#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fiq s ALA 3 N 0.00 1.97 0.36 1.79 0.00 -1.26 -5.12 121.76 119.50 1fiq s ALA 3 Ca 0.00 -1.09 -0.26 0.00 0.00 0.00 0.00 51.96 50.61 1fiq s ALA 3 Cb 0.00 -0.45 -0.09 0.00 0.00 0.00 0.00 23.12 22.58 1fiq s ALA 3 CO 0.00 0.47 1.07 -0.51 0.00 0.00 0.00 175.76 176.79 1fiq s ASP 4 N -0.91 6.92 0.44 0.00 1.01 -1.26 -5.02 116.67 117.85 1fiq s ASP 4 Ca 0.09 2.13 -0.21 0.00 0.71 0.00 0.00 52.55 55.27 1fiq s ASP 4 Cb -0.09 -2.60 -0.10 0.00 1.01 0.00 0.00 42.92 41.13 1fiq s ASP 4 CO 0.01 -0.38 0.97 -1.61 0.21 0.00 0.00 175.17 174.37 1fiq s GLU 5 N -2.13 4.12 -0.24 8.23 2.02 -1.26 -4.83 118.70 124.62 1fiq s GLU 5 Ca 0.53 1.18 -0.09 0.00 0.02 0.00 0.00 54.97 56.61 1fiq s GLU 5 Cb -0.26 -2.16 -0.04 0.00 0.10 0.00 0.00 34.13 31.77 1fiq s GLU 5 CO 0.33 -0.13 0.11 -1.17 0.02 0.00 0.00 175.26 174.41 1fiq s LEU 6 N -3.26 3.78 -0.09 1.80 2.96 0.39 -4.98 118.68 119.28 1fiq s LEU 6 Ca 0.63 -0.04 0.02 0.00 -0.22 0.00 0.00 54.13 54.53 1fiq s LEU 6 Cb -0.11 -2.01 0.01 0.00 0.50 0.00 0.00 46.19 44.59 1fiq s LEU 6 CO 0.15 0.03 -0.14 -0.69 -1.32 0.00 0.00 176.35 174.38 1fiq s VAL 7 N 1.23 1.38 0.36 1.68 1.01 -1.26 -0.42 120.40 124.38 1fiq s VAL 7 Ca 0.06 -0.59 -0.09 0.00 0.00 0.00 0.00 61.98 61.36 1fiq s VAL 7 Cb -0.14 -1.26 0.04 0.00 0.00 0.00 0.00 36.38 35.02 1fiq s VAL 7 CO 0.05 0.41 0.63 2.22 0.00 0.00 0.00 175.10 178.41 1fiq n PHE 8 N 4.03 -1.91 -4.34 5.22 1.16 -0.89 0.26 117.46 120.98 1fiq n PHE 8 Ca -0.20 -1.97 -0.23 0.00 -1.87 0.00 0.00 57.45 53.18 1fiq n PHE 8 Cb 0.52 0.73 -0.12 0.00 -1.61 0.00 0.00 39.48 39.00 1fiq n PHE 8 CO 0.00 0.00 0.00 -0.06 -1.87 0.00 0.00 176.76 174.83 1fiq s PHE 9 N -2.77 1.91 -0.09 2.97 0.40 -0.87 -0.36 117.98 119.17 1fiq s PHE 9 Ca 0.20 -0.44 -0.03 0.00 -0.60 0.00 0.00 56.93 56.06 1fiq s PHE 9 Cb -0.03 -0.97 0.05 0.00 0.51 0.00 0.00 43.02 42.58 1fiq s PHE 9 CO 0.15 0.34 0.13 0.08 0.70 0.00 0.00 175.22 176.62 1fiq s VAL 10 N -1.81 -0.20 -1.46 -0.44 1.01 -0.79 0.60 120.40 117.32 1fiq s VAL 10 Ca 0.15 0.26 -0.10 0.00 0.00 0.00 0.00 61.98 62.29 1fiq s VAL 10 Cb -0.07 -0.32 0.05 0.00 0.00 0.00 0.00 36.38 36.04 1fiq s VAL 10 CO 0.07 0.06 0.78 0.59 0.00 0.00 0.00 175.10 176.61 1fiq n ASN 11 N 5.31 -5.04 0.00 3.32 3.02 0.96 -1.85 115.26 120.98 1fiq n ASN 11 Ca -0.04 -0.53 0.00 0.00 -0.03 0.00 0.00 54.58 53.98 1fiq n ASN 11 Cb 0.50 -4.06 0.00 0.00 -0.61 0.00 0.00 39.78 35.61 1fiq n ASN 11 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1fiq n GLY 12 N -1.55 0.56 3.34 7.41 0.00 -1.26 -5.02 105.19 108.66 1fiq n GLY 12 Ca -0.01 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.68 1fiq n GLY 12 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1fiq s LYS 13 N -0.02 3.01 0.19 1.61 2.20 -0.77 -5.10 119.74 120.86 1fiq s LYS 13 Ca 0.00 -0.77 -0.30 0.00 -0.36 0.00 0.00 55.97 54.54 1fiq s LYS 13 Cb 0.00 -2.43 -0.08 0.00 -1.51 0.00 0.00 37.83 33.81 1fiq s LYS 13 CO 0.00 0.31 1.26 0.21 -0.36 0.00 0.00 175.35 176.76 1fiq s LYS 14 N 0.07 4.44 -0.20 4.03 2.20 -1.26 -1.88 119.74 127.14 1fiq s LYS 14 Ca -0.07 1.97 0.01 0.00 -0.36 0.00 0.00 55.97 57.52 1fiq s LYS 14 Cb -0.15 -3.21 0.04 0.00 -1.51 0.00 0.00 37.83 32.99 1fiq s LYS 14 CO 0.05 -0.17 -0.12 0.08 -0.36 0.00 0.00 175.35 174.82 1fiq s VAL 15 N 0.01 1.76 -0.33 4.02 1.01 0.52 -4.96 120.40 122.43 1fiq s VAL 15 Ca 0.55 -1.02 -0.08 0.00 0.00 0.00 0.00 61.98 61.43 1fiq s VAL 15 Cb -0.35 -1.77 0.02 0.00 0.00 0.00 0.00 36.38 34.28 1fiq s VAL 15 CO 0.38 0.24 0.13 -0.69 0.00 0.00 0.00 175.10 175.16 1fiq s VAL 16 N 1.36 4.14 -0.42 2.92 1.01 -1.26 -2.09 120.40 126.05 1fiq s VAL 16 Ca -0.00 -0.83 -0.11 0.00 0.00 0.00 0.00 61.98 61.04 1fiq s VAL 16 Cb -0.16 -3.24 0.07 0.00 0.00 0.00 0.00 36.38 33.06 1fiq s VAL 16 CO -0.09 -0.07 0.28 -0.70 0.00 0.00 0.00 175.10 174.52 1fiq s GLU 17 N 1.50 2.73 0.28 2.72 2.56 0.44 -4.96 118.70 123.98 1fiq s GLU 17 Ca 0.01 -1.37 0.26 0.00 0.00 0.00 0.00 54.97 53.87 1fiq s GLU 17 Cb -0.18 -3.85 0.77 0.00 2.00 0.00 0.00 34.13 32.86 1fiq s GLU 17 CO 0.04 -0.93 1.74 0.87 -0.56 0.00 0.00 175.26 176.43 1fiq h LYS 18 N 8.49 0.00 -0.36 4.30 1.57 -1.91 0.11 116.57 128.77 1fiq h LYS 18 Ca -0.25 0.00 -0.27 0.00 -1.87 0.00 0.00 60.65 58.26 1fiq h LYS 18 Cb 1.09 0.00 -0.34 0.00 0.08 0.00 0.00 32.23 33.07 1fiq h LYS 18 CO 0.77 0.00 -0.91 0.09 -0.57 0.00 0.00 179.45 178.83 1fiq n ASN 19 N -2.48 2.45 -4.47 0.86 3.02 -1.26 -4.68 115.26 108.69 1fiq n ASN 19 Ca 0.04 -2.85 -0.54 0.00 -0.03 0.00 0.00 54.58 51.20 1fiq n ASN 19 Cb 0.42 -0.41 -0.06 0.00 -0.61 0.00 0.00 39.78 39.11 1fiq n ASN 19 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1fiq n ALA 20 N -0.50 -3.17 -3.05 5.41 0.00 -1.26 -4.94 120.51 113.01 1fiq n ALA 20 Ca 0.20 0.53 -0.37 0.00 0.00 0.00 0.00 53.44 53.80 1fiq n ALA 20 Cb 0.90 -1.73 -0.12 0.00 0.00 0.00 0.00 19.45 18.50 1fiq n ALA 20 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1fiq s ASP 21 N -0.35 5.24 0.44 0.00 -1.08 -1.26 -4.99 116.67 114.66 1fiq s ASP 21 Ca 0.80 -0.46 0.30 0.00 -0.52 0.00 0.00 52.55 52.67 1fiq s ASP 21 Cb -1.12 -1.93 1.41 0.00 -1.46 0.00 0.00 42.92 39.82 1fiq s ASP 21 CO 0.56 -0.13 1.64 -0.65 0.52 0.00 0.00 175.17 177.11 1fiq h PRO 22 N 8.27 0.11 0.00 4.34 0.11 -2.02 0.21 132.00 143.02 1fiq h PRO 22 Ca -0.34 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.76 1fiq h PRO 22 Cb 1.15 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.24 1fiq h PRO 22 CO 0.60 0.07 0.00 0.39 -0.21 0.00 0.00 178.00 178.85 1fiq n GLU 23 N -4.65 0.40 -2.42 1.05 1.02 -1.26 -4.78 120.64 109.99 1fiq n GLU 23 Ca 0.36 0.03 -0.43 0.00 -0.02 0.00 0.00 57.16 57.10 1fiq n GLU 23 Cb 1.39 -1.50 -0.02 0.00 -0.02 0.00 0.00 31.44 31.29 1fiq n GLU 23 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 1fiq s THR 24 N -2.56 4.27 0.42 2.62 2.01 0.74 -5.02 115.64 118.12 1fiq s THR 24 Ca 0.26 1.53 -0.16 0.00 0.31 0.00 0.00 61.69 63.64 1fiq s THR 24 Cb 0.18 -4.01 -0.09 0.00 0.01 0.00 0.00 72.50 68.60 1fiq s THR 24 CO 0.41 -0.16 0.87 0.42 -0.69 0.00 0.00 174.62 175.47 1fiq s THR 25 N 3.56 4.59 0.35 -0.82 -4.23 -1.26 -1.62 115.64 116.22 1fiq s THR 25 Ca 0.55 1.08 0.03 0.00 -1.18 0.00 0.00 61.69 62.17 1fiq s THR 25 Cb -0.21 -3.67 0.27 0.00 1.34 0.00 0.00 72.50 70.23 1fiq s THR 25 CO 0.15 -0.44 1.99 0.25 -0.54 0.00 0.00 174.62 176.04 1fiq h LEU 26 N 1.57 0.73 0.12 4.79 5.85 0.78 -2.02 115.31 127.13 1fiq h LEU 26 Ca -0.48 -0.01 0.01 0.00 0.84 0.00 0.00 57.88 58.24 1fiq h LEU 26 Cb 1.18 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 42.02 1fiq h LEU 26 CO 0.63 0.52 -0.14 0.25 -0.34 0.00 0.00 178.44 179.36 1fiq h LEU 27 N 0.86 -0.37 -0.64 2.25 5.85 -1.52 0.15 115.31 121.88 1fiq h LEU 27 Ca 0.26 0.04 -0.02 0.00 0.84 0.00 0.00 57.88 59.00 1fiq h LEU 27 Cb -0.01 0.13 -0.03 0.00 0.37 0.00 0.00 40.66 41.12 1fiq h LEU 27 CO -0.07 -0.21 0.34 0.00 -0.34 0.00 0.00 178.44 178.16 1fiq h ALA 28 N 0.55 0.83 -0.44 1.25 0.00 -1.78 -0.98 119.26 118.68 1fiq h ALA 28 Ca 0.01 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 1fiq h ALA 28 Cb 0.29 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 1fiq h ALA 28 CO -0.05 0.36 0.23 -0.92 0.00 0.00 0.00 179.25 178.87 1fiq h TYR 29 N 0.88 0.61 0.21 0.00 3.20 -1.09 0.12 116.97 120.89 1fiq h TYR 29 Ca 0.22 -0.02 -0.01 0.00 3.14 0.00 0.00 58.73 62.07 1fiq h TYR 29 Cb 0.07 -0.19 0.00 0.00 1.54 0.00 0.00 36.73 38.14 1fiq h TYR 29 CO -0.00 0.47 -0.10 -0.07 -1.64 0.00 0.00 178.16 176.82 1fiq h LEU 30 N 0.57 -0.23 0.02 2.82 3.38 -0.37 -1.78 115.31 119.72 1fiq h LEU 30 Ca 0.15 -0.03 -0.00 0.00 0.09 0.00 0.00 57.88 58.09 1fiq h LEU 30 Cb 0.07 0.06 0.00 0.00 0.09 0.00 0.00 40.66 40.88 1fiq h LEU 30 CO -0.02 -0.12 -0.01 0.03 0.09 0.00 0.00 178.44 178.40 1fiq h ARG 31 N -0.32 -0.03 0.00 1.13 3.08 -1.08 0.76 114.38 117.91 1fiq h ARG 31 Ca -0.03 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 59.99 1fiq h ARG 31 Cb 0.25 0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.30 1fiq h ARG 31 CO 0.05 0.38 -0.22 0.00 -1.07 0.00 0.00 179.97 179.11 1fiq h ARG 32 N -0.45 0.00 0.01 0.04 3.08 -0.83 -2.88 114.38 113.34 1fiq h ARG 32 Ca -0.00 0.00 -0.16 0.00 0.07 0.00 0.00 59.98 59.89 1fiq h ARG 32 Cb 0.43 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.49 1fiq h ARG 32 CO 0.01 0.65 -0.62 -0.22 -1.07 0.00 0.00 179.97 178.72 1fiq h LYS 33 N -1.00 0.41 -0.00 0.04 3.11 -1.47 -3.33 116.57 114.33 1fiq h LYS 33 Ca -0.05 -0.45 0.00 0.00 -2.81 0.00 0.00 60.65 57.34 1fiq h LYS 33 Cb 0.74 0.13 0.00 0.00 -1.00 0.00 0.00 32.23 32.09 1fiq h LYS 33 CO -0.03 1.11 -0.53 1.28 -2.81 0.00 0.00 179.45 178.47 1fiq n LEU 34 N -4.21 0.61 -2.94 5.20 4.77 -0.74 -4.97 117.00 114.71 1fiq n LEU 34 Ca -0.11 -0.08 -0.22 0.00 -0.03 0.00 0.00 56.01 55.57 1fiq n LEU 34 Cb 0.68 -0.21 0.04 0.00 -2.33 0.00 0.00 43.42 41.60 1fiq n LEU 34 CO 0.47 0.15 0.00 0.61 -1.33 0.00 0.00 177.39 177.29 1fiq n GLY 35 N 1.49 -0.49 3.17 -0.72 0.00 -0.76 -4.95 105.19 102.92 1fiq n GLY 35 Ca 0.06 0.11 -0.39 0.00 0.00 0.00 0.00 46.02 45.79 1fiq n GLY 35 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1fiq s LEU 36 N -6.53 5.74 0.00 0.99 1.43 0.19 -4.91 118.68 115.60 1fiq s LEU 36 Ca 0.30 -3.12 0.08 0.00 -1.03 0.00 0.00 54.13 50.35 1fiq s LEU 36 Cb -0.13 -1.97 0.46 0.00 0.03 0.00 0.00 46.19 44.57 1fiq s LEU 36 CO 0.37 -0.35 1.29 0.54 0.23 0.00 0.00 176.35 178.43 1fiq n ARG 37 N 3.20 1.00 -0.28 1.70 3.00 -1.26 -3.86 116.66 120.16 1fiq n ARG 37 Ca 0.14 0.00 -0.01 0.00 -0.01 0.00 0.00 57.85 57.98 1fiq n ARG 37 Cb 0.40 -1.12 0.19 0.00 0.00 0.00 0.00 32.46 31.93 1fiq n ARG 37 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.63 178.41 1fiq h GLY 38 N 5.74 1.20 -4.41 -0.13 0.00 -1.95 -3.40 103.07 100.11 1fiq h GLY 38 Ca 0.00 -0.45 -0.54 0.00 0.00 0.00 0.00 47.33 46.34 1fiq h GLY 38 CO 0.00 0.44 0.34 -1.59 0.00 0.00 0.00 176.54 175.73 1fiq s THR 39 N -5.96 4.82 0.28 4.70 2.01 -1.25 -4.79 115.64 115.46 1fiq s THR 39 Ca -0.12 2.00 0.09 0.00 0.31 0.00 0.00 61.69 63.97 1fiq s THR 39 Cb 0.18 -4.29 -0.04 0.00 0.01 0.00 0.00 72.50 68.35 1fiq s THR 39 CO 0.80 0.20 0.08 -0.54 -0.69 0.00 0.00 174.62 174.47 1fiq s LYS 40 N 0.81 2.48 -0.25 4.92 -0.14 -0.92 -4.90 119.74 121.74 1fiq s LYS 40 Ca 0.50 -1.35 -0.10 0.00 -1.36 0.00 0.00 55.97 53.66 1fiq s LYS 40 Cb -0.21 -2.27 -0.04 0.00 -1.68 0.00 0.00 37.83 33.62 1fiq s LYS 40 CO 0.27 0.32 0.14 -1.17 -0.76 0.00 0.00 175.35 174.15 1fiq s LEU 41 N -3.76 3.89 0.00 3.17 2.96 -1.26 -2.30 118.68 121.38 1fiq s LEU 41 Ca 0.33 -0.02 0.00 0.00 -0.22 0.00 0.00 54.13 54.23 1fiq s LEU 41 Cb -0.06 -2.06 0.00 0.00 0.50 0.00 0.00 46.19 44.57 1fiq s LEU 41 CO 0.22 0.00 0.00 0.61 -1.32 0.00 0.00 176.35 175.86 1fiq n GLY 42 N 4.69 0.53 0.00 7.98 0.00 -1.26 -4.96 105.19 112.16 1fiq n GLY 42 Ca -0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.87 1fiq n GLY 42 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fiq n GLY 44 N -0.14 0.42 0.08 0.00 0.00 -1.26 -4.80 105.19 99.49 1fiq n GLY 44 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.03 1fiq n GLY 44 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1fiq n GLU 45 N -1.87 2.98 -0.71 1.61 0.28 -1.26 -4.84 120.64 116.83 1fiq n GLU 45 Ca 0.00 -1.57 0.00 0.00 -0.16 0.00 0.00 57.16 55.43 1fiq n GLU 45 Cb 0.03 -1.03 0.00 0.00 1.43 0.00 0.00 31.44 31.87 1fiq n GLU 45 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1fiq n GLY 46 N -0.38 0.80 0.01 -1.84 0.00 -1.26 -4.97 105.19 97.54 1fiq n GLY 46 Ca 0.01 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.14 1fiq n GLY 46 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1fiq n GLY 47 N -2.19 -1.06 0.03 -0.02 0.00 -1.26 -4.59 105.19 96.09 1fiq n GLY 47 Ca 0.00 -0.53 0.05 0.00 0.00 0.00 0.00 46.02 45.54 1fiq n GLY 47 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fiq n GLY 49 N 1.60 0.59 0.34 0.00 0.00 -0.92 -0.67 105.19 106.14 1fiq n GLY 49 Ca -0.09 0.00 0.22 0.00 0.00 0.00 0.00 46.02 46.15 1fiq n GLY 49 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fiq h ALA 50 N 0.00 1.06 -0.68 4.61 0.00 -1.86 -0.81 119.26 121.58 1fiq h ALA 50 Ca 0.00 -0.00 -0.27 0.00 0.00 0.00 0.00 54.91 54.64 1fiq h ALA 50 Cb 0.10 0.00 -0.16 0.00 0.00 0.00 0.00 17.79 17.72 1fiq h ALA 50 CO 0.00 -0.02 0.28 0.00 0.00 0.00 0.00 179.25 179.51 1fiq s THR 52 N -3.12 3.65 0.26 0.00 2.01 -0.31 -1.48 115.64 116.64 1fiq s THR 52 Ca 0.52 1.56 -0.04 0.00 0.31 0.00 0.00 61.69 64.04 1fiq s THR 52 Cb 0.43 -3.95 -0.02 0.00 0.01 0.00 0.00 72.50 68.97 1fiq s THR 52 CO 0.09 0.30 0.32 0.68 -0.69 0.00 0.00 174.62 175.32 1fiq s VAL 53 N -1.29 0.00 -0.14 3.82 -7.23 -0.65 -4.64 120.40 110.27 1fiq s VAL 53 Ca 0.47 -1.75 -0.02 0.00 -1.81 0.00 0.00 61.98 58.87 1fiq s VAL 53 Cb -0.28 -2.44 -0.02 0.00 0.56 0.00 0.00 36.38 34.19 1fiq s VAL 53 CO 0.36 0.00 -0.07 -0.32 -0.31 0.00 0.00 175.10 174.76 1fiq s MET 54 N -3.81 3.48 -0.09 4.82 1.75 -0.65 -1.08 119.30 123.72 1fiq s MET 54 Ca 0.33 -0.58 -0.01 0.00 -1.25 0.00 0.00 55.69 54.18 1fiq s MET 54 Cb 0.03 -2.78 -0.03 0.00 2.84 0.00 0.00 34.83 34.89 1fiq s MET 54 CO 0.15 0.28 -0.05 -0.51 -0.65 0.00 0.00 175.02 174.23 1fiq s LEU 55 N 0.23 3.25 -0.05 4.11 1.43 0.49 -0.77 118.68 127.37 1fiq s LEU 55 Ca -0.05 -0.02 0.04 0.00 -1.03 0.00 0.00 54.13 53.08 1fiq s LEU 55 Cb -0.14 -1.73 -0.00 0.00 0.03 0.00 0.00 46.19 44.34 1fiq s LEU 55 CO 0.04 0.32 -0.18 -0.44 0.23 0.00 0.00 176.35 176.32 1fiq s SER 56 N -0.55 2.27 -0.20 2.29 0.01 0.00 -1.90 113.70 115.62 1fiq s SER 56 Ca 0.09 -0.37 -0.10 0.00 1.31 0.00 0.00 55.95 56.87 1fiq s SER 56 Cb -0.12 -0.66 0.07 0.00 0.21 0.00 0.00 66.02 65.52 1fiq s SER 56 CO 0.02 0.16 0.47 -1.59 0.41 0.00 0.00 173.24 172.71 1fiq s LYS 57 N 0.06 0.45 0.42 12.44 -2.85 -1.02 -1.27 119.74 127.96 1fiq s LYS 57 Ca -0.05 0.92 -0.26 0.00 -1.00 0.00 0.00 55.97 55.58 1fiq s LYS 57 Cb -0.12 0.06 -0.10 0.00 -2.06 0.00 0.00 37.83 35.62 1fiq s LYS 57 CO 0.03 -0.17 1.45 0.98 0.10 0.00 0.00 175.35 177.74 1fiq n TYR 58 N 4.41 2.81 -4.10 1.78 9.36 -1.26 -2.90 117.16 127.27 1fiq n TYR 58 Ca -0.21 0.44 -0.33 0.00 3.32 0.00 0.00 57.90 61.13 1fiq n TYR 58 Cb 0.55 -2.49 -0.16 0.00 -0.63 0.00 0.00 39.34 36.62 1fiq n TYR 58 CO 0.00 0.00 0.00 0.34 0.22 0.00 0.00 176.86 177.42 1fiq s ASP 59 N -0.33 3.52 -1.04 2.98 2.15 -1.23 -4.94 116.67 117.78 1fiq s ASP 59 Ca 0.58 -0.84 -0.22 0.00 0.43 0.00 0.00 52.55 52.50 1fiq s ASP 59 Cb -0.46 -1.51 -0.11 0.00 -0.30 0.00 0.00 42.92 40.54 1fiq s ASP 59 CO 0.60 -0.05 1.92 0.54 -0.17 0.00 0.00 175.17 178.01 1fiq n ARG 60 N 4.58 1.61 0.00 4.34 5.12 -1.26 -2.66 116.66 128.39 1fiq n ARG 60 Ca -0.19 -2.27 0.00 0.00 -1.93 0.00 0.00 57.85 53.46 1fiq n ARG 60 Cb 0.48 -3.43 0.00 0.00 -1.16 0.00 0.00 32.46 28.35 1fiq n ARG 60 CO 0.00 0.00 0.00 -0.11 -1.93 0.00 0.00 177.63 175.59 1fiq n LEU 61 N 11.71 0.00 0.00 0.55 7.94 -1.26 -4.90 117.00 131.03 1fiq n LEU 61 Ca 0.47 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 55.37 1fiq n LEU 61 Cb 0.44 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.39 1fiq n LEU 61 CO 0.81 0.00 0.11 0.00 -1.11 0.00 0.00 177.39 177.21 1fiq n GLN 62 N 0.00 0.00 0.00 1.96 1.13 -1.25 -4.80 117.38 114.42 1fiq n GLN 62 Ca 0.00 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.06 1fiq n GLN 62 Cb 0.00 -1.26 0.00 0.00 0.11 0.00 0.00 30.24 29.09 1fiq n GLN 62 CO 0.00 0.00 0.00 -3.47 -1.44 0.00 0.00 177.06 172.15 1fiq n ASP 63 N -0.70 0.00 -2.03 1.08 -0.08 -1.09 -4.88 116.55 108.86 1fiq n ASP 63 Ca 0.00 0.00 -0.19 0.00 -1.51 0.00 0.00 54.79 53.09 1fiq n ASP 63 Cb 0.00 0.00 0.01 0.00 2.34 0.00 0.00 41.12 43.47 1fiq n ASP 63 CO 0.00 0.00 0.00 0.29 0.12 0.00 0.00 177.20 177.61 1fiq n LYS 64 N 0.00 0.00 -3.03 -0.67 5.02 -1.26 -3.66 118.16 114.56 1fiq n LYS 64 Ca 0.00 0.00 -0.41 0.00 -2.02 0.00 0.00 58.31 55.88 1fiq n LYS 64 Cb 0.00 -0.48 -0.05 0.00 -0.02 0.00 0.00 35.03 34.47 1fiq n LYS 64 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1fiq s ILE 65 N -0.96 4.95 0.45 -0.18 1.01 -1.26 -3.57 121.20 121.62 1fiq s ILE 65 Ca 0.26 1.31 -0.07 0.00 0.00 0.00 0.00 60.65 62.15 1fiq s ILE 65 Cb -0.21 -4.00 -0.05 0.00 0.01 0.00 0.00 42.46 38.21 1fiq s ILE 65 CO 0.33 0.02 0.77 0.27 0.00 0.00 0.00 174.94 176.34 1fiq s ILE 66 N 2.40 4.87 -0.07 2.92 -4.36 -1.14 -4.87 121.20 120.95 1fiq s ILE 66 Ca 0.30 0.35 0.02 0.00 -0.26 0.00 0.00 60.65 61.07 1fiq s ILE 66 Cb -0.16 -3.81 0.01 0.00 1.25 0.00 0.00 42.46 39.75 1fiq s ILE 66 CO 0.09 -0.72 -0.12 -1.00 0.24 0.00 0.00 174.94 173.43 1fiq s HIS 67 N -2.59 1.44 0.07 1.37 3.76 -1.26 -2.44 115.29 115.64 1fiq s HIS 67 Ca 0.49 -0.54 -0.09 0.00 -0.15 0.00 0.00 55.06 54.77 1fiq s HIS 67 Cb -0.10 -1.07 0.00 0.00 1.11 0.00 0.00 32.58 32.52 1fiq s HIS 67 CO 0.40 -0.29 0.19 -0.59 -0.85 0.00 0.00 174.74 173.60 1fiq s PHE 68 N 0.72 0.11 0.43 1.40 -0.12 -0.80 -4.88 117.98 114.85 1fiq s PHE 68 Ca -0.13 -0.46 -0.01 0.00 -0.05 0.00 0.00 56.93 56.27 1fiq s PHE 68 Cb -0.16 -0.04 -0.02 0.00 -0.63 0.00 0.00 43.02 42.17 1fiq s PHE 68 CO 0.03 -0.50 0.67 -1.54 -0.05 0.00 0.00 175.22 173.83 1fiq s SER 69 N -2.57 6.06 0.05 1.98 1.04 -1.26 -0.38 113.70 118.62 1fiq s SER 69 Ca 0.01 0.51 -0.27 0.00 0.48 0.00 0.00 55.95 56.68 1fiq s SER 69 Cb 0.03 -1.86 0.07 0.00 0.10 0.00 0.00 66.02 64.36 1fiq s SER 69 CO -0.08 -0.57 0.65 0.00 0.98 0.00 0.00 173.24 174.22 1fiq s ALA 70 N -2.55 -1.69 -0.49 5.32 0.00 -0.24 -4.84 121.76 117.27 1fiq s ALA 70 Ca 0.46 0.91 -0.24 0.00 0.00 0.00 0.00 51.96 53.09 1fiq s ALA 70 Cb -0.10 0.44 0.03 0.00 0.00 0.00 0.00 23.12 23.49 1fiq s ALA 70 CO 0.39 -0.57 0.85 -0.80 0.00 0.00 0.00 175.76 175.63 1fiq s ASN 71 N -1.99 6.39 0.46 0.00 0.01 -1.26 -1.64 114.94 116.90 1fiq s ASN 71 Ca -0.05 -0.21 0.31 0.00 -0.71 0.00 0.00 52.86 52.20 1fiq s ASN 71 Cb -0.01 -2.41 1.50 0.00 0.41 0.00 0.00 41.25 40.75 1fiq s ASN 71 CO -0.02 -1.04 1.94 0.00 -1.51 0.00 0.00 177.10 176.47 1fiq h ALA 72 N 9.11 1.00 0.00 0.60 0.00 -1.62 -2.21 119.26 126.14 1fiq h ALA 72 Ca -0.25 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.66 1fiq h ALA 72 Cb 1.08 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.87 1fiq h ALA 72 CO 1.01 0.00 0.00 0.00 0.00 0.00 0.00 179.25 180.26 1fiq n LEU 74 N -2.17 1.20 -4.52 0.00 4.77 -0.85 -4.90 117.00 110.53 1fiq n LEU 74 Ca 0.03 -1.20 -0.42 0.00 -0.03 0.00 0.00 56.01 54.39 1fiq n LEU 74 Cb 0.25 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.27 1fiq n LEU 74 CO 0.21 0.30 0.22 0.00 -1.33 0.00 0.00 177.39 176.79 1fiq s ALA 75 N -0.36 3.42 0.18 -1.18 0.00 -1.09 -4.98 121.76 117.75 1fiq s ALA 75 Ca 0.00 -1.25 -0.30 0.00 0.00 0.00 0.00 51.96 50.41 1fiq s ALA 75 Cb 0.00 -3.10 -0.08 0.00 0.00 0.00 0.00 23.12 19.93 1fiq s ALA 75 CO 0.00 -1.50 1.27 -2.14 0.00 0.00 0.00 175.76 173.38 1fiq s PRO 76 N 2.42 4.42 0.52 0.00 0.02 -1.26 0.10 135.00 141.23 1fiq s PRO 76 Ca 0.17 1.98 0.24 0.00 0.02 0.00 0.00 61.00 63.41 1fiq s PRO 76 Cb -0.16 -3.22 1.43 0.00 0.02 0.00 0.00 34.50 32.58 1fiq s PRO 76 CO 0.15 -0.20 2.12 -0.84 -0.33 0.00 0.00 177.00 177.90 1fiq h ILE 77 N 3.81 0.74 0.00 2.83 3.07 -1.59 -2.08 117.51 124.29 1fiq h ILE 77 Ca -0.44 -0.34 0.00 0.00 1.55 0.00 0.00 64.86 65.63 1fiq h ILE 77 Cb 1.21 1.20 0.00 0.00 -0.27 0.00 0.00 36.82 38.97 1fiq h ILE 77 CO 0.77 0.09 0.00 0.00 -1.05 0.00 0.00 178.15 177.95 1fiq n THR 79 N -2.27 0.49 -0.51 0.00 -2.24 -0.78 -4.28 114.28 104.69 1fiq n THR 79 Ca 0.01 -0.63 0.07 0.00 -2.27 0.00 0.00 64.05 61.22 1fiq n THR 79 Cb 0.15 0.64 0.22 0.00 -2.10 0.00 0.00 70.33 69.24 1fiq n THR 79 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1fiq n LEU 80 N 1.07 3.52 -4.68 3.22 4.77 -0.27 -4.93 117.00 119.69 1fiq n LEU 80 Ca 0.18 -2.39 -0.45 0.00 -0.03 0.00 0.00 56.01 53.32 1fiq n LEU 80 Cb 0.49 -0.39 -0.04 0.00 -2.33 0.00 0.00 43.42 41.16 1fiq n LEU 80 CO 0.14 0.73 1.39 1.57 -1.33 0.00 0.00 177.39 179.89 1fiq n HIS 81 N 0.29 2.43 -1.12 -1.77 -0.00 -1.26 -0.49 115.22 113.31 1fiq n HIS 81 Ca 0.17 0.03 -0.04 0.00 0.46 0.00 0.00 57.72 58.33 1fiq n HIS 81 Cb 0.65 -2.65 -0.02 0.00 -0.12 0.00 0.00 29.99 27.85 1fiq n HIS 81 CO 0.00 0.00 0.00 0.72 0.46 0.00 0.00 176.34 177.52 1fiq n HIS 82 N 5.18 0.00 -3.95 1.57 8.25 0.14 -4.99 115.22 121.42 1fiq n HIS 82 Ca 0.19 0.00 -0.36 0.00 -0.26 0.00 0.00 57.72 57.29 1fiq n HIS 82 Cb 0.32 -1.39 -0.07 0.00 1.12 0.00 0.00 29.99 29.97 1fiq n HIS 82 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1fiq s VAL 83 N -1.86 5.25 -0.11 1.59 1.01 0.36 -4.78 120.40 121.86 1fiq s VAL 83 Ca 0.00 0.12 -0.14 0.00 0.00 0.00 0.00 61.98 61.96 1fiq s VAL 83 Cb 0.00 -3.29 -0.05 0.00 0.00 0.00 0.00 36.38 33.04 1fiq s VAL 83 CO 0.00 0.58 0.33 0.00 0.00 0.00 0.00 175.10 176.02 1fiq s ALA 84 N -0.74 3.63 -0.05 5.51 0.00 -0.40 -2.05 121.76 127.66 1fiq s ALA 84 Ca 0.13 -0.38 -0.01 0.00 0.00 0.00 0.00 51.96 51.71 1fiq s ALA 84 Cb -0.12 -2.39 -0.03 0.00 0.00 0.00 0.00 23.12 20.58 1fiq s ALA 84 CO 0.03 0.22 0.01 0.08 0.00 0.00 0.00 175.76 176.10 1fiq s VAL 85 N -0.02 4.29 -0.14 0.00 1.01 0.20 -0.82 120.40 124.93 1fiq s VAL 85 Ca 0.19 -0.38 -0.01 0.00 0.00 0.00 0.00 61.98 61.78 1fiq s VAL 85 Cb -0.14 -2.86 0.03 0.00 0.00 0.00 0.00 36.38 33.42 1fiq s VAL 85 CO 0.07 0.50 -0.05 -0.89 0.00 0.00 0.00 175.10 174.74 1fiq s THR 86 N -0.98 0.93 0.47 3.92 2.01 0.05 -0.03 115.64 122.01 1fiq s THR 86 Ca 0.16 -0.39 0.08 0.00 0.31 0.00 0.00 61.69 61.85 1fiq s THR 86 Cb -0.11 -1.07 0.02 0.00 0.01 0.00 0.00 72.50 71.35 1fiq s THR 86 CO 0.06 0.21 0.54 0.42 -0.69 0.00 0.00 174.62 175.16 1fiq s THR 87 N 1.73 2.55 0.26 -0.82 -4.23 -1.26 -1.64 115.64 112.22 1fiq s THR 87 Ca 0.03 -1.16 -0.02 0.00 -1.18 0.00 0.00 61.69 59.35 1fiq s THR 87 Cb -0.14 -2.71 0.24 0.00 1.34 0.00 0.00 72.50 71.24 1fiq s THR 87 CO -0.08 0.00 1.83 1.62 -0.54 0.00 0.00 174.62 177.45 1fiq h VAL 88 N 0.66 0.94 0.00 2.29 3.04 -1.88 0.22 116.25 121.53 1fiq h VAL 88 Ca -0.38 -0.31 0.00 0.00 -1.01 0.00 0.00 66.70 65.00 1fiq h VAL 88 Cb 1.28 -0.05 0.00 0.00 -2.01 0.00 0.00 31.29 30.51 1fiq h VAL 88 CO 0.49 0.17 0.00 -1.84 -1.01 0.00 0.00 177.57 175.38 1fiq n GLU 89 N -4.67 0.05 0.00 4.17 0.00 -1.26 -2.36 120.64 116.57 1fiq n GLU 89 Ca 0.15 0.24 0.13 0.00 0.00 0.00 0.00 57.16 57.69 1fiq n GLU 89 Cb 0.28 -1.50 0.44 0.00 0.00 0.00 0.00 31.44 30.67 1fiq n GLU 89 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1fiq n GLY 90 N -0.13 -0.71 0.15 -1.84 0.00 0.77 -4.13 105.19 99.29 1fiq n GLY 90 Ca 0.04 -0.36 0.02 0.00 0.00 0.00 0.00 46.02 45.72 1fiq n GLY 90 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1fiq n ILE 91 N -0.75 0.00 0.00 -0.61 -5.35 -1.00 -4.93 119.36 106.73 1fiq n ILE 91 Ca 0.13 -0.50 0.00 0.00 -0.27 0.00 0.00 62.75 62.11 1fiq n ILE 91 Cb 0.33 1.08 0.00 0.00 -1.74 0.00 0.00 39.64 39.30 1fiq n ILE 91 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1fiq n GLY 92 N 0.25 3.05 3.79 3.28 0.00 -1.25 -3.64 105.19 110.67 1fiq n GLY 92 Ca 0.02 -1.09 -0.09 0.00 0.00 0.00 0.00 46.02 44.86 1fiq n GLY 92 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1fiq s SER 93 N 0.00 0.04 0.00 1.61 1.04 -0.70 -4.62 113.70 111.08 1fiq s SER 93 Ca 0.00 -1.14 0.24 0.00 0.48 0.00 0.00 55.95 55.53 1fiq s SER 93 Cb 0.00 0.84 0.34 0.00 0.10 0.00 0.00 66.02 67.29 1fiq s SER 93 CO 0.00 -1.65 1.30 0.35 0.98 0.00 0.00 173.24 174.22 1fiq n THR 94 N -0.53 0.00 0.98 2.02 -2.24 -1.26 -2.18 114.28 111.07 1fiq n THR 94 Ca -0.08 -0.01 0.13 0.00 -2.27 0.00 0.00 64.05 61.82 1fiq n THR 94 Cb 0.60 0.45 0.35 0.00 -2.10 0.00 0.00 70.33 69.63 1fiq n THR 94 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1fiq n LYS 95 N -1.43 0.02 0.00 -0.78 5.02 -1.26 -4.80 118.16 114.93 1fiq n LYS 95 Ca 0.06 0.01 0.00 0.00 -2.02 0.00 0.00 58.31 56.35 1fiq n LYS 95 Cb 0.34 -1.51 0.00 0.00 -0.02 0.00 0.00 35.03 33.83 1fiq n LYS 95 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1fiq n THR 96 N -1.54 0.00 -3.79 -0.18 -2.24 -1.23 -5.15 114.28 100.14 1fiq n THR 96 Ca 0.06 0.00 -0.13 0.00 -2.27 0.00 0.00 64.05 61.71 1fiq n THR 96 Cb 0.34 0.00 -0.14 0.00 -2.10 0.00 0.00 70.33 68.44 1fiq n THR 96 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1fiq s ARG 97 N 1.15 0.11 0.33 -0.78 0.52 -0.93 -4.90 118.95 114.45 1fiq s ARG 97 Ca 0.00 0.25 -0.27 0.00 -0.52 0.00 0.00 55.73 55.19 1fiq s ARG 97 Cb 0.00 -0.05 -0.09 0.00 0.52 0.00 0.00 34.95 35.32 1fiq s ARG 97 CO 0.00 -0.09 1.04 -0.51 0.02 0.00 0.00 175.30 175.76 1fiq s LEU 98 N 0.57 4.36 0.55 2.53 1.43 -1.04 -1.72 118.68 125.36 1fiq s LEU 98 Ca -0.04 2.08 -0.19 0.00 -1.03 0.00 0.00 54.13 54.94 1fiq s LEU 98 Cb -0.06 -3.92 -0.06 0.00 0.03 0.00 0.00 46.19 42.19 1fiq s LEU 98 CO -0.03 -0.25 1.11 -2.28 0.23 0.00 0.00 176.35 175.14 1fiq s HIS 99 N -1.44 2.72 0.40 0.29 5.65 -1.24 -4.75 115.29 116.92 1fiq s HIS 99 Ca 0.50 1.55 0.19 0.00 0.25 0.00 0.00 55.06 57.55 1fiq s HIS 99 Cb -0.25 -3.24 1.11 0.00 -1.18 0.00 0.00 32.58 29.02 1fiq s HIS 99 CO 0.32 -1.47 1.79 -1.35 -0.65 0.00 0.00 174.74 173.38 1fiq h PRO 100 N 1.11 0.38 -0.74 2.88 0.11 -1.95 0.46 132.00 134.25 1fiq h PRO 100 Ca -0.50 -0.02 -0.05 0.00 0.11 0.00 0.00 66.00 65.54 1fiq h PRO 100 Cb 1.25 -0.09 -0.03 0.00 0.11 0.00 0.00 31.00 32.25 1fiq h PRO 100 CO 0.57 0.25 0.26 0.28 -0.21 0.00 0.00 178.00 179.15 1fiq h VAL 101 N 0.39 1.26 -0.13 3.15 2.07 -1.97 0.15 116.25 121.17 1fiq h VAL 101 Ca 0.57 -0.85 -0.22 0.00 0.82 0.00 0.00 66.70 67.01 1fiq h VAL 101 Cb 1.46 0.41 0.01 0.00 -1.52 0.00 0.00 31.29 31.65 1fiq h VAL 101 CO -0.27 0.34 -0.80 1.56 0.02 0.00 0.00 177.57 178.42 1fiq h GLN 102 N 1.09 0.75 -0.46 1.57 4.20 -1.31 -2.55 115.11 118.40 1fiq h GLN 102 Ca 0.24 -0.63 -0.12 0.00 0.06 0.00 0.00 58.65 58.21 1fiq h GLN 102 Cb 0.26 0.14 -0.02 0.00 0.30 0.00 0.00 27.48 28.16 1fiq h GLN 102 CO -0.01 1.24 -0.17 1.49 -0.67 0.00 0.00 178.83 180.70 1fiq h GLU 103 N 0.50 0.90 0.34 1.46 4.81 -1.03 -2.59 114.58 118.97 1fiq h GLU 103 Ca -0.06 -0.35 -0.02 0.00 -0.13 0.00 0.00 59.36 58.81 1fiq h GLU 103 Cb 1.43 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 30.76 1fiq h GLU 103 CO 0.16 1.00 -0.16 -0.09 -0.73 0.00 0.00 179.01 179.19 1fiq h ARG 104 N 0.79 -0.44 0.00 1.92 9.65 -0.67 -1.81 114.38 123.82 1fiq h ARG 104 Ca 0.12 0.03 -0.03 0.00 -1.10 0.00 0.00 59.98 58.99 1fiq h ARG 104 Cb 0.71 0.10 -0.00 0.00 -1.39 0.00 0.00 29.97 29.38 1fiq h ARG 104 CO 0.05 -0.17 -0.16 0.97 2.80 0.00 0.00 179.97 183.47 1fiq h ILE 105 N -0.67 1.07 -0.01 1.20 2.10 -1.52 -1.00 117.51 118.68 1fiq h ILE 105 Ca -0.05 -0.55 -0.01 0.00 1.08 0.00 0.00 64.86 65.34 1fiq h ILE 105 Cb 0.47 1.30 -0.00 0.00 -1.09 0.00 0.00 36.82 37.50 1fiq h ILE 105 CO 0.08 0.15 -0.01 0.00 -1.08 0.00 0.00 178.15 177.29 1fiq h ALA 106 N 1.84 0.02 0.00 0.18 0.00 -1.34 -1.94 119.26 118.02 1fiq h ALA 106 Ca -0.00 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.68 1fiq h ALA 106 Cb 0.29 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.07 1fiq h ALA 106 CO 0.02 -0.24 0.00 0.87 0.00 0.00 0.00 179.25 179.90 1fiq h LYS 107 N -0.41 0.00 -0.32 0.00 1.57 -1.00 -3.03 116.57 113.38 1fiq h LYS 107 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1fiq h LYS 107 Cb 0.47 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.78 1fiq h LYS 107 CO 0.00 0.00 0.00 0.43 -0.57 0.00 0.00 179.45 179.31 1fiq n SER 108 N -2.52 2.24 -1.65 0.86 7.64 -0.41 -4.92 113.62 114.85 1fiq n SER 108 Ca 0.03 -1.88 -0.15 0.00 1.01 0.00 0.00 58.87 57.88 1fiq n SER 108 Cb 0.35 -0.21 -0.01 0.00 -1.01 0.00 0.00 64.21 63.32 1fiq n SER 108 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 1fiq n HIS 109 N 0.70 -0.65 1.29 1.43 8.25 -1.14 -4.70 115.22 120.40 1fiq n HIS 109 Ca 0.16 0.00 0.09 0.00 -0.26 0.00 0.00 57.72 57.71 1fiq n HIS 109 Cb 0.39 -3.09 0.35 0.00 1.12 0.00 0.00 29.99 28.76 1fiq n HIS 109 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1fiq n GLY 110 N -1.03 0.14 2.97 -1.41 0.00 -0.73 -4.76 105.19 100.38 1fiq n GLY 110 Ca -0.18 -0.36 -0.27 0.00 0.00 0.00 0.00 46.02 45.21 1fiq n GLY 110 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1fiq s SER 111 N -1.46 2.26 0.00 1.61 0.15 -1.25 -4.73 113.70 110.28 1fiq s SER 111 Ca 0.29 -0.36 0.00 0.00 0.70 0.00 0.00 55.95 56.58 1fiq s SER 111 Cb 0.15 -0.95 0.00 0.00 -1.71 0.00 0.00 66.02 63.52 1fiq s SER 111 CO 0.23 -0.06 0.00 0.00 1.20 0.00 0.00 173.24 174.61 1fiq n GLN 112 N 4.60 0.00 0.25 5.44 6.02 -1.26 -4.76 117.38 127.68 1fiq n GLN 112 Ca -0.16 0.00 0.11 0.00 -0.01 0.00 0.00 57.00 56.94 1fiq n GLN 112 Cb 0.50 0.00 0.68 0.00 1.02 0.00 0.00 30.24 32.45 1fiq n GLN 112 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1fiq n GLY 114 N -0.68 0.51 0.14 0.00 0.00 -1.26 -4.92 105.19 98.97 1fiq n GLY 114 Ca -0.02 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 45.99 1fiq n GLY 114 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1fiq h PHE 115 N 0.00 0.00 0.00 1.61 3.57 -2.00 -3.10 116.94 117.02 1fiq h PHE 115 Ca 0.00 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 1fiq h PHE 115 Cb 0.14 0.00 0.00 0.00 2.79 0.00 0.00 35.95 38.88 1fiq h PHE 115 CO 0.09 0.62 -0.48 0.00 -2.23 0.00 0.00 178.31 176.31 1fiq h THR 117 N 0.00 0.53 -0.74 0.00 2.02 -1.91 -2.74 112.91 110.08 1fiq h THR 117 Ca 0.00 0.00 0.16 0.00 0.77 0.00 0.00 66.41 67.34 1fiq h THR 117 Cb 0.54 0.53 -0.11 0.00 -1.74 0.00 0.00 68.15 67.37 1fiq h THR 117 CO 0.00 0.00 0.18 -0.65 0.37 0.00 0.00 175.52 175.42 1fiq h PRO 118 N -0.42 0.26 -0.59 6.66 0.11 -1.78 0.13 132.00 136.38 1fiq h PRO 118 Ca 0.02 -0.02 -0.06 0.00 0.11 0.00 0.00 66.00 66.05 1fiq h PRO 118 Cb 0.42 -0.06 -0.02 0.00 0.11 0.00 0.00 31.00 31.45 1fiq h PRO 118 CO -0.09 0.18 0.12 0.78 -0.21 0.00 0.00 178.00 178.77 1fiq h GLY 119 N 0.27 1.04 1.16 -0.55 0.00 -1.72 0.25 103.07 103.52 1fiq h GLY 119 Ca 0.41 -0.68 -0.13 0.00 0.00 0.00 0.00 47.33 46.94 1fiq h GLY 119 CO -0.51 0.63 -0.21 -2.22 0.00 0.00 0.00 176.54 174.23 1fiq h ILE 120 N 0.87 1.27 -0.58 2.60 2.04 -1.05 0.54 117.51 123.20 1fiq h ILE 120 Ca 0.18 -1.37 0.00 0.00 1.00 0.00 0.00 64.86 64.67 1fiq h ILE 120 Cb 0.39 1.13 -0.03 0.00 -0.74 0.00 0.00 36.82 37.57 1fiq h ILE 120 CO 0.01 0.47 0.37 0.58 0.00 0.00 0.00 178.15 179.58 1fiq h VAL 121 N 0.83 1.16 -0.33 1.67 2.07 -0.49 -0.99 116.25 120.16 1fiq h VAL 121 Ca 0.11 -0.30 -0.11 0.00 0.82 0.00 0.00 66.70 67.22 1fiq h VAL 121 Cb 0.78 0.33 -0.01 0.00 -1.52 0.00 0.00 31.29 30.86 1fiq h VAL 121 CO 0.06 0.15 -0.24 0.24 0.02 0.00 0.00 177.57 177.80 1fiq h MET 122 N 0.78 0.65 -0.53 1.57 2.86 -0.53 0.22 114.93 119.95 1fiq h MET 122 Ca 0.21 -0.26 -0.01 0.00 -2.06 0.00 0.00 59.70 57.58 1fiq h MET 122 Cb -0.07 -0.03 -0.02 0.00 0.06 0.00 0.00 31.60 31.54 1fiq h MET 122 CO -0.04 0.83 0.27 0.77 1.06 0.00 0.00 176.91 179.80 1fiq h SER 123 N 0.57 0.68 -0.09 1.22 0.02 -0.41 -0.90 113.55 114.64 1fiq h SER 123 Ca 0.08 -0.11 -0.02 0.00 -0.84 0.00 0.00 61.79 60.90 1fiq h SER 123 Cb 0.72 -0.17 -0.00 0.00 0.14 0.00 0.00 62.40 63.08 1fiq h SER 123 CO 0.06 0.59 -0.02 -0.03 -1.14 0.00 0.00 176.83 176.29 1fiq h MET 124 N 0.71 0.17 -0.78 3.45 -1.53 -0.96 -2.07 114.93 113.92 1fiq h MET 124 Ca 0.18 -0.06 0.15 0.00 -3.44 0.00 0.00 59.70 56.53 1fiq h MET 124 Cb 0.08 -0.01 -0.10 0.00 -0.55 0.00 0.00 31.60 31.02 1fiq h MET 124 CO -0.03 0.48 0.32 -0.92 0.14 0.00 0.00 176.91 176.90 1fiq h TYR 125 N -0.15 0.55 -0.14 1.39 3.20 -0.38 -0.35 116.97 121.09 1fiq h TYR 125 Ca 0.02 0.04 -0.00 0.00 3.14 0.00 0.00 58.73 61.93 1fiq h TYR 125 Cb 0.41 -0.13 -0.01 0.00 1.54 0.00 0.00 36.73 38.55 1fiq h TYR 125 CO 0.05 0.07 0.09 1.15 -1.64 0.00 0.00 178.16 177.87 1fiq h THR 126 N 0.46 1.07 -0.10 1.81 2.02 -1.00 -1.88 112.91 115.28 1fiq h THR 126 Ca 0.43 -0.17 0.04 0.00 0.77 0.00 0.00 66.41 67.49 1fiq h THR 126 Cb 0.67 0.92 -0.05 0.00 -1.74 0.00 0.00 68.15 67.95 1fiq h THR 126 CO -0.41 0.06 -0.23 0.25 0.37 0.00 0.00 175.52 175.56 1fiq h LEU 127 N 0.16 -0.70 -2.32 2.58 5.85 -0.39 -0.28 115.31 120.20 1fiq h LEU 127 Ca 0.05 0.11 0.00 0.00 0.84 0.00 0.00 57.88 58.89 1fiq h LEU 127 Cb 0.03 0.31 -0.00 0.00 0.37 0.00 0.00 40.66 41.36 1fiq h LEU 127 CO -0.01 -0.28 0.02 -0.07 -0.34 0.00 0.00 178.44 177.76 1fiq h LEU 128 N -0.30 0.00 -0.53 2.25 3.38 -1.12 0.40 115.31 119.38 1fiq h LEU 128 Ca 0.09 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.90 1fiq h LEU 128 Cb 0.44 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.18 1fiq h LEU 128 CO -0.28 0.00 -0.69 -0.09 0.09 0.00 0.00 178.44 177.47 1fiq h ARG 129 N 0.00 0.24 0.00 1.13 9.65 -0.23 -2.95 114.38 122.22 1fiq h ARG 129 Ca 0.01 -0.19 0.00 0.00 -1.10 0.00 0.00 59.98 58.69 1fiq h ARG 129 Cb 0.04 0.04 0.00 0.00 -1.39 0.00 0.00 29.97 28.66 1fiq h ARG 129 CO -0.00 0.84 -1.14 0.09 2.80 0.00 0.00 179.97 182.55 1fiq n ASN 130 N -3.81 0.70 -3.22 -3.80 3.02 -0.30 -4.79 115.26 103.05 1fiq n ASN 130 Ca -0.03 0.23 -0.02 0.00 -0.03 0.00 0.00 54.58 54.73 1fiq n ASN 130 Cb 0.67 0.70 -0.03 0.00 -0.61 0.00 0.00 39.78 40.52 1fiq n ASN 130 CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 1fiq s GLN 131 N -3.37 0.56 0.26 3.52 2.00 0.13 -5.05 119.66 117.70 1fiq s GLN 131 Ca -0.01 0.18 -0.04 0.00 -2.00 0.00 0.00 55.36 53.49 1fiq s GLN 131 Cb 0.11 -0.02 0.51 0.00 0.80 0.00 0.00 33.01 34.40 1fiq s GLN 131 CO 0.81 -1.08 1.65 -1.35 -0.50 0.00 0.00 175.29 174.81 1fiq h PRO 132 N 7.82 0.15 -3.12 1.67 0.11 -1.76 -3.30 132.00 133.57 1fiq h PRO 132 Ca -0.02 -0.01 -0.62 0.00 0.11 0.00 0.00 66.00 65.46 1fiq h PRO 132 Cb 1.16 -0.03 -0.41 0.00 0.11 0.00 0.00 31.00 31.83 1fiq h PRO 132 CO 0.18 0.10 -0.69 -1.21 -0.21 0.00 0.00 178.00 176.18 1fiq s GLU 133 N -6.06 1.66 0.74 1.05 2.02 -1.26 -4.91 118.70 111.95 1fiq s GLU 133 Ca -0.13 -2.39 -0.08 0.00 0.02 0.00 0.00 54.97 52.39 1fiq s GLU 133 Cb 0.23 -2.79 0.08 0.00 0.10 0.00 0.00 34.13 31.75 1fiq s GLU 133 CO 0.76 -1.17 1.07 -1.25 0.02 0.00 0.00 175.26 174.69 1fiq s PRO 134 N -0.10 2.03 0.41 0.39 0.04 -1.24 -4.73 135.00 131.79 1fiq s PRO 134 Ca 0.19 -0.21 -0.05 0.00 0.04 0.00 0.00 61.00 60.97 1fiq s PRO 134 Cb -0.22 -2.11 -0.04 0.00 0.04 0.00 0.00 34.50 32.18 1fiq s PRO 134 CO -0.03 -1.40 0.69 0.95 0.04 0.00 0.00 177.00 177.26 1fiq s THR 135 N -3.36 4.95 0.45 1.26 -4.23 -1.26 -2.93 115.64 110.52 1fiq s THR 135 Ca 0.62 0.12 0.15 0.00 -1.18 0.00 0.00 61.69 61.40 1fiq s THR 135 Cb -0.10 -3.82 0.33 0.00 1.34 0.00 0.00 72.50 70.25 1fiq s THR 135 CO 0.46 -0.64 1.99 0.58 -0.54 0.00 0.00 174.62 176.47 1fiq h VAL 136 N 0.68 0.89 -0.23 2.29 2.07 -1.97 0.94 116.25 120.93 1fiq h VAL 136 Ca -0.48 -0.12 -0.02 0.00 0.82 0.00 0.00 66.70 66.90 1fiq h VAL 136 Cb 1.20 0.52 -0.01 0.00 -1.52 0.00 0.00 31.29 31.48 1fiq h VAL 136 CO 0.63 0.06 0.05 -0.33 0.02 0.00 0.00 177.57 178.00 1fiq h GLU 137 N 0.34 0.36 -0.50 1.57 3.07 -1.99 -0.97 114.58 116.46 1fiq h GLU 137 Ca 0.26 -0.09 -0.02 0.00 -0.50 0.00 0.00 59.36 59.00 1fiq h GLU 137 Cb 0.56 -0.05 -0.02 0.00 -0.84 0.00 0.00 28.75 28.40 1fiq h GLU 137 CO -0.06 0.48 0.22 0.93 -1.40 0.00 0.00 179.01 179.18 1fiq h GLU 138 N 0.18 0.73 -0.24 2.33 5.08 -1.43 -0.66 114.58 120.57 1fiq h GLU 138 Ca 0.07 -0.12 0.04 0.00 -1.00 0.00 0.00 59.36 58.35 1fiq h GLU 138 Cb 0.28 -0.13 -0.04 0.00 0.50 0.00 0.00 28.75 29.37 1fiq h GLU 138 CO 0.00 0.62 0.00 0.82 -1.00 0.00 0.00 179.01 179.46 1fiq h ILE 139 N 0.66 0.83 -0.40 3.13 2.04 -0.75 -0.94 117.51 122.08 1fiq h ILE 139 Ca 0.17 -0.03 -0.05 0.00 1.00 0.00 0.00 64.86 65.96 1fiq h ILE 139 Cb 0.15 0.74 -0.02 0.00 -0.74 0.00 0.00 36.82 36.95 1fiq h ILE 139 CO -0.02 0.01 0.06 -0.08 0.00 0.00 0.00 178.15 178.12 1fiq h GLU 140 N 0.08 0.61 0.00 2.37 4.81 -0.85 -2.06 114.58 119.53 1fiq h GLU 140 Ca 0.12 -0.12 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1fiq h GLU 140 Cb 0.15 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.43 1fiq h GLU 140 CO -0.19 0.59 0.00 -0.44 -0.73 0.00 0.00 179.01 178.24 1fiq h ASP 141 N 0.59 0.00 0.33 1.04 3.32 -0.30 -2.78 116.42 118.62 1fiq h ASP 141 Ca 0.13 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.17 1fiq h ASP 141 Cb 0.29 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.84 1fiq h ASP 141 CO 0.00 0.00 -0.04 0.00 -1.72 0.00 0.00 179.24 177.49 1fiq h ALA 142 N 2.04 1.14 -0.49 3.45 0.00 -0.45 -2.87 119.26 122.09 1fiq h ALA 142 Ca 0.00 -0.03 -0.22 0.00 0.00 0.00 0.00 54.91 54.66 1fiq h ALA 142 Cb 0.56 -0.01 -0.13 0.00 0.00 0.00 0.00 17.79 18.21 1fiq h ALA 142 CO 0.00 0.05 0.10 1.19 0.00 0.00 0.00 179.25 180.59 1fiq n PHE 143 N -3.33 1.55 -0.12 0.00 3.01 -1.05 -4.62 117.46 112.90 1fiq n PHE 143 Ca -0.02 -1.49 -0.05 0.00 1.01 0.00 0.00 57.45 56.90 1fiq n PHE 143 Cb 0.17 -0.56 0.03 0.00 -0.01 0.00 0.00 39.48 39.11 1fiq n PHE 143 CO 0.00 0.00 0.00 1.96 1.01 0.00 0.00 176.76 179.73 1fiq h GLN 144 N 1.29 0.32 -1.01 -1.08 4.20 -1.66 -2.62 115.11 114.55 1fiq h GLN 144 Ca 0.26 -0.02 -0.42 0.00 0.06 0.00 0.00 58.65 58.53 1fiq h GLN 144 Cb 1.91 -0.07 -0.25 0.00 0.30 0.00 0.00 27.48 29.37 1fiq h GLN 144 CO 0.53 0.21 0.54 0.41 -0.67 0.00 0.00 178.83 179.85 1fiq n GLY 145 N -1.23 4.06 3.08 3.46 0.00 -1.26 -4.88 105.19 108.42 1fiq n GLY 145 Ca 0.02 -0.92 -0.29 0.00 0.00 0.00 0.00 46.02 44.84 1fiq n GLY 145 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1fiq s ASN 146 N -0.85 2.47 0.00 1.61 0.01 -0.99 -2.16 114.94 115.03 1fiq s ASN 146 Ca 0.46 -0.44 0.06 0.00 -0.71 0.00 0.00 52.86 52.24 1fiq s ASN 146 Cb 0.39 -1.12 -0.03 0.00 0.41 0.00 0.00 41.25 40.90 1fiq s ASN 146 CO 0.08 0.04 -0.19 -0.76 -1.51 0.00 0.00 177.10 174.77 1fiq s LEU 147 N 0.83 2.51 -0.02 0.60 1.43 0.16 -4.97 118.68 119.22 1fiq s LEU 147 Ca -0.10 -0.38 0.01 0.00 -1.03 0.00 0.00 54.13 52.63 1fiq s LEU 147 Cb -0.16 -1.48 0.01 0.00 0.03 0.00 0.00 46.19 44.60 1fiq s LEU 147 CO 0.01 0.29 -0.02 0.00 0.23 0.00 0.00 176.35 176.86 1fiq n ARG 149 N 3.66 1.16 -0.09 0.00 3.00 -1.26 -4.71 116.66 118.42 1fiq n ARG 149 Ca -0.21 -0.04 -0.23 0.00 -0.00 0.00 0.00 57.85 57.37 1fiq n ARG 149 Cb 0.54 -1.33 -0.12 0.00 0.00 0.00 0.00 32.46 31.55 1fiq n ARG 149 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1fiq h THR 151 N -0.66 1.37 0.00 0.00 1.35 -1.91 -3.48 112.91 109.58 1fiq h THR 151 Ca -0.48 -2.72 0.00 0.00 -0.55 0.00 0.00 66.41 62.67 1fiq h THR 151 Cb 1.60 2.83 0.00 0.00 -1.73 0.00 0.00 68.15 70.85 1fiq h THR 151 CO -0.19 0.81 0.00 0.61 -0.25 0.00 0.00 175.52 176.50 1fiq n GLY 152 N 1.45 0.64 4.35 5.82 0.00 -1.26 -4.53 105.19 111.65 1fiq n GLY 152 Ca -0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.90 1fiq n GLY 152 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1fiq n TYR 153 N -2.03 0.00 -0.33 1.61 4.02 -1.26 -4.83 117.16 114.34 1fiq n TYR 153 Ca 0.00 0.00 -0.08 0.00 -0.01 0.00 0.00 57.90 57.81 1fiq n TYR 153 Cb 0.00 0.00 -0.05 0.00 -0.02 0.00 0.00 39.34 39.27 1fiq n TYR 153 CO 0.00 0.00 0.00 -0.09 -1.01 0.00 0.00 176.86 175.76 1fiq h ARG 154 N 0.00 -0.09 -0.74 -0.72 1.12 -2.00 -2.03 114.38 109.91 1fiq h ARG 154 Ca 0.00 0.01 0.09 0.00 -1.11 0.00 0.00 59.98 58.97 1fiq h ARG 154 Cb 0.00 0.02 -0.07 0.00 -0.01 0.00 0.00 29.97 29.91 1fiq h ARG 154 CO 0.00 -0.06 0.39 -1.35 -3.11 0.00 0.00 179.97 175.84 1fiq h PRO 155 N -0.09 0.65 0.59 0.20 0.11 -1.86 -1.47 132.00 130.12 1fiq h PRO 155 Ca 0.20 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 66.25 1fiq h PRO 155 Cb 0.51 -0.15 -0.00 0.00 0.11 0.00 0.00 31.00 31.48 1fiq h PRO 155 CO -0.86 0.43 -0.35 0.82 -0.21 0.00 0.00 178.00 177.83 1fiq h ILE 156 N 0.66 0.29 -0.88 4.15 2.04 -1.66 -1.03 117.51 121.09 1fiq h ILE 156 Ca 0.36 0.00 0.06 0.00 1.00 0.00 0.00 64.86 66.28 1fiq h ILE 156 Cb 0.35 0.29 -0.06 0.00 -0.74 0.00 0.00 36.82 36.66 1fiq h ILE 156 CO -0.25 0.00 0.55 -0.07 0.00 0.00 0.00 178.15 178.38 1fiq h LEU 157 N -0.88 0.87 -1.26 1.44 3.38 -1.21 -1.90 115.31 115.75 1fiq h LEU 157 Ca -0.07 0.02 -0.04 0.00 0.09 0.00 0.00 57.88 57.88 1fiq h LEU 157 Cb 0.71 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.27 1fiq h LEU 157 CO 0.09 0.55 0.10 -0.61 0.09 0.00 0.00 178.44 178.66 1fiq h GLN 158 N 1.00 0.61 0.00 1.13 4.15 -1.10 -2.57 115.11 118.33 1fiq h GLN 158 Ca 0.38 -0.11 -0.13 0.00 0.77 0.00 0.00 58.65 59.57 1fiq h GLN 158 Cb 0.17 -0.10 -0.02 0.00 0.21 0.00 0.00 27.48 27.74 1fiq h GLN 158 CO -0.17 0.56 -0.61 0.78 -1.93 0.00 0.00 178.83 177.46 1fiq h GLY 159 N 0.82 0.00 -0.67 2.39 0.00 -0.40 -3.06 103.07 102.15 1fiq h GLY 159 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.47 1fiq h GLY 159 CO -0.00 0.00 0.00 0.69 0.00 0.00 0.00 176.54 177.23 1fiq n PHE 160 N -3.67 0.10 0.20 5.60 3.72 -0.96 -3.93 117.46 118.52 1fiq n PHE 160 Ca -0.01 -0.05 0.05 0.00 -0.05 0.00 0.00 57.45 57.39 1fiq n PHE 160 Cb 0.64 0.00 0.41 0.00 -0.94 0.00 0.00 39.48 39.59 1fiq n PHE 160 CO 0.00 0.00 0.00 -0.09 -0.05 0.00 0.00 176.76 176.62 1fiq h ARG 161 N 2.37 0.00 0.00 -1.08 2.43 -1.36 -2.70 114.38 114.04 1fiq h ARG 161 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1fiq h ARG 161 Cb 0.51 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.06 1fiq h ARG 161 CO 0.00 0.34 0.00 0.00 -1.51 0.00 0.00 179.97 178.80 1fiq h THR 162 N 0.00 0.00 -0.00 0.20 1.03 -1.78 -1.54 112.91 110.82 1fiq h THR 162 Ca -0.00 -0.06 0.00 0.00 -0.01 0.00 0.00 66.41 66.34 1fiq h THR 162 Cb 0.70 0.72 0.00 0.00 -1.07 0.00 0.00 68.15 68.50 1fiq h THR 162 CO 0.04 0.00 -0.53 0.49 -0.01 0.00 0.00 175.52 175.52 1fiq n PHE 163 N -2.49 0.00 -1.47 0.00 3.01 -1.02 -4.95 117.46 110.54 1fiq n PHE 163 Ca -0.01 0.00 -0.09 0.00 1.01 0.00 0.00 57.45 58.36 1fiq n PHE 163 Cb 0.08 -0.21 0.06 0.00 -0.01 0.00 0.00 39.48 39.40 1fiq n PHE 163 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1fiq n ALA 164 N -1.41 -0.39 -0.99 4.37 0.00 -0.58 -3.82 120.51 117.69 1fiq n ALA 164 Ca 0.06 -0.55 0.00 0.00 0.00 0.00 0.00 53.44 52.95 1fiq n ALA 164 Cb 0.34 -0.01 0.00 0.00 0.00 0.00 0.00 19.45 19.78 1fiq n ALA 164 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13