#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gri s GLU 2 N 0.00 2.56 -0.13 2.12 2.02 -1.26 0.25 118.70 124.26 1gri s GLU 2 Ca 0.00 -0.24 -0.30 0.00 0.02 0.00 0.00 54.97 54.45 1gri s GLU 2 Cb 0.00 -2.27 0.12 0.00 0.10 0.00 0.00 34.13 32.08 1gri s GLU 2 CO 0.00 -0.92 0.99 0.00 0.02 0.00 0.00 175.26 175.35 1gri s ALA 3 N -3.05 -1.92 -0.18 5.21 0.00 -0.54 -4.47 121.76 116.81 1gri s ALA 3 Ca 0.57 1.46 -0.09 0.00 0.00 0.00 0.00 51.96 53.90 1gri s ALA 3 Cb -0.11 -0.43 -0.05 0.00 0.00 0.00 0.00 23.12 22.53 1gri s ALA 3 CO 0.44 -0.41 0.14 -1.50 0.00 0.00 0.00 175.76 174.43 1gri s ILE 4 N -1.62 5.43 0.30 0.00 2.07 -0.00 0.17 121.20 127.55 1gri s ILE 4 Ca 0.00 0.21 -0.29 0.00 -1.41 0.00 0.00 60.65 59.16 1gri s ILE 4 Cb -0.01 -3.46 -0.11 0.00 0.13 0.00 0.00 42.46 39.02 1gri s ILE 4 CO -0.01 0.48 1.50 0.00 -1.91 0.00 0.00 174.94 175.00 1gri s ALA 5 N 0.00 3.65 -0.22 1.50 0.00 0.11 -1.45 121.76 125.35 1gri s ALA 5 Ca 0.10 1.47 0.00 0.00 0.00 0.00 0.00 51.96 53.54 1gri s ALA 5 Cb -0.11 -3.60 -0.14 0.00 0.00 0.00 0.00 23.12 19.27 1gri s ALA 5 CO -0.00 -0.90 -0.21 1.17 0.00 0.00 0.00 175.76 175.83 1gri n LYS 6 N 1.73 0.55 -4.87 0.00 4.81 0.27 -1.51 118.16 119.13 1gri n LYS 6 Ca 0.05 0.14 -0.29 0.00 -0.87 0.00 0.00 58.31 57.34 1gri n LYS 6 Cb 0.39 -1.43 -0.15 0.00 0.02 0.00 0.00 35.03 33.86 1gri n LYS 6 CO 0.00 0.00 0.00 0.71 1.17 0.00 0.00 177.40 179.28 1gri s TYR 7 N -2.44 2.19 0.84 5.64 2.02 -1.23 -4.77 117.35 119.60 1gri s TYR 7 Ca -0.30 -0.40 -0.13 0.00 -0.37 0.00 0.00 57.07 55.87 1gri s TYR 7 Cb 0.08 -1.32 0.09 0.00 -0.40 0.00 0.00 41.96 40.41 1gri s TYR 7 CO 0.50 0.10 1.08 -0.25 -1.57 0.00 0.00 175.55 175.42 1gri n ASP 8 N 1.85 0.49 -3.73 2.29 9.92 -1.26 -4.33 116.55 121.79 1gri n ASP 8 Ca -0.17 0.53 -0.12 0.00 -0.53 0.00 0.00 54.79 54.50 1gri n ASP 8 Cb 0.52 -1.46 -0.11 0.00 -0.64 0.00 0.00 41.12 39.43 1gri n ASP 8 CO 0.00 0.00 0.00 0.12 0.13 0.00 0.00 177.20 177.45 1gri s PHE 9 N -2.24 -0.46 -0.22 1.24 5.36 -0.33 -4.91 117.98 116.42 1gri s PHE 9 Ca 0.70 1.06 -0.08 0.00 -0.96 0.00 0.00 56.93 57.66 1gri s PHE 9 Cb -0.28 0.17 -0.04 0.00 -0.34 0.00 0.00 43.02 42.54 1gri s PHE 9 CO 0.54 -0.25 0.07 0.21 -1.46 0.00 0.00 175.22 174.34 1gri s LYS 10 N 0.73 3.84 -0.92 10.12 2.36 -1.26 -2.36 119.74 132.25 1gri s LYS 10 Ca -0.04 -0.40 -0.18 0.00 -2.55 0.00 0.00 55.97 52.79 1gri s LYS 10 Cb -0.05 -3.29 -0.25 0.00 -1.05 0.00 0.00 37.83 33.18 1gri s LYS 10 CO -0.05 0.05 2.34 0.00 1.55 0.00 0.00 175.35 179.24 1gri n ALA 11 N 4.21 0.77 0.73 3.13 0.00 -1.26 -4.72 120.51 123.37 1gri n ALA 11 Ca -0.16 -0.83 0.07 0.00 0.00 0.00 0.00 53.44 52.52 1gri n ALA 11 Cb 0.52 -2.61 0.37 0.00 0.00 0.00 0.00 19.45 17.73 1gri n ALA 11 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 1gri n THR 12 N 6.77 0.40 -1.59 0.00 5.66 -1.26 -4.83 114.28 119.44 1gri n THR 12 Ca 0.61 0.10 0.00 0.00 -3.05 0.00 0.00 64.05 61.71 1gri n THR 12 Cb 0.21 -0.88 0.00 0.00 -1.55 0.00 0.00 70.33 68.11 1gri n THR 12 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1gri n ALA 13 N -1.18 0.00 -0.02 1.79 0.00 -1.26 -5.07 120.51 114.77 1gri n ALA 13 Ca 0.08 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.55 1gri n ALA 13 Cb 0.09 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.40 1gri n ALA 13 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1gri n ASP 14 N 0.00 0.23 -4.21 0.00 5.75 -1.26 -4.60 116.55 112.45 1gri n ASP 14 Ca 0.00 0.10 -0.41 0.00 -0.01 0.00 0.00 54.79 54.46 1gri n ASP 14 Cb 0.00 1.26 -0.07 0.00 -1.03 0.00 0.00 41.12 41.27 1gri n ASP 14 CO 0.00 0.00 0.00 1.51 -0.11 0.00 0.00 177.20 178.60 1gri s ASP 15 N -5.09 5.81 0.00 -1.12 -4.77 -1.26 -4.96 116.67 105.28 1gri s ASP 15 Ca -0.07 -2.20 0.00 0.00 -3.30 0.00 0.00 52.55 46.98 1gri s ASP 15 Cb 0.10 -2.02 0.00 0.00 -1.09 0.00 0.00 42.92 39.91 1gri s ASP 15 CO 0.86 -0.63 0.00 -1.84 0.70 0.00 0.00 175.17 174.26 1gri n GLU 16 N 4.53 0.00 -3.15 2.11 0.00 -1.26 -4.23 120.64 118.63 1gri n GLU 16 Ca -0.02 0.00 0.06 0.00 0.00 0.00 0.00 57.16 57.20 1gri n GLU 16 Cb 0.41 0.00 -0.01 0.00 0.00 0.00 0.00 31.44 31.84 1gri n GLU 16 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.13 175.96 1gri s LEU 17 N 0.00 -0.13 0.13 -1.84 2.96 0.03 -1.45 118.68 118.38 1gri s LEU 17 Ca 0.00 0.07 -0.26 0.00 -0.22 0.00 0.00 54.13 53.72 1gri s LEU 17 Cb 0.00 1.10 -0.07 0.00 0.50 0.00 0.00 46.19 47.72 1gri s LEU 17 CO 0.00 -0.02 0.80 -0.44 -1.32 0.00 0.00 176.35 175.36 1gri s SER 18 N 2.99 7.36 -0.01 3.68 0.01 -1.26 -4.72 113.70 121.75 1gri s SER 18 Ca 0.00 1.62 -0.15 0.00 1.31 0.00 0.00 55.95 58.73 1gri s SER 18 Cb -0.07 -2.50 0.02 0.00 0.21 0.00 0.00 66.02 63.68 1gri s SER 18 CO -0.11 0.13 0.30 0.72 0.41 0.00 0.00 173.24 174.70 1gri s PHE 19 N -0.73 -0.18 0.28 2.43 -0.12 -1.00 -4.97 117.98 113.70 1gri s PHE 19 Ca 0.38 0.26 -0.04 0.00 -0.05 0.00 0.00 56.93 57.47 1gri s PHE 19 Cb -0.23 0.09 -0.05 0.00 -0.63 0.00 0.00 43.02 42.21 1gri s PHE 19 CO 0.26 -0.39 0.53 0.21 -0.05 0.00 0.00 175.22 175.79 1gri s LYS 20 N -1.32 3.61 0.16 1.99 2.20 -1.26 -1.19 119.74 123.93 1gri s LYS 20 Ca -0.14 -0.06 -0.31 0.00 -0.36 0.00 0.00 55.97 55.10 1gri s LYS 20 Cb -0.05 -2.67 -0.11 0.00 -1.51 0.00 0.00 37.83 33.49 1gri s LYS 20 CO 0.04 0.23 1.72 0.50 -0.36 0.00 0.00 175.35 177.49 1gri s ARG 21 N -3.57 4.15 0.00 4.03 3.52 -1.26 -1.58 118.95 124.24 1gri s ARG 21 Ca 0.43 2.54 0.00 0.00 -0.13 0.00 0.00 55.73 58.57 1gri s ARG 21 Cb -0.11 -3.29 0.00 0.00 -1.56 0.00 0.00 34.95 29.99 1gri s ARG 21 CO 0.30 -0.75 0.00 0.41 -0.81 0.00 0.00 175.30 174.45 1gri n GLY 22 N 4.02 2.69 3.72 8.12 0.00 -0.57 -4.96 105.19 118.22 1gri n GLY 22 Ca 0.16 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.79 1gri n GLY 22 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1gri n ASP 23 N 0.00 2.50 -4.48 1.61 9.92 -0.61 -4.64 116.55 120.85 1gri n ASP 23 Ca 0.00 1.00 -0.38 0.00 -0.53 0.00 0.00 54.79 54.87 1gri n ASP 23 Cb 0.00 -1.54 -0.12 0.00 -0.64 0.00 0.00 41.12 38.82 1gri n ASP 23 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 1gri s ILE 24 N -1.29 4.77 -0.15 0.53 -1.09 -1.26 0.04 121.20 122.75 1gri s ILE 24 Ca 0.69 -0.24 -0.05 0.00 -2.23 0.00 0.00 60.65 58.82 1gri s ILE 24 Cb -0.44 -3.37 -0.04 0.00 -1.58 0.00 0.00 42.46 37.04 1gri s ILE 24 CO 0.51 0.14 0.03 -0.76 -1.23 0.00 0.00 174.94 173.63 1gri s LEU 25 N 1.65 3.66 -0.68 2.97 1.43 0.13 -4.92 118.68 122.92 1gri s LEU 25 Ca 0.06 0.07 -0.27 0.00 -1.03 0.00 0.00 54.13 52.96 1gri s LEU 25 Cb -0.17 -1.89 0.01 0.00 0.03 0.00 0.00 46.19 44.17 1gri s LEU 25 CO 0.07 0.24 1.47 -0.54 0.23 0.00 0.00 176.35 177.82 1gri s LYS 26 N -0.02 3.03 0.00 1.70 1.02 -0.55 -1.46 119.74 123.45 1gri s LYS 26 Ca 0.04 0.09 0.00 0.00 0.02 0.00 0.00 55.97 56.13 1gri s LYS 26 Cb -0.12 -4.24 0.00 0.00 -0.52 0.00 0.00 37.83 32.95 1gri s LYS 26 CO 0.02 -2.31 0.00 1.55 -0.92 0.00 0.00 175.35 173.69 1gri n VAL 27 N 6.69 0.00 -1.01 3.17 3.14 0.14 -1.08 118.33 129.37 1gri n VAL 27 Ca 0.09 0.00 -0.00 0.00 -2.96 0.00 0.00 64.34 61.47 1gri n VAL 27 Cb 0.50 -0.66 -0.00 0.00 -1.06 0.00 0.00 33.84 32.62 1gri n VAL 27 CO 0.00 0.00 0.00 1.67 -6.46 0.00 0.00 176.83 172.04 1gri n GLN 34 N -0.59 -0.50 -0.43 1.45 7.27 -1.26 -3.20 117.38 120.12 1gri n GLN 34 Ca 0.00 0.17 0.00 0.00 0.07 0.00 0.00 57.00 57.24 1gri n GLN 34 Cb 0.00 -3.59 0.00 0.00 2.41 0.00 0.00 30.24 29.06 1gri n GLN 34 CO 0.00 0.00 0.00 0.09 0.07 0.00 0.00 177.06 177.22 1gri n ASN 35 N -0.14 0.00 -3.64 1.69 5.03 -1.26 -4.89 115.26 112.04 1gri n ASN 35 Ca -0.00 0.00 -0.21 0.00 0.87 0.00 0.00 54.58 55.24 1gri n ASN 35 Cb 0.13 -2.20 -0.17 0.00 -1.02 0.00 0.00 39.78 36.52 1gri n ASN 35 CO 0.00 0.00 0.00 0.26 -1.83 0.00 0.00 177.26 175.69 1gri s TRP 36 N -0.89 0.04 0.21 3.10 0.52 -1.26 -2.27 118.94 118.39 1gri s TRP 36 Ca 0.00 0.16 -0.18 0.00 0.02 0.00 0.00 56.10 56.10 1gri s TRP 36 Cb 0.00 -0.50 -0.08 0.00 -1.15 0.00 0.00 33.47 31.75 1gri s TRP 36 CO 0.00 -0.31 0.68 0.71 0.02 0.00 0.00 176.95 178.05 1gri s TYR 37 N 2.19 3.62 0.05 -1.98 2.02 0.14 -4.87 117.35 118.51 1gri s TYR 37 Ca 0.04 1.28 -0.22 0.00 -0.37 0.00 0.00 57.07 57.81 1gri s TYR 37 Cb -0.13 -2.54 -0.06 0.00 -0.40 0.00 0.00 41.96 38.82 1gri s TYR 37 CO -0.06 0.35 0.64 0.21 -1.57 0.00 0.00 175.55 175.12 1gri s LYS 38 N -2.04 4.35 0.35 -0.62 2.36 -1.26 -0.18 119.74 122.70 1gri s LYS 38 Ca 0.42 0.86 -0.15 0.00 -2.55 0.00 0.00 55.97 54.55 1gri s LYS 38 Cb -0.16 -3.30 0.04 0.00 -1.05 0.00 0.00 37.83 33.36 1gri s LYS 38 CO 0.20 0.46 0.72 0.00 1.55 0.00 0.00 175.35 178.28 1gri s ALA 39 N -0.56 -0.61 0.02 3.13 0.00 0.37 -4.75 121.76 119.35 1gri s ALA 39 Ca 0.32 -0.77 -0.02 0.00 0.00 0.00 0.00 51.96 51.49 1gri s ALA 39 Cb -0.20 0.80 -0.01 0.00 0.00 0.00 0.00 23.12 23.71 1gri s ALA 39 CO 0.20 -0.96 0.02 -1.83 0.00 0.00 0.00 175.76 173.19 1gri s GLU 40 N -2.84 0.38 0.00 0.00 -1.05 -0.24 -0.82 118.70 114.13 1gri s GLU 40 Ca 0.17 -0.58 0.00 0.00 -0.15 0.00 0.00 54.97 54.41 1gri s GLU 40 Cb -0.04 0.14 0.00 0.00 -0.44 0.00 0.00 34.13 33.79 1gri s GLU 40 CO 0.12 -0.07 0.00 -0.11 0.95 0.00 0.00 175.26 176.14 1gri n LEU 41 N 1.47 0.00 -0.62 1.83 7.94 -1.04 -1.48 117.00 125.10 1gri n LEU 41 Ca -0.23 0.00 0.11 0.00 -1.11 0.00 0.00 56.01 54.78 1gri n LEU 41 Cb 0.55 0.00 0.36 0.00 0.53 0.00 0.00 43.42 44.86 1gri n LEU 41 CO 0.21 0.00 0.77 -0.46 -1.11 0.00 0.00 177.39 176.79 1gri n ASN 42 N 0.00 1.86 0.00 1.96 6.94 -1.26 -4.84 115.26 119.92 1gri n ASN 42 Ca 0.00 -1.74 0.00 0.00 -0.02 0.00 0.00 54.58 52.82 1gri n ASN 42 Cb 0.00 -0.12 0.00 0.00 -2.36 0.00 0.00 39.78 37.30 1gri n ASN 42 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1gri n GLY 43 N 1.17 4.06 3.77 4.83 0.00 -1.26 -5.08 105.19 112.68 1gri n GLY 43 Ca 0.16 -0.70 -0.39 0.00 0.00 0.00 0.00 46.02 45.09 1gri n GLY 43 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1gri s LYS 44 N 0.00 4.68 0.32 1.61 1.02 -1.26 -5.04 119.74 121.07 1gri s LYS 44 Ca 0.00 1.30 0.03 0.00 0.02 0.00 0.00 55.97 57.31 1gri s LYS 44 Cb 0.00 -3.22 -0.01 0.00 -0.52 0.00 0.00 37.83 34.08 1gri s LYS 44 CO 0.00 0.52 0.10 -0.40 -0.92 0.00 0.00 175.35 174.65 1gri n ASP 45 N 1.44 1.43 0.00 2.83 5.68 -1.26 -2.50 116.55 124.18 1gri n ASP 45 Ca -0.04 -2.67 0.00 0.00 -0.50 0.00 0.00 54.79 51.58 1gri n ASP 45 Cb 0.48 0.72 0.00 0.00 -1.14 0.00 0.00 41.12 41.18 1gri n ASP 45 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1gri n GLY 46 N -0.01 -0.58 3.93 6.12 0.00 0.00 -4.77 105.19 109.88 1gri n GLY 46 Ca -0.06 -0.54 -0.25 0.00 0.00 0.00 0.00 46.02 45.17 1gri n GLY 46 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1gri s PHE 47 N -4.00 3.42 -0.08 1.61 0.40 -0.53 0.14 117.98 118.94 1gri s PHE 47 Ca 0.00 0.06 -0.07 0.00 -0.60 0.00 0.00 56.93 56.32 1gri s PHE 47 Cb 0.00 -1.61 0.02 0.00 0.51 0.00 0.00 43.02 41.94 1gri s PHE 47 CO 0.00 0.50 0.21 0.42 0.70 0.00 0.00 175.22 177.05 1gri s ILE 48 N -1.82 -0.00 0.40 0.64 1.09 0.75 -0.79 121.20 121.47 1gri s ILE 48 Ca 0.34 0.01 -0.25 0.00 -1.10 0.00 0.00 60.65 59.65 1gri s ILE 48 Cb -0.10 -0.30 -0.08 0.00 -1.06 0.00 0.00 42.46 40.91 1gri s ILE 48 CO 0.28 0.00 1.12 -2.16 -0.10 0.00 0.00 174.94 174.08 1gri s PRO 49 N 0.17 4.08 0.16 2.79 0.04 -1.26 -0.69 135.00 140.29 1gri s PRO 49 Ca -0.01 1.69 -0.10 0.00 0.04 0.00 0.00 61.00 62.62 1gri s PRO 49 Cb -0.02 -2.60 0.02 0.00 0.04 0.00 0.00 34.50 31.94 1gri s PRO 49 CO -0.00 -0.26 1.57 -0.22 0.04 0.00 0.00 177.00 178.13 1gri h LYS 50 N 2.54 0.99 -1.28 4.56 3.64 -1.82 -3.20 116.57 122.00 1gri h LYS 50 Ca -0.49 -0.38 -0.31 0.00 -1.27 0.00 0.00 60.65 58.21 1gri h LYS 50 Cb 1.23 -0.06 -0.15 0.00 -0.41 0.00 0.00 32.23 32.84 1gri h LYS 50 CO 0.62 1.06 0.39 0.27 -2.27 0.00 0.00 179.45 179.52 1gri n ASN 51 N -4.17 5.15 -0.06 4.20 6.94 -1.26 -2.89 115.26 123.16 1gri n ASN 51 Ca 0.01 -2.97 0.01 0.00 -0.02 0.00 0.00 54.58 51.60 1gri n ASN 51 Cb 0.41 -0.89 0.01 0.00 -2.36 0.00 0.00 39.78 36.95 1gri n ASN 51 CO 0.00 0.00 0.00 -1.22 -1.03 0.00 0.00 177.26 175.01 1gri n TYR 52 N 0.01 0.00 -4.29 -2.53 4.02 -1.21 -4.92 117.16 108.25 1gri n TYR 52 Ca 0.31 -0.04 -0.24 0.00 -0.01 0.00 0.00 57.90 57.93 1gri n TYR 52 Cb 0.81 -0.00 -0.12 0.00 -0.02 0.00 0.00 39.34 40.00 1gri n TYR 52 CO 0.00 0.00 0.00 0.96 -1.01 0.00 0.00 176.86 176.81 1gri s ILE 53 N -0.19 1.74 0.17 -0.72 -4.36 -1.14 0.93 121.20 117.64 1gri s ILE 53 Ca 0.02 -1.60 0.00 0.00 -0.26 0.00 0.00 60.65 58.81 1gri s ILE 53 Cb 0.01 -1.61 -0.04 0.00 1.25 0.00 0.00 42.46 42.07 1gri s ILE 53 CO 0.02 -0.09 0.05 -0.70 0.24 0.00 0.00 174.94 174.46 1gri s GLU 54 N -2.04 1.09 0.34 0.37 2.56 -0.53 -4.88 118.70 115.62 1gri s GLU 54 Ca 0.08 -1.54 -0.28 0.00 0.00 0.00 0.00 54.97 53.22 1gri s GLU 54 Cb -0.09 0.00 -0.12 0.00 2.00 0.00 0.00 34.13 35.92 1gri s GLU 54 CO 0.05 -0.24 1.42 -0.12 -0.56 0.00 0.00 175.26 175.81 1gri n MET 55 N -0.22 2.44 -2.03 4.30 0.00 -1.26 -0.82 117.12 119.52 1gri n MET 55 Ca -0.04 0.86 -0.42 0.00 0.00 0.00 0.00 57.70 58.09 1gri n MET 55 Cb 0.64 -2.53 -0.03 0.00 0.00 0.00 0.00 33.22 31.30 1gri n MET 55 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 175.97 176.18 1gri s LYS 56 N -1.71 3.29 1.28 2.12 2.20 -1.26 -4.49 119.74 121.17 1gri s LYS 56 Ca 0.56 1.31 -0.19 0.00 -0.36 0.00 0.00 55.97 57.30 1gri s LYS 56 Cb -0.52 -4.20 0.31 0.00 -1.51 0.00 0.00 37.83 31.91 1gri s LYS 56 CO 0.60 -1.91 1.02 -1.25 -0.36 0.00 0.00 175.35 173.45 1gri s PRO 57 N 5.72 -1.79 0.21 4.03 0.05 -1.26 -4.92 135.00 137.04 1gri s PRO 57 Ca 0.77 0.19 -0.30 0.00 0.05 0.00 0.00 61.00 61.71 1gri s PRO 57 Cb -0.21 -1.51 -0.09 0.00 0.05 0.00 0.00 34.50 32.75 1gri s PRO 57 CO 0.32 -4.14 1.35 -1.58 0.05 0.00 0.00 177.00 173.01 1gri s HIS 58 N -2.62 3.19 0.09 0.56 2.46 -1.26 -4.92 115.29 112.79 1gri s HIS 58 Ca 0.69 1.14 -0.15 0.00 0.47 0.00 0.00 55.06 57.21 1gri s HIS 58 Cb -0.14 -3.67 -0.11 0.00 -0.13 0.00 0.00 32.58 28.53 1gri s HIS 58 CO 0.58 -2.15 1.38 -1.00 -2.47 0.00 0.00 174.74 171.08 1gri h PRO 59 N 5.39 0.67 0.00 2.88 0.13 -1.99 -3.40 132.00 135.68 1gri h PRO 59 Ca -0.45 -0.40 0.00 0.00 -0.87 0.00 0.00 66.00 64.28 1gri h PRO 59 Cb 1.21 0.04 0.00 0.00 0.13 0.00 0.00 31.00 32.38 1gri h PRO 59 CO 0.78 1.01 -0.11 -2.67 -0.23 0.00 0.00 178.00 176.78 1gri n TRP 60 N -4.24 0.00 -2.91 1.56 4.27 -1.26 -4.53 117.44 110.33 1gri n TRP 60 Ca -0.05 0.00 -0.43 0.00 -3.89 0.00 0.00 57.50 53.13 1gri n TRP 60 Cb 0.51 0.00 -0.05 0.00 -1.36 0.00 0.00 31.31 30.42 1gri n TRP 60 CO 0.00 0.00 0.00 0.12 -2.29 0.00 0.00 177.69 175.52 1gri s PHE 61 N -0.80 2.94 -0.48 -2.67 5.36 -1.26 -1.38 117.98 119.69 1gri s PHE 61 Ca 0.00 0.18 0.03 0.00 -0.96 0.00 0.00 56.93 56.17 1gri s PHE 61 Cb 0.00 -3.81 0.50 0.00 -0.34 0.00 0.00 43.02 39.37 1gri s PHE 61 CO 0.00 -1.08 1.72 1.19 -1.46 0.00 0.00 175.22 175.60 1gri n PHE 62 N 6.94 2.73 -1.37 10.12 3.72 -0.52 -4.89 117.46 134.19 1gri n PHE 62 Ca 0.03 -2.42 0.00 0.00 -0.05 0.00 0.00 57.45 55.01 1gri n PHE 62 Cb 0.48 -0.95 0.00 0.00 -0.94 0.00 0.00 39.48 38.07 1gri n PHE 62 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1gri n GLY 63 N -0.94 2.12 1.81 1.37 0.00 -1.26 -2.14 105.19 106.15 1gri n GLY 63 Ca 0.53 -0.25 -0.16 0.00 0.00 0.00 0.00 46.02 46.15 1gri n GLY 63 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1gri n LYS 64 N 14.00 1.79 -1.68 1.61 5.02 -1.26 -0.68 118.16 136.95 1gri n LYS 64 Ca 0.00 -1.67 -0.43 0.00 -2.02 0.00 0.00 58.31 54.20 1gri n LYS 64 Cb 0.00 -1.65 -0.03 0.00 -0.02 0.00 0.00 35.03 33.33 1gri n LYS 64 CO 0.00 0.00 0.00 -1.50 -0.52 0.00 0.00 177.40 175.38 1gri s ILE 65 N -2.19 3.09 0.42 -0.18 1.10 -0.91 -4.64 121.20 117.89 1gri s ILE 65 Ca 0.32 0.10 -0.26 0.00 -0.51 0.00 0.00 60.65 60.30 1gri s ILE 65 Cb 0.26 -3.11 -0.09 0.00 0.15 0.00 0.00 42.46 39.67 1gri s ILE 65 CO 0.02 -0.06 1.43 -2.16 -2.11 0.00 0.00 174.94 172.06 1gri s PRO 66 N 5.91 3.88 0.33 3.50 0.05 -1.26 -4.61 135.00 142.80 1gri s PRO 66 Ca 0.95 2.45 0.09 0.00 0.05 0.00 0.00 61.00 64.54 1gri s PRO 66 Cb -0.33 -2.79 0.98 0.00 0.05 0.00 0.00 34.50 32.41 1gri s PRO 66 CO 0.36 -0.67 1.58 -0.09 0.05 0.00 0.00 177.00 178.23 1gri h ARG 67 N 2.63 0.04 0.04 4.56 2.43 -1.97 0.44 114.38 122.54 1gri h ARG 67 Ca -0.51 -0.00 0.01 0.00 -0.81 0.00 0.00 59.98 58.67 1gri h ARG 67 Cb 1.25 -0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 30.76 1gri h ARG 67 CO 0.62 0.02 -0.33 0.00 -1.51 0.00 0.00 179.97 178.78 1gri h ALA 68 N 1.97 -0.80 -0.80 2.80 0.00 -1.99 0.72 119.26 121.17 1gri h ALA 68 Ca 0.69 -0.06 0.09 0.00 0.00 0.00 0.00 54.91 55.63 1gri h ALA 68 Cb 1.61 0.75 -0.07 0.00 0.00 0.00 0.00 17.79 20.08 1gri h ALA 68 CO -0.83 -0.89 0.45 -0.22 0.00 0.00 0.00 179.25 177.76 1gri h LYS 69 N -0.44 0.75 -0.06 0.00 1.63 -0.67 0.55 116.57 118.34 1gri h LYS 69 Ca 0.00 -0.05 0.04 0.00 -0.85 0.00 0.00 60.65 59.79 1gri h LYS 69 Cb 0.45 -0.17 -0.05 0.00 -0.60 0.00 0.00 32.23 31.86 1gri h LYS 69 CO -0.20 0.50 -0.31 0.00 -3.45 0.00 0.00 179.45 176.00 1gri h ALA 70 N 1.43 -0.40 0.04 5.00 0.00 0.05 -1.58 119.26 123.80 1gri h ALA 70 Ca 0.38 0.00 0.02 0.00 0.00 0.00 0.00 54.91 55.31 1gri h ALA 70 Cb 0.32 0.56 -0.05 0.00 0.00 0.00 0.00 17.79 18.62 1gri h ALA 70 CO -0.23 -0.80 -0.51 0.93 0.00 0.00 0.00 179.25 178.64 1gri h GLU 71 N -0.42 -0.64 0.00 0.00 5.08 0.19 -2.35 114.58 116.43 1gri h GLU 71 Ca 0.08 0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.48 1gri h GLU 71 Cb 0.54 0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.93 1gri h GLU 71 CO -0.29 -0.43 0.00 0.39 -1.00 0.00 0.00 179.01 177.68 1gri n GLU 72 N -5.30 0.00 0.13 2.33 1.02 0.18 -0.44 120.64 118.56 1gri n GLU 72 Ca -0.07 0.20 0.10 0.00 -0.02 0.00 0.00 57.16 57.37 1gri n GLU 72 Cb 0.38 -0.71 0.60 0.00 -0.02 0.00 0.00 31.44 31.68 1gri n GLU 72 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1gri h MET 73 N 0.00 0.14 -0.33 3.49 -0.00 -1.40 -1.38 114.93 115.44 1gri h MET 73 Ca 0.00 -0.01 -0.08 0.00 -0.00 0.00 0.00 59.70 59.61 1gri h MET 73 Cb 0.00 -0.03 -0.01 0.00 -0.00 0.00 0.00 31.60 31.56 1gri h MET 73 CO 0.00 0.09 -0.11 1.25 -0.00 0.00 0.00 176.91 178.14 1gri h LEU 74 N 0.14 0.67 -1.31 -0.10 5.85 -1.35 -3.11 115.31 116.10 1gri h LEU 74 Ca 0.10 -0.38 0.03 0.00 0.84 0.00 0.00 57.88 58.47 1gri h LEU 74 Cb 0.23 -0.18 -0.04 0.00 0.37 0.00 0.00 40.66 41.04 1gri h LEU 74 CO -0.01 0.90 0.48 0.77 -0.34 0.00 0.00 178.44 180.24 1gri h SER 75 N 0.43 0.78 -0.15 1.25 4.64 0.40 -2.98 113.55 117.93 1gri h SER 75 Ca 0.08 -0.01 -0.18 0.00 -0.47 0.00 0.00 61.79 61.20 1gri h SER 75 Cb 0.63 -0.18 -0.07 0.00 -0.31 0.00 0.00 62.40 62.46 1gri h SER 75 CO 0.04 0.54 -0.15 0.29 -0.87 0.00 0.00 176.83 176.69 1gri n LYS 76 N -4.45 1.77 -5.03 4.77 5.02 -1.10 -4.92 118.16 114.22 1gri n LYS 76 Ca 0.09 -0.93 -0.31 0.00 -2.02 0.00 0.00 58.31 55.14 1gri n LYS 76 Cb 0.10 -1.73 -0.14 0.00 -0.02 0.00 0.00 35.03 33.24 1gri n LYS 76 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 1gri s GLN 77 N 0.25 2.16 -0.60 1.97 -1.52 -1.13 -5.04 119.66 115.76 1gri s GLN 77 Ca 0.46 -0.90 -0.05 0.00 -1.95 0.00 0.00 55.36 52.92 1gri s GLN 77 Cb 0.24 -2.15 -0.01 0.00 -0.22 0.00 0.00 33.01 30.87 1gri s GLN 77 CO -0.03 0.57 2.90 0.54 -0.25 0.00 0.00 175.29 179.02 1gri n ARG 78 N 2.16 2.83 0.00 2.91 1.74 -1.26 -4.79 116.66 120.25 1gri n ARG 78 Ca -0.16 -2.26 0.00 0.00 -0.77 0.00 0.00 57.85 54.66 1gri n ARG 78 Cb 0.52 -2.25 0.00 0.00 -1.02 0.00 0.00 32.46 29.71 1gri n ARG 78 CO 0.00 0.00 0.00 -2.39 -1.52 0.00 0.00 177.63 173.72 1gri n HIS 79 N 1.57 0.00 -2.39 -1.55 1.44 -1.26 -5.09 115.22 107.95 1gri n HIS 79 Ca 0.52 0.00 -0.40 0.00 -2.01 0.00 0.00 57.72 55.84 1gri n HIS 79 Cb 0.55 0.00 -0.03 0.00 0.12 0.00 0.00 29.99 30.63 1gri n HIS 79 CO 0.00 0.00 0.00 -0.51 -2.81 0.00 0.00 176.34 173.02 1gri s ASP 80 N 0.00 7.01 0.00 4.39 1.01 -1.26 -3.39 116.67 124.43 1gri s ASP 80 Ca 0.00 2.34 0.00 0.00 0.71 0.00 0.00 52.55 55.60 1gri s ASP 80 Cb 0.00 -2.63 0.00 0.00 1.01 0.00 0.00 42.92 41.30 1gri s ASP 80 CO 0.00 -0.33 0.00 0.61 0.21 0.00 0.00 175.17 175.66 1gri n GLY 81 N 0.95 0.82 3.62 0.21 0.00 0.04 -4.61 105.19 106.22 1gri n GLY 81 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.63 1gri n GLY 81 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gri n ALA 82 N -1.07 0.26 -3.63 4.61 0.00 -1.22 -2.28 120.51 117.18 1gri n ALA 82 Ca 0.00 0.14 -0.09 0.00 0.00 0.00 0.00 53.44 53.49 1gri n ALA 82 Cb 0.00 -2.10 -0.02 0.00 0.00 0.00 0.00 19.45 17.33 1gri n ALA 82 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 1gri s PHE 83 N -1.37 -0.29 0.16 0.00 -0.71 -1.22 -1.64 117.98 112.91 1gri s PHE 83 Ca 0.68 -0.06 -0.02 0.00 -1.04 0.00 0.00 56.93 56.48 1gri s PHE 83 Cb -0.49 0.61 -0.04 0.00 -1.21 0.00 0.00 43.02 41.89 1gri s PHE 83 CO 0.53 -1.06 0.12 -0.48 -1.34 0.00 0.00 175.22 172.99 1gri s LEU 84 N -2.86 1.43 -0.07 -1.99 2.34 -1.18 -4.41 118.68 111.95 1gri s LEU 84 Ca 0.07 -1.23 0.02 0.00 0.06 0.00 0.00 54.13 53.06 1gri s LEU 84 Cb -0.04 0.46 0.01 0.00 -0.56 0.00 0.00 46.19 46.07 1gri s LEU 84 CO -0.01 -0.80 -0.13 -0.63 -1.06 0.00 0.00 176.35 173.72 1gri s ILE 85 N -4.08 1.21 0.04 1.48 1.01 -0.48 -2.50 121.20 117.88 1gri s ILE 85 Ca 0.28 -0.51 0.01 0.00 0.00 0.00 0.00 60.65 60.43 1gri s ILE 85 Cb 0.07 -1.10 -0.03 0.00 0.01 0.00 0.00 42.46 41.41 1gri s ILE 85 CO 0.05 0.37 -0.05 0.00 0.00 0.00 0.00 174.94 175.32 1gri s ARG 86 N 0.73 0.46 0.53 2.79 1.70 -1.06 -1.44 118.95 122.66 1gri s ARG 86 Ca -0.13 -0.78 -0.03 0.00 -0.47 0.00 0.00 55.73 54.32 1gri s ARG 86 Cb -0.16 -0.05 0.01 0.00 -0.57 0.00 0.00 34.95 34.17 1gri s ARG 86 CO 0.03 -0.02 0.79 -2.00 -1.08 0.00 0.00 175.30 173.02 1gri s GLU 87 N -1.94 2.95 -0.40 3.89 2.12 0.14 -1.76 118.70 123.70 1gri s GLU 87 Ca -0.09 -0.27 0.04 0.00 0.36 0.00 0.00 54.97 55.00 1gri s GLU 87 Cb -0.07 -2.41 0.11 0.00 0.26 0.00 0.00 34.13 32.02 1gri s GLU 87 CO -0.02 -0.51 0.13 0.45 -0.54 0.00 0.00 175.26 174.77 1gri s SER 88 N -4.27 4.65 0.00 -1.70 0.15 -0.95 -4.35 113.70 107.22 1gri s SER 88 Ca 0.52 -2.44 0.00 0.00 0.70 0.00 0.00 55.95 54.73 1gri s SER 88 Cb -0.10 -1.64 0.00 0.00 -1.71 0.00 0.00 66.02 62.56 1gri s SER 88 CO 0.41 -0.34 0.00 1.21 1.20 0.00 0.00 173.24 175.73 1gri n GLU 89 N 3.89 0.00 0.00 5.44 4.07 -1.26 -0.77 120.64 132.01 1gri n GLU 89 Ca 0.04 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.14 1gri n GLU 89 Cb 0.39 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.77 1gri n GLU 89 CO 0.00 0.00 0.00 -1.13 -0.06 0.00 0.00 177.13 175.94 1gri n SER 90 N -2.72 0.00 -4.55 4.31 3.41 -1.26 -4.52 113.62 108.28 1gri n SER 90 Ca 0.00 0.36 -0.41 0.00 -0.26 0.00 0.00 58.87 58.56 1gri n SER 90 Cb 0.00 -0.22 -0.03 0.00 -0.26 0.00 0.00 64.21 63.70 1gri n SER 90 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1gri s ALA 91 N -3.25 2.68 0.04 7.33 0.00 0.05 -4.92 121.76 123.69 1gri s ALA 91 Ca 0.00 -1.69 -0.19 0.00 0.00 0.00 0.00 51.96 50.08 1gri s ALA 91 Cb 0.00 -4.37 -0.10 0.00 0.00 0.00 0.00 23.12 18.65 1gri s ALA 91 CO 0.00 -3.48 1.29 -1.35 0.00 0.00 0.00 175.76 172.23 1gri h PRO 92 N 10.16 -0.59 0.00 0.00 0.11 -1.77 -3.19 132.00 136.73 1gri h PRO 92 Ca -0.09 0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.06 1gri h PRO 92 Cb 1.04 0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1gri h PRO 92 CO 1.33 -0.39 0.01 0.41 -0.21 0.00 0.00 178.00 179.15 1gri n GLY 93 N -1.32 -0.05 3.60 -0.55 0.00 -1.26 -3.86 105.19 101.76 1gri n GLY 93 Ca -0.07 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.64 1gri n GLY 93 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1gri s ASP 94 N -1.96 4.59 0.15 1.61 1.01 -1.20 -5.02 116.67 115.84 1gri s ASP 94 Ca 0.00 -0.28 0.09 0.00 0.71 0.00 0.00 52.55 53.07 1gri s ASP 94 Cb 0.00 -0.98 -0.04 0.00 1.01 0.00 0.00 42.92 42.91 1gri s ASP 94 CO 0.00 0.21 -0.15 -0.36 0.21 0.00 0.00 175.17 175.08 1gri s PHE 95 N -1.18 2.57 -0.10 4.23 0.08 -1.26 -2.24 117.98 120.08 1gri s PHE 95 Ca 0.21 -0.25 -0.05 0.00 0.12 0.00 0.00 56.93 56.96 1gri s PHE 95 Cb -0.11 -1.31 0.04 0.00 -0.57 0.00 0.00 43.02 41.07 1gri s PHE 95 CO 0.13 0.45 0.23 -1.54 -0.10 0.00 0.00 175.22 174.38 1gri s SER 96 N -2.44 -0.23 0.33 1.36 1.04 -0.73 -0.92 113.70 112.11 1gri s SER 96 Ca 0.21 0.48 -0.19 0.00 0.48 0.00 0.00 55.95 56.93 1gri s SER 96 Cb -0.10 0.37 -0.09 0.00 0.10 0.00 0.00 66.02 66.30 1gri s SER 96 CO 0.12 -0.15 0.82 -0.22 0.98 0.00 0.00 173.24 174.79 1gri s LEU 97 N 1.13 4.12 -0.06 2.42 0.20 0.04 -2.55 118.68 123.99 1gri s LEU 97 Ca -0.08 1.49 0.00 0.00 0.69 0.00 0.00 54.13 56.23 1gri s LEU 97 Cb -0.10 -4.10 0.02 0.00 -0.43 0.00 0.00 46.19 41.58 1gri s LEU 97 CO -0.07 -0.19 -0.03 -0.44 -0.29 0.00 0.00 176.35 175.33 1gri s SER 98 N -2.05 1.26 0.08 3.68 0.01 -1.04 -1.85 113.70 113.79 1gri s SER 98 Ca 0.54 -0.13 0.07 0.00 1.31 0.00 0.00 55.95 57.74 1gri s SER 98 Cb -0.12 -0.49 -0.03 0.00 0.21 0.00 0.00 66.02 65.59 1gri s SER 98 CO 0.18 -0.10 -0.19 -0.69 0.41 0.00 0.00 173.24 172.85 1gri s VAL 99 N 1.30 1.55 -1.01 3.43 1.01 -0.67 -3.07 120.40 122.93 1gri s VAL 99 Ca -0.05 -1.42 -0.21 0.00 0.00 0.00 0.00 61.98 60.31 1gri s VAL 99 Cb -0.14 -1.41 0.09 0.00 0.00 0.00 0.00 36.38 34.92 1gri s VAL 99 CO -0.02 -0.06 1.35 -0.75 0.00 0.00 0.00 175.10 175.62 1gri s LYS 100 N -1.73 3.64 -0.50 2.72 2.20 -0.65 -0.31 119.74 125.11 1gri s LYS 100 Ca 0.04 -1.47 -0.19 0.00 -0.36 0.00 0.00 55.97 53.99 1gri s LYS 100 Cb -0.10 -5.19 0.05 0.00 -1.51 0.00 0.00 37.83 31.08 1gri s LYS 100 CO 0.03 -2.03 0.63 0.12 -0.36 0.00 0.00 175.35 173.74 1gri s PHE 101 N 3.95 3.05 0.00 4.03 5.36 0.36 -0.78 117.98 133.94 1gri s PHE 101 Ca 0.41 -0.47 0.00 0.00 -0.96 0.00 0.00 56.93 55.91 1gri s PHE 101 Cb -0.02 -3.52 0.00 0.00 -0.34 0.00 0.00 43.02 39.15 1gri s PHE 101 CO -0.08 -1.02 0.00 0.41 -1.46 0.00 0.00 175.22 173.07 1gri n GLY 102 N 5.16 0.59 0.00 13.12 0.00 -1.26 0.62 105.19 123.42 1gri n GLY 102 Ca -0.06 0.68 0.00 0.00 0.00 0.00 0.00 46.02 46.64 1gri n GLY 102 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1gri n ASN 103 N 1.96 0.25 -4.19 1.61 6.94 -1.26 -4.90 115.26 115.67 1gri n ASN 103 Ca 0.00 -0.68 -0.12 0.00 -0.02 0.00 0.00 54.58 53.75 1gri n ASN 103 Cb 0.00 0.16 -0.10 0.00 -2.36 0.00 0.00 39.78 37.48 1gri n ASN 103 CO 0.00 0.00 0.00 1.51 -1.03 0.00 0.00 177.26 177.74 1gri s ASP 104 N -0.16 1.34 -0.36 0.53 1.47 0.20 -4.92 116.67 114.77 1gri s ASP 104 Ca 0.00 -0.95 -0.25 0.00 1.18 0.00 0.00 52.55 52.52 1gri s ASP 104 Cb 0.00 0.05 0.01 0.00 -0.34 0.00 0.00 42.92 42.64 1gri s ASP 104 CO 0.00 -0.38 0.90 -0.69 0.68 0.00 0.00 175.17 175.67 1gri s VAL 105 N -3.23 4.62 -0.21 2.11 1.01 -1.25 0.13 120.40 123.58 1gri s VAL 105 Ca 0.11 1.17 -0.04 0.00 0.00 0.00 0.00 61.98 63.22 1gri s VAL 105 Cb 0.02 -4.30 -0.01 0.00 0.00 0.00 0.00 36.38 32.09 1gri s VAL 105 CO -0.02 -0.49 -0.04 -1.58 0.00 0.00 0.00 175.10 172.97 1gri s GLN 106 N 3.37 3.42 0.58 2.72 0.74 0.58 -4.86 119.66 126.20 1gri s GLN 106 Ca 0.37 -0.61 0.00 0.00 0.05 0.00 0.00 55.36 55.17 1gri s GLN 106 Cb -0.12 -3.00 0.04 0.00 1.10 0.00 0.00 33.01 31.03 1gri s GLN 106 CO 0.18 -0.14 0.81 -1.01 -0.55 0.00 0.00 175.29 174.58 1gri s HIS 107 N 1.32 2.86 -0.28 1.67 3.76 -1.26 -1.67 115.29 121.69 1gri s HIS 107 Ca 0.04 0.05 -0.09 0.00 -0.15 0.00 0.00 55.06 54.91 1gri s HIS 107 Cb -0.14 -2.83 0.12 0.00 1.11 0.00 0.00 32.58 30.84 1gri s HIS 107 CO -0.02 -0.96 0.61 -0.06 -0.85 0.00 0.00 174.74 173.45 1gri s PHE 108 N -2.84 -1.25 0.14 1.40 0.40 -0.77 -4.99 117.98 110.08 1gri s PHE 108 Ca 0.58 2.18 -0.31 0.00 -0.60 0.00 0.00 56.93 58.79 1gri s PHE 108 Cb -0.10 0.71 -0.08 0.00 0.51 0.00 0.00 43.02 44.06 1gri s PHE 108 CO 0.39 -0.63 1.33 0.15 0.70 0.00 0.00 175.22 177.16 1gri s LYS 109 N 2.85 4.36 -0.28 0.44 1.02 -1.26 -0.78 119.74 126.09 1gri s LYS 109 Ca -0.05 2.02 -0.13 0.00 0.02 0.00 0.00 55.97 57.83 1gri s LYS 109 Cb -0.12 -3.24 -0.04 0.00 -0.52 0.00 0.00 37.83 33.91 1gri s LYS 109 CO -0.18 -0.34 0.28 0.08 -0.92 0.00 0.00 175.35 174.27 1gri s VAL 110 N 0.70 5.25 0.12 3.17 1.01 -0.10 -4.74 120.40 125.81 1gri s VAL 110 Ca 0.61 0.32 0.07 0.00 0.00 0.00 0.00 61.98 62.98 1gri s VAL 110 Cb -0.36 -3.62 -0.04 0.00 0.00 0.00 0.00 36.38 32.36 1gri s VAL 110 CO 0.33 0.19 -0.09 -0.76 0.00 0.00 0.00 175.10 174.76 1gri s LEU 111 N 1.90 3.05 -0.09 3.92 1.43 -0.74 -4.05 118.68 124.10 1gri s LEU 111 Ca 0.11 -0.41 0.04 0.00 -1.03 0.00 0.00 54.13 52.83 1gri s LEU 111 Cb -0.16 -1.83 0.00 0.00 0.03 0.00 0.00 46.19 44.24 1gri s LEU 111 CO 0.11 0.16 -0.23 -0.60 0.23 0.00 0.00 176.35 176.02 1gri s ARG 112 N -2.33 2.86 -0.91 1.70 3.52 -1.25 -0.52 118.95 122.02 1gri s ARG 112 Ca 0.22 -0.83 -0.02 0.00 -0.13 0.00 0.00 55.73 54.97 1gri s ARG 112 Cb -0.11 -2.19 0.27 0.00 -1.56 0.00 0.00 34.95 31.37 1gri s ARG 112 CO 0.14 0.17 2.10 -0.40 -0.81 0.00 0.00 175.30 176.51 1gri n ASP 113 N 3.53 7.39 0.00 -2.12 5.68 0.24 -4.87 116.55 126.40 1gri n ASP 113 Ca -0.19 -3.62 0.00 0.00 -0.50 0.00 0.00 54.79 50.47 1gri n ASP 113 Cb 0.53 -1.16 0.00 0.00 -1.14 0.00 0.00 41.12 39.35 1gri n ASP 113 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1gri n GLY 114 N 0.07 1.72 1.47 6.12 0.00 -1.26 -4.38 105.19 108.93 1gri n GLY 114 Ca 0.52 -0.12 -0.09 0.00 0.00 0.00 0.00 46.02 46.33 1gri n GLY 114 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gri n ALA 115 N 0.00 3.72 -0.98 4.61 0.00 -1.26 -4.85 120.51 121.74 1gri n ALA 115 Ca 0.00 -1.04 0.00 0.00 0.00 0.00 0.00 53.44 52.40 1gri n ALA 115 Cb 0.00 -1.17 0.00 0.00 0.00 0.00 0.00 19.45 18.28 1gri n ALA 115 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1gri n GLY 116 N -0.01 0.87 3.81 0.00 0.00 -1.26 -5.04 105.19 103.57 1gri n GLY 116 Ca 0.21 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.86 1gri n GLY 116 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1gri s LYS 117 N -0.02 3.94 -0.01 1.61 -0.14 -1.26 -4.80 119.74 119.06 1gri s LYS 117 Ca 0.00 0.28 -0.19 0.00 -1.36 0.00 0.00 55.97 54.70 1gri s LYS 117 Cb 0.00 -3.27 -0.05 0.00 -1.68 0.00 0.00 37.83 32.83 1gri s LYS 117 CO 0.00 0.58 0.53 0.71 -0.76 0.00 0.00 175.35 176.41 1gri s TYR 118 N -0.65 3.68 0.04 3.18 2.02 -0.97 0.83 117.35 125.48 1gri s TYR 118 Ca 0.21 1.12 -0.19 0.00 -0.37 0.00 0.00 57.07 57.84 1gri s TYR 118 Cb -0.15 -2.52 0.04 0.00 -0.40 0.00 0.00 41.96 38.93 1gri s TYR 118 CO 0.10 0.42 0.43 -0.59 -1.57 0.00 0.00 175.55 174.34 1gri s PHE 119 N -0.37 -0.30 -0.26 2.71 -0.71 0.32 -1.00 117.98 118.37 1gri s PHE 119 Ca 0.28 0.30 -0.15 0.00 -1.04 0.00 0.00 56.93 56.33 1gri s PHE 119 Cb -0.18 0.24 -0.14 0.00 -1.21 0.00 0.00 43.02 41.73 1gri s PHE 119 CO 0.15 -0.57 -0.21 1.28 -1.34 0.00 0.00 175.22 174.53 1gri n LEU 120 N 0.56 2.00 0.00 -1.99 4.32 -1.26 -1.79 117.00 118.83 1gri n LEU 120 Ca -0.19 0.33 0.00 0.00 -0.02 0.00 0.00 56.01 56.14 1gri n LEU 120 Cb 0.59 -0.86 0.00 0.00 -1.62 0.00 0.00 43.42 41.53 1gri n LEU 120 CO 0.20 0.53 0.00 0.79 -1.22 0.00 0.00 177.39 177.69 1gri n TRP 121 N -4.23 -0.17 -0.12 -1.77 8.01 -1.26 -4.92 117.44 112.98 1gri n TRP 121 Ca -0.49 0.00 -0.24 0.00 -1.31 0.00 0.00 57.50 55.46 1gri n TRP 121 Cb 0.85 0.13 -0.10 0.00 -2.01 0.00 0.00 31.31 30.18 1gri n TRP 121 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.69 176.96 1gri n VAL 122 N -1.40 1.53 -3.89 -0.99 0.31 -1.26 -4.95 118.33 107.68 1gri n VAL 122 Ca 0.00 -0.15 -0.37 0.00 -0.01 0.00 0.00 64.34 63.81 1gri n VAL 122 Cb 0.00 -2.00 -0.06 0.00 -0.91 0.00 0.00 33.84 30.87 1gri n VAL 122 CO 0.00 0.00 0.00 0.68 -1.32 0.00 0.00 176.83 176.19 1gri s VAL 123 N -2.43 5.49 0.02 2.52 -7.23 -1.26 -5.08 120.40 112.43 1gri s VAL 123 Ca -0.32 0.18 -0.04 0.00 -1.81 0.00 0.00 61.98 59.98 1gri s VAL 123 Cb 0.09 -3.40 -0.04 0.00 0.56 0.00 0.00 36.38 33.58 1gri s VAL 123 CO 0.53 0.60 0.24 -0.54 -0.31 0.00 0.00 175.10 175.62 1gri s LYS 124 N -1.10 3.51 0.15 4.82 1.02 -1.26 -4.16 119.74 122.72 1gri s LYS 124 Ca 0.16 -0.21 0.03 0.00 0.02 0.00 0.00 55.97 55.97 1gri s LYS 124 Cb -0.12 -3.06 -0.04 0.00 -0.52 0.00 0.00 37.83 34.09 1gri s LYS 124 CO 0.05 0.64 -0.05 -0.06 -0.92 0.00 0.00 175.35 175.01 1gri s PHE 125 N -1.37 1.16 -2.47 3.18 0.08 -0.17 -5.01 117.98 113.38 1gri s PHE 125 Ca 0.30 -0.90 0.23 0.00 0.12 0.00 0.00 56.93 56.67 1gri s PHE 125 Cb -0.13 -0.64 0.51 0.00 -0.57 0.00 0.00 43.02 42.19 1gri s PHE 125 CO 0.19 -0.09 1.44 0.09 -0.10 0.00 0.00 175.22 176.75 1gri n ASN 126 N -0.18 2.88 -3.56 1.36 4.13 -1.26 -2.30 115.26 116.33 1gri n ASN 126 Ca -0.09 -1.91 -0.15 0.00 1.68 0.00 0.00 54.58 54.11 1gri n ASN 126 Cb 0.62 -0.19 -0.06 0.00 -1.54 0.00 0.00 39.78 38.61 1gri n ASN 126 CO 0.00 0.00 0.00 -0.94 0.28 0.00 0.00 177.26 176.60 1gri s SER 127 N -1.56 -0.58 0.27 6.41 1.04 -1.26 -4.90 113.70 113.13 1gri s SER 127 Ca 0.36 0.76 0.01 0.00 0.48 0.00 0.00 55.95 57.55 1gri s SER 127 Cb 0.21 0.65 0.57 0.00 0.10 0.00 0.00 66.02 67.55 1gri s SER 127 CO 0.30 -0.44 1.78 -0.07 0.98 0.00 0.00 173.24 175.79 1gri h LEU 128 N 3.29 0.66 0.27 2.42 3.38 -1.96 -0.37 115.31 123.01 1gri h LEU 128 Ca -0.25 0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.80 1gri h LEU 128 Cb 1.15 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 41.85 1gri h LEU 128 CO 0.29 0.29 -0.27 0.78 0.09 0.00 0.00 178.44 179.63 1gri h ASN 129 N 0.73 -0.72 -0.93 -0.43 4.21 -1.98 0.22 115.58 116.68 1gri h ASN 129 Ca 0.49 0.06 0.14 0.00 1.21 0.00 0.00 56.30 58.21 1gri h ASN 129 Cb 0.65 0.24 -0.09 0.00 -1.12 0.00 0.00 38.32 38.01 1gri h ASN 129 CO -0.34 -0.39 0.55 -0.08 -1.29 0.00 0.00 177.43 175.88 1gri h GLU 130 N -0.57 0.77 -0.03 0.81 4.81 -1.64 0.12 114.58 118.85 1gri h GLU 130 Ca -0.01 -0.05 -0.00 0.00 -0.13 0.00 0.00 59.36 59.17 1gri h GLU 130 Cb 0.52 -0.17 -0.00 0.00 0.63 0.00 0.00 28.75 29.73 1gri h GLU 130 CO -0.05 0.51 0.01 1.25 -0.73 0.00 0.00 179.01 180.00 1gri h LEU 131 N 0.80 0.04 0.77 1.64 6.46 -0.66 -1.62 115.31 122.74 1gri h LEU 131 Ca 0.49 -0.14 -0.04 0.00 -0.12 0.00 0.00 57.88 58.08 1gri h LEU 131 Cb 0.63 -0.01 0.01 0.00 -0.73 0.00 0.00 40.66 40.55 1gri h LEU 131 CO -0.32 0.16 -0.37 0.58 -0.62 0.00 0.00 178.44 177.87 1gri h VAL 132 N -0.09 0.22 -0.88 1.05 2.07 0.11 -0.90 116.25 117.83 1gri h VAL 132 Ca 0.01 -0.06 0.12 0.00 0.82 0.00 0.00 66.70 67.59 1gri h VAL 132 Cb 0.14 0.23 -0.07 0.00 -1.52 0.00 0.00 31.29 30.07 1gri h VAL 132 CO -0.00 0.01 0.57 0.44 0.02 0.00 0.00 177.57 178.60 1gri h ASP 133 N -1.08 0.73 -0.83 0.57 3.32 -0.90 0.12 116.42 118.35 1gri h ASP 133 Ca -0.11 0.03 0.09 0.00 0.02 0.00 0.00 57.03 57.06 1gri h ASP 133 Cb 0.80 -0.12 -0.07 0.00 0.22 0.00 0.00 39.33 40.16 1gri h ASP 133 CO 0.17 0.40 0.49 0.22 -1.72 0.00 0.00 179.24 178.80 1gri h TYR 134 N 0.79 0.89 -0.61 4.55 3.20 -0.73 -1.59 116.97 123.46 1gri h TYR 134 Ca 0.43 0.03 -0.26 0.00 3.14 0.00 0.00 58.73 62.06 1gri h TYR 134 Cb 0.55 -0.27 -0.16 0.00 1.54 0.00 0.00 36.73 38.39 1gri h TYR 134 CO -0.00 0.38 0.33 0.72 -1.64 0.00 0.00 178.16 177.95 1gri n HIS 135 N -4.71 1.93 -0.10 -3.82 8.25 0.37 -2.38 115.22 114.75 1gri n HIS 135 Ca 0.13 -1.18 -0.24 0.00 -0.26 0.00 0.00 57.72 56.17 1gri n HIS 135 Cb 0.26 -0.64 -0.11 0.00 1.12 0.00 0.00 29.99 30.61 1gri n HIS 135 CO 0.00 0.00 0.00 -2.13 0.64 0.00 0.00 176.34 174.85 1gri n ARG 136 N -0.35 0.62 -0.09 -0.41 0.63 -0.60 -1.98 116.66 114.48 1gri n ARG 136 Ca 0.35 0.35 -0.17 0.00 -0.92 0.00 0.00 57.85 57.46 1gri n ARG 136 Cb 1.20 -1.61 -0.10 0.00 0.45 0.00 0.00 32.46 32.40 1gri n ARG 136 CO 0.00 0.00 0.00 0.66 -2.51 0.00 0.00 177.63 175.78 1gri h SER 137 N -0.67 0.00 -3.34 6.15 4.64 -1.67 -3.38 113.55 115.29 1gri h SER 137 Ca -0.53 -0.48 -0.58 0.00 -0.47 0.00 0.00 61.79 59.73 1gri h SER 137 Cb 1.63 0.00 -0.10 0.00 -0.31 0.00 0.00 62.40 63.62 1gri h SER 137 CO -0.22 1.24 0.74 -0.89 -0.87 0.00 0.00 176.83 176.83 1gri s THR 138 N -2.28 4.26 0.52 2.95 2.01 -1.00 -5.00 115.64 117.11 1gri s THR 138 Ca -0.23 0.67 -0.18 0.00 0.31 0.00 0.00 61.69 62.25 1gri s THR 138 Cb 0.04 -4.59 -0.13 0.00 0.01 0.00 0.00 72.50 67.83 1gri s THR 138 CO 0.52 -1.13 0.13 -0.24 -0.69 0.00 0.00 174.62 173.20 1gri n SER 139 N 7.77 -2.66 -2.78 3.53 2.88 -1.26 -4.16 113.62 116.94 1gri n SER 139 Ca 0.06 0.69 -0.35 0.00 -1.33 0.00 0.00 58.87 57.94 1gri n SER 139 Cb 0.48 -0.97 0.02 0.00 -0.75 0.00 0.00 64.21 62.99 1gri n SER 139 CO 0.00 0.00 0.00 0.55 -1.23 0.00 0.00 175.04 174.36 1gri n VAL 140 N -1.55 3.23 0.00 2.46 3.14 -0.78 -4.89 118.33 119.93 1gri n VAL 140 Ca 0.09 -4.65 0.00 0.00 -2.96 0.00 0.00 64.34 56.82 1gri n VAL 140 Cb 0.47 -1.27 0.00 0.00 -1.06 0.00 0.00 33.84 31.98 1gri n VAL 140 CO 0.00 0.00 0.00 -0.24 -6.46 0.00 0.00 176.83 170.13 1gri n SER 141 N -0.49 0.00 0.00 6.55 2.88 -1.26 -5.02 113.62 116.28 1gri n SER 141 Ca 0.47 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 58.01 1gri n SER 141 Cb 0.40 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.86 1gri n SER 141 CO 0.00 0.00 0.00 -2.11 -1.23 0.00 0.00 175.04 171.70 1gri n ARG 142 N 0.00 0.00 -3.38 -1.46 -4.01 -1.26 -5.06 116.66 101.50 1gri n ARG 142 Ca 0.00 0.00 -0.44 0.00 -1.04 0.00 0.00 57.85 56.37 1gri n ARG 142 Cb 0.00 0.00 -0.01 0.00 -3.04 0.00 0.00 32.46 29.41 1gri n ARG 142 CO 0.00 0.00 0.00 -0.80 -3.04 0.00 0.00 177.63 173.79 1gri s ASN 143 N 0.00 6.99 -0.02 2.89 0.01 -1.26 -4.97 114.94 118.59 1gri s ASN 143 Ca 0.00 -3.34 -0.00 0.00 -0.71 0.00 0.00 52.86 48.81 1gri s ASN 143 Cb 0.00 -2.17 -0.01 0.00 0.41 0.00 0.00 41.25 39.48 1gri s ASN 143 CO 0.00 -0.36 0.75 0.00 -1.51 0.00 0.00 177.10 175.98 1gri n GLN 144 N 3.03 0.08 0.00 -0.60 1.13 -1.26 -2.05 117.38 117.71 1gri n GLN 144 Ca 0.20 -0.20 0.00 0.00 -1.94 0.00 0.00 57.00 55.07 1gri n GLN 144 Cb 0.41 -1.68 0.00 0.00 0.11 0.00 0.00 30.24 29.08 1gri n GLN 144 CO 0.00 0.00 0.00 0.94 -1.44 0.00 0.00 177.06 176.56 1gri n GLN 145 N 3.61 0.00 -1.52 -1.09 -0.06 -1.26 -5.00 117.38 112.06 1gri n GLN 145 Ca 0.02 0.00 -0.36 0.00 -2.00 0.00 0.00 57.00 54.65 1gri n GLN 145 Cb 0.02 -0.39 -0.11 0.00 -4.06 0.00 0.00 30.24 25.71 1gri n GLN 145 CO 0.00 0.00 0.00 -0.89 -0.20 0.00 0.00 177.06 175.97 1gri n ILE 146 N -1.47 -0.03 -4.82 1.69 5.41 -0.87 -4.87 119.36 114.40 1gri n ILE 146 Ca 0.00 -0.37 -0.31 0.00 1.00 0.00 0.00 62.75 63.08 1gri n ILE 146 Cb 0.00 -1.42 -0.14 0.00 -0.71 0.00 0.00 39.64 37.37 1gri n ILE 146 CO 0.00 0.00 0.00 -0.36 0.00 0.00 0.00 176.55 176.19 1gri s PHE 147 N 9.95 2.44 -0.92 1.39 0.08 -1.26 -1.86 117.98 127.80 1gri s PHE 147 Ca 1.19 -0.34 -0.24 0.00 0.12 0.00 0.00 56.93 57.66 1gri s PHE 147 Cb -0.76 -1.44 0.02 0.00 -0.57 0.00 0.00 43.02 40.27 1gri s PHE 147 CO 0.39 0.17 1.57 -0.51 -0.10 0.00 0.00 175.22 176.74 1gri s LEU 148 N -1.27 3.35 -0.15 -0.37 1.43 -0.84 -4.08 118.68 116.75 1gri s LEU 148 Ca 0.13 -0.98 -0.18 0.00 -1.03 0.00 0.00 54.13 52.07 1gri s LEU 148 Cb -0.10 -2.56 -0.04 0.00 0.03 0.00 0.00 46.19 43.52 1gri s LEU 148 CO 0.03 -1.91 0.47 -0.13 0.23 0.00 0.00 176.35 175.04 1gri s ARG 149 N 5.72 4.28 0.47 1.70 1.81 -0.97 -4.72 118.95 127.24 1gri s ARG 149 Ca 0.51 0.40 -0.24 0.00 -1.72 0.00 0.00 55.73 54.68 1gri s ARG 149 Cb -0.04 -3.48 -0.07 0.00 -0.45 0.00 0.00 34.95 30.91 1gri s ARG 149 CO -0.02 0.06 1.27 -0.51 -0.68 0.00 0.00 175.30 175.43 1gri s ASP 150 N 0.79 5.95 0.54 0.23 1.01 -1.26 -3.40 116.67 120.54 1gri s ASP 150 Ca 0.24 2.55 -0.22 0.00 0.71 0.00 0.00 52.55 55.84 1gri s ASP 150 Cb -0.15 -2.62 -0.05 0.00 1.01 0.00 0.00 42.92 41.11 1gri s ASP 150 CO 0.09 -1.08 1.34 -0.63 0.21 0.00 0.00 175.17 175.10 1gri s ILE 151 N -1.38 2.18 -0.61 0.77 1.01 -1.26 -4.86 121.20 117.05 1gri s ILE 151 Ca 0.64 0.14 -0.26 0.00 0.00 0.00 0.00 60.65 61.16 1gri s ILE 151 Cb -0.35 -3.07 -0.09 0.00 0.01 0.00 0.00 42.46 38.96 1gri s ILE 151 CO 0.43 -0.00 2.39 -1.61 0.00 0.00 0.00 174.94 176.15 1gri s GLU 152 N -2.90 1.92 0.28 2.79 0.41 -1.26 -4.89 118.70 115.05 1gri s GLU 152 Ca 0.71 1.02 -0.29 0.00 -0.41 0.00 0.00 54.97 56.00 1gri s GLU 152 Cb -0.39 -4.66 -0.09 0.00 -1.78 0.00 0.00 34.13 27.20 1gri s GLU 152 CO 0.46 -3.72 1.00 -1.14 -0.49 0.00 0.00 175.26 171.37 1gri s GLN 153 N 8.46 4.68 0.03 1.61 2.00 -1.26 -5.08 119.66 130.10 1gri s GLN 153 Ca 0.94 1.57 0.07 0.00 -2.00 0.00 0.00 55.36 55.94 1gri s GLN 153 Cb -0.15 -3.10 -0.02 0.00 0.80 0.00 0.00 33.01 30.53 1gri s GLN 153 CO 0.19 0.32 -0.20 0.54 -0.50 0.00 0.00 175.29 175.64 1gri s VAL 154 N -1.29 1.56 0.30 1.34 0.11 -1.26 -4.60 120.40 116.56 1gri s VAL 154 Ca 0.45 -1.10 -0.30 0.00 -2.93 0.00 0.00 61.98 58.11 1gri s VAL 154 Cb -0.26 -1.35 -0.11 0.00 -1.53 0.00 0.00 36.38 33.13 1gri s VAL 154 CO 0.33 0.22 1.52 -2.16 -3.33 0.00 0.00 175.10 171.69 1gri s PRO 155 N -1.03 4.17 0.51 1.54 0.04 -1.26 -4.98 135.00 133.99 1gri s PRO 155 Ca 0.07 2.48 0.07 0.00 0.04 0.00 0.00 61.00 63.66 1gri s PRO 155 Cb -0.08 -3.04 0.03 0.00 0.04 0.00 0.00 34.50 31.45 1gri s PRO 155 CO 0.01 -0.53 0.49 -0.65 0.04 0.00 0.00 177.00 176.36 1gri s GLN 156 N -0.81 2.37 0.49 4.56 -1.52 -1.26 -5.10 119.66 118.39 1gri s GLN 156 Ca 0.60 -1.76 -0.21 0.00 -1.95 0.00 0.00 55.36 52.04 1gri s GLN 156 Cb -0.46 -2.33 -0.10 0.00 -0.22 0.00 0.00 33.01 29.91 1gri s GLN 156 CO 0.50 -0.53 0.67 1.04 -0.25 0.00 0.00 175.29 176.71 1gri n GLN 157 N -1.81 0.74 -2.12 2.91 1.13 -1.26 -4.91 117.38 112.06 1gri n GLN 157 Ca 0.04 0.28 -0.38 0.00 -1.94 0.00 0.00 57.00 55.00 1gri n GLN 157 Cb 0.63 -1.75 -0.00 0.00 0.11 0.00 0.00 30.24 29.23 1gri n GLN 157 CO 0.00 0.00 0.00 -1.25 -1.44 0.00 0.00 177.06 174.37 1gri s PRO 158 N -1.97 3.75 -0.16 -1.09 0.04 -1.26 -5.01 135.00 129.30 1gri s PRO 158 Ca 0.66 1.98 -0.15 0.00 0.04 0.00 0.00 61.00 63.53 1gri s PRO 158 Cb -0.52 -2.52 -0.04 0.00 0.04 0.00 0.00 34.50 31.46 1gri s PRO 158 CO 0.55 -0.62 0.37 0.99 0.04 0.00 0.00 177.00 178.33 1gri s THR 159 N -1.40 5.25 -0.13 1.26 2.01 -1.26 -5.06 115.64 116.31 1gri s THR 159 Ca 0.62 0.69 0.03 0.00 0.31 0.00 0.00 61.69 63.35 1gri s THR 159 Cb -0.34 -3.71 0.01 0.00 0.01 0.00 0.00 72.50 68.47 1gri s THR 159 CO 0.42 0.33 -0.23 -0.31 -0.69 0.00 0.00 174.62 174.14 1gri s TYR 160 N 0.77 2.63 0.38 4.92 1.51 -1.26 -2.01 117.35 124.29 1gri s TYR 160 Ca 0.20 -1.24 0.04 0.00 -1.01 0.00 0.00 57.07 55.05 1gri s TYR 160 Cb -0.14 -1.78 -0.01 0.00 -0.11 0.00 0.00 41.96 39.92 1gri s TYR 160 CO 0.07 -0.55 0.55 0.14 -1.11 0.00 0.00 175.55 174.65 1gri s VAL 161 N 0.65 4.08 0.13 0.71 -7.23 -0.32 -2.27 120.40 116.14 1gri s VAL 161 Ca -0.11 -0.79 0.11 0.00 -1.81 0.00 0.00 61.98 59.37 1gri s VAL 161 Cb -0.16 -3.45 -0.04 0.00 0.56 0.00 0.00 36.38 33.29 1gri s VAL 161 CO 0.02 -0.23 -0.27 -1.58 -0.31 0.00 0.00 175.10 172.73 1gri s GLN 162 N -4.32 1.39 -0.20 4.82 0.74 0.14 -1.37 119.66 120.86 1gri s GLN 162 Ca 0.46 -1.34 -0.12 0.00 0.05 0.00 0.00 55.36 54.41 1gri s GLN 162 Cb -0.10 -1.87 -0.05 0.00 1.10 0.00 0.00 33.01 32.09 1gri s GLN 162 CO 0.34 0.44 0.22 0.00 -0.55 0.00 0.00 175.29 175.74 1gri s ALA 163 N -1.06 3.62 0.02 1.58 0.00 -0.48 0.03 121.76 125.47 1gri s ALA 163 Ca 0.14 -0.68 -0.18 0.00 0.00 0.00 0.00 51.96 51.24 1gri s ALA 163 Cb -0.10 -2.34 -0.28 0.00 0.00 0.00 0.00 23.12 20.41 1gri s ALA 163 CO 0.06 -0.04 1.06 -0.07 0.00 0.00 0.00 175.76 176.78 1gri h LEU 164 N 7.08 0.70 -7.80 0.00 4.07 -0.03 0.49 115.31 119.83 1gri h LEU 164 Ca -0.39 -0.83 -0.34 0.00 0.08 0.00 0.00 57.88 56.40 1gri h LEU 164 Cb 1.16 -0.22 -0.31 0.00 1.08 0.00 0.00 40.66 42.37 1gri h LEU 164 CO 0.72 1.45 -0.75 -0.36 -1.08 0.00 0.00 178.44 178.42 1gri s PHE 165 N -2.96 0.47 0.81 1.13 0.08 -1.21 -4.70 117.98 111.60 1gri s PHE 165 Ca -0.11 -0.09 -0.16 0.00 0.12 0.00 0.00 56.93 56.69 1gri s PHE 165 Cb 0.04 -0.39 -0.08 0.00 -0.57 0.00 0.00 43.02 42.03 1gri s PHE 165 CO 0.88 -0.07 0.01 -0.25 -0.10 0.00 0.00 175.22 175.69 1gri n ASP 166 N 3.45 -3.18 -3.01 1.36 9.92 -1.26 -4.53 116.55 119.31 1gri n ASP 166 Ca -0.19 0.44 -0.15 0.00 -0.53 0.00 0.00 54.79 54.35 1gri n ASP 166 Cb 0.55 -1.02 -0.02 0.00 -0.64 0.00 0.00 41.12 39.98 1gri n ASP 166 CO 0.00 0.00 0.00 0.33 0.13 0.00 0.00 177.20 177.66 1gri n PHE 167 N -2.50 -2.20 -1.57 1.24 7.35 -0.02 -4.90 117.46 114.86 1gri n PHE 167 Ca 0.06 -2.45 -0.52 0.00 -0.76 0.00 0.00 57.45 53.77 1gri n PHE 167 Cb 0.52 0.78 -0.07 0.00 0.35 0.00 0.00 39.48 41.06 1gri n PHE 167 CO 0.00 0.00 0.00 -3.47 -0.76 0.00 0.00 176.76 172.53 1gri n ASP 168 N 2.18 2.49 -4.56 -2.13 -0.08 -1.26 -3.82 116.55 109.37 1gri n ASP 168 Ca 0.19 0.72 -0.25 0.00 -1.51 0.00 0.00 54.79 53.94 1gri n ASP 168 Cb 0.55 -1.25 -0.05 0.00 2.34 0.00 0.00 41.12 42.71 1gri n ASP 168 CO 0.00 0.00 0.00 -2.16 0.12 0.00 0.00 177.20 175.16 1gri s PRO 169 N 5.01 2.09 0.24 -0.67 0.05 -1.26 -4.87 135.00 135.58 1gri s PRO 169 Ca 1.03 0.54 0.12 0.00 0.05 0.00 0.00 61.00 62.73 1gri s PRO 169 Cb -0.89 -4.75 0.83 0.00 0.05 0.00 0.00 34.50 29.74 1gri s PRO 169 CO 0.55 -3.68 1.03 0.94 0.05 0.00 0.00 177.00 175.89 1gri n GLN 170 N 8.93 -0.04 -3.93 4.56 7.27 -1.26 -4.45 117.38 128.45 1gri n GLN 170 Ca 0.39 0.91 -0.09 0.00 0.07 0.00 0.00 57.00 58.28 1gri n GLN 170 Cb 0.48 -1.61 -0.06 0.00 2.41 0.00 0.00 30.24 31.46 1gri n GLN 170 CO 0.00 0.00 0.00 -1.83 0.07 0.00 0.00 177.06 175.30 1gri s GLU 171 N -5.08 1.34 -0.11 3.69 -1.05 -1.26 -5.10 118.70 111.13 1gri s GLU 171 Ca -0.06 -1.15 -0.02 0.00 -0.15 0.00 0.00 54.97 53.59 1gri s GLU 171 Cb 0.22 0.44 -0.03 0.00 -0.44 0.00 0.00 34.13 34.31 1gri s GLU 171 CO 0.51 -0.53 -0.02 -0.51 0.95 0.00 0.00 175.26 175.66 1gri s ASP 172 N -2.97 5.04 0.00 0.83 1.01 -1.26 -2.29 116.67 117.03 1gri s ASP 172 Ca 0.18 0.04 0.00 0.00 0.71 0.00 0.00 52.55 53.47 1gri s ASP 172 Cb 0.01 -1.54 0.00 0.00 1.01 0.00 0.00 42.92 42.40 1gri s ASP 172 CO 0.03 0.30 0.00 0.61 0.21 0.00 0.00 175.17 176.32 1gri n GLY 173 N 2.64 0.47 3.79 0.21 0.00 -1.26 -5.16 105.19 105.89 1gri n GLY 173 Ca -0.18 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.48 1gri n GLY 173 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1gri s GLU 174 N 0.00 4.31 -0.16 1.61 2.02 -0.97 -0.18 118.70 125.33 1gri s GLU 174 Ca 0.00 1.37 -0.06 0.00 0.02 0.00 0.00 54.97 56.30 1gri s GLU 174 Cb 0.00 -2.55 -0.04 0.00 0.10 0.00 0.00 34.13 31.65 1gri s GLU 174 CO 0.00 0.02 0.03 -1.17 0.02 0.00 0.00 175.26 174.16 1gri s LEU 175 N -2.57 3.64 -0.06 1.80 0.20 0.66 -4.71 118.68 117.65 1gri s LEU 175 Ca 0.56 0.04 -0.10 0.00 0.69 0.00 0.00 54.13 55.32 1gri s LEU 175 Cb -0.18 -1.90 -0.05 0.00 -0.43 0.00 0.00 46.19 43.63 1gri s LEU 175 CO 0.23 0.20 0.26 -0.83 -0.29 0.00 0.00 176.35 175.93 1gri s GLY 176 N 0.18 2.30 -0.14 7.98 0.00 -1.26 -4.61 107.32 111.76 1gri s GLY 176 Ca 0.02 -0.46 -0.30 0.00 0.00 0.00 0.00 44.72 43.99 1gri s GLY 176 CO 0.01 -0.16 0.92 -0.11 0.00 0.00 0.00 173.10 173.76 1gri s PHE 177 N -1.08 -0.45 0.51 1.90 -0.12 -1.25 -4.73 117.98 112.75 1gri s PHE 177 Ca 0.20 0.80 0.00 0.00 -0.05 0.00 0.00 56.93 57.88 1gri s PHE 177 Cb -0.14 0.43 0.01 0.00 -0.63 0.00 0.00 43.02 42.70 1gri s PHE 177 CO 0.09 -0.40 0.73 1.03 -0.05 0.00 0.00 175.22 176.62 1gri s ARG 178 N -1.04 2.82 0.00 1.99 0.52 -1.26 -0.84 118.95 121.14 1gri s ARG 178 Ca -0.04 -0.58 -0.30 0.00 -0.52 0.00 0.00 55.73 54.29 1gri s ARG 178 Cb -0.01 -2.50 -0.08 0.00 0.52 0.00 0.00 34.95 32.88 1gri s ARG 178 CO 0.03 -0.50 1.84 0.50 0.02 0.00 0.00 175.30 177.19 1gri s ARG 179 N -4.68 4.16 0.00 3.54 3.52 -1.26 -2.31 118.95 121.91 1gri s ARG 179 Ca 0.53 2.45 0.00 0.00 -0.13 0.00 0.00 55.73 58.57 1gri s ARG 179 Cb -0.10 -4.08 0.00 0.00 -1.56 0.00 0.00 34.95 29.21 1gri s ARG 179 CO 0.39 -0.91 0.00 0.41 -0.81 0.00 0.00 175.30 174.38 1gri n GLY 180 N 4.37 1.34 3.73 8.12 0.00 0.17 -4.94 105.19 117.98 1gri n GLY 180 Ca 0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.79 1gri n GLY 180 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1gri n ASP 181 N 0.00 3.88 -4.47 1.61 8.00 -0.98 -4.56 116.55 120.03 1gri n ASP 181 Ca 0.00 1.11 -0.43 0.00 0.71 0.00 0.00 54.79 56.18 1gri n ASP 181 Cb 0.00 -1.58 -0.04 0.00 -0.02 0.00 0.00 41.12 39.48 1gri n ASP 181 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 1gri s PHE 182 N 0.49 2.82 -0.17 1.24 0.08 -1.26 -1.38 117.98 119.80 1gri s PHE 182 Ca 0.69 -0.42 -0.10 0.00 0.12 0.00 0.00 56.93 57.22 1gri s PHE 182 Cb -0.51 -4.04 -0.05 0.00 -0.57 0.00 0.00 43.02 37.85 1gri s PHE 182 CO 0.42 -1.40 0.17 0.96 -0.10 0.00 0.00 175.22 175.27 1gri s ILE 183 N 3.60 5.40 -0.21 0.64 -5.25 -0.47 -4.89 121.20 120.02 1gri s ILE 183 Ca 0.22 0.29 -0.22 0.00 -0.99 0.00 0.00 60.65 59.95 1gri s ILE 183 Cb -0.17 -3.49 -0.02 0.00 2.95 0.00 0.00 42.46 41.73 1gri s ILE 183 CO 0.13 0.48 0.70 -2.28 -1.79 0.00 0.00 174.94 172.17 1gri s HIS 184 N 0.02 3.35 -0.15 1.37 5.65 0.03 -1.17 115.29 124.40 1gri s HIS 184 Ca 0.12 1.00 -0.24 0.00 0.25 0.00 0.00 55.06 56.19 1gri s HIS 184 Cb -0.12 -2.89 -0.02 0.00 -1.18 0.00 0.00 32.58 28.37 1gri s HIS 184 CO 0.01 -0.26 0.74 0.08 -0.65 0.00 0.00 174.74 174.67 1gri s VAL 185 N 2.24 4.96 -0.24 0.89 1.01 -0.85 0.79 120.40 129.20 1gri s VAL 185 Ca 0.31 1.47 -0.10 0.00 0.00 0.00 0.00 61.98 63.66 1gri s VAL 185 Cb -0.16 -4.06 -0.11 0.00 0.00 0.00 0.00 36.38 32.05 1gri s VAL 185 CO 0.10 0.11 -0.29 0.80 0.00 0.00 0.00 175.10 175.82 1gri n MET 186 N 4.75 0.52 -3.89 2.72 1.56 -0.03 -4.58 117.12 118.17 1gri n MET 186 Ca 0.01 0.21 -0.26 0.00 -0.27 0.00 0.00 57.70 57.40 1gri n MET 186 Cb 0.50 -1.37 -0.17 0.00 2.15 0.00 0.00 33.22 34.32 1gri n MET 186 CO 0.00 0.00 0.00 0.34 -0.73 0.00 0.00 175.97 175.58 1gri s ASP 187 N -7.02 2.01 -0.05 6.12 2.15 -0.61 -4.12 116.67 115.16 1gri s ASP 187 Ca -0.33 -0.25 0.17 0.00 0.43 0.00 0.00 52.55 52.57 1gri s ASP 187 Cb 0.12 -0.74 0.33 0.00 -0.30 0.00 0.00 42.92 42.33 1gri s ASP 187 CO 0.44 -0.13 1.14 -0.46 -0.17 0.00 0.00 175.17 175.99 1gri n ASN 188 N 4.96 1.02 -0.07 -0.34 0.23 -1.26 -0.44 115.26 119.35 1gri n ASN 188 Ca -0.12 -2.44 -0.15 0.00 -0.53 0.00 0.00 54.58 51.35 1gri n ASN 188 Cb 0.50 -0.33 -0.05 0.00 -2.08 0.00 0.00 39.78 37.82 1gri n ASN 188 CO 0.00 0.00 0.00 0.77 -0.93 0.00 0.00 177.26 177.10 1gri h SER 189 N 0.72 0.89 -3.02 0.53 4.64 -1.94 -3.44 113.55 111.92 1gri h SER 189 Ca -0.12 -0.54 -0.54 0.00 -0.47 0.00 0.00 61.79 60.12 1gri h SER 189 Cb 1.56 -0.25 0.01 0.00 -0.31 0.00 0.00 62.40 63.40 1gri h SER 189 CO 0.05 1.27 0.72 -0.62 -0.87 0.00 0.00 176.83 177.38 1gri s ASP 190 N -6.85 6.92 0.64 4.97 -1.08 -1.26 -4.95 116.67 115.06 1gri s ASP 190 Ca -0.11 2.13 0.40 0.00 -0.52 0.00 0.00 52.55 54.45 1gri s ASP 190 Cb 0.09 -2.57 2.25 0.00 -1.46 0.00 0.00 42.92 41.23 1gri s ASP 190 CO 0.87 -0.62 2.34 -0.65 0.52 0.00 0.00 175.17 177.63 1gri h PRO 191 N 7.22 0.00 0.00 4.34 0.11 -2.02 -3.31 132.00 138.34 1gri h PRO 191 Ca -0.40 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.71 1gri h PRO 191 Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 1gri h PRO 191 CO 0.87 0.00 -0.88 0.09 -0.21 0.00 0.00 178.00 177.86 1gri n ASN 192 N -3.31 4.41 -3.80 -2.05 3.02 -1.26 -4.80 115.26 107.46 1gri n ASN 192 Ca -0.03 0.00 -0.28 0.00 -0.03 0.00 0.00 54.58 54.24 1gri n ASN 192 Cb 0.08 0.84 -0.16 0.00 -0.61 0.00 0.00 39.78 39.92 1gri n ASN 192 CO 0.00 0.00 0.00 0.26 -2.62 0.00 0.00 177.26 174.90 1gri s TRP 193 N -1.78 1.46 -0.12 3.10 0.52 -1.25 -1.63 118.94 119.25 1gri s TRP 193 Ca 0.00 -1.13 -0.07 0.00 0.02 0.00 0.00 56.10 54.92 1gri s TRP 193 Cb 0.00 -1.20 -0.04 0.00 -1.15 0.00 0.00 33.47 31.08 1gri s TRP 193 CO 0.00 -0.66 0.13 -1.58 0.02 0.00 0.00 176.95 174.86 1gri s TRP 194 N 1.71 3.56 -0.45 -1.98 0.52 -0.64 -4.56 118.94 117.10 1gri s TRP 194 Ca -0.02 0.50 -0.16 0.00 0.02 0.00 0.00 56.10 56.44 1gri s TRP 194 Cb -0.17 -1.93 0.05 0.00 -1.15 0.00 0.00 33.47 30.26 1gri s TRP 194 CO -0.07 0.71 0.40 0.21 0.02 0.00 0.00 176.95 178.22 1gri s LYS 195 N -1.00 3.01 0.00 4.98 2.20 0.41 -0.58 119.74 128.76 1gri s LYS 195 Ca 0.15 -1.11 0.00 0.00 -0.36 0.00 0.00 55.97 54.65 1gri s LYS 195 Cb -0.12 -4.06 0.00 0.00 -1.51 0.00 0.00 37.83 32.14 1gri s LYS 195 CO 0.04 -0.94 0.00 0.41 -0.36 0.00 0.00 175.35 174.50 1gri n GLY 196 N 5.17 3.05 3.18 5.54 0.00 0.14 -0.85 105.19 121.43 1gri n GLY 196 Ca -0.11 -2.15 -0.09 0.00 0.00 0.00 0.00 46.02 43.68 1gri n GLY 196 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gri s ALA 197 N -2.00 -1.11 0.00 4.61 0.00 0.24 -0.82 121.76 122.68 1gri s ALA 197 Ca 0.00 1.36 0.00 0.00 0.00 0.00 0.00 51.96 53.32 1gri s ALA 197 Cb 0.00 -1.37 0.00 0.00 0.00 0.00 0.00 23.12 21.75 1gri s ALA 197 CO 0.00 -0.84 0.00 0.00 0.00 0.00 0.00 175.76 174.92 1gri n HIS 199 N -2.97 1.45 0.00 0.00 8.25 -1.26 -4.88 115.22 115.81 1gri n HIS 199 Ca 0.00 -2.81 0.00 0.00 -0.26 0.00 0.00 57.72 54.65 1gri n HIS 199 Cb 0.45 -0.34 0.00 0.00 1.12 0.00 0.00 29.99 31.22 1gri n HIS 199 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1gri n GLY 200 N -0.13 3.09 3.89 -1.41 0.00 -1.26 -5.01 105.19 104.35 1gri n GLY 200 Ca 0.13 -0.86 -0.29 0.00 0.00 0.00 0.00 46.02 44.99 1gri n GLY 200 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1gri s GLN 201 N 0.00 3.71 0.21 1.61 -2.07 -1.26 -5.00 119.66 116.86 1gri s GLN 201 Ca 0.00 0.36 0.06 0.00 -1.82 0.00 0.00 55.36 53.96 1gri s GLN 201 Cb 0.00 -2.41 -0.05 0.00 -1.09 0.00 0.00 33.01 29.46 1gri s GLN 201 CO 0.00 -0.06 -0.09 0.95 -1.32 0.00 0.00 175.29 174.77 1gri s THR 202 N -2.44 1.45 -3.04 3.63 -4.23 -1.26 -1.80 115.64 107.94 1gri s THR 202 Ca 0.50 -2.12 0.00 0.00 -1.18 0.00 0.00 61.69 58.88 1gri s THR 202 Cb -0.10 -2.16 0.00 0.00 1.34 0.00 0.00 72.50 71.58 1gri s THR 202 CO 0.35 -0.51 0.00 0.61 -0.54 0.00 0.00 174.62 174.53 1gri n GLY 203 N -0.39 -1.18 3.89 3.99 0.00 0.00 -4.74 105.19 106.75 1gri n GLY 203 Ca -0.07 -1.03 -0.29 0.00 0.00 0.00 0.00 46.02 44.62 1gri n GLY 203 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1gri s MET 204 N -1.22 3.60 -0.29 1.61 -1.94 0.75 0.26 119.30 122.07 1gri s MET 204 Ca 0.00 0.49 -0.19 0.00 -1.71 0.00 0.00 55.69 54.28 1gri s MET 204 Cb 0.00 -2.24 0.15 0.00 2.01 0.00 0.00 34.83 34.75 1gri s MET 204 CO 0.00 -0.35 1.08 -0.59 -0.01 0.00 0.00 175.02 175.15 1gri s PHE 205 N -2.90 -0.42 0.03 -0.03 -0.71 0.25 -0.25 117.98 113.95 1gri s PHE 205 Ca 0.51 0.90 -0.30 0.00 -1.04 0.00 0.00 56.93 57.00 1gri s PHE 205 Cb -0.11 0.32 -0.07 0.00 -1.21 0.00 0.00 43.02 41.96 1gri s PHE 205 CO 0.47 -0.21 1.65 -1.25 -1.34 0.00 0.00 175.22 174.54 1gri s PRO 206 N 0.87 4.20 0.33 1.99 0.05 -1.26 -1.61 135.00 139.56 1gri s PRO 206 Ca -0.04 2.27 0.08 0.00 0.05 0.00 0.00 61.00 63.37 1gri s PRO 206 Cb -0.04 -3.73 0.95 0.00 0.05 0.00 0.00 34.50 31.73 1gri s PRO 206 CO -0.12 -0.76 1.58 -0.09 0.05 0.00 0.00 177.00 177.66 1gri h ARG 207 N 8.73 0.02 0.00 4.56 2.43 -1.62 -1.10 114.38 127.40 1gri h ARG 207 Ca -0.42 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.75 1gri h ARG 207 Cb 1.19 -0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.74 1gri h ARG 207 CO 0.93 0.01 0.07 0.09 -1.51 0.00 0.00 179.97 179.56 1gri n ASN 208 N -5.40 0.00 0.01 -3.80 4.13 -1.26 -1.12 115.26 107.82 1gri n ASN 208 Ca 0.28 0.41 0.11 0.00 1.68 0.00 0.00 54.58 57.06 1gri n ASN 208 Cb 0.94 -0.41 0.02 0.00 -1.54 0.00 0.00 39.78 38.79 1gri n ASN 208 CO 0.00 0.00 0.00 -1.22 0.28 0.00 0.00 177.26 176.32 1gri n TYR 209 N -1.41 0.08 -4.85 3.10 4.02 -0.42 -4.93 117.16 112.76 1gri n TYR 209 Ca 0.00 0.02 -0.26 0.00 -0.01 0.00 0.00 57.90 57.65 1gri n TYR 209 Cb 0.07 -0.22 -0.16 0.00 -0.02 0.00 0.00 39.34 39.00 1gri n TYR 209 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 176.86 175.99 1gri s VAL 210 N -3.08 1.45 -0.14 -0.72 -7.23 -0.27 0.72 120.40 111.13 1gri s VAL 210 Ca 0.07 -0.73 -0.07 0.00 -1.81 0.00 0.00 61.98 59.43 1gri s VAL 210 Cb 0.16 -1.24 -0.04 0.00 0.56 0.00 0.00 36.38 35.81 1gri s VAL 210 CO 0.80 0.42 0.13 0.28 -0.31 0.00 0.00 175.10 176.42 1gri s THR 211 N -0.01 5.42 1.04 5.32 -1.32 0.10 -4.86 115.64 121.34 1gri s THR 211 Ca -0.03 0.18 -0.11 0.00 -1.21 0.00 0.00 61.69 60.52 1gri s THR 211 Cb -0.11 -3.38 0.22 0.00 -1.51 0.00 0.00 72.50 67.71 1gri s THR 211 CO 0.02 0.58 1.08 -2.84 -2.21 0.00 0.00 174.62 171.25 1gri s PRO 212 N -0.70 0.01 -0.28 7.08 0.02 -1.26 -0.68 135.00 139.18 1gri s PRO 212 Ca 0.13 1.19 0.02 0.00 0.02 0.00 0.00 61.00 62.36 1gri s PRO 212 Cb -0.12 -1.64 0.08 0.00 0.02 0.00 0.00 34.50 32.85 1gri s PRO 212 CO 0.03 -3.21 -0.00 0.08 -0.33 0.00 0.00 177.00 173.57 1gri s VAL 213 N -2.55 1.68 0.15 3.83 1.01 -0.96 -4.58 120.40 118.98 1gri s VAL 213 Ca 0.68 -1.61 -0.31 0.00 0.00 0.00 0.00 61.98 60.74 1gri s VAL 213 Cb -0.24 -2.07 -0.08 0.00 0.00 0.00 0.00 36.38 33.99 1gri s VAL 213 CO 0.61 -0.34 1.32 0.20 0.00 0.00 0.00 175.10 176.90 1gri s ASN 214 N 1.27 6.90 0.65 3.32 0.02 -1.26 -4.48 114.94 121.35 1gri s ASN 214 Ca 0.01 2.31 -0.18 0.00 -1.02 0.00 0.00 52.86 53.99 1gri s ASN 214 Cb -0.19 -2.60 -0.01 0.00 0.02 0.00 0.00 41.25 38.48 1gri s ASN 214 CO -0.10 -0.56 1.28 0.00 0.02 0.00 0.00 177.10 177.74 1gri s ARG 215 N 0.52 2.57 0.00 -0.60 1.04 -1.26 -4.95 118.95 116.27 1gri s ARG 215 Ca 0.60 2.03 0.00 0.00 -1.04 0.00 0.00 55.73 57.32 1gri s ARG 215 Cb -0.35 -1.85 0.00 0.00 -2.04 0.00 0.00 34.95 30.70 1gri s ARG 215 CO 0.34 -1.58 0.13 0.27 -0.04 0.00 0.00 175.30 174.42 1gri n ASN 216 N -1.91 0.00 0.00 -2.89 2.04 -1.26 -5.25 115.26 105.99 1gri n ASN 216 Ca 0.16 -1.00 0.00 0.00 -0.44 0.00 0.00 54.58 53.30 1gri n ASN 216 Cb 0.48 0.00 0.00 0.00 -2.53 0.00 0.00 39.78 37.73 1gri n ASN 216 CO 0.00 0.00 0.00 0.52 -0.44 0.00 0.00 177.26 177.34