca 0.65 -0.20 -0.10 0.00 -0.13 0.00 0.00 55.73 55.95 1yhi s ARG 73 Cb -0.27 -3.84 -0.05 0.00 -1.56 0.00 0.00 34.95 29.23 1yhi s ARG 73 CO 0.32 -0.72 0.16 0.71 -0.81 0.00 0.00 175.30 174.97 1yhi s TYR 74 N 2.48 3.27 0.81 5.12 1.51 -1.26 -2.14 117.35 127.13 1yhi s TYR 74 Ca 0.20 0.15 -0.12 0.00 -1.01 0.00 0.00 57.07 56.28 1yhi s TYR 74 Cb -0.15 -2.30 0.09 0.00 -0.11 0.00 0.00 41.96 39.48 1yhi s TYR 74 CO 0.14 -0.04 1.16 -2.14 -1.11 0.00 0.00 175.55 173.57 1yhi s PRO 75 N 1.32 1.68 0.27 -1.71 0.02 -1.26 -4.75 135.00 130.57 1yhi s PRO 75 Ca 0.07 1.58 0.00 0.00 0.02 0.00 0.00 61.00 62.68 1yhi s PRO 75 Cb -0.14 -1.80 0.60 0.00 0.02 0.00 0.00 34.50 33.17 1yhi s PRO 75 CO 0.07 -2.15 1.72 0.22 -0.33 0.00 0.00 177.00 176.53 1yhi h ASP 76 N -1.09 0.34 0.34 2.53 3.58 -2.01 -0.79 116.42 119.31 1yhi h ASP 76 Ca -0.45 0.13 0.00 0.00 0.42 0.00 0.00 57.03 57.13 1yhi h ASP 76 Cb 1.27 0.10 0.00 0.00 1.72 0.00 0.00 39.33 42.42 1yhi h ASP 76 CO 0.46 0.07 0.00 0.00 -2.88 0.00 0.00 179.24 176.90 1yhi n HIS 77 N -5.00 0.00 0.01 0.28 1.44 -1.26 -3.11 115.22 107.57 1yhi n HIS 77 Ca 0.18 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.90 1yhi n HIS 77 Cb 0.53 -0.25 0.00 0.00 0.12 0.00 0.00 29.99 30.39 1yhi n HIS 77 CO 0.00 0.00 0.00 -1.33 -2.81 0.00 0.00 176.34 172.20 1yhi n MET 78 N -1.25 0.75 0.30 -1.40 2.81 -0.33 -4.80 117.12 113.21 1yhi n MET 78 Ca 0.11 -0.95 0.20 0.00 -1.81 0.00 0.00 57.70 55.25 1yhi n MET 78 Cb 0.15 -1.01 1.07 0.00 -0.71 0.00 0.00 33.22 32.73 1yhi n MET 78 CO 0.00 0.00 0.00 0.87 1.51 0.00 0.00 175.97 178.35 1yhi h LYS 79 N 0.06 0.00 -0.00 0.03 1.57 -1.43 -2.19 116.57 114.61 1yhi h LYS 79 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1yhi h LYS 79 Cb 0.23 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.54 1yhi h LYS 79 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 179.45 178.88 1yhi n GLN 80 N -2.89 1.03 -0.12 3.15 0.00 -1.26 -3.44 117.38 113.84 1yhi n GLN 80 Ca -0.03 -0.05 0.04 0.00 0.00 0.00 0.00 57.00 56.97 1yhi n GLN 80 Cb 0.08 -1.40 0.11 0.00 0.00 0.00 0.00 30.24 29.03 1yhi n GLN 80 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.06 177.78 1yhi n HIS 81 N -0.85 0.31 -2.94 2.61 8.25 -0.82 -4.77 115.22 117.01 1yhi n HIS 81 Ca 0.19 -0.47 -0.44 0.00 -0.26 0.00 0.00 57.72 56.74 1yhi n HIS 81 Cb 0.10 -0.03 -0.03 0.00 1.12 0.00 0.00 29.99 31.15 1yhi n HIS 81 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1yhi s ASP 82 N -0.98 6.62 0.07 0.41 -1.08 -1.22 -4.66 116.67 115.83 1yhi s ASP 82 Ca 0.16 -2.03 -0.20 0.00 -0.52 0.00 0.00 52.55 49.96 1yhi s ASP 82 Cb 0.09 -2.39 -0.10 0.00 -1.46 0.00 0.00 42.92 39.05 1yhi s ASP 82 CO 0.11 -1.05 1.49 0.15 0.52 0.00 0.00 175.17 176.39 1yhi h PHE 83 N 8.82 0.40 -0.50 -5.34 3.57 -1.93 -3.25 116.94 118.70 1yhi h PHE 83 Ca 0.14 -0.08 0.10 0.00 3.53 0.00 0.00 57.97 61.66 1yhi h PHE 83 Cb 1.03 -0.10 -0.10 0.00 2.79 0.00 0.00 35.95 39.56 1yhi h PHE 83 CO 1.15 0.58 -0.27 0.74 -2.23 0.00 0.00 178.31 178.28 1yhi h PHE 84 N 0.11 -0.72 -0.00 0.41 0.04 -1.91 -2.59 116.94 112.28 1yhi h PHE 84 Ca 0.06 0.06 -0.14 0.00 2.80 0.00 0.00 57.97 60.74 1yhi h PHE 84 Cb 0.43 0.39 -0.02 0.00 2.20 0.00 0.00 35.95 38.95 1yhi h PHE 84 CO 0.04 -0.34 -0.66 0.87 -0.60 0.00 0.00 178.31 177.62 1yhi h LYS 85 N -0.15 0.01 0.00 1.51 1.57 -1.87 -3.27 116.57 114.37 1yhi h LYS 85 Ca 0.22 -0.01 -0.04 0.00 -1.87 0.00 0.00 60.65 58.95 1yhi h LYS 85 Cb 0.51 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.82 1yhi h LYS 85 CO -0.59 0.67 -0.20 0.66 -0.57 0.00 0.00 179.45 179.41 1yhi h SER 86 N 0.01 0.00 0.94 0.86 4.64 -1.50 -2.95 113.55 115.55 1yhi h SER 86 Ca -0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 1yhi h SER 86 Cb 1.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.26 1yhi h SER 86 CO 0.09 0.20 -0.06 0.00 -0.87 0.00 0.00 176.83 176.19 1yhi n ALA 87 N -2.30 2.47 -1.92 5.18 0.00 -1.13 -4.64 120.51 118.18 1yhi n ALA 87 Ca -0.01 -0.13 -0.32 0.00 0.00 0.00 0.00 53.44 52.97 1yhi n ALA 87 Cb 0.33 -1.43 -0.06 0.00 0.00 0.00 0.00 19.45 18.30 1yhi n ALA 87 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 1yhi s MET 88 N -3.00 4.07 0.31 0.00 1.00 -1.11 -1.58 119.30 119.00 1yhi s MET 88 Ca 0.14 0.93 0.26 0.00 0.00 0.00 0.00 55.69 57.02 1yhi s MET 88 Cb 0.19 -2.23 0.75 0.00 0.00 0.00 0.00 34.83 33.53 1yhi s MET 88 CO 0.55 -0.06 1.74 -1.00 0.00 0.00 0.00 175.02 176.25 1yhi h PRO 89 N 1.66 0.00 -0.71 2.03 0.13 -1.90 -3.37 132.00 129.84 1yhi h PRO 89 Ca -0.48 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 64.66 1yhi h PRO 89 Cb 1.18 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.28 1yhi h PRO 89 CO 0.62 0.00 0.47 0.93 -0.23 0.00 0.00 178.00 179.79 1yhi h GLU 90 N 0.00 0.93 0.00 0.86 3.07 -1.93 -3.01 114.58 114.50 1yhi h GLU 90 Ca 0.00 -0.06 0.00 0.00 -0.50 0.00 0.00 59.36 58.80 1yhi h GLU 90 Cb 0.74 -0.21 0.00 0.00 -0.84 0.00 0.00 28.75 28.44 1yhi h GLU 90 CO 0.00 0.61 0.00 0.41 -1.40 0.00 0.00 179.01 178.63 1yhi n GLY 91 N -1.43 -1.77 3.36 -3.84 0.00 -0.61 -4.71 105.19 96.18 1yhi n GLY 91 Ca 0.08 -1.58 -0.10 0.00 0.00 0.00 0.00 46.02 44.42 1yhi n GLY 91 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1yhi s TYR 92 N 0.00 0.09 -0.14 1.61 -0.85 -0.86 -2.27 117.35 114.94 1yhi s TYR 92 Ca 0.00 -0.46 -0.05 0.00 -0.52 0.00 0.00 57.07 56.05 1yhi s TYR 92 Cb 0.00 0.12 -0.04 0.00 0.38 0.00 0.00 41.96 42.43 1yhi s TYR 92 CO 0.00 -0.74 0.03 0.08 -1.52 0.00 0.00 175.55 173.40 1yhi s VAL 93 N -3.89 4.49 -0.12 -3.49 1.01 -0.26 -2.20 120.40 115.95 1yhi s VAL 93 Ca 0.10 -0.15 0.03 0.00 0.00 0.00 0.00 61.98 61.95 1yhi s VAL 93 Cb 0.02 -2.97 -0.00 0.00 0.00 0.00 0.00 36.38 33.43 1yhi s VAL 93 CO -0.05 0.52 -0.21 -1.58 0.00 0.00 0.00 175.10 173.78 1yhi s GLN 94 N -0.11 3.12 -0.05 2.72 0.74 -0.35 -1.77 119.66 123.95 1yhi s GLN 94 Ca 0.05 -0.83 0.05 0.00 0.05 0.00 0.00 55.36 54.68 1yhi s GLN 94 Cb -0.12 -2.40 -0.01 0.00 1.10 0.00 0.00 33.01 31.58 1yhi s GLN 94 CO 0.02 0.14 -0.22 -1.21 -0.55 0.00 0.00 175.29 173.47 1yhi s GLU 95 N 0.45 2.25 0.14 1.67 2.02 -0.71 -1.02 118.70 123.51 1yhi s GLU 95 Ca -0.15 -0.79 -0.10 0.00 0.02 0.00 0.00 54.97 53.96 1yhi s GLU 95 Cb -0.17 -1.92 -0.00 0.00 0.10 0.00 0.00 34.13 32.14 1yhi s GLU 95 CO 0.06 0.32 0.29 0.00 0.02 0.00 0.00 175.26 175.95 1yhi s ALA 96 N -0.07 -0.19 -0.05 5.21 0.00 -0.91 -1.55 121.76 124.20 1yhi s ALA 96 Ca -0.04 -0.71 -0.01 0.00 0.00 0.00 0.00 51.96 51.20 1yhi s ALA 96 Cb -0.13 0.75 0.03 0.00 0.00 0.00 0.00 23.12 23.77 1yhi s ALA 96 CO 0.03 -0.62 0.01 0.99 0.00 0.00 0.00 175.76 176.17 1yhi s THR 97 N -3.92 0.23 -0.32 0.00 2.01 -0.80 -1.89 115.64 110.95 1yhi s THR 97 Ca 0.13 0.16 -0.05 0.00 0.31 0.00 0.00 61.69 62.24 1yhi s THR 97 Cb 0.03 -0.39 0.04 0.00 0.01 0.00 0.00 72.50 72.20 1yhi s THR 97 CO -0.04 0.21 0.06 -0.63 -0.69 0.00 0.00 174.62 173.54 1yhi s ILE 98 N 1.70 3.47 -0.25 1.82 1.09 -0.71 -2.46 121.20 125.87 1yhi s ILE 98 Ca 0.00 -1.22 -0.10 0.00 -1.10 0.00 0.00 60.65 58.24 1yhi s ILE 98 Cb -0.13 -2.97 -0.04 0.00 -1.06 0.00 0.00 42.46 38.26 1yhi s ILE 98 CO -0.03 -0.14 0.14 -0.44 -0.10 0.00 0.00 174.94 174.36 1yhi s SER 99 N 1.35 5.83 -0.22 3.58 0.01 -0.73 -1.58 113.70 121.94 1yhi s SER 99 Ca -0.03 0.01 -0.12 0.00 1.31 0.00 0.00 55.95 57.12 1yhi s SER 99 Cb -0.20 -2.06 -0.05 0.00 0.21 0.00 0.00 66.02 63.93 1yhi s SER 99 CO 0.01 0.02 0.22 -0.36 0.41 0.00 0.00 173.24 173.54 1yhi s PHE 100 N 1.31 3.36 0.16 2.43 0.08 -0.95 -2.10 117.98 122.26 1yhi s PHE 100 Ca 0.07 0.36 -0.31 0.00 0.12 0.00 0.00 56.93 57.16 1yhi s PHE 100 Cb -0.14 -2.31 -0.11 0.00 -0.57 0.00 0.00 43.02 39.89 1yhi s PHE 100 CO 0.06 0.11 1.74 0.21 -0.10 0.00 0.00 175.22 177.24 1yhi s LYS 101 N 0.92 4.14 -1.70 0.44 2.20 -0.87 -2.21 119.74 122.67 1yhi s LYS 101 Ca 0.11 2.56 0.00 0.00 -0.36 0.00 0.00 55.97 58.28 1yhi s LYS 101 Cb -0.13 -3.32 0.00 0.00 -1.51 0.00 0.00 37.83 32.87 1yhi s LYS 101 CO 0.04 -0.77 0.00 -0.25 -0.36 0.00 0.00 175.35 174.01 1yhi n ASP 102 N 4.75 -5.00 -0.27 1.43 8.00 -1.26 -4.86 116.55 119.34 1yhi n ASP 102 Ca 0.16 0.32 0.00 0.00 0.71 0.00 0.00 54.79 55.98 1yhi n ASP 102 Cb 0.37 -4.00 0.00 0.00 -0.02 0.00 0.00 41.12 37.47 1yhi n ASP 102 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1yhi n ASP 103 N -0.81 0.00 -2.29 -2.24 -0.08 -0.94 -4.98 116.55 105.21 1yhi n ASP 103 Ca -0.17 -0.27 0.00 0.00 -1.51 0.00 0.00 54.79 52.84 1yhi n ASP 103 Cb 0.57 0.00 0.00 0.00 2.34 0.00 0.00 41.12 44.03 1yhi n ASP 103 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1yhi n GLY 104 N 0.00 -0.68 3.06 0.27 0.00 -1.22 -4.66 105.19 101.97 1yhi n GLY 104 Ca 0.00 -1.70 -0.08 0.00 0.00 0.00 0.00 46.02 44.24 1yhi n GLY 104 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1yhi s ASN 105 N -1.00 0.33 -0.13 1.61 2.20 -0.93 -2.25 114.94 114.77 1yhi s ASN 105 Ca 0.00 -0.72 -0.03 0.00 -0.94 0.00 0.00 52.86 51.17 1yhi s ASN 105 Cb 0.00 0.18 -0.03 0.00 -2.00 0.00 0.00 41.25 39.40 1yhi s ASN 105 CO 0.00 -0.49 -0.03 -0.31 -2.94 0.00 0.00 177.10 173.33 1yhi s TYR 106 N -2.83 3.04 -0.17 1.54 2.02 -0.62 -1.94 117.35 118.39 1yhi s TYR 106 Ca -0.03 -0.14 0.01 0.00 -0.37 0.00 0.00 57.07 56.54 1yhi s TYR 106 Cb 0.00 -1.88 0.01 0.00 -0.40 0.00 0.00 41.96 39.69 1yhi s TYR 106 CO -0.06 0.13 -0.18 0.15 -1.57 0.00 0.00 175.55 174.02 1yhi s LYS 107 N -0.09 3.06 0.18 -0.62 1.02 -0.62 -1.74 119.74 120.93 1yhi s LYS 107 Ca 0.02 -0.81 0.09 0.00 0.02 0.00 0.00 55.97 55.29 1yhi s LYS 107 Cb -0.13 -2.59 -0.04 0.00 -0.52 0.00 0.00 37.83 34.55 1yhi s LYS 107 CO 0.02 -0.14 -0.18 0.95 -0.92 0.00 0.00 175.35 175.09 1yhi s THR 108 N 1.16 1.85 -0.06 2.17 -4.23 -0.79 -1.90 115.64 113.84 1yhi s THR 108 Ca 0.01 -2.01 -0.04 0.00 -1.18 0.00 0.00 61.69 58.48 1yhi s THR 108 Cb -0.14 -1.92 0.03 0.00 1.34 0.00 0.00 72.50 71.81 1yhi s THR 108 CO -0.08 -0.38 0.14 -0.60 -0.54 0.00 0.00 174.62 173.16 1yhi s ARG 109 N -3.01 0.12 -0.00 3.99 3.52 -1.04 -2.15 118.95 120.37 1yhi s ARG 109 Ca 0.18 0.29 -0.06 0.00 -0.13 0.00 0.00 55.73 56.01 1yhi s ARG 109 Cb -0.05 -0.07 0.00 0.00 -1.56 0.00 0.00 34.95 33.27 1yhi s ARG 109 CO 0.07 -0.10 0.12 0.00 -0.81 0.00 0.00 175.30 174.58 1yhi s ALA 110 N 0.70 -0.28 -0.20 6.12 0.00 -0.19 -2.02 121.76 125.88 1yhi s ALA 110 Ca -0.05 -0.13 -0.03 0.00 0.00 0.00 0.00 51.96 51.74 1yhi s ALA 110 Cb -0.07 0.08 -0.01 0.00 0.00 0.00 0.00 23.12 23.12 1yhi s ALA 110 CO -0.03 -0.19 -0.06 -1.21 0.00 0.00 0.00 175.76 174.27 1yhi s GLU 111 N -1.25 3.39 -0.20 0.00 2.02 -0.74 -1.21 118.70 120.71 1yhi s GLU 111 Ca -0.13 -0.63 0.01 0.00 0.02 0.00 0.00 54.97 54.24 1yhi s GLU 111 Cb -0.07 -2.95 0.03 0.00 0.10 0.00 0.00 34.13 31.23 1yhi s GLU 111 CO 0.01 -0.12 -0.18 0.08 0.02 0.00 0.00 175.26 175.08 1yhi s VAL 112 N 1.26 2.15 0.37 2.63 1.01 -0.94 -2.18 120.40 124.70 1yhi s VAL 112 Ca 0.03 -1.03 -0.14 0.00 0.00 0.00 0.00 61.98 60.84 1yhi s VAL 112 Cb -0.14 -1.97 0.05 0.00 0.00 0.00 0.00 36.38 34.32 1yhi s VAL 112 CO -0.02 0.44 0.74 2.29 0.00 0.00 0.00 175.10 178.55 1yhi n LYS 113 N 4.60 1.06 -4.24 2.72 2.85 -1.08 -2.02 118.16 122.05 1yhi n LYS 113 Ca -0.20 -2.09 -0.35 0.00 -1.05 0.00 0.00 58.31 54.63 1yhi n LYS 113 Cb 0.49 2.60 -0.10 0.00 -0.65 0.00 0.00 35.03 37.37 1yhi n LYS 113 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 177.40 177.29 1yhi s PHE 114 N -2.61 3.20 -0.29 5.58 0.08 -1.14 -0.95 117.98 121.84 1yhi s PHE 114 Ca 0.15 0.09 -0.00 0.00 0.12 0.00 0.00 56.93 57.29 1yhi s PHE 114 Cb -0.05 -1.92 0.09 0.00 -0.57 0.00 0.00 43.02 40.58 1yhi s PHE 114 CO 0.11 0.31 0.07 -1.21 -0.10 0.00 0.00 175.22 174.40 1yhi s GLU 115 N -0.30 0.90 6.75 0.44 0.41 -0.80 -4.96 118.70 121.14 1yhi s GLU 115 Ca 0.07 -1.09 0.00 0.00 -0.41 0.00 0.00 54.97 53.54 1yhi s GLU 115 Cb -0.12 -2.22 0.00 0.00 -1.78 0.00 0.00 34.13 30.01 1yhi s GLU 115 CO 0.02 -0.90 0.00 0.41 -0.49 0.00 0.00 175.26 174.30 1yhi n GLY 116 N 4.78 1.46 1.64 -1.39 0.00 -1.26 -2.68 105.19 107.73 1yhi n GLY 116 Ca -0.03 -0.49 0.07 0.00 0.00 0.00 0.00 46.02 45.57 1yhi n GLY 116 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1yhi n ASP 117 N 6.66 5.24 -4.33 1.61 10.43 -1.26 -4.97 116.55 129.94 1yhi n ASP 117 Ca 0.00 -2.97 -0.30 0.00 2.57 0.00 0.00 54.79 54.08 1yhi n ASP 117 Cb 0.00 -0.65 -0.15 0.00 1.84 0.00 0.00 41.12 42.15 1yhi n ASP 117 CO 0.00 0.00 0.00 -0.89 -1.07 0.00 0.00 177.20 175.24 1yhi s THR 118 N -2.80 2.09 -0.25 -3.53 2.01 -1.09 -4.42 115.64 107.65 1yhi s THR 118 Ca 0.52 -1.26 -0.18 0.00 0.31 0.00 0.00 61.69 61.07 1yhi s THR 118 Cb 0.40 -1.77 -0.03 0.00 0.01 0.00 0.00 72.50 71.12 1yhi s THR 118 CO 0.14 0.46 0.52 -0.22 -0.69 0.00 0.00 174.62 174.83 1yhi s LEU 119 N -0.95 4.08 0.03 4.42 1.98 -0.98 -1.90 118.68 125.35 1yhi s LEU 119 Ca 0.11 0.57 0.03 0.00 -2.89 0.00 0.00 54.13 51.95 1yhi s LEU 119 Cb -0.10 -2.68 -0.04 0.00 0.66 0.00 0.00 46.19 44.03 1yhi s LEU 119 CO 0.01 -0.26 -0.03 -0.69 -1.89 0.00 0.00 176.35 173.48 1yhi s VAL 120 N 2.15 3.91 -0.11 1.68 1.01 -0.13 -2.27 120.40 126.65 1yhi s VAL 120 Ca 0.22 -0.78 -0.01 0.00 0.00 0.00 0.00 61.98 61.41 1yhi s VAL 120 Cb -0.16 -2.76 0.03 0.00 0.00 0.00 0.00 36.38 33.50 1yhi s VAL 120 CO 0.09 0.31 -0.04 0.20 0.00 0.00 0.00 175.10 175.67 1yhi s ASN 121 N -1.71 2.08 -0.22 3.32 0.02 -0.77 -2.65 114.94 115.02 1yhi s ASN 121 Ca 0.20 -0.30 0.01 0.00 -1.02 0.00 0.00 52.86 51.76 1yhi s ASN 121 Cb -0.11 -0.68 0.04 0.00 0.02 0.00 0.00 41.25 40.51 1yhi s ASN 121 CO 0.11 -0.17 -0.15 -0.13 0.02 0.00 0.00 177.10 176.79 1yhi s ARG 122 N 1.81 2.69 0.08 -0.60 0.52 -0.93 -1.95 118.95 120.57 1yhi s ARG 122 Ca 0.04 -1.04 0.08 0.00 -0.52 0.00 0.00 55.73 54.29 1yhi s ARG 122 Cb -0.13 -2.74 -0.03 0.00 0.52 0.00 0.00 34.95 32.57 1yhi s ARG 122 CO -0.07 -0.37 -0.22 0.42 0.02 0.00 0.00 175.30 175.08 1yhi s ILE 123 N 1.22 1.79 -0.04 1.52 1.01 -0.53 -1.78 121.20 124.38 1yhi s ILE 123 Ca -0.01 -1.44 0.03 0.00 0.00 0.00 0.00 60.65 59.23 1yhi s ILE 123 Cb -0.16 -1.59 0.00 0.00 0.01 0.00 0.00 42.46 40.73 1yhi s ILE 123 CO -0.09 0.08 -0.13 -1.61 0.00 0.00 0.00 174.94 173.19 1yhi s GLU 124 N -1.63 1.45 -0.01 2.79 2.02 -0.86 -2.34 118.70 120.12 1yhi s GLU 124 Ca 0.08 -0.43 0.04 0.00 0.02 0.00 0.00 54.97 54.68 1yhi s GLU 124 Cb -0.10 -1.26 -0.01 0.00 0.10 0.00 0.00 34.13 32.86 1yhi s GLU 124 CO 0.03 0.13 -0.13 -1.17 0.02 0.00 0.00 175.26 174.14 1yhi s LEU 125 N 0.29 2.02 -0.12 1.80 0.20 -0.74 -2.50 118.68 119.63 1yhi s LEU 125 Ca -0.07 -0.24 -0.01 0.00 0.69 0.00 0.00 54.13 54.50 1yhi s LEU 125 Cb -0.12 -0.68 0.03 0.00 -0.43 0.00 0.00 46.19 44.99 1yhi s LEU 125 CO 0.02 0.16 -0.04 -0.54 -0.29 0.00 0.00 176.35 175.66 1yhi s LYS 126 N -0.30 1.12 -0.19 1.98 1.02 -0.80 -2.24 119.74 120.33 1yhi s LYS 126 Ca 0.05 -0.19 -0.04 0.00 0.02 0.00 0.00 55.97 55.80 1yhi s LYS 126 Cb -0.05 -1.51 -0.02 0.00 -0.52 0.00 0.00 37.83 35.73 1yhi s LYS 126 CO -0.00 -0.34 -0.02 0.20 -0.92 0.00 0.00 175.35 174.26 1yhi s GLY 127 N 1.80 1.69 0.17 -3.33 0.00 -0.05 -1.58 107.32 106.02 1yhi s GLY 127 Ca 0.04 -0.99 0.07 0.00 0.00 0.00 0.00 44.72 43.83 1yhi s GLY 127 CO -0.07 0.21 -0.14 -0.26 0.00 0.00 0.00 173.10 172.84 1yhi s ILE 128 N 0.96 1.54 -1.48 0.90 -4.36 -0.82 -2.56 121.20 115.39 1yhi s ILE 128 Ca 0.01 -2.02 -0.07 0.00 -0.26 0.00 0.00 60.65 58.30 1yhi s ILE 128 Cb -0.14 -1.85 0.02 0.00 1.25 0.00 0.00 42.46 41.73 1yhi s ILE 128 CO 0.01 -0.55 0.78 0.47 0.24 0.00 0.00 174.94 175.90 1yhi n ASP 129 N -0.04 -5.87 -4.84 4.36 8.00 -1.26 -2.19 116.55 114.71 1yhi n ASP 129 Ca -0.11 -0.40 -0.33 0.00 0.71 0.00 0.00 54.79 54.66 1yhi n ASP 129 Cb 0.59 -4.71 -0.06 0.00 -0.02 0.00 0.00 41.12 36.92 1yhi n ASP 129 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 1yhi s PHE 130 N -3.20 3.44 0.02 1.24 0.40 -1.26 -3.45 117.98 115.17 1yhi s PHE 130 Ca 0.42 1.20 -0.23 0.00 -0.60 0.00 0.00 56.93 57.72 1yhi s PHE 130 Cb -0.19 -2.51 -0.05 0.00 0.51 0.00 0.00 43.02 40.77 1yhi s PHE 130 CO 0.52 0.17 0.70 0.15 0.70 0.00 0.00 175.22 177.46 1yhi s LYS 131 N -2.73 4.43 0.45 0.44 1.02 -1.26 -4.95 119.74 117.13 1yhi s LYS 131 Ca 0.51 0.93 0.22 0.00 0.02 0.00 0.00 55.97 57.65 1yhi s LYS 131 Cb -0.12 -3.36 1.08 0.00 -0.52 0.00 0.00 37.83 34.91 1yhi s LYS 131 CO 0.19 0.30 1.92 0.93 -0.92 0.00 0.00 175.35 177.77 1yhi h GLU 132 N 5.72 0.00 -0.42 1.68 5.08 -1.97 -2.99 114.58 121.68 1yhi h GLU 132 Ca -0.44 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.92 1yhi h GLU 132 Cb 1.20 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.45 1yhi h GLU 132 CO 0.71 0.23 0.00 -0.40 -1.00 0.00 0.00 179.01 178.55 1yhi n ASP 133 N -3.69 3.25 -3.36 1.42 3.85 -1.26 -4.22 116.55 112.53 1yhi n ASP 133 Ca -0.01 -1.93 -0.23 0.00 -0.71 0.00 0.00 54.79 51.91 1yhi n ASP 133 Cb 0.35 -0.28 0.18 0.00 -1.35 0.00 0.00 41.12 40.02 1yhi n ASP 133 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1yhi n GLY 134 N 1.13 -2.13 0.20 6.12 0.00 -1.13 -4.78 105.19 104.60 1yhi n GLY 134 Ca 0.17 -1.58 0.05 0.00 0.00 0.00 0.00 46.02 44.66 1yhi n GLY 134 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1yhi h ASN 135 N -1.88 0.00 0.00 1.61 2.35 -1.94 -1.97 115.58 113.75 1yhi h ASN 135 Ca -0.32 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.43 1yhi h ASN 135 Cb 0.93 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.30 1yhi h ASN 135 CO 0.22 0.34 -0.07 0.40 -1.65 0.00 0.00 177.43 176.66 1yhi h ILE 136 N 0.00 0.00 0.00 2.81 5.03 -1.94 -2.26 117.51 121.15 1yhi h ILE 136 Ca -0.00 -0.68 0.00 0.00 -0.12 0.00 0.00 64.86 64.05 1yhi h ILE 136 Cb 0.67 0.00 0.00 0.00 -3.03 0.00 0.00 36.82 34.46 1yhi h ILE 136 CO 0.04 0.00 0.00 0.18 -0.68 0.00 0.00 178.15 177.69 1yhi n LEU 137 N -3.90 0.70 -0.59 1.44 4.77 -1.26 -2.56 117.00 115.60 1yhi n LEU 137 Ca -0.01 0.65 0.13 0.00 -0.03 0.00 0.00 56.01 56.75 1yhi n LEU 137 Cb 0.04 -0.53 0.27 0.00 -2.33 0.00 0.00 43.42 40.87 1yhi n LEU 137 CO 0.02 -0.50 0.66 0.61 -1.33 0.00 0.00 177.39 176.85 1yhi n GLY 138 N 0.23 0.21 3.59 -0.72 0.00 -0.74 -4.95 105.19 102.81 1yhi n GLY 138 Ca 0.03 -0.55 -0.26 0.00 0.00 0.00 0.00 46.02 45.23 1yhi n GLY 138 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1yhi n HIS 139 N 0.37 -2.04 -0.53 1.61 8.25 -1.06 -4.96 115.22 116.85 1yhi n HIS 139 Ca 0.15 0.60 0.08 0.00 -0.26 0.00 0.00 57.72 58.29 1yhi n HIS 139 Cb 0.45 -3.72 0.27 0.00 1.12 0.00 0.00 29.99 28.11 1yhi n HIS 139 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 1yhi n LYS 140 N -3.97 3.21 -3.95 -0.41 5.02 -0.85 -5.02 118.16 112.19 1yhi n LYS 140 Ca -0.12 -2.59 -0.32 0.00 -2.02 0.00 0.00 58.31 53.26 1yhi n LYS 140 Cb 0.61 -1.65 -0.05 0.00 -0.02 0.00 0.00 35.03 33.92 1yhi n LYS 140 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1yhi s LEU 141 N -1.70 4.24 0.50 -0.35 1.43 -1.26 -2.65 118.68 118.89 1yhi s LEU 141 Ca 0.40 0.26 -0.16 0.00 -1.03 0.00 0.00 54.13 53.60 1yhi s LEU 141 Cb 0.26 -2.67 -0.08 0.00 0.03 0.00 0.00 46.19 43.73 1yhi s LEU 141 CO 0.19 0.22 0.95 -1.61 0.23 0.00 0.00 176.35 176.34 1yhi s GLU 142 N -2.16 3.93 -1.29 1.70 2.02 -0.88 -4.92 118.70 117.11 1yhi s GLU 142 Ca 0.30 0.88 -0.13 0.00 0.02 0.00 0.00 54.97 56.04 1yhi s GLU 142 Cb -0.13 -2.18 0.13 0.00 0.10 0.00 0.00 34.13 32.06 1yhi s GLU 142 CO 0.22 -0.23 1.79 0.98 0.02 0.00 0.00 175.26 178.03 1yhi n TYR 143 N -1.52 3.91 -3.89 1.61 9.36 -1.26 -4.88 117.16 120.48 1yhi n TYR 143 Ca 0.06 -3.00 -0.09 0.00 3.32 0.00 0.00 57.90 58.19 1yhi n TYR 143 Cb 0.54 -2.23 -0.02 0.00 -0.63 0.00 0.00 39.34 37.01 1yhi n TYR 143 CO 0.00 0.00 0.00 0.54 0.22 0.00 0.00 176.86 177.62 1yhi s ASN 144 N 2.34 -0.06 -0.24 2.98 2.20 -1.26 -4.91 114.94 116.00 1yhi s ASN 144 Ca 0.44 -0.89 -0.12 0.00 -0.94 0.00 0.00 52.86 51.34 1yhi s ASN 144 Cb 0.06 0.73 0.08 0.00 -2.00 0.00 0.00 41.25 40.12 1yhi s ASN 144 CO -0.00 -1.40 0.57 -0.47 -2.94 0.00 0.00 177.10 172.85 1yhi s TYR 145 N -3.41 -0.90 0.53 1.54 5.04 -1.26 -4.93 117.35 113.96 1yhi s TYR 145 Ca 0.16 1.80 -0.05 0.00 -2.44 0.00 0.00 57.07 56.54 1yhi s TYR 145 Cb -0.04 0.49 -0.01 0.00 0.35 0.00 0.00 41.96 42.75 1yhi s TYR 145 CO 0.10 -0.47 0.82 -0.80 -1.34 0.00 0.00 175.55 173.86 1yhi s ASN 146 N 1.70 5.92 0.43 4.32 0.01 -1.26 -4.64 114.94 121.42 1yhi s ASN 146 Ca -0.09 0.76 -0.24 0.00 -0.71 0.00 0.00 52.86 52.58 1yhi s ASN 146 Cb -0.07 -1.93 -0.08 0.00 0.41 0.00 0.00 41.25 39.58 1yhi s ASN 146 CO -0.17 -0.80 1.12 -0.44 -1.51 0.00 0.00 177.10 175.29 1yhi s SER 147 N -4.21 6.47 0.29 -1.22 0.01 -1.26 -4.74 113.70 109.04 1yhi s SER 147 Ca 0.50 2.19 -0.19 0.00 1.31 0.00 0.00 55.95 59.76 1yhi s SER 147 Cb -0.10 -2.60 0.02 0.00 0.21 0.00 0.00 66.02 63.55 1yhi s SER 147 CO 0.44 -0.70 0.70 -1.38 0.41 0.00 0.00 173.24 172.71 1yhi s HIS 148 N -1.58 -0.08 -0.05 2.43 -3.43 -1.08 -5.05 115.29 106.46 1yhi s HIS 148 Ca 0.60 -0.40 0.05 0.00 -0.80 0.00 0.00 55.06 54.51 1yhi s HIS 148 Cb -0.26 0.66 -0.02 0.00 -1.43 0.00 0.00 32.58 31.53 1yhi s HIS 148 CO 0.32 -1.25 -0.18 -0.80 -2.00 0.00 0.00 174.74 170.82 1yhi s ASN 149 N -2.95 3.67 -0.26 7.38 0.01 -1.26 -1.61 114.94 119.92 1yhi s ASN 149 Ca 0.13 -0.31 -0.05 0.00 -0.71 0.00 0.00 52.86 51.91 1yhi s ASN 149 Cb -0.05 -0.81 0.00 0.00 0.41 0.00 0.00 41.25 40.80 1yhi s ASN 149 CO 0.08 0.31 0.02 -0.69 -1.51 0.00 0.00 177.10 175.31 1yhi s VAL 150 N -0.52 3.70 -0.12 1.60 1.01 -0.78 -4.80 120.40 120.49 1yhi s VAL 150 Ca 0.07 -0.60 -0.21 0.00 0.00 0.00 0.00 61.98 61.25 1yhi s VAL 150 Cb -0.11 -2.81 -0.04 0.00 0.00 0.00 0.00 36.38 33.42 1yhi s VAL 150 CO 0.01 0.24 0.59 -0.31 0.00 0.00 0.00 175.10 175.63 1yhi s TYR 151 N 1.49 3.50 0.04 5.22 2.02 -1.05 -1.69 117.35 126.87 1yhi s TYR 151 Ca 0.04 1.02 0.08 0.00 -0.37 0.00 0.00 57.07 57.84 1yhi s TYR 151 Cb -0.16 -2.70 -0.03 0.00 -0.40 0.00 0.00 41.96 38.67 1yhi s TYR 151 CO -0.00 0.06 -0.20 0.42 -1.57 0.00 0.00 175.55 174.26 1yhi s ILE 152 N 0.98 2.61 0.06 2.71 1.01 -0.58 -2.07 121.20 125.93 1yhi s ILE 152 Ca 0.31 -1.24 -0.10 0.00 0.00 0.00 0.00 60.65 59.62 1yhi s ILE 152 Cb -0.16 -2.08 0.01 0.00 0.01 0.00 0.00 42.46 40.24 1yhi s ILE 152 CO 0.13 0.35 0.22 0.28 0.00 0.00 0.00 174.94 175.93 1yhi s THR 153 N -0.89 0.12 0.34 2.92 -1.32 -0.96 -2.80 115.64 113.05 1yhi s THR 153 Ca 0.14 -0.95 -0.17 0.00 -1.21 0.00 0.00 61.69 59.49 1yhi s THR 153 Cb -0.10 -1.10 -0.09 0.00 -1.51 0.00 0.00 72.50 69.69 1yhi s THR 153 CO 0.04 -0.53 0.80 0.00 -2.21 0.00 0.00 174.62 172.73 1yhi s ALA 154 N -3.15 3.25 -0.56 11.08 0.00 -1.26 -1.31 121.76 129.81 1yhi s ALA 154 Ca -0.01 0.16 0.04 0.00 0.00 0.00 0.00 51.96 52.16 1yhi s ALA 154 Cb 0.02 -2.89 0.15 0.00 0.00 0.00 0.00 23.12 20.40 1yhi s ALA 154 CO -0.07 0.27 0.36 0.34 0.00 0.00 0.00 175.76 176.66 1yhi s ASP 155 N -2.18 3.96 0.27 0.00 2.15 -0.40 -4.81 116.67 115.65 1yhi s ASP 155 Ca 0.55 -3.26 -0.02 0.00 0.43 0.00 0.00 52.55 50.25 1yhi s ASP 155 Cb -0.11 -1.32 0.44 0.00 -0.30 0.00 0.00 42.92 41.63 1yhi s ASP 155 CO 0.17 -0.17 1.87 0.11 -0.17 0.00 0.00 175.17 176.97 1yhi h LYS 156 N 5.99 1.09 0.00 4.34 1.57 -1.97 -2.22 116.57 125.38 1yhi h LYS 156 Ca 0.08 -0.07 -0.01 0.00 -1.87 0.00 0.00 60.65 58.78 1yhi h LYS 156 Cb 0.85 -0.25 -0.00 0.00 0.08 0.00 0.00 32.23 32.91 1yhi h LYS 156 CO 0.61 0.72 -0.05 1.96 -0.57 0.00 0.00 179.45 182.12 1yhi h GLN 157 N 1.12 0.00 -0.01 3.15 4.20 -1.96 -2.85 115.11 118.77 1yhi h GLN 157 Ca 0.45 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.16 1yhi h GLN 157 Cb 0.25 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.03 1yhi h GLN 157 CO -0.20 0.05 0.00 1.63 -0.67 0.00 0.00 178.83 179.64 1yhi n LYS 158 N -3.49 2.14 -3.85 1.46 5.02 -1.15 -5.03 118.16 113.26 1yhi n LYS 158 Ca -0.02 -1.30 -0.26 0.00 -2.02 0.00 0.00 58.31 54.71 1yhi n LYS 158 Cb 0.17 -1.01 0.01 0.00 -0.02 0.00 0.00 35.03 34.18 1yhi n LYS 158 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1yhi n ASN 159 N -0.35 -2.10 0.00 4.39 3.02 -0.94 -4.69 115.26 114.58 1yhi n ASN 159 Ca 0.00 -0.86 0.00 0.00 -0.03 0.00 0.00 54.58 53.69 1yhi n ASN 159 Cb 0.20 -3.69 0.00 0.00 -0.61 0.00 0.00 39.78 35.68 1yhi n ASN 159 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1yhi n GLY 160 N -1.69 4.81 3.30 7.41 0.00 -0.88 -4.57 105.19 113.57 1yhi n GLY 160 Ca -0.18 -1.00 -0.16 0.00 0.00 0.00 0.00 46.02 44.67 1yhi n GLY 160 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1yhi s ILE 161 N 0.09 0.36 0.04 -0.61 -4.36 -1.18 -1.28 121.20 114.26 1yhi s ILE 161 Ca 0.00 -2.00 0.03 0.00 -0.26 0.00 0.00 60.65 58.42 1yhi s ILE 161 Cb 0.00 -2.56 -0.02 0.00 1.25 0.00 0.00 42.46 41.12 1yhi s ILE 161 CO 0.00 0.00 -0.10 -0.54 0.24 0.00 0.00 174.94 174.54 1yhi s LYS 162 N -3.97 0.64 0.02 0.37 1.02 -0.43 -2.17 119.74 115.22 1yhi s LYS 162 Ca 0.37 -0.73 0.01 0.00 0.02 0.00 0.00 55.97 55.64 1yhi s LYS 162 Cb 0.07 -0.53 -0.01 0.00 -0.52 0.00 0.00 37.83 36.84 1yhi s LYS 162 CO 0.15 0.12 -0.04 0.00 -0.92 0.00 0.00 175.35 174.65 1yhi s ALA 163 N -1.13 0.29 -0.15 5.17 0.00 -0.83 -2.27 121.76 122.84 1yhi s ALA 163 Ca -0.05 -0.43 -0.21 0.00 0.00 0.00 0.00 51.96 51.28 1yhi s ALA 163 Cb -0.09 0.03 0.05 0.00 0.00 0.00 0.00 23.12 23.11 1yhi s ALA 163 CO 0.01 -0.03 0.54 1.21 0.00 0.00 0.00 175.76 177.49 1yhi s ASN 164 N -0.87 -0.54 0.05 0.00 3.04 -0.88 -1.29 114.94 114.45 1yhi s ASN 164 Ca -0.07 0.91 -0.27 0.00 0.04 0.00 0.00 52.86 53.47 1yhi s ASN 164 Cb -0.06 0.92 0.09 0.00 -1.54 0.00 0.00 41.25 40.66 1yhi s ASN 164 CO -0.00 -0.30 0.84 0.72 -3.04 0.00 0.00 177.10 175.32 1yhi s PHE 165 N -0.18 -0.35 -0.09 0.43 -0.12 -1.11 -2.54 117.98 114.02 1yhi s PHE 165 Ca -0.04 0.18 -0.04 0.00 -0.05 0.00 0.00 56.93 56.98 1yhi s PHE 165 Cb -0.03 0.56 -0.04 0.00 -0.63 0.00 0.00 43.02 42.88 1yhi s PHE 165 CO 0.03 -0.64 0.07 0.15 -0.05 0.00 0.00 175.22 174.78 1yhi s LYS 166 N -3.27 3.20 0.06 1.99 -0.14 -1.26 -2.22 119.74 118.10 1yhi s LYS 166 Ca 0.05 -0.28 0.07 0.00 -1.36 0.00 0.00 55.97 54.45 1yhi s LYS 166 Cb -0.01 -2.98 -0.03 0.00 -1.68 0.00 0.00 37.83 33.12 1yhi s LYS 166 CO -0.08 0.73 -0.17 0.42 -0.76 0.00 0.00 175.35 175.49 1yhi s ILE 167 N -0.98 2.87 -0.35 2.17 1.01 0.38 -5.00 121.20 121.31 1yhi s ILE 167 Ca 0.15 -1.23 0.01 0.00 0.00 0.00 0.00 60.65 59.58 1yhi s ILE 167 Cb -0.12 -2.24 0.11 0.00 0.01 0.00 0.00 42.46 40.22 1yhi s ILE 167 CO 0.04 0.28 0.12 -0.13 0.00 0.00 0.00 174.94 175.26 1yhi s ARG 168 N -1.61 0.97 -0.17 2.79 0.52 -1.26 -2.08 118.95 118.10 1yhi s ARG 168 Ca 0.16 -1.42 -0.21 0.00 -0.52 0.00 0.00 55.73 53.74 1yhi s ARG 168 Cb -0.11 -2.26 -0.03 0.00 0.52 0.00 0.00 34.95 33.08 1yhi s ARG 168 CO 0.07 -1.02 0.61 -1.01 0.02 0.00 0.00 175.30 173.97 1yhi s HIS 169 N 1.21 3.42 0.06 -0.53 3.76 -0.71 -4.80 115.29 117.70 1yhi s HIS 169 Ca 0.12 0.95 -0.30 0.00 -0.15 0.00 0.00 55.06 55.68 1yhi s HIS 169 Cb -0.19 -2.76 -0.05 0.00 1.11 0.00 0.00 32.58 30.69 1yhi s HIS 169 CO -0.17 -0.09 1.15 -0.80 -0.85 0.00 0.00 174.74 173.99 1yhi s ASN 170 N 1.06 7.15 0.17 1.40 0.01 -1.26 -1.11 114.94 122.36 1yhi s ASN 170 Ca 0.29 1.95 0.04 0.00 -0.71 0.00 0.00 52.86 54.43 1yhi s ASN 170 Cb -0.16 -2.58 -0.03 0.00 0.41 0.00 0.00 41.25 38.89 1yhi s ASN 170 CO 0.11 -0.41 0.26 -0.63 -1.51 0.00 0.00 177.10 174.92 1yhi s ILE 171 N 0.97 5.07 0.53 0.60 1.01 -0.65 -2.06 121.20 126.66 1yhi s ILE 171 Ca 0.57 -0.87 0.23 0.00 0.00 0.00 0.00 60.65 60.58 1yhi s ILE 171 Cb -0.28 -3.64 0.37 0.00 0.01 0.00 0.00 42.46 38.92 1yhi s ILE 171 CO 0.29 -0.15 2.03 1.05 0.00 0.00 0.00 174.94 178.16 1yhi h GLU 172 N 2.00 0.00 0.00 2.79 4.11 -1.81 -2.68 114.58 118.99 1yhi h GLU 172 Ca -0.49 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.94 1yhi h GLU 172 Cb 1.20 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.45 1yhi h GLU 172 CO 0.66 0.00 -0.13 0.38 0.07 0.00 0.00 179.01 179.99 1yhi h ASP 173 N 0.00 0.00 0.00 3.06 -0.00 -1.96 -3.47 116.42 114.04 1yhi h ASP 173 Ca 0.19 -0.01 0.00 0.00 -0.00 0.00 0.00 57.03 57.22 1yhi h ASP 173 Cb 0.79 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 40.12 1yhi h ASP 173 CO -0.00 0.00 0.00 0.61 -0.00 0.00 0.00 179.24 179.85 1yhi n GLY 174 N 1.14 1.75 1.85 7.15 0.00 -1.01 -5.13 105.19 110.95 1yhi n GLY 174 Ca 0.04 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.92 1yhi n GLY 174 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1yhi n SER 175 N 0.00 0.20 -4.30 1.61 2.88 -1.26 -4.82 113.62 107.93 1yhi n SER 175 Ca 0.00 -1.31 -0.16 0.00 -1.33 0.00 0.00 58.87 56.07 1yhi n SER 175 Cb 0.00 -0.44 -0.10 0.00 -0.75 0.00 0.00 64.21 62.92 1yhi n SER 175 CO 0.00 0.00 0.00 0.68 -1.23 0.00 0.00 175.04 174.49 1yhi s VAL 176 N -2.12 1.44 -0.21 2.46 -7.23 -1.26 -1.63 120.40 111.85 1yhi s VAL 176 Ca 0.35 -2.13 0.01 0.00 -1.81 0.00 0.00 61.98 58.39 1yhi s VAL 176 Cb -0.01 -1.95 0.03 0.00 0.56 0.00 0.00 36.38 35.01 1yhi s VAL 176 CO 0.24 -0.67 -0.15 -1.58 -0.31 0.00 0.00 175.10 172.63 1yhi s GLN 177 N -3.70 2.88 0.30 4.82 2.00 -0.27 -4.93 119.66 120.75 1yhi s GLN 177 Ca 0.20 -0.92 -0.16 0.00 -2.00 0.00 0.00 55.36 52.48 1yhi s GLN 177 Cb 0.01 -2.72 -0.09 0.00 0.80 0.00 0.00 33.01 31.02 1yhi s GLN 177 CO 0.04 -0.29 0.73 -0.51 -0.50 0.00 0.00 175.29 174.75 1yhi s LEU 178 N 1.28 4.13 0.12 3.68 1.43 -1.26 -1.73 118.68 126.32 1yhi s LEU 178 Ca 0.02 1.30 -0.14 0.00 -1.03 0.00 0.00 54.13 54.28 1yhi s LEU 178 Cb -0.15 -3.96 0.03 0.00 0.03 0.00 0.00 46.19 42.13 1yhi s LEU 178 CO -0.10 -0.15 0.36 0.00 0.23 0.00 0.00 176.35 176.69 1yhi s ALA 179 N -1.88 -0.75 -0.01 4.21 0.00 -0.89 -2.05 121.76 120.39 1yhi s ALA 179 Ca 0.52 -0.20 0.03 0.00 0.00 0.00 0.00 51.96 52.31 1yhi s ALA 179 Cb -0.12 0.66 -0.01 0.00 0.00 0.00 0.00 23.12 23.66 1yhi s ALA 179 CO 0.18 -0.62 -0.11 0.34 0.00 0.00 0.00 175.76 175.55 1yhi s ASP 180 N -2.82 1.31 -0.16 0.00 -1.08 -0.89 -0.47 116.67 112.55 1yhi s ASP 180 Ca 0.04 -0.20 0.02 0.00 -0.52 0.00 0.00 52.55 51.88 1yhi s ASP 180 Cb 0.02 -0.21 0.01 0.00 -1.46 0.00 0.00 42.92 41.29 1yhi s ASP 180 CO -0.11 0.12 -0.21 -2.28 0.52 0.00 0.00 175.17 173.21 1yhi s HIS 181 N -0.13 2.74 -0.08 -5.34 5.65 -0.94 -1.77 115.29 115.41 1yhi s HIS 181 Ca 0.02 -1.50 0.02 0.00 0.25 0.00 0.00 55.06 53.85 1yhi s HIS 181 Cb -0.06 -1.88 0.01 0.00 -1.18 0.00 0.00 32.58 29.48 1yhi s HIS 181 CO -0.00 -0.72 -0.15 -0.47 -0.65 0.00 0.00 174.74 172.75 1yhi s TYR 182 N 1.08 1.81 0.10 3.88 5.04 -1.03 -2.74 117.35 125.50 1yhi s TYR 182 Ca -0.00 -0.75 0.04 0.00 -2.44 0.00 0.00 57.07 53.92 1yhi s TYR 182 Cb -0.14 -1.29 -0.04 0.00 0.35 0.00 0.00 41.96 40.84 1yhi s TYR 182 CO -0.08 -0.36 -0.11 -1.14 -1.34 0.00 0.00 175.55 172.52 1yhi s GLN 183 N 0.71 0.87 -0.07 4.97 0.74 -0.41 -1.90 119.66 124.57 1yhi s GLN 183 Ca -0.13 -1.15 -0.03 0.00 0.05 0.00 0.00 55.36 54.10 1yhi s GLN 183 Cb -0.16 -0.62 0.04 0.00 1.10 0.00 0.00 33.01 33.37 1yhi s GLN 183 CO 0.03 0.10 0.15 -1.14 -0.55 0.00 0.00 175.29 173.89 1yhi s GLN 184 N -2.67 0.10 -0.06 1.67 -0.44 -0.60 -1.97 119.66 115.68 1yhi s GLN 184 Ca 0.05 0.37 0.05 0.00 -2.50 0.00 0.00 55.36 53.33 1yhi s GLN 184 Cb -0.04 -0.17 -0.02 0.00 -1.64 0.00 0.00 33.01 31.14 1yhi s GLN 184 CO 0.01 -0.16 -0.20 -0.80 0.50 0.00 0.00 175.29 174.64 1yhi s ASN 185 N 1.16 3.53 -0.04 6.67 -0.87 -0.92 -1.73 114.94 122.73 1yhi s ASN 185 Ca -0.09 -0.37 0.01 0.00 -1.57 0.00 0.00 52.86 50.84 1yhi s ASN 185 Cb -0.11 -0.90 0.02 0.00 -0.02 0.00 0.00 41.25 40.24 1yhi s ASN 185 CO -0.06 0.27 -0.04 -0.89 -2.57 0.00 0.00 177.10 173.81 1yhi s THR 186 N -0.32 0.53 0.53 1.60 2.01 -0.73 -3.09 115.64 116.17 1yhi s THR 186 Ca 0.02 -0.12 -0.21 0.00 0.31 0.00 0.00 61.69 61.69 1yhi s THR 186 Cb -0.13 -0.56 -0.06 0.00 0.01 0.00 0.00 72.50 71.77 1yhi s THR 186 CO 0.02 0.22 1.23 -2.16 -0.69 0.00 0.00 174.62 173.25 1yhi s PRO 187 N 0.93 3.34 -0.12 4.92 0.04 -1.26 -1.10 135.00 141.75 1yhi s PRO 187 Ca -0.11 1.92 -0.17 0.00 0.04 0.00 0.00 61.00 62.68 1yhi s PRO 187 Cb -0.14 -2.21 -0.26 0.00 0.04 0.00 0.00 34.50 31.92 1yhi s PRO 187 CO 0.00 -0.93 0.52 0.82 0.04 0.00 0.00 177.00 177.45 1yhi h ILE 188 N 1.45 1.05 -4.40 0.56 2.04 -1.75 -3.46 117.51 113.00 1yhi h ILE 188 Ca -0.50 -2.37 -0.44 0.00 1.00 0.00 0.00 64.86 62.55 1yhi h ILE 188 Cb 1.28 2.69 0.15 0.00 -0.74 0.00 0.00 36.82 40.19 1yhi h ILE 188 CO 0.58 0.66 0.32 0.61 0.00 0.00 0.00 178.15 180.32 1yhi n GLY 189 N 1.71 -0.80 0.91 5.37 0.00 -1.26 -5.03 105.19 106.09 1yhi n GLY 189 Ca -0.25 -1.81 0.06 0.00 0.00 0.00 0.00 46.02 44.02 1yhi n GLY 189 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1yhi n ASP 190 N -3.55 3.61 -4.60 1.61 3.85 -1.26 -5.03 116.55 111.18 1yhi n ASP 190 Ca 0.17 -3.14 -0.25 0.00 -0.71 0.00 0.00 54.79 50.85 1yhi n ASP 190 Cb 0.58 -0.56 0.12 0.00 -1.35 0.00 0.00 41.12 39.91 1yhi n ASP 190 CO 0.00 0.00 0.00 -0.83 -1.01 0.00 0.00 177.20 175.36 1yhi s GLY 191 N -2.06 1.76 0.41 6.12 0.00 -1.26 -5.07 107.32 107.21 1yhi s GLY 191 Ca 0.42 -1.55 -0.24 0.00 0.00 0.00 0.00 44.72 43.35 1yhi s GLY 191 CO 0.07 -0.97 1.04 2.56 0.00 0.00 0.00 173.10 175.81 1yhi s PRO 192 N -5.28 4.14 0.15 2.90 0.04 -1.26 -5.08 135.00 130.61 1yhi s PRO 192 Ca 0.67 1.49 0.03 0.00 0.04 0.00 0.00 61.00 63.23 1yhi s PRO 192 Cb -0.06 -2.50 -0.04 0.00 0.04 0.00 0.00 34.50 31.94 1yhi s PRO 192 CO 0.46 -0.16 -0.06 0.14 0.04 0.00 0.00 177.00 177.43 1yhi s VAL 193 N -1.70 0.91 -0.23 -0.36 -7.23 -1.26 -4.76 120.40 105.77 1yhi s VAL 193 Ca 0.59 -2.01 -0.14 0.00 -1.81 0.00 0.00 61.98 58.61 1yhi s VAL 193 Cb -0.21 -1.93 -0.04 0.00 0.56 0.00 0.00 36.38 34.76 1yhi s VAL 193 CO 0.26 -0.66 0.30 -0.76 -0.31 0.00 0.00 175.10 173.93 1yhi s LEU 194 N -3.15 4.12 -0.35 1.32 1.43 -1.26 -5.07 118.68 115.71 1yhi s LEU 194 Ca 0.19 0.32 -0.12 0.00 -1.03 0.00 0.00 54.13 53.48 1yhi s LEU 194 Cb 0.04 -2.34 -0.00 0.00 0.03 0.00 0.00 46.19 43.93 1yhi s LEU 194 CO 0.01 -0.03 0.23 -0.76 0.23 0.00 0.00 176.35 176.03 1yhi s LEU 195 N 1.31 4.59 0.70 1.79 1.43 -1.26 -4.29 118.68 122.95 1yhi s LEU 195 Ca 0.14 -0.60 -0.10 0.00 -1.03 0.00 0.00 54.13 52.54 1yhi s LEU 195 Cb -0.14 -2.11 0.03 0.00 0.03 0.00 0.00 46.19 44.00 1yhi s LEU 195 CO 0.07 -0.29 1.07 -2.16 0.23 0.00 0.00 176.35 175.27 1yhi s PRO 196 N 1.68 2.70 0.50 1.29 0.04 -1.26 -4.99 135.00 134.95 1yhi s PRO 196 Ca 0.05 0.28 0.00 0.00 0.04 0.00 0.00 61.00 61.38 1yhi s PRO 196 Cb -0.18 -2.07 0.01 0.00 0.04 0.00 0.00 34.50 32.31 1yhi s PRO 196 CO 0.09 -1.07 0.73 -0.51 0.04 0.00 0.00 177.00 176.28 1yhi s ASP 197 N -4.39 5.57 0.13 6.66 1.01 -1.26 -4.10 116.67 120.28 1yhi s ASP 197 Ca 0.58 0.17 -0.31 0.00 0.71 0.00 0.00 52.55 53.69 1yhi s ASP 197 Cb -0.11 -1.24 -0.11 0.00 1.01 0.00 0.00 42.92 42.47 1yhi s ASP 197 CO 0.50 -0.92 1.83 0.59 0.21 0.00 0.00 175.17 177.38 1yhi n ASN 198 N -2.22 4.02 -2.60 0.27 3.02 -1.26 -4.83 115.26 111.66 1yhi n ASN 198 Ca 0.04 0.99 -0.10 0.00 -0.03 0.00 0.00 54.58 55.49 1yhi n ASN 198 Cb 0.59 -1.54 0.00 0.00 -0.61 0.00 0.00 39.78 38.21 1yhi n ASN 198 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1yhi n HIS 199 N 5.50 -1.76 -4.12 3.10 1.44 -1.12 -5.01 115.22 113.25 1yhi n HIS 199 Ca 0.18 -1.78 -0.09 0.00 -2.01 0.00 0.00 57.72 54.02 1yhi n HIS 199 Cb 0.37 0.64 -0.10 0.00 0.12 0.00 0.00 29.99 31.02 1yhi n HIS 199 CO 0.00 0.00 0.00 1.52 -2.81 0.00 0.00 176.34 175.05 1yhi s TYR 200 N -3.24 0.75 -0.21 -1.40 -0.85 -0.94 -1.53 117.35 109.92 1yhi s TYR 200 Ca 0.19 -1.16 0.01 0.00 -0.52 0.00 0.00 57.07 55.59 1yhi s TYR 200 Cb -0.03 -0.43 0.03 0.00 0.38 0.00 0.00 41.96 41.92 1yhi s TYR 200 CO 0.14 -0.50 -0.16 -0.51 -1.52 0.00 0.00 175.55 172.99 1yhi s LEU 201 N -3.01 2.62 -0.17 -3.49 1.43 -0.68 -1.16 118.68 114.22 1yhi s LEU 201 Ca 0.20 -0.89 -0.24 0.00 -1.03 0.00 0.00 54.13 52.16 1yhi s LEU 201 Cb 0.07 -1.52 -0.02 0.00 0.03 0.00 0.00 46.19 44.76 1yhi s LEU 201 CO -0.01 -0.07 0.78 -0.55 0.23 0.00 0.00 176.35 176.73 1yhi s SER 202 N 1.24 6.91 0.09 2.29 0.15 -0.03 -1.87 113.70 122.47 1yhi s SER 202 Ca 0.00 1.11 0.07 0.00 0.70 0.00 0.00 55.95 57.83 1yhi s SER 202 Cb -0.15 -2.43 -0.03 0.00 -1.71 0.00 0.00 66.02 61.69 1yhi s SER 202 CO -0.10 -0.35 -0.17 0.42 1.20 0.00 0.00 173.24 174.23 1yhi s THR 203 N 2.01 1.42 -0.05 6.45 -4.23 -0.63 -1.99 115.64 118.62 1yhi s THR 203 Ca 0.36 -1.47 -0.03 0.00 -1.18 0.00 0.00 61.69 59.38 1yhi s THR 203 Cb -0.16 -1.35 0.03 0.00 1.34 0.00 0.00 72.50 72.35 1yhi s THR 203 CO 0.12 -0.17 0.11 0.00 -0.54 0.00 0.00 174.62 174.14 1yhi s GLN 204 N -1.93 0.08 0.17 3.99 -2.07 -0.99 -2.62 119.66 116.29 1yhi s GLN 204 Ca 0.03 0.27 0.07 0.00 -1.82 0.00 0.00 55.36 53.91 1yhi s GLN 204 Cb -0.09 -0.12 -0.04 0.00 -1.09 0.00 0.00 33.01 31.66 1yhi s GLN 204 CO 0.03 -0.12 -0.14 -1.12 -1.32 0.00 0.00 175.29 172.63 1yhi s SER 205 N 0.80 2.30 -0.08 12.60 0.01 -1.26 -2.32 113.70 125.75 1yhi s SER 205 Ca -0.06 -0.97 -0.03 0.00 1.31 0.00 0.00 55.95 56.20 1yhi s SER 205 Cb -0.08 -0.10 0.05 0.00 0.21 0.00 0.00 66.02 66.10 1yhi s SER 205 CO -0.04 -0.19 0.17 0.00 0.41 0.00 0.00 173.24 173.59 1yhi s ALA 206 N -2.83 -0.25 -0.13 1.44 0.00 -0.81 -4.81 121.76 114.37 1yhi s ALA 206 Ca 0.18 0.66 -0.06 0.00 0.00 0.00 0.00 51.96 52.74 1yhi s ALA 206 Cb -0.01 -0.69 -0.04 0.00 0.00 0.00 0.00 23.12 22.38 1yhi s ALA 206 CO 0.05 -0.40 0.10 -0.51 0.00 0.00 0.00 175.76 175.00 1yhi s LEU 207 N 1.83 4.13 0.37 0.00 1.02 -1.26 -2.46 118.68 122.30 1yhi s LEU 207 Ca -0.02 0.34 -0.03 0.00 0.02 0.00 0.00 54.13 54.44 1yhi s LEU 207 Cb -0.12 -2.00 0.01 0.00 0.02 0.00 0.00 46.19 44.10 1yhi s LEU 207 CO -0.06 0.36 0.52 -0.94 0.02 0.00 0.00 176.35 176.25 1yhi s SER 208 N -0.73 0.98 0.14 2.29 1.04 -0.81 -4.99 113.70 111.61 1yhi s SER 208 Ca 0.13 -1.52 0.08 0.00 0.48 0.00 0.00 55.95 55.11 1yhi s SER 208 Cb -0.12 0.71 -0.04 0.00 0.10 0.00 0.00 66.02 66.67 1yhi s SER 208 CO 0.03 -1.38 -0.18 -0.54 0.98 0.00 0.00 173.24 172.15 1yhi s LYS 209 N -2.81 1.16 -0.27 4.02 -0.14 -1.26 -2.40 119.74 118.04 1yhi s LYS 209 Ca 0.30 -1.29 -0.17 0.00 -1.36 0.00 0.00 55.97 53.44 1yhi s LYS 209 Cb -0.01 -1.23 -0.03 0.00 -1.68 0.00 0.00 37.83 34.88 1yhi s LYS 209 CO 0.21 0.26 0.49 0.34 -0.76 0.00 0.00 175.35 175.89 1yhi s ASP 210 N -2.40 6.40 0.54 2.83 -1.08 -1.26 -4.99 116.67 116.71 1yhi s ASP 210 Ca 0.11 0.44 0.36 0.00 -0.52 0.00 0.00 52.55 52.94 1yhi s ASP 210 Cb -0.07 -2.27 1.80 0.00 -1.46 0.00 0.00 42.92 40.92 1yhi s ASP 210 CO 0.05 -0.29 2.09 1.55 0.52 0.00 0.00 175.17 179.09 1yhi h PRO 211 N 8.08 0.00 -0.19 4.34 0.13 -2.05 -2.90 132.00 139.42 1yhi h PRO 211 Ca -0.29 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.84 1yhi h PRO 211 Cb 1.14 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.27 1yhi h PRO 211 CO 0.71 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.57 1yhi n ASN 212 N -2.88 3.00 -4.58 1.44 3.02 -1.26 -4.96 115.26 109.04 1yhi n ASN 212 Ca -0.01 -1.94 -0.35 0.00 -0.03 0.00 0.00 54.58 52.24 1yhi n ASN 212 Cb 0.15 -0.11 -0.11 0.00 -0.61 0.00 0.00 39.78 39.10 1yhi n ASN 212 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 1yhi s GLU 213 N -1.78 3.89 0.01 3.52 2.56 -1.10 -5.00 118.70 120.81 1yhi s GLU 213 Ca 0.34 -0.37 0.22 0.00 0.00 0.00 0.00 54.97 55.15 1yhi s GLU 213 Cb 0.21 -3.28 -0.26 0.00 2.00 0.00 0.00 34.13 32.79 1yhi s GLU 213 CO 0.31 0.12 0.62 1.63 -0.56 0.00 0.00 175.26 177.38 1yhi n LYS 214 N 4.02 0.58 -1.75 4.30 4.01 -1.26 -4.93 118.16 123.13 1yhi n LYS 214 Ca -0.16 -0.13 -0.31 0.00 -0.51 0.00 0.00 58.31 57.20 1yhi n LYS 214 Cb 0.52 -1.56 0.03 0.00 -0.51 0.00 0.00 35.03 33.51 1yhi n LYS 214 CO 0.00 0.00 0.00 1.03 -1.11 0.00 0.00 177.40 177.32 1yhi s ARG 215 N -3.44 3.21 -0.08 1.97 0.52 -1.26 -4.99 118.95 114.89 1yhi s ARG 215 Ca -0.05 0.94 -0.30 0.00 -0.52 0.00 0.00 55.73 55.80 1yhi s ARG 215 Cb 0.14 -2.03 -0.04 0.00 0.52 0.00 0.00 34.95 33.54 1yhi s ARG 215 CO 0.88 -0.88 1.52 0.34 0.02 0.00 0.00 175.30 177.18 1yhi s ASP 216 N -3.72 6.76 0.35 0.23 2.15 -1.26 -4.98 116.67 116.20 1yhi s ASP 216 Ca 0.58 2.07 -0.04 0.00 0.43 0.00 0.00 52.55 55.59 1yhi s ASP 216 Cb -0.13 -2.54 0.01 0.00 -0.30 0.00 0.00 42.92 39.96 1yhi s ASP 216 CO 0.51 -0.86 0.52 -1.38 -0.17 0.00 0.00 175.17 173.79 1yhi s HIS 217 N 3.73 0.93 -0.21 -5.34 -3.43 -1.26 -2.39 115.29 107.31 1yhi s HIS 217 Ca 0.67 -1.22 -0.15 0.00 -0.80 0.00 0.00 55.06 53.56 1yhi s HIS 217 Cb -0.30 0.05 0.06 0.00 -1.43 0.00 0.00 32.58 30.96 1yhi s HIS 217 CO 0.25 -1.21 0.53 1.41 -2.00 0.00 0.00 174.74 173.72 1yhi s MET 218 N -2.93 0.56 -0.14 -0.38 1.75 -0.94 -5.02 119.30 112.20 1yhi s MET 218 Ca 0.28 0.86 -0.02 0.00 -1.25 0.00 0.00 55.69 55.56 1yhi s MET 218 Cb -0.01 0.16 -0.02 0.00 2.84 0.00 0.00 34.83 37.79 1yhi s MET 218 CO 0.19 -0.12 -0.07 0.08 -0.65 0.00 0.00 175.02 174.45 1yhi s VAL 219 N 0.96 3.57 -0.04 10.11 1.01 -1.01 -1.37 120.40 133.63 1yhi s VAL 219 Ca -0.05 -0.48 0.05 0.00 0.00 0.00 0.00 61.98 61.50 1yhi s VAL 219 Cb -0.06 -2.53 -0.01 0.00 0.00 0.00 0.00 36.38 33.78 1yhi s VAL 219 CO -0.08 0.51 -0.20 -0.22 0.00 0.00 0.00 175.10 175.11 1yhi s LEU 220 N 0.28 1.99 -0.07 3.92 2.96 -0.49 -1.93 118.68 125.33 1yhi s LEU 220 Ca -0.06 -0.39 0.02 0.00 -0.22 0.00 0.00 54.13 53.48 1yhi s LEU 220 Cb -0.15 -1.09 0.01 0.00 0.50 0.00 0.00 46.19 45.47 1yhi s LEU 220 CO 0.04 0.21 -0.13 -0.22 -1.32 0.00 0.00 176.35 174.92 1yhi s LEU 221 N -0.18 1.66 0.01 -0.68 2.96 -1.03 -1.86 118.68 119.57 1yhi s LEU 221 Ca 0.00 -0.33 -0.00 0.00 -0.22 0.00 0.00 54.13 53.58 1yhi s LEU 221 Cb -0.11 -0.89 -0.01 0.00 0.50 0.00 0.00 46.19 45.69 1yhi s LEU 221 CO 0.02 0.04 -0.01 -0.70 -1.32 0.00 0.00 176.35 174.37 1yhi s GLU 222 N 0.70 0.21 -0.11 1.98 2.12 -0.96 -1.93 118.70 120.72 1yhi s GLU 222 Ca -0.14 -0.38 0.02 0.00 0.36 0.00 0.00 54.97 54.83 1yhi s GLU 222 Cb -0.16 0.08 0.02 0.00 0.26 0.00 0.00 34.13 34.33 1yhi s GLU 222 CO 0.03 -0.04 -0.15 -0.06 -0.54 0.00 0.00 175.26 174.51 1yhi s PHE 223 N -0.94 1.97 -0.03 5.30 0.40 -0.98 -2.32 117.98 121.38 1yhi s PHE 223 Ca -0.10 -0.94 0.01 0.00 -0.60 0.00 0.00 56.93 55.30 1yhi s PHE 223 Cb -0.06 -1.43 0.01 0.00 0.51 0.00 0.00 43.02 42.05 1yhi s PHE 223 CO -0.01 -0.49 -0.06 0.08 0.70 0.00 0.00 175.22 175.45 1yhi s VAL 224 N 1.03 0.57 -0.01 -0.44 1.01 -0.86 -2.35 120.40 119.36 1yhi s VAL 224 Ca -0.06 -0.19 0.00 0.00 0.00 0.00 0.00 61.98 61.73 1yhi s VAL 224 Cb -0.15 -0.56 0.01 0.00 0.00 0.00 0.00 36.38 35.68 1yhi s VAL 224 CO -0.02 0.21 -0.00 -0.89 0.00 0.00 0.00 175.10 174.40 1yhi s THR 225 N 0.57 0.08 0.22 3.92 2.01 -0.84 -2.68 115.64 118.92 1yhi s THR 225 Ca -0.08 0.01 -0.27 0.00 0.31 0.00 0.00 61.69 61.67 1yhi s THR 225 Cb -0.11 -0.11 -0.09 0.00 0.01 0.00 0.00 72.50 72.20 1yhi s THR 225 CO 0.00 0.05 0.86 0.00 -0.69 0.00 0.00 174.62 174.85 1yhi s ALA 226 N 0.30 3.37 0.01 7.40 0.00 -0.91 -0.85 121.76 131.08 1yhi s ALA 226 Ca -0.03 0.48 -0.01 0.00 0.00 0.00 0.00 51.96 52.40 1yhi s ALA 226 Cb -0.04 -3.09 -0.01 0.00 0.00 0.00 0.00 23.12 19.98 1yhi s ALA 226 CO -0.01 0.24 -0.00 0.00 0.00 0.00 0.00 175.76 175.99 1yhi s ALA 227 N -1.25 0.04 -2.30 0.00 0.00 -0.30 -4.67 121.76 113.27 1yhi s ALA 227 Ca 0.40 -0.41 0.30 0.00 0.00 0.00 0.00 51.96 52.25 1yhi s ALA 227 Cb -0.23 0.11 1.39 0.00 0.00 0.00 0.00 23.12 24.39 1yhi s ALA 227 CO 0.28 -0.13 1.94 0.41 0.00 0.00 0.00 175.76 178.25