#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fk5 s LEU 2 N 0.00 2.50 0.14 4.03 1.43 -1.26 -4.96 118.68 120.56 3fk5 s LEU 2 Ca 0.00 0.89 -0.29 0.00 -1.03 0.00 0.00 54.13 53.70 3fk5 s LEU 2 Cb 0.00 -3.42 -0.07 0.00 0.03 0.00 0.00 46.19 42.73 3fk5 s LEU 2 CO 0.00 -1.91 0.92 -0.36 0.23 0.00 0.00 176.35 175.23 3fk5 s PHE 3 N -3.48 3.86 -0.20 0.29 0.40 0.37 -4.97 117.98 114.24 3fk5 s PHE 3 Ca 0.62 1.78 0.05 0.00 -0.60 0.00 0.00 56.93 58.78 3fk5 s PHE 3 Cb -0.12 -2.99 -0.21 0.00 0.51 0.00 0.00 43.02 40.22 3fk5 s PHE 3 CO 0.50 0.30 0.02 1.04 0.70 0.00 0.00 175.22 177.79 3fk5 n GLN 4 N 2.36 0.68 -2.21 0.44 1.13 -1.26 -4.65 117.38 113.87 3fk5 n GLN 4 Ca 0.00 0.14 -0.19 0.00 -1.94 0.00 0.00 57.00 55.01 3fk5 n GLN 4 Cb 0.49 -1.57 0.02 0.00 0.11 0.00 0.00 30.24 29.29 3fk5 n GLN 4 CO 0.00 0.00 0.00 0.09 -1.44 0.00 0.00 177.06 175.71 3fk5 n ASN 5 N -3.15 4.24 -4.23 1.08 3.02 -1.26 -4.98 115.26 109.98 3fk5 n ASN 5 Ca -0.38 -3.41 -0.33 0.00 -0.03 0.00 0.00 54.58 50.44 3fk5 n ASN 5 Cb 1.05 -0.37 -0.16 0.00 -0.61 0.00 0.00 39.78 39.68 3fk5 n ASN 5 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 3fk5 s VAL 6 N -4.48 2.35 0.33 2.41 1.01 -1.26 -1.23 120.40 119.52 3fk5 s VAL 6 Ca 0.46 -0.89 0.06 0.00 0.00 0.00 0.00 61.98 61.61 3fk5 s VAL 6 Cb 0.39 -1.95 -0.06 0.00 0.00 0.00 0.00 36.38 34.76 3fk5 s VAL 6 CO 0.01 0.54 -0.01 -0.44 0.00 0.00 0.00 175.10 175.21 3fk5 s SER 7 N 0.65 2.94 -0.40 3.32 0.01 -0.65 -1.26 113.70 118.32 3fk5 s SER 7 Ca -0.10 -1.29 -0.15 0.00 1.31 0.00 0.00 55.95 55.72 3fk5 s SER 7 Cb -0.16 -0.20 0.01 0.00 0.21 0.00 0.00 66.02 65.88 3fk5 s SER 7 CO 0.02 -0.44 0.32 -0.63 0.41 0.00 0.00 173.24 172.91 3fk5 s ILE 8 N -3.01 5.23 -0.06 1.44 -1.09 0.35 -1.47 121.20 122.59 3fk5 s ILE 8 Ca 0.33 -0.49 0.14 0.00 -2.23 0.00 0.00 60.65 58.39 3fk5 s ILE 8 Cb 0.07 -3.90 -0.15 0.00 -1.58 0.00 0.00 42.46 36.89 3fk5 s ILE 8 CO 0.15 -0.26 0.95 0.00 -1.23 0.00 0.00 174.94 174.54 3fk5 h ALA 9 N 8.61 0.64 -2.35 9.38 0.00 -0.08 -3.33 119.26 132.13 3fk5 h ALA 9 Ca -0.28 -0.99 -0.06 0.00 0.00 0.00 0.00 54.91 53.58 3fk5 h ALA 9 Cb 1.13 0.22 -0.17 0.00 0.00 0.00 0.00 17.79 18.96 3fk5 h ALA 9 CO 0.72 1.14 0.10 0.20 0.00 0.00 0.00 179.25 181.41 3fk5 s GLY 10 N -4.83 -0.49 -0.24 0.00 0.00 -1.01 -3.93 107.32 96.83 3fk5 s GLY 10 Ca -0.02 0.86 -0.16 0.00 0.00 0.00 0.00 44.72 45.40 3fk5 s GLY 10 CO 0.81 0.54 0.60 -2.27 0.00 0.00 0.00 173.10 172.78 3fk5 s LEU 11 N -1.69 -0.54 0.18 0.66 2.96 -1.26 -0.72 118.68 118.28 3fk5 s LEU 11 Ca -0.08 1.27 -0.11 0.00 -0.22 0.00 0.00 54.13 54.99 3fk5 s LEU 11 Cb -0.01 2.04 0.00 0.00 0.50 0.00 0.00 46.19 48.73 3fk5 s LEU 11 CO 0.02 -0.22 0.37 0.00 -1.32 0.00 0.00 176.35 175.20 3fk5 s ALA 12 N 1.14 -0.25 0.10 5.97 0.00 -0.70 -4.76 121.76 123.27 3fk5 s ALA 12 Ca -0.07 -0.73 -0.03 0.00 0.00 0.00 0.00 51.96 51.13 3fk5 s ALA 12 Cb -0.06 0.89 -0.03 0.00 0.00 0.00 0.00 23.12 23.93 3fk5 s ALA 12 CO -0.11 -0.71 0.08 -3.38 0.00 0.00 0.00 175.76 171.63 3fk5 s HIS 13 N -3.95 0.59 -0.06 0.00 -3.43 -1.26 -1.44 115.29 105.73 3fk5 s HIS 13 Ca 0.16 -1.02 0.02 0.00 -0.80 0.00 0.00 55.06 53.42 3fk5 s HIS 13 Cb 0.02 -0.33 0.01 0.00 -1.43 0.00 0.00 32.58 30.85 3fk5 s HIS 13 CO 0.01 -0.51 -0.12 0.08 -2.00 0.00 0.00 174.74 172.20 3fk5 s VAL 14 N -3.97 1.14 -0.03 -5.38 1.01 -0.04 -4.92 120.40 108.20 3fk5 s VAL 14 Ca 0.15 -0.49 -0.23 0.00 0.00 0.00 0.00 61.98 61.41 3fk5 s VAL 14 Cb 0.07 -1.03 -0.04 0.00 0.00 0.00 0.00 36.38 35.37 3fk5 s VAL 14 CO -0.04 0.35 0.67 -1.81 0.00 0.00 0.00 175.10 174.27 3fk5 s ASP 15 N 0.58 7.01 0.49 3.32 1.01 -1.26 -2.00 116.67 125.81 3fk5 s ASP 15 Ca -0.13 1.20 -0.19 0.00 0.71 0.00 0.00 52.55 54.14 3fk5 s ASP 15 Cb -0.15 -2.40 -0.08 0.00 1.01 0.00 0.00 42.92 41.30 3fk5 s ASP 15 CO 0.03 -0.03 1.02 0.00 0.21 0.00 0.00 175.17 176.40 3fk5 s ALA 16 N 0.37 2.91 0.15 5.23 0.00 -1.26 -4.94 121.76 124.21 3fk5 s ALA 16 Ca 0.35 0.49 0.04 0.00 0.00 0.00 0.00 51.96 52.84 3fk5 s ALA 16 Cb -0.18 -3.21 -0.06 0.00 0.00 0.00 0.00 23.12 19.66 3fk5 s ALA 16 CO 0.18 -0.28 1.35 -1.00 0.00 0.00 0.00 175.76 176.01 3fk5 h PRO 17 N 1.41 0.13 -5.53 0.00 0.13 -1.92 -3.42 132.00 122.79 3fk5 h PRO 17 Ca -0.49 -0.16 -0.59 0.00 -0.87 0.00 0.00 66.00 63.90 3fk5 h PRO 17 Cb 1.21 0.05 -0.10 0.00 0.13 0.00 0.00 31.00 32.29 3fk5 h PRO 17 CO 0.59 0.96 -0.24 -1.01 -0.23 0.00 0.00 178.00 178.07 3fk5 s HIS 18 N -3.04 3.45 -0.18 1.56 3.76 -0.56 -4.93 115.29 115.35 3fk5 s HIS 18 Ca -0.02 0.67 -0.20 0.00 -0.15 0.00 0.00 55.06 55.37 3fk5 s HIS 18 Cb 0.10 -2.45 -0.03 0.00 1.11 0.00 0.00 32.58 31.31 3fk5 s HIS 18 CO 0.82 0.14 0.56 0.99 -0.85 0.00 0.00 174.74 176.41 3fk5 s THR 19 N 0.76 5.08 -0.36 1.30 2.01 -1.26 -1.03 115.64 122.14 3fk5 s THR 19 Ca 0.20 1.07 -0.06 0.00 0.31 0.00 0.00 61.69 63.21 3fk5 s THR 19 Cb -0.14 -3.89 0.06 0.00 0.01 0.00 0.00 72.50 68.54 3fk5 s THR 19 CO 0.07 0.18 0.13 -0.22 -0.69 0.00 0.00 174.62 174.09 3fk5 s LEU 20 N 1.52 4.56 0.58 4.42 2.96 0.17 -4.99 118.68 127.91 3fk5 s LEU 20 Ca 0.27 -1.38 -0.17 0.00 -0.22 0.00 0.00 54.13 52.63 3fk5 s LEU 20 Cb -0.16 -1.86 -0.04 0.00 0.50 0.00 0.00 46.19 44.64 3fk5 s LEU 20 CO 0.11 -0.39 1.08 0.42 -1.32 0.00 0.00 176.35 176.24 3fk5 s THR 21 N 1.34 3.56 0.30 3.68 -4.23 -1.26 -1.97 115.64 117.07 3fk5 s THR 21 Ca 0.00 0.81 0.09 0.00 -1.18 0.00 0.00 61.69 61.41 3fk5 s THR 21 Cb -0.21 -3.31 0.03 0.00 1.34 0.00 0.00 72.50 70.35 3fk5 s THR 21 CO 0.01 -0.37 1.69 0.28 -0.54 0.00 0.00 174.62 175.69 3fk5 h SER 22 N 0.65 0.12 -0.42 3.99 0.02 -0.95 -2.69 113.55 114.27 3fk5 h SER 22 Ca -0.48 -0.05 0.09 0.00 -0.84 0.00 0.00 61.79 60.50 3fk5 h SER 22 Cb 1.23 -0.03 -0.09 0.00 0.14 0.00 0.00 62.40 63.65 3fk5 h SER 22 CO 0.57 0.58 -0.17 0.50 -1.14 0.00 0.00 176.83 177.17 3fk5 h LYS 23 N 0.09 -0.09 -0.08 3.45 3.64 -1.92 0.29 116.57 121.95 3fk5 h LYS 23 Ca 0.00 0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.39 3fk5 h LYS 23 Cb 0.88 0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 32.72 3fk5 h LYS 23 CO 0.07 -0.06 0.04 1.49 -2.27 0.00 0.00 179.45 178.73 3fk5 h GLU 24 N -0.09 0.11 -0.70 1.90 4.81 -1.90 -2.13 114.58 116.58 3fk5 h GLU 24 Ca 0.20 -0.01 0.11 0.00 -0.13 0.00 0.00 59.36 59.53 3fk5 h GLU 24 Cb 0.40 -0.02 -0.08 0.00 0.63 0.00 0.00 28.75 29.68 3fk5 h GLU 24 CO -0.48 0.14 0.31 0.82 -0.73 0.00 0.00 179.01 179.07 3fk5 h ILE 25 N 0.05 0.77 0.00 2.32 2.04 -1.13 -2.50 117.51 119.06 3fk5 h ILE 25 Ca 0.03 -0.17 -0.02 0.00 1.00 0.00 0.00 64.86 65.70 3fk5 h ILE 25 Cb 0.06 0.22 -0.00 0.00 -0.74 0.00 0.00 36.82 36.35 3fk5 h ILE 25 CO -0.00 0.09 -0.08 0.78 0.00 0.00 0.00 178.15 178.94 3fk5 h ASN 26 N 0.51 0.00 0.45 1.72 2.35 0.24 -0.66 115.58 120.18 3fk5 h ASN 26 Ca 0.36 0.00 -0.10 0.00 -0.55 0.00 0.00 56.30 56.01 3fk5 h ASN 26 Cb 0.45 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.81 3fk5 h ASN 26 CO -0.32 0.08 -0.48 1.23 -1.65 0.00 0.00 177.43 176.29 3fk5 h GLY 27 N 0.34 0.03 1.92 2.83 0.00 -1.15 -0.33 103.07 106.71 3fk5 h GLY 27 Ca -0.00 -0.03 -0.17 0.00 0.00 0.00 0.00 47.33 47.13 3fk5 h GLY 27 CO 0.01 0.03 -0.83 3.21 0.00 0.00 0.00 176.54 178.96 3fk5 h ARG 28 N 0.03 0.00 0.00 4.80 3.08 -1.14 -3.32 114.38 117.83 3fk5 h ARG 28 Ca -0.00 0.00 -0.06 0.00 0.07 0.00 0.00 59.98 59.98 3fk5 h ARG 28 Cb 0.86 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.90 3fk5 h ARG 28 CO 0.06 0.73 -0.31 -0.07 -1.07 0.00 0.00 179.97 179.32 3fk5 h LEU 29 N 0.00 0.00 -0.70 3.04 3.38 -0.83 -3.40 115.31 116.80 3fk5 h LEU 29 Ca -0.02 0.00 0.15 0.00 0.09 0.00 0.00 57.88 58.09 3fk5 h LEU 29 Cb 1.60 0.00 -0.13 0.00 0.09 0.00 0.00 40.66 42.23 3fk5 h LEU 29 CO 0.10 0.31 -0.09 -0.61 0.09 0.00 0.00 178.44 178.23 3fk5 h GLN 30 N 0.00 0.04 -0.89 1.13 5.75 -1.17 -0.27 115.11 119.70 3fk5 h GLN 30 Ca -0.00 -0.00 -0.00 0.00 -0.15 0.00 0.00 58.65 58.49 3fk5 h GLN 30 Cb 1.18 -0.01 -0.04 0.00 1.07 0.00 0.00 27.48 29.68 3fk5 h GLN 30 CO 0.04 0.03 0.55 -1.35 -2.65 0.00 0.00 178.83 175.44 3fk5 h PRO 31 N 0.04 1.20 -0.30 -2.39 0.11 -1.84 0.01 132.00 128.84 3fk5 h PRO 31 Ca 0.36 -0.10 -0.04 0.00 0.11 0.00 0.00 66.00 66.32 3fk5 h PRO 31 Cb 0.58 -0.26 -0.01 0.00 0.11 0.00 0.00 31.00 31.43 3fk5 h PRO 31 CO -0.68 0.84 0.03 1.15 -0.21 0.00 0.00 178.00 179.13 3fk5 h THR 32 N 1.22 1.24 -0.66 -1.15 2.02 -1.39 -1.31 112.91 112.88 3fk5 h THR 32 Ca 0.32 -0.86 0.13 0.00 0.77 0.00 0.00 66.41 66.76 3fk5 h THR 32 Cb -0.06 1.23 -0.09 0.00 -1.74 0.00 0.00 68.15 67.48 3fk5 h THR 32 CO -0.06 0.28 0.18 1.88 0.37 0.00 0.00 175.52 178.17 3fk5 h TYR 33 N 0.32 0.30 0.42 3.16 0.99 -0.70 -1.55 116.97 119.90 3fk5 h TYR 33 Ca 0.09 0.04 -0.02 0.00 2.00 0.00 0.00 58.73 60.83 3fk5 h TYR 33 Cb 0.38 -0.03 0.00 0.00 1.00 0.00 0.00 36.73 38.08 3fk5 h TYR 33 CO 0.03 -0.01 -0.20 -0.44 -0.00 0.00 0.00 178.16 177.54 3fk5 h ASP 34 N 0.31 -0.48 -0.51 3.88 3.32 -0.71 0.14 116.42 122.38 3fk5 h ASP 34 Ca 0.36 -0.01 0.05 0.00 0.02 0.00 0.00 57.03 57.44 3fk5 h ASP 34 Cb 0.54 0.12 -0.03 0.00 0.22 0.00 0.00 39.33 40.18 3fk5 h ASP 34 CO -0.42 -0.31 0.34 -0.09 -1.72 0.00 0.00 179.24 177.05 3fk5 h ARG 35 N -0.61 0.49 -0.00 3.56 2.43 -1.01 0.32 114.38 119.56 3fk5 h ARG 35 Ca -0.06 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.08 3fk5 h ARG 35 Cb 0.46 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 29.90 3fk5 h ARG 35 CO 0.09 0.33 -0.16 1.28 -1.51 0.00 0.00 179.97 180.01 3fk5 n LEU 36 N -4.47 0.40 0.00 3.80 4.77 -0.61 -4.94 117.00 115.96 3fk5 n LEU 36 Ca 0.06 0.09 0.00 0.00 -0.03 0.00 0.00 56.01 56.13 3fk5 n LEU 36 Cb 0.20 -0.25 0.00 0.00 -2.33 0.00 0.00 43.42 41.04 3fk5 n LEU 36 CO 0.35 0.08 0.00 0.61 -1.33 0.00 0.00 177.39 177.10 3fk5 n GLY 37 N 1.35 0.45 3.63 -0.72 0.00 0.10 -5.02 105.19 104.99 3fk5 n GLY 37 Ca 0.12 -0.97 -0.35 0.00 0.00 0.00 0.00 46.02 44.82 3fk5 n GLY 37 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3fk5 s ILE 38 N -2.00 4.23 -0.21 -0.61 1.01 -0.12 -4.98 121.20 118.52 3fk5 s ILE 38 Ca 0.00 -0.27 0.03 0.00 0.00 0.00 0.00 60.65 60.42 3fk5 s ILE 38 Cb 0.00 -2.80 -0.02 0.00 0.01 0.00 0.00 42.46 39.64 3fk5 s ILE 38 CO 0.00 0.56 0.23 0.29 0.00 0.00 0.00 174.94 176.03 3fk5 n LYS 39 N 2.60 4.64 -2.57 2.79 4.76 -1.26 -4.27 118.16 124.85 3fk5 n LYS 39 Ca -0.18 -0.14 -0.41 0.00 -2.87 0.00 0.00 58.31 54.70 3fk5 n LYS 39 Cb 0.53 -0.74 -0.04 0.00 -1.84 0.00 0.00 35.03 32.95 3fk5 n LYS 39 CO 0.00 0.00 0.00 0.99 -1.37 0.00 0.00 177.40 177.02 3fk5 s THR 40 N -1.10 4.13 -1.10 -0.18 2.01 -1.26 -4.97 115.64 113.17 3fk5 s THR 40 Ca 0.02 1.75 -0.22 0.00 0.31 0.00 0.00 61.69 63.55 3fk5 s THR 40 Cb 0.03 -4.12 0.04 0.00 0.01 0.00 0.00 72.50 68.46 3fk5 s THR 40 CO 0.11 0.26 1.59 -0.62 -0.69 0.00 0.00 174.62 175.28 3fk5 s ASP 41 N 0.15 6.44 0.15 3.53 -1.08 -1.26 -4.86 116.67 119.74 3fk5 s ASP 41 Ca 0.50 -1.69 -0.14 0.00 -0.52 0.00 0.00 52.55 50.70 3fk5 s ASP 41 Cb -0.27 -2.57 0.04 0.00 -1.46 0.00 0.00 42.92 38.65 3fk5 s ASP 41 CO 0.32 -1.57 1.73 0.58 0.52 0.00 0.00 175.17 176.75 3fk5 h VAL 42 N 6.45 1.20 0.91 1.11 2.07 -1.96 0.18 116.25 126.21 3fk5 h VAL 42 Ca 0.27 -0.57 -0.04 0.00 0.82 0.00 0.00 66.70 67.17 3fk5 h VAL 42 Cb 0.97 0.66 0.01 0.00 -1.52 0.00 0.00 31.29 31.41 3fk5 h VAL 42 CO 1.41 0.22 -0.45 -0.07 0.02 0.00 0.00 177.57 178.71 3fk5 h LEU 43 N 0.65 -1.06 0.21 2.57 3.38 -1.89 0.84 115.31 120.02 3fk5 h LEU 43 Ca 0.17 0.04 -0.34 0.00 0.09 0.00 0.00 57.88 57.83 3fk5 h LEU 43 Cb 0.14 0.28 0.02 0.00 0.09 0.00 0.00 40.66 41.19 3fk5 h LEU 43 CO -0.02 -0.75 -1.64 1.23 0.09 0.00 0.00 178.44 177.35 3fk5 h GLY 44 N -1.23 0.50 1.11 0.83 0.00 -1.62 -0.52 103.07 102.13 3fk5 h GLY 44 Ca -0.12 -1.28 -0.29 0.00 0.00 0.00 0.00 47.33 45.63 3fk5 h GLY 44 CO 0.20 1.12 -1.63 -0.55 0.00 0.00 0.00 176.54 175.69 3fk5 h ASP 45 N 0.12 0.13 0.00 0.19 3.32 -1.12 -3.26 116.42 115.81 3fk5 h ASP 45 Ca -0.31 -0.24 -0.23 0.00 0.02 0.00 0.00 57.03 56.27 3fk5 h ASP 45 Cb 2.12 -0.04 -0.03 0.00 0.22 0.00 0.00 39.33 41.59 3fk5 h ASP 45 CO 0.21 1.21 -1.67 0.55 -1.72 0.00 0.00 179.24 177.82 3fk5 n VAL 46 N -3.22 1.51 0.24 -1.35 3.14 -1.05 -4.57 118.33 113.03 3fk5 n VAL 46 Ca -0.17 -0.10 0.11 0.00 -2.96 0.00 0.00 64.34 61.22 3fk5 n VAL 46 Cb 1.04 -2.11 0.55 0.00 -1.06 0.00 0.00 33.84 32.25 3fk5 n VAL 46 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 3fk5 h ALA 47 N -0.95 1.08 -0.22 1.55 0.00 -0.69 -3.38 119.26 116.65 3fk5 h ALA 47 Ca -0.35 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 54.36 3fk5 h ALA 47 Cb 1.26 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 19.02 3fk5 h ALA 47 CO -0.21 0.23 -0.04 0.41 0.00 0.00 0.00 179.25 179.63 3fk5 n GLY 48 N -0.08 0.35 3.36 0.00 0.00 -0.62 -0.35 105.19 107.86 3fk5 n GLY 48 Ca -0.00 -0.86 -0.37 0.00 0.00 0.00 0.00 46.02 44.79 3fk5 n GLY 48 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 3fk5 s ILE 49 N -2.09 3.95 -0.08 -0.61 2.07 -0.30 -4.04 121.20 120.10 3fk5 s ILE 49 Ca 0.00 -0.53 0.21 0.00 -1.41 0.00 0.00 60.65 58.92 3fk5 s ILE 49 Cb 0.00 -2.95 -0.31 0.00 0.13 0.00 0.00 42.46 39.33 3fk5 s ILE 49 CO 0.00 0.20 0.40 1.41 -1.91 0.00 0.00 174.94 175.04 3fk5 n HIS 50 N 4.87 0.04 -3.44 3.50 8.25 0.43 -3.66 115.22 125.19 3fk5 n HIS 50 Ca -0.16 0.01 -0.13 0.00 -0.26 0.00 0.00 57.72 57.18 3fk5 n HIS 50 Cb 0.49 -0.64 -0.03 0.00 1.12 0.00 0.00 29.99 30.94 3fk5 n HIS 50 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3fk5 s ALA 51 N -3.26 -1.62 0.15 -1.41 0.00 -0.71 -0.35 121.76 114.55 3fk5 s ALA 51 Ca -0.08 0.65 -0.06 0.00 0.00 0.00 0.00 51.96 52.47 3fk5 s ALA 51 Cb 0.12 0.71 -0.02 0.00 0.00 0.00 0.00 23.12 23.93 3fk5 s ALA 51 CO 0.89 -0.69 0.19 -0.98 0.00 0.00 0.00 175.76 175.17 3fk5 s ARG 52 N -3.23 1.06 0.13 0.00 3.03 -0.83 -2.94 118.95 116.17 3fk5 s ARG 52 Ca -0.01 -1.28 0.04 0.00 2.03 0.00 0.00 55.73 56.51 3fk5 s ARG 52 Cb -0.01 0.32 -0.04 0.00 -1.03 0.00 0.00 34.95 34.20 3fk5 s ARG 52 CO -0.08 -0.35 0.11 1.03 -1.13 0.00 0.00 175.30 174.87 3fk5 s ARG 53 N -4.00 2.87 0.04 3.89 1.81 -1.26 -0.66 118.95 121.65 3fk5 s ARG 53 Ca 0.20 -0.82 0.04 0.00 -1.72 0.00 0.00 55.73 53.43 3fk5 s ARG 53 Cb 0.05 -2.66 -0.02 0.00 -0.45 0.00 0.00 34.95 31.86 3fk5 s ARG 53 CO 0.00 0.51 -0.12 -0.51 -0.68 0.00 0.00 175.30 174.50 3fk5 s LEU 54 N -2.85 2.20 0.75 2.53 1.43 -0.20 -1.56 118.68 120.98 3fk5 s LEU 54 Ca 0.30 -0.48 -0.12 0.00 -1.03 0.00 0.00 54.13 52.81 3fk5 s LEU 54 Cb -0.11 -0.49 0.04 0.00 0.03 0.00 0.00 46.19 45.67 3fk5 s LEU 54 CO 0.23 -0.03 1.13 0.26 0.23 0.00 0.00 176.35 178.17 3fk5 s TRP 55 N -0.97 3.15 0.72 0.29 0.52 -1.26 -1.50 118.94 119.89 3fk5 s TRP 55 Ca -0.01 0.90 -0.16 0.00 0.02 0.00 0.00 56.10 56.85 3fk5 s TRP 55 Cb -0.08 -3.26 -0.04 0.00 -1.15 0.00 0.00 33.47 28.93 3fk5 s TRP 55 CO 0.01 -1.45 0.51 -0.25 0.02 0.00 0.00 176.95 175.79 3fk5 n ASP 56 N -3.14 -1.25 -0.29 2.95 8.00 -1.26 -4.88 116.55 116.68 3fk5 n ASP 56 Ca 0.07 0.59 0.15 0.00 0.71 0.00 0.00 54.79 56.32 3fk5 n ASP 56 Cb 0.59 -1.21 0.41 0.00 -0.02 0.00 0.00 41.12 40.90 3fk5 n ASP 56 CO 0.00 0.00 0.00 1.56 -0.39 0.00 0.00 177.20 178.37 3fk5 h GLN 57 N -0.36 0.58 -0.58 -1.24 7.50 -2.04 -2.70 115.11 116.26 3fk5 h GLN 57 Ca -0.45 -0.04 -0.40 0.00 0.50 0.00 0.00 58.65 58.26 3fk5 h GLN 57 Cb 1.35 -0.13 -0.28 0.00 0.05 0.00 0.00 27.48 28.47 3fk5 h GLN 57 CO 0.42 0.39 -0.38 -0.25 -1.50 0.00 0.00 178.83 177.51 3fk5 n ASP 58 N -4.60 4.27 -4.75 1.46 8.00 -1.26 -5.00 116.55 114.67 3fk5 n ASP 58 Ca 0.20 -3.79 -0.40 0.00 0.71 0.00 0.00 54.79 51.51 3fk5 n ASP 58 Cb 0.60 -0.52 -0.04 0.00 -0.02 0.00 0.00 41.12 41.14 3fk5 n ASP 58 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3fk5 s VAL 59 N -4.13 3.55 0.17 2.53 1.01 -1.02 -5.04 120.40 117.47 3fk5 s VAL 59 Ca 0.50 1.51 0.03 0.00 0.00 0.00 0.00 61.98 64.02 3fk5 s VAL 59 Cb 0.42 -3.96 -0.03 0.00 0.00 0.00 0.00 36.38 32.80 3fk5 s VAL 59 CO 0.01 0.34 0.27 -1.10 0.00 0.00 0.00 175.10 174.61 3fk5 s GLN 60 N -1.20 3.33 0.29 2.72 -0.21 -1.26 -4.97 119.66 118.35 3fk5 s GLN 60 Ca 0.46 -0.69 0.03 0.00 0.02 0.00 0.00 55.36 55.17 3fk5 s GLN 60 Cb -0.32 -2.88 0.62 0.00 1.00 0.00 0.00 33.01 31.43 3fk5 s GLN 60 CO 0.40 0.50 1.81 0.00 -2.12 0.00 0.00 175.29 175.87 3fk5 h ALA 61 N 1.99 1.54 -0.13 6.09 0.00 -1.90 -0.84 119.26 126.01 3fk5 h ALA 61 Ca -0.49 0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.41 3fk5 h ALA 61 Cb 1.20 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.84 3fk5 h ALA 61 CO 0.66 0.09 -0.21 0.66 0.00 0.00 0.00 179.25 180.46 3fk5 h SER 62 N 0.87 0.22 -0.45 0.00 4.64 -1.92 -1.75 113.55 115.16 3fk5 h SER 62 Ca 0.52 -0.06 -0.04 0.00 -0.47 0.00 0.00 61.79 61.75 3fk5 h SER 62 Cb 0.66 -0.06 -0.02 0.00 -0.31 0.00 0.00 62.40 62.67 3fk5 h SER 62 CO -0.32 0.44 0.13 0.44 -0.87 0.00 0.00 176.83 176.65 3fk5 h ASP 63 N 0.21 0.66 -0.37 4.97 3.32 -1.54 -0.79 116.42 122.87 3fk5 h ASP 63 Ca 0.04 -0.22 -0.14 0.00 0.02 0.00 0.00 57.03 56.73 3fk5 h ASP 63 Cb 0.49 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 39.86 3fk5 h ASP 63 CO 0.03 0.70 -0.33 0.00 -1.72 0.00 0.00 179.24 177.93 3fk5 h ALA 64 N 0.98 0.54 -0.77 3.45 0.00 -1.16 -2.37 119.26 119.93 3fk5 h ALA 64 Ca 0.14 -0.43 -0.03 0.00 0.00 0.00 0.00 54.91 54.60 3fk5 h ALA 64 Cb 0.28 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 17.92 3fk5 h ALA 64 CO -0.00 0.60 0.37 0.00 0.00 0.00 0.00 179.25 180.21 3fk5 h ALA 65 N 0.77 1.00 -0.29 0.00 0.00 -1.23 -2.30 119.26 117.21 3fk5 h ALA 65 Ca 0.06 -0.16 0.01 0.00 0.00 0.00 0.00 54.91 54.83 3fk5 h ALA 65 Cb 0.91 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 18.38 3fk5 h ALA 65 CO 0.08 0.57 0.18 1.15 0.00 0.00 0.00 179.25 181.23 3fk5 h THR 66 N 1.09 1.05 -0.32 0.00 2.02 -1.11 0.02 112.91 115.66 3fk5 h THR 66 Ca 0.26 -0.12 -0.01 0.00 0.77 0.00 0.00 66.41 67.31 3fk5 h THR 66 Cb 0.13 0.65 -0.02 0.00 -1.74 0.00 0.00 68.15 67.17 3fk5 h THR 66 CO -0.03 0.07 0.18 -0.61 0.37 0.00 0.00 175.52 175.49 3fk5 h GLN 67 N 0.36 0.45 -0.83 6.66 4.15 -1.08 -1.25 115.11 123.58 3fk5 h GLN 67 Ca 0.11 -0.05 0.01 0.00 0.77 0.00 0.00 58.65 59.49 3fk5 h GLN 67 Cb -0.02 -0.09 -0.04 0.00 0.21 0.00 0.00 27.48 27.54 3fk5 h GLN 67 CO -0.04 0.38 0.55 0.00 -1.93 0.00 0.00 178.83 177.78 3fk5 h ALA 68 N 1.05 1.06 -0.68 3.38 0.00 -1.22 -1.60 119.26 121.24 3fk5 h ALA 68 Ca 0.11 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.97 3fk5 h ALA 68 Cb 0.06 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 17.49 3fk5 h ALA 68 CO -0.02 0.45 0.43 0.00 0.00 0.00 0.00 179.25 180.11 3fk5 h ALA 69 N 1.31 0.87 -0.43 0.00 0.00 -0.59 0.13 119.26 120.54 3fk5 h ALA 69 Ca 0.31 -0.06 -0.05 0.00 0.00 0.00 0.00 54.91 55.11 3fk5 h ALA 69 Cb -0.11 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.38 3fk5 h ALA 69 CO -0.07 0.31 0.08 0.00 0.00 0.00 0.00 179.25 179.57 3fk5 h ARG 70 N 0.93 0.71 -0.43 0.00 3.08 -0.77 -0.80 114.38 117.10 3fk5 h ARG 70 Ca 0.25 -0.19 -0.04 0.00 0.07 0.00 0.00 59.98 60.07 3fk5 h ARG 70 Cb -0.07 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 29.87 3fk5 h ARG 70 CO -0.05 0.73 0.08 0.87 -1.07 0.00 0.00 179.97 180.53 3fk5 h LYS 71 N 0.57 0.65 -0.21 0.04 1.57 -0.76 -2.35 116.57 116.07 3fk5 h LYS 71 Ca 0.13 -0.12 -0.14 0.00 -1.87 0.00 0.00 60.65 58.65 3fk5 h LYS 71 Cb 0.37 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.57 3fk5 h LYS 71 CO 0.01 0.61 -0.46 0.00 -0.57 0.00 0.00 179.45 179.04 3fk5 h ALA 72 N 1.46 0.81 -0.40 3.86 0.00 -0.16 -1.10 119.26 123.74 3fk5 h ALA 72 Ca 0.14 -0.47 -0.01 0.00 0.00 0.00 0.00 54.91 54.57 3fk5 h ALA 72 Cb 0.28 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 3fk5 h ALA 72 CO 0.00 0.66 0.20 -0.07 0.00 0.00 0.00 179.25 180.04 3fk5 h LEU 73 N 0.44 0.51 -0.01 0.00 3.38 -1.04 0.11 115.31 118.69 3fk5 h LEU 73 Ca 0.03 -0.11 0.03 0.00 0.09 0.00 0.00 57.88 57.91 3fk5 h LEU 73 Cb 0.97 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 41.55 3fk5 h LEU 73 CO 0.09 0.48 -0.17 0.40 0.09 0.00 0.00 178.44 179.32 3fk5 h ILE 74 N 0.50 0.58 -0.99 1.22 1.08 -1.17 -0.42 117.51 118.31 3fk5 h ILE 74 Ca 0.14 0.00 0.17 0.00 -0.39 0.00 0.00 64.86 64.78 3fk5 h ILE 74 Cb 0.10 0.58 -0.10 0.00 -3.07 0.00 0.00 36.82 34.32 3fk5 h ILE 74 CO -0.02 0.00 0.60 -0.78 -0.69 0.00 0.00 178.15 177.26 3fk5 h ASP 75 N -0.28 0.79 0.96 1.72 3.58 -0.97 -0.31 116.42 121.91 3fk5 h ASP 75 Ca 0.06 0.09 0.00 0.00 0.42 0.00 0.00 57.03 57.60 3fk5 h ASP 75 Cb 0.36 -0.06 0.00 0.00 1.72 0.00 0.00 39.33 41.35 3fk5 h ASP 75 CO -0.18 0.31 -0.05 0.00 -2.88 0.00 0.00 179.24 176.45 3fk5 n ALA 76 N -2.34 2.45 -1.95 -0.78 0.00 0.35 -4.73 120.51 113.50 3fk5 n ALA 76 Ca 0.22 -0.12 -0.15 0.00 0.00 0.00 0.00 53.44 53.39 3fk5 n ALA 76 Cb 0.52 -1.44 -0.03 0.00 0.00 0.00 0.00 19.45 18.51 3fk5 n ALA 76 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3fk5 n GLY 77 N 1.50 0.44 3.31 0.00 0.00 -0.13 -4.90 105.19 105.41 3fk5 n GLY 77 Ca 0.07 -0.28 -0.17 0.00 0.00 0.00 0.00 46.02 45.64 3fk5 n GLY 77 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3fk5 s ILE 78 N -2.67 1.33 0.42 -0.61 -4.36 -0.97 -5.05 121.20 109.29 3fk5 s ILE 78 Ca 0.00 -2.10 0.03 0.00 -0.26 0.00 0.00 60.65 58.32 3fk5 s ILE 78 Cb 0.00 -2.07 0.00 0.00 1.25 0.00 0.00 42.46 41.64 3fk5 s ILE 78 CO 0.00 -0.57 0.60 -0.83 0.24 0.00 0.00 174.94 174.38 3fk5 s GLY 79 N -3.26 1.64 0.51 6.27 0.00 -1.26 -4.50 107.32 106.71 3fk5 s GLY 79 Ca 0.22 -1.29 0.19 0.00 0.00 0.00 0.00 44.72 43.84 3fk5 s GLY 79 CO 0.05 -1.13 2.08 1.19 0.00 0.00 0.00 173.10 175.29 3fk5 h ILE 80 N 0.56 0.90 0.00 0.90 6.09 -1.92 -1.72 117.51 122.32 3fk5 h ILE 80 Ca -0.45 -0.02 0.00 0.00 -1.37 0.00 0.00 64.86 63.02 3fk5 h ILE 80 Cb 1.26 0.85 0.00 0.00 0.47 0.00 0.00 36.82 39.41 3fk5 h ILE 80 CO 0.54 0.01 0.05 1.05 -3.07 0.00 0.00 178.15 176.73 3fk5 h GLU 81 N 0.05 0.00 -0.00 2.19 9.09 -1.95 -0.96 114.58 123.00 3fk5 h GLU 81 Ca 0.11 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.52 3fk5 h GLU 81 Cb 0.39 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.49 3fk5 h GLU 81 CO -0.01 0.00 -0.09 1.63 0.05 0.00 0.00 179.01 180.59 3fk5 n LYS 82 N -2.98 0.44 -3.21 1.06 5.02 -0.65 -4.81 118.16 113.03 3fk5 n LYS 82 Ca -0.03 -0.10 -0.39 0.00 -2.02 0.00 0.00 58.31 55.77 3fk5 n LYS 82 Cb 0.11 -1.50 -0.06 0.00 -0.02 0.00 0.00 35.03 33.57 3fk5 n LYS 82 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3fk5 s ILE 83 N -2.63 5.11 -0.39 -0.18 -1.09 -0.36 -4.04 121.20 117.60 3fk5 s ILE 83 Ca 0.25 1.08 0.08 0.00 -2.23 0.00 0.00 60.65 59.83 3fk5 s ILE 83 Cb 0.20 -3.89 -0.09 0.00 -1.58 0.00 0.00 42.46 37.10 3fk5 s ILE 83 CO 0.50 0.23 0.36 0.61 -1.23 0.00 0.00 174.94 175.40 3fk5 n GLY 84 N 3.52 0.20 2.98 6.18 0.00 -0.32 -4.56 105.19 113.18 3fk5 n GLY 84 Ca -0.04 -0.24 -0.13 0.00 0.00 0.00 0.00 46.02 45.61 3fk5 n GLY 84 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3fk5 s LEU 85 N -2.41 1.34 -0.12 0.99 2.96 -1.24 -2.19 118.68 118.02 3fk5 s LEU 85 Ca 0.03 0.26 -0.02 0.00 -0.22 0.00 0.00 54.13 54.18 3fk5 s LEU 85 Cb 0.06 0.40 0.04 0.00 0.50 0.00 0.00 46.19 47.19 3fk5 s LEU 85 CO 0.35 -0.07 -0.01 -0.22 -1.32 0.00 0.00 176.35 175.08 3fk5 s LEU 86 N 0.33 0.91 -0.14 -0.68 0.20 -0.44 -0.48 118.68 118.38 3fk5 s LEU 86 Ca -0.02 -0.35 -0.01 0.00 0.69 0.00 0.00 54.13 54.44 3fk5 s LEU 86 Cb -0.03 -0.58 -0.01 0.00 -0.43 0.00 0.00 46.19 45.13 3fk5 s LEU 86 CO -0.01 -0.21 -0.12 -0.69 -0.29 0.00 0.00 176.35 175.03 3fk5 s VAL 87 N 1.88 3.09 -0.20 1.68 1.01 0.00 -3.19 120.40 124.66 3fk5 s VAL 87 Ca 0.03 -0.64 -0.12 0.00 0.00 0.00 0.00 61.98 61.25 3fk5 s VAL 87 Cb -0.14 -2.31 -0.05 0.00 0.00 0.00 0.00 36.38 33.88 3fk5 s VAL 87 CO -0.07 0.51 0.20 0.21 0.00 0.00 0.00 175.10 175.96 3fk5 s ASN 88 N 0.49 6.26 -0.04 3.32 2.47 -1.05 -1.14 114.94 125.26 3fk5 s ASN 88 Ca -0.08 0.29 0.09 0.00 0.42 0.00 0.00 52.86 53.58 3fk5 s ASN 88 Cb -0.16 -2.13 0.24 0.00 -1.45 0.00 0.00 41.25 37.76 3fk5 s ASN 88 CO 0.04 0.11 1.19 0.35 -3.72 0.00 0.00 177.10 175.07 3fk5 n THR 89 N 3.79 1.29 -2.00 -5.21 -2.24 -0.43 -0.90 114.28 108.58 3fk5 n THR 89 Ca -0.14 -1.26 -0.32 0.00 -2.27 0.00 0.00 64.05 60.06 3fk5 n THR 89 Cb 0.52 0.31 0.01 0.00 -2.10 0.00 0.00 70.33 69.06 3fk5 n THR 89 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 3fk5 s SER 90 N -1.33 6.09 -0.09 3.42 1.04 -1.26 -4.57 113.70 116.99 3fk5 s SER 90 Ca 0.20 1.58 -0.26 0.00 0.48 0.00 0.00 55.95 57.94 3fk5 s SER 90 Cb 0.13 -2.50 -0.28 0.00 0.10 0.00 0.00 66.02 63.48 3fk5 s SER 90 CO 0.08 -0.96 0.85 0.58 0.98 0.00 0.00 173.24 174.78 3fk5 h VAL 91 N 0.10 1.66 -2.19 5.02 2.07 -1.87 -3.44 116.25 117.61 3fk5 h VAL 91 Ca -0.45 -2.37 -0.58 0.00 0.82 0.00 0.00 66.70 64.12 3fk5 h VAL 91 Cb 1.20 3.25 0.02 0.00 -1.52 0.00 0.00 31.29 34.24 3fk5 h VAL 91 CO 0.60 0.64 1.11 -1.20 0.02 0.00 0.00 177.57 178.74 3fk5 n SER 92 N -4.42 3.68 -4.14 0.57 7.64 -1.26 -5.03 113.62 110.66 3fk5 n SER 92 Ca -0.11 0.96 -0.20 0.00 1.01 0.00 0.00 58.87 60.53 3fk5 n SER 92 Cb 0.61 -1.44 -0.13 0.00 -1.01 0.00 0.00 64.21 62.24 3fk5 n SER 92 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 3fk5 s ARG 93 N 3.76 0.96 0.18 1.43 0.52 -1.26 -4.90 118.95 119.63 3fk5 s ARG 93 Ca 0.89 -0.73 -0.13 0.00 -0.52 0.00 0.00 55.73 55.24 3fk5 s ARG 93 Cb -0.60 -0.96 0.10 0.00 0.52 0.00 0.00 34.95 34.01 3fk5 s ARG 93 CO 0.46 0.24 1.82 -0.44 0.02 0.00 0.00 175.30 177.40 3fk5 h ASP 94 N 5.02 0.52 -5.27 0.23 5.19 -1.96 -3.47 116.42 116.68 3fk5 h ASP 94 Ca -0.38 0.00 -0.12 0.00 -0.62 0.00 0.00 57.03 55.91 3fk5 h ASP 94 Cb 1.18 -0.11 -0.06 0.00 0.18 0.00 0.00 39.33 40.52 3fk5 h ASP 94 CO 0.44 0.37 -0.03 -0.31 -3.12 0.00 0.00 179.24 176.60 3fk5 s TYR 95 N -6.14 0.53 0.04 4.55 2.02 -1.26 -5.06 117.35 112.03 3fk5 s TYR 95 Ca -0.13 -0.93 -0.20 0.00 -0.37 0.00 0.00 57.07 55.45 3fk5 s TYR 95 Cb 0.13 0.28 -0.16 0.00 -0.40 0.00 0.00 41.96 41.81 3fk5 s TYR 95 CO 0.74 -1.21 1.29 -0.07 -1.57 0.00 0.00 175.55 174.73 3fk5 h LEU 96 N 2.12 0.46 -8.21 -1.29 3.38 -2.02 -3.46 115.31 106.29 3fk5 h LEU 96 Ca -0.28 -0.55 -0.34 0.00 0.09 0.00 0.00 57.88 56.80 3fk5 h LEU 96 Cb 1.25 -0.13 -0.23 0.00 0.09 0.00 0.00 40.66 41.64 3fk5 h LEU 96 CO 0.37 0.93 -0.76 -1.61 0.09 0.00 0.00 178.44 177.47 3fk5 s GLU 97 N -4.01 0.64 0.43 1.13 2.02 -1.26 -4.62 118.70 113.02 3fk5 s GLU 97 Ca -0.14 -0.73 -0.07 0.00 0.02 0.00 0.00 54.97 54.05 3fk5 s GLU 97 Cb 0.05 -0.52 0.10 0.00 0.10 0.00 0.00 34.13 33.86 3fk5 s GLU 97 CO 0.78 0.11 0.59 -0.35 0.02 0.00 0.00 175.26 176.41 3fk5 n PRO 98 N 1.68 -0.57 -2.02 0.39 -0.04 -1.26 -5.09 135.00 128.09 3fk5 n PRO 98 Ca -0.20 -0.91 -0.34 0.00 -0.04 0.00 0.00 63.50 62.00 3fk5 n PRO 98 Cb 0.55 -0.61 0.03 0.00 -0.04 0.00 0.00 33.50 33.43 3fk5 n PRO 98 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 3fk5 s SER 99 N -3.16 5.38 0.34 3.54 1.04 -1.26 -4.61 113.70 114.97 3fk5 s SER 99 Ca 0.33 2.14 0.03 0.00 0.48 0.00 0.00 55.95 58.94 3fk5 s SER 99 Cb -0.01 -2.57 0.65 0.00 0.10 0.00 0.00 66.02 64.19 3fk5 s SER 99 CO 0.23 -1.45 1.95 0.74 0.98 0.00 0.00 173.24 175.69 3fk5 h THR 100 N 0.68 1.06 -0.92 2.02 2.02 -1.94 -2.35 112.91 113.47 3fk5 h THR 100 Ca -0.49 -0.30 0.07 0.00 0.77 0.00 0.00 66.41 66.46 3fk5 h THR 100 Cb 1.26 0.11 -0.07 0.00 -1.74 0.00 0.00 68.15 67.71 3fk5 h THR 100 CO 0.55 0.16 0.58 0.00 0.37 0.00 0.00 175.52 177.18 3fk5 h ALA 101 N 1.57 1.28 -0.67 6.16 0.00 -1.91 -0.60 119.26 125.08 3fk5 h ALA 101 Ca 0.33 -0.01 0.06 0.00 0.00 0.00 0.00 54.91 55.29 3fk5 h ALA 101 Cb 0.19 -0.25 -0.06 0.00 0.00 0.00 0.00 17.79 17.68 3fk5 h ALA 101 CO -0.11 0.32 0.37 0.77 0.00 0.00 0.00 179.25 180.60 3fk5 h SER 102 N 1.03 0.55 -0.24 0.00 0.02 -1.78 0.69 113.55 113.83 3fk5 h SER 102 Ca 0.41 0.03 -0.08 0.00 -0.84 0.00 0.00 61.79 61.30 3fk5 h SER 102 Cb 0.21 -0.08 -0.00 0.00 0.14 0.00 0.00 62.40 62.66 3fk5 h SER 102 CO -0.19 0.36 -0.17 0.40 -1.14 0.00 0.00 176.83 176.09 3fk5 h ILE 103 N 0.69 1.31 0.04 3.27 2.04 -1.22 -0.41 117.51 123.23 3fk5 h ILE 103 Ca 0.30 -1.30 -0.00 0.00 1.00 0.00 0.00 64.86 64.86 3fk5 h ILE 103 Cb 0.19 1.64 0.00 0.00 -0.74 0.00 0.00 36.82 37.91 3fk5 h ILE 103 CO -0.18 0.40 -0.02 0.58 0.00 0.00 0.00 178.15 178.93 3fk5 h VAL 104 N 0.24 1.06 -0.60 1.67 2.07 -0.88 -0.68 116.25 119.14 3fk5 h VAL 104 Ca 0.05 -0.33 0.11 0.00 0.82 0.00 0.00 66.70 67.35 3fk5 h VAL 104 Cb 0.70 1.28 -0.12 0.00 -1.52 0.00 0.00 31.29 31.64 3fk5 h VAL 104 CO 0.05 0.08 -0.30 0.28 0.02 0.00 0.00 177.57 177.70 3fk5 h SER 105 N -0.20 -1.05 -0.56 0.57 0.02 -0.88 -0.95 113.55 110.51 3fk5 h SER 105 Ca -0.01 0.22 -0.03 0.00 -0.84 0.00 0.00 61.79 61.14 3fk5 h SER 105 Cb 0.18 0.54 -0.03 0.00 0.14 0.00 0.00 62.40 63.23 3fk5 h SER 105 CO 0.01 -0.29 0.25 1.23 -1.14 0.00 0.00 176.83 176.89 3fk5 h GLY 106 N -0.13 0.88 0.93 -3.77 0.00 -0.69 -0.18 103.07 100.11 3fk5 h GLY 106 Ca 0.25 -0.46 0.02 0.00 0.00 0.00 0.00 47.33 47.14 3fk5 h GLY 106 CO -0.68 0.43 0.57 3.43 0.00 0.00 0.00 176.54 180.29 3fk5 h ASN 107 N 0.76 0.96 1.15 0.19 2.35 -0.35 -2.74 115.58 117.91 3fk5 h ASN 107 Ca 0.19 -0.01 -0.14 0.00 -0.55 0.00 0.00 56.30 55.79 3fk5 h ASN 107 Cb 0.16 -0.23 -0.02 0.00 0.05 0.00 0.00 38.32 38.28 3fk5 h ASN 107 CO -0.02 0.68 -0.65 -0.07 -1.65 0.00 0.00 177.43 175.71 3fk5 h LEU 108 N 1.13 0.00 -0.81 1.61 3.38 -0.78 -3.48 115.31 116.36 3fk5 h LEU 108 Ca 0.34 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.31 3fk5 h LEU 108 Cb -0.05 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.70 3fk5 h LEU 108 CO -0.10 0.65 0.00 0.61 0.09 0.00 0.00 178.44 179.70 3fk5 n GLY 109 N 1.02 0.85 3.70 0.83 0.00 -0.12 -4.90 105.19 106.57 3fk5 n GLY 109 Ca 0.01 -0.41 -0.33 0.00 0.00 0.00 0.00 46.02 45.29 3fk5 n GLY 109 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3fk5 s VAL 110 N -2.56 2.05 0.79 1.61 -7.23 -1.07 -4.73 120.40 109.26 3fk5 s VAL 110 Ca 0.00 0.02 -0.10 0.00 -1.81 0.00 0.00 61.98 60.10 3fk5 s VAL 110 Cb 0.00 -2.41 0.10 0.00 0.56 0.00 0.00 36.38 34.62 3fk5 s VAL 110 CO 0.00 -0.02 1.12 -0.83 -0.31 0.00 0.00 175.10 175.07 3fk5 s GLY 111 N -2.18 1.68 0.00 2.32 0.00 -1.26 -4.96 107.32 102.92 3fk5 s GLY 111 Ca 0.73 -0.95 0.18 0.00 0.00 0.00 0.00 44.72 44.68 3fk5 s GLY 111 CO 0.51 -0.43 1.49 2.09 0.00 0.00 0.00 173.10 176.75 3fk5 n ASP 112 N -3.20 0.00 -0.00 1.64 3.85 -1.26 -2.00 116.55 115.58 3fk5 n ASP 112 Ca 0.10 -0.44 0.10 0.00 -0.71 0.00 0.00 54.79 53.84 3fk5 n ASP 112 Cb 0.60 -0.06 -0.13 0.00 -1.35 0.00 0.00 41.12 40.19 3fk5 n ASP 112 CO 0.00 0.00 0.00 1.41 -1.01 0.00 0.00 177.20 177.60 3fk5 n HIS 113 N -1.06 0.01 -1.98 2.11 8.25 -1.26 -4.93 115.22 116.36 3fk5 n HIS 113 Ca 0.12 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.17 3fk5 n HIS 113 Cb 0.08 -0.19 -0.03 0.00 1.12 0.00 0.00 29.99 30.97 3fk5 n HIS 113 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3fk5 s VAL 115 N 2.87 4.53 0.01 0.00 1.01 -0.93 -4.96 120.40 122.93 3fk5 s VAL 115 Ca 0.73 1.85 -0.01 0.00 0.00 0.00 0.00 61.98 64.55 3fk5 s VAL 115 Cb -0.38 -4.22 -0.01 0.00 0.00 0.00 0.00 36.38 31.78 3fk5 s VAL 115 CO 0.31 0.38 -0.00 0.42 0.00 0.00 0.00 175.10 176.21 3fk5 s THR 116 N -0.30 0.09 -0.08 3.92 -4.23 -1.26 -1.33 115.64 112.45 3fk5 s THR 116 Ca 0.41 -0.71 -0.32 0.00 -1.18 0.00 0.00 61.69 59.90 3fk5 s THR 116 Cb -0.22 -0.23 0.13 0.00 1.34 0.00 0.00 72.50 73.51 3fk5 s THR 116 CO 0.27 -0.39 1.26 0.72 -0.54 0.00 0.00 174.62 175.94 3fk5 s PHE 117 N -1.16 -0.07 0.08 3.99 -0.12 -1.19 -4.93 117.98 114.57 3fk5 s PHE 117 Ca -0.13 -0.01 0.02 0.00 -0.05 0.00 0.00 56.93 56.76 3fk5 s PHE 117 Cb -0.08 0.53 -0.04 0.00 -0.63 0.00 0.00 43.02 42.81 3fk5 s PHE 117 CO -0.01 -0.25 0.15 -0.51 -0.05 0.00 0.00 175.22 174.56 3fk5 s ASP 118 N -2.69 5.95 0.05 1.98 1.01 -1.26 -2.52 116.67 119.18 3fk5 s ASP 118 Ca 0.12 0.12 0.09 0.00 0.71 0.00 0.00 52.55 53.60 3fk5 s ASP 118 Cb 0.03 -1.72 -0.03 0.00 1.01 0.00 0.00 42.92 42.21 3fk5 s ASP 118 CO -0.04 0.16 -0.26 -0.69 0.21 0.00 0.00 175.17 174.55 3fk5 s VAL 119 N -1.48 2.19 -0.01 -1.27 1.01 -0.07 -4.94 120.40 115.82 3fk5 s VAL 119 Ca 0.32 -1.39 0.00 0.00 0.00 0.00 0.00 61.98 60.91 3fk5 s VAL 119 Cb -0.12 -1.86 0.02 0.00 0.00 0.00 0.00 36.38 34.42 3fk5 s VAL 119 CO 0.25 0.36 0.01 0.00 0.00 0.00 0.00 175.10 175.72 3fk5 s ALA 120 N -0.82 0.09 -0.34 5.51 0.00 -1.26 -4.23 121.76 120.71 3fk5 s ALA 120 Ca 0.12 0.14 0.03 0.00 0.00 0.00 0.00 51.96 52.25 3fk5 s ALA 120 Cb -0.10 -0.15 0.17 0.00 0.00 0.00 0.00 23.12 23.04 3fk5 s ALA 120 CO 0.02 -0.05 1.17 -1.71 0.00 0.00 0.00 175.76 175.19 3fk5 n ASN 121 N 3.66 -1.33 0.00 0.00 4.05 -1.26 -4.98 115.26 115.40 3fk5 n ASN 121 Ca -0.21 -1.90 0.00 0.00 0.45 0.00 0.00 54.58 52.93 3fk5 n ASN 121 Cb 0.55 1.07 0.00 0.00 1.23 0.00 0.00 39.78 42.63 3fk5 n ASN 121 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 3fk5 n ALA 122 N -0.32 0.00 1.15 5.20 0.00 -1.26 -1.48 120.51 123.79 3fk5 n ALA 122 Ca -0.19 0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.32 3fk5 n ALA 122 Cb 0.70 0.00 0.20 0.00 0.00 0.00 0.00 19.45 20.35 3fk5 n ALA 122 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3fk5 n LEU 124 N 0.29 1.88 0.26 0.00 4.77 -0.55 -4.17 117.00 119.48 3fk5 n LEU 124 Ca 0.11 -0.85 0.11 0.00 -0.03 0.00 0.00 56.01 55.35 3fk5 n LEU 124 Cb 0.25 0.00 0.71 0.00 -2.33 0.00 0.00 43.42 42.05 3fk5 n LEU 124 CO 0.08 0.35 1.00 0.00 -1.33 0.00 0.00 177.39 177.49 3fk5 h ALA 125 N 2.89 1.49 -0.53 -1.18 0.00 -1.62 -1.96 119.26 118.34 3fk5 h ALA 125 Ca 0.00 -0.09 -0.06 0.00 0.00 0.00 0.00 54.91 54.75 3fk5 h ALA 125 Cb 0.59 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.34 3fk5 h ALA 125 CO 0.00 0.13 0.08 0.35 0.00 0.00 0.00 179.25 179.81 3fk5 h PHE 126 N 0.00 0.94 -0.73 0.00 3.57 -1.81 0.52 116.94 119.43 3fk5 h PHE 126 Ca -0.00 -0.13 -0.01 0.00 3.53 0.00 0.00 57.97 61.35 3fk5 h PHE 126 Cb 0.23 -0.26 -0.03 0.00 2.79 0.00 0.00 35.95 38.68 3fk5 h PHE 126 CO 0.00 0.84 0.40 0.82 -2.23 0.00 0.00 178.31 178.14 3fk5 h ILE 127 N 0.76 1.22 -0.65 1.41 2.04 -1.70 -0.26 117.51 120.33 3fk5 h ILE 127 Ca 0.16 -0.56 0.04 0.00 1.00 0.00 0.00 64.86 65.50 3fk5 h ILE 127 Cb 0.41 0.26 -0.05 0.00 -0.74 0.00 0.00 36.82 36.70 3fk5 h ILE 127 CO 0.01 0.25 0.39 0.78 0.00 0.00 0.00 178.15 179.57 3fk5 h ASN 128 N 1.01 0.61 -0.38 1.72 2.35 -1.05 -1.27 115.58 118.57 3fk5 h ASN 128 Ca 0.26 0.01 -0.04 0.00 -0.55 0.00 0.00 56.30 55.98 3fk5 h ASN 128 Cb 0.04 -0.11 -0.02 0.00 0.05 0.00 0.00 38.32 38.28 3fk5 h ASN 128 CO -0.04 0.41 0.09 1.23 -1.65 0.00 0.00 177.43 177.47 3fk5 h GLY 129 N 0.74 0.66 0.12 2.83 0.00 -0.45 -0.21 103.07 106.76 3fk5 h GLY 129 Ca 0.27 -0.41 0.12 0.00 0.00 0.00 0.00 47.33 47.31 3fk5 h GLY 129 CO -0.14 0.38 0.11 -0.33 0.00 0.00 0.00 176.54 176.57 3fk5 h MET 130 N 0.47 0.23 -0.42 4.80 2.86 -0.77 -0.33 114.93 121.77 3fk5 h MET 130 Ca 0.12 -0.01 -0.13 0.00 -2.06 0.00 0.00 59.70 57.62 3fk5 h MET 130 Cb 0.31 -0.05 -0.01 0.00 0.06 0.00 0.00 31.60 31.90 3fk5 h MET 130 CO 0.00 0.15 -0.24 -0.44 1.06 0.00 0.00 176.91 177.44 3fk5 h ASP 131 N 0.24 0.90 -0.26 1.22 3.32 -0.68 0.39 116.42 121.56 3fk5 h ASP 131 Ca 0.33 -0.34 -0.02 0.00 0.02 0.00 0.00 57.03 57.02 3fk5 h ASP 131 Cb 0.50 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.79 3fk5 h ASP 131 CO -0.43 1.10 0.09 0.40 -1.72 0.00 0.00 179.24 178.67 3fk5 h ILE 132 N 0.75 1.19 -0.20 0.35 2.04 -0.59 -1.54 117.51 119.50 3fk5 h ILE 132 Ca 0.10 -0.58 -0.00 0.00 1.00 0.00 0.00 64.86 65.37 3fk5 h ILE 132 Cb 0.79 1.09 -0.01 0.00 -0.74 0.00 0.00 36.82 37.95 3fk5 h ILE 132 CO 0.07 0.19 0.11 0.00 0.00 0.00 0.00 178.15 178.52 3fk5 h ALA 133 N 0.92 0.26 -0.95 1.87 0.00 -0.84 -3.07 119.26 117.45 3fk5 h ALA 133 Ca 0.08 -0.06 0.13 0.00 0.00 0.00 0.00 54.91 55.06 3fk5 h ALA 133 Cb 0.21 -0.08 -0.09 0.00 0.00 0.00 0.00 17.79 17.83 3fk5 h ALA 133 CO -0.00 -0.20 0.58 0.00 0.00 0.00 0.00 179.25 179.62 3fk5 h ALA 134 N 0.99 1.45 -0.49 0.00 0.00 0.03 -1.69 119.26 119.56 3fk5 h ALA 134 Ca 0.07 0.04 -0.07 0.00 0.00 0.00 0.00 54.91 54.96 3fk5 h ALA 134 Cb 0.08 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 3fk5 h ALA 134 CO -0.01 0.11 0.04 0.00 0.00 0.00 0.00 179.25 179.39 3fk5 h ARG 135 N 0.87 0.79 -0.30 0.00 3.08 -1.20 0.81 114.38 118.44 3fk5 h ARG 135 Ca 0.49 -0.20 -0.04 0.00 0.07 0.00 0.00 59.98 60.30 3fk5 h ARG 135 Cb 0.56 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.50 3fk5 h ARG 135 CO -0.30 0.77 0.02 0.52 -1.07 0.00 0.00 179.97 179.92 3fk5 h MET 136 N 0.75 0.51 -0.34 0.04 2.86 -1.26 -2.66 114.93 114.83 3fk5 h MET 136 Ca 0.15 -0.15 -0.00 0.00 -2.06 0.00 0.00 59.70 57.64 3fk5 h MET 136 Cb 0.40 -0.05 -0.02 0.00 0.06 0.00 0.00 31.60 32.00 3fk5 h MET 136 CO 0.01 0.64 0.20 -0.07 1.06 0.00 0.00 176.91 178.75 3fk5 h LEU 137 N 0.31 0.41 -1.40 1.22 3.38 -1.26 -0.59 115.31 117.39 3fk5 h LEU 137 Ca 0.09 -0.06 -0.04 0.00 0.09 0.00 0.00 57.88 57.95 3fk5 h LEU 137 Cb 0.40 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.03 3fk5 h LEU 137 CO 0.01 0.35 -0.04 -0.08 0.09 0.00 0.00 178.44 178.77 3fk5 h GLU 138 N 0.43 0.34 0.00 1.13 4.57 -0.85 -0.71 114.58 119.49 3fk5 h GLU 138 Ca 0.12 -0.07 0.00 0.00 -1.18 0.00 0.00 59.36 58.23 3fk5 h GLU 138 Cb 0.03 -0.05 0.00 0.00 -0.16 0.00 0.00 28.75 28.56 3fk5 h GLU 138 CO -0.02 0.41 -0.12 -2.13 -1.18 0.00 0.00 179.01 175.96 3fk5 n ARG 139 N -4.31 0.09 -0.76 1.92 0.63 -1.01 -4.92 116.66 108.29 3fk5 n ARG 139 Ca 0.00 0.06 0.00 0.00 -0.92 0.00 0.00 57.85 56.99 3fk5 n ARG 139 Cb 0.23 -1.59 0.00 0.00 0.45 0.00 0.00 32.46 31.55 3fk5 n ARG 139 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 3fk5 n GLY 140 N 1.44 0.77 0.25 5.14 0.00 -0.27 -4.95 105.19 107.56 3fk5 n GLY 140 Ca 0.06 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.12 3fk5 n GLY 140 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3fk5 h GLU 141 N 2.70 0.19 -4.31 1.61 5.08 -1.34 -3.45 114.58 115.05 3fk5 h GLU 141 Ca 0.00 -0.03 -0.17 0.00 -1.00 0.00 0.00 59.36 58.15 3fk5 h GLU 141 Cb 0.00 -0.03 -0.14 0.00 0.50 0.00 0.00 28.75 29.08 3fk5 h GLU 141 CO 0.00 0.29 -0.54 0.96 -1.00 0.00 0.00 179.01 178.72 3fk5 s ILE 142 N -4.82 0.06 -0.23 3.13 -4.36 -1.24 -5.03 121.20 108.70 3fk5 s ILE 142 Ca -0.05 -1.80 0.06 0.00 -0.26 0.00 0.00 60.65 58.60 3fk5 s ILE 142 Cb 0.16 -2.13 -0.18 0.00 1.25 0.00 0.00 42.46 41.56 3fk5 s ILE 142 CO 0.72 -0.29 -0.14 0.47 0.24 0.00 0.00 174.94 175.94 3fk5 n ASP 143 N -0.18 1.56 -3.96 4.36 8.00 -1.26 -4.45 116.55 120.61 3fk5 n ASP 143 Ca -0.04 -0.10 -0.12 0.00 0.71 0.00 0.00 54.79 55.24 3fk5 n ASP 143 Cb 0.64 -0.03 -0.13 0.00 -0.02 0.00 0.00 41.12 41.59 3fk5 n ASP 143 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 3fk5 s TYR 144 N -2.49 0.33 0.02 1.24 2.02 -1.26 -2.06 117.35 115.15 3fk5 s TYR 144 Ca -0.27 -0.28 0.03 0.00 -0.37 0.00 0.00 57.07 56.19 3fk5 s TYR 144 Cb 0.08 -0.21 -0.01 0.00 -0.40 0.00 0.00 41.96 41.42 3fk5 s TYR 144 CO 0.64 -0.07 -0.11 0.00 -1.57 0.00 0.00 175.55 174.43 3fk5 s ALA 145 N -0.74 0.89 -0.12 3.71 0.00 0.60 -1.18 121.76 124.93 3fk5 s ALA 145 Ca -0.06 -0.60 -0.11 0.00 0.00 0.00 0.00 51.96 51.19 3fk5 s ALA 145 Cb -0.05 -0.16 -0.05 0.00 0.00 0.00 0.00 23.12 22.86 3fk5 s ALA 145 CO -0.00 0.17 0.23 -0.51 0.00 0.00 0.00 175.76 175.65 3fk5 s LEU 146 N -0.72 4.34 -0.16 0.00 1.43 0.37 -0.23 118.68 123.70 3fk5 s LEU 146 Ca 0.01 0.53 0.01 0.00 -1.03 0.00 0.00 54.13 53.65 3fk5 s LEU 146 Cb -0.06 -2.24 0.01 0.00 0.03 0.00 0.00 46.19 43.93 3fk5 s LEU 146 CO 0.00 0.27 -0.19 -0.69 0.23 0.00 0.00 176.35 175.97 3fk5 s VAL 147 N -0.41 2.20 0.10 -1.59 1.01 -0.62 -0.82 120.40 120.28 3fk5 s VAL 147 Ca 0.16 -0.91 0.05 0.00 0.00 0.00 0.00 61.98 61.27 3fk5 s VAL 147 Cb -0.13 -1.91 -0.04 0.00 0.00 0.00 0.00 36.38 34.31 3fk5 s VAL 147 CO 0.05 0.54 -0.13 0.68 0.00 0.00 0.00 175.10 176.23 3fk5 s VAL 148 N 1.03 1.15 -0.30 2.92 -7.23 -0.29 -1.20 120.40 116.48 3fk5 s VAL 148 Ca -0.01 -1.60 -0.01 0.00 -1.81 0.00 0.00 61.98 58.54 3fk5 s VAL 148 Cb -0.14 -1.37 0.19 0.00 0.56 0.00 0.00 36.38 35.61 3fk5 s VAL 148 CO -0.06 -0.42 0.62 -0.62 -0.31 0.00 0.00 175.10 174.30 3fk5 s ASP 149 N -2.30 -1.36 -0.11 4.85 -1.08 0.24 -1.32 116.67 115.60 3fk5 s ASP 149 Ca 0.05 0.85 0.01 0.00 -0.52 0.00 0.00 52.55 52.94 3fk5 s ASP 149 Cb -0.05 2.14 -0.02 0.00 -1.46 0.00 0.00 42.92 43.53 3fk5 s ASP 149 CO 0.02 -0.25 -0.13 -0.83 0.52 0.00 0.00 175.17 174.49 3fk5 s GLY 150 N 2.86 1.54 -0.07 2.66 0.00 -1.26 -0.28 107.32 112.77 3fk5 s GLY 150 Ca 0.20 -0.91 0.05 0.00 0.00 0.00 0.00 44.72 44.06 3fk5 s GLY 150 CO -0.21 -0.32 -0.21 -0.54 0.00 0.00 0.00 173.10 171.82 3fk5 s GLU 151 N 0.10 2.33 -0.06 2.90 0.41 0.46 -4.62 118.70 120.23 3fk5 s GLU 151 Ca -0.06 -0.74 0.04 0.00 -0.41 0.00 0.00 54.97 53.80 3fk5 s GLU 151 Cb -0.15 -1.91 0.00 0.00 -1.78 0.00 0.00 34.13 30.29 3fk5 s GLU 151 CO 0.05 0.24 -0.18 -0.08 -0.49 0.00 0.00 175.26 174.79 3fk5 s THR 152 N 0.14 1.55 -0.04 3.63 -1.32 -1.26 -2.25 115.64 116.09 3fk5 s THR 152 Ca -0.09 -0.76 0.00 0.00 -1.21 0.00 0.00 61.69 59.63 3fk5 s THR 152 Cb -0.14 -1.34 0.01 0.00 -1.51 0.00 0.00 72.50 69.51 3fk5 s THR 152 CO 0.05 0.44 0.90 0.00 -2.21 0.00 0.00 174.62 173.80 3fk5 n ALA 153 N 3.33 2.11 -0.03 11.08 0.00 -1.26 -4.78 120.51 130.96 3fk5 n ALA 153 Ca -0.19 -0.90 -0.08 0.00 0.00 0.00 0.00 53.44 52.27 3fk5 n ALA 153 Cb 0.53 -0.01 -0.02 0.00 0.00 0.00 0.00 19.45 19.94 3fk5 n ALA 153 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 3fk5 h ASN 154 N 0.07 -0.52 -0.49 0.00 4.21 -1.93 -2.39 115.58 114.53 3fk5 h ASN 154 Ca 0.00 0.10 -0.06 0.00 1.21 0.00 0.00 56.30 57.56 3fk5 h ASN 154 Cb 0.40 0.26 -0.02 0.00 -1.12 0.00 0.00 38.32 37.83 3fk5 h ASN 154 CO 0.00 -0.20 0.11 0.25 -1.29 0.00 0.00 177.43 176.29 3fk5 h LEU 155 N -0.17 0.80 -0.85 1.61 5.85 -1.98 -1.75 115.31 118.82 3fk5 h LEU 155 Ca 0.12 -0.15 0.08 0.00 0.84 0.00 0.00 57.88 58.76 3fk5 h LEU 155 Cb 0.35 -0.21 -0.07 0.00 0.37 0.00 0.00 40.66 41.10 3fk5 h LEU 155 CO -0.29 0.80 0.50 0.58 -0.34 0.00 0.00 178.44 179.69 3fk5 h VAL 156 N 0.81 0.96 -0.24 1.05 2.07 -1.81 0.83 116.25 119.92 3fk5 h VAL 156 Ca 0.17 -0.30 -0.11 0.00 0.82 0.00 0.00 66.70 67.29 3fk5 h VAL 156 Cb 0.33 0.01 -0.00 0.00 -1.52 0.00 0.00 31.29 30.11 3fk5 h VAL 156 CO 0.00 0.16 -0.28 1.88 0.02 0.00 0.00 177.57 179.35 3fk5 h TYR 157 N 0.87 0.74 0.18 1.57 -1.99 -0.89 -0.17 116.97 117.29 3fk5 h TYR 157 Ca 0.39 -0.23 -0.01 0.00 2.00 0.00 0.00 58.73 60.88 3fk5 h TYR 157 Cb 0.29 -0.15 0.00 0.00 2.00 0.00 0.00 36.73 38.87 3fk5 h TYR 157 CO -0.05 0.96 -0.09 0.93 -0.00 0.00 0.00 178.16 179.91 3fk5 h GLU 158 N 0.32 -0.23 0.14 4.88 5.08 -1.00 0.12 114.58 123.89 3fk5 h GLU 158 Ca 0.03 0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.40 3fk5 h GLU 158 Cb 0.85 0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.15 3fk5 h GLU 158 CO 0.07 -0.10 -0.07 0.87 -1.00 0.00 0.00 179.01 178.78 3fk5 h LYS 159 N -0.31 -0.18 -0.03 2.33 1.57 -0.91 -2.04 116.57 117.00 3fk5 h LYS 159 Ca -0.02 0.01 0.04 0.00 -1.87 0.00 0.00 60.65 58.80 3fk5 h LYS 159 Cb 0.24 0.04 -0.05 0.00 0.08 0.00 0.00 32.23 32.54 3fk5 h LYS 159 CO 0.04 0.20 -0.32 1.15 -0.57 0.00 0.00 179.45 179.95 3fk5 h THR 160 N -0.61 0.30 -0.85 -0.16 2.02 -1.05 -1.21 112.91 111.36 3fk5 h THR 160 Ca -0.02 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.15 3fk5 h THR 160 Cb 0.47 0.30 -0.04 0.00 -1.74 0.00 0.00 68.15 67.14 3fk5 h THR 160 CO 0.03 0.00 0.48 -0.07 0.37 0.00 0.00 175.52 176.33 3fk5 h LEU 161 N -0.45 1.04 -1.83 2.58 3.38 -1.01 -2.27 115.31 116.76 3fk5 h LEU 161 Ca 0.07 -0.09 -0.03 0.00 0.09 0.00 0.00 57.88 57.92 3fk5 h LEU 161 Cb 0.55 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 41.04 3fk5 h LEU 161 CO -0.28 0.83 -0.14 -0.08 0.09 0.00 0.00 178.44 178.85 3fk5 h GLU 162 N 1.17 0.00 0.00 1.13 4.81 -0.89 0.88 114.58 121.68 3fk5 h GLU 162 Ca 0.30 0.00 -0.04 0.00 -0.13 0.00 0.00 59.36 59.49 3fk5 h GLU 162 Cb 0.00 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.38 3fk5 h GLU 162 CO -0.05 0.14 -0.17 -0.09 -0.73 0.00 0.00 179.01 178.12 3fk5 h ARG 163 N 0.00 0.00 -0.60 1.92 2.43 -0.61 -3.14 114.38 114.38 3fk5 h ARG 163 Ca -0.00 0.00 -0.08 0.00 -0.81 0.00 0.00 59.98 59.09 3fk5 h ARG 163 Cb 0.31 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.84 3fk5 h ARG 163 CO 0.02 0.17 0.06 0.52 -1.51 0.00 0.00 179.97 179.23 3fk5 h MET 164 N 0.00 1.00 0.00 0.20 2.86 -0.82 -2.21 114.93 115.96 3fk5 h MET 164 Ca -0.00 -0.27 0.00 0.00 -2.06 0.00 0.00 59.70 57.37 3fk5 h MET 164 Cb 0.37 -0.11 0.00 0.00 0.06 0.00 0.00 31.60 31.92 3fk5 h MET 164 CO 0.02 0.95 0.43 2.41 1.06 0.00 0.00 176.91 181.78 3fk5 n THR 165 N -4.21 0.45 -3.05 2.22 -1.04 -1.18 -4.52 114.28 102.95 3fk5 n THR 165 Ca 0.04 0.60 -0.42 0.00 -2.04 0.00 0.00 64.05 62.22 3fk5 n THR 165 Cb 0.30 -1.60 -0.06 0.00 -1.82 0.00 0.00 70.33 67.15 3fk5 n THR 165 CO 0.00 0.00 0.00 -0.55 -0.64 0.00 0.00 175.07 173.88 3fk5 s SER 166 N -2.55 6.42 0.64 8.00 0.15 -0.83 -4.92 113.70 120.61 3fk5 s SER 166 Ca -0.00 0.02 0.06 0.00 0.70 0.00 0.00 55.95 56.73 3fk5 s SER 166 Cb 0.01 -2.35 0.30 0.00 -1.71 0.00 0.00 66.02 62.27 3fk5 s SER 166 CO 0.02 -0.73 1.16 1.55 1.20 0.00 0.00 173.24 176.44 3fk5 h PRO 167 N 8.67 0.00 0.00 5.44 0.13 -1.89 -2.75 132.00 141.61 3fk5 h PRO 167 Ca -0.25 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.88 3fk5 h PRO 167 Cb 1.10 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.23 3fk5 h PRO 167 CO 0.89 0.00 -0.43 -0.25 -0.23 0.00 0.00 178.00 177.98 3fk5 n ASP 168 N -2.53 0.53 -4.70 1.44 9.92 -1.26 -4.91 116.55 115.04 3fk5 n ASP 168 Ca -0.00 0.09 -0.42 0.00 -0.53 0.00 0.00 54.79 53.93 3fk5 n ASP 168 Cb 0.87 0.00 -0.03 0.00 -0.64 0.00 0.00 41.12 41.32 3fk5 n ASP 168 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 3fk5 s VAL 169 N -3.08 2.94 0.64 2.53 1.01 -1.04 -5.00 120.40 118.40 3fk5 s VAL 169 Ca 0.10 0.49 -0.05 0.00 0.00 0.00 0.00 61.98 62.52 3fk5 s VAL 169 Cb 0.16 -3.32 0.04 0.00 0.00 0.00 0.00 36.38 33.26 3fk5 s VAL 169 CO 0.67 0.01 0.93 0.42 0.00 0.00 0.00 175.10 177.13 3fk5 s THR 170 N 2.19 2.82 0.13 3.92 -4.23 -1.26 -4.88 115.64 114.33 3fk5 s THR 170 Ca 0.72 -0.25 -0.13 0.00 -1.18 0.00 0.00 61.69 60.85 3fk5 s THR 170 Cb -0.41 -3.16 -0.02 0.00 1.34 0.00 0.00 72.50 70.26 3fk5 s THR 170 CO 0.32 -0.16 1.54 -0.08 -0.54 0.00 0.00 174.62 175.70 3fk5 h GLU 171 N -0.33 0.82 -0.58 3.99 4.81 -1.98 0.26 114.58 121.56 3fk5 h GLU 171 Ca -0.44 -0.32 0.05 0.00 -0.13 0.00 0.00 59.36 58.51 3fk5 h GLU 171 Cb 1.29 -0.04 -0.05 0.00 0.63 0.00 0.00 28.75 30.58 3fk5 h GLU 171 CO 0.59 0.95 0.32 1.49 -0.73 0.00 0.00 179.01 181.62 3fk5 h GLU 172 N 0.65 0.59 -0.07 1.92 4.81 -1.99 0.47 114.58 120.95 3fk5 h GLU 172 Ca 0.11 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.29 3fk5 h GLU 172 Cb 0.65 -0.13 -0.00 0.00 0.63 0.00 0.00 28.75 29.89 3fk5 h GLU 172 CO 0.04 0.39 -0.00 1.49 -0.73 0.00 0.00 179.01 180.20 3fk5 h GLU 173 N 0.60 0.12 -0.94 1.92 4.81 -1.84 -2.99 114.58 116.27 3fk5 h GLU 173 Ca 0.25 -0.04 0.16 0.00 -0.13 0.00 0.00 59.36 59.60 3fk5 h GLU 173 Cb 0.13 -0.01 -0.10 0.00 0.63 0.00 0.00 28.75 29.40 3fk5 h GLU 173 CO -0.15 0.40 0.54 0.35 -0.73 0.00 0.00 179.01 179.42 3fk5 h PHE 174 N -0.17 0.95 -0.43 0.92 3.57 -0.80 -2.15 116.94 118.82 3fk5 h PHE 174 Ca 0.02 0.03 -0.05 0.00 3.53 0.00 0.00 57.97 61.50 3fk5 h PHE 174 Cb 0.35 -0.28 -0.02 0.00 2.79 0.00 0.00 35.95 38.79 3fk5 h PHE 174 CO 0.04 0.24 0.06 0.00 -2.23 0.00 0.00 178.31 176.41 3fk5 h ARG 175 N 0.73 0.67 -0.17 1.11 3.08 -0.79 0.37 114.38 119.38 3fk5 h ARG 175 Ca 0.52 -0.14 -0.10 0.00 0.07 0.00 0.00 59.98 60.33 3fk5 h ARG 175 Cb 0.75 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.68 3fk5 h ARG 175 CO -0.36 0.65 -0.34 -0.91 -1.07 0.00 0.00 179.97 177.93 3fk5 h ASN 176 N 0.64 0.35 -0.10 7.04 4.21 -1.29 -3.18 115.58 123.25 3fk5 h ASN 176 Ca 0.14 -0.13 -0.17 0.00 1.21 0.00 0.00 56.30 57.34 3fk5 h ASN 176 Cb 0.32 -0.10 -0.00 0.00 -1.12 0.00 0.00 38.32 37.42 3fk5 h ASN 176 CO 0.01 0.67 -0.56 -0.33 -1.29 0.00 0.00 177.43 175.93 3fk5 h GLU 177 N 0.29 0.70 -0.83 0.81 5.08 -0.85 -2.61 114.58 117.16 3fk5 h GLU 177 Ca 0.04 -0.45 0.10 0.00 -1.00 0.00 0.00 59.36 58.04 3fk5 h GLU 177 Cb 0.75 0.06 -0.06 0.00 0.50 0.00 0.00 28.75 29.99 3fk5 h GLU 177 CO 0.06 1.07 0.54 -0.07 -1.00 0.00 0.00 179.01 179.61 3fk5 h LEU 178 N 0.53 0.72 -0.67 1.33 3.38 -0.92 -1.55 115.31 118.13 3fk5 h LEU 178 Ca 0.01 0.02 -0.10 0.00 0.09 0.00 0.00 57.88 57.89 3fk5 h LEU 178 Cb 1.14 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.74 3fk5 h LEU 178 CO 0.11 0.42 -0.08 0.00 0.09 0.00 0.00 178.44 178.99 3fk5 h ALA 179 N 1.58 0.87 -0.13 1.53 0.00 -1.47 -2.45 119.26 119.20 3fk5 h ALA 179 Ca 0.39 -0.33 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 3fk5 h ALA 179 Cb 0.44 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 3fk5 h ALA 179 CO -0.16 0.65 -0.02 0.00 0.00 0.00 0.00 179.25 179.72 3fk5 h ALA 180 N 1.04 1.73 -0.01 0.00 0.00 -1.04 -2.04 119.26 118.94 3fk5 h ALA 180 Ca 0.14 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.95 3fk5 h ALA 180 Cb 0.61 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.34 3fk5 h ALA 180 CO 0.04 0.21 0.00 1.28 0.00 0.00 0.00 179.25 180.78 3fk5 n LEU 181 N -4.40 0.09 -0.90 0.00 4.77 -0.66 -2.29 117.00 113.61 3fk5 n LEU 181 Ca -0.01 -0.05 0.11 0.00 -0.03 0.00 0.00 56.01 56.04 3fk5 n LEU 181 Cb 0.17 -0.02 0.09 0.00 -2.33 0.00 0.00 43.42 41.33 3fk5 n LEU 181 CO 0.36 0.02 0.60 0.35 -1.33 0.00 0.00 177.39 177.39 3fk5 n THR 182 N -0.45 0.00 -2.88 -5.08 -2.24 -0.77 -5.02 114.28 97.84 3fk5 n THR 182 Ca 0.00 -0.49 -0.31 0.00 -2.27 0.00 0.00 64.05 60.99 3fk5 n THR 182 Cb 0.02 1.47 -0.04 0.00 -2.10 0.00 0.00 70.33 69.68 3fk5 n THR 182 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 3fk5 s LEU 183 N -1.94 3.86 0.09 3.22 1.43 -0.97 -1.15 118.68 123.22 3fk5 s LEU 183 Ca 0.26 1.18 -0.00 0.00 -1.03 0.00 0.00 54.13 54.54 3fk5 s LEU 183 Cb 0.19 -4.05 -0.04 0.00 0.03 0.00 0.00 46.19 42.32 3fk5 s LEU 183 CO 0.30 -0.38 -0.02 -0.83 0.23 0.00 0.00 176.35 175.65 3fk5 s GLY 184 N -3.00 0.73 0.27 -3.19 0.00 0.09 -4.72 107.32 97.49 3fk5 s GLY 184 Ca 0.52 -1.34 -0.13 0.00 0.00 0.00 0.00 44.72 43.77 3fk5 s GLY 184 CO 0.29 -1.38 0.65 0.00 0.00 0.00 0.00 173.10 172.65 3fk5 n GLY 186 N -0.12 0.51 3.23 0.00 0.00 -0.95 -4.34 105.19 103.51 3fk5 n GLY 186 Ca 0.01 -0.94 -0.10 0.00 0.00 0.00 0.00 46.02 44.99 3fk5 n GLY 186 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fk5 s ALA 187 N -2.00 -0.51 0.11 4.61 0.00 -0.85 -0.40 121.76 122.72 3fk5 s ALA 187 Ca 0.00 -0.24 -0.09 0.00 0.00 0.00 0.00 51.96 51.63 3fk5 s ALA 187 Cb 0.00 0.41 -0.00 0.00 0.00 0.00 0.00 23.12 23.52 3fk5 s ALA 187 CO 0.00 -0.46 0.21 0.00 0.00 0.00 0.00 175.76 175.52 3fk5 s ALA 188 N -3.09 -0.15 0.06 0.00 0.00 0.61 -0.86 121.76 118.33 3fk5 s ALA 188 Ca -0.01 -0.70 -0.09 0.00 0.00 0.00 0.00 51.96 51.16 3fk5 s ALA 188 Cb 0.01 0.59 0.00 0.00 0.00 0.00 0.00 23.12 23.73 3fk5 s ALA 188 CO -0.07 -0.55 0.20 0.00 0.00 0.00 0.00 175.76 175.34 3fk5 s ALA 189 N -3.89 -0.31 -0.05 0.00 0.00 -0.52 -0.59 121.76 116.40 3fk5 s ALA 189 Ca 0.08 -0.44 -0.04 0.00 0.00 0.00 0.00 51.96 51.57 3fk5 s ALA 189 Cb 0.04 0.38 0.02 0.00 0.00 0.00 0.00 23.12 23.57 3fk5 s ALA 189 CO -0.08 -0.44 0.13 1.41 0.00 0.00 0.00 175.76 176.79 3fk5 s MET 190 N -3.20 0.13 -0.26 0.00 0.00 -0.34 -1.72 119.30 113.89 3fk5 s MET 190 Ca -0.00 0.25 -0.11 0.00 0.00 0.00 0.00 55.69 55.82 3fk5 s MET 190 Cb 0.02 -0.02 -0.05 0.00 0.00 0.00 0.00 34.83 34.78 3fk5 s MET 190 CO -0.07 -0.07 0.20 0.08 0.00 0.00 0.00 175.02 175.15 3fk5 s VAL 191 N 0.47 5.31 0.13 10.11 1.01 0.11 -1.58 120.40 135.95 3fk5 s VAL 191 Ca -0.03 0.22 0.04 0.00 0.00 0.00 0.00 61.98 62.20 3fk5 s VAL 191 Cb -0.05 -3.54 -0.04 0.00 0.00 0.00 0.00 36.38 32.76 3fk5 s VAL 191 CO -0.02 0.28 0.13 -0.04 0.00 0.00 0.00 175.10 175.44 3fk5 s MET 192 N 1.53 2.95 0.14 2.72 -1.94 0.68 0.66 119.30 126.04 3fk5 s MET 192 Ca 0.08 -0.76 -0.13 0.00 -1.71 0.00 0.00 55.69 53.17 3fk5 s MET 192 Cb -0.15 -2.71 0.01 0.00 2.01 0.00 0.00 34.83 33.99 3fk5 s MET 192 CO 0.09 0.52 0.35 0.00 -0.01 0.00 0.00 175.02 175.97 3fk5 s ALA 193 N -1.60 -0.53 0.18 3.03 0.00 -0.54 -0.29 121.76 122.01 3fk5 s ALA 193 Ca 0.31 -0.43 -0.30 0.00 0.00 0.00 0.00 51.96 51.54 3fk5 s ALA 193 Cb -0.11 0.72 -0.08 0.00 0.00 0.00 0.00 23.12 23.65 3fk5 s ALA 193 CO 0.23 -0.65 1.16 1.03 0.00 0.00 0.00 175.76 177.54 3fk5 s ARG 194 N -3.87 4.53 0.43 0.00 0.52 -0.87 -1.63 118.95 118.05 3fk5 s ARG 194 Ca 0.08 1.81 0.18 0.00 -0.52 0.00 0.00 55.73 57.29 3fk5 s ARG 194 Cb 0.02 -3.26 1.11 0.00 0.52 0.00 0.00 34.95 33.35 3fk5 s ARG 194 CO -0.07 -0.03 1.86 1.15 0.02 0.00 0.00 175.30 178.23 3fk5 h THR 195 N 3.78 0.68 0.00 0.02 2.02 -1.49 -1.63 112.91 116.29 3fk5 h THR 195 Ca -0.44 -0.13 -0.03 0.00 0.77 0.00 0.00 66.41 66.58 3fk5 h THR 195 Cb 1.21 0.27 -0.00 0.00 -1.74 0.00 0.00 68.15 67.89 3fk5 h THR 195 CO 0.74 0.07 -0.15 1.05 0.37 0.00 0.00 175.52 177.60 3fk5 h GLU 196 N 0.37 0.00 0.00 6.66 4.11 -1.90 -0.79 114.58 123.03 3fk5 h GLU 196 Ca 0.46 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.89 3fk5 h GLU 196 Cb 1.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.43 3fk5 h GLU 196 CO -0.16 0.15 0.00 -0.07 0.07 0.00 0.00 179.01 179.00 3fk5 h LEU 197 N 0.00 0.00 -5.99 3.06 3.38 -1.68 -3.37 115.31 110.72 3fk5 h LEU 197 Ca -0.00 0.00 -0.54 0.00 0.09 0.00 0.00 57.88 57.43 3fk5 h LEU 197 Cb 0.68 0.00 -0.40 0.00 0.09 0.00 0.00 40.66 41.03 3fk5 h LEU 197 CO 0.02 0.00 -1.08 1.33 0.09 0.00 0.00 178.44 178.80 3fk5 n VAL 198 N -2.96 -0.20 -1.94 1.22 0.24 -0.32 -5.06 118.33 109.31 3fk5 n VAL 198 Ca 0.04 -4.31 -0.41 0.00 -2.04 0.00 0.00 64.34 57.61 3fk5 n VAL 198 Cb 0.48 -1.48 -0.02 0.00 -1.47 0.00 0.00 33.84 31.35 3fk5 n VAL 198 CO 0.00 0.00 0.00 -2.16 -2.14 0.00 0.00 176.83 172.53 3fk5 s PRO 199 N -1.70 4.22 0.00 7.34 0.04 -1.13 -2.05 135.00 141.73 3fk5 s PRO 199 Ca 0.37 2.40 0.00 0.00 0.04 0.00 0.00 61.00 63.81 3fk5 s PRO 199 Cb 0.22 -3.05 0.00 0.00 0.04 0.00 0.00 34.50 31.71 3fk5 s PRO 199 CO -0.10 -0.44 0.00 -3.47 0.04 0.00 0.00 177.00 173.04 3fk5 n ASP 200 N 1.54 0.00 -4.77 6.66 2.03 -1.26 -5.04 116.55 115.71 3fk5 n ASP 200 Ca 0.04 0.00 -0.33 0.00 0.52 0.00 0.00 54.79 55.02 3fk5 n ASP 200 Cb 0.40 0.00 0.04 0.00 -0.72 0.00 0.00 41.12 40.84 3fk5 n ASP 200 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3fk5 s ALA 201 N -3.30 2.48 0.66 -1.67 0.00 -0.87 -5.00 121.76 114.06 3fk5 s ALA 201 Ca 0.00 0.58 -0.17 0.00 0.00 0.00 0.00 51.96 52.37 3fk5 s ALA 201 Cb 0.00 -3.33 -0.06 0.00 0.00 0.00 0.00 23.12 19.74 3fk5 s ALA 201 CO 0.00 -1.25 0.57 -2.30 0.00 0.00 0.00 175.76 172.78 3fk5 n PRO 202 N -2.33 0.43 -4.66 0.00 -0.02 -1.25 -4.76 135.00 122.41 3fk5 n PRO 202 Ca 0.11 0.18 -0.33 0.00 -2.02 0.00 0.00 63.50 61.44 3fk5 n PRO 202 Cb 0.52 -1.81 -0.12 0.00 -0.02 0.00 0.00 33.50 32.07 3fk5 n PRO 202 CO 0.00 0.00 0.00 0.50 1.98 0.00 0.00 175.50 177.98 3fk5 s ARG 203 N -2.51 2.55 -0.31 -0.52 3.52 -0.39 -0.49 118.95 120.79 3fk5 s ARG 203 Ca 0.68 -0.69 -0.09 0.00 -0.13 0.00 0.00 55.73 55.50 3fk5 s ARG 203 Cb -0.39 -2.46 -0.00 0.00 -1.56 0.00 0.00 34.95 30.54 3fk5 s ARG 203 CO 0.55 0.62 0.13 -0.47 -0.81 0.00 0.00 175.30 175.33 3fk5 s TYR 204 N -0.85 3.17 -0.18 5.12 5.04 -0.39 -1.06 117.35 128.20 3fk5 s TYR 204 Ca 0.14 -0.69 0.17 0.00 -2.44 0.00 0.00 57.07 54.25 3fk5 s TYR 204 Cb -0.11 -2.33 0.01 0.00 0.35 0.00 0.00 41.96 39.89 3fk5 s TYR 204 CO 0.03 -0.49 1.21 0.87 -1.34 0.00 0.00 175.55 175.83 3fk5 h LYS 205 N 8.32 0.00 0.00 4.97 1.57 -1.35 -3.42 116.57 126.66 3fk5 h LYS 205 Ca -0.32 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.46 3fk5 h LYS 205 Cb 1.14 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.45 3fk5 h LYS 205 CO 0.61 0.33 0.00 0.41 -0.57 0.00 0.00 179.45 180.23 3fk5 n GLY 206 N 1.27 -1.80 0.00 3.86 0.00 -1.25 -0.48 105.19 106.79 3fk5 n GLY 206 Ca -0.02 -1.86 0.00 0.00 0.00 0.00 0.00 46.02 44.14 3fk5 n GLY 206 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fk5 n GLY 207 N 0.00 1.64 3.21 -0.02 0.00 -1.26 -1.70 105.19 107.05 3fk5 n GLY 207 Ca 0.00 -0.30 -0.16 0.00 0.00 0.00 0.00 46.02 45.56 3fk5 n GLY 207 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3fk5 s VAL 208 N -0.95 1.13 -0.01 1.61 -7.23 0.50 -4.98 120.40 110.46 3fk5 s VAL 208 Ca 0.00 -1.69 0.00 0.00 -1.81 0.00 0.00 61.98 58.48 3fk5 s VAL 208 Cb 0.00 -1.45 0.01 0.00 0.56 0.00 0.00 36.38 35.50 3fk5 s VAL 208 CO 0.00 -0.50 -0.01 -0.89 -0.31 0.00 0.00 175.10 173.39 3fk5 s THR 209 N -2.34 0.14 0.23 5.32 2.01 -1.26 -1.05 115.64 118.69 3fk5 s THR 209 Ca 0.07 0.01 0.09 0.00 0.31 0.00 0.00 61.69 62.17 3fk5 s THR 209 Cb -0.04 -0.18 -0.05 0.00 0.01 0.00 0.00 72.50 72.24 3fk5 s THR 209 CO 0.01 0.09 -0.15 -0.13 -0.69 0.00 0.00 174.62 173.75 3fk5 s ARG 210 N 0.46 1.43 0.06 4.92 1.81 -0.65 -5.01 118.95 121.97 3fk5 s ARG 210 Ca -0.04 -1.65 -0.01 0.00 -1.72 0.00 0.00 55.73 52.31 3fk5 s ARG 210 Cb -0.07 -1.26 -0.04 0.00 -0.45 0.00 0.00 34.95 33.13 3fk5 s ARG 210 CO -0.01 0.20 -0.02 -1.54 -0.68 0.00 0.00 175.30 173.25 3fk5 s SER 211 N -3.37 0.47 -0.41 0.23 1.04 -1.26 -1.17 113.70 109.23 3fk5 s SER 211 Ca 0.25 -1.02 0.08 0.00 0.48 0.00 0.00 55.95 55.74 3fk5 s SER 211 Cb -0.01 0.21 0.27 0.00 0.10 0.00 0.00 66.02 66.59 3fk5 s SER 211 CO 0.09 -0.61 0.67 0.00 0.98 0.00 0.00 173.24 174.36 3fk5 n ALA 212 N 0.09 1.47 0.61 5.32 0.00 0.31 -4.97 120.51 123.34 3fk5 n ALA 212 Ca -0.13 -2.93 0.12 0.00 0.00 0.00 0.00 53.44 50.49 3fk5 n ALA 212 Cb 0.61 -0.95 0.46 0.00 0.00 0.00 0.00 19.45 19.57 3fk5 n ALA 212 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3fk5 n THR 213 N 1.15 0.62 0.33 0.00 -2.24 -1.25 -1.48 114.28 111.41 3fk5 n THR 213 Ca 0.19 0.05 0.12 0.00 -2.27 0.00 0.00 64.05 62.14 3fk5 n THR 213 Cb 0.58 -0.83 0.66 0.00 -2.10 0.00 0.00 70.33 68.65 3fk5 n THR 213 CO 0.00 0.00 0.00 1.05 -0.57 0.00 0.00 175.07 175.55 3fk5 h GLU 214 N 0.00 0.00 -0.51 -0.78 9.09 -1.93 -1.93 114.58 118.53 3fk5 h GLU 214 Ca 0.00 0.00 -0.04 0.00 0.05 0.00 0.00 59.36 59.37 3fk5 h GLU 214 Cb 0.47 0.00 -0.02 0.00 -1.65 0.00 0.00 28.75 27.55 3fk5 h GLU 214 CO 0.00 0.00 0.04 0.91 0.05 0.00 0.00 179.01 180.01 3fk5 n TRP 215 N -2.79 1.81 0.29 2.06 7.02 -0.55 -4.60 117.44 120.68 3fk5 n TRP 215 Ca -0.02 -0.86 0.17 0.00 -1.02 0.00 0.00 57.50 55.77 3fk5 n TRP 215 Cb 0.48 -0.49 0.86 0.00 -2.42 0.00 0.00 31.31 29.75 3fk5 n TRP 215 CO 0.00 0.00 0.00 -2.95 -2.02 0.00 0.00 177.69 172.72 3fk5 h ASN 216 N 3.14 0.00 0.56 -0.99 7.08 -1.03 -2.11 115.58 122.23 3fk5 h ASN 216 Ca 0.04 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.26 3fk5 h ASN 216 Cb 1.89 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 38.13 3fk5 h ASN 216 CO 0.46 0.05 0.00 0.29 -2.08 0.00 0.00 177.43 176.15 3fk5 n LYS 217 N -3.33 0.43 0.26 4.14 5.02 -1.26 -3.82 118.16 119.60 3fk5 n LYS 217 Ca -0.01 0.00 0.14 0.00 -2.02 0.00 0.00 58.31 56.42 3fk5 n LYS 217 Cb 0.21 -1.50 0.70 0.00 -0.02 0.00 0.00 35.03 34.41 3fk5 n LYS 217 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 3fk5 h LEU 218 N 0.00 0.00 -7.86 -0.35 3.38 -1.75 -3.43 115.31 105.30 3fk5 h LEU 218 Ca 0.00 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.89 3fk5 h LEU 218 Cb 0.28 0.00 -0.12 0.00 0.09 0.00 0.00 40.66 40.91 3fk5 h LEU 218 CO 0.00 0.11 -0.22 0.00 0.09 0.00 0.00 178.44 178.42 3fk5 s ARG 220 N -3.91 0.34 -0.03 0.00 1.81 -0.64 -4.98 118.95 111.55 3fk5 s ARG 220 Ca 0.11 0.68 -0.00 0.00 -1.72 0.00 0.00 55.73 54.80 3fk5 s ARG 220 Cb 0.02 -0.02 0.03 0.00 -0.45 0.00 0.00 34.95 34.53 3fk5 s ARG 220 CO -0.04 -0.14 0.03 0.20 -0.68 0.00 0.00 175.30 174.66 3fk5 s GLY 221 N 1.20 0.18 0.36 -3.53 0.00 -1.26 -1.35 107.32 102.91 3fk5 s GLY 221 Ca -0.08 0.22 0.04 0.00 0.00 0.00 0.00 44.72 44.90 3fk5 s GLY 221 CO -0.10 0.88 0.07 -1.31 0.00 0.00 0.00 173.10 172.63 3fk5 s ASN 222 N 1.39 2.66 0.52 1.64 0.01 -0.17 -5.01 114.94 115.97 3fk5 s ASN 222 Ca -0.05 -1.45 0.19 0.00 -0.71 0.00 0.00 52.86 50.84 3fk5 s ASN 222 Cb -0.13 0.04 1.30 0.00 0.41 0.00 0.00 41.25 42.88 3fk5 s ASN 222 CO -0.03 -0.67 2.10 -0.07 -1.51 0.00 0.00 177.10 176.91 3fk5 h LEU 223 N 1.98 0.01 -0.01 0.60 3.38 -2.03 -3.11 115.31 116.14 3fk5 h LEU 223 Ca -0.40 -0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.41 3fk5 h LEU 223 Cb 1.25 -0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.98 3fk5 h LEU 223 CO 0.68 0.01 -0.74 0.44 0.09 0.00 0.00 178.44 178.92 3fk5 h ASP 224 N 0.02 0.00 -3.00 -0.43 3.32 -2.03 -3.48 116.42 110.82 3fk5 h ASP 224 Ca 0.09 0.00 0.05 0.00 0.02 0.00 0.00 57.03 57.19 3fk5 h ASP 224 Cb 0.33 0.00 -0.24 0.00 0.22 0.00 0.00 39.33 39.64 3fk5 h ASP 224 CO -0.00 0.74 0.23 -0.60 -1.72 0.00 0.00 179.24 177.90 3fk5 s ARG 225 N -2.84 0.58 -0.09 3.56 3.52 -1.18 -5.14 118.95 117.36 3fk5 s ARG 225 Ca 0.03 0.90 0.02 0.00 -0.13 0.00 0.00 55.73 56.54 3fk5 s ARG 225 Cb 0.09 0.17 0.01 0.00 -1.56 0.00 0.00 34.95 33.66 3fk5 s ARG 225 CO 0.78 -0.10 -0.14 1.41 -0.81 0.00 0.00 175.30 176.44 3fk5 s MET 226 N 1.13 1.98 -0.01 5.12 -2.45 -1.26 -1.00 119.30 122.81 3fk5 s MET 226 Ca -0.06 -0.49 0.07 0.00 -1.25 0.00 0.00 55.69 53.96 3fk5 s MET 226 Cb -0.05 -1.67 -0.02 0.00 1.25 0.00 0.00 34.83 34.34 3fk5 s MET 226 CO -0.13 -0.03 -0.21 0.08 1.05 0.00 0.00 175.02 175.78 3fk5 s VAL 227 N 0.87 1.67 0.05 10.11 1.01 -0.46 -4.82 120.40 128.83 3fk5 s VAL 227 Ca -0.10 -0.92 -0.10 0.00 0.00 0.00 0.00 61.98 60.86 3fk5 s VAL 227 Cb -0.15 -1.39 0.00 0.00 0.00 0.00 0.00 36.38 34.84 3fk5 s VAL 227 CO 0.01 0.46 0.20 0.42 0.00 0.00 0.00 175.10 176.19 3fk5 s THR 228 N -0.51 0.11 -0.59 3.92 -4.23 -1.26 -1.62 115.64 111.46 3fk5 s THR 228 Ca 0.08 -0.94 0.02 0.00 -1.18 0.00 0.00 61.69 59.67 3fk5 s THR 228 Cb -0.08 -1.01 0.15 0.00 1.34 0.00 0.00 72.50 72.89 3fk5 s THR 228 CO -0.01 -0.52 0.37 -0.62 -0.54 0.00 0.00 174.62 173.30 3fk5 s ASP 229 N -2.27 4.73 0.40 3.99 -1.08 0.57 -4.96 116.67 118.05 3fk5 s ASP 229 Ca -0.03 -3.09 0.17 0.00 -0.52 0.00 0.00 52.55 49.09 3fk5 s ASP 229 Cb 0.00 -1.72 0.84 0.00 -1.46 0.00 0.00 42.92 40.58 3fk5 s ASP 229 CO -0.06 -0.26 1.84 0.71 0.52 0.00 0.00 175.17 177.93 3fk5 h THR 230 N 5.24 1.02 0.24 1.71 1.35 -1.98 -0.31 112.91 120.18 3fk5 h THR 230 Ca -0.03 -1.24 -0.01 0.00 -0.55 0.00 0.00 66.41 64.58 3fk5 h THR 230 Cb 0.89 1.71 0.00 0.00 -1.73 0.00 0.00 68.15 69.03 3fk5 h THR 230 CO 0.71 0.33 -0.12 -0.09 -0.25 0.00 0.00 175.52 176.10 3fk5 h ARG 231 N 0.00 -0.31 -0.00 4.72 2.43 -1.98 -2.36 114.38 116.87 3fk5 h ARG 231 Ca -0.00 0.02 -0.17 0.00 -0.81 0.00 0.00 59.98 59.02 3fk5 h ARG 231 Cb 0.68 0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 30.29 3fk5 h ARG 231 CO 0.04 -0.19 -0.79 -0.07 -1.51 0.00 0.00 179.97 177.46 3fk5 h LEU 232 N -0.35 0.07 -0.69 3.80 3.38 -1.92 -2.22 115.31 117.39 3fk5 h LEU 232 Ca -0.03 -0.06 0.08 0.00 0.09 0.00 0.00 57.88 57.96 3fk5 h LEU 232 Cb 0.27 -0.02 -0.07 0.00 0.09 0.00 0.00 40.66 40.93 3fk5 h LEU 232 CO 0.05 0.83 0.35 -0.07 0.09 0.00 0.00 178.44 179.69 3fk5 h LEU 233 N 0.03 0.47 0.06 1.67 3.38 -1.00 0.38 115.31 120.30 3fk5 h LEU 233 Ca -0.02 0.05 -0.00 0.00 0.09 0.00 0.00 57.88 58.00 3fk5 h LEU 233 Cb 1.39 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 42.11 3fk5 h LEU 233 CO 0.11 0.28 -0.03 0.25 0.09 0.00 0.00 178.44 179.14 3fk5 h LEU 234 N 0.61 -0.07 -0.22 1.67 5.85 -1.29 0.09 115.31 121.95 3fk5 h LEU 234 Ca 0.33 -0.25 -0.02 0.00 0.84 0.00 0.00 57.88 58.79 3fk5 h LEU 234 Cb 0.31 0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.35 3fk5 h LEU 234 CO -0.24 0.21 0.07 0.40 -0.34 0.00 0.00 178.44 178.54 3fk5 h ILE 235 N -0.35 1.19 0.00 4.05 2.04 -1.19 -2.23 117.51 121.02 3fk5 h ILE 235 Ca -0.01 -0.59 -0.17 0.00 1.00 0.00 0.00 64.86 65.09 3fk5 h ILE 235 Cb 0.31 1.17 -0.03 0.00 -0.74 0.00 0.00 36.82 37.53 3fk5 h ILE 235 CO 0.01 0.19 -0.97 -0.33 0.00 0.00 0.00 178.15 177.06 3fk5 h GLU 236 N 0.19 0.00 -0.35 2.37 4.39 -0.32 -2.57 114.58 118.29 3fk5 h GLU 236 Ca 0.07 0.00 0.02 0.00 0.34 0.00 0.00 59.36 59.79 3fk5 h GLU 236 Cb 0.23 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 28.85 3fk5 h GLU 236 CO -0.00 0.62 0.19 0.78 -1.16 0.00 0.00 179.01 179.44 3fk5 h GLY 237 N 3.38 0.48 1.03 -3.84 0.00 -0.95 -1.19 103.07 101.97 3fk5 h GLY 237 Ca -0.07 -0.14 -0.13 0.00 0.00 0.00 0.00 47.33 46.99 3fk5 h GLY 237 CO 0.08 0.12 -0.31 -2.22 0.00 0.00 0.00 176.54 174.21 3fk5 h ILE 238 N 0.39 1.29 -0.85 2.60 2.04 -1.40 -1.93 117.51 119.64 3fk5 h ILE 238 Ca 0.14 -1.48 -0.01 0.00 1.00 0.00 0.00 64.86 64.51 3fk5 h ILE 238 Cb 0.03 1.50 -0.04 0.00 -0.74 0.00 0.00 36.82 37.56 3fk5 h ILE 238 CO -0.08 0.48 0.50 0.11 0.00 0.00 0.00 178.15 179.16 3fk5 h LYS 239 N 0.56 1.16 -0.77 2.37 1.57 -1.39 -1.59 116.57 118.49 3fk5 h LYS 239 Ca 0.05 -0.11 -0.03 0.00 -1.87 0.00 0.00 60.65 58.69 3fk5 h LYS 239 Cb 0.89 -0.24 -0.04 0.00 0.08 0.00 0.00 32.23 32.93 3fk5 h LYS 239 CO 0.08 0.83 0.35 1.25 -0.57 0.00 0.00 179.45 181.39 3fk5 h LEU 240 N 1.17 1.02 -1.17 2.94 5.85 -1.10 -2.24 115.31 121.80 3fk5 h LEU 240 Ca 0.30 -0.13 -0.09 0.00 0.84 0.00 0.00 57.88 58.81 3fk5 h LEU 240 Cb -0.03 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 40.73 3fk5 h LEU 240 CO -0.05 0.88 -0.41 0.00 -0.34 0.00 0.00 178.44 178.51 3fk5 h ALA 241 N 1.27 1.30 -0.11 1.25 0.00 -0.91 -1.32 119.26 120.73 3fk5 h ALA 241 Ca 0.26 -0.38 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 3fk5 h ALA 241 Cb 0.14 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.86 3fk5 h ALA 241 CO -0.03 0.52 0.03 1.96 0.00 0.00 0.00 179.25 181.73 3fk5 h GLN 242 N 0.00 0.18 -0.75 0.00 4.20 -0.81 0.22 115.11 118.15 3fk5 h GLN 242 Ca -0.00 -0.04 0.02 0.00 0.06 0.00 0.00 58.65 58.68 3fk5 h GLN 242 Cb 0.74 -0.02 -0.04 0.00 0.30 0.00 0.00 27.48 28.45 3fk5 h GLN 242 CO 0.05 0.34 0.49 -0.22 -0.67 0.00 0.00 178.83 178.82 3fk5 h LYS 243 N -0.01 0.94 -0.15 1.46 3.64 -1.31 -2.64 116.57 118.50 3fk5 h LYS 243 Ca 0.04 -0.06 -0.19 0.00 -1.27 0.00 0.00 60.65 59.17 3fk5 h LYS 243 Cb 0.24 -0.21 -0.00 0.00 -0.41 0.00 0.00 32.23 31.84 3fk5 h LYS 243 CO -0.00 0.62 -0.67 1.15 -2.27 0.00 0.00 179.45 178.29 3fk5 h THR 244 N 0.97 1.32 -0.70 1.00 2.02 -0.93 -2.37 112.91 114.22 3fk5 h THR 244 Ca 0.29 -1.95 0.02 0.00 0.77 0.00 0.00 66.41 65.54 3fk5 h THR 244 Cb -0.04 1.92 -0.04 0.00 -1.74 0.00 0.00 68.15 68.25 3fk5 h THR 244 CO -0.09 0.60 0.46 -0.26 0.37 0.00 0.00 175.52 176.61 3fk5 h PHE 245 N 0.43 0.85 -0.54 3.16 0.05 -0.44 -1.12 116.94 119.33 3fk5 h PHE 245 Ca -0.02 0.02 -0.06 0.00 3.82 0.00 0.00 57.97 61.73 3fk5 h PHE 245 Cb 1.25 -0.29 -0.02 0.00 2.00 0.00 0.00 35.95 38.89 3fk5 h PHE 245 CO 0.06 0.52 0.10 1.25 -0.18 0.00 0.00 178.31 180.07 3fk5 h LEU 246 N 0.91 0.85 -1.02 1.54 6.46 -1.31 0.21 115.31 122.96 3fk5 h LEU 246 Ca 0.26 -0.25 -0.03 0.00 -0.12 0.00 0.00 57.88 57.75 3fk5 h LEU 246 Cb -0.05 -0.23 -0.03 0.00 -0.73 0.00 0.00 40.66 39.62 3fk5 h LEU 246 CO -0.06 0.89 0.36 0.00 -0.62 0.00 0.00 178.44 179.00 3fk5 h ALA 247 N 1.00 1.24 0.00 1.25 0.00 -1.02 -2.80 119.26 118.93 3fk5 h ALA 247 Ca 0.17 -0.14 -0.12 0.00 0.00 0.00 0.00 54.91 54.81 3fk5 h ALA 247 Cb 0.39 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 3fk5 h ALA 247 CO 0.01 0.59 -0.58 0.00 0.00 0.00 0.00 179.25 179.27 3fk5 h ALA 248 N 1.34 0.77 -0.28 0.00 0.00 -0.77 0.13 119.26 120.45 3fk5 h ALA 248 Ca 0.26 -0.52 0.01 0.00 0.00 0.00 0.00 54.91 54.66 3fk5 h ALA 248 Cb 0.10 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 3fk5 h ALA 248 CO -0.03 0.72 0.16 -0.09 0.00 0.00 0.00 179.25 180.00 3fk5 h ARG 249 N 0.00 0.31 -0.01 0.00 9.65 -0.47 0.22 114.38 124.08 3fk5 h ARG 249 Ca -0.01 -0.02 -0.01 0.00 -1.10 0.00 0.00 59.98 58.84 3fk5 h ARG 249 Cb 1.24 -0.07 0.00 0.00 -1.39 0.00 0.00 29.97 29.75 3fk5 h ARG 249 CO 0.07 0.21 -0.04 1.96 2.80 0.00 0.00 179.97 184.98 3fk5 h GLN 250 N 0.32 0.05 0.10 0.20 4.20 -1.22 -1.39 115.11 117.36 3fk5 h GLN 250 Ca 0.11 -0.03 -0.33 0.00 0.06 0.00 0.00 58.65 58.46 3fk5 h GLN 250 Cb 0.01 0.01 -0.02 0.00 0.30 0.00 0.00 27.48 27.78 3fk5 h GLN 250 CO -0.06 0.65 -1.75 -0.24 -0.67 0.00 0.00 178.83 176.76 3fk5 h VAL 251 N -0.55 0.88 -0.00 -0.54 3.04 -0.83 -3.38 116.25 114.86 3fk5 h VAL 251 Ca -0.00 -2.59 0.00 0.00 -1.01 0.00 0.00 66.70 63.10 3fk5 h VAL 251 Cb 0.65 2.59 0.00 0.00 -2.01 0.00 0.00 31.29 32.52 3fk5 h VAL 251 CO 0.01 0.77 -0.80 0.18 -1.01 0.00 0.00 177.57 176.72 3fk5 n LEU 252 N -3.38 1.25 -0.16 3.16 4.77 -0.02 -4.96 117.00 117.66 3fk5 n LEU 252 Ca -0.23 -0.58 -0.02 0.00 -0.03 0.00 0.00 56.01 55.16 3fk5 n LEU 252 Cb 1.05 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 42.13 3fk5 n LEU 252 CO 0.47 0.28 -0.02 0.61 -1.33 0.00 0.00 177.39 177.39 3fk5 n GLY 253 N 1.45 0.55 3.77 -0.72 0.00 -0.52 -4.98 105.19 104.73 3fk5 n GLY 253 Ca 0.05 -0.82 -0.40 0.00 0.00 0.00 0.00 46.02 44.85 3fk5 n GLY 253 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3fk5 s TRP 254 N -2.06 2.50 0.09 1.61 0.52 -1.00 -4.93 118.94 115.66 3fk5 s TRP 254 Ca 0.00 1.21 -0.26 0.00 0.02 0.00 0.00 56.10 57.08 3fk5 s TRP 254 Cb 0.00 -3.98 0.08 0.00 -1.15 0.00 0.00 33.47 28.42 3fk5 s TRP 254 CO 0.00 -3.00 0.67 0.00 0.02 0.00 0.00 176.95 174.64 3fk5 s ALA 255 N -1.16 -1.68 0.31 0.98 0.00 -1.26 -4.37 121.76 114.57 3fk5 s ALA 255 Ca 0.57 0.75 -0.00 0.00 0.00 0.00 0.00 51.96 53.28 3fk5 s ALA 255 Cb -0.45 0.61 0.49 0.00 0.00 0.00 0.00 23.12 23.76 3fk5 s ALA 255 CO 0.60 -0.67 1.92 -0.24 0.00 0.00 0.00 175.76 177.37 3fk5 h VAL 256 N 2.19 1.20 0.00 0.00 3.04 -1.95 -0.77 116.25 119.96 3fk5 h VAL 256 Ca -0.30 -0.54 0.00 0.00 -1.01 0.00 0.00 66.70 64.84 3fk5 h VAL 256 Cb 1.26 0.37 0.00 0.00 -2.01 0.00 0.00 31.29 30.91 3fk5 h VAL 256 CO 0.37 0.23 0.00 0.47 -1.01 0.00 0.00 177.57 177.63 3fk5 n ASP 257 N -4.36 0.19 0.03 3.17 10.43 -1.26 -3.45 116.55 121.30 3fk5 n ASP 257 Ca 0.06 0.53 0.12 0.00 2.57 0.00 0.00 54.79 58.07 3fk5 n ASP 257 Cb 0.12 -0.58 0.13 0.00 1.84 0.00 0.00 41.12 42.63 3fk5 n ASP 257 CO 0.00 0.00 0.00 -0.62 -1.07 0.00 0.00 177.20 175.51 3fk5 n GLU 258 N -1.69 0.19 -4.12 -1.24 -0.58 -0.30 -4.93 120.64 107.97 3fk5 n GLU 258 Ca 0.05 0.02 -0.35 0.00 -0.42 0.00 0.00 57.16 56.47 3fk5 n GLU 258 Cb 0.27 -1.59 -0.12 0.00 -0.57 0.00 0.00 31.44 29.44 3fk5 n GLU 258 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 3fk5 s LEU 259 N -3.68 3.37 -0.07 -4.62 1.43 -1.20 -4.65 118.68 109.25 3fk5 s LEU 259 Ca 0.07 -0.14 0.00 0.00 -1.03 0.00 0.00 54.13 53.04 3fk5 s LEU 259 Cb 0.15 -1.85 -0.25 0.00 0.03 0.00 0.00 46.19 44.27 3fk5 s LEU 259 CO 0.75 0.10 0.56 0.44 0.23 0.00 0.00 176.35 178.43 3fk5 h ASP 260 N 7.22 0.27 -4.49 2.29 3.32 -1.36 -3.48 116.42 120.20 3fk5 h ASP 260 Ca -0.35 -0.56 -0.17 0.00 0.02 0.00 0.00 57.03 55.97 3fk5 h ASP 260 Cb 1.18 -0.09 -0.23 0.00 0.22 0.00 0.00 39.33 40.41 3fk5 h ASP 260 CO 0.63 1.50 -0.57 -1.10 -1.72 0.00 0.00 179.24 177.98 3fk5 s GLN 261 N -2.58 0.31 -0.18 3.56 -1.52 -1.17 -4.83 119.66 113.25 3fk5 s GLN 261 Ca -0.14 -0.21 -0.01 0.00 -1.95 0.00 0.00 55.36 53.05 3fk5 s GLN 261 Cb 0.07 0.13 0.00 0.00 -0.22 0.00 0.00 33.01 32.99 3fk5 s GLN 261 CO 0.80 -0.06 -0.13 -0.06 -0.25 0.00 0.00 175.29 175.60 3fk5 s PHE 262 N -0.81 2.84 -0.40 0.91 0.40 0.59 -1.50 117.98 120.02 3fk5 s PHE 262 Ca -0.09 -1.14 -0.05 0.00 -0.60 0.00 0.00 56.93 55.05 3fk5 s PHE 262 Cb -0.05 -1.97 0.09 0.00 0.51 0.00 0.00 43.02 41.60 3fk5 s PHE 262 CO 0.01 -0.57 0.19 0.08 0.70 0.00 0.00 175.22 175.63 3fk5 s VAL 263 N 1.13 3.58 -0.04 -0.44 1.01 0.12 -4.04 120.40 121.73 3fk5 s VAL 263 Ca 0.01 -1.72 0.07 0.00 0.00 0.00 0.00 61.98 60.34 3fk5 s VAL 263 Cb -0.14 -3.29 -0.02 0.00 0.00 0.00 0.00 36.38 32.93 3fk5 s VAL 263 CO -0.04 -0.53 -0.26 -0.63 0.00 0.00 0.00 175.10 173.64 3fk5 s ILE 264 N 1.26 2.05 0.25 2.22 1.01 -1.26 -1.27 121.20 125.46 3fk5 s ILE 264 Ca 0.04 -1.09 -0.30 0.00 0.00 0.00 0.00 60.65 59.30 3fk5 s ILE 264 Cb -0.22 -1.72 -0.09 0.00 0.01 0.00 0.00 42.46 40.43 3fk5 s ILE 264 CO -0.01 0.58 1.33 -2.28 0.00 0.00 0.00 174.94 174.55 3fk5 s HIS 265 N -0.39 3.16 -0.02 3.97 5.65 -0.25 -4.77 115.29 122.65 3fk5 s HIS 265 Ca 0.03 1.24 0.08 0.00 0.25 0.00 0.00 55.06 56.65 3fk5 s HIS 265 Cb -0.12 -3.66 -0.02 0.00 -1.18 0.00 0.00 32.58 27.60 3fk5 s HIS 265 CO 0.01 -2.02 -0.25 -0.65 -0.65 0.00 0.00 174.74 171.19 3fk5 s GLN 266 N -0.62 2.00 -0.09 2.88 -0.21 -1.26 -4.80 119.66 117.56 3fk5 s GLN 266 Ca 0.55 -0.88 0.10 0.00 0.02 0.00 0.00 55.36 55.15 3fk5 s GLN 266 Cb -0.38 -1.93 -0.14 0.00 1.00 0.00 0.00 33.01 31.56 3fk5 s GLN 266 CO 0.43 0.53 0.07 0.28 -2.12 0.00 0.00 175.29 174.48 3fk5 n VAL 267 N 2.48 0.60 -3.55 1.09 0.31 -1.26 -4.59 118.33 113.41 3fk5 n VAL 267 Ca -0.16 -0.41 -0.08 0.00 -0.01 0.00 0.00 64.34 63.68 3fk5 n VAL 267 Cb 0.51 -0.56 -0.03 0.00 -0.91 0.00 0.00 33.84 32.85 3fk5 n VAL 267 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 3fk5 s SER 268 N -4.12 -0.31 0.14 4.52 1.04 -1.26 -4.91 113.70 108.80 3fk5 s SER 268 Ca -0.05 0.13 -0.23 0.00 0.48 0.00 0.00 55.95 56.28 3fk5 s SER 268 Cb 0.04 0.30 -0.01 0.00 0.10 0.00 0.00 66.02 66.45 3fk5 s SER 268 CO 0.43 -0.44 1.65 -0.09 0.98 0.00 0.00 173.24 175.78 3fk5 h ARG 269 N 2.17 -0.22 -0.09 4.02 2.43 -0.97 -1.52 114.38 120.20 3fk5 h ARG 269 Ca -0.18 0.02 -0.08 0.00 -0.81 0.00 0.00 59.98 58.93 3fk5 h ARG 269 Cb 1.20 0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.79 3fk5 h ARG 269 CO 0.29 -0.15 -0.29 -1.00 -1.51 0.00 0.00 179.97 177.31 3fk5 h PRO 270 N -0.23 0.16 -0.58 0.20 0.13 -1.75 -0.68 132.00 129.25 3fk5 h PRO 270 Ca 0.11 -0.05 -0.04 0.00 -0.87 0.00 0.00 66.00 65.14 3fk5 h PRO 270 Cb 0.39 -0.01 -0.02 0.00 0.13 0.00 0.00 31.00 31.48 3fk5 h PRO 270 CO -0.29 0.44 0.21 0.45 -0.23 0.00 0.00 178.00 178.58 3fk5 h HIS 271 N 0.14 0.90 -0.56 1.56 3.86 -1.83 -1.91 115.15 117.30 3fk5 h HIS 271 Ca 0.02 -0.08 -0.09 0.00 -1.16 0.00 0.00 60.37 59.07 3fk5 h HIS 271 Cb 0.59 -0.26 -0.02 0.00 1.06 0.00 0.00 27.41 28.78 3fk5 h HIS 271 CO 0.01 0.74 0.02 1.15 0.86 0.00 0.00 177.93 180.70 3fk5 h THR 272 N 0.80 1.26 -0.53 2.45 2.02 -1.03 -1.75 112.91 116.13 3fk5 h THR 272 Ca 0.19 -1.10 0.05 0.00 0.77 0.00 0.00 66.41 66.32 3fk5 h THR 272 Cb 0.24 0.85 -0.05 0.00 -1.74 0.00 0.00 68.15 67.46 3fk5 h THR 272 CO -0.01 0.40 0.26 0.00 0.37 0.00 0.00 175.52 176.54 3fk5 h ALA 273 N 0.97 0.68 -0.21 6.16 0.00 -0.99 -0.61 119.26 125.26 3fk5 h ALA 273 Ca 0.16 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.10 3fk5 h ALA 273 Cb 0.52 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 3fk5 h ALA 273 CO 0.03 -0.09 0.13 0.00 0.00 0.00 0.00 179.25 179.32 3fk5 h ALA 274 N 1.29 0.26 0.33 0.00 0.00 -1.15 -1.50 119.26 118.49 3fk5 h ALA 274 Ca 0.24 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.11 3fk5 h ALA 274 Cb 0.15 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 3fk5 h ALA 274 CO -0.17 -0.23 -0.34 0.35 0.00 0.00 0.00 179.25 178.86 3fk5 h PHE 275 N 0.26 -0.92 -0.94 0.00 3.57 -1.13 0.95 116.94 118.73 3fk5 h PHE 275 Ca 0.07 0.01 0.12 0.00 3.53 0.00 0.00 57.97 61.71 3fk5 h PHE 275 Cb 0.01 0.36 -0.09 0.00 2.79 0.00 0.00 35.95 39.03 3fk5 h PHE 275 CO -0.05 -0.48 0.57 0.28 -2.23 0.00 0.00 178.31 176.40 3fk5 h VAL 276 N -0.70 0.87 -0.09 1.41 2.07 -1.07 -1.99 116.25 116.75 3fk5 h VAL 276 Ca -0.02 -0.30 -0.08 0.00 0.82 0.00 0.00 66.70 67.12 3fk5 h VAL 276 Cb 0.64 -0.09 0.00 0.00 -1.52 0.00 0.00 31.29 30.32 3fk5 h VAL 276 CO -0.07 0.16 -0.24 0.50 0.02 0.00 0.00 177.57 177.94 3fk5 h LYS 277 N 0.88 0.33 -0.37 1.57 3.64 -1.14 -1.08 116.57 120.41 3fk5 h LYS 277 Ca 0.48 -0.23 0.11 0.00 -1.27 0.00 0.00 60.65 59.74 3fk5 h LYS 277 Cb 0.52 0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.36 3fk5 h LYS 277 CO -0.28 0.84 0.30 0.77 -2.27 0.00 0.00 179.45 178.81 3fk5 h SER 278 N -0.13 0.00 -0.15 4.20 0.02 -0.60 -2.95 113.55 113.94 3fk5 h SER 278 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 3fk5 h SER 278 Cb 0.85 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.39 3fk5 h SER 278 CO 0.05 0.00 0.00 0.49 -1.14 0.00 0.00 176.83 176.23 3fk5 n PHE 279 N -4.17 0.19 -2.70 3.45 3.72 -0.77 -4.99 117.46 112.19 3fk5 n PHE 279 Ca 0.06 -0.23 -0.13 0.00 -0.05 0.00 0.00 57.45 57.10 3fk5 n PHE 279 Cb 0.48 -0.01 0.02 0.00 -0.94 0.00 0.00 39.48 39.03 3fk5 n PHE 279 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3fk5 n GLY 280 N 0.48 -0.04 3.84 1.37 0.00 -0.69 -5.00 105.19 105.15 3fk5 n GLY 280 Ca 0.08 -0.24 -0.37 0.00 0.00 0.00 0.00 46.02 45.49 3fk5 n GLY 280 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3fk5 s ILE 281 N -2.91 4.91 -0.31 -0.61 1.01 -0.49 -5.03 121.20 117.75 3fk5 s ILE 281 Ca 0.18 0.86 -0.29 0.00 0.00 0.00 0.00 60.65 61.40 3fk5 s ILE 281 Cb -0.08 -3.75 -0.00 0.00 0.01 0.00 0.00 42.46 38.64 3fk5 s ILE 281 CO 0.22 0.40 1.38 -0.62 0.00 0.00 0.00 174.94 176.31 3fk5 s ASP 282 N -1.44 6.55 0.34 3.58 -1.08 -1.26 -4.75 116.67 118.61 3fk5 s ASP 282 Ca 0.32 1.20 0.20 0.00 -0.52 0.00 0.00 52.55 53.74 3fk5 s ASP 282 Cb -0.16 -2.54 1.09 0.00 -1.46 0.00 0.00 42.92 39.85 3fk5 s ASP 282 CO 0.18 -1.18 1.59 1.55 0.52 0.00 0.00 175.17 177.82 3fk5 h PRO 283 N 9.82 0.00 0.00 4.34 0.13 -1.95 0.37 132.00 144.71 3fk5 h PRO 283 Ca -0.28 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.85 3fk5 h PRO 283 Cb 1.11 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.24 3fk5 h PRO 283 CO 1.04 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.81 3fk5 n ALA 284 N -1.73 2.03 -0.77 -0.56 0.00 -1.26 -2.70 120.51 115.51 3fk5 n ALA 284 Ca -0.01 0.02 0.08 0.00 0.00 0.00 0.00 53.44 53.53 3fk5 n ALA 284 Cb 0.12 -1.44 0.38 0.00 0.00 0.00 0.00 19.45 18.52 3fk5 n ALA 284 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3fk5 n LYS 285 N -2.26 4.32 -3.80 0.00 5.02 0.13 -4.71 118.16 116.86 3fk5 n LYS 285 Ca 0.04 -3.04 -0.30 0.00 -2.02 0.00 0.00 58.31 53.00 3fk5 n LYS 285 Cb 0.35 -2.08 -0.13 0.00 -0.02 0.00 0.00 35.03 33.14 3fk5 n LYS 285 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3fk5 s VAL 286 N -2.32 1.90 0.40 -0.18 1.01 -1.10 -0.30 120.40 119.81 3fk5 s VAL 286 Ca 0.53 -2.95 -0.27 0.00 0.00 0.00 0.00 61.98 59.29 3fk5 s VAL 286 Cb 0.38 -2.32 -0.10 0.00 0.00 0.00 0.00 36.38 34.33 3fk5 s VAL 286 CO 0.20 -0.88 1.47 -0.32 0.00 0.00 0.00 175.10 175.58 3fk5 s MET 287 N -0.01 3.99 -0.03 2.72 1.75 -1.26 -5.01 119.30 121.46 3fk5 s MET 287 Ca 0.18 2.54 0.03 0.00 -1.25 0.00 0.00 55.69 57.19 3fk5 s MET 287 Cb -0.23 -2.88 0.00 0.00 2.84 0.00 0.00 34.83 34.56 3fk5 s MET 287 CO -0.01 -0.62 -0.10 -0.08 -0.65 0.00 0.00 175.02 173.56 3fk5 s THR 288 N -1.14 0.89 0.00 10.11 -1.32 -1.26 -4.79 115.64 118.13 3fk5 s THR 288 Ca 0.55 -0.43 0.00 0.00 -1.21 0.00 0.00 61.69 60.60 3fk5 s THR 288 Cb -0.46 -0.78 0.00 0.00 -1.51 0.00 0.00 72.50 69.75 3fk5 s THR 288 CO 0.62 0.27 0.62 2.30 -2.21 0.00 0.00 174.62 176.21 3fk5 n ILE 289 N 3.20 0.35 -0.35 5.08 -5.35 -1.26 -4.79 119.36 116.25 3fk5 n ILE 289 Ca -0.18 -0.57 0.05 0.00 -0.27 0.00 0.00 62.75 61.78 3fk5 n ILE 289 Cb 0.54 0.94 0.20 0.00 -1.74 0.00 0.00 39.64 39.59 3fk5 n ILE 289 CO 0.00 0.00 0.00 0.15 -1.76 0.00 0.00 176.55 174.94 3fk5 h PHE 290 N 0.00 1.09 -0.87 4.28 3.57 -1.93 0.16 116.94 123.25 3fk5 h PHE 290 Ca 0.00 0.03 0.09 0.00 3.53 0.00 0.00 57.97 61.62 3fk5 h PHE 290 Cb 0.33 -0.35 -0.06 0.00 2.79 0.00 0.00 35.95 38.67 3fk5 h PHE 290 CO 0.00 0.48 0.56 0.78 -2.23 0.00 0.00 178.31 177.90 3fk5 h GLY 291 N 1.00 1.24 0.00 2.40 0.00 -1.87 0.42 103.07 106.25 3fk5 h GLY 291 Ca 0.45 -0.37 0.00 0.00 0.00 0.00 0.00 47.33 47.42 3fk5 h GLY 291 CO -0.23 0.23 -1.01 1.18 0.00 0.00 0.00 176.54 176.70 3fk5 n GLU 292 N -4.51 1.88 0.00 4.80 4.71 -1.01 -0.43 120.64 126.07 3fk5 n GLU 292 Ca 0.14 -0.05 0.00 0.00 -0.01 0.00 0.00 57.16 57.24 3fk5 n GLU 292 Cb 0.27 -1.13 0.00 0.00 -1.01 0.00 0.00 31.44 29.58 3fk5 n GLU 292 CO 0.00 0.00 0.00 0.72 0.09 0.00 0.00 177.13 177.94 3fk5 n HIS 293 N -1.57 0.00 -3.96 -0.32 8.25 0.55 -3.33 115.22 114.84 3fk5 n HIS 293 Ca -0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 3fk5 n HIS 293 Cb 0.22 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.33 3fk5 n HIS 293 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3fk5 n GLY 294 N 0.56 0.97 3.54 -1.41 0.00 0.13 -4.03 105.19 104.95 3fk5 n GLY 294 Ca 0.00 -0.64 -0.40 0.00 0.00 0.00 0.00 46.02 44.97 3fk5 n GLY 294 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3fk5 s ASN 295 N -4.00 6.10 -0.41 1.61 3.84 -0.30 -4.29 114.94 117.49 3fk5 s ASN 295 Ca 0.00 -0.35 0.05 0.00 0.21 0.00 0.00 52.86 52.77 3fk5 s ASN 295 Cb 0.00 -2.16 0.63 0.00 -0.55 0.00 0.00 41.25 39.17 3fk5 s ASN 295 CO 0.00 -0.26 1.80 -0.38 -2.79 0.00 0.00 177.10 175.47 3fk5 n ILE 296 N 5.15 3.04 -4.84 -5.21 5.41 -1.26 -0.73 119.36 120.91 3fk5 n ILE 296 Ca -0.12 -2.14 0.00 0.00 1.00 0.00 0.00 62.75 61.50 3fk5 n ILE 296 Cb 0.50 -0.43 0.00 0.00 -0.71 0.00 0.00 39.64 39.00 3fk5 n ILE 296 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3fk5 n GLY 297 N -1.13 1.90 0.11 7.39 0.00 -1.26 -1.90 105.19 110.29 3fk5 n GLY 297 Ca 0.53 -0.54 0.10 0.00 0.00 0.00 0.00 46.02 46.11 3fk5 n GLY 297 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3fk5 n PRO 298 N 8.33 0.15 0.11 1.61 -0.04 -1.26 -1.42 135.00 142.47 3fk5 n PRO 298 Ca 0.00 0.43 0.13 0.00 -0.04 0.00 0.00 63.50 64.02 3fk5 n PRO 298 Cb 0.00 -1.81 0.40 0.00 -0.04 0.00 0.00 33.50 32.06 3fk5 n PRO 298 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3fk5 n ALA 299 N -1.72 2.25 -0.08 0.55 0.00 -0.80 -4.23 120.51 116.49 3fk5 n ALA 299 Ca 0.02 -0.01 -0.08 0.00 0.00 0.00 0.00 53.44 53.36 3fk5 n ALA 299 Cb 0.18 -1.47 -0.01 0.00 0.00 0.00 0.00 19.45 18.16 3fk5 n ALA 299 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 3fk5 h SER 300 N 0.00 0.18 0.49 0.00 0.02 -1.26 -0.99 113.55 111.99 3fk5 h SER 300 Ca 0.00 0.02 -0.02 0.00 -0.84 0.00 0.00 61.79 60.95 3fk5 h SER 300 Cb 0.73 -0.01 -0.01 0.00 0.14 0.00 0.00 62.40 63.25 3fk5 h SER 300 CO 0.00 0.14 -0.32 0.58 -1.14 0.00 0.00 176.83 176.09 3fk5 h VAL 301 N 0.28 0.34 -0.04 2.27 2.07 -1.79 -0.60 116.25 118.77 3fk5 h VAL 301 Ca 0.12 0.00 -0.09 0.00 0.82 0.00 0.00 66.70 67.55 3fk5 h VAL 301 Cb 0.06 0.34 -0.01 0.00 -1.52 0.00 0.00 31.29 30.15 3fk5 h VAL 301 CO -0.10 0.00 -0.41 1.55 0.02 0.00 0.00 177.57 178.63 3fk5 h PRO 302 N -0.78 0.08 -0.59 1.57 0.13 -1.77 -0.78 132.00 129.85 3fk5 h PRO 302 Ca -0.05 -0.03 0.02 0.00 -0.87 0.00 0.00 66.00 65.06 3fk5 h PRO 302 Cb 0.65 -0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.74 3fk5 h PRO 302 CO 0.04 0.48 0.37 0.82 -0.23 0.00 0.00 178.00 179.48 3fk5 h ILE 303 N 0.07 1.10 -0.33 -3.56 2.04 -1.08 0.31 117.51 116.06 3fk5 h ILE 303 Ca 0.00 -0.26 -0.03 0.00 1.00 0.00 0.00 64.86 65.58 3fk5 h ILE 303 Cb 0.75 0.29 -0.01 0.00 -0.74 0.00 0.00 36.82 37.11 3fk5 h ILE 303 CO 0.06 0.14 0.09 0.58 0.00 0.00 0.00 178.15 179.01 3fk5 h VAL 304 N 0.75 1.22 -0.28 1.67 2.07 -0.84 -0.77 116.25 120.06 3fk5 h VAL 304 Ca 0.23 -0.72 0.06 0.00 0.82 0.00 0.00 66.70 67.09 3fk5 h VAL 304 Cb -0.03 1.06 -0.06 0.00 -1.52 0.00 0.00 31.29 30.74 3fk5 h VAL 304 CO -0.08 0.24 -0.11 0.25 0.02 0.00 0.00 177.57 177.89 3fk5 h LEU 305 N 0.38 -0.39 -1.33 2.57 5.85 -1.05 -0.88 115.31 120.46 3fk5 h LEU 305 Ca 0.11 0.10 0.03 0.00 0.84 0.00 0.00 57.88 58.96 3fk5 h LEU 305 Cb 0.28 0.23 -0.04 0.00 0.37 0.00 0.00 40.66 41.50 3fk5 h LEU 305 CO -0.00 -0.15 0.47 -1.28 -0.34 0.00 0.00 178.44 177.14 3fk5 h SER 306 N -0.06 0.76 0.42 1.25 0.87 -0.74 -1.63 113.55 114.41 3fk5 h SER 306 Ca 0.14 -0.01 -0.16 0.00 -1.23 0.00 0.00 61.79 60.54 3fk5 h SER 306 Cb 0.28 -0.18 -0.01 0.00 -0.44 0.00 0.00 62.40 62.05 3fk5 h SER 306 CO -0.33 0.53 -0.67 0.11 -0.53 0.00 0.00 176.83 175.94 3fk5 h LYS 307 N 0.88 0.22 -0.19 2.24 1.57 -0.46 -1.52 116.57 119.31 3fk5 h LYS 307 Ca 0.28 -0.17 -0.04 0.00 -1.87 0.00 0.00 60.65 58.86 3fk5 h LYS 307 Cb 0.03 0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.37 3fk5 h LYS 307 CO -0.08 0.81 -0.03 -0.07 -0.57 0.00 0.00 179.45 179.51 3fk5 h LEU 308 N 0.15 0.35 -0.39 2.94 4.07 -0.71 -1.68 115.31 120.05 3fk5 h LEU 308 Ca -0.01 -0.34 0.08 0.00 0.08 0.00 0.00 57.88 57.68 3fk5 h LEU 308 Cb 1.20 -0.10 -0.07 0.00 1.08 0.00 0.00 40.66 42.77 3fk5 h LEU 308 CO 0.10 0.61 -0.09 0.50 -1.08 0.00 0.00 178.44 178.48 3fk5 h LYS 309 N 0.09 0.00 0.00 1.13 3.64 -1.17 -1.63 116.57 118.63 3fk5 h LYS 309 Ca 0.05 -0.00 -0.08 0.00 -1.27 0.00 0.00 60.65 59.35 3fk5 h LYS 309 Cb 0.45 -0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.25 3fk5 h LYS 309 CO 0.01 0.00 -0.36 1.05 -2.27 0.00 0.00 179.45 177.88 3fk5 h GLU 310 N 0.00 0.00 0.00 1.90 4.11 -1.17 -2.05 114.58 117.37 3fk5 h GLU 310 Ca 0.19 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.62 3fk5 h GLU 310 Cb 0.28 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.53 3fk5 h GLU 310 CO -0.40 0.36 0.00 1.28 0.07 0.00 0.00 179.01 180.32 3fk5 n LEU 311 N -3.34 0.00 -1.40 3.06 4.77 -0.64 -4.92 117.00 114.53 3fk5 n LEU 311 Ca 0.01 0.30 -0.12 0.00 -0.03 0.00 0.00 56.01 56.17 3fk5 n LEU 311 Cb 0.58 -0.30 -0.01 0.00 -2.33 0.00 0.00 43.42 41.36 3fk5 n LEU 311 CO 0.37 -0.08 -0.15 0.61 -1.33 0.00 0.00 177.39 176.81 3fk5 n GLY 312 N 0.60 -0.13 0.69 -0.72 0.00 -0.77 -4.95 105.19 99.91 3fk5 n GLY 312 Ca 0.10 -0.37 0.13 0.00 0.00 0.00 0.00 46.02 45.88 3fk5 n GLY 312 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3fk5 n ARG 313 N -2.18 1.93 -4.31 1.61 5.12 -0.63 -4.84 116.66 113.37 3fk5 n ARG 313 Ca -0.14 -1.38 -0.34 0.00 -1.93 0.00 0.00 57.85 54.06 3fk5 n ARG 313 Cb 0.61 -1.47 -0.13 0.00 -1.16 0.00 0.00 32.46 30.31 3fk5 n ARG 313 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 3fk5 s LEU 314 N -2.02 3.14 0.07 0.55 1.43 -1.26 -5.01 118.68 115.59 3fk5 s LEU 314 Ca 0.33 -0.20 0.08 0.00 -1.03 0.00 0.00 54.13 53.30 3fk5 s LEU 314 Cb 0.20 -1.77 -0.04 0.00 0.03 0.00 0.00 46.19 44.62 3fk5 s LEU 314 CO 0.33 0.12 -0.17 -0.54 0.23 0.00 0.00 176.35 176.32 3fk5 s LYS 315 N 0.65 1.98 0.03 1.70 -0.14 -1.26 -5.02 119.74 117.68 3fk5 s LYS 315 Ca -0.02 -1.05 -0.38 0.00 -1.36 0.00 0.00 55.97 53.15 3fk5 s LYS 315 Cb -0.14 -2.18 -0.18 0.00 -1.68 0.00 0.00 37.83 33.65 3fk5 s LYS 315 CO 0.02 0.52 1.29 1.17 -0.76 0.00 0.00 175.35 177.59 3fk5 n LYS 316 N 1.19 0.79 0.00 1.68 3.00 -1.26 -0.50 118.16 123.06 3fk5 n LYS 316 Ca -0.16 0.28 0.00 0.00 -0.00 0.00 0.00 58.31 58.44 3fk5 n LYS 316 Cb 0.52 -1.89 0.00 0.00 0.00 0.00 0.00 35.03 33.67 3fk5 n LYS 316 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 3fk5 n GLY 317 N 2.33 2.33 3.65 3.14 0.00 -0.43 -4.98 105.19 111.23 3fk5 n GLY 317 Ca 0.19 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.74 3fk5 n GLY 317 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3fk5 n ASP 318 N 0.00 2.59 -4.59 1.61 8.00 0.34 -4.68 116.55 119.83 3fk5 n ASP 318 Ca 0.00 1.11 -0.40 0.00 0.71 0.00 0.00 54.79 56.21 3fk5 n ASP 318 Cb 0.00 -1.36 -0.09 0.00 -0.02 0.00 0.00 41.12 39.65 3fk5 n ASP 318 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 3fk5 s ARG 319 N 0.42 3.86 -0.17 -1.24 0.52 -1.26 -1.47 118.95 119.62 3fk5 s ARG 319 Ca 0.77 -0.06 0.01 0.00 -0.52 0.00 0.00 55.73 55.93 3fk5 s ARG 319 Cb -0.74 -3.71 0.01 0.00 0.52 0.00 0.00 34.95 31.03 3fk5 s ARG 319 CO 0.43 -0.40 -0.18 0.42 0.02 0.00 0.00 175.30 175.59 3fk5 s ILE 320 N 2.14 2.32 -0.24 1.52 1.01 0.43 -0.88 121.20 127.51 3fk5 s ILE 320 Ca 0.16 -0.87 -0.18 0.00 0.00 0.00 0.00 60.65 59.76 3fk5 s ILE 320 Cb -0.16 -1.97 -0.03 0.00 0.01 0.00 0.00 42.46 40.31 3fk5 s ILE 320 CO 0.11 0.53 0.51 0.00 0.00 0.00 0.00 174.94 176.08 3fk5 s ALA 321 N 1.06 3.57 -0.22 9.38 0.00 -0.56 -1.46 121.76 133.54 3fk5 s ALA 321 Ca -0.01 -0.54 -0.10 0.00 0.00 0.00 0.00 51.96 51.31 3fk5 s ALA 321 Cb -0.14 -2.85 -0.05 0.00 0.00 0.00 0.00 23.12 20.08 3fk5 s ALA 321 CO -0.06 -0.62 0.13 -0.51 0.00 0.00 0.00 175.76 174.70 3fk5 s LEU 322 N 2.04 4.09 0.11 0.00 1.43 0.14 0.14 118.68 126.63 3fk5 s LEU 322 Ca 0.22 0.14 -0.16 0.00 -1.03 0.00 0.00 54.13 53.30 3fk5 s LEU 322 Cb -0.15 -2.08 0.04 0.00 0.03 0.00 0.00 46.19 44.02 3fk5 s LEU 322 CO 0.09 0.12 0.40 -1.48 0.23 0.00 0.00 176.35 175.71 3fk5 s LEU 323 N 0.71 0.41 -0.07 1.79 0.05 -0.39 -0.51 118.68 120.67 3fk5 s LEU 323 Ca 0.07 -0.26 -0.30 0.00 0.05 0.00 0.00 54.13 53.69 3fk5 s LEU 323 Cb -0.12 1.82 0.09 0.00 -2.05 0.00 0.00 46.19 45.92 3fk5 s LEU 323 CO 0.01 -0.82 0.80 -0.83 -0.55 0.00 0.00 176.35 174.97 3fk5 s GLY 324 N -2.65 -0.47 -0.27 -3.48 0.00 -1.02 -1.09 107.32 98.34 3fk5 s GLY 324 Ca 0.01 1.46 -0.05 0.00 0.00 0.00 0.00 44.72 46.14 3fk5 s GLY 324 CO -0.10 0.86 0.03 -0.42 0.00 0.00 0.00 173.10 173.47 3fk5 s ILE 325 N -1.56 3.68 0.21 0.90 1.01 -1.26 -2.23 121.20 121.94 3fk5 s ILE 325 Ca -0.05 -0.68 0.08 0.00 0.00 0.00 0.00 60.65 60.00 3fk5 s ILE 325 Cb -0.00 -2.84 -0.04 0.00 0.01 0.00 0.00 42.46 39.58 3fk5 s ILE 325 CO 0.03 0.18 -0.02 -0.83 0.00 0.00 0.00 174.94 174.31 3fk5 s GLY 326 N 1.47 1.69 0.62 6.18 0.00 0.49 -4.94 107.32 112.83 3fk5 s GLY 326 Ca 0.03 -1.49 -0.18 0.00 0.00 0.00 0.00 44.72 43.08 3fk5 s GLY 326 CO 0.00 -1.53 1.09 -1.14 0.00 0.00 0.00 173.10 171.53 3fk5 n SER 327 N -0.38 1.28 0.00 1.64 3.41 -1.26 -1.25 113.62 117.05 3fk5 n SER 327 Ca -0.09 0.82 0.00 0.00 -0.26 0.00 0.00 58.87 59.34 3fk5 n SER 327 Cb 0.57 -1.45 0.00 0.00 -0.26 0.00 0.00 64.21 63.06 3fk5 n SER 327 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3fk5 n GLY 328 N 1.15 2.47 3.85 5.00 0.00 -1.26 -4.26 105.19 112.13 3fk5 n GLY 328 Ca 0.14 -0.30 -0.33 0.00 0.00 0.00 0.00 46.02 45.53 3fk5 n GLY 328 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3fk5 s LEU 329 N 0.00 4.12 0.05 0.99 1.43 -0.92 -2.49 118.68 121.87 3fk5 s LEU 329 Ca 0.00 1.22 0.01 0.00 -1.03 0.00 0.00 54.13 54.33 3fk5 s LEU 329 Cb 0.00 -3.92 -0.03 0.00 0.03 0.00 0.00 46.19 42.27 3fk5 s LEU 329 CO 0.00 -0.14 -0.05 0.20 0.23 0.00 0.00 176.35 176.59 3fk5 s ASN 330 N -2.20 0.68 -0.06 2.29 0.01 -0.38 -0.53 114.94 114.75 3fk5 s ASN 330 Ca 0.51 -0.78 -0.02 0.00 -0.71 0.00 0.00 52.86 51.85 3fk5 s ASN 330 Cb -0.11 0.11 0.04 0.00 0.41 0.00 0.00 41.25 41.70 3fk5 s ASN 330 CO 0.19 -0.41 0.12 0.00 -1.51 0.00 0.00 177.10 175.48 3fk5 s SER 332 N 1.27 2.23 -0.05 0.00 0.01 -0.95 -1.63 113.70 114.58 3fk5 s SER 332 Ca -0.08 -0.38 -0.02 0.00 1.31 0.00 0.00 55.95 56.79 3fk5 s SER 332 Cb -0.12 -0.23 0.03 0.00 0.21 0.00 0.00 66.02 65.91 3fk5 s SER 332 CO -0.05 0.21 0.04 -0.04 0.41 0.00 0.00 173.24 173.81 3fk5 s MET 333 N -0.59 0.15 0.11 12.44 -1.94 -0.21 -2.44 119.30 126.81 3fk5 s MET 333 Ca 0.07 0.27 0.03 0.00 -1.71 0.00 0.00 55.69 54.36 3fk5 s MET 333 Cb -0.08 -0.64 -0.04 0.00 2.01 0.00 0.00 34.83 36.08 3fk5 s MET 333 CO -0.00 -0.31 -0.09 0.00 -0.01 0.00 0.00 175.02 174.62 3fk5 s ALA 334 N 2.01 1.13 -0.05 3.03 0.00 0.33 -0.37 121.76 127.85 3fk5 s ALA 334 Ca 0.04 -1.33 0.05 0.00 0.00 0.00 0.00 51.96 50.72 3fk5 s ALA 334 Cb -0.12 0.09 -0.00 0.00 0.00 0.00 0.00 23.12 23.08 3fk5 s ALA 334 CO -0.04 -0.14 -0.19 -2.00 0.00 0.00 0.00 175.76 173.40 3fk5 s GLU 335 N -3.46 2.01 -0.12 0.00 2.12 -0.69 0.23 118.70 118.79 3fk5 s GLU 335 Ca 0.11 -0.69 -0.00 0.00 0.36 0.00 0.00 54.97 54.75 3fk5 s GLU 335 Cb 0.02 -1.72 -0.02 0.00 0.26 0.00 0.00 34.13 32.67 3fk5 s GLU 335 CO -0.02 0.27 -0.11 0.08 -0.54 0.00 0.00 175.26 174.94 3fk5 s VAL 336 N 0.01 3.27 -0.36 3.70 1.01 -0.53 -1.04 120.40 126.46 3fk5 s VAL 336 Ca -0.04 -0.59 -0.10 0.00 0.00 0.00 0.00 61.98 61.25 3fk5 s VAL 336 Cb -0.12 -2.37 0.03 0.00 0.00 0.00 0.00 36.38 33.91 3fk5 s VAL 336 CO 0.03 0.53 0.17 -0.69 0.00 0.00 0.00 175.10 175.14 3fk5 s VAL 337 N 0.15 4.34 -2.00 2.92 1.01 -0.22 -0.43 120.40 126.16 3fk5 s VAL 337 Ca -0.05 -0.93 0.03 0.00 0.00 0.00 0.00 61.98 61.02 3fk5 s VAL 337 Cb -0.15 -3.43 0.07 0.00 0.00 0.00 0.00 36.38 32.88 3fk5 s VAL 337 CO 0.04 -0.21 0.64 1.87 0.00 0.00 0.00 175.10 177.44