#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2b59 s TYR 9 N 0.00 1.85 -0.17 1.61 2.02 0.56 -4.58 117.35 118.64 2b59 s TYR 9 Ca 0.00 -0.85 -0.03 0.00 -0.37 0.00 0.00 57.07 55.82 2b59 s TYR 9 Cb 0.00 -1.80 -0.02 0.00 -0.40 0.00 0.00 41.96 39.74 2b59 s TYR 9 CO 0.00 -0.11 -0.07 0.15 -1.57 0.00 0.00 175.55 173.96 2b59 s LYS 10 N -4.07 3.48 -0.29 -0.62 1.02 -1.26 -1.10 119.74 116.90 2b59 s LYS 10 Ca 0.24 -0.61 -0.04 0.00 0.02 0.00 0.00 55.97 55.57 2b59 s LYS 10 Cb 0.00 -2.85 0.03 0.00 -0.52 0.00 0.00 37.83 34.48 2b59 s LYS 10 CO 0.14 0.09 0.03 0.08 -0.92 0.00 0.00 175.35 174.76 2b59 s VAL 11 N 0.73 3.43 0.32 3.17 1.01 0.49 -1.14 120.40 128.41 2b59 s VAL 11 Ca -0.03 -0.98 0.03 0.00 0.00 0.00 0.00 61.98 61.00 2b59 s VAL 11 Cb -0.15 -2.82 -0.04 0.00 0.00 0.00 0.00 36.38 33.37 2b59 s VAL 11 CO 0.02 0.05 0.11 -0.94 0.00 0.00 0.00 175.10 174.34 2b59 s SER 12 N 1.39 1.87 0.00 3.32 1.04 -0.62 -0.47 113.70 120.23 2b59 s SER 12 Ca -0.00 -1.50 0.00 0.00 0.48 0.00 0.00 55.95 54.93 2b59 s SER 12 Cb -0.18 0.25 0.00 0.00 0.10 0.00 0.00 66.02 66.19 2b59 s SER 12 CO -0.00 -0.79 0.00 0.61 0.98 0.00 0.00 173.24 174.03 2b59 n GLY 13 N -0.64 -1.67 3.29 7.32 0.00 -0.96 0.70 105.19 113.23 2b59 n GLY 13 Ca -0.01 -1.09 -0.26 0.00 0.00 0.00 0.00 46.02 44.67 2b59 n GLY 13 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2b59 s TYR 14 N -2.39 1.89 0.02 1.61 1.51 -1.26 -1.75 117.35 116.99 2b59 s TYR 14 Ca 0.00 -0.40 0.06 0.00 -1.01 0.00 0.00 57.07 55.73 2b59 s TYR 14 Cb 0.00 -1.08 -0.02 0.00 -0.11 0.00 0.00 41.96 40.75 2b59 s TYR 14 CO 0.00 0.17 -0.19 0.42 -1.11 0.00 0.00 175.55 174.84 2b59 s ILE 15 N -0.98 1.50 -0.03 2.71 1.01 0.66 -1.12 121.20 124.95 2b59 s ILE 15 Ca 0.08 -1.03 -0.01 0.00 0.00 0.00 0.00 60.65 59.69 2b59 s ILE 15 Cb -0.10 -1.29 0.03 0.00 0.01 0.00 0.00 42.46 41.11 2b59 s ILE 15 CO 0.03 0.23 0.04 -0.22 0.00 0.00 0.00 174.94 175.03 2b59 s LEU 16 N -0.93 0.71 0.49 2.97 2.96 0.42 -4.61 118.68 120.69 2b59 s LEU 16 Ca 0.06 0.06 -0.22 0.00 -0.22 0.00 0.00 54.13 53.81 2b59 s LEU 16 Cb -0.08 -0.09 -0.07 0.00 0.50 0.00 0.00 46.19 46.45 2b59 s LEU 16 CO 0.01 -0.18 1.18 -2.16 -1.32 0.00 0.00 176.35 173.89 2b59 s PRO 17 N 1.50 3.59 -1.31 0.98 0.04 -1.26 -2.12 135.00 136.42 2b59 s PRO 17 Ca -0.04 1.81 -0.12 0.00 0.04 0.00 0.00 61.00 62.70 2b59 s PRO 17 Cb -0.13 -2.31 0.13 0.00 0.04 0.00 0.00 34.50 32.24 2b59 s PRO 17 CO -0.03 -0.70 1.88 -3.47 0.04 0.00 0.00 177.00 174.72 2b59 n ASP 18 N -0.72 4.84 -3.60 6.66 4.64 -0.42 -4.82 116.55 123.12 2b59 n ASP 18 Ca 0.09 -3.02 -0.05 0.00 -1.38 0.00 0.00 54.79 50.43 2b59 n ASP 18 Cb 0.48 -1.55 -0.02 0.00 -1.04 0.00 0.00 41.12 39.00 2b59 n ASP 18 CO 0.00 0.00 0.00 0.72 -0.82 0.00 0.00 177.20 177.10 2b59 s PHE 19 N 1.39 -0.20 0.18 -0.67 -0.12 -1.26 -4.87 117.98 112.43 2b59 s PHE 19 Ca 0.42 0.04 -0.20 0.00 -0.05 0.00 0.00 56.93 57.15 2b59 s PHE 19 Cb 0.08 0.56 -0.08 0.00 -0.63 0.00 0.00 43.02 42.96 2b59 s PHE 19 CO -0.01 -0.51 0.70 -1.12 -0.05 0.00 0.00 175.22 174.22 2b59 s SER 20 N -2.62 7.10 0.02 1.98 0.01 -1.26 -5.08 113.70 113.86 2b59 s SER 20 Ca 0.09 1.41 -0.22 0.00 1.31 0.00 0.00 55.95 58.54 2b59 s SER 20 Cb -0.00 -2.41 0.05 0.00 0.21 0.00 0.00 66.02 63.86 2b59 s SER 20 CO -0.04 0.11 0.51 0.72 0.41 0.00 0.00 173.24 174.94 2b59 s PHE 21 N -1.39 -0.41 0.69 2.43 -0.71 -1.26 -4.91 117.98 112.42 2b59 s PHE 21 Ca 0.39 0.54 -0.06 0.00 -1.04 0.00 0.00 56.93 56.76 2b59 s PHE 21 Cb -0.18 0.31 0.06 0.00 -1.21 0.00 0.00 43.02 41.99 2b59 s PHE 21 CO 0.22 -0.59 1.00 0.16 -1.34 0.00 0.00 175.22 174.66 2b59 s ASP 22 N -1.74 4.85 0.40 1.98 1.47 -1.26 -4.92 116.67 117.45 2b59 s ASP 22 Ca -0.07 0.43 0.11 0.00 1.18 0.00 0.00 52.55 54.19 2b59 s ASP 22 Cb -0.01 -1.10 0.91 0.00 -0.34 0.00 0.00 42.92 42.37 2b59 s ASP 22 CO 0.01 -1.56 1.95 0.00 0.68 0.00 0.00 175.17 176.25 2b59 h ALA 23 N -0.55 1.90 -0.05 2.11 0.00 -2.02 -2.62 119.26 118.01 2b59 h ALA 23 Ca -0.44 -0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.37 2b59 h ALA 23 Cb 1.31 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.97 2b59 h ALA 23 CO 0.60 -0.05 -0.37 1.79 0.00 0.00 0.00 179.25 181.22 2b59 h THR 24 N 0.56 1.28 0.00 0.00 1.35 -2.02 -3.16 112.91 110.92 2b59 h THR 24 Ca 0.32 -1.34 0.00 0.00 -0.55 0.00 0.00 66.41 64.84 2b59 h THR 24 Cb 0.51 1.65 0.00 0.00 -1.73 0.00 0.00 68.15 68.58 2b59 h THR 24 CO -0.11 0.39 -0.91 0.55 -0.25 0.00 0.00 175.52 175.19 2b59 n VAL 25 N -4.08 0.10 -0.26 6.82 3.14 -1.02 -4.48 118.33 118.55 2b59 n VAL 25 Ca -0.02 -0.15 0.03 0.00 -2.96 0.00 0.00 64.34 61.24 2b59 n VAL 25 Cb 0.42 0.35 0.11 0.00 -1.06 0.00 0.00 33.84 33.66 2b59 n VAL 25 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2b59 h ALA 26 N 2.72 0.59 0.00 1.55 0.00 -1.45 0.16 119.26 122.82 2b59 h ALA 26 Ca 0.00 0.28 -0.01 0.00 0.00 0.00 0.00 54.91 55.18 2b59 h ALA 26 Cb 0.64 0.54 -0.00 0.00 0.00 0.00 0.00 17.79 18.97 2b59 h ALA 26 CO 0.00 -0.42 -0.05 -1.00 0.00 0.00 0.00 179.25 177.79 2b59 h PRO 27 N 0.02 0.00 0.20 0.00 0.13 -1.79 -1.81 132.00 128.76 2b59 h PRO 27 Ca 0.38 0.00 -0.32 0.00 -0.87 0.00 0.00 66.00 65.19 2b59 h PRO 27 Cb 0.62 0.00 0.03 0.00 0.13 0.00 0.00 31.00 31.78 2b59 h PRO 27 CO -0.76 0.05 -1.39 -0.07 -0.23 0.00 0.00 178.00 175.60 2b59 h LEU 28 N 0.00 0.78 0.00 1.56 3.38 -1.00 -3.25 115.31 116.78 2b59 h LEU 28 Ca -0.00 -0.81 0.00 0.00 0.09 0.00 0.00 57.88 57.16 2b59 h LEU 28 Cb 0.10 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.60 2b59 h LEU 28 CO 0.01 1.62 -0.45 -0.37 0.09 0.00 0.00 178.44 179.34 2b59 h VAL 29 N 0.16 0.00 0.00 1.22 -1.51 -1.10 -3.33 116.25 111.70 2b59 h VAL 29 Ca -0.22 -0.89 0.00 0.00 -1.23 0.00 0.00 66.70 64.36 2b59 h VAL 29 Cb 2.08 1.65 0.00 0.00 -2.13 0.00 0.00 31.29 32.89 2b59 h VAL 29 CO 0.26 0.00 -0.92 0.29 -1.23 0.00 0.00 177.57 175.96 2b59 n LYS 30 N -2.75 0.29 -3.30 5.19 5.02 -0.71 -4.66 118.16 117.25 2b59 n LYS 30 Ca 0.03 0.02 -0.24 0.00 -2.02 0.00 0.00 58.31 56.10 2b59 n LYS 30 Cb 0.52 -1.62 -0.01 0.00 -0.02 0.00 0.00 35.03 33.90 2b59 n LYS 30 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2b59 s ALA 31 N -3.19 3.69 0.00 7.82 0.00 -1.23 -3.79 121.76 125.07 2b59 s ALA 31 Ca 0.04 -0.91 0.00 0.00 0.00 0.00 0.00 51.96 51.10 2b59 s ALA 31 Cb 0.14 -2.14 0.00 0.00 0.00 0.00 0.00 23.12 21.13 2b59 s ALA 31 CO 0.78 -0.07 0.00 0.41 0.00 0.00 0.00 175.76 176.88 2b59 n GLY 32 N -1.84 0.70 3.63 0.00 0.00 -1.04 -4.97 105.19 101.67 2b59 n GLY 32 Ca -0.04 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.55 2b59 n GLY 32 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2b59 s PHE 33 N -2.60 3.17 -0.17 1.61 0.08 -1.26 -4.74 117.98 114.07 2b59 s PHE 33 Ca 0.00 1.12 -0.24 0.00 0.12 0.00 0.00 56.93 57.93 2b59 s PHE 33 Cb 0.00 -3.57 -0.02 0.00 -0.57 0.00 0.00 43.02 38.86 2b59 s PHE 33 CO 0.00 -0.71 0.77 0.21 -0.10 0.00 0.00 175.22 175.39 2b59 s LYS 34 N 3.49 4.29 -0.22 0.44 2.20 -0.08 -1.49 119.74 128.37 2b59 s LYS 34 Ca 0.43 0.91 -0.04 0.00 -0.36 0.00 0.00 55.97 56.91 2b59 s LYS 34 Cb -0.13 -3.56 -0.01 0.00 -1.51 0.00 0.00 37.83 32.62 2b59 s LYS 34 CO 0.14 -0.27 -0.05 0.08 -0.36 0.00 0.00 175.35 174.89 2b59 s VAL 35 N 1.98 3.34 0.04 4.02 1.01 0.11 -1.43 120.40 129.46 2b59 s VAL 35 Ca 0.36 -0.51 0.05 0.00 0.00 0.00 0.00 61.98 61.88 2b59 s VAL 35 Cb -0.16 -2.51 -0.02 0.00 0.00 0.00 0.00 36.38 33.68 2b59 s VAL 35 CO 0.12 0.43 -0.15 -1.83 0.00 0.00 0.00 175.10 173.68 2b59 s GLU 36 N 1.43 0.98 -0.44 2.72 -1.05 -0.48 -1.23 118.70 120.63 2b59 s GLU 36 Ca 0.05 -0.78 -0.22 0.00 -0.15 0.00 0.00 54.97 53.87 2b59 s GLU 36 Cb -0.14 -1.00 0.02 0.00 -0.44 0.00 0.00 34.13 32.57 2b59 s GLU 36 CO -0.03 0.25 0.72 0.42 0.95 0.00 0.00 175.26 177.57 2b59 s ILE 37 N -0.85 4.73 0.18 1.83 1.01 -0.75 -0.77 121.20 126.58 2b59 s ILE 37 Ca 0.02 0.34 -0.33 0.00 0.00 0.00 0.00 60.65 60.68 2b59 s ILE 37 Cb -0.08 -4.26 -0.14 0.00 0.01 0.00 0.00 42.46 37.99 2b59 s ILE 37 CO 0.01 -0.64 1.52 0.52 0.00 0.00 0.00 174.94 176.36 2b59 n VAL 38 N 5.98 0.28 -0.52 2.92 0.31 0.93 -1.85 118.33 126.39 2b59 n VAL 38 Ca 0.01 -0.07 0.00 0.00 -0.01 0.00 0.00 64.34 64.27 2b59 n VAL 38 Cb 0.48 -1.49 0.00 0.00 -0.91 0.00 0.00 33.84 31.92 2b59 n VAL 38 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2b59 n GLY 39 N 3.00 0.75 2.38 2.92 0.00 -1.26 -4.65 105.19 108.33 2b59 n GLY 39 Ca 0.15 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.01 2b59 n GLY 39 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2b59 n THR 40 N -2.32 0.00 -1.32 2.61 -2.24 -0.77 -5.04 114.28 105.20 2b59 n THR 40 Ca 0.00 -1.75 0.04 0.00 -2.27 0.00 0.00 64.05 60.07 2b59 n THR 40 Cb 0.00 0.77 0.20 0.00 -2.10 0.00 0.00 70.33 69.20 2b59 n THR 40 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2b59 n GLU 41 N -0.55 1.81 -3.71 -0.78 1.02 -1.26 -4.85 120.64 112.32 2b59 n GLU 41 Ca 0.01 -3.01 -0.35 0.00 -0.02 0.00 0.00 57.16 53.79 2b59 n GLU 41 Cb 0.44 -1.69 -0.08 0.00 -0.02 0.00 0.00 31.44 30.10 2b59 n GLU 41 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2b59 s LEU 42 N -3.08 4.21 0.10 -4.62 1.43 -1.26 -5.06 118.68 110.40 2b59 s LEU 42 Ca 0.39 0.26 -0.26 0.00 -1.03 0.00 0.00 54.13 53.49 2b59 s LEU 42 Cb 0.35 -2.12 0.08 0.00 0.03 0.00 0.00 46.19 44.53 2b59 s LEU 42 CO 0.00 0.17 1.09 -0.72 0.23 0.00 0.00 176.35 177.12 2b59 s TYR 43 N 0.37 -0.06 0.14 0.29 -0.85 -1.26 -1.81 117.35 114.16 2b59 s TYR 43 Ca 0.09 -0.19 -0.24 0.00 -0.52 0.00 0.00 57.07 56.21 2b59 s TYR 43 Cb -0.11 0.62 0.07 0.00 0.38 0.00 0.00 41.96 42.92 2b59 s TYR 43 CO -0.01 -0.65 0.71 0.00 -1.52 0.00 0.00 175.55 174.07 2b59 s ALA 44 N -2.80 -1.60 -0.09 9.51 0.00 -0.36 -4.85 121.76 121.57 2b59 s ALA 44 Ca 0.15 0.47 0.05 0.00 0.00 0.00 0.00 51.96 52.62 2b59 s ALA 44 Cb 0.00 0.76 -0.00 0.00 0.00 0.00 0.00 23.12 23.88 2b59 s ALA 44 CO 0.01 -0.81 -0.24 0.08 0.00 0.00 0.00 175.76 174.80 2b59 s VAL 45 N -3.60 2.06 0.50 0.00 1.01 -1.26 0.04 120.40 119.15 2b59 s VAL 45 Ca 0.04 -1.03 -0.23 0.00 0.00 0.00 0.00 61.98 60.76 2b59 s VAL 45 Cb -0.02 -1.77 -0.07 0.00 0.00 0.00 0.00 36.38 34.53 2b59 s VAL 45 CO -0.08 0.56 1.23 0.35 0.00 0.00 0.00 175.10 177.16 2b59 n THR 46 N 3.36 3.25 -2.27 3.92 -2.24 -0.56 -4.81 114.28 114.93 2b59 n THR 46 Ca -0.19 -0.50 -0.11 0.00 -2.27 0.00 0.00 64.05 60.98 2b59 n THR 46 Cb 0.53 -1.49 0.06 0.00 -2.10 0.00 0.00 70.33 67.33 2b59 n THR 46 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2b59 n ASP 47 N -0.41 0.55 0.29 3.42 3.85 -0.33 -2.49 116.55 121.43 2b59 n ASP 47 Ca 0.10 -1.49 0.17 0.00 -0.71 0.00 0.00 54.79 52.85 2b59 n ASP 47 Cb 0.43 -0.33 0.89 0.00 -1.35 0.00 0.00 41.12 40.76 2b59 n ASP 47 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2b59 h ALA 48 N -0.73 1.14 -0.18 2.12 0.00 -1.87 0.06 119.26 119.81 2b59 h ALA 48 Ca -0.16 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.75 2b59 h ALA 48 Cb 0.57 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.36 2b59 h ALA 48 CO 0.16 -0.14 0.00 0.09 0.00 0.00 0.00 179.25 179.36 2b59 n ASN 49 N -2.77 2.43 0.00 0.00 3.02 -1.26 -4.25 115.26 112.42 2b59 n ASN 49 Ca -0.02 -1.82 0.00 0.00 -0.03 0.00 0.00 54.58 52.71 2b59 n ASN 49 Cb 0.20 -0.11 0.00 0.00 -0.61 0.00 0.00 39.78 39.26 2b59 n ASN 49 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2b59 n GLY 50 N 1.29 0.48 3.81 7.41 0.00 0.01 -4.84 105.19 113.36 2b59 n GLY 50 Ca 0.17 -0.20 -0.38 0.00 0.00 0.00 0.00 46.02 45.62 2b59 n GLY 50 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2b59 s TYR 51 N -2.00 3.64 0.06 1.61 5.04 -1.26 -0.24 117.35 124.20 2b59 s TYR 51 Ca 0.00 0.84 0.04 0.00 -2.44 0.00 0.00 57.07 55.51 2b59 s TYR 51 Cb 0.00 -2.27 -0.03 0.00 0.35 0.00 0.00 41.96 40.01 2b59 s TYR 51 CO 0.00 0.54 -0.12 -0.59 -1.34 0.00 0.00 175.55 174.05 2b59 s PHE 52 N -0.64 1.00 -0.18 4.97 -0.12 -0.71 -1.19 117.98 121.11 2b59 s PHE 52 Ca 0.21 -0.48 -0.05 0.00 -0.05 0.00 0.00 56.93 56.57 2b59 s PHE 52 Cb -0.15 -0.57 0.09 0.00 -0.63 0.00 0.00 43.02 41.75 2b59 s PHE 52 CO 0.10 0.00 0.34 -2.00 -0.05 0.00 0.00 175.22 173.61 2b59 s GLU 53 N -1.68 0.25 -0.21 1.99 2.12 -1.26 -2.26 118.70 117.66 2b59 s GLU 53 Ca -0.05 0.76 -0.09 0.00 0.36 0.00 0.00 54.97 55.95 2b59 s GLU 53 Cb -0.10 -0.09 -0.04 0.00 0.26 0.00 0.00 34.13 34.16 2b59 s GLU 53 CO 0.02 -0.38 0.10 0.42 -0.54 0.00 0.00 175.26 174.88 2b59 s ILE 54 N 2.51 5.00 0.32 -3.70 1.01 0.38 -4.83 121.20 121.90 2b59 s ILE 54 Ca 0.03 0.05 0.09 0.00 0.00 0.00 0.00 60.65 60.82 2b59 s ILE 54 Cb -0.13 -3.29 -0.05 0.00 0.01 0.00 0.00 42.46 39.00 2b59 s ILE 54 CO -0.12 0.40 0.07 0.28 0.00 0.00 0.00 174.94 175.58 2b59 s THR 55 N 0.75 3.02 -1.00 2.92 -1.32 -1.26 -0.37 115.64 118.37 2b59 s THR 55 Ca 0.05 -1.82 -0.01 0.00 -1.21 0.00 0.00 61.69 58.71 2b59 s THR 55 Cb -0.13 -2.90 0.00 0.00 -1.51 0.00 0.00 72.50 67.96 2b59 s THR 55 CO 0.02 -0.23 0.08 0.61 -2.21 0.00 0.00 174.62 172.89 2b59 n GLY 56 N -1.04 -0.10 3.64 6.08 0.00 -0.78 -4.93 105.19 108.07 2b59 n GLY 56 Ca -0.04 -0.35 -0.41 0.00 0.00 0.00 0.00 46.02 45.22 2b59 n GLY 56 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2b59 s VAL 57 N -2.67 4.93 0.51 1.61 1.01 -0.26 -4.62 120.40 120.91 2b59 s VAL 57 Ca 0.04 1.33 -0.22 0.00 0.00 0.00 0.00 61.98 63.12 2b59 s VAL 57 Cb -0.02 -4.01 -0.06 0.00 0.00 0.00 0.00 36.38 32.29 2b59 s VAL 57 CO 0.05 0.00 1.29 -2.84 0.00 0.00 0.00 175.10 173.61 2b59 s PRO 58 N 2.52 3.39 0.67 2.72 0.02 -1.26 -0.32 135.00 142.74 2b59 s PRO 58 Ca 0.30 2.08 -0.17 0.00 0.02 0.00 0.00 61.00 63.23 2b59 s PRO 58 Cb -0.16 -2.34 0.00 0.00 0.02 0.00 0.00 34.50 32.03 2b59 s PRO 58 CO 0.08 -0.94 1.25 0.00 -0.33 0.00 0.00 177.00 177.07 2b59 s ALA 59 N -1.38 2.32 -0.35 -1.55 0.00 -1.26 -4.90 121.76 114.64 2b59 s ALA 59 Ca 0.68 1.07 0.06 0.00 0.00 0.00 0.00 51.96 53.76 2b59 s ALA 59 Cb -0.36 -3.51 0.18 0.00 0.00 0.00 0.00 23.12 19.43 2b59 s ALA 59 CO 0.44 -1.61 0.54 1.21 0.00 0.00 0.00 175.76 176.33 2b59 s ASN 60 N -1.64 -0.79 0.36 0.00 3.04 0.21 -5.00 114.94 111.12 2b59 s ASN 60 Ca 0.79 -0.56 0.08 0.00 0.04 0.00 0.00 52.86 53.21 2b59 s ASN 60 Cb -0.33 1.61 0.81 0.00 -1.54 0.00 0.00 41.25 41.80 2b59 s ASN 60 CO 0.40 -0.25 1.90 0.00 -3.04 0.00 0.00 177.10 176.11 2b59 h ALA 61 N 7.50 1.81 -1.79 1.71 0.00 -1.96 -2.68 119.26 123.85 2b59 h ALA 61 Ca 0.01 0.00 -0.66 0.00 0.00 0.00 0.00 54.91 54.25 2b59 h ALA 61 Cb 1.15 -0.14 -0.16 0.00 0.00 0.00 0.00 17.79 18.64 2b59 h ALA 61 CO 0.16 -0.01 0.71 -1.54 0.00 0.00 0.00 179.25 178.57 2b59 s SER 62 N -5.94 6.43 0.27 0.00 1.04 -1.26 -4.77 113.70 109.46 2b59 s SER 62 Ca -0.10 -1.59 -0.12 0.00 0.48 0.00 0.00 55.95 54.62 2b59 s SER 62 Cb 0.21 -2.41 -0.09 0.00 0.10 0.00 0.00 66.02 63.83 2b59 s SER 62 CO 0.78 -1.23 -0.00 0.61 0.98 0.00 0.00 173.24 174.38 2b59 n GLY 63 N 5.47 -1.76 3.93 7.32 0.00 -1.19 -4.91 105.19 114.05 2b59 n GLY 63 Ca 0.12 -0.05 -0.27 0.00 0.00 0.00 0.00 46.02 45.82 2b59 n GLY 63 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2b59 s TYR 64 N -1.09 2.48 -0.15 1.61 1.51 0.26 -4.40 117.35 117.56 2b59 s TYR 64 Ca 0.35 0.39 0.00 0.00 -1.01 0.00 0.00 57.07 56.80 2b59 s TYR 64 Cb -0.34 -3.43 -0.00 0.00 -0.11 0.00 0.00 41.96 38.07 2b59 s TYR 64 CO 0.38 -1.78 -0.15 0.99 -1.11 0.00 0.00 175.55 173.88 2b59 s THR 65 N -3.44 2.74 0.09 -0.71 2.01 -1.26 -0.94 115.64 114.14 2b59 s THR 65 Ca 0.64 -0.75 0.05 0.00 0.31 0.00 0.00 61.69 61.94 2b59 s THR 65 Cb -0.09 -2.16 -0.04 0.00 0.01 0.00 0.00 72.50 70.23 2b59 s THR 65 CO 0.47 0.51 0.01 -0.76 -0.69 0.00 0.00 174.62 174.16 2b59 s LEU 66 N 0.76 3.49 -0.06 4.42 1.02 0.17 -0.05 118.68 128.43 2b59 s LEU 66 Ca -0.06 -0.18 0.02 0.00 0.02 0.00 0.00 54.13 53.94 2b59 s LEU 66 Cb -0.15 -2.21 0.01 0.00 0.02 0.00 0.00 46.19 43.86 2b59 s LEU 66 CO 0.01 0.17 -0.12 -0.75 0.02 0.00 0.00 176.35 175.68 2b59 s LYS 67 N -2.36 1.56 -0.13 1.70 2.20 0.05 -0.89 119.74 121.86 2b59 s LYS 67 Ca 0.26 -0.40 -0.01 0.00 -0.36 0.00 0.00 55.97 55.46 2b59 s LYS 67 Cb -0.12 -1.32 -0.02 0.00 -1.51 0.00 0.00 37.83 34.86 2b59 s LYS 67 CO 0.19 0.05 -0.09 0.42 -0.36 0.00 0.00 175.35 175.56 2b59 s ILE 68 N 0.57 3.44 0.06 5.43 -1.09 0.22 -1.38 121.20 128.46 2b59 s ILE 68 Ca -0.12 -0.53 -0.05 0.00 -2.23 0.00 0.00 60.65 57.72 2b59 s ILE 68 Cb -0.15 -2.47 -0.02 0.00 -1.58 0.00 0.00 42.46 38.25 2b59 s ILE 68 CO 0.03 0.52 0.09 -0.94 -1.23 0.00 0.00 174.94 173.41 2b59 s SER 69 N 0.24 0.26 -0.28 3.58 1.04 -0.51 -1.45 113.70 116.60 2b59 s SER 69 Ca -0.06 -0.75 -0.26 0.00 0.48 0.00 0.00 55.95 55.36 2b59 s SER 69 Cb -0.15 0.26 0.16 0.00 0.10 0.00 0.00 66.02 66.40 2b59 s SER 69 CO 0.04 -0.63 1.25 -0.60 0.98 0.00 0.00 173.24 174.28 2b59 s ARG 70 N -3.59 0.27 0.21 4.02 3.52 -1.26 -0.90 118.95 121.21 2b59 s ARG 70 Ca 0.03 0.25 -0.32 0.00 -0.13 0.00 0.00 55.73 55.56 2b59 s ARG 70 Cb 0.05 0.13 -0.13 0.00 -1.56 0.00 0.00 34.95 33.44 2b59 s ARG 70 CO -0.09 -0.05 1.60 0.00 -0.81 0.00 0.00 175.30 175.95 2b59 n ALA 71 N 1.57 1.94 -0.37 6.12 0.00 -1.26 -1.32 120.51 127.19 2b59 n ALA 71 Ca -0.10 0.42 0.00 0.00 0.00 0.00 0.00 53.44 53.76 2b59 n ALA 71 Cb 0.57 -2.41 0.00 0.00 0.00 0.00 0.00 19.45 17.61 2b59 n ALA 71 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2b59 n THR 72 N 3.16 0.00 -4.11 0.00 -2.24 -1.25 -5.03 114.28 104.81 2b59 n THR 72 Ca 0.15 0.00 -0.23 0.00 -2.27 0.00 0.00 64.05 61.69 2b59 n THR 72 Cb 0.32 0.00 -0.05 0.00 -2.10 0.00 0.00 70.33 68.50 2b59 n THR 72 CO 0.00 0.00 0.00 -0.31 -0.57 0.00 0.00 175.07 174.19 2b59 s TYR 73 N -3.16 3.11 -0.20 4.78 2.02 -0.44 -0.28 117.35 123.18 2b59 s TYR 73 Ca 0.00 -0.08 -0.22 0.00 -0.37 0.00 0.00 57.07 56.40 2b59 s TYR 73 Cb 0.00 -1.44 -0.02 0.00 -0.40 0.00 0.00 41.96 40.10 2b59 s TYR 73 CO 0.00 0.52 0.69 -1.17 -1.57 0.00 0.00 175.55 174.02 2b59 s LEU 74 N -3.57 4.14 0.31 -1.29 2.96 -0.14 -4.54 118.68 116.54 2b59 s LEU 74 Ca 0.32 0.91 -0.27 0.00 -0.22 0.00 0.00 54.13 54.86 2b59 s LEU 74 Cb -0.09 -2.98 -0.14 0.00 0.50 0.00 0.00 46.19 43.49 2b59 s LEU 74 CO 0.24 -0.33 0.97 0.47 -1.32 0.00 0.00 176.35 176.38 2b59 n ASP 75 N 5.23 1.10 -4.15 3.68 8.00 -1.26 -4.61 116.55 124.54 2b59 n ASP 75 Ca 0.00 1.15 -0.27 0.00 0.71 0.00 0.00 54.79 56.38 2b59 n ASP 75 Cb 0.49 -1.28 -0.16 0.00 -0.02 0.00 0.00 41.12 40.15 2b59 n ASP 75 CO 0.00 0.00 0.00 -0.60 -0.39 0.00 0.00 177.20 176.21 2b59 s ARG 76 N -1.60 2.01 -0.14 -1.24 3.52 -0.52 -4.47 118.95 116.51 2b59 s ARG 76 Ca 0.59 -0.66 0.01 0.00 -0.13 0.00 0.00 55.73 55.54 2b59 s ARG 76 Cb -0.68 -1.70 -0.00 0.00 -1.56 0.00 0.00 34.95 31.00 2b59 s ARG 76 CO 0.59 0.24 -0.17 0.08 -0.81 0.00 0.00 175.30 175.24 2b59 s VAL 77 N 0.08 2.58 -0.21 7.11 1.01 -1.26 -0.61 120.40 129.10 2b59 s VAL 77 Ca -0.06 -0.81 0.01 0.00 0.00 0.00 0.00 61.98 61.12 2b59 s VAL 77 Cb -0.13 -2.07 0.05 0.00 0.00 0.00 0.00 36.38 34.23 2b59 s VAL 77 CO 0.03 0.53 -0.11 -0.63 0.00 0.00 0.00 175.10 174.92 2b59 s ILE 78 N 0.63 1.80 0.47 2.22 1.01 -0.07 -4.97 121.20 122.29 2b59 s ILE 78 Ca -0.09 -1.17 0.05 0.00 0.00 0.00 0.00 60.65 59.44 2b59 s ILE 78 Cb -0.16 -1.87 0.02 0.00 0.01 0.00 0.00 42.46 40.46 2b59 s ILE 78 CO 0.03 0.14 0.65 0.00 0.00 0.00 0.00 174.94 175.75 2b59 s ALA 79 N 1.32 4.25 -1.30 9.38 0.00 -1.26 -0.66 121.76 133.50 2b59 s ALA 79 Ca -0.03 -1.51 -0.07 0.00 0.00 0.00 0.00 51.96 50.35 2b59 s ALA 79 Cb -0.17 -1.82 0.01 0.00 0.00 0.00 0.00 23.12 21.14 2b59 s ALA 79 CO -0.08 -0.46 0.93 -1.71 0.00 0.00 0.00 175.76 174.44 2b59 n ASN 80 N -2.04 -5.95 -4.48 0.00 4.05 -1.06 -4.95 115.26 100.83 2b59 n ASN 80 Ca 0.08 -0.42 -0.43 0.00 0.45 0.00 0.00 54.58 54.25 2b59 n ASN 80 Cb 0.59 -4.63 -0.03 0.00 1.23 0.00 0.00 39.78 36.94 2b59 n ASN 80 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 177.26 173.52 2b59 s VAL 81 N -3.24 4.40 0.20 3.44 1.01 -0.11 -4.69 120.40 121.41 2b59 s VAL 81 Ca 0.46 -1.06 -0.30 0.00 0.00 0.00 0.00 61.98 61.07 2b59 s VAL 81 Cb -0.20 -4.84 -0.09 0.00 0.00 0.00 0.00 36.38 31.25 2b59 s VAL 81 CO 0.57 -1.63 1.32 0.68 0.00 0.00 0.00 175.10 176.04 2b59 s VAL 82 N 3.65 3.19 -0.29 2.92 -7.23 -1.26 -0.58 120.40 120.81 2b59 s VAL 82 Ca 0.34 0.97 -0.00 0.00 -1.81 0.00 0.00 61.98 61.48 2b59 s VAL 82 Cb -0.06 -3.62 0.09 0.00 0.56 0.00 0.00 36.38 33.35 2b59 s VAL 82 CO -0.05 0.14 0.06 -0.69 -0.31 0.00 0.00 175.10 174.25 2b59 s VAL 83 N 0.15 1.15 -0.17 1.32 1.01 -1.02 -4.90 120.40 117.94 2b59 s VAL 83 Ca 0.57 -1.40 0.02 0.00 0.00 0.00 0.00 61.98 61.17 2b59 s VAL 83 Cb -0.37 -1.76 0.05 0.00 0.00 0.00 0.00 36.38 34.30 2b59 s VAL 83 CO 0.38 -0.50 0.96 0.35 0.00 0.00 0.00 175.10 176.29 2b59 n THR 84 N 4.75 0.82 -3.34 3.92 -2.24 -1.26 0.68 114.28 117.61 2b59 n THR 84 Ca -0.04 -0.91 0.00 0.00 -2.27 0.00 0.00 64.05 60.83 2b59 n THR 84 Cb 0.43 0.60 0.00 0.00 -2.10 0.00 0.00 70.33 69.26 2b59 n THR 84 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2b59 n GLY 85 N -0.25 -1.12 3.72 3.38 0.00 -1.26 -5.03 105.19 104.62 2b59 n GLY 85 Ca 0.02 -0.91 -0.42 0.00 0.00 0.00 0.00 46.02 44.71 2b59 n GLY 85 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2b59 s ASP 86 N -4.00 6.43 -0.00 1.61 -0.00 -1.26 -4.65 116.67 114.79 2b59 s ASP 86 Ca 0.00 2.82 0.01 0.00 -0.00 0.00 0.00 52.55 55.38 2b59 s ASP 86 Cb 0.00 -2.60 -0.00 0.00 -0.00 0.00 0.00 42.92 40.32 2b59 s ASP 86 CO 0.00 -0.94 -0.05 0.28 -0.00 0.00 0.00 175.17 174.47 2b59 s THR 87 N 1.12 0.37 -0.44 -1.27 -1.32 -0.29 -4.96 115.64 108.85 2b59 s THR 87 Ca 0.73 -0.19 -0.17 0.00 -1.21 0.00 0.00 61.69 60.85 2b59 s THR 87 Cb -0.48 -0.32 0.04 0.00 -1.51 0.00 0.00 72.50 70.22 2b59 s THR 87 CO 0.32 0.11 0.42 -0.44 -2.21 0.00 0.00 174.62 172.83 2b59 s SER 88 N -0.07 6.17 0.29 8.08 0.01 -1.26 -1.60 113.70 125.32 2b59 s SER 88 Ca 0.01 -0.89 -0.00 0.00 1.31 0.00 0.00 55.95 56.38 2b59 s SER 88 Cb -0.02 -2.21 0.43 0.00 0.21 0.00 0.00 66.02 64.42 2b59 s SER 88 CO -0.00 -0.61 1.81 0.58 0.41 0.00 0.00 173.24 175.43 2b59 h VAL 89 N 5.73 1.22 -3.67 3.43 2.07 -0.11 -3.46 116.25 121.47 2b59 h VAL 89 Ca -0.27 -0.88 -0.13 0.00 0.82 0.00 0.00 66.70 66.24 2b59 h VAL 89 Cb 1.11 0.82 -0.06 0.00 -1.52 0.00 0.00 31.29 31.64 2b59 h VAL 89 CO 0.82 0.31 -0.04 -0.94 0.02 0.00 0.00 177.57 177.74 2b59 s SER 90 N -6.64 0.35 0.32 0.57 1.04 -1.24 -5.03 113.70 103.07 2b59 s SER 90 Ca -0.09 -1.20 0.03 0.00 0.48 0.00 0.00 55.95 55.17 2b59 s SER 90 Cb 0.15 0.69 -0.05 0.00 0.10 0.00 0.00 66.02 66.91 2b59 s SER 90 CO 0.79 -1.35 0.09 0.42 0.98 0.00 0.00 173.24 174.18 2b59 s THR 91 N -3.20 0.84 0.21 2.02 -4.23 -1.07 -4.08 115.64 106.14 2b59 s THR 91 Ca 0.24 -2.00 -0.08 0.00 -1.18 0.00 0.00 61.69 58.67 2b59 s THR 91 Cb -0.02 -2.64 0.16 0.00 1.34 0.00 0.00 72.50 71.34 2b59 s THR 91 CO 0.14 0.00 1.78 -1.28 -0.54 0.00 0.00 174.62 174.72 2b59 h SER 92 N 2.13 1.10 -0.14 3.99 0.87 -1.95 -0.98 113.55 118.56 2b59 h SER 92 Ca -0.38 -0.17 -0.09 0.00 -1.23 0.00 0.00 61.79 59.92 2b59 h SER 92 Cb 1.25 -0.28 -0.02 0.00 -0.44 0.00 0.00 62.40 62.91 2b59 h SER 92 CO 0.63 0.97 -0.19 -0.61 -0.53 0.00 0.00 176.83 177.10 2b59 h GLN 93 N 1.16 0.56 -2.43 2.24 4.15 -2.00 -3.35 115.11 115.44 2b59 h GLN 93 Ca 0.27 -0.19 -0.59 0.00 0.77 0.00 0.00 58.65 58.90 2b59 h GLN 93 Cb 0.20 -0.04 -0.40 0.00 0.21 0.00 0.00 27.48 27.46 2b59 h GLN 93 CO -0.02 0.72 -0.87 0.00 -1.93 0.00 0.00 178.83 176.73 2b59 n ALA 94 N -2.49 3.03 -1.68 3.38 0.00 -0.98 -5.13 120.51 116.64 2b59 n ALA 94 Ca 0.00 -3.67 -0.30 0.00 0.00 0.00 0.00 53.44 49.48 2b59 n ALA 94 Cb 0.38 -0.84 0.09 0.00 0.00 0.00 0.00 19.45 19.08 2b59 n ALA 94 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2b59 s PRO 95 N -0.83 2.07 -0.07 0.00 0.04 -0.41 -2.58 135.00 133.22 2b59 s PRO 95 Ca 0.32 0.45 -0.27 0.00 0.04 0.00 0.00 61.00 61.54 2b59 s PRO 95 Cb 0.06 -1.93 -0.02 0.00 0.04 0.00 0.00 34.50 32.64 2b59 s PRO 95 CO -0.15 -1.59 0.88 0.42 0.04 0.00 0.00 177.00 176.60 2b59 s ILE 96 N -3.29 4.90 0.19 0.56 -1.09 -0.27 -4.84 121.20 117.36 2b59 s ILE 96 Ca 0.61 1.81 -0.17 0.00 -2.23 0.00 0.00 60.65 60.67 2b59 s ILE 96 Cb -0.13 -4.21 -0.08 0.00 -1.58 0.00 0.00 42.46 36.46 2b59 s ILE 96 CO 0.53 0.12 0.65 -0.04 -1.23 0.00 0.00 174.94 174.97 2b59 s MET 97 N 1.40 4.13 -0.03 2.79 -1.94 -1.26 -0.43 119.30 123.96 2b59 s MET 97 Ca 0.45 0.70 0.04 0.00 -1.71 0.00 0.00 55.69 55.17 2b59 s MET 97 Cb -0.19 -2.89 -0.01 0.00 2.01 0.00 0.00 34.83 33.76 2b59 s MET 97 CO 0.20 0.42 -0.15 -1.64 -0.01 0.00 0.00 175.02 173.85 2b59 s MET 98 N -1.99 1.42 -0.23 2.03 -1.94 -0.90 -4.91 119.30 112.78 2b59 s MET 98 Ca 0.41 -0.53 -0.10 0.00 -1.71 0.00 0.00 55.69 53.75 2b59 s MET 98 Cb -0.16 -1.30 -0.05 0.00 2.01 0.00 0.00 34.83 35.33 2b59 s MET 98 CO 0.20 0.26 0.15 -1.58 -0.01 0.00 0.00 175.02 174.04 2b59 s TRP 99 N -0.10 3.33 0.33 -0.03 0.51 -1.26 -1.30 118.94 120.42 2b59 s TRP 99 Ca 0.00 0.23 -0.09 0.00 -2.12 0.00 0.00 56.10 54.13 2b59 s TRP 99 Cb -0.09 -2.24 -0.06 0.00 -0.81 0.00 0.00 33.47 30.27 2b59 s TRP 99 CO 0.01 0.11 0.67 0.54 -0.51 0.00 0.00 176.95 177.76 2b59 s VAL 100 N 0.90 4.87 0.00 4.03 0.11 -1.26 -0.97 120.40 128.08 2b59 s VAL 100 Ca 0.07 0.45 0.00 0.00 -2.93 0.00 0.00 61.98 59.58 2b59 s VAL 100 Cb -0.13 -3.70 0.00 0.00 -1.53 0.00 0.00 36.38 31.02 2b59 s VAL 100 CO 0.03 -0.36 0.00 0.61 -3.33 0.00 0.00 175.10 172.05 2b59 n GLY 101 N -0.92 0.82 2.76 6.54 0.00 0.61 -4.67 105.19 110.34 2b59 n GLY 101 Ca 0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.61 2b59 n GLY 101 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2b59 n ASP 102 N 0.00 6.00 0.25 1.61 2.03 -0.56 -4.68 116.55 121.20 2b59 n ASP 102 Ca 0.00 -3.14 -0.11 0.00 0.52 0.00 0.00 54.79 52.05 2b59 n ASP 102 Cb 0.00 -1.43 -0.06 0.00 -0.72 0.00 0.00 41.12 38.91 2b59 n ASP 102 CO 0.00 0.00 0.00 0.40 -1.92 0.00 0.00 177.20 175.68 2b59 h ILE 103 N 3.39 0.10 -1.96 5.18 2.04 -1.91 -3.34 117.51 121.01 2b59 h ILE 103 Ca 0.47 -0.51 -0.63 0.00 1.00 0.00 0.00 64.86 65.19 2b59 h ILE 103 Cb 0.53 0.15 -0.13 0.00 -0.74 0.00 0.00 36.82 36.63 2b59 h ILE 103 CO 1.57 0.02 1.06 0.68 0.00 0.00 0.00 178.15 181.48 2b59 s VAL 104 N -3.95 4.25 -0.48 1.67 -7.23 -1.26 -4.74 120.40 108.65 2b59 s VAL 104 Ca -0.11 -0.84 -0.39 0.00 -1.81 0.00 0.00 61.98 58.82 2b59 s VAL 104 Cb 0.01 -4.88 -0.16 0.00 0.56 0.00 0.00 36.38 31.91 2b59 s VAL 104 CO 0.35 -1.70 2.21 0.29 -0.31 0.00 0.00 175.10 175.93 2b59 n LYS 105 N 7.93 0.42 -0.57 4.82 4.76 -1.26 -4.69 118.16 129.58 2b59 n LYS 105 Ca 0.20 0.11 -0.01 0.00 -2.87 0.00 0.00 58.31 55.74 2b59 n LYS 105 Cb 0.49 -1.90 -0.01 0.00 -1.84 0.00 0.00 35.03 31.77 2b59 n LYS 105 CO 0.00 0.00 0.00 -0.40 -1.37 0.00 0.00 177.40 175.63 2b59 n ASP 106 N 8.78 -0.19 -3.87 4.39 3.85 -1.26 -5.02 116.55 123.22 2b59 n ASP 106 Ca 0.50 -1.12 -0.27 0.00 -0.71 0.00 0.00 54.79 53.19 2b59 n ASP 106 Cb 0.08 0.06 0.02 0.00 -1.35 0.00 0.00 41.12 39.92 2b59 n ASP 106 CO 0.00 0.00 0.00 0.59 -1.01 0.00 0.00 177.20 176.78 2b59 n ASN 107 N 0.00 -2.82 -3.59 -1.12 5.03 -1.26 -4.98 115.26 106.52 2b59 n ASN 107 Ca -0.05 -0.84 -0.02 0.00 0.87 0.00 0.00 54.58 54.53 2b59 n ASN 107 Cb 0.51 -3.73 -0.05 0.00 -1.02 0.00 0.00 39.78 35.48 2b59 n ASN 107 CO 0.00 0.00 0.00 -0.55 -1.83 0.00 0.00 177.26 174.88 2b59 s SER 108 N -3.82 -0.84 -0.49 6.41 0.15 -1.26 -4.26 113.70 109.59 2b59 s SER 108 Ca 0.35 1.24 -0.25 0.00 0.70 0.00 0.00 55.95 57.99 2b59 s SER 108 Cb -0.18 1.69 0.03 0.00 -1.71 0.00 0.00 66.02 65.85 2b59 s SER 108 CO 0.84 -0.18 0.94 -0.63 1.20 0.00 0.00 173.24 175.41 2b59 s ILE 109 N 2.13 4.43 0.08 6.45 -1.09 -0.32 -4.81 121.20 128.07 2b59 s ILE 109 Ca -0.07 0.63 0.02 0.00 -2.23 0.00 0.00 60.65 59.00 2b59 s ILE 109 Cb -0.07 -4.48 -0.01 0.00 -1.58 0.00 0.00 42.46 36.32 2b59 s ILE 109 CO -0.18 -0.94 0.07 -0.46 -1.23 0.00 0.00 174.94 172.20 2b59 n ASN 110 N 7.31 -0.17 0.20 3.58 2.04 -1.26 0.41 115.26 127.38 2b59 n ASN 110 Ca 0.05 -1.53 0.16 0.00 -0.44 0.00 0.00 54.58 52.83 2b59 n ASN 110 Cb 0.48 0.40 0.81 0.00 -2.53 0.00 0.00 39.78 38.95 2b59 n ASN 110 CO 0.00 0.00 0.00 -0.07 -0.44 0.00 0.00 177.26 176.75 2b59 h LEU 111 N 0.00 0.00 -0.97 -4.53 3.38 -1.99 -1.16 115.31 110.04 2b59 h LEU 111 Ca -0.06 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.83 2b59 h LEU 111 Cb 0.29 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.02 2b59 h LEU 111 CO 0.08 0.00 -0.15 -0.07 0.09 0.00 0.00 178.44 178.39 2b59 h LEU 112 N 0.00 0.56 -0.27 1.67 3.38 -1.96 -0.48 115.31 118.21 2b59 h LEU 112 Ca 0.08 -0.16 -0.06 0.00 0.09 0.00 0.00 57.88 57.83 2b59 h LEU 112 Cb 0.42 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.01 2b59 h LEU 112 CO -0.00 0.74 -0.06 0.44 0.09 0.00 0.00 178.44 179.64 2b59 h ASP 113 N 0.52 0.53 -0.35 -0.43 3.32 -1.52 -2.58 116.42 115.90 2b59 h ASP 113 Ca 0.09 -0.36 -0.06 0.00 0.02 0.00 0.00 57.03 56.72 2b59 h ASP 113 Cb 0.57 -0.14 -0.02 0.00 0.22 0.00 0.00 39.33 39.95 2b59 h ASP 113 CO 0.04 0.77 0.02 0.58 -1.72 0.00 0.00 179.24 178.93 2b59 h VAL 114 N 0.28 1.22 -0.52 -1.35 2.07 -1.40 -2.62 116.25 113.93 2b59 h VAL 114 Ca 0.07 -0.90 -0.03 0.00 0.82 0.00 0.00 66.70 66.67 2b59 h VAL 114 Cb 0.54 0.86 -0.03 0.00 -1.52 0.00 0.00 31.29 31.14 2b59 h VAL 114 CO 0.03 0.32 0.22 0.00 0.02 0.00 0.00 177.57 178.15 2b59 h ALA 115 N 1.36 1.41 -0.51 1.67 0.00 -0.88 -1.49 119.26 120.82 2b59 h ALA 115 Ca 0.14 -0.13 -0.08 0.00 0.00 0.00 0.00 54.91 54.84 2b59 h ALA 115 Cb 0.38 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 2b59 h ALA 115 CO 0.01 0.45 0.01 0.93 0.00 0.00 0.00 179.25 180.66 2b59 h GLU 116 N 0.74 0.86 -0.32 0.00 4.39 -1.08 -1.41 114.58 117.76 2b59 h GLU 116 Ca 0.18 -0.23 -0.17 0.00 0.34 0.00 0.00 59.36 59.48 2b59 h GLU 116 Cb 0.13 -0.10 -0.00 0.00 -0.10 0.00 0.00 28.75 28.68 2b59 h GLU 116 CO -0.02 0.85 -0.47 0.28 -1.16 0.00 0.00 179.01 178.49 2b59 h VAL 117 N 0.80 1.28 -0.57 3.13 2.07 -1.38 -3.05 116.25 118.53 2b59 h VAL 117 Ca 0.15 -1.65 0.00 0.00 0.82 0.00 0.00 66.70 66.02 2b59 h VAL 117 Cb 0.46 1.53 -0.03 0.00 -1.52 0.00 0.00 31.29 31.73 2b59 h VAL 117 CO 0.02 0.54 0.36 0.40 0.02 0.00 0.00 177.57 178.91 2b59 h ILE 118 N 0.68 1.15 -0.25 4.57 1.08 -0.91 -1.87 117.51 121.96 2b59 h ILE 118 Ca 0.04 -0.32 0.07 0.00 -0.39 0.00 0.00 64.86 64.26 2b59 h ILE 118 Cb 1.06 0.34 -0.01 0.00 -3.07 0.00 0.00 36.82 35.14 2b59 h ILE 118 CO 0.11 0.16 0.20 0.03 -0.69 0.00 0.00 178.15 177.95 2b59 h ARG 119 N 0.77 0.00 -0.36 2.37 3.08 -1.15 -0.45 114.38 118.65 2b59 h ARG 119 Ca 0.21 0.00 -0.04 0.00 0.07 0.00 0.00 59.98 60.21 2b59 h ARG 119 Cb -0.06 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 29.97 2b59 h ARG 119 CO -0.04 0.00 0.02 0.00 -1.07 0.00 0.00 179.97 178.88 2b59 n PHE 121 N -0.41 1.66 -0.89 0.00 7.35 -0.18 -1.54 117.46 123.46 2b59 n PHE 121 Ca 0.25 0.56 0.00 0.00 -0.76 0.00 0.00 57.45 57.51 2b59 n PHE 121 Cb 1.00 -2.37 0.00 0.00 0.35 0.00 0.00 39.48 38.46 2b59 n PHE 121 CO 0.00 0.00 0.00 0.09 -0.76 0.00 0.00 176.76 176.09 2b59 n ASN 122 N 2.54 -2.76 -4.77 -2.13 3.02 0.24 -4.99 115.26 106.41 2b59 n ASN 122 Ca 0.17 0.00 -0.39 0.00 -0.03 0.00 0.00 54.58 54.33 2b59 n ASN 122 Cb 0.23 -1.84 0.00 0.00 -0.61 0.00 0.00 39.78 37.56 2b59 n ASN 122 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2b59 s ALA 123 N -1.81 3.20 0.21 5.41 0.00 -0.59 -4.72 121.76 123.46 2b59 s ALA 123 Ca 0.00 1.26 0.10 0.00 0.00 0.00 0.00 51.96 53.33 2b59 s ALA 123 Cb 0.00 -3.50 -0.04 0.00 0.00 0.00 0.00 23.12 19.57 2b59 s ALA 123 CO 0.00 -0.92 -0.17 0.95 0.00 0.00 0.00 175.76 175.62 2b59 s THR 124 N -1.27 2.73 -0.05 0.00 -4.23 -1.26 -0.85 115.64 110.71 2b59 s THR 124 Ca 0.59 -1.95 -0.38 0.00 -1.18 0.00 0.00 61.69 58.77 2b59 s THR 124 Cb -0.39 -2.36 -0.17 0.00 1.34 0.00 0.00 72.50 70.93 2b59 s THR 124 CO 0.49 -0.17 1.45 1.17 -0.54 0.00 0.00 174.62 177.02 2b59 n LYS 125 N -0.02 1.02 -0.27 3.99 3.00 -0.41 -0.53 118.16 124.94 2b59 n LYS 125 Ca -0.10 0.37 0.00 0.00 -0.00 0.00 0.00 58.31 58.57 2b59 n LYS 125 Cb 0.57 -2.01 0.00 0.00 0.00 0.00 0.00 35.03 33.59 2b59 n LYS 125 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2b59 n GLY 126 N 2.99 1.15 3.87 3.14 0.00 -1.26 -5.05 105.19 110.03 2b59 n GLY 126 Ca 0.21 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.93 2b59 n GLY 126 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2b59 s SER 127 N -3.02 6.40 0.47 1.61 0.01 0.31 -4.96 113.70 114.51 2b59 s SER 127 Ca 0.00 1.35 0.17 0.00 1.31 0.00 0.00 55.95 58.78 2b59 s SER 127 Cb 0.00 -2.43 1.15 0.00 0.21 0.00 0.00 66.02 64.95 2b59 s SER 127 CO 0.00 -0.67 2.00 0.00 0.41 0.00 0.00 173.24 174.99 2b59 h ALA 128 N 0.38 2.13 -0.66 1.44 0.00 -1.97 -2.40 119.26 118.18 2b59 h ALA 128 Ca -0.46 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.44 2b59 h ALA 128 Cb 1.19 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.94 2b59 h ALA 128 CO 0.62 -0.25 0.00 0.27 0.00 0.00 0.00 179.25 179.89 2b59 n ASN 129 N -4.46 4.34 -4.73 0.00 2.04 -1.26 -4.96 115.26 106.23 2b59 n ASN 129 Ca 0.08 -2.25 -0.38 0.00 -0.44 0.00 0.00 54.58 51.58 2b59 n ASN 129 Cb 0.39 -0.53 -0.06 0.00 -2.53 0.00 0.00 39.78 37.06 2b59 n ASN 129 CO 0.00 0.00 0.00 -0.47 -0.44 0.00 0.00 177.26 176.35 2b59 s TYR 130 N -1.48 3.56 -0.18 -2.53 6.14 -0.91 -4.71 117.35 117.25 2b59 s TYR 130 Ca 0.49 1.01 -0.01 0.00 0.64 0.00 0.00 57.07 59.19 2b59 s TYR 130 Cb 0.29 -2.59 0.05 0.00 0.42 0.00 0.00 41.96 40.13 2b59 s TYR 130 CO 0.28 0.21 -0.02 0.08 0.64 0.00 0.00 175.55 176.74 2b59 s VAL 131 N 0.41 0.94 0.27 3.14 1.01 -1.26 -4.88 120.40 120.03 2b59 s VAL 131 Ca 0.29 -0.65 -0.01 0.00 0.00 0.00 0.00 61.98 61.61 2b59 s VAL 131 Cb -0.16 -1.24 0.27 0.00 0.00 0.00 0.00 36.38 35.25 2b59 s VAL 131 CO 0.13 -0.01 1.68 -0.08 0.00 0.00 0.00 175.10 176.82 2b59 h GLU 132 N 8.15 0.30 0.00 2.72 4.81 -1.96 -0.30 114.58 128.29 2b59 h GLU 132 Ca -0.20 -0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.01 2b59 h GLU 132 Cb 1.11 -0.07 -0.00 0.00 0.63 0.00 0.00 28.75 30.42 2b59 h GLU 132 CO 0.37 0.20 -0.01 1.05 -0.73 0.00 0.00 179.01 179.89 2b59 h GLU 133 N 0.30 0.00 0.00 1.92 4.11 -2.00 -0.33 114.58 118.59 2b59 h GLU 133 Ca 0.49 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.92 2b59 h GLU 133 Cb 0.91 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.16 2b59 h GLU 133 CO -0.55 0.01 -0.55 1.28 0.07 0.00 0.00 179.01 179.27 2b59 n LEU 134 N -3.74 0.58 -4.04 3.06 4.77 -0.14 -4.31 117.00 113.18 2b59 n LEU 134 Ca -0.03 0.14 -0.43 0.00 -0.03 0.00 0.00 56.01 55.67 2b59 n LEU 134 Cb 0.09 -0.22 0.00 0.00 -2.33 0.00 0.00 43.42 40.96 2b59 n LEU 134 CO 0.27 0.02 1.96 -0.67 -1.33 0.00 0.00 177.39 177.64 2b59 n ASP 135 N -1.83 4.89 -0.33 -1.43 2.03 -0.13 -4.88 116.55 114.87 2b59 n ASP 135 Ca 0.04 -3.02 -0.04 0.00 0.52 0.00 0.00 54.79 52.30 2b59 n ASP 135 Cb 0.39 -1.56 -0.01 0.00 -0.72 0.00 0.00 41.12 39.23 2b59 n ASP 135 CO 0.00 0.00 0.00 -0.38 -1.92 0.00 0.00 177.20 174.90 2b59 n ILE 136 N 4.20 -0.49 0.99 5.18 2.08 -1.26 -0.17 119.36 129.89 2b59 n ILE 136 Ca 0.42 1.99 0.09 0.00 0.56 0.00 0.00 62.75 65.82 2b59 n ILE 136 Cb 0.39 -2.57 0.30 0.00 -0.75 0.00 0.00 39.64 37.00 2b59 n ILE 136 CO 0.00 0.00 0.00 -0.46 0.56 0.00 0.00 176.55 176.65 2b59 n ASN 137 N -5.17 1.97 -3.25 4.38 6.94 -1.26 -4.95 115.26 113.92 2b59 n ASN 137 Ca 0.06 -1.83 -0.23 0.00 -0.02 0.00 0.00 54.58 52.56 2b59 n ASN 137 Cb 0.30 -0.17 0.01 0.00 -2.36 0.00 0.00 39.78 37.56 2b59 n ASN 137 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 2b59 n ARG 138 N 0.53 -4.10 -0.17 -3.83 5.12 0.76 -4.85 116.66 110.12 2b59 n ARG 138 Ca 0.15 0.65 0.08 0.00 -1.93 0.00 0.00 57.85 56.81 2b59 n ARG 138 Cb 0.36 -5.43 0.25 0.00 -1.16 0.00 0.00 32.46 26.47 2b59 n ARG 138 CO 0.00 0.00 0.00 0.27 -1.93 0.00 0.00 177.63 175.97 2b59 n ASN 139 N -2.40 2.16 0.00 0.55 6.94 -1.26 -4.92 115.26 116.32 2b59 n ASN 139 Ca -0.05 -1.91 0.00 0.00 -0.02 0.00 0.00 54.58 52.60 2b59 n ASN 139 Cb 0.57 -0.22 0.00 0.00 -2.36 0.00 0.00 39.78 37.77 2b59 n ASN 139 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2b59 n GLY 140 N 1.18 0.47 3.22 4.83 0.00 -1.26 -5.06 105.19 108.57 2b59 n GLY 140 Ca 0.15 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.04 2b59 n GLY 140 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2b59 s ALA 141 N -2.00 -0.72 -0.28 4.61 0.00 -1.26 -1.29 121.76 120.82 2b59 s ALA 141 Ca 0.00 0.32 -0.08 0.00 0.00 0.00 0.00 51.96 52.19 2b59 s ALA 141 Cb 0.00 0.02 -0.02 0.00 0.00 0.00 0.00 23.12 23.12 2b59 s ALA 141 CO 0.00 -0.24 0.10 0.42 0.00 0.00 0.00 175.76 176.04 2b59 s ILE 142 N -1.19 4.41 0.00 0.00 1.01 -0.03 -4.86 121.20 120.54 2b59 s ILE 142 Ca -0.12 -0.30 0.00 0.00 0.00 0.00 0.00 60.65 60.22 2b59 s ILE 142 Cb -0.05 -3.15 0.00 0.00 0.01 0.00 0.00 42.46 39.27 2b59 s ILE 142 CO 0.03 0.21 0.00 -0.46 0.00 0.00 0.00 174.94 174.73 2b59 n ASN 143 N 4.94 0.00 0.26 3.58 0.23 -1.26 0.81 115.26 123.82 2b59 n ASN 143 Ca -0.15 -0.39 0.09 0.00 -0.53 0.00 0.00 54.58 53.60 2b59 n ASN 143 Cb 0.50 0.00 0.67 0.00 -2.08 0.00 0.00 39.78 38.87 2b59 n ASN 143 CO 0.00 0.00 0.00 -0.03 -0.93 0.00 0.00 177.26 176.30 2b59 h MET 144 N 0.00 0.00 -0.93 -3.83 1.85 -1.99 -2.12 114.93 107.90 2b59 h MET 144 Ca 0.00 0.00 0.01 0.00 -0.61 0.00 0.00 59.70 59.10 2b59 h MET 144 Cb 0.00 0.00 -0.05 0.00 0.43 0.00 0.00 31.60 31.98 2b59 h MET 144 CO 0.00 0.03 0.62 0.37 -0.40 0.00 0.00 176.91 177.53 2b59 h GLN 145 N 0.00 1.23 -0.34 0.39 4.15 -1.97 0.35 115.11 118.93 2b59 h GLN 145 Ca -0.00 -0.07 -0.17 0.00 0.77 0.00 0.00 58.65 59.17 2b59 h GLN 145 Cb 0.06 -0.28 -0.00 0.00 0.21 0.00 0.00 27.48 27.47 2b59 h GLN 145 CO 0.00 0.82 -0.47 -0.44 -1.93 0.00 0.00 178.83 176.81 2b59 h ASP 146 N 1.27 0.99 -0.68 -0.69 5.19 -1.76 -2.97 116.42 117.77 2b59 h ASP 146 Ca 0.34 -0.49 -0.04 0.00 -0.62 0.00 0.00 57.03 56.22 2b59 h ASP 146 Cb -0.15 -0.28 -0.03 0.00 0.18 0.00 0.00 39.33 39.05 2b59 h ASP 146 CO -0.07 1.30 0.29 0.40 -3.12 0.00 0.00 179.24 178.03 2b59 h ILE 147 N 0.72 1.24 -0.25 0.35 2.04 -1.23 -2.37 117.51 118.01 2b59 h ILE 147 Ca 0.04 -0.73 0.00 0.00 1.00 0.00 0.00 64.86 65.17 2b59 h ILE 147 Cb 1.07 0.45 -0.01 0.00 -0.74 0.00 0.00 36.82 37.59 2b59 h ILE 147 CO 0.11 0.29 0.16 0.24 0.00 0.00 0.00 178.15 178.95 2b59 h MET 148 N 0.96 0.33 -0.35 2.37 2.86 -0.86 -0.07 114.93 120.16 2b59 h MET 148 Ca 0.23 -0.02 -0.07 0.00 -2.06 0.00 0.00 59.70 57.78 2b59 h MET 148 Cb 0.18 -0.07 -0.01 0.00 0.06 0.00 0.00 31.60 31.76 2b59 h MET 148 CO -0.02 0.22 -0.05 0.82 1.06 0.00 0.00 176.91 178.94 2b59 h ILE 149 N 0.34 1.27 -0.85 -1.22 2.04 -1.28 -2.42 117.51 115.38 2b59 h ILE 149 Ca 0.09 -1.09 -0.03 0.00 1.00 0.00 0.00 64.86 64.83 2b59 h ILE 149 Cb -0.03 1.27 -0.04 0.00 -0.74 0.00 0.00 36.82 37.28 2b59 h ILE 149 CO -0.02 0.36 0.40 0.58 0.00 0.00 0.00 178.15 179.47 2b59 h VAL 150 N 0.45 1.26 0.00 1.67 2.07 -1.02 -2.08 116.25 118.60 2b59 h VAL 150 Ca 0.09 -0.74 -0.00 0.00 0.82 0.00 0.00 66.70 66.86 2b59 h VAL 150 Cb 0.54 0.18 -0.00 0.00 -1.52 0.00 0.00 31.29 30.49 2b59 h VAL 150 CO 0.03 0.32 -0.02 0.45 0.02 0.00 0.00 177.57 178.37 2b59 h HIS 151 N 1.22 0.00 -1.01 1.57 3.86 -0.72 -2.62 115.15 117.45 2b59 h HIS 151 Ca 0.29 0.00 0.24 0.00 -1.16 0.00 0.00 60.37 59.74 2b59 h HIS 151 Cb 0.13 0.00 -0.09 0.00 1.06 0.00 0.00 27.41 28.51 2b59 h HIS 151 CO 0.02 0.02 0.64 0.87 0.86 0.00 0.00 177.93 180.34 2b59 h LYS 152 N 0.00 0.46 -0.50 2.45 1.57 -0.89 -2.44 116.57 117.21 2b59 h LYS 152 Ca -0.00 -0.03 -0.36 0.00 -1.87 0.00 0.00 60.65 58.39 2b59 h LYS 152 Cb 0.07 -0.10 -0.36 0.00 0.08 0.00 0.00 32.23 31.92 2b59 h LYS 152 CO 0.00 0.30 -0.88 0.72 -0.57 0.00 0.00 179.45 179.03 2b59 n HIS 153 N -4.65 1.76 -1.74 -1.35 8.25 -0.99 -5.07 115.22 111.43 2b59 n HIS 153 Ca 0.24 -1.97 -0.42 0.00 -0.26 0.00 0.00 57.72 55.31 2b59 n HIS 153 Cb 0.78 -0.28 -0.02 0.00 1.12 0.00 0.00 29.99 31.59 2b59 n HIS 153 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 2b59 n PHE 154 N -0.64 2.80 -0.14 4.41 7.35 -0.92 -2.00 117.46 128.31 2b59 n PHE 154 Ca 0.27 0.23 0.00 0.00 -0.76 0.00 0.00 57.45 57.20 2b59 n PHE 154 Cb 0.90 -2.60 0.00 0.00 0.35 0.00 0.00 39.48 38.13 2b59 n PHE 154 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 2b59 n GLY 155 N 2.43 1.49 3.80 7.13 0.00 0.17 -5.01 105.19 115.20 2b59 n GLY 155 Ca 0.10 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.78 2b59 n GLY 155 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2b59 s ALA 156 N -2.72 2.98 0.31 4.61 0.00 -0.84 -4.75 121.76 121.34 2b59 s ALA 156 Ca 0.00 0.55 0.03 0.00 0.00 0.00 0.00 51.96 52.54 2b59 s ALA 156 Cb 0.00 -3.22 -0.06 0.00 0.00 0.00 0.00 23.12 19.84 2b59 s ALA 156 CO 0.00 -0.12 0.06 0.95 0.00 0.00 0.00 175.76 176.65 2b59 s THR 157 N -1.98 1.09 0.38 0.00 -4.23 -1.26 -1.18 115.64 108.46 2b59 s THR 157 Ca 0.63 -2.00 0.17 0.00 -1.18 0.00 0.00 61.69 59.31 2b59 s THR 157 Cb -0.15 -2.77 0.38 0.00 1.34 0.00 0.00 72.50 71.30 2b59 s THR 157 CO 0.19 -0.00 1.75 0.28 -0.54 0.00 0.00 174.62 176.30 2b59 h SER 158 N 2.16 0.49 0.47 3.99 0.02 -1.78 0.30 113.55 119.20 2b59 h SER 158 Ca -0.40 0.10 0.00 0.00 -0.84 0.00 0.00 61.79 60.65 2b59 h SER 158 Cb 1.24 0.02 0.00 0.00 0.14 0.00 0.00 62.40 63.81 2b59 h SER 158 CO 0.68 0.07 0.00 -1.54 -1.14 0.00 0.00 176.83 174.91 2b59 n SER 159 N -4.69 0.00 0.09 3.07 3.41 -1.26 -2.65 113.62 111.59 2b59 n SER 159 Ca 0.26 0.50 0.13 0.00 -0.26 0.00 0.00 58.87 59.50 2b59 n SER 159 Cb 0.88 -0.50 0.43 0.00 -0.26 0.00 0.00 64.21 64.76 2b59 n SER 159 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2b59 n ASP 160 N -1.50 0.71 -4.76 4.04 8.00 0.09 -4.82 116.55 118.31 2b59 n ASP 160 Ca 0.03 0.57 -0.36 0.00 0.71 0.00 0.00 54.79 55.75 2b59 n ASP 160 Cb 0.16 -0.76 0.01 0.00 -0.02 0.00 0.00 41.12 40.52 2b59 n ASP 160 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 2b59 s TYR 161 N -3.10 2.57 0.19 1.24 2.02 -1.08 -4.92 117.35 114.27 2b59 s TYR 161 Ca 0.11 1.52 -0.32 0.00 -0.37 0.00 0.00 57.07 58.01 2b59 s TYR 161 Cb 0.13 -3.40 -0.11 0.00 -0.40 0.00 0.00 41.96 38.17 2b59 s TYR 161 CO 0.58 -1.88 1.69 -0.51 -1.57 0.00 0.00 175.55 173.86 2b59 s ASP 162 N -1.60 6.43 0.00 2.29 1.01 -1.26 -5.09 116.67 118.46 2b59 s ASP 162 Ca 0.73 2.80 0.26 0.00 0.71 0.00 0.00 52.55 57.05 2b59 s ASP 162 Cb -0.28 -2.60 0.71 0.00 1.01 0.00 0.00 42.92 41.76 2b59 s ASP 162 CO 0.31 -0.94 1.55 0.00 0.21 0.00 0.00 175.17 176.31