#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3f65 s LEU 2 N 0.00 4.48 0.12 -3.43 1.43 -1.26 0.12 118.68 120.14 3f65 s LEU 2 Ca 0.00 1.02 -0.01 0.00 -1.03 0.00 0.00 54.13 54.11 3f65 s LEU 2 Cb 0.00 -2.69 -0.04 0.00 0.03 0.00 0.00 46.19 43.49 3f65 s LEU 2 CO 0.00 0.30 0.05 0.00 0.23 0.00 0.00 176.35 176.93 3f65 s ALA 3 N -1.11 0.80 0.31 4.21 0.00 -0.73 -4.96 121.76 120.28 3f65 s ALA 3 Ca 0.26 -1.43 0.10 0.00 0.00 0.00 0.00 51.96 50.89 3f65 s ALA 3 Cb -0.17 0.79 -0.06 0.00 0.00 0.00 0.00 23.12 23.69 3f65 s ALA 3 CO 0.15 -0.48 -0.14 0.14 0.00 0.00 0.00 175.76 175.43 3f65 s VAL 4 N -4.03 2.29 0.35 0.00 -7.23 -1.26 -1.52 120.40 108.99 3f65 s VAL 4 Ca 0.22 -2.29 0.10 0.00 -1.81 0.00 0.00 61.98 58.21 3f65 s VAL 4 Cb 0.07 -2.47 0.08 0.00 0.56 0.00 0.00 36.38 34.62 3f65 s VAL 4 CO 0.00 -0.30 1.80 -2.24 -0.31 0.00 0.00 175.10 174.05 3f65 h ASP 5 N 2.16 0.10 -4.55 4.85 -0.00 -1.97 -3.47 116.42 113.54 3f65 h ASP 5 Ca -0.41 -0.04 -0.49 0.00 -0.00 0.00 0.00 57.03 56.10 3f65 h ASP 5 Cb 1.25 -0.03 -0.10 0.00 -0.00 0.00 0.00 39.33 40.45 3f65 h ASP 5 CO 0.66 0.46 -0.39 0.00 -0.00 0.00 0.00 179.24 179.96 3f65 n GLN 6 N -4.09 0.72 -0.00 4.15 6.02 -1.26 -5.06 117.38 117.85 3f65 n GLN 6 Ca -0.02 -2.95 0.06 0.00 -0.01 0.00 0.00 57.00 54.09 3f65 n GLN 6 Cb 0.41 1.38 -0.09 0.00 1.02 0.00 0.00 30.24 32.97 3f65 n GLN 6 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 3f65 n THR 7 N -0.84 0.00 -3.75 5.09 -2.24 -1.26 -4.99 114.28 106.28 3f65 n THR 7 Ca -0.08 -0.24 -0.10 0.00 -2.27 0.00 0.00 64.05 61.35 3f65 n THR 7 Cb 0.52 0.64 -0.07 0.00 -2.10 0.00 0.00 70.33 69.32 3f65 n THR 7 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3f65 s ARG 8 N -2.54 0.89 0.08 -0.78 1.70 -1.26 -4.22 118.95 112.82 3f65 s ARG 8 Ca 0.01 -0.69 0.05 0.00 -0.47 0.00 0.00 55.73 54.63 3f65 s ARG 8 Cb 0.09 0.38 -0.03 0.00 -0.57 0.00 0.00 34.95 34.82 3f65 s ARG 8 CO 0.54 -0.30 -0.14 0.71 -1.08 0.00 0.00 175.30 175.03 3f65 s TYR 9 N -3.26 1.20 -0.22 5.89 1.51 -0.28 -5.00 117.35 117.19 3f65 s TYR 9 Ca -0.00 -0.48 0.01 0.00 -1.01 0.00 0.00 57.07 55.59 3f65 s TYR 9 Cb 0.02 -0.67 0.05 0.00 -0.11 0.00 0.00 41.96 41.24 3f65 s TYR 9 CO -0.08 0.06 -0.10 0.42 -1.11 0.00 0.00 175.55 174.73 3f65 s ILE 10 N -1.41 1.77 -0.57 2.71 1.01 -1.26 -0.45 121.20 123.00 3f65 s ILE 10 Ca -0.01 -1.17 -0.27 0.00 0.00 0.00 0.00 60.65 59.19 3f65 s ILE 10 Cb -0.09 -1.86 0.03 0.00 0.01 0.00 0.00 42.46 40.55 3f65 s ILE 10 CO 0.02 0.11 1.13 0.12 0.00 0.00 0.00 174.94 176.32 3f65 s PHE 11 N 1.32 2.66 0.15 3.97 2.19 0.15 -4.97 117.98 123.46 3f65 s PHE 11 Ca -0.03 0.32 -0.27 0.00 0.33 0.00 0.00 56.93 57.28 3f65 s PHE 11 Cb -0.17 -4.40 -0.07 0.00 -1.31 0.00 0.00 43.02 37.07 3f65 s PHE 11 CO -0.08 -1.51 0.85 -0.98 1.83 0.00 0.00 175.22 175.33 3f65 s ARG 12 N 4.68 4.65 0.31 10.12 1.70 -1.26 -1.55 118.95 137.60 3f65 s ARG 12 Ca 0.40 1.27 0.25 0.00 -0.47 0.00 0.00 55.73 57.18 3f65 s ARG 12 Cb -0.09 -3.31 1.09 0.00 -0.57 0.00 0.00 34.95 32.07 3f65 s ARG 12 CO 0.24 0.44 1.76 0.78 -1.08 0.00 0.00 175.30 177.44 3f65 h GLY 13 N 4.77 0.00 -1.63 3.88 0.00 -1.11 -2.73 103.07 106.25 3f65 h GLY 13 Ca -0.45 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.88 3f65 h GLY 13 CO 0.68 0.00 0.00 2.09 0.00 0.00 0.00 176.54 179.31 3f65 n ASP 14 N -2.37 2.39 -4.30 0.19 5.75 -1.26 -4.53 116.55 112.41 3f65 n ASP 14 Ca 0.01 -2.12 -0.16 0.00 -0.01 0.00 0.00 54.79 52.52 3f65 n ASP 14 Cb 0.21 -0.34 -0.10 0.00 -1.03 0.00 0.00 41.12 39.86 3f65 n ASP 14 CO 0.00 0.00 0.00 -1.61 -0.11 0.00 0.00 177.20 175.48 3f65 s GLU 15 N -1.59 1.24 0.11 0.11 2.02 -1.03 -5.05 118.70 114.50 3f65 s GLU 15 Ca 0.26 -1.60 0.22 0.00 0.02 0.00 0.00 54.97 53.88 3f65 s GLU 15 Cb 0.15 -0.59 -0.09 0.00 0.10 0.00 0.00 34.13 33.70 3f65 s GLU 15 CO 0.15 -0.05 0.88 -0.25 0.02 0.00 0.00 175.26 176.01 3f65 n ASP 16 N -0.34 0.57 -3.67 -0.19 8.00 -1.26 -4.93 116.55 114.72 3f65 n ASP 16 Ca -0.07 0.16 -0.11 0.00 0.71 0.00 0.00 54.79 55.48 3f65 n ASP 16 Cb 0.63 0.94 -0.05 0.00 -0.02 0.00 0.00 41.12 42.62 3f65 n ASP 16 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3f65 s ALA 17 N -3.38 -0.83 -0.12 2.24 0.00 -1.26 -4.49 121.76 113.91 3f65 s ALA 17 Ca -0.02 -0.08 0.02 0.00 0.00 0.00 0.00 51.96 51.88 3f65 s ALA 17 Cb 0.12 0.60 0.01 0.00 0.00 0.00 0.00 23.12 23.85 3f65 s ALA 17 CO 0.83 -0.59 -0.19 -1.17 0.00 0.00 0.00 175.76 174.64 3f65 s LEU 18 N -2.67 1.92 -0.22 0.00 0.20 -0.16 -4.93 118.68 112.81 3f65 s LEU 18 Ca 0.02 -0.51 -0.09 0.00 0.69 0.00 0.00 54.13 54.24 3f65 s LEU 18 Cb 0.02 -1.26 -0.04 0.00 -0.43 0.00 0.00 46.19 44.48 3f65 s LEU 18 CO -0.10 0.06 0.11 -0.89 -0.29 0.00 0.00 176.35 175.23 3f65 s THR 19 N 0.84 4.93 -0.08 3.68 2.01 -1.26 0.05 115.64 125.81 3f65 s THR 19 Ca -0.08 0.03 0.01 0.00 0.31 0.00 0.00 61.69 61.95 3f65 s THR 19 Cb -0.15 -3.27 -0.03 0.00 0.01 0.00 0.00 72.50 69.06 3f65 s THR 19 CO -0.01 0.38 -0.08 -0.63 -0.69 0.00 0.00 174.62 173.60 3f65 s ILE 20 N 0.93 3.63 -0.19 1.82 1.09 -0.08 -4.96 121.20 123.43 3f65 s ILE 20 Ca 0.05 -0.50 -0.03 0.00 -1.10 0.00 0.00 60.65 59.08 3f65 s ILE 20 Cb -0.13 -2.49 -0.01 0.00 -1.06 0.00 0.00 42.46 38.77 3f65 s ILE 20 CO 0.03 0.58 -0.07 0.28 -0.10 0.00 0.00 174.94 175.66 3f65 s THR 21 N -0.61 3.24 -0.10 2.92 -1.32 -1.26 0.97 115.64 119.48 3f65 s THR 21 Ca 0.09 -0.55 -0.03 0.00 -1.21 0.00 0.00 61.69 59.99 3f65 s THR 21 Cb -0.12 -2.44 -0.03 0.00 -1.51 0.00 0.00 72.50 68.40 3f65 s THR 21 CO 0.02 0.46 0.01 0.68 -2.21 0.00 0.00 174.62 173.57 3f65 s VAL 22 N 1.13 4.36 0.06 5.08 -7.23 -0.22 -3.28 120.40 120.30 3f65 s VAL 22 Ca 0.01 -0.22 0.09 0.00 -1.81 0.00 0.00 61.98 60.05 3f65 s VAL 22 Cb -0.14 -2.85 -0.03 0.00 0.56 0.00 0.00 36.38 33.92 3f65 s VAL 22 CO -0.02 0.59 -0.25 0.42 -0.31 0.00 0.00 175.10 175.53 3f65 s THR 23 N -0.71 2.04 -0.22 5.32 -4.23 -0.58 -0.34 115.64 116.92 3f65 s THR 23 Ca 0.11 -1.41 -0.22 0.00 -1.18 0.00 0.00 61.69 58.99 3f65 s THR 23 Cb -0.12 -1.76 -0.02 0.00 1.34 0.00 0.00 72.50 71.95 3f65 s THR 23 CO 0.02 0.27 0.70 0.21 -0.54 0.00 0.00 174.62 175.28 3f65 s ASN 24 N -1.38 6.71 -0.00 3.99 3.84 -0.10 -1.77 114.94 126.23 3f65 s ASN 24 Ca 0.11 0.88 -0.19 0.00 0.21 0.00 0.00 52.86 53.86 3f65 s ASN 24 Cb -0.10 -2.38 -0.11 0.00 -0.55 0.00 0.00 41.25 38.12 3f65 s ASN 24 CO 0.03 -0.38 0.88 -1.13 -2.79 0.00 0.00 177.10 173.71 3f65 h ASN 25 N 7.65 -0.59 -1.23 -4.21 -0.00 0.63 -3.10 115.58 114.73 3f65 h ASN 25 Ca -0.28 0.02 -0.80 0.00 -0.00 0.00 0.00 56.30 55.25 3f65 h ASN 25 Cb 1.12 0.15 0.03 0.00 -0.00 0.00 0.00 38.32 39.62 3f65 h ASN 25 CO 0.80 -0.25 0.57 -0.67 -0.00 0.00 0.00 177.43 177.89 3f65 n ASP 26 N -4.85 1.30 -0.20 1.15 -0.08 -1.26 -4.57 116.55 108.04 3f65 n ASP 26 Ca -0.09 1.14 0.14 0.00 -1.51 0.00 0.00 54.79 54.47 3f65 n ASP 26 Cb 0.27 -1.00 0.50 0.00 2.34 0.00 0.00 41.12 43.24 3f65 n ASP 26 CO 0.00 0.00 0.00 2.29 0.12 0.00 0.00 177.20 179.61 3f65 n LYS 27 N 3.59 0.82 0.00 -0.67 -0.00 -1.26 -2.77 118.16 117.87 3f65 n LYS 27 Ca 0.26 -0.40 0.00 0.00 -0.00 0.00 0.00 58.31 58.17 3f65 n LYS 27 Cb 0.05 -1.49 0.00 0.00 -0.00 0.00 0.00 35.03 33.59 3f65 n LYS 27 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.40 176.55 3f65 n GLU 28 N -0.74 2.30 -4.77 -1.58 0.00 -1.26 -4.73 120.64 109.86 3f65 n GLU 28 Ca 0.14 0.00 -0.33 0.00 0.00 0.00 0.00 57.16 56.97 3f65 n GLU 28 Cb 0.31 -0.83 -0.13 0.00 0.00 0.00 0.00 31.44 30.79 3f65 n GLU 28 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.13 176.15 3f65 s ARG 29 N -1.49 2.99 0.23 3.44 3.03 -1.26 -4.87 118.95 121.02 3f65 s ARG 29 Ca 0.00 -0.66 -0.30 0.00 2.03 0.00 0.00 55.73 56.80 3f65 s ARG 29 Cb 0.00 -2.55 -0.09 0.00 -1.03 0.00 0.00 34.95 31.28 3f65 s ARG 29 CO 0.00 0.43 0.95 0.95 -1.13 0.00 0.00 175.30 176.50 3f65 s THR 30 N -0.21 4.08 -0.07 4.99 -4.23 -1.26 -4.19 115.64 114.75 3f65 s THR 30 Ca 0.01 2.05 0.03 0.00 -1.18 0.00 0.00 61.69 62.59 3f65 s THR 30 Cb -0.13 -4.30 -0.02 0.00 1.34 0.00 0.00 72.50 69.38 3f65 s THR 30 CO 0.03 0.47 -0.14 -0.36 -0.54 0.00 0.00 174.62 174.08 3f65 s PHE 31 N -1.05 2.72 0.65 3.99 0.40 -0.55 -4.14 117.98 120.00 3f65 s PHE 31 Ca 0.42 -0.30 -0.12 0.00 -0.60 0.00 0.00 56.93 56.33 3f65 s PHE 31 Cb -0.26 -1.68 -0.02 0.00 0.51 0.00 0.00 43.02 41.57 3f65 s PHE 31 CO 0.32 0.07 1.05 0.20 0.70 0.00 0.00 175.22 177.56 3f65 s GLY 32 N -0.44 1.76 -0.07 4.36 0.00 -0.50 0.09 107.32 112.52 3f65 s GLY 32 Ca 0.05 0.09 -0.08 0.00 0.00 0.00 0.00 44.72 44.78 3f65 s GLY 32 CO 0.02 0.39 0.22 -0.32 0.00 0.00 0.00 173.10 173.41 3f65 s GLY 33 N -3.69 -0.13 -0.03 0.20 0.00 0.17 -0.94 107.32 102.88 3f65 s GLY 33 Ca 0.58 0.49 0.02 0.00 0.00 0.00 0.00 44.72 45.81 3f65 s GLY 33 CO 0.50 0.38 -0.06 1.62 0.00 0.00 0.00 173.10 175.55 3f65 s GLN 34 N -0.25 0.83 0.06 2.90 0.74 0.18 -1.01 119.66 123.11 3f65 s GLN 34 Ca -0.04 -0.17 0.05 0.00 0.05 0.00 0.00 55.36 55.26 3f65 s GLN 34 Cb -0.03 -0.80 -0.03 0.00 1.10 0.00 0.00 33.01 33.25 3f65 s GLN 34 CO 0.01 -0.00 -0.14 0.00 -0.55 0.00 0.00 175.29 174.60 3f65 s ALA 35 N 0.59 1.19 0.02 1.58 0.00 -0.39 -0.19 121.76 124.57 3f65 s ALA 35 Ca -0.08 -0.97 -0.28 0.00 0.00 0.00 0.00 51.96 50.63 3f65 s ALA 35 Cb -0.12 -0.12 0.10 0.00 0.00 0.00 0.00 23.12 22.98 3f65 s ALA 35 CO 0.00 0.19 0.94 1.67 0.00 0.00 0.00 175.76 178.56 3f65 s TRP 36 N -1.17 -0.27 -0.12 0.00 -2.14 -0.88 -4.68 118.94 109.69 3f65 s TRP 36 Ca -0.01 0.09 0.03 0.00 2.66 0.00 0.00 56.10 58.87 3f65 s TRP 36 Cb -0.09 0.56 -0.00 0.00 -3.10 0.00 0.00 33.47 30.84 3f65 s TRP 36 CO 0.02 -0.58 -0.21 0.08 -2.66 0.00 0.00 176.95 173.60 3f65 s VAL 37 N -3.09 2.27 -0.16 -0.66 1.01 -1.26 -0.57 120.40 117.94 3f65 s VAL 37 Ca 0.07 -0.93 -0.09 0.00 0.00 0.00 0.00 61.98 61.03 3f65 s VAL 37 Cb -0.01 -1.90 -0.05 0.00 0.00 0.00 0.00 36.38 34.43 3f65 s VAL 37 CO -0.06 0.55 0.16 -1.81 0.00 0.00 0.00 175.10 173.94 3f65 s ASP 38 N 0.49 6.32 0.79 3.32 1.01 0.10 -4.70 116.67 123.99 3f65 s ASP 38 Ca -0.14 0.38 -0.12 0.00 0.71 0.00 0.00 52.55 53.38 3f65 s ASP 38 Cb -0.17 -2.10 0.07 0.00 1.01 0.00 0.00 42.92 41.73 3f65 s ASP 38 CO 0.05 0.26 1.13 0.20 0.21 0.00 0.00 175.17 177.02 3f65 s ASN 39 N -0.20 4.13 0.12 0.27 0.01 -1.26 -1.64 114.94 116.37 3f65 s ASN 39 Ca 0.12 2.03 0.00 0.00 -0.71 0.00 0.00 52.86 54.30 3f65 s ASN 39 Cb -0.12 -2.55 0.00 0.00 0.41 0.00 0.00 41.25 38.99 3f65 s ASN 39 CO 0.01 -2.29 0.00 -0.38 -1.51 0.00 0.00 177.10 172.93 3f65 n ILE 40 N -3.41 0.71 0.01 0.60 5.41 -1.26 -4.78 119.36 116.64 3f65 n ILE 40 Ca 0.11 0.23 -0.13 0.00 1.00 0.00 0.00 62.75 63.96 3f65 n ILE 40 Cb 0.52 -1.17 -0.01 0.00 -0.71 0.00 0.00 39.64 38.27 3f65 n ILE 40 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 176.55 177.13 3f65 h VAL 41 N 0.00 1.33 -3.19 1.39 2.07 -1.95 -3.44 116.25 112.46 3f65 h VAL 41 Ca 0.00 -2.02 -0.53 0.00 0.82 0.00 0.00 66.70 64.97 3f65 h VAL 41 Cb 0.00 2.01 0.04 0.00 -1.52 0.00 0.00 31.29 31.82 3f65 h VAL 41 CO 0.00 0.62 0.76 -1.61 0.02 0.00 0.00 177.57 177.36 3f65 s GLU 42 N -3.73 4.29 0.15 1.57 8.01 -1.26 -4.91 118.70 122.82 3f65 s GLU 42 Ca -0.08 2.22 -0.05 0.00 0.01 0.00 0.00 54.97 57.07 3f65 s GLU 42 Cb 0.10 -3.16 -0.02 0.00 -4.31 0.00 0.00 34.13 26.74 3f65 s GLU 42 CO 0.87 -0.43 1.38 1.57 0.01 0.00 0.00 175.26 178.66 3f65 h LYS 43 N 5.83 0.50 -6.75 1.61 -0.00 -1.98 -3.47 116.57 112.31 3f65 h LYS 43 Ca -0.44 -0.43 -0.57 0.00 -0.00 0.00 0.00 60.65 59.21 3f65 h LYS 43 Cb 1.21 0.09 0.16 0.00 -0.00 0.00 0.00 32.23 33.70 3f65 h LYS 43 CO 0.82 1.06 0.01 -3.47 -0.00 0.00 0.00 179.45 177.87 3f65 n ASP 44 N -3.85 0.37 0.02 7.07 -0.08 -1.26 -4.94 116.55 113.89 3f65 n ASP 44 Ca -0.05 0.80 0.11 0.00 -1.51 0.00 0.00 54.79 54.14 3f65 n ASP 44 Cb 0.74 -1.34 0.01 0.00 2.34 0.00 0.00 41.12 42.87 3f65 n ASP 44 CO 0.00 0.00 0.00 1.07 0.12 0.00 0.00 177.20 178.39 3f65 n THR 45 N -1.67 0.14 -1.68 5.18 5.66 -1.26 -4.84 114.28 115.81 3f65 n THR 45 Ca 0.13 -0.22 -0.52 0.00 -3.05 0.00 0.00 64.05 60.39 3f65 n THR 45 Cb 0.47 0.28 -0.06 0.00 -1.55 0.00 0.00 70.33 69.47 3f65 n THR 45 CO 0.00 0.00 0.00 -1.14 -3.05 0.00 0.00 175.07 170.88 3f65 n ARG 46 N -1.90 1.68 -1.75 1.09 0.63 -1.26 -4.86 116.66 110.29 3f65 n ARG 46 Ca 0.02 0.61 -0.42 0.00 -0.92 0.00 0.00 57.85 57.14 3f65 n ARG 46 Cb 0.43 -2.41 -0.03 0.00 0.45 0.00 0.00 32.46 30.90 3f65 n ARG 46 CO 0.00 0.00 0.00 -2.14 -2.51 0.00 0.00 177.63 172.98 3f65 s PRO 47 N 4.02 4.13 0.07 -0.14 0.02 -1.26 -4.89 135.00 136.96 3f65 s PRO 47 Ca 0.96 2.58 -0.02 0.00 0.02 0.00 0.00 61.00 64.54 3f65 s PRO 47 Cb -0.86 -3.14 -0.27 0.00 0.02 0.00 0.00 34.50 30.24 3f65 s PRO 47 CO 0.58 -0.75 1.13 1.15 -0.33 0.00 0.00 177.00 178.78 3f65 h THR 48 N 3.93 1.49 -4.27 0.99 2.02 -1.89 -3.42 112.91 111.77 3f65 h THR 48 Ca -0.43 -3.09 -0.64 0.00 0.77 0.00 0.00 66.41 63.02 3f65 h THR 48 Cb 1.20 2.91 -0.27 0.00 -1.74 0.00 0.00 68.15 70.26 3f65 h THR 48 CO 0.95 0.90 -0.86 -0.36 0.37 0.00 0.00 175.52 176.52 3f65 s PHE 49 N -2.66 2.08 -0.08 3.16 0.40 -1.26 -1.27 117.98 118.34 3f65 s PHE 49 Ca -0.04 -0.39 0.01 0.00 -0.60 0.00 0.00 56.93 55.91 3f65 s PHE 49 Cb 0.07 -1.25 -0.03 0.00 0.51 0.00 0.00 43.02 42.33 3f65 s PHE 49 CO 0.87 0.10 -0.10 0.08 0.70 0.00 0.00 175.22 176.87 3f65 s VAL 50 N -0.78 3.39 -0.14 -0.44 1.01 -0.04 -4.55 120.40 118.85 3f65 s VAL 50 Ca 0.10 -0.58 -0.00 0.00 0.00 0.00 0.00 61.98 61.50 3f65 s VAL 50 Cb -0.09 -2.39 -0.01 0.00 0.00 0.00 0.00 36.38 33.89 3f65 s VAL 50 CO 0.02 0.57 -0.14 -0.69 0.00 0.00 0.00 175.10 174.86 3f65 s VAL 51 N -0.42 2.90 -0.10 2.92 1.01 -1.26 -1.52 120.40 123.93 3f65 s VAL 51 Ca 0.05 -0.70 0.01 0.00 0.00 0.00 0.00 61.98 61.34 3f65 s VAL 51 Cb -0.12 -2.22 0.02 0.00 0.00 0.00 0.00 36.38 34.06 3f65 s VAL 51 CO 0.02 0.52 -0.11 -0.89 0.00 0.00 0.00 175.10 174.64 3f65 s THR 52 N 0.56 1.21 0.41 3.92 2.01 -0.79 -2.43 115.64 120.52 3f65 s THR 52 Ca -0.09 -0.45 -0.22 0.00 0.31 0.00 0.00 61.69 61.24 3f65 s THR 52 Cb -0.16 -1.15 -0.10 0.00 0.01 0.00 0.00 72.50 71.10 3f65 s THR 52 CO 0.04 0.39 0.97 -2.16 -0.69 0.00 0.00 174.62 173.17 3f65 s PRO 53 N 1.24 4.23 0.07 4.92 0.04 -1.26 -0.92 135.00 143.32 3f65 s PRO 53 Ca -0.03 1.23 0.24 0.00 0.04 0.00 0.00 61.00 62.48 3f65 s PRO 53 Cb -0.14 -2.32 0.32 0.00 0.04 0.00 0.00 34.50 32.40 3f65 s PRO 53 CO -0.04 -0.04 1.28 -1.13 0.04 0.00 0.00 177.00 177.12 3f65 n SER 54 N -0.40 0.63 -3.63 6.66 3.41 -1.02 -4.72 113.62 114.56 3f65 n SER 54 Ca 0.06 -0.04 -0.18 0.00 -0.26 0.00 0.00 58.87 58.45 3f65 n SER 54 Cb 0.53 0.32 -0.15 0.00 -0.26 0.00 0.00 64.21 64.64 3f65 n SER 54 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 3f65 s PHE 55 N -3.13 -0.17 0.30 7.33 5.99 -1.26 -1.26 117.98 125.79 3f65 s PHE 55 Ca 0.07 0.46 -0.11 0.00 0.00 0.00 0.00 56.93 57.35 3f65 s PHE 55 Cb 0.15 -0.31 0.01 0.00 0.00 0.00 0.00 43.02 42.86 3f65 s PHE 55 CO 0.73 -0.36 0.56 -0.59 -0.00 0.00 0.00 175.22 175.57 3f65 s PHE 56 N 2.29 0.46 0.07 10.12 -0.12 -0.18 -4.99 117.98 125.62 3f65 s PHE 56 Ca 0.04 -0.85 0.06 0.00 -0.05 0.00 0.00 56.93 56.13 3f65 s PHE 56 Cb -0.13 0.29 -0.03 0.00 -0.63 0.00 0.00 43.02 42.52 3f65 s PHE 56 CO -0.07 -1.17 -0.17 0.15 -0.05 0.00 0.00 175.22 173.91 3f65 s LYS 57 N -3.42 1.05 -0.11 1.99 3.01 -1.26 0.42 119.74 121.42 3f65 s LYS 57 Ca 0.22 -0.96 0.00 0.00 -1.01 0.00 0.00 55.97 54.22 3f65 s LYS 57 Cb -0.02 -1.16 0.02 0.00 -1.01 0.00 0.00 37.83 35.67 3f65 s LYS 57 CO 0.12 0.28 -0.09 0.08 0.51 0.00 0.00 175.35 176.25 3f65 s VAL 58 N -1.04 1.12 0.80 3.17 1.01 0.11 -4.96 120.40 120.61 3f65 s VAL 58 Ca 0.03 -0.37 -0.13 0.00 0.00 0.00 0.00 61.98 61.52 3f65 s VAL 58 Cb -0.09 -1.11 0.08 0.00 0.00 0.00 0.00 36.38 35.26 3f65 s VAL 58 CO 0.02 0.38 1.18 -1.59 0.00 0.00 0.00 175.10 175.09 3f65 s LYS 59 N 1.53 1.73 0.27 2.72 0.00 -1.26 -1.48 119.74 123.25 3f65 s LYS 59 Ca 0.02 1.65 -0.30 0.00 0.00 0.00 0.00 55.97 57.33 3f65 s LYS 59 Cb -0.13 -1.80 -0.13 0.00 0.00 0.00 0.00 37.83 35.77 3f65 s LYS 59 CO -0.07 -2.12 1.40 -2.30 0.00 0.00 0.00 175.35 172.26 3f65 n PRO 60 N -3.34 2.14 -0.96 1.78 -0.02 -1.26 -0.47 135.00 132.87 3f65 n PRO 60 Ca 0.13 0.76 0.00 0.00 -2.02 0.00 0.00 63.50 62.37 3f65 n PRO 60 Cb 0.51 -2.42 0.00 0.00 -0.02 0.00 0.00 33.50 31.57 3f65 n PRO 60 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 3f65 n ASN 61 N 1.84 -5.30 -4.54 2.55 5.03 -1.12 -4.95 115.26 108.77 3f65 n ASN 61 Ca 0.10 0.00 -0.25 0.00 0.87 0.00 0.00 54.58 55.30 3f65 n ASN 61 Cb 0.33 -3.25 0.13 0.00 -1.02 0.00 0.00 39.78 35.97 3f65 n ASN 61 CO 0.00 0.00 0.00 -0.83 -1.83 0.00 0.00 177.26 174.60 3f65 s GLY 62 N -2.00 1.76 0.08 7.41 0.00 0.38 -4.76 107.32 110.19 3f65 s GLY 62 Ca 0.00 -1.71 0.03 0.00 0.00 0.00 0.00 44.72 43.04 3f65 s GLY 62 CO 0.00 -1.07 -0.10 1.20 0.00 0.00 0.00 173.10 173.12 3f65 s GLN 63 N -5.31 0.76 -0.05 2.90 -0.21 -1.26 -0.92 119.66 115.57 3f65 s GLN 63 Ca 0.69 -1.02 -0.01 0.00 0.02 0.00 0.00 55.36 55.03 3f65 s GLN 63 Cb -0.04 -0.51 0.03 0.00 1.00 0.00 0.00 33.01 33.48 3f65 s GLN 63 CO 0.46 0.09 0.03 -1.14 -2.12 0.00 0.00 175.29 172.62 3f65 s GLN 64 N -2.32 0.16 0.12 2.91 2.00 0.54 -4.93 119.66 118.14 3f65 s GLN 64 Ca 0.00 0.25 -0.26 0.00 -2.00 0.00 0.00 55.36 53.35 3f65 s GLN 64 Cb -0.06 -0.61 -0.07 0.00 0.80 0.00 0.00 33.01 33.07 3f65 s GLN 64 CO 0.00 -0.28 0.82 0.95 -0.50 0.00 0.00 175.29 176.28 3f65 s THR 65 N 1.88 4.50 -0.08 -0.34 -4.23 -1.26 -1.05 115.64 115.05 3f65 s THR 65 Ca 0.02 1.78 -0.00 0.00 -1.18 0.00 0.00 61.69 62.30 3f65 s THR 65 Cb -0.12 -4.18 -0.03 0.00 1.34 0.00 0.00 72.50 69.51 3f65 s THR 65 CO -0.03 0.43 -0.05 -0.76 -0.54 0.00 0.00 174.62 173.66 3f65 s LEU 66 N -0.54 3.25 -0.27 4.79 1.43 0.27 -4.58 118.68 123.03 3f65 s LEU 66 Ca 0.39 -0.00 -0.02 0.00 -1.03 0.00 0.00 54.13 53.46 3f65 s LEU 66 Cb -0.22 -1.72 0.03 0.00 0.03 0.00 0.00 46.19 44.30 3f65 s LEU 66 CO 0.26 0.34 -0.02 -0.60 0.23 0.00 0.00 176.35 176.56 3f65 s ARG 67 N -0.68 2.77 -0.20 1.70 3.52 -0.10 -0.90 118.95 125.06 3f65 s ARG 67 Ca 0.10 -1.04 -0.11 0.00 -0.13 0.00 0.00 55.73 54.55 3f65 s ARG 67 Cb -0.11 -3.10 -0.05 0.00 -1.56 0.00 0.00 34.95 30.13 3f65 s ARG 67 CO 0.02 -0.46 0.19 0.42 -0.81 0.00 0.00 175.30 174.66 3f65 s ILE 68 N 1.33 5.36 0.14 4.11 1.01 0.11 -1.89 121.20 131.36 3f65 s ILE 68 Ca -0.01 0.31 0.06 0.00 0.00 0.00 0.00 60.65 61.02 3f65 s ILE 68 Cb -0.18 -3.53 -0.04 0.00 0.01 0.00 0.00 42.46 38.72 3f65 s ILE 68 CO -0.03 0.40 -0.15 0.27 0.00 0.00 0.00 174.94 175.44 3f65 s ILE 69 N 0.54 1.45 -0.19 2.92 -5.25 -0.57 -0.99 121.20 119.11 3f65 s ILE 69 Ca 0.11 -1.79 -0.26 0.00 -0.99 0.00 0.00 60.65 57.72 3f65 s ILE 69 Cb -0.12 -1.63 -0.01 0.00 2.95 0.00 0.00 42.46 43.65 3f65 s ILE 69 CO 0.01 -0.41 0.87 -0.32 -1.79 0.00 0.00 174.94 173.30 3f65 s MET 70 N -2.77 4.27 -0.00 0.37 -2.45 -1.26 -0.86 119.30 116.59 3f65 s MET 70 Ca 0.11 1.07 0.16 0.00 -1.25 0.00 0.00 55.69 55.78 3f65 s MET 70 Cb -0.05 -3.60 -0.18 0.00 1.25 0.00 0.00 34.83 32.26 3f65 s MET 70 CO 0.04 -0.41 0.65 0.00 1.05 0.00 0.00 175.02 176.35 3f65 n ALA 71 N 5.52 3.96 -3.76 4.11 0.00 -0.40 -4.86 120.51 125.08 3f65 n ALA 71 Ca 0.06 -0.44 -0.30 0.00 0.00 0.00 0.00 53.44 52.76 3f65 n ALA 71 Cb 0.48 -0.57 -0.14 0.00 0.00 0.00 0.00 19.45 19.21 3f65 n ALA 71 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3f65 s SER 72 N -2.59 3.99 0.00 0.00 0.15 -1.13 -4.98 113.70 109.14 3f65 s SER 72 Ca 0.05 -2.07 0.00 0.00 0.70 0.00 0.00 55.95 54.63 3f65 s SER 72 Cb 0.12 -1.03 0.00 0.00 -1.71 0.00 0.00 66.02 63.40 3f65 s SER 72 CO 0.65 -0.36 0.20 -0.90 1.20 0.00 0.00 173.24 174.03 3f65 n ASP 73 N 4.29 0.20 -0.55 5.45 5.75 -1.26 -3.72 116.55 126.71 3f65 n ASP 73 Ca 0.03 -0.59 0.01 0.00 -0.01 0.00 0.00 54.79 54.23 3f65 n ASP 73 Cb 0.39 -0.10 0.05 0.00 -1.03 0.00 0.00 41.12 40.44 3f65 n ASP 73 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3f65 n HIS 74 N 0.07 0.25 -3.07 2.11 1.44 -1.26 -4.91 115.22 109.86 3f65 n HIS 74 Ca 0.00 -0.09 -0.39 0.00 -2.01 0.00 0.00 57.72 55.22 3f65 n HIS 74 Cb 0.05 -0.11 -0.05 0.00 0.12 0.00 0.00 29.99 30.00 3f65 n HIS 74 CO 0.00 0.00 0.00 -0.51 -2.81 0.00 0.00 176.34 173.02 3f65 s LEU 75 N -0.56 4.41 0.29 2.39 1.43 -1.24 -5.01 118.68 120.38 3f65 s LEU 75 Ca 0.07 1.30 -0.30 0.00 -1.03 0.00 0.00 54.13 54.17 3f65 s LEU 75 Cb 0.05 -3.10 -0.12 0.00 0.03 0.00 0.00 46.19 43.05 3f65 s LEU 75 CO 0.03 0.01 1.54 -2.65 0.23 0.00 0.00 176.35 175.51 3f65 n PRO 76 N 3.00 2.55 0.00 1.29 -0.02 -1.26 -4.91 135.00 135.65 3f65 n PRO 76 Ca -0.04 0.91 0.11 0.00 -2.02 0.00 0.00 63.50 62.46 3f65 n PRO 76 Cb 0.51 -2.65 0.01 0.00 -0.02 0.00 0.00 33.50 31.34 3f65 n PRO 76 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 3f65 n LYS 77 N 1.93 0.39 0.00 -0.52 4.76 -1.26 -4.30 118.16 119.15 3f65 n LYS 77 Ca 0.08 -0.30 0.09 0.00 -2.87 0.00 0.00 58.31 55.31 3f65 n LYS 77 Cb 0.36 -1.49 -0.02 0.00 -1.84 0.00 0.00 35.03 32.04 3f65 n LYS 77 CO 0.00 0.00 0.00 -0.40 -1.37 0.00 0.00 177.40 175.63 3f65 n ASP 78 N -1.04 1.70 -3.77 4.39 5.75 -1.26 -4.72 116.55 117.60 3f65 n ASP 78 Ca 0.06 -1.35 -0.11 0.00 -0.01 0.00 0.00 54.79 53.38 3f65 n ASP 78 Cb 0.37 0.54 -0.07 0.00 -1.03 0.00 0.00 41.12 40.93 3f65 n ASP 78 CO 0.00 0.00 0.00 -1.59 -0.11 0.00 0.00 177.20 175.50 3f65 s LYS 79 N -2.26 0.81 0.49 0.11 -2.85 -1.26 -4.79 119.74 109.99 3f65 s LYS 79 Ca 0.15 -0.57 -0.22 0.00 -1.00 0.00 0.00 55.97 54.33 3f65 s LYS 79 Cb 0.15 0.34 -0.07 0.00 -2.06 0.00 0.00 37.83 36.20 3f65 s LYS 79 CO 0.52 -0.26 1.15 -2.00 0.10 0.00 0.00 175.35 174.86 3f65 s GLU 80 N -2.72 3.61 0.21 1.78 2.12 -0.21 -4.70 118.70 118.79 3f65 s GLU 80 Ca -0.04 1.71 0.02 0.00 0.36 0.00 0.00 54.97 57.02 3f65 s GLU 80 Cb -0.00 -2.25 -0.05 0.00 0.26 0.00 0.00 34.13 32.09 3f65 s GLU 80 CO -0.04 -0.66 0.03 -1.54 -0.54 0.00 0.00 175.26 172.50 3f65 s SER 81 N -1.52 1.37 0.17 -1.70 1.04 -1.03 -4.81 113.70 107.22 3f65 s SER 81 Ca 0.67 -1.25 0.07 0.00 0.48 0.00 0.00 55.95 55.93 3f65 s SER 81 Cb -0.27 0.10 -0.04 0.00 0.10 0.00 0.00 66.02 65.91 3f65 s SER 81 CO 0.31 -0.60 -0.15 0.68 0.98 0.00 0.00 173.24 174.46 3f65 s VAL 82 N -3.62 1.65 0.06 5.02 -7.23 -1.26 -0.79 120.40 114.23 3f65 s VAL 82 Ca 0.29 -2.02 -0.11 0.00 -1.81 0.00 0.00 61.98 58.34 3f65 s VAL 82 Cb 0.06 -1.87 0.01 0.00 0.56 0.00 0.00 36.38 35.14 3f65 s VAL 82 CO 0.08 -0.48 0.23 -0.31 -0.31 0.00 0.00 175.10 174.31 3f65 s TYR 83 N -2.55 0.02 -0.26 2.82 1.51 -0.03 -4.31 117.35 114.55 3f65 s TYR 83 Ca 0.17 -0.28 -0.17 0.00 -1.01 0.00 0.00 57.07 55.79 3f65 s TYR 83 Cb -0.03 0.01 -0.03 0.00 -0.11 0.00 0.00 41.96 41.80 3f65 s TYR 83 CO 0.06 -0.49 0.47 -1.58 -1.11 0.00 0.00 175.55 172.90 3f65 s TRP 84 N -2.93 3.26 -0.28 2.71 0.52 -0.65 0.56 118.94 122.13 3f65 s TRP 84 Ca -0.02 0.56 -0.19 0.00 0.02 0.00 0.00 56.10 56.47 3f65 s TRP 84 Cb 0.01 -2.67 -0.02 0.00 -1.15 0.00 0.00 33.47 29.63 3f65 s TRP 84 CO -0.06 -0.26 0.55 -1.17 0.02 0.00 0.00 176.95 176.03 3f65 s LEU 85 N 2.23 4.10 -0.13 2.99 2.96 0.86 0.03 118.68 131.71 3f65 s LEU 85 Ca 0.19 0.48 -0.03 0.00 -0.22 0.00 0.00 54.13 54.55 3f65 s LEU 85 Cb -0.16 -2.71 -0.03 0.00 0.50 0.00 0.00 46.19 43.79 3f65 s LEU 85 CO 0.09 -0.35 -0.02 0.20 -1.32 0.00 0.00 176.35 174.95 3f65 s ASN 86 N 1.57 4.97 -0.24 3.68 0.01 0.26 -0.78 114.94 124.42 3f65 s ASN 86 Ca 0.22 -0.02 0.02 0.00 -0.71 0.00 0.00 52.86 52.37 3f65 s ASN 86 Cb -0.15 -1.63 0.06 0.00 0.41 0.00 0.00 41.25 39.93 3f65 s ASN 86 CO 0.10 0.25 -0.09 -0.22 -1.51 0.00 0.00 177.10 175.63 3f65 s LEU 87 N -0.13 2.96 -0.25 0.60 0.20 0.40 -2.07 118.68 120.39 3f65 s LEU 87 Ca 0.03 -1.23 -0.05 0.00 0.69 0.00 0.00 54.13 53.57 3f65 s LEU 87 Cb -0.13 -1.39 -0.00 0.00 -0.43 0.00 0.00 46.19 44.24 3f65 s LEU 87 CO 0.02 -0.19 0.01 -1.58 -0.29 0.00 0.00 176.35 174.32 3f65 s GLN 88 N 1.24 3.26 0.43 1.98 2.00 0.73 -0.28 119.66 129.03 3f65 s GLN 88 Ca -0.06 -0.72 -0.02 0.00 -2.00 0.00 0.00 55.36 52.55 3f65 s GLN 88 Cb -0.19 -3.17 -0.03 0.00 0.80 0.00 0.00 33.01 30.42 3f65 s GLN 88 CO -0.06 -0.30 0.68 0.16 -0.50 0.00 0.00 175.29 175.27 3f65 s ASP 89 N 1.49 6.21 -0.33 6.67 1.47 -0.33 -0.64 116.67 131.20 3f65 s ASP 89 Ca 0.04 0.67 -0.01 0.00 1.18 0.00 0.00 52.55 54.43 3f65 s ASP 89 Cb -0.16 -2.08 0.11 0.00 -0.34 0.00 0.00 42.92 40.46 3f65 s ASP 89 CO -0.01 -0.49 0.15 -0.63 0.68 0.00 0.00 175.17 174.87 3f65 s ILE 90 N -2.56 0.49 0.82 2.11 1.01 -0.12 -4.33 121.20 118.62 3f65 s ILE 90 Ca 0.45 -1.41 -0.14 0.00 0.00 0.00 0.00 60.65 59.55 3f65 s ILE 90 Cb -0.10 -1.37 0.05 0.00 0.01 0.00 0.00 42.46 41.05 3f65 s ILE 90 CO 0.41 -0.79 0.94 -0.81 0.00 0.00 0.00 174.94 174.69 3f65 n PRO 91 N 4.63 0.11 -1.37 2.79 -0.04 -1.26 -1.41 135.00 138.46 3f65 n PRO 91 Ca 0.01 0.10 -0.32 0.00 -0.04 0.00 0.00 63.50 63.25 3f65 n PRO 91 Cb 0.40 -2.22 0.09 0.00 -0.04 0.00 0.00 33.50 31.73 3f65 n PRO 91 CO 0.00 0.00 0.00 -2.14 -0.04 0.00 0.00 175.50 173.32 3f65 s PRO 92 N -3.77 2.20 0.64 0.54 0.02 -1.26 -4.84 135.00 128.53 3f65 s PRO 92 Ca 0.69 1.44 -0.18 0.00 0.02 0.00 0.00 61.00 62.97 3f65 s PRO 92 Cb -0.29 -1.87 -0.02 0.00 0.02 0.00 0.00 34.50 32.34 3f65 s PRO 92 CO 0.55 -1.72 1.29 0.00 -0.33 0.00 0.00 177.00 176.79 3f65 s ALA 93 N -2.46 2.41 0.16 -1.55 0.00 -1.26 -4.96 121.76 114.11 3f65 s ALA 93 Ca 0.67 1.20 -0.30 0.00 0.00 0.00 0.00 51.96 53.53 3f65 s ALA 93 Cb -0.22 -3.54 -0.07 0.00 0.00 0.00 0.00 23.12 19.28 3f65 s ALA 93 CO 0.49 -1.54 1.07 -0.51 0.00 0.00 0.00 175.76 175.27 3f65 s LEU 94 N -4.30 4.49 -0.52 0.00 1.43 -1.26 -4.94 118.68 113.58 3f65 s LEU 94 Ca 0.82 2.02 -0.03 0.00 -1.03 0.00 0.00 54.13 55.91 3f65 s LEU 94 Cb -0.37 -3.60 0.20 0.00 0.03 0.00 0.00 46.19 42.45 3f65 s LEU 94 CO 0.39 -0.19 2.37 -1.84 0.23 0.00 0.00 176.35 177.32 3f65 n GLU 95 N 2.49 2.36 0.00 1.70 -0.00 -1.26 -4.92 120.64 121.00 3f65 n GLU 95 Ca 0.03 -2.49 0.00 0.00 -0.00 0.00 0.00 57.16 54.70 3f65 n GLU 95 Cb 0.47 -2.06 0.00 0.00 -0.00 0.00 0.00 31.44 29.85 3f65 n GLU 95 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 3f65 n GLY 96 N 0.28 0.87 3.69 -1.84 0.00 -1.26 -5.09 105.19 101.83 3f65 n GLY 96 Ca 0.47 -2.14 -0.36 0.00 0.00 0.00 0.00 46.02 43.98 3f65 n GLY 96 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3f65 n SER 97 N 1.41 1.48 0.00 1.61 3.41 -1.26 -4.94 113.62 115.33 3f65 n SER 97 Ca 0.00 0.76 0.00 0.00 -0.26 0.00 0.00 58.87 59.37 3f65 n SER 97 Cb 0.00 -1.50 0.00 0.00 -0.26 0.00 0.00 64.21 62.45 3f65 n SER 97 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3f65 n GLY 98 N 0.94 -2.09 3.27 5.00 0.00 -1.26 -5.11 105.19 105.95 3f65 n GLY 98 Ca 0.15 -1.45 -0.32 0.00 0.00 0.00 0.00 46.02 44.40 3f65 n GLY 98 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3f65 s ILE 99 N -1.86 2.23 -0.15 -0.61 -1.09 -1.26 -5.09 121.20 113.36 3f65 s ILE 99 Ca 0.00 -0.98 -0.02 0.00 -2.23 0.00 0.00 60.65 57.42 3f65 s ILE 99 Cb 0.00 -1.85 -0.02 0.00 -1.58 0.00 0.00 42.46 39.01 3f65 s ILE 99 CO 0.00 0.56 -0.07 0.00 -1.23 0.00 0.00 174.94 174.20 3f65 s ALA 100 N 0.08 2.84 -0.24 9.38 0.00 -1.26 -5.10 121.76 127.46 3f65 s ALA 100 Ca -0.10 -0.88 -0.10 0.00 0.00 0.00 0.00 51.96 50.87 3f65 s ALA 100 Cb -0.16 -1.44 -0.05 0.00 0.00 0.00 0.00 23.12 21.47 3f65 s ALA 100 CO 0.06 0.16 0.15 0.08 0.00 0.00 0.00 175.76 176.21 3f65 s VAL 101 N 0.48 5.32 -0.15 0.00 1.01 -1.26 -5.07 120.40 120.73 3f65 s VAL 101 Ca -0.06 0.17 -0.00 0.00 0.00 0.00 0.00 61.98 62.09 3f65 s VAL 101 Cb -0.15 -3.48 -0.01 0.00 0.00 0.00 0.00 36.38 32.75 3f65 s VAL 101 CO 0.03 0.35 -0.14 0.00 0.00 0.00 0.00 175.10 175.35 3f65 s ALA 102 N 1.01 2.56 -0.18 5.51 0.00 -1.26 -4.53 121.76 124.87 3f65 s ALA 102 Ca 0.07 -0.99 -0.04 0.00 0.00 0.00 0.00 51.96 50.99 3f65 s ALA 102 Cb -0.13 -1.25 -0.03 0.00 0.00 0.00 0.00 23.12 21.71 3f65 s ALA 102 CO 0.04 0.05 -0.02 -0.51 0.00 0.00 0.00 175.76 175.32 3f65 s LEU 103 N 0.68 3.24 -0.24 0.00 1.43 -1.26 -4.99 118.68 117.55 3f65 s LEU 103 Ca -0.07 -0.18 -0.05 0.00 -1.03 0.00 0.00 54.13 52.80 3f65 s LEU 103 Cb -0.15 -1.80 -0.01 0.00 0.03 0.00 0.00 46.19 44.25 3f65 s LEU 103 CO 0.02 0.11 0.01 -0.60 0.23 0.00 0.00 176.35 176.11 3f65 s ARG 104 N 0.73 3.46 -0.11 1.70 3.52 -1.26 -1.19 118.95 125.80 3f65 s ARG 104 Ca -0.01 -0.59 -0.03 0.00 -0.13 0.00 0.00 55.73 54.97 3f65 s ARG 104 Cb -0.14 -3.15 -0.03 0.00 -1.56 0.00 0.00 34.95 30.06 3f65 s ARG 104 CO 0.02 -0.21 0.02 -0.08 -0.81 0.00 0.00 175.30 174.24 3f65 s THR 105 N 1.53 4.43 -0.20 4.11 -1.32 0.62 -4.96 115.64 119.84 3f65 s THR 105 Ca 0.06 -0.19 -0.00 0.00 -1.21 0.00 0.00 61.69 60.34 3f65 s THR 105 Cb -0.15 -2.90 0.05 0.00 -1.51 0.00 0.00 72.50 68.00 3f65 s THR 105 CO -0.00 0.57 -0.05 -0.75 -2.21 0.00 0.00 174.62 172.18 3f65 s LYS 106 N -0.53 1.49 0.13 7.08 2.20 -1.26 -0.45 119.74 128.41 3f65 s LYS 106 Ca 0.09 -0.75 0.10 0.00 -0.36 0.00 0.00 55.97 55.06 3f65 s LYS 106 Cb -0.12 -2.32 -0.04 0.00 -1.51 0.00 0.00 37.83 33.84 3f65 s LYS 106 CO 0.02 -0.53 -0.23 -0.51 -0.36 0.00 0.00 175.35 173.74 3f65 s LEU 107 N 1.53 2.48 0.07 5.43 1.43 0.04 -4.95 118.68 124.71 3f65 s LEU 107 Ca -0.03 -0.69 -0.31 0.00 -1.03 0.00 0.00 54.13 52.08 3f65 s LEU 107 Cb -0.17 -1.34 -0.07 0.00 0.03 0.00 0.00 46.19 44.65 3f65 s LEU 107 CO -0.07 0.17 1.32 -0.54 0.23 0.00 0.00 176.35 177.47 3f65 s LYS 108 N -2.16 4.35 -0.34 1.70 1.02 -1.26 -0.10 119.74 122.96 3f65 s LYS 108 Ca 0.16 1.95 -0.04 0.00 0.02 0.00 0.00 55.97 58.06 3f65 s LYS 108 Cb -0.10 -3.34 0.06 0.00 -0.52 0.00 0.00 37.83 33.92 3f65 s LYS 108 CO 0.08 -0.40 0.08 -1.17 -0.92 0.00 0.00 175.35 173.02 3f65 s LEU 109 N 1.34 4.32 0.17 3.17 2.96 0.19 -1.12 118.68 129.71 3f65 s LEU 109 Ca 0.62 -1.38 -0.21 0.00 -0.22 0.00 0.00 54.13 52.95 3f65 s LEU 109 Cb -0.33 -1.79 -0.08 0.00 0.50 0.00 0.00 46.19 44.49 3f65 s LEU 109 CO 0.29 -0.34 0.69 -0.36 -1.32 0.00 0.00 176.35 175.31 3f65 s PHE 110 N 1.29 3.76 -0.22 5.38 0.40 0.41 -0.85 117.98 128.14 3f65 s PHE 110 Ca -0.01 1.41 -0.05 0.00 -0.60 0.00 0.00 56.93 57.68 3f65 s PHE 110 Cb -0.20 -2.61 -0.02 0.00 0.51 0.00 0.00 43.02 40.69 3f65 s PHE 110 CO -0.00 0.45 -0.01 -0.47 0.70 0.00 0.00 175.22 175.89 3f65 s TYR 111 N -1.32 3.00 -0.35 0.36 5.04 0.03 0.34 117.35 124.45 3f65 s TYR 111 Ca 0.37 -0.68 -0.01 0.00 -2.44 0.00 0.00 57.07 54.31 3f65 s TYR 111 Cb -0.19 -2.11 0.09 0.00 0.35 0.00 0.00 41.96 40.09 3f65 s TYR 111 CO 0.22 -0.41 0.09 0.50 -1.34 0.00 0.00 175.55 174.62 3f65 s ARG 112 N 1.32 2.03 0.68 4.97 3.52 -0.60 -2.47 118.95 128.41 3f65 s ARG 112 Ca 0.04 -1.64 -0.17 0.00 -0.13 0.00 0.00 55.73 53.83 3f65 s ARG 112 Cb -0.15 -3.35 -0.05 0.00 -1.56 0.00 0.00 34.95 29.85 3f65 s ARG 112 CO -0.00 -0.88 0.55 -2.30 -0.81 0.00 0.00 175.30 171.86 3f65 n PRO 113 N 4.52 0.38 -0.17 5.12 -0.02 -1.26 -0.61 135.00 142.96 3f65 n PRO 113 Ca -0.05 0.17 -0.02 0.00 -2.02 0.00 0.00 63.50 61.58 3f65 n PRO 113 Cb 0.42 -1.82 0.08 0.00 -0.02 0.00 0.00 33.50 32.16 3f65 n PRO 113 CO 0.00 0.00 0.00 1.57 1.98 0.00 0.00 175.50 179.05 3f65 h LYS 114 N -0.19 0.34 0.00 -0.52 -0.00 -1.88 -0.78 116.57 113.53 3f65 h LYS 114 Ca -0.46 -0.02 0.00 0.00 -0.00 0.00 0.00 60.65 60.17 3f65 h LYS 114 Cb 1.36 -0.08 0.00 0.00 -0.00 0.00 0.00 32.23 33.52 3f65 h LYS 114 CO 0.44 0.22 0.00 0.00 -0.00 0.00 0.00 179.45 180.11 3f65 n ALA 115 N -2.46 1.83 0.60 0.07 0.00 -1.26 -1.70 120.51 117.59 3f65 n ALA 115 Ca 0.06 -0.07 0.06 0.00 0.00 0.00 0.00 53.44 53.50 3f65 n ALA 115 Cb 0.24 -1.22 -0.06 0.00 0.00 0.00 0.00 19.45 18.41 3f65 n ALA 115 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3f65 n LEU 116 N -1.22 0.78 -0.20 0.00 4.77 -0.31 -4.62 117.00 116.20 3f65 n LEU 116 Ca 0.07 -0.55 0.00 0.00 -0.03 0.00 0.00 56.01 55.50 3f65 n LEU 116 Cb 0.09 0.00 0.11 0.00 -2.33 0.00 0.00 43.42 41.29 3f65 n LEU 116 CO 0.10 0.18 0.98 -0.07 -1.33 0.00 0.00 177.39 177.24 3f65 h LEU 117 N 0.31 0.20 -0.25 2.23 3.38 -1.18 -3.02 115.31 116.98 3f65 h LEU 117 Ca 0.00 0.08 -0.01 0.00 0.09 0.00 0.00 57.88 58.04 3f65 h LEU 117 Cb 0.33 0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.14 3f65 h LEU 117 CO 0.00 0.12 0.10 -0.33 0.09 0.00 0.00 178.44 178.42 3f65 h GLU 118 N 0.39 0.37 -0.00 1.13 5.08 -1.82 -3.25 114.58 116.48 3f65 h GLU 118 Ca 0.31 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.60 3f65 h GLU 118 Cb 0.40 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.59 3f65 h GLU 118 CO -0.32 0.41 -0.01 0.41 -1.00 0.00 0.00 179.01 178.50 3f65 n GLY 119 N -0.73 -1.17 0.19 -3.84 0.00 -1.15 -3.99 105.19 94.51 3f65 n GLY 119 Ca -0.03 -0.17 -0.11 0.00 0.00 0.00 0.00 46.02 45.72 3f65 n GLY 119 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 3f65 h ARG 120 N 0.05 -0.22 0.00 1.61 9.65 -1.59 -3.38 114.38 120.51 3f65 h ARG 120 Ca 0.00 0.01 0.00 0.00 -1.10 0.00 0.00 59.98 58.89 3f65 h ARG 120 Cb 0.20 0.05 0.00 0.00 -1.39 0.00 0.00 29.97 28.83 3f65 h ARG 120 CO 0.00 -0.15 0.00 0.36 2.80 0.00 0.00 179.97 182.98 3f65 n LYS 121 N -5.28 0.00 -3.45 0.20 -0.00 -1.26 -3.26 118.16 105.12 3f65 n LYS 121 Ca -0.05 0.00 -0.43 0.00 -0.00 0.00 0.00 58.31 57.83 3f65 n LYS 121 Cb 0.20 0.00 -0.08 0.00 -0.00 0.00 0.00 35.03 35.15 3f65 n LYS 121 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.40 177.60 3f65 s GLY 122 N 0.00 2.03 0.00 2.58 0.00 -1.26 -5.02 107.32 105.64 3f65 s GLY 122 Ca 0.00 -2.11 0.00 0.00 0.00 0.00 0.00 44.72 42.61 3f65 s GLY 122 CO 0.00 1.03 0.00 0.00 0.00 0.00 0.00 173.10 174.13 3f65 n ALA 123 N 5.13 0.00 -1.48 3.20 0.00 -1.20 -4.54 120.51 121.61 3f65 n ALA 123 Ca -0.12 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.32 3f65 n ALA 123 Cb 0.44 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.89 3f65 n ALA 123 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 3f65 n GLU 124 N -0.26 0.00 0.00 0.00 -0.58 -1.26 -4.74 120.64 113.81 3f65 n GLU 124 Ca 0.00 0.00 0.03 0.00 -0.42 0.00 0.00 57.16 56.77 3f65 n GLU 124 Cb 0.00 0.00 0.13 0.00 -0.57 0.00 0.00 31.44 31.00 3f65 n GLU 124 CO 0.00 0.00 0.00 -0.85 -0.48 0.00 0.00 177.13 175.80 3f65 n GLU 125 N 0.00 0.08 0.25 3.49 -0.00 -1.26 -0.96 120.64 122.24 3f65 n GLU 125 Ca 0.00 0.22 0.14 0.00 -0.00 0.00 0.00 57.16 57.52 3f65 n GLU 125 Cb 0.00 -1.50 0.57 0.00 -0.00 0.00 0.00 31.44 30.51 3f65 n GLU 125 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.13 177.91 3f65 h GLY 126 N 0.85 0.00 0.00 -1.84 0.00 -1.89 -3.53 103.07 96.67 3f65 h GLY 126 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3f65 h GLY 126 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 176.54 181.05 3f65 n ILE 127 N -3.25 0.00 -3.09 2.60 0.13 -0.13 -4.46 119.36 111.15 3f65 n ILE 127 Ca 0.00 0.00 -0.00 0.00 -1.10 0.00 0.00 62.75 61.65 3f65 n ILE 127 Cb 0.36 0.00 -0.00 0.00 -0.84 0.00 0.00 39.64 39.16 3f65 n ILE 127 CO 0.00 0.00 0.00 0.55 2.80 0.00 0.00 176.55 179.90 3f65 n VAL 140 N -0.00 -0.02 0.00 9.51 3.14 -1.26 0.79 118.33 130.49 3f65 n VAL 140 Ca 0.00 -0.01 0.00 0.00 -2.96 0.00 0.00 64.34 61.37 3f65 n VAL 140 Cb 0.00 -0.02 0.00 0.00 -1.06 0.00 0.00 33.84 32.76 3f65 n VAL 140 CO 0.00 0.00 0.00 -3.20 -6.46 0.00 0.00 176.83 167.17 3f65 n ASN 141 N 0.57 0.00 0.02 6.55 2.85 -1.26 -4.60 115.26 119.38 3f65 n ASN 141 Ca -0.00 0.00 0.11 0.00 -0.11 0.00 0.00 54.58 54.58 3f65 n ASN 141 Cb 0.01 0.00 0.11 0.00 1.24 0.00 0.00 39.78 41.14 3f65 n ASN 141 CO 0.00 0.00 0.00 0.41 -2.11 0.00 0.00 177.26 175.56 3f65 n THR 142 N 0.00 0.11 -1.75 -0.44 -1.04 0.24 -0.19 114.28 111.21 3f65 n THR 142 Ca 0.00 -0.13 -0.32 0.00 -2.04 0.00 0.00 64.05 61.57 3f65 n THR 142 Cb 0.00 0.27 0.04 0.00 -1.82 0.00 0.00 70.33 68.81 3f65 n THR 142 CO 0.00 0.00 0.00 0.42 -0.64 0.00 0.00 175.07 174.85 3f65 s THR 143 N -3.09 3.93 -1.25 12.58 -4.23 -1.20 -4.93 115.64 117.46 3f65 s THR 143 Ca 0.07 0.74 0.03 0.00 -1.18 0.00 0.00 61.69 61.35 3f65 s THR 143 Cb 0.16 -3.38 0.15 0.00 1.34 0.00 0.00 72.50 70.77 3f65 s THR 143 CO 0.76 -0.72 0.87 -2.65 -0.54 0.00 0.00 174.62 172.35 3f65 n PRO 144 N -2.71 1.63 -4.33 3.99 -0.02 -1.26 -4.46 135.00 127.85 3f65 n PRO 144 Ca 0.08 -0.60 -0.27 0.00 -2.02 0.00 0.00 63.50 60.70 3f65 n PRO 144 Cb 0.53 -1.47 -0.10 0.00 -0.02 0.00 0.00 33.50 32.45 3f65 n PRO 144 CO 0.00 0.00 0.00 0.71 1.98 0.00 0.00 175.50 178.19 3f65 s TYR 145 N -1.51 2.54 -0.26 6.00 1.51 -1.26 -1.05 117.35 123.33 3f65 s TYR 145 Ca 0.11 -0.26 -0.10 0.00 -1.01 0.00 0.00 57.07 55.81 3f65 s TYR 145 Cb 0.07 -1.24 -0.05 0.00 -0.11 0.00 0.00 41.96 40.63 3f65 s TYR 145 CO 0.04 0.52 0.16 0.42 -1.11 0.00 0.00 175.55 175.58 3f65 s ILE 146 N -1.72 5.17 0.17 2.71 1.01 -1.26 -3.79 121.20 123.48 3f65 s ILE 146 Ca 0.24 0.12 0.06 0.00 0.00 0.00 0.00 60.65 61.07 3f65 s ILE 146 Cb -0.08 -3.43 -0.04 0.00 0.01 0.00 0.00 42.46 38.91 3f65 s ILE 146 CO 0.14 0.30 0.09 -0.36 0.00 0.00 0.00 174.94 175.10 3f65 s PHE 147 N 1.46 3.03 -0.16 3.97 0.40 -0.44 -4.93 117.98 121.32 3f65 s PHE 147 Ca 0.07 -0.06 -0.04 0.00 -0.60 0.00 0.00 56.93 56.29 3f65 s PHE 147 Cb -0.15 -1.46 -0.03 0.00 0.51 0.00 0.00 43.02 41.89 3f65 s PHE 147 CO 0.08 0.52 -0.02 0.00 0.70 0.00 0.00 175.22 176.50 3f65 s ALA 148 N -1.75 3.09 0.00 5.36 0.00 -1.26 -0.83 121.76 126.38 3f65 s ALA 148 Ca 0.30 -0.80 0.00 0.00 0.00 0.00 0.00 51.96 51.45 3f65 s ALA 148 Cb -0.10 -1.62 0.00 0.00 0.00 0.00 0.00 23.12 21.40 3f65 s ALA 148 CO 0.22 0.22 0.05 0.00 0.00 0.00 0.00 175.76 176.25 3f65 n GLN 168 N 3.48 0.00 -0.00 0.00 10.64 -1.26 -3.99 117.38 126.24 3f65 n GLN 168 Ca -0.17 0.05 0.16 0.00 -1.83 0.00 0.00 57.00 55.20 3f65 n GLN 168 Cb 0.52 -0.35 0.89 0.00 -0.86 0.00 0.00 30.24 30.45 3f65 n GLN 168 CO 0.00 0.00 0.00 1.17 -1.83 0.00 0.00 177.06 176.40 3f65 n LYS 169 N -0.13 1.08 0.00 2.61 4.81 -1.26 -3.07 118.16 122.19 3f65 n LYS 169 Ca 0.00 -0.12 0.12 0.00 -0.87 0.00 0.00 58.31 57.44 3f65 n LYS 169 Cb 0.00 -1.49 0.20 0.00 0.02 0.00 0.00 35.03 33.75 3f65 n LYS 169 CO 0.00 0.00 0.00 -0.11 1.17 0.00 0.00 177.40 178.46 3f65 n LEU 170 N -0.85 0.61 0.21 3.14 7.94 -1.26 -3.55 117.00 123.24 3f65 n LEU 170 Ca 0.23 -0.09 0.12 0.00 -1.11 0.00 0.00 56.01 55.16 3f65 n LEU 170 Cb 0.14 -0.20 0.17 0.00 0.53 0.00 0.00 43.42 44.06 3f65 n LEU 170 CO 0.18 0.15 0.77 -0.07 -1.11 0.00 0.00 177.39 177.30 3f65 h LEU 171 N 0.07 0.00 -5.70 -1.96 3.38 -1.81 -3.36 115.31 105.93 3f65 h LEU 171 Ca 0.00 -0.00 -0.56 0.00 0.09 0.00 0.00 57.88 57.41 3f65 h LEU 171 Cb 0.50 0.00 -0.41 0.00 0.09 0.00 0.00 40.66 40.84 3f65 h LEU 171 CO 0.00 0.00 -0.84 0.80 0.09 0.00 0.00 178.44 178.49 3f65 n MET 172 N -3.03 2.24 -2.49 1.13 1.56 -1.23 -4.15 117.12 111.15 3f65 n MET 172 Ca 0.04 -4.25 -0.39 0.00 -0.27 0.00 0.00 57.70 52.82 3f65 n MET 172 Cb 0.53 -1.99 -0.03 0.00 2.15 0.00 0.00 33.22 33.87 3f65 n MET 172 CO 0.00 0.00 0.00 0.12 -0.73 0.00 0.00 175.97 175.36 3f65 s PHE 173 N -2.80 2.39 0.57 1.12 5.36 -0.01 -4.92 117.98 119.69 3f65 s PHE 173 Ca 0.44 -0.51 -0.16 0.00 -0.96 0.00 0.00 56.93 55.74 3f65 s PHE 173 Cb 0.27 -4.60 -0.05 0.00 -0.34 0.00 0.00 43.02 38.30 3f65 s PHE 173 CO -0.10 -1.95 1.04 -1.64 -1.46 0.00 0.00 175.22 171.11 3f65 s MET 174 N 5.38 3.49 -0.11 10.12 -1.94 -1.26 -1.32 119.30 133.66 3f65 s MET 174 Ca 0.48 1.13 -0.35 0.00 -1.71 0.00 0.00 55.69 55.24 3f65 s MET 174 Cb -0.02 -2.06 -0.12 0.00 2.01 0.00 0.00 34.83 34.63 3f65 s MET 174 CO -0.04 -0.66 1.86 -2.30 -0.01 0.00 0.00 175.02 173.87 3f65 n PRO 175 N -1.91 2.05 -0.06 2.03 -0.02 -1.25 -1.02 135.00 134.82 3f65 n PRO 175 Ca 0.08 0.75 0.00 0.00 -2.02 0.00 0.00 63.50 62.31 3f65 n PRO 175 Cb 0.53 -2.58 0.00 0.00 -0.02 0.00 0.00 33.50 31.43 3f65 n PRO 175 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3f65 n GLY 176 N 4.38 0.59 0.10 -1.23 0.00 0.74 -5.04 105.19 104.73 3f65 n GLY 176 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.25 3f65 n GLY 176 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3f65 n ASP 177 N 0.00 0.00 -4.08 1.61 9.92 -0.19 -4.88 116.55 118.93 3f65 n ASP 177 Ca 0.00 0.00 -0.23 0.00 -0.53 0.00 0.00 54.79 54.03 3f65 n ASP 177 Cb 0.00 -0.18 -0.15 0.00 -0.64 0.00 0.00 41.12 40.15 3f65 n ASP 177 CO 0.00 0.00 0.00 -0.44 0.13 0.00 0.00 177.20 176.89 3f65 s SER 190 N -2.23 1.67 0.00 -2.24 0.01 -1.26 -4.43 113.70 105.22 3f65 s SER 190 Ca 0.00 -0.26 0.00 0.00 1.31 0.00 0.00 55.95 57.00 3f65 s SER 190 Cb 0.00 -0.34 0.00 0.00 0.21 0.00 0.00 66.02 65.89 3f65 s SER 190 CO 0.00 0.14 0.00 0.18 0.41 0.00 0.00 173.24 173.97 3f65 n LEU 191 N 3.01 0.00 0.00 2.44 4.32 -1.26 -1.03 117.00 124.48 3f65 n LEU 191 Ca -0.16 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.83 3f65 n LEU 191 Cb 0.54 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.34 3f65 n LEU 191 CO 0.25 0.00 0.00 -0.46 -1.22 0.00 0.00 177.39 175.96 3f65 n ASN 192 N 0.00 0.00 0.00 -1.43 6.94 -1.26 -4.75 115.26 114.76 3f65 n ASN 192 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 54.58 54.56 3f65 n ASN 192 Cb 0.00 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.42 3f65 n ASN 192 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3f65 n GLY 195 N 0.00 1.62 0.00 4.83 0.00 -1.26 -5.08 105.19 105.30 3f65 n GLY 195 Ca 0.00 -0.36 0.00 0.00 0.00 0.00 0.00 46.02 45.66 3f65 n GLY 195 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 3f65 n GLU 196 N 0.00 3.42 -3.69 1.61 0.00 -1.26 -5.10 120.64 115.62 3f65 n GLU 196 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 57.16 57.06 3f65 n GLU 196 Cb 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 31.44 31.33 3f65 n GLU 196 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.13 176.62 3f65 s LEU 197 N 0.00 -0.13 0.00 -1.84 1.43 -1.26 -4.48 118.68 112.39 3f65 s LEU 197 Ca 0.00 0.93 0.13 0.00 -1.03 0.00 0.00 54.13 54.16 3f65 s LEU 197 Cb 0.00 1.41 0.11 0.00 0.03 0.00 0.00 46.19 47.74 3f65 s LEU 197 CO 0.00 -0.20 0.92 1.67 0.23 0.00 0.00 176.35 178.98