#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gri n PRO 2 N 0.00 1.47 -3.08 0.00 -0.04 -1.26 -4.93 135.00 127.16 2gri n PRO 2 Ca 0.00 -2.03 -0.32 0.00 -0.04 0.00 0.00 63.50 61.11 2gri n PRO 2 Cb 0.00 -3.19 -0.06 0.00 -0.04 0.00 0.00 33.50 30.21 2gri n PRO 2 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 2gri s ILE 3 N 7.25 4.68 0.22 0.52 1.01 -1.26 -4.69 121.20 128.92 2gri s ILE 3 Ca 0.62 0.94 -0.32 0.00 0.00 0.00 0.00 60.65 61.89 2gri s ILE 3 Cb 0.09 -3.62 -0.12 0.00 0.01 0.00 0.00 42.46 38.81 2gri s ILE 3 CO 0.14 -0.24 1.67 1.17 0.00 0.00 0.00 174.94 177.68 2gri n LYS 4 N -0.51 2.67 0.00 2.79 3.00 -0.98 -4.52 118.16 120.60 2gri n LYS 4 Ca 0.04 0.96 0.00 0.00 -0.00 0.00 0.00 58.31 59.30 2gri n LYS 4 Cb 0.53 -2.78 0.00 0.00 0.00 0.00 0.00 35.03 32.78 2gri n LYS 4 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2gri n GLY 5 N 3.49 0.45 1.17 3.14 0.00 -1.26 -1.01 105.19 111.17 2gri n GLY 5 Ca 0.15 0.73 0.02 0.00 0.00 0.00 0.00 46.02 46.91 2gri n GLY 5 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2gri n VAL 6 N 0.00 0.00 -1.21 1.61 0.31 -1.26 -5.12 118.33 112.66 2gri n VAL 6 Ca 0.00 -0.63 -0.29 0.00 -0.01 0.00 0.00 64.34 63.41 2gri n VAL 6 Cb 0.00 0.79 0.15 0.00 -0.91 0.00 0.00 33.84 33.87 2gri n VAL 6 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 2gri s THR 7 N 0.00 2.46 -0.29 2.52 2.01 -0.18 -5.08 115.64 117.08 2gri s THR 7 Ca 0.21 0.15 -0.21 0.00 0.31 0.00 0.00 61.69 62.15 2gri s THR 7 Cb 0.24 -2.65 0.15 0.00 0.01 0.00 0.00 72.50 70.25 2gri s THR 7 CO -0.11 -0.20 1.11 0.72 -0.69 0.00 0.00 174.62 175.46 2gri s PHE 8 N -2.96 -0.39 -0.58 4.92 -0.12 -1.26 -4.80 117.98 112.80 2gri s PHE 8 Ca 0.64 0.85 -0.15 0.00 -0.05 0.00 0.00 56.93 58.23 2gri s PHE 8 Cb -0.18 0.34 0.02 0.00 -0.63 0.00 0.00 43.02 42.57 2gri s PHE 8 CO 0.57 -0.19 0.64 0.41 -0.05 0.00 0.00 175.22 176.60 2gri n GLY 9 N 2.70 -0.96 0.50 1.99 0.00 -1.26 -4.98 105.19 103.18 2gri n GLY 9 Ca -0.15 0.93 -0.15 0.00 0.00 0.00 0.00 46.02 46.66 2gri n GLY 9 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2gri n GLU 10 N -1.03 0.33 0.03 1.61 -0.58 -1.26 -5.05 120.64 114.69 2gri n GLU 10 Ca -0.03 0.14 0.00 0.00 -0.42 0.00 0.00 57.16 56.85 2gri n GLU 10 Cb 0.56 -1.06 0.00 0.00 -0.57 0.00 0.00 31.44 30.37 2gri n GLU 10 CO 0.00 0.00 0.00 -3.47 -0.48 0.00 0.00 177.13 173.18 2gri n ASP 11 N -3.79 -0.47 -3.63 1.62 -0.08 -1.26 -5.16 116.55 103.78 2gri n ASP 11 Ca -0.27 0.13 0.02 0.00 -1.51 0.00 0.00 54.79 53.15 2gri n ASP 11 Cb 0.64 0.75 -0.00 0.00 2.34 0.00 0.00 41.12 44.85 2gri n ASP 11 CO 0.00 0.00 0.00 0.28 0.12 0.00 0.00 177.20 177.60 2gri s THR 12 N -2.00 0.00 0.57 5.18 -1.32 -1.26 -5.12 115.64 111.69 2gri s THR 12 Ca 0.00 -0.20 -0.05 0.00 -1.21 0.00 0.00 61.69 60.23 2gri s THR 12 Cb 0.00 -2.09 0.00 0.00 -1.51 0.00 0.00 72.50 68.90 2gri s THR 12 CO 0.00 0.00 0.87 -0.69 -2.21 0.00 0.00 174.62 172.59 2gri s VAL 13 N -2.35 3.81 -1.52 5.08 1.01 -1.26 -3.33 120.40 121.83 2gri s VAL 13 Ca 0.16 -0.03 0.00 0.00 0.00 0.00 0.00 61.98 62.11 2gri s VAL 13 Cb 0.05 -3.49 0.00 0.00 0.00 0.00 0.00 36.38 32.93 2gri s VAL 13 CO -0.04 -0.49 0.00 0.79 0.00 0.00 0.00 175.10 175.36 2gri n TRP 14 N -2.50 0.00 0.00 5.22 7.02 -1.26 -4.63 117.44 121.29 2gri n TRP 14 Ca 0.04 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.52 2gri n TRP 14 Cb 0.57 -2.88 0.00 0.00 -2.42 0.00 0.00 31.31 26.59 2gri n TRP 14 CO 0.00 0.00 0.00 0.39 -2.02 0.00 0.00 177.69 176.06 2gri n GLU 15 N -1.68 0.05 0.00 -0.99 1.02 -1.26 -4.96 120.64 112.82 2gri n GLU 15 Ca -0.14 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.00 2gri n GLU 15 Cb 0.58 -0.53 0.00 0.00 -0.02 0.00 0.00 31.44 31.47 2gri n GLU 15 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 2gri n VAL 16 N -1.38 0.00 -0.29 2.62 0.31 -1.21 -4.76 118.33 113.62 2gri n VAL 16 Ca 0.00 0.00 0.09 0.00 -0.01 0.00 0.00 64.34 64.42 2gri n VAL 16 Cb 0.03 -0.60 0.25 0.00 -0.91 0.00 0.00 33.84 32.61 2gri n VAL 16 CO 0.00 0.00 0.00 -0.61 -1.32 0.00 0.00 176.83 174.90 2gri h GLN 17 N 0.00 0.41 -0.61 5.55 4.15 -1.91 -3.43 115.11 119.28 2gri h GLN 17 Ca 0.00 -0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.40 2gri h GLN 17 Cb 0.77 -0.09 0.00 0.00 0.21 0.00 0.00 27.48 28.37 2gri h GLN 17 CO 0.00 0.27 0.00 0.41 -1.93 0.00 0.00 178.83 177.58 2gri n GLY 18 N -1.34 0.85 3.63 2.39 0.00 -1.26 -2.32 105.19 107.14 2gri n GLY 18 Ca 0.18 -0.65 -0.09 0.00 0.00 0.00 0.00 46.02 45.47 2gri n GLY 18 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2gri s TYR 19 N -2.61 0.10 0.21 1.61 2.02 -1.26 -2.64 117.35 114.78 2gri s TYR 19 Ca 0.00 -0.49 0.05 0.00 -0.37 0.00 0.00 57.07 56.26 2gri s TYR 19 Cb 0.00 0.36 -0.02 0.00 -0.40 0.00 0.00 41.96 41.91 2gri s TYR 19 CO 0.00 -1.03 0.18 1.63 -1.57 0.00 0.00 175.55 174.76 2gri n LYS 20 N -0.39 0.27 -3.75 -0.62 4.01 0.11 -4.38 118.16 113.41 2gri n LYS 20 Ca -0.04 -2.11 -0.19 0.00 -0.51 0.00 0.00 58.31 55.46 2gri n LYS 20 Cb 0.61 1.74 -0.17 0.00 -0.51 0.00 0.00 35.03 36.70 2gri n LYS 20 CO 0.00 0.00 0.00 -0.80 -1.11 0.00 0.00 177.40 175.49 2gri s ASN 21 N -2.48 0.81 -0.05 4.39 0.01 -1.26 -2.88 114.94 113.48 2gri s ASN 21 Ca 0.25 0.03 -0.05 0.00 -0.71 0.00 0.00 52.86 52.38 2gri s ASN 21 Cb 0.01 -0.17 0.01 0.00 0.41 0.00 0.00 41.25 41.51 2gri s ASN 21 CO 0.18 -0.19 0.15 -0.69 -1.51 0.00 0.00 177.10 175.04 2gri s VAL 22 N 1.69 0.01 0.29 1.60 1.01 -0.69 -4.51 120.40 119.79 2gri s VAL 22 Ca -0.01 -0.09 0.08 0.00 0.00 0.00 0.00 61.98 61.96 2gri s VAL 22 Cb -0.13 -0.24 -0.04 0.00 0.00 0.00 0.00 36.38 35.98 2gri s VAL 22 CO -0.03 -0.05 0.18 -0.13 0.00 0.00 0.00 175.10 175.07 2gri s ARG 23 N -0.10 2.68 -0.11 2.72 0.52 0.45 -0.95 118.95 124.16 2gri s ARG 23 Ca -0.02 -1.26 0.00 0.00 -0.52 0.00 0.00 55.73 53.94 2gri s ARG 23 Cb -0.02 -2.41 0.02 0.00 0.52 0.00 0.00 34.95 33.06 2gri s ARG 23 CO 0.00 0.27 -0.09 0.42 0.02 0.00 0.00 175.30 175.92 2gri s ILE 24 N -2.26 1.12 -0.42 1.52 -1.09 -0.83 -0.62 121.20 118.63 2gri s ILE 24 Ca 0.35 -0.36 0.06 0.00 -2.23 0.00 0.00 60.65 58.47 2gri s ILE 24 Cb -0.06 -1.11 0.18 0.00 -1.58 0.00 0.00 42.46 39.89 2gri s ILE 24 CO 0.24 0.38 0.69 -0.89 -1.23 0.00 0.00 174.94 174.13 2gri s THR 25 N 1.54 -0.92 0.00 2.92 2.01 -1.25 -4.84 115.64 115.10 2gri s THR 25 Ca 0.02 -0.19 0.00 0.00 0.31 0.00 0.00 61.69 61.84 2gri s THR 25 Cb -0.13 0.00 0.00 0.00 0.01 0.00 0.00 72.50 72.38 2gri s THR 25 CO -0.07 0.00 0.00 0.33 -0.69 0.00 0.00 174.62 174.19 2gri n PHE 26 N 4.06 0.00 0.00 4.92 7.35 -1.26 -4.84 117.46 127.69 2gri n PHE 26 Ca 0.12 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.81 2gri n PHE 26 Cb 0.57 0.00 0.00 0.00 0.35 0.00 0.00 39.48 40.41 2gri n PHE 26 CO 0.00 0.00 0.00 0.39 -0.76 0.00 0.00 176.76 176.39 2gri n GLU 27 N -1.51 0.00 0.05 -4.13 1.02 -1.26 -5.01 120.64 109.80 2gri n GLU 27 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 2gri n GLU 27 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.42 2gri n GLU 27 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 2gri n LEU 28 N 0.00 0.61 -4.74 -4.62 4.32 -1.26 -4.83 117.00 106.48 2gri n LEU 28 Ca 0.00 0.14 -0.33 0.00 -0.02 0.00 0.00 56.01 55.80 2gri n LEU 28 Cb 0.00 -0.14 -0.07 0.00 -1.62 0.00 0.00 43.42 41.59 2gri n LEU 28 CO 0.00 -0.55 -0.24 -1.81 -1.22 0.00 0.00 177.39 173.58 2gri s ASP 29 N -5.56 3.94 -0.04 -1.43 1.11 -1.26 -5.06 116.67 108.36 2gri s ASP 29 Ca 0.00 -1.72 0.04 0.00 0.18 0.00 0.00 52.55 51.06 2gri s ASP 29 Cb 0.00 0.68 -0.06 0.00 1.07 0.00 0.00 42.92 44.61 2gri s ASP 29 CO 0.00 -0.94 0.04 -0.62 1.18 0.00 0.00 175.17 174.82 2gri n GLU 30 N -1.25 2.58 -0.06 8.23 -0.58 -1.26 -4.54 120.64 123.77 2gri n GLU 30 Ca -0.19 -0.01 -0.11 0.00 -0.42 0.00 0.00 57.16 56.43 2gri n GLU 30 Cb 0.66 -1.12 -0.05 0.00 -0.57 0.00 0.00 31.44 30.37 2gri n GLU 30 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 2gri n ARG 31 N -2.06 0.26 -1.26 3.49 3.00 -1.26 -4.67 116.66 114.15 2gri n ARG 31 Ca -0.06 0.09 -0.32 0.00 -0.01 0.00 0.00 57.85 57.55 2gri n ARG 31 Cb 0.54 -1.03 0.07 0.00 0.00 0.00 0.00 32.46 32.05 2gri n ARG 31 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.63 178.96 2gri n VAL 32 N -3.27 3.50 -0.00 1.55 0.24 -1.26 -4.39 118.33 114.70 2gri n VAL 32 Ca -0.22 -2.74 -0.13 0.00 -2.04 0.00 0.00 64.34 59.22 2gri n VAL 32 Cb 0.68 -1.19 -0.14 0.00 -1.47 0.00 0.00 33.84 31.72 2gri n VAL 32 CO 0.00 0.00 0.00 -0.78 -2.14 0.00 0.00 176.83 173.91 2gri h ASP 33 N 1.92 0.16 1.03 -1.34 3.58 -1.83 -3.34 116.42 116.60 2gri h ASP 33 Ca 0.56 -0.33 -0.03 0.00 0.42 0.00 0.00 57.03 57.64 2gri h ASP 33 Cb 0.82 -0.05 -0.00 0.00 1.72 0.00 0.00 39.33 41.81 2gri h ASP 33 CO 1.47 1.29 -0.16 0.07 -2.88 0.00 0.00 179.24 179.03 2gri h LYS 34 N 0.03 0.00 0.00 0.28 -0.00 -1.94 -2.74 116.57 112.19 2gri h LYS 34 Ca -0.31 0.00 -0.01 0.00 -0.00 0.00 0.00 60.65 60.33 2gri h LYS 34 Cb 2.01 0.00 -0.00 0.00 -0.00 0.00 0.00 32.23 34.24 2gri h LYS 34 CO 0.09 0.16 -0.03 0.28 -0.00 0.00 0.00 179.45 179.96 2gri h VAL 35 N 0.00 0.09 -0.26 0.07 2.07 -1.87 -0.76 116.25 115.59 2gri h VAL 35 Ca -0.00 -0.44 0.00 0.00 0.82 0.00 0.00 66.70 67.08 2gri h VAL 35 Cb 0.72 1.40 0.00 0.00 -1.52 0.00 0.00 31.29 31.89 2gri h VAL 35 CO 0.02 0.03 0.00 0.00 0.02 0.00 0.00 177.57 177.64 2gri n LEU 36 N -3.16 2.66 -0.01 2.57 -0.00 -1.05 -3.33 117.00 114.69 2gri n LEU 36 Ca -0.00 -1.70 0.02 0.00 -0.00 0.00 0.00 56.01 54.33 2gri n LEU 36 Cb 0.25 -0.17 -0.04 0.00 -0.00 0.00 0.00 43.42 43.46 2gri n LEU 36 CO 0.26 0.63 -0.58 -3.20 -0.00 0.00 0.00 177.39 174.50 2gri n ASN 37 N 0.58 3.75 -0.01 1.45 5.15 -0.83 -3.89 115.26 121.46 2gri n ASN 37 Ca 0.10 0.00 -0.00 0.00 -0.60 0.00 0.00 54.58 54.08 2gri n ASN 37 Cb 0.39 1.18 -0.03 0.00 -0.53 0.00 0.00 39.78 40.79 2gri n ASN 37 CO 0.00 0.00 0.00 -1.84 1.40 0.00 0.00 177.26 176.82 2gri n GLU 38 N -1.75 2.03 0.00 1.20 0.28 -0.35 -4.21 120.64 117.85 2gri n GLU 38 Ca -0.02 -0.01 0.11 0.00 -0.16 0.00 0.00 57.16 57.08 2gri n GLU 38 Cb 0.20 -1.09 0.04 0.00 1.43 0.00 0.00 31.44 32.02 2gri n GLU 38 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 177.13 178.14 2gri n LYS 39 N -1.91 0.04 -2.68 3.44 4.81 -1.21 -4.76 118.16 115.89 2gri n LYS 39 Ca -0.03 -0.00 -0.03 0.00 -0.87 0.00 0.00 58.31 57.37 2gri n LYS 39 Cb 0.39 -1.51 0.03 0.00 0.02 0.00 0.00 35.03 33.96 2gri n LYS 39 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2gri n SER 41 N 2.66 4.56 -4.78 0.00 3.41 -1.25 -4.28 113.62 113.94 2gri n SER 41 Ca 0.11 0.00 -0.39 0.00 -0.26 0.00 0.00 58.87 58.33 2gri n SER 41 Cb 0.65 0.55 -0.06 0.00 -0.26 0.00 0.00 64.21 65.08 2gri n SER 41 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 2gri s VAL 42 N -2.04 4.63 0.05 -3.33 1.01 -1.26 -1.96 120.40 117.50 2gri s VAL 42 Ca -0.01 1.45 -0.01 0.00 0.00 0.00 0.00 61.98 63.42 2gri s VAL 42 Cb 0.01 -4.02 -0.04 0.00 0.00 0.00 0.00 36.38 32.33 2gri s VAL 42 CO 0.07 0.50 -0.03 -0.31 0.00 0.00 0.00 175.10 175.32 2gri s TYR 43 N -0.83 0.55 -0.03 5.22 1.51 -0.13 -5.00 117.35 118.64 2gri s TYR 43 Ca 0.33 -1.01 0.07 0.00 -1.01 0.00 0.00 57.07 55.44 2gri s TYR 43 Cb -0.21 -0.39 -0.02 0.00 -0.11 0.00 0.00 41.96 41.23 2gri s TYR 43 CO 0.22 -0.34 -0.22 0.99 -1.11 0.00 0.00 175.55 175.09 2gri s THR 44 N -3.71 2.35 -0.19 -0.71 2.01 -1.26 -1.71 115.64 112.42 2gri s THR 44 Ca 0.06 -0.99 0.01 0.00 0.31 0.00 0.00 61.69 61.08 2gri s THR 44 Cb 0.06 -1.85 0.02 0.00 0.01 0.00 0.00 72.50 70.74 2gri s THR 44 CO -0.09 0.58 -0.19 -0.69 -0.69 0.00 0.00 174.62 173.55 2gri s VAL 45 N -0.60 2.12 0.00 3.82 1.01 -1.14 -4.91 120.40 120.70 2gri s VAL 45 Ca 0.09 -0.98 -0.00 0.00 0.00 0.00 0.00 61.98 61.09 2gri s VAL 45 Cb -0.11 -1.92 0.00 0.00 0.00 0.00 0.00 36.38 34.36 2gri s VAL 45 CO -0.00 0.49 0.00 1.21 0.00 0.00 0.00 175.10 176.80 2gri n GLU 46 N 4.61 -1.92 0.08 2.72 2.13 -1.26 0.07 120.64 127.07 2gri n GLU 46 Ca -0.20 -0.00 -0.02 0.00 0.66 0.00 0.00 57.16 57.60 2gri n GLU 46 Cb 0.49 -0.00 -0.05 0.00 0.27 0.00 0.00 31.44 32.15 2gri n GLU 46 CO 0.00 0.00 0.00 1.03 -0.41 0.00 0.00 177.13 177.75 2gri h SER 47 N -1.92 0.00 -2.71 4.31 0.87 -1.87 -3.39 113.55 108.84 2gri h SER 47 Ca -0.00 0.00 -0.67 0.00 -1.23 0.00 0.00 61.79 59.89 2gri h SER 47 Cb 0.00 0.00 -0.38 0.00 -0.44 0.00 0.00 62.40 61.59 2gri h SER 47 CO 0.00 0.70 -0.19 0.61 -0.53 0.00 0.00 176.83 177.43 2gri n GLY 48 N 1.32 4.64 3.00 5.77 0.00 -1.26 -5.03 105.19 113.63 2gri n GLY 48 Ca -0.02 -2.69 -0.15 0.00 0.00 0.00 0.00 46.02 43.15 2gri n GLY 48 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2gri s THR 49 N -2.17 0.51 0.42 2.61 2.01 -1.26 -5.15 115.64 112.61 2gri s THR 49 Ca 0.33 -0.53 0.08 0.00 0.31 0.00 0.00 61.69 61.88 2gri s THR 49 Cb 0.05 -0.48 -0.00 0.00 0.01 0.00 0.00 72.50 72.08 2gri s THR 49 CO -0.03 -0.03 0.47 -1.61 -0.69 0.00 0.00 174.62 172.73 2gri s GLU 50 N -0.62 2.64 0.21 4.92 8.01 -1.26 -4.99 118.70 127.61 2gri s GLU 50 Ca -0.01 -1.43 0.21 0.00 0.01 0.00 0.00 54.97 53.75 2gri s GLU 50 Cb -0.05 -2.54 0.90 0.00 -4.31 0.00 0.00 34.13 28.14 2gri s GLU 50 CO 0.00 -0.25 1.64 0.28 0.01 0.00 0.00 175.26 176.94 2gri n VAL 51 N -1.70 0.90 -0.02 2.63 0.31 -1.26 -2.28 118.33 116.91 2gri n VAL 51 Ca 0.06 0.28 -0.05 0.00 -0.01 0.00 0.00 64.34 64.61 2gri n VAL 51 Cb 0.61 -1.18 -0.13 0.00 -0.91 0.00 0.00 33.84 32.23 2gri n VAL 51 CO 0.00 0.00 0.00 1.07 -1.32 0.00 0.00 176.83 176.58 2gri n THR 52 N -2.08 1.32 0.28 2.52 5.66 -1.26 -4.07 114.28 116.65 2gri n THR 52 Ca 0.02 -0.76 0.12 0.00 -3.05 0.00 0.00 64.05 60.38 2gri n THR 52 Cb 0.20 -0.74 0.78 0.00 -1.55 0.00 0.00 70.33 69.02 2gri n THR 52 CO 0.00 0.00 0.00 -0.08 -3.05 0.00 0.00 175.07 171.94 2gri h GLU 53 N 0.00 0.00 0.00 1.09 4.81 -1.85 0.04 114.58 118.67 2gri h GLU 53 Ca -0.29 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 58.93 2gri h GLU 53 Cb 1.86 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 31.24 2gri h GLU 53 CO 0.05 0.02 -0.07 0.74 -0.73 0.00 0.00 179.01 179.02 2gri h PHE 54 N 0.00 0.00 0.00 0.92 0.04 -1.70 -2.91 116.94 113.28 2gri h PHE 54 Ca -0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 2gri h PHE 54 Cb 0.03 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.18 2gri h PHE 54 CO 0.00 0.07 -0.04 0.00 -0.60 0.00 0.00 178.31 177.74 2gri h ALA 55 N 1.93 0.98 -0.01 2.45 0.00 -1.16 -2.50 119.26 120.95 2gri h ALA 55 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2gri h ALA 55 Cb 1.02 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.81 2gri h ALA 55 CO 0.01 0.00 -0.27 0.00 0.00 0.00 0.00 179.25 178.99 2gri n VAL 57 N 0.15 0.59 0.05 0.00 3.14 -1.11 -4.48 118.33 116.68 2gri n VAL 57 Ca 0.08 -0.51 -0.22 0.00 -2.96 0.00 0.00 64.34 60.73 2gri n VAL 57 Cb 0.38 -0.32 -0.15 0.00 -1.06 0.00 0.00 33.84 32.69 2gri n VAL 57 CO 0.00 0.00 0.00 0.58 -6.46 0.00 0.00 176.83 170.95 2gri h VAL 58 N 0.00 1.09 -0.41 1.55 2.07 -1.65 -2.87 116.25 116.03 2gri h VAL 58 Ca -0.23 -2.49 0.12 0.00 0.82 0.00 0.00 66.70 64.92 2gri h VAL 58 Cb 1.42 2.83 -0.02 0.00 -1.52 0.00 0.00 31.29 34.00 2gri h VAL 58 CO 0.01 0.77 0.38 0.00 0.02 0.00 0.00 177.57 178.76 2gri h ALA 59 N 0.04 2.17 0.00 1.67 0.00 -1.81 0.16 119.26 121.49 2gri h ALA 59 Ca -0.29 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.50 2gri h ALA 59 Cb 1.90 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 19.71 2gri h ALA 59 CO 0.14 -0.59 -1.68 -0.85 0.00 0.00 0.00 179.25 176.26 2gri n GLU 60 N -3.91 0.64 -0.00 0.00 0.28 -1.25 -3.93 120.64 112.47 2gri n GLU 60 Ca 0.07 0.02 0.14 0.00 -0.16 0.00 0.00 57.16 57.23 2gri n GLU 60 Cb 0.57 -1.67 0.77 0.00 1.43 0.00 0.00 31.44 32.54 2gri n GLU 60 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2gri n ALA 61 N -2.35 2.65 -0.08 -1.84 0.00 0.47 -3.51 120.51 115.85 2gri n ALA 61 Ca -0.09 -0.25 -0.09 0.00 0.00 0.00 0.00 53.44 53.01 2gri n ALA 61 Cb 0.73 -1.39 -0.11 0.00 0.00 0.00 0.00 19.45 18.68 2gri n ALA 61 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 2gri n VAL 62 N -0.67 1.02 0.00 0.00 0.24 -0.70 -4.15 118.33 114.06 2gri n VAL 62 Ca 0.21 -0.56 0.00 0.00 -2.04 0.00 0.00 64.34 61.95 2gri n VAL 62 Cb 0.16 -0.77 0.00 0.00 -1.47 0.00 0.00 33.84 31.76 2gri n VAL 62 CO 0.00 0.00 0.00 0.52 -2.14 0.00 0.00 176.83 175.21 2gri n VAL 63 N -2.69 0.00 -0.31 3.34 0.31 -1.23 -0.01 118.33 117.74 2gri n VAL 63 Ca -0.26 1.03 0.17 0.00 -0.01 0.00 0.00 64.34 65.26 2gri n VAL 63 Cb 0.94 -1.92 0.42 0.00 -0.91 0.00 0.00 33.84 32.37 2gri n VAL 63 CO 0.00 0.00 0.00 0.07 -1.32 0.00 0.00 176.83 175.58 2gri h LYS 64 N 0.00 0.56 0.00 5.55 2.10 -1.86 0.38 116.57 123.29 2gri h LYS 64 Ca 0.00 -0.03 -0.10 0.00 -2.00 0.00 0.00 60.65 58.52 2gri h LYS 64 Cb 0.00 -0.13 -0.01 0.00 -0.90 0.00 0.00 32.23 31.19 2gri h LYS 64 CO 0.00 0.37 -0.46 1.15 -2.00 0.00 0.00 179.45 178.51 2gri h THR 65 N 0.57 1.30 -2.21 0.07 2.02 -1.72 -3.29 112.91 109.65 2gri h THR 65 Ca 0.54 -1.60 -0.57 0.00 0.77 0.00 0.00 66.41 65.55 2gri h THR 65 Cb 1.10 1.87 -0.42 0.00 -1.74 0.00 0.00 68.15 68.96 2gri h THR 65 CO -0.29 0.45 -0.75 0.18 0.37 0.00 0.00 175.52 175.49 2gri n LEU 66 N -3.94 3.59 -1.81 2.58 4.77 0.12 -4.82 117.00 117.50 2gri n LEU 66 Ca -0.02 -5.50 -0.08 0.00 -0.03 0.00 0.00 56.01 50.38 2gri n LEU 66 Cb 0.49 -0.31 0.07 0.00 -2.33 0.00 0.00 43.42 41.34 2gri n LEU 66 CO 0.40 2.29 0.17 0.00 -1.33 0.00 0.00 177.39 178.91 2gri n GLN 67 N 0.07 2.29 -0.03 3.23 1.13 -0.65 -4.76 117.38 118.65 2gri n GLN 67 Ca 0.29 -3.56 -0.13 0.00 -1.94 0.00 0.00 57.00 51.67 2gri n GLN 67 Cb 0.44 -1.70 -0.09 0.00 0.11 0.00 0.00 30.24 29.01 2gri n GLN 67 CO 0.00 0.00 0.00 -1.00 -1.44 0.00 0.00 177.06 174.62 2gri h PRO 68 N 1.86 0.16 -0.73 -1.09 0.13 -1.88 -3.41 132.00 127.04 2gri h PRO 68 Ca 0.10 -0.08 -0.33 0.00 -0.87 0.00 0.00 66.00 64.81 2gri h PRO 68 Cb 1.40 0.00 -0.24 0.00 0.13 0.00 0.00 31.00 32.29 2gri h PRO 68 CO 0.37 0.60 -0.72 1.33 -0.23 0.00 0.00 178.00 179.36 2gri n VAL 69 N -4.72 -0.09 0.32 1.56 0.24 -1.26 -4.95 118.33 109.44 2gri n VAL 69 Ca -0.07 -2.60 0.10 0.00 -2.04 0.00 0.00 64.34 59.73 2gri n VAL 69 Cb 0.30 0.78 0.44 0.00 -1.47 0.00 0.00 33.84 33.89 2gri n VAL 69 CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15 2gri n SER 70 N 0.49 0.47 0.25 -1.34 3.41 -1.26 -2.21 113.62 113.42 2gri n SER 70 Ca 0.13 0.65 0.17 0.00 -0.26 0.00 0.00 58.87 59.55 2gri n SER 70 Cb 0.67 -0.73 0.86 0.00 -0.26 0.00 0.00 64.21 64.75 2gri n SER 70 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 2gri h ASP 71 N 0.00 0.00 0.07 4.04 5.19 -1.96 -2.19 116.42 121.57 2gri h ASP 71 Ca 0.00 0.00 -0.37 0.00 -0.62 0.00 0.00 57.03 56.04 2gri h ASP 71 Cb 0.23 0.00 -0.06 0.00 0.18 0.00 0.00 39.33 39.68 2gri h ASP 71 CO 0.00 0.00 -2.31 0.00 -3.12 0.00 0.00 179.24 173.81 2gri n LEU 72 N -2.69 1.87 0.13 1.55 -0.00 -0.94 -4.29 117.00 112.63 2gri n LEU 72 Ca -0.02 0.01 0.05 0.00 -0.00 0.00 0.00 56.01 56.05 2gri n LEU 72 Cb 0.09 -0.43 0.51 0.00 -0.00 0.00 0.00 43.42 43.60 2gri n LEU 72 CO 0.17 0.75 1.09 -0.07 -0.00 0.00 0.00 177.39 179.32 2gri h LEU 73 N 0.01 0.24 -0.85 1.47 3.38 -1.52 -0.17 115.31 117.88 2gri h LEU 73 Ca -0.52 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.44 2gri h LEU 73 Cb 2.03 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 42.72 2gri h LEU 73 CO -0.01 0.20 0.00 0.74 0.09 0.00 0.00 178.44 179.46 2gri h THR 74 N 0.28 0.00 0.00 0.22 2.02 -1.11 -1.08 112.91 113.23 2gri h THR 74 Ca 0.07 -0.44 -0.06 0.00 0.77 0.00 0.00 66.41 66.75 2gri h THR 74 Cb 0.02 1.33 -0.01 0.00 -1.74 0.00 0.00 68.15 67.75 2gri h THR 74 CO -0.01 0.00 -0.28 0.78 0.37 0.00 0.00 175.52 176.38 2gri h ASN 75 N 0.00 0.00 0.00 4.18 2.35 -1.20 -3.26 115.58 117.65 2gri h ASN 75 Ca 0.00 0.00 -0.20 0.00 -0.55 0.00 0.00 56.30 55.55 2gri h ASN 75 Cb 0.53 0.00 -0.04 0.00 0.05 0.00 0.00 38.32 38.86 2gri h ASN 75 CO 0.00 0.28 -2.16 1.15 -1.65 0.00 0.00 177.43 175.04 2gri n MET 76 N -3.23 0.75 0.00 0.81 0.00 -1.02 -5.02 117.12 109.42 2gri n MET 76 Ca 0.02 -0.09 0.00 0.00 0.00 0.00 0.00 57.70 57.63 2gri n MET 76 Cb 0.59 -1.50 0.00 0.00 0.00 0.00 0.00 33.22 32.31 2gri n MET 76 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 2gri n GLY 77 N 1.60 4.74 3.57 3.17 0.00 -0.65 -5.09 105.19 112.52 2gri n GLY 77 Ca -0.20 -0.79 -0.47 0.00 0.00 0.00 0.00 46.02 44.57 2gri n GLY 77 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2gri n ILE 78 N 0.00 0.36 -3.71 -0.61 5.41 -0.50 -4.79 119.36 115.51 2gri n ILE 78 Ca 0.00 -0.30 -0.37 0.00 1.00 0.00 0.00 62.75 63.08 2gri n ILE 78 Cb 0.00 -2.10 -0.06 0.00 -0.71 0.00 0.00 39.64 36.77 2gri n ILE 78 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 2gri s ASP 79 N 6.92 6.51 -0.06 4.38 -1.08 -1.26 -2.43 116.67 129.64 2gri s ASP 79 Ca 1.02 0.60 0.11 0.00 -0.52 0.00 0.00 52.55 53.76 2gri s ASP 79 Cb -0.59 -2.14 -0.23 0.00 -1.46 0.00 0.00 42.92 38.49 2gri s ASP 79 CO 0.44 0.33 0.60 -0.11 0.52 0.00 0.00 175.17 176.94 2gri n LEU 80 N 2.25 1.02 0.21 -1.34 -0.00 -1.26 -3.88 117.00 113.99 2gri n LEU 80 Ca -0.17 0.37 0.06 0.00 -0.00 0.00 0.00 56.01 56.27 2gri n LEU 80 Cb 0.54 0.05 0.45 0.00 -0.00 0.00 0.00 43.42 44.45 2gri n LEU 80 CO 0.34 0.44 0.78 -0.78 -0.00 0.00 0.00 177.39 178.17 2gri h ASP 81 N 0.01 0.00 0.69 1.96 3.58 -1.99 -2.71 116.42 117.96 2gri h ASP 81 Ca -0.31 0.00 -0.17 0.00 0.42 0.00 0.00 57.03 56.96 2gri h ASP 81 Cb 2.03 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 43.06 2gri h ASP 81 CO 0.08 0.31 -0.79 1.05 -2.88 0.00 0.00 179.24 177.00 2gri h GLU 82 N 0.00 0.07 -0.85 0.28 4.11 -1.93 -3.18 114.58 113.07 2gri h GLU 82 Ca -0.00 -0.07 0.19 0.00 0.07 0.00 0.00 59.36 59.54 2gri h GLU 82 Cb 0.65 0.02 -0.06 0.00 0.50 0.00 0.00 28.75 29.86 2gri h GLU 82 CO 0.04 0.83 0.57 -1.49 0.07 0.00 0.00 179.01 179.02 2gri h TRP 83 N 0.04 0.50 0.00 2.06 4.06 -1.59 0.33 115.95 121.36 2gri h TRP 83 Ca -0.02 0.02 -0.15 0.00 2.06 0.00 0.00 58.89 60.80 2gri h TRP 83 Cb 1.39 -0.15 -0.02 0.00 -1.00 0.00 0.00 29.16 29.38 2gri h TRP 83 CO 0.01 0.15 -0.72 0.77 -3.56 0.00 0.00 178.44 175.09 2gri h SER 84 N 0.39 0.00 -0.79 -3.49 0.02 -1.66 -3.27 113.55 104.75 2gri h SER 84 Ca 0.44 0.00 -0.56 0.00 -0.84 0.00 0.00 61.79 60.82 2gri h SER 84 Cb 1.09 0.00 -0.38 0.00 0.14 0.00 0.00 62.40 63.25 2gri h SER 84 CO -0.15 0.72 -0.35 1.33 -1.14 0.00 0.00 176.83 177.23 2gri n VAL 85 N -3.46 2.81 -4.03 2.27 0.24 0.87 -4.89 118.33 112.15 2gri n VAL 85 Ca 0.00 -3.82 -0.13 0.00 -2.04 0.00 0.00 64.34 58.35 2gri n VAL 85 Cb 0.76 -1.10 -0.02 0.00 -1.47 0.00 0.00 33.84 32.01 2gri n VAL 85 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2gri n ALA 86 N -0.79 0.26 -3.91 2.33 0.00 0.52 -4.96 120.51 113.97 2gri n ALA 86 Ca 0.48 -0.95 -0.30 0.00 0.00 0.00 0.00 53.44 52.67 2gri n ALA 86 Cb 0.89 0.46 -0.16 0.00 0.00 0.00 0.00 19.45 20.65 2gri n ALA 86 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2gri s THR 87 N -1.49 1.41 -1.06 0.00 2.01 -1.26 -5.01 115.64 110.23 2gri s THR 87 Ca 0.06 -1.19 -0.06 0.00 0.31 0.00 0.00 61.69 60.81 2gri s THR 87 Cb -0.00 -1.73 0.28 0.00 0.01 0.00 0.00 72.50 71.06 2gri s THR 87 CO 0.04 -0.16 1.20 0.49 -0.69 0.00 0.00 174.62 175.49 2gri n PHE 88 N 4.71 4.00 -1.71 4.92 3.01 -1.26 -4.41 117.46 126.72 2gri n PHE 88 Ca -0.11 -3.47 -0.41 0.00 1.01 0.00 0.00 57.45 54.47 2gri n PHE 88 Cb 0.44 -1.43 0.01 0.00 -0.01 0.00 0.00 39.48 38.49 2gri n PHE 88 CO 0.00 0.00 0.00 0.66 1.01 0.00 0.00 176.76 178.43 2gri n TYR 89 N 2.06 2.29 -3.77 1.38 4.02 -0.03 -4.32 117.16 118.78 2gri n TYR 89 Ca 0.25 0.51 -0.21 0.00 -0.01 0.00 0.00 57.90 58.43 2gri n TYR 89 Cb 0.37 -2.41 -0.02 0.00 -0.02 0.00 0.00 39.34 37.26 2gri n TYR 89 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 2gri s LEU 90 N -1.55 4.20 0.13 7.72 2.01 -1.26 -0.06 118.68 129.88 2gri s LEU 90 Ca 0.58 0.13 -0.25 0.00 0.01 0.00 0.00 54.13 54.60 2gri s LEU 90 Cb -0.52 -2.95 0.07 0.00 0.01 0.00 0.00 46.19 42.80 2gri s LEU 90 CO 0.60 -0.17 1.03 -0.36 1.01 0.00 0.00 176.35 178.45 2gri s PHE 91 N -2.08 -0.08 0.08 0.29 0.08 -0.81 -4.63 117.98 110.83 2gri s PHE 91 Ca 0.37 -0.21 0.00 0.00 0.12 0.00 0.00 56.93 57.20 2gri s PHE 91 Cb -0.09 0.64 0.00 0.00 -0.57 0.00 0.00 43.02 43.00 2gri s PHE 91 CO 0.31 -0.76 0.01 -3.47 -0.10 0.00 0.00 175.22 171.21 2gri n ASP 92 N -0.61 2.05 0.03 1.36 2.03 -1.03 -0.06 116.55 120.32 2gri n ASP 92 Ca -0.06 -1.34 0.11 0.00 0.52 0.00 0.00 54.79 54.03 2gri n ASP 92 Cb 0.61 0.04 0.47 0.00 -0.72 0.00 0.00 41.12 41.52 2gri n ASP 92 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 2gri n ASP 93 N -1.21 0.19 -0.37 1.67 -0.08 -1.26 -2.52 116.55 112.97 2gri n ASP 93 Ca -0.03 0.53 0.09 0.00 -1.51 0.00 0.00 54.79 53.87 2gri n ASP 93 Cb 0.10 -0.58 -0.01 0.00 2.34 0.00 0.00 41.12 42.97 2gri n ASP 93 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2gri n ALA 94 N -1.57 3.45 -1.74 -1.67 0.00 -1.26 -4.98 120.51 112.74 2gri n ALA 94 Ca 0.05 -0.57 0.00 0.00 0.00 0.00 0.00 53.44 52.92 2gri n ALA 94 Cb 0.28 -0.65 0.00 0.00 0.00 0.00 0.00 19.45 19.08 2gri n ALA 94 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2gri n GLY 95 N 1.28 0.67 3.17 0.00 0.00 -1.05 -5.07 105.19 104.19 2gri n GLY 95 Ca 0.07 -0.73 -0.28 0.00 0.00 0.00 0.00 46.02 45.09 2gri n GLY 95 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2gri s GLU 96 N -3.62 2.02 -1.22 1.61 -1.05 -1.26 -4.84 118.70 110.33 2gri s GLU 96 Ca 0.00 -0.69 -0.19 0.00 -0.15 0.00 0.00 54.97 53.93 2gri s GLU 96 Cb 0.00 -1.73 0.06 0.00 -0.44 0.00 0.00 34.13 32.02 2gri s GLU 96 CO 0.00 0.28 1.67 -1.21 0.95 0.00 0.00 175.26 176.95 2gri s GLU 97 N -0.00 3.85 0.26 -4.83 2.02 -1.26 -2.48 118.70 116.26 2gri s GLU 97 Ca -0.04 -1.75 0.04 0.00 0.02 0.00 0.00 54.97 53.24 2gri s GLU 97 Cb -0.12 -5.49 -0.06 0.00 0.10 0.00 0.00 34.13 28.57 2gri s GLU 97 CO 0.03 -2.28 -0.00 -0.80 0.02 0.00 0.00 175.26 172.22 2gri s ASN 98 N 4.49 2.13 -1.39 -0.19 0.01 -1.26 -4.90 114.94 113.83 2gri s ASN 98 Ca 0.52 -1.25 -0.09 0.00 -0.71 0.00 0.00 52.86 51.33 2gri s ASN 98 Cb 0.03 -0.05 -0.07 0.00 0.41 0.00 0.00 41.25 41.57 2gri s ASN 98 CO 0.03 -0.50 2.65 0.49 -1.51 0.00 0.00 177.10 178.26 2gri n PHE 99 N -0.51 2.17 -2.74 2.20 3.72 -1.26 -4.86 117.46 116.18 2gri n PHE 99 Ca -0.04 -2.73 -0.30 0.00 -0.05 0.00 0.00 57.45 54.33 2gri n PHE 99 Cb 0.64 -2.24 -0.02 0.00 -0.94 0.00 0.00 39.48 36.92 2gri n PHE 99 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 176.76 175.59 2gri s SER 100 N 2.67 6.46 0.55 4.37 0.01 -1.26 -4.95 113.70 121.55 2gri s SER 100 Ca 0.59 1.12 0.29 0.00 1.31 0.00 0.00 55.95 59.27 2gri s SER 100 Cb 0.15 -2.32 1.46 0.00 0.21 0.00 0.00 66.02 65.52 2gri s SER 100 CO -0.05 -0.47 1.92 0.28 0.41 0.00 0.00 173.24 175.33 2gri h SER 101 N 0.96 0.00 -3.29 2.44 0.02 -1.91 -3.38 113.55 108.38 2gri h SER 101 Ca -0.47 0.00 -0.67 0.00 -0.84 0.00 0.00 61.79 59.82 2gri h SER 101 Cb 1.19 0.00 -0.30 0.00 0.14 0.00 0.00 62.40 63.43 2gri h SER 101 CO 0.63 0.00 -0.81 -0.60 -1.14 0.00 0.00 176.83 174.92 2gri s ARG 102 N -4.89 3.23 -0.25 3.45 3.52 -1.26 -0.41 118.95 122.34 2gri s ARG 102 Ca -0.05 -0.75 0.01 0.00 -0.13 0.00 0.00 55.73 54.81 2gri s ARG 102 Cb 0.19 -2.58 0.06 0.00 -1.56 0.00 0.00 34.95 31.06 2gri s ARG 102 CO 0.70 0.08 -0.06 -1.64 -0.81 0.00 0.00 175.30 173.58 2gri s MET 103 N 0.65 1.73 -0.11 5.12 -1.94 0.21 -4.47 119.30 120.49 2gri s MET 103 Ca -0.08 -1.11 -0.30 0.00 -1.71 0.00 0.00 55.69 52.49 2gri s MET 103 Cb -0.16 -2.67 -0.01 0.00 2.01 0.00 0.00 34.83 34.00 2gri s MET 103 CO 0.02 -0.62 1.02 0.71 -0.01 0.00 0.00 175.02 176.14 2gri s TYR 104 N 1.31 3.49 -0.72 -0.03 2.02 0.91 -3.76 117.35 120.58 2gri s TYR 104 Ca -0.05 1.57 -0.20 0.00 -0.37 0.00 0.00 57.07 58.02 2gri s TYR 104 Cb -0.19 -3.20 0.10 0.00 -0.40 0.00 0.00 41.96 38.27 2gri s TYR 104 CO -0.06 -0.28 0.94 0.00 -1.57 0.00 0.00 175.55 174.57 2gri s SER 106 N 3.61 6.55 0.00 0.00 1.04 0.91 -4.27 113.70 121.54 2gri s SER 106 Ca 0.22 0.64 0.30 0.00 0.48 0.00 0.00 55.95 57.59 2gri s SER 106 Cb -0.15 -2.13 1.44 0.00 0.10 0.00 0.00 66.02 65.28 2gri s SER 106 CO 0.03 0.31 2.00 2.22 0.98 0.00 0.00 173.24 178.79 2gri n PHE 107 N 1.52 0.00 -4.19 5.02 1.16 -1.26 -0.85 117.46 118.86 2gri n PHE 107 Ca -0.14 0.00 -0.27 0.00 -1.87 0.00 0.00 57.45 55.17 2gri n PHE 107 Cb 0.53 -0.29 -0.07 0.00 -1.61 0.00 0.00 39.48 38.04 2gri n PHE 107 CO 0.00 0.00 0.00 1.52 -1.87 0.00 0.00 176.76 176.41 2gri s TYR 108 N -2.60 2.88 0.97 2.97 1.13 -1.26 -4.85 117.35 116.59 2gri s TYR 108 Ca 0.27 -0.12 -0.12 0.00 -1.41 0.00 0.00 57.07 55.69 2gri s TYR 108 Cb 0.20 -1.39 0.17 0.00 -1.10 0.00 0.00 41.96 39.84 2gri s TYR 108 CO 0.47 0.52 1.09 -1.25 -2.51 0.00 0.00 175.55 173.87 2gri s PRO 109 N -2.94 0.67 0.01 -3.49 0.04 -1.26 -4.56 135.00 123.47 2gri s PRO 109 Ca 0.28 0.61 -0.23 0.00 0.04 0.00 0.00 61.00 61.70 2gri s PRO 109 Cb -0.09 -1.76 -0.17 0.00 0.04 0.00 0.00 34.50 32.52 2gri s PRO 109 CO 0.19 -2.59 1.31 -1.00 0.04 0.00 0.00 177.00 174.95 2gri h PRO 110 N -1.79 0.18 0.00 0.56 0.13 -1.98 -3.47 132.00 125.63 2gri h PRO 110 Ca -0.53 -0.10 0.00 0.00 -0.87 0.00 0.00 66.00 64.50 2gri h PRO 110 Cb 1.32 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.45 2gri h PRO 110 CO 0.57 0.61 0.00 -0.25 -0.23 0.00 0.00 178.00 178.70 2gri n ASP 111 N -4.70 0.00 0.00 1.44 8.00 -1.26 -5.20 116.55 114.83 2gri n ASP 111 Ca -0.07 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.43 2gri n ASP 111 Cb 0.31 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.41 2gri n ASP 111 CO 0.00 0.00 0.00 1.21 -0.39 0.00 0.00 177.20 178.02