#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fk5 h ALA 3 N 0.00 -0.15 -0.74 7.54 0.00 -2.05 0.17 119.26 124.03 2fk5 h ALA 3 Ca 0.00 0.05 0.01 0.00 0.00 0.00 0.00 54.91 54.97 2fk5 h ALA 3 Cb 0.00 0.44 -0.04 0.00 0.00 0.00 0.00 17.79 18.20 2fk5 h ALA 3 CO 0.00 -0.67 0.49 0.00 0.00 0.00 0.00 179.25 179.07 2fk5 h ARG 4 N -0.26 0.98 -0.48 0.00 3.08 -2.06 -0.92 114.38 114.72 2fk5 h ARG 4 Ca 0.11 -0.06 -0.03 0.00 0.07 0.00 0.00 59.98 60.07 2fk5 h ARG 4 Cb 0.43 -0.22 -0.02 0.00 0.08 0.00 0.00 29.97 30.24 2fk5 h ARG 4 CO -0.32 0.65 0.18 1.25 -1.07 0.00 0.00 179.97 180.67 2fk5 h LEU 5 N 1.01 0.67 -1.19 3.04 5.85 -1.80 -0.57 115.31 122.31 2fk5 h LEU 5 Ca 0.27 -0.18 0.02 0.00 0.84 0.00 0.00 57.88 58.83 2fk5 h LEU 5 Cb -0.11 -0.17 -0.04 0.00 0.37 0.00 0.00 40.66 40.71 2fk5 h LEU 5 CO -0.06 0.66 0.55 0.22 -0.34 0.00 0.00 178.44 179.47 2fk5 h TYR 6 N 0.63 1.03 -0.73 1.25 3.20 -0.39 -1.08 116.97 120.87 2fk5 h TYR 6 Ca 0.16 0.02 0.02 0.00 3.14 0.00 0.00 58.73 62.07 2fk5 h TYR 6 Cb 0.21 -0.35 -0.04 0.00 1.54 0.00 0.00 36.73 38.09 2fk5 h TYR 6 CO 0.01 0.63 0.48 0.00 -1.64 0.00 0.00 178.16 177.63 2fk5 h ALA 7 N 1.49 0.94 -0.51 1.82 0.00 -0.21 0.19 119.26 122.98 2fk5 h ALA 7 Ca 0.32 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.17 2fk5 h ALA 7 Cb -0.07 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.42 2fk5 h ALA 7 CO -0.08 0.31 0.27 0.00 0.00 0.00 0.00 179.25 179.74 2fk5 h ALA 8 N 1.29 0.66 -0.19 0.00 0.00 0.08 0.11 119.26 121.20 2fk5 h ALA 8 Ca 0.28 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 2fk5 h ALA 8 Cb -0.06 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 2fk5 h ALA 8 CO -0.08 0.20 0.08 0.74 0.00 0.00 0.00 179.25 180.19 2fk5 h PHE 9 N 0.69 0.29 -0.47 0.00 -1.00 -0.65 -0.73 116.94 115.07 2fk5 h PHE 9 Ca 0.18 -0.02 0.03 0.00 2.81 0.00 0.00 57.97 60.97 2fk5 h PHE 9 Cb 0.08 -0.09 -0.04 0.00 3.61 0.00 0.00 35.95 39.51 2fk5 h PHE 9 CO -0.01 0.33 0.26 -0.09 -1.61 0.00 0.00 178.31 177.18 2fk5 h ARG 10 N 0.17 0.49 -0.23 1.51 2.43 -0.38 -0.81 114.38 117.56 2fk5 h ARG 10 Ca 0.07 -0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 59.20 2fk5 h ARG 10 Cb 0.16 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 29.59 2fk5 h ARG 10 CO -0.01 0.33 0.12 0.37 -1.51 0.00 0.00 179.97 179.27 2fk5 h GLN 11 N 0.51 0.33 -0.57 0.20 4.15 -0.63 0.42 115.11 119.52 2fk5 h GLN 11 Ca 0.20 -0.04 -0.01 0.00 0.77 0.00 0.00 58.65 59.56 2fk5 h GLN 11 Cb 0.07 -0.06 -0.03 0.00 0.21 0.00 0.00 27.48 27.67 2fk5 h GLN 11 CO -0.12 0.32 0.30 0.28 -1.93 0.00 0.00 178.83 177.68 2fk5 h VAL 12 N 0.26 1.19 -0.21 2.39 2.07 -0.90 0.18 116.25 121.24 2fk5 h VAL 12 Ca 0.08 -0.51 -0.00 0.00 0.82 0.00 0.00 66.70 67.09 2fk5 h VAL 12 Cb 0.09 0.48 -0.01 0.00 -1.52 0.00 0.00 31.29 30.33 2fk5 h VAL 12 CO -0.01 0.21 0.12 1.23 0.02 0.00 0.00 177.57 179.14 2fk5 h GLY 13 N 0.77 0.30 1.00 2.17 0.00 -0.94 0.41 103.07 106.78 2fk5 h GLY 13 Ca 0.20 -0.13 -0.00 0.00 0.00 0.00 0.00 47.33 47.40 2fk5 h GLY 13 CO -0.03 0.12 0.36 0.83 0.00 0.00 0.00 176.54 177.83 2fk5 h GLU 14 N 0.25 0.82 -0.12 4.80 5.08 -0.34 -1.82 114.58 123.24 2fk5 h GLU 14 Ca 0.07 -0.07 -0.17 0.00 -1.00 0.00 0.00 59.36 58.19 2fk5 h GLU 14 Cb 0.03 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.10 2fk5 h GLU 14 CO -0.01 0.58 -0.64 -0.44 -1.00 0.00 0.00 179.01 177.50 2fk5 h ASP 15 N 0.81 0.52 -0.46 1.42 3.45 -0.53 -1.02 116.42 120.61 2fk5 h ASP 15 Ca 0.22 -0.31 -0.05 0.00 0.43 0.00 0.00 57.03 57.32 2fk5 h ASP 15 Cb -0.02 -0.15 -0.02 0.00 -0.56 0.00 0.00 39.33 38.58 2fk5 h ASP 15 CO -0.04 1.03 0.10 -0.07 -1.57 0.00 0.00 179.24 178.68 2fk5 h LEU 16 N 0.33 0.72 0.13 1.55 3.38 -0.77 -2.01 115.31 118.63 2fk5 h LEU 16 Ca -0.01 -0.25 -0.01 0.00 0.09 0.00 0.00 57.88 57.70 2fk5 h LEU 16 Cb 1.20 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.76 2fk5 h LEU 16 CO 0.11 0.78 -0.06 0.15 0.09 0.00 0.00 178.44 179.51 2fk5 h PHE 17 N 0.62 -0.17 -0.97 1.13 3.57 -1.30 0.77 116.94 120.59 2fk5 h PHE 17 Ca 0.14 -0.00 0.21 0.00 3.53 0.00 0.00 57.97 61.85 2fk5 h PHE 17 Cb 0.35 0.06 -0.09 0.00 2.79 0.00 0.00 35.95 39.06 2fk5 h PHE 17 CO 0.02 0.09 0.62 0.00 -2.23 0.00 0.00 178.31 176.81 2fk5 h ALA 18 N 0.41 1.97 -0.19 2.41 0.00 -1.10 0.18 119.26 122.94 2fk5 h ALA 18 Ca -0.02 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.94 2fk5 h ALA 18 Cb 0.34 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.08 2fk5 h ALA 18 CO 0.03 -0.32 0.00 1.04 0.00 0.00 0.00 179.25 180.00 2fk5 n GLN 19 N -4.64 1.74 -1.15 0.00 6.02 -0.77 -4.93 117.38 113.66 2fk5 n GLN 19 Ca 0.22 -1.12 -0.05 0.00 -0.01 0.00 0.00 57.00 56.04 2fk5 n GLN 19 Cb 0.67 -1.38 -0.02 0.00 1.02 0.00 0.00 30.24 30.53 2fk5 n GLN 19 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2fk5 n GLY 20 N 1.12 0.77 0.17 1.08 0.00 0.64 -4.90 105.19 104.07 2fk5 n GLY 20 Ca 0.15 -0.67 0.12 0.00 0.00 0.00 0.00 46.02 45.62 2fk5 n GLY 20 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2fk5 h LEU 21 N 0.00 0.00 -7.76 0.99 3.38 -1.05 -3.43 115.31 107.44 2fk5 h LEU 21 Ca -0.10 -0.01 -0.08 0.00 0.09 0.00 0.00 57.88 57.77 2fk5 h LEU 21 Cb 0.37 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 40.99 2fk5 h LEU 21 CO 0.15 0.01 -0.31 0.27 0.09 0.00 0.00 178.44 178.65 2fk5 s ILE 22 N -3.24 0.12 -0.08 1.22 -4.36 -1.16 -1.60 121.20 112.11 2fk5 s ILE 22 Ca 0.05 -1.09 -0.23 0.00 -0.26 0.00 0.00 60.65 59.12 2fk5 s ILE 22 Cb 0.07 -1.37 0.05 0.00 1.25 0.00 0.00 42.46 42.47 2fk5 s ILE 22 CO 0.70 -0.55 0.53 -0.44 0.24 0.00 0.00 174.94 175.42 2fk5 s SER 23 N -2.86 -0.49 1.98 4.36 0.01 -1.26 -4.22 113.70 111.22 2fk5 s SER 23 Ca 0.06 0.61 0.00 0.00 1.31 0.00 0.00 55.95 57.93 2fk5 s SER 23 Cb 0.04 0.61 0.00 0.00 0.21 0.00 0.00 66.02 66.88 2fk5 s SER 23 CO -0.10 -0.46 0.00 0.00 0.41 0.00 0.00 173.24 173.09 2fk5 n ALA 24 N 1.46 0.00 0.17 1.44 0.00 -1.26 -1.60 120.51 120.73 2fk5 n ALA 24 Ca -0.19 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.34 2fk5 n ALA 24 Cb 0.56 0.00 0.15 0.00 0.00 0.00 0.00 19.45 20.17 2fk5 n ALA 24 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2fk5 n THR 25 N 0.00 0.54 -2.22 0.00 -2.24 -1.26 -3.68 114.28 105.42 2fk5 n THR 25 Ca 0.00 -0.77 -0.38 0.00 -2.27 0.00 0.00 64.05 60.63 2fk5 n THR 25 Cb 0.00 0.89 -0.01 0.00 -2.10 0.00 0.00 70.33 69.11 2fk5 n THR 25 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2fk5 s ALA 26 N -1.17 3.09 0.00 6.98 0.00 -0.63 -4.70 121.76 125.34 2fk5 s ALA 26 Ca 0.27 1.02 0.00 0.00 0.00 0.00 0.00 51.96 53.25 2fk5 s ALA 26 Cb 0.16 -3.41 0.00 0.00 0.00 0.00 0.00 23.12 19.87 2fk5 s ALA 26 CO 0.22 -0.66 0.00 0.41 0.00 0.00 0.00 175.76 175.73 2fk5 n GLY 27 N 0.58 -0.40 3.57 0.00 0.00 -1.26 -4.39 105.19 103.29 2fk5 n GLY 27 Ca 0.05 -1.72 -0.07 0.00 0.00 0.00 0.00 46.02 44.28 2fk5 n GLY 27 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2fk5 s ASN 28 N -2.57 -0.27 0.11 1.61 2.20 -0.76 -5.01 114.94 110.24 2fk5 s ASN 28 Ca 0.00 0.13 -0.11 0.00 -0.94 0.00 0.00 52.86 51.94 2fk5 s ASN 28 Cb 0.00 0.26 0.01 0.00 -2.00 0.00 0.00 41.25 39.52 2fk5 s ASN 28 CO 0.00 -0.37 0.27 0.72 -2.94 0.00 0.00 177.10 174.78 2fk5 s PHE 29 N -2.08 0.04 0.26 1.54 -0.12 -1.26 -0.51 117.98 115.84 2fk5 s PHE 29 Ca 0.04 -0.42 -0.15 0.00 -0.05 0.00 0.00 56.93 56.35 2fk5 s PHE 29 Cb -0.01 0.06 0.00 0.00 -0.63 0.00 0.00 43.02 42.44 2fk5 s PHE 29 CO -0.04 -0.61 0.55 -1.54 -0.05 0.00 0.00 175.22 173.53 2fk5 s SER 30 N -2.85 -0.15 0.02 1.98 1.04 -0.17 -2.47 113.70 111.11 2fk5 s SER 30 Ca 0.05 -0.82 0.02 0.00 0.48 0.00 0.00 55.95 55.67 2fk5 s SER 30 Cb 0.04 0.63 -0.02 0.00 0.10 0.00 0.00 66.02 66.77 2fk5 s SER 30 CO -0.11 -1.20 -0.06 0.68 0.98 0.00 0.00 173.24 173.53 2fk5 s VAL 31 N -3.98 0.41 0.19 5.02 -7.23 -0.82 -1.16 120.40 112.82 2fk5 s VAL 31 Ca 0.19 -0.72 -0.30 0.00 -1.81 0.00 0.00 61.98 59.34 2fk5 s VAL 31 Cb -0.02 -0.44 -0.08 0.00 0.56 0.00 0.00 36.38 36.39 2fk5 s VAL 31 CO 0.08 -0.22 1.25 -0.60 -0.31 0.00 0.00 175.10 175.30 2fk5 s ARG 32 N -1.00 4.44 0.39 4.82 6.06 0.25 -1.09 118.95 132.82 2fk5 s ARG 32 Ca -0.06 1.95 0.05 0.00 -2.50 0.00 0.00 55.73 55.17 2fk5 s ARG 32 Cb -0.07 -3.22 -0.06 0.00 0.06 0.00 0.00 34.95 31.66 2fk5 s ARG 32 CO 0.00 -0.16 0.04 0.95 -2.50 0.00 0.00 175.30 173.62 2fk5 s THR 33 N 0.01 1.50 0.18 4.11 -4.23 0.19 -4.87 115.64 112.54 2fk5 s THR 33 Ca 0.54 -2.00 -0.13 0.00 -1.18 0.00 0.00 61.69 58.93 2fk5 s THR 33 Cb -0.34 -2.78 0.09 0.00 1.34 0.00 0.00 72.50 70.81 2fk5 s THR 33 CO 0.37 0.00 1.75 0.11 -0.54 0.00 0.00 174.62 176.31 2fk5 h LYS 34 N 1.85 0.34 0.00 3.99 1.57 -2.00 -2.64 116.57 119.68 2fk5 h LYS 34 Ca -0.42 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.34 2fk5 h LYS 34 Cb 1.25 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 33.49 2fk5 h LYS 34 CO 0.74 0.23 0.00 0.78 -0.57 0.00 0.00 179.45 180.63 2fk5 h GLY 35 N 0.35 0.00 0.00 3.86 0.00 -1.96 -3.49 103.07 101.83 2fk5 h GLY 35 Ca 0.24 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.57 2fk5 h GLY 35 CO -0.24 0.00 0.00 0.61 0.00 0.00 0.00 176.54 176.91 2fk5 n GLY 36 N 1.17 -1.00 3.19 4.60 0.00 -1.00 -4.20 105.19 107.95 2fk5 n GLY 36 Ca 0.05 0.47 -0.12 0.00 0.00 0.00 0.00 46.02 46.42 2fk5 n GLY 36 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2fk5 s PHE 37 N 0.00 -0.07 -0.24 1.61 -0.12 -0.74 0.57 117.98 118.99 2fk5 s PHE 37 Ca 0.00 0.04 -0.07 0.00 -0.05 0.00 0.00 56.93 56.85 2fk5 s PHE 37 Cb 0.00 0.03 -0.03 0.00 -0.63 0.00 0.00 43.02 42.40 2fk5 s PHE 37 CO 0.00 -0.37 0.06 -1.17 -0.05 0.00 0.00 175.22 173.69 2fk5 s LEU 38 N -1.52 3.43 0.17 -1.99 2.96 -0.25 -0.23 118.68 121.26 2fk5 s LEU 38 Ca -0.12 -0.19 0.06 0.00 -0.22 0.00 0.00 54.13 53.66 2fk5 s LEU 38 Cb -0.05 -1.91 -0.04 0.00 0.50 0.00 0.00 46.19 44.68 2fk5 s LEU 38 CO 0.02 -0.01 -0.13 -0.51 -1.32 0.00 0.00 176.35 174.40 2fk5 s ILE 39 N 1.46 1.46 0.47 6.68 2.07 -0.46 -1.95 121.20 130.92 2fk5 s ILE 39 Ca 0.06 -2.08 -0.23 0.00 -1.41 0.00 0.00 60.65 56.99 2fk5 s ILE 39 Cb -0.15 -1.89 -0.07 0.00 0.13 0.00 0.00 42.46 40.48 2fk5 s ILE 39 CO 0.03 -0.63 1.18 0.42 -1.91 0.00 0.00 174.94 174.03 2fk5 s THR 40 N -2.99 3.05 0.70 4.00 -4.23 -1.03 -1.27 115.64 113.88 2fk5 s THR 40 Ca 0.18 0.78 -0.11 0.00 -1.18 0.00 0.00 61.69 61.37 2fk5 s THR 40 Cb -0.00 -3.40 0.01 0.00 1.34 0.00 0.00 72.50 70.46 2fk5 s THR 40 CO 0.04 -0.01 1.06 -0.54 -0.54 0.00 0.00 174.62 174.63 2fk5 s LYS 41 N -2.72 2.88 0.35 3.99 1.02 0.90 -2.38 119.74 123.78 2fk5 s LYS 41 Ca 0.64 0.83 -0.27 0.00 0.02 0.00 0.00 55.97 57.20 2fk5 s LYS 41 Cb -0.29 -1.99 -0.09 0.00 -0.52 0.00 0.00 37.83 34.94 2fk5 s LYS 41 CO 0.35 -1.11 1.16 0.45 -0.92 0.00 0.00 175.35 175.28 2fk5 s SER 42 N -3.91 6.82 -0.24 2.83 0.15 0.24 -3.78 113.70 115.82 2fk5 s SER 42 Ca 0.58 2.34 0.00 0.00 0.70 0.00 0.00 55.95 59.58 2fk5 s SER 42 Cb -0.13 -2.62 0.00 0.00 -1.71 0.00 0.00 66.02 61.56 2fk5 s SER 42 CO 0.54 -0.47 0.00 0.61 1.20 0.00 0.00 173.24 175.13 2fk5 n GLY 43 N 0.80 0.37 3.93 9.45 0.00 -1.26 -4.96 105.19 113.52 2fk5 n GLY 43 Ca 0.02 -0.06 -0.25 0.00 0.00 0.00 0.00 46.02 45.73 2fk5 n GLY 43 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2fk5 s VAL 44 N -1.51 4.29 -0.61 1.61 -7.23 -1.25 -4.89 120.40 110.81 2fk5 s VAL 44 Ca 0.00 -0.20 -0.26 0.00 -1.81 0.00 0.00 61.98 59.71 2fk5 s VAL 44 Cb 0.00 -3.62 0.04 0.00 0.56 0.00 0.00 36.38 33.36 2fk5 s VAL 44 CO 0.00 -0.53 1.10 -1.10 -0.31 0.00 0.00 175.10 174.26 2fk5 s GLN 45 N -4.68 3.35 0.46 4.82 -1.52 -1.26 -4.39 119.66 116.43 2fk5 s GLN 45 Ca 0.48 -0.13 0.12 0.00 -1.95 0.00 0.00 55.36 53.88 2fk5 s GLN 45 Cb -0.10 -4.08 1.03 0.00 -0.22 0.00 0.00 33.01 29.64 2fk5 s GLN 45 CO 0.41 -1.72 2.07 0.87 -0.25 0.00 0.00 175.29 176.67 2fk5 h LYS 46 N 9.56 0.22 0.00 2.91 6.56 -1.91 -1.85 116.57 132.05 2fk5 h LYS 46 Ca -0.26 -0.02 0.00 0.00 -1.06 0.00 0.00 60.65 59.31 2fk5 h LYS 46 Cb 1.06 -0.04 0.00 0.00 -0.57 0.00 0.00 32.23 32.68 2fk5 h LYS 46 CO 1.17 0.20 0.00 0.00 -2.06 0.00 0.00 179.45 178.76 2fk5 n ALA 47 N -2.51 1.72 -2.62 3.86 0.00 -1.26 -3.50 120.51 116.20 2fk5 n ALA 47 Ca -0.01 0.05 -0.13 0.00 0.00 0.00 0.00 53.44 53.35 2fk5 n ALA 47 Cb 0.12 -1.37 0.02 0.00 0.00 0.00 0.00 19.45 18.23 2fk5 n ALA 47 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2fk5 n ARG 48 N -2.09 1.66 -2.07 0.00 1.74 -0.71 -4.18 116.66 111.01 2fk5 n ARG 48 Ca 0.03 -3.54 -0.37 0.00 -0.77 0.00 0.00 57.85 53.20 2fk5 n ARG 48 Cb 0.24 -1.47 0.02 0.00 -1.02 0.00 0.00 32.46 30.22 2fk5 n ARG 48 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2fk5 s LEU 49 N -3.22 3.87 0.20 0.55 1.43 -1.17 -4.87 118.68 115.47 2fk5 s LEU 49 Ca 0.32 2.44 0.09 0.00 -1.03 0.00 0.00 54.13 55.95 2fk5 s LEU 49 Cb 0.44 -4.36 -0.04 0.00 0.03 0.00 0.00 46.19 42.26 2fk5 s LEU 49 CO -0.01 -1.28 -0.17 0.42 0.23 0.00 0.00 176.35 175.54 2fk5 s THR 50 N -1.51 1.93 0.47 5.49 -4.23 -1.26 -4.88 115.64 111.64 2fk5 s THR 50 Ca 0.70 -2.11 0.22 0.00 -1.18 0.00 0.00 61.69 59.32 2fk5 s THR 50 Cb -0.32 -2.00 0.40 0.00 1.34 0.00 0.00 72.50 71.92 2fk5 s THR 50 CO 0.37 -0.42 1.91 -0.65 -0.54 0.00 0.00 174.62 175.29 2fk5 h PRO 51 N 2.84 0.23 0.00 3.99 0.11 -1.97 0.24 132.00 137.45 2fk5 h PRO 51 Ca -0.41 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.69 2fk5 h PRO 51 Cb 1.22 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.28 2fk5 h PRO 51 CO 0.56 0.16 0.00 -0.85 -0.21 0.00 0.00 178.00 177.66 2fk5 n GLU 52 N -4.42 0.29 -0.03 1.05 0.00 -1.26 -2.40 120.64 113.86 2fk5 n GLU 52 Ca 0.16 0.10 0.13 0.00 0.00 0.00 0.00 57.16 57.54 2fk5 n GLU 52 Cb 0.69 -1.50 0.49 0.00 0.00 0.00 0.00 31.44 31.12 2fk5 n GLU 52 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 2fk5 n ASP 53 N -1.28 1.44 -4.44 -1.84 10.43 0.84 -4.86 116.55 116.85 2fk5 n ASP 53 Ca 0.09 -1.56 -0.31 0.00 2.57 0.00 0.00 54.79 55.59 2fk5 n ASP 53 Cb 0.15 -0.04 -0.13 0.00 1.84 0.00 0.00 41.12 42.94 2fk5 n ASP 53 CO 0.00 0.00 0.00 -0.76 -1.07 0.00 0.00 177.20 175.37 2fk5 s LEU 54 N -1.81 2.55 -0.01 0.64 1.43 -1.01 -0.07 118.68 120.41 2fk5 s LEU 54 Ca 0.36 -0.42 -0.03 0.00 -1.03 0.00 0.00 54.13 53.01 2fk5 s LEU 54 Cb 0.19 -1.49 -0.00 0.00 0.03 0.00 0.00 46.19 44.92 2fk5 s LEU 54 CO 0.30 0.27 0.05 -1.48 0.23 0.00 0.00 176.35 175.72 2fk5 s LEU 55 N -1.33 1.84 0.05 1.79 0.05 -0.39 -4.93 118.68 115.77 2fk5 s LEU 55 Ca 0.14 -0.10 -0.22 0.00 0.05 0.00 0.00 54.13 54.00 2fk5 s LEU 55 Cb -0.10 0.28 -0.06 0.00 -2.05 0.00 0.00 46.19 44.25 2fk5 s LEU 55 CO 0.04 -0.16 0.67 -0.70 -0.55 0.00 0.00 176.35 175.66 2fk5 s GLU 56 N -0.62 4.39 -0.05 1.48 2.12 -1.26 -1.36 118.70 123.40 2fk5 s GLU 56 Ca -0.07 0.91 0.05 0.00 0.36 0.00 0.00 54.97 56.22 2fk5 s GLU 56 Cb -0.04 -3.32 -0.01 0.00 0.26 0.00 0.00 34.13 31.02 2fk5 s GLU 56 CO 0.00 0.42 -0.22 0.08 -0.54 0.00 0.00 175.26 175.00 2fk5 s VAL 57 N -0.44 1.78 0.53 3.70 1.01 0.68 -4.89 120.40 122.77 2fk5 s VAL 57 Ca 0.34 -0.91 -0.16 0.00 0.00 0.00 0.00 61.98 61.24 2fk5 s VAL 57 Cb -0.20 -1.52 -0.07 0.00 0.00 0.00 0.00 36.38 34.59 2fk5 s VAL 57 CO 0.21 0.50 1.00 -2.16 0.00 0.00 0.00 175.10 174.65 2fk5 s PRO 58 N -0.04 3.85 0.05 2.72 0.04 -1.26 -1.79 135.00 138.58 2fk5 s PRO 58 Ca -0.05 0.99 0.22 0.00 0.04 0.00 0.00 61.00 62.20 2fk5 s PRO 58 Cb -0.13 -2.12 0.91 0.00 0.04 0.00 0.00 34.50 33.20 2fk5 s PRO 58 CO 0.03 -0.35 1.70 1.28 0.04 0.00 0.00 177.00 179.69 2fk5 n LEU 59 N -1.66 0.17 -4.11 -3.56 4.77 -1.26 -4.70 117.00 106.64 2fk5 n LEU 59 Ca 0.07 0.53 -0.25 0.00 -0.03 0.00 0.00 56.01 56.33 2fk5 n LEU 59 Cb 0.54 -0.49 -0.16 0.00 -2.33 0.00 0.00 43.42 40.98 2fk5 n LEU 59 CO 0.47 -0.19 -0.49 -1.61 -1.33 0.00 0.00 177.39 174.23 2fk5 s GLU 60 N -3.05 1.58 0.00 3.23 2.02 -1.26 -5.03 118.70 116.19 2fk5 s GLU 60 Ca 0.10 -0.56 0.00 0.00 0.02 0.00 0.00 54.97 54.53 2fk5 s GLU 60 Cb 0.13 -1.40 0.00 0.00 0.10 0.00 0.00 34.13 32.96 2fk5 s GLU 60 CO 0.41 0.24 0.00 0.41 0.02 0.00 0.00 175.26 176.34 2fk5 n GLY 61 N 3.10 0.23 3.62 -1.39 0.00 -1.26 -4.99 105.19 104.49 2fk5 n GLY 61 Ca -0.18 -2.05 -0.39 0.00 0.00 0.00 0.00 46.02 43.40 2fk5 n GLY 61 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2fk5 n PRO 62 N -0.11 1.15 -3.09 1.61 -0.02 -1.26 -4.95 135.00 128.34 2fk5 n PRO 62 Ca 0.00 0.43 -0.40 0.00 -2.02 0.00 0.00 63.50 61.51 2fk5 n PRO 62 Cb 0.00 -2.16 -0.05 0.00 -0.02 0.00 0.00 33.50 31.27 2fk5 n PRO 62 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 2fk5 s ILE 63 N -1.42 5.01 0.26 4.25 1.01 -1.26 -4.83 121.20 124.22 2fk5 s ILE 63 Ca 0.70 1.28 -0.29 0.00 0.00 0.00 0.00 60.65 62.35 2fk5 s ILE 63 Cb -0.46 -3.98 -0.15 0.00 0.01 0.00 0.00 42.46 37.88 2fk5 s ILE 63 CO 0.51 0.13 0.92 -2.65 0.00 0.00 0.00 174.94 173.86 2fk5 n PRO 64 N 4.79 1.04 -2.12 2.79 -0.02 -1.26 -4.89 135.00 135.33 2fk5 n PRO 64 Ca -0.01 0.36 -0.37 0.00 -2.02 0.00 0.00 63.50 61.46 2fk5 n PRO 64 Cb 0.50 -1.67 0.01 0.00 -0.02 0.00 0.00 33.50 32.32 2fk5 n PRO 64 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 2fk5 s GLU 65 N -1.31 3.51 0.00 -0.52 2.56 -1.26 -2.88 118.70 118.80 2fk5 s GLU 65 Ca 0.61 1.88 0.00 0.00 0.00 0.00 0.00 54.97 57.46 2fk5 s GLU 65 Cb -0.77 -2.30 0.00 0.00 2.00 0.00 0.00 34.13 33.06 2fk5 s GLU 65 CO 0.58 -0.78 0.00 0.41 -0.56 0.00 0.00 175.26 174.91 2fk5 n GLY 66 N 0.50 1.54 3.82 -1.50 0.00 -1.26 -5.05 105.19 103.24 2fk5 n GLY 66 Ca 0.09 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.79 2fk5 n GLY 66 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fk5 s ALA 67 N -2.32 2.74 0.36 4.61 0.00 -1.14 -0.59 121.76 125.42 2fk5 s ALA 67 Ca 0.00 0.14 -0.25 0.00 0.00 0.00 0.00 51.96 51.85 2fk5 s ALA 67 Cb 0.00 -3.18 -0.12 0.00 0.00 0.00 0.00 23.12 19.82 2fk5 s ALA 67 CO 0.00 -1.06 0.91 0.45 0.00 0.00 0.00 175.76 176.05 2fk5 n SER 68 N -2.82 0.80 0.23 0.00 2.88 -1.00 -3.82 113.62 109.89 2fk5 n SER 68 Ca 0.08 1.07 0.16 0.00 -1.33 0.00 0.00 58.87 58.85 2fk5 n SER 68 Cb 0.53 -1.27 0.80 0.00 -0.75 0.00 0.00 64.21 63.52 2fk5 n SER 68 CO 0.00 0.00 0.00 -0.37 -1.23 0.00 0.00 175.04 173.44 2fk5 h VAL 69 N 1.55 0.00 -0.32 2.46 -1.51 -1.93 -1.12 116.25 115.38 2fk5 h VAL 69 Ca -0.41 -0.12 0.00 0.00 -1.23 0.00 0.00 66.70 64.94 2fk5 h VAL 69 Cb 1.35 0.89 0.00 0.00 -2.13 0.00 0.00 31.29 31.41 2fk5 h VAL 69 CO 0.57 0.00 0.00 -0.62 -1.23 0.00 0.00 177.57 176.29 2fk5 n GLU 70 N -2.66 2.01 -0.32 5.19 -0.58 -1.26 -4.16 120.64 118.87 2fk5 n GLU 70 Ca -0.01 -1.54 0.11 0.00 -0.42 0.00 0.00 57.16 55.30 2fk5 n GLU 70 Cb 0.12 -1.40 0.33 0.00 -0.57 0.00 0.00 31.44 29.92 2fk5 n GLU 70 CO 0.00 0.00 0.00 0.77 -0.48 0.00 0.00 177.13 177.42 2fk5 h SER 71 N 2.84 0.76 -0.54 1.62 0.02 -1.54 0.15 113.55 116.86 2fk5 h SER 71 Ca 0.00 0.06 0.04 0.00 -0.84 0.00 0.00 61.79 61.04 2fk5 h SER 71 Cb 0.63 -0.09 -0.03 0.00 0.14 0.00 0.00 62.40 63.06 2fk5 h SER 71 CO 0.00 0.35 0.36 1.62 -1.14 0.00 0.00 176.83 178.02 2fk5 h VAL 72 N 0.78 1.05 -0.05 2.27 3.04 -1.83 0.25 116.25 121.77 2fk5 h VAL 72 Ca 0.50 -0.21 -0.05 0.00 -1.01 0.00 0.00 66.70 65.93 2fk5 h VAL 72 Cb 0.73 0.40 0.00 0.00 -2.01 0.00 0.00 31.29 30.41 2fk5 h VAL 72 CO -0.27 0.11 -0.18 0.58 -1.01 0.00 0.00 177.57 176.80 2fk5 h VAL 73 N 0.60 1.46 -0.53 1.51 2.07 -1.03 -2.46 116.25 117.86 2fk5 h VAL 73 Ca 0.22 -1.62 0.03 0.00 0.82 0.00 0.00 66.70 66.15 2fk5 h VAL 73 Cb 0.13 2.39 -0.04 0.00 -1.52 0.00 0.00 31.29 32.25 2fk5 h VAL 73 CO -0.06 0.45 0.30 0.45 0.02 0.00 0.00 177.57 178.73 2fk5 h HIS 74 N -0.34 0.56 -0.36 1.57 3.86 -0.77 -1.82 115.15 117.85 2fk5 h HIS 74 Ca -0.01 0.02 0.03 0.00 -1.16 0.00 0.00 60.37 59.25 2fk5 h HIS 74 Cb 0.82 -0.18 -0.03 0.00 1.06 0.00 0.00 27.41 29.08 2fk5 h HIS 74 CO 0.14 0.31 0.16 -0.09 0.86 0.00 0.00 177.93 179.30 2fk5 h ARG 75 N 0.59 0.32 -0.57 2.45 2.43 -0.53 -1.73 114.38 117.34 2fk5 h ARG 75 Ca 0.22 -0.02 -0.03 0.00 -0.81 0.00 0.00 59.98 59.34 2fk5 h ARG 75 Cb 0.06 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 29.51 2fk5 h ARG 75 CO -0.12 0.21 0.24 1.49 -1.51 0.00 0.00 179.97 180.28 2fk5 h GLU 76 N 0.33 0.81 -0.63 0.20 4.57 -1.11 -1.12 114.58 117.64 2fk5 h GLU 76 Ca 0.16 -0.12 -0.08 0.00 -1.18 0.00 0.00 59.36 58.14 2fk5 h GLU 76 Cb 0.10 -0.15 -0.02 0.00 -0.16 0.00 0.00 28.75 28.52 2fk5 h GLU 76 CO -0.13 0.66 0.09 0.28 -1.18 0.00 0.00 179.01 178.72 2fk5 h VAL 77 N 0.81 1.26 -0.19 0.32 2.07 -0.69 -0.67 116.25 119.16 2fk5 h VAL 77 Ca 0.19 -1.04 -0.13 0.00 0.82 0.00 0.00 66.70 66.55 2fk5 h VAL 77 Cb 0.14 0.71 -0.01 0.00 -1.52 0.00 0.00 31.29 30.61 2fk5 h VAL 77 CO -0.02 0.38 -0.44 1.88 0.02 0.00 0.00 177.57 179.40 2fk5 h TYR 78 N 0.96 0.55 -0.13 1.57 0.99 -0.96 0.59 116.97 120.54 2fk5 h TYR 78 Ca 0.19 -0.16 -0.02 0.00 2.00 0.00 0.00 58.73 60.74 2fk5 h TYR 78 Cb 0.45 -0.12 -0.00 0.00 1.00 0.00 0.00 36.73 38.06 2fk5 h TYR 78 CO 0.03 0.82 0.01 0.00 -0.00 0.00 0.00 178.16 179.02 2fk5 h ARG 79 N 0.37 0.23 0.00 4.88 3.08 -0.92 -3.33 114.38 118.69 2fk5 h ARG 79 Ca 0.03 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 60.01 2fk5 h ARG 79 Cb 0.92 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.95 2fk5 h ARG 79 CO 0.08 0.45 -0.90 0.54 -1.07 0.00 0.00 179.97 179.07 2fk5 n ARG 80 N -4.79 0.46 -4.60 0.04 1.74 -0.29 -4.97 116.66 104.26 2fk5 n ARG 80 Ca -0.05 0.09 -0.27 0.00 -0.77 0.00 0.00 57.85 56.84 2fk5 n ARG 80 Cb 0.20 -1.75 -0.09 0.00 -1.02 0.00 0.00 32.46 29.80 2fk5 n ARG 80 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 2fk5 s THR 81 N -3.28 1.18 -0.39 0.55 -4.23 0.19 -4.95 115.64 104.70 2fk5 s THR 81 Ca 0.02 -2.00 0.09 0.00 -1.18 0.00 0.00 61.69 58.62 2fk5 s THR 81 Cb 0.11 -2.52 0.62 0.00 1.34 0.00 0.00 72.50 72.06 2fk5 s THR 81 CO 0.77 0.00 1.54 0.61 -0.54 0.00 0.00 174.62 177.00 2fk5 n GLY 82 N -0.98 2.97 3.70 3.99 0.00 -1.26 -4.63 105.19 108.98 2fk5 n GLY 82 Ca -0.09 -0.75 -0.42 0.00 0.00 0.00 0.00 46.02 44.75 2fk5 n GLY 82 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fk5 n ALA 83 N 0.19 1.41 0.30 4.61 0.00 -1.26 -4.89 120.51 120.86 2fk5 n ALA 83 Ca 0.28 0.36 0.06 0.00 0.00 0.00 0.00 53.44 54.14 2fk5 n ALA 83 Cb 1.10 -2.27 -0.08 0.00 0.00 0.00 0.00 19.45 18.19 2fk5 n ALA 83 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2fk5 n ARG 84 N 0.64 1.70 -3.50 0.00 5.12 0.56 -4.79 116.66 116.40 2fk5 n ARG 84 Ca 0.05 -0.06 -0.16 0.00 -1.93 0.00 0.00 57.85 55.75 2fk5 n ARG 84 Cb 0.36 -1.19 -0.05 0.00 -1.16 0.00 0.00 32.46 30.42 2fk5 n ARG 84 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2fk5 s ALA 85 N -2.51 -1.73 -0.03 7.54 0.00 -0.97 -0.58 121.76 123.47 2fk5 s ALA 85 Ca 0.00 1.12 -0.02 0.00 0.00 0.00 0.00 51.96 53.07 2fk5 s ALA 85 Cb 0.09 0.20 0.02 0.00 0.00 0.00 0.00 23.12 23.43 2fk5 s ALA 85 CO 0.52 -0.47 0.07 -1.17 0.00 0.00 0.00 175.76 174.71 2fk5 s LEU 86 N -1.58 1.32 -0.11 0.00 2.96 -0.31 -0.92 118.68 120.04 2fk5 s LEU 86 Ca -0.08 0.14 0.02 0.00 -0.22 0.00 0.00 54.13 54.00 2fk5 s LEU 86 Cb -0.00 0.17 0.01 0.00 0.50 0.00 0.00 46.19 46.86 2fk5 s LEU 86 CO 0.04 -0.08 -0.19 -0.69 -1.32 0.00 0.00 176.35 174.11 2fk5 s VAL 87 N 0.61 1.74 -0.16 1.68 1.01 -0.28 -1.00 120.40 124.00 2fk5 s VAL 87 Ca -0.05 -0.80 -0.02 0.00 0.00 0.00 0.00 61.98 61.11 2fk5 s VAL 87 Cb -0.07 -1.55 -0.02 0.00 0.00 0.00 0.00 36.38 34.74 2fk5 s VAL 87 CO -0.02 0.49 -0.08 -2.28 0.00 0.00 0.00 175.10 173.20 2fk5 s HIS 88 N 0.78 2.91 0.20 5.22 2.46 0.33 -1.12 115.29 126.06 2fk5 s HIS 88 Ca -0.10 -0.65 0.03 0.00 0.47 0.00 0.00 55.06 54.81 2fk5 s HIS 88 Cb -0.16 -1.95 -0.01 0.00 -0.13 0.00 0.00 32.58 30.33 2fk5 s HIS 88 CO 0.01 -0.27 0.20 0.00 -2.47 0.00 0.00 174.74 172.21 2fk5 n ALA 89 N 3.90 0.26 -3.20 1.58 0.00 -0.65 -1.84 120.51 120.57 2fk5 n ALA 89 Ca -0.18 -1.11 -0.24 0.00 0.00 0.00 0.00 53.44 51.91 2fk5 n ALA 89 Cb 0.52 0.90 -0.06 0.00 0.00 0.00 0.00 19.45 20.81 2fk5 n ALA 89 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2fk5 n HIS 90 N -0.37 1.80 -1.61 0.00 8.25 -0.63 -1.44 115.22 121.23 2fk5 n HIS 90 Ca 0.04 -3.88 -0.44 0.00 -0.26 0.00 0.00 57.72 53.18 2fk5 n HIS 90 Cb 0.36 -0.45 -0.04 0.00 1.12 0.00 0.00 29.99 30.98 2fk5 n HIS 90 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 2fk5 n PRO 91 N 0.64 2.17 0.01 -0.41 -0.04 -1.26 -4.76 135.00 131.35 2fk5 n PRO 91 Ca 0.26 0.69 -0.10 0.00 -0.04 0.00 0.00 63.50 64.32 2fk5 n PRO 91 Cb 0.50 -3.03 -0.04 0.00 -0.04 0.00 0.00 33.50 30.89 2fk5 n PRO 91 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2fk5 h ARG 92 N 12.86 -0.16 -0.38 0.54 3.08 -1.90 0.02 114.38 128.44 2fk5 h ARG 92 Ca -0.43 0.01 -0.08 0.00 0.07 0.00 0.00 59.98 59.55 2fk5 h ARG 92 Cb 1.25 0.04 -0.01 0.00 0.08 0.00 0.00 29.97 31.33 2fk5 h ARG 92 CO 0.96 -0.11 -0.08 0.28 -1.07 0.00 0.00 179.97 179.95 2fk5 h VAL 93 N -0.17 1.28 -0.97 2.04 2.07 -1.91 -1.19 116.25 117.39 2fk5 h VAL 93 Ca 0.08 -1.15 0.01 0.00 0.82 0.00 0.00 66.70 66.45 2fk5 h VAL 93 Cb 0.28 1.25 -0.05 0.00 -1.52 0.00 0.00 31.29 31.25 2fk5 h VAL 93 CO -0.20 0.38 0.63 0.00 0.02 0.00 0.00 177.57 178.41 2fk5 h ALA 94 N 0.83 1.29 -0.46 1.67 0.00 -1.84 0.64 119.26 121.40 2fk5 h ALA 94 Ca 0.10 -0.07 -0.08 0.00 0.00 0.00 0.00 54.91 54.85 2fk5 h ALA 94 Cb 0.59 -0.39 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 2fk5 h ALA 94 CO 0.04 0.65 -0.02 0.28 0.00 0.00 0.00 179.25 180.19 2fk5 h VAL 95 N 1.32 1.26 -0.47 0.00 2.07 -0.78 0.42 116.25 120.06 2fk5 h VAL 95 Ca 0.35 -1.10 -0.00 0.00 0.82 0.00 0.00 66.70 66.78 2fk5 h VAL 95 Cb -0.14 1.04 -0.02 0.00 -1.52 0.00 0.00 31.29 30.65 2fk5 h VAL 95 CO -0.08 0.38 0.29 0.00 0.02 0.00 0.00 177.57 178.18 2fk5 h ALA 96 N 0.91 0.60 0.00 1.67 0.00 -0.62 -1.75 119.26 120.07 2fk5 h ALA 96 Ca 0.13 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.94 2fk5 h ALA 96 Cb 0.54 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.13 2fk5 h ALA 96 CO 0.03 0.09 -0.17 -0.07 0.00 0.00 0.00 179.25 179.13 2fk5 h LEU 97 N 0.63 0.00 -2.41 0.00 3.38 -0.61 -2.89 115.31 113.41 2fk5 h LEU 97 Ca 0.17 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.13 2fk5 h LEU 97 Cb -0.01 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.74 2fk5 h LEU 97 CO -0.03 0.17 -0.03 0.77 0.09 0.00 0.00 178.44 179.40 2fk5 h SER 98 N 0.00 0.00 1.40 -0.43 4.64 0.03 -0.47 113.55 118.73 2fk5 h SER 98 Ca -0.00 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.28 2fk5 h SER 98 Cb 0.49 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.57 2fk5 h SER 98 CO 0.02 0.03 -0.18 -0.26 -0.87 0.00 0.00 176.83 175.57 2fk5 h PHE 99 N 0.00 0.00 0.00 4.77 -1.00 -1.56 -3.30 116.94 115.85 2fk5 h PHE 99 Ca -0.00 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.78 2fk5 h PHE 99 Cb 0.14 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.70 2fk5 h PHE 99 CO 0.00 0.18 -1.35 0.72 -1.61 0.00 0.00 178.31 176.25 2fk5 n HIS 100 N -3.21 0.00 -4.38 -0.55 8.25 -0.26 -5.01 115.22 110.05 2fk5 n HIS 100 Ca 0.02 0.00 -0.24 0.00 -0.26 0.00 0.00 57.72 57.24 2fk5 n HIS 100 Cb 0.51 -0.21 -0.11 0.00 1.12 0.00 0.00 29.99 31.31 2fk5 n HIS 100 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2fk5 s LEU 101 N -3.57 2.47 0.02 2.41 1.43 -0.73 -5.00 118.68 115.72 2fk5 s LEU 101 Ca 0.01 -0.90 0.22 0.00 -1.03 0.00 0.00 54.13 52.43 2fk5 s LEU 101 Cb 0.13 -0.97 -0.18 0.00 0.03 0.00 0.00 46.19 45.20 2fk5 s LEU 101 CO 0.79 0.02 0.76 -1.54 0.23 0.00 0.00 176.35 176.61 2fk5 n SER 102 N 0.11 0.44 -3.59 2.29 3.41 -1.26 -4.78 113.62 110.24 2fk5 n SER 102 Ca -0.11 -0.22 -0.15 0.00 -0.26 0.00 0.00 58.87 58.12 2fk5 n SER 102 Cb 0.57 1.34 -0.07 0.00 -0.26 0.00 0.00 64.21 65.80 2fk5 n SER 102 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2fk5 s ARG 103 N -3.32 0.90 -0.30 4.33 3.03 -1.26 -1.60 118.95 120.73 2fk5 s ARG 103 Ca -0.01 0.69 -0.10 0.00 2.03 0.00 0.00 55.73 58.34 2fk5 s ARG 103 Cb 0.14 0.43 -0.02 0.00 -1.03 0.00 0.00 34.95 34.47 2fk5 s ARG 103 CO 0.86 -0.18 0.16 -1.17 -1.13 0.00 0.00 175.30 173.84 2fk5 s LEU 104 N -0.24 4.03 -0.34 -1.89 0.20 0.12 -4.93 118.68 115.64 2fk5 s LEU 104 Ca -0.04 -0.34 -0.03 0.00 0.69 0.00 0.00 54.13 54.41 2fk5 s LEU 104 Cb -0.03 -2.03 0.06 0.00 -0.43 0.00 0.00 46.19 43.76 2fk5 s LEU 104 CO 0.04 -0.14 0.08 -0.13 -0.29 0.00 0.00 176.35 175.91 2fk5 s ARG 105 N 1.66 2.37 0.49 1.98 0.52 -1.26 -0.74 118.95 123.98 2fk5 s ARG 105 Ca 0.06 -1.38 -0.24 0.00 -0.52 0.00 0.00 55.73 53.65 2fk5 s ARG 105 Cb -0.17 -3.35 -0.07 0.00 0.52 0.00 0.00 34.95 31.88 2fk5 s ARG 105 CO 0.07 -0.74 1.35 -2.30 0.02 0.00 0.00 175.30 173.70 2fk5 n PRO 106 N 4.67 1.89 0.02 3.54 -0.02 -1.26 -4.94 135.00 138.90 2fk5 n PRO 106 Ca -0.10 0.68 0.02 0.00 -2.02 0.00 0.00 63.50 62.08 2fk5 n PRO 106 Cb 0.43 -2.53 -0.09 0.00 -0.02 0.00 0.00 33.50 31.29 2fk5 n PRO 106 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 2fk5 n LEU 107 N -0.46 0.64 -4.85 2.45 4.77 -1.26 -4.63 117.00 113.66 2fk5 n LEU 107 Ca 0.08 0.27 -0.32 0.00 -0.03 0.00 0.00 56.01 56.01 2fk5 n LEU 107 Cb 0.43 0.09 -0.05 0.00 -2.33 0.00 0.00 43.42 41.55 2fk5 n LEU 107 CO 0.56 0.12 0.44 1.51 -1.33 0.00 0.00 177.39 178.69 2fk5 s ASP 108 N -5.51 6.72 0.14 -1.43 -4.77 -1.26 -4.95 116.67 105.61 2fk5 s ASP 108 Ca -0.04 1.28 -0.18 0.00 -3.30 0.00 0.00 52.55 50.31 2fk5 s ASP 108 Cb 0.09 -2.37 0.03 0.00 -1.09 0.00 0.00 42.92 39.58 2fk5 s ASP 108 CO 0.82 -0.27 1.72 0.25 0.70 0.00 0.00 175.17 178.39 2fk5 h LEU 109 N 1.96 -0.07 -0.23 2.11 5.85 -1.99 -0.72 115.31 122.22 2fk5 h LEU 109 Ca -0.48 0.06 0.05 0.00 0.84 0.00 0.00 57.88 58.35 2fk5 h LEU 109 Cb 1.18 0.10 -0.04 0.00 0.37 0.00 0.00 40.66 42.26 2fk5 h LEU 109 CO 0.65 0.00 -0.06 -0.08 -0.34 0.00 0.00 178.44 178.61 2fk5 h GLU 110 N 0.12 0.00 -0.71 1.25 4.57 -1.99 0.07 114.58 117.88 2fk5 h GLU 110 Ca 0.14 -0.00 -0.06 0.00 -1.18 0.00 0.00 59.36 58.26 2fk5 h GLU 110 Cb 0.17 -0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 28.73 2fk5 h GLU 110 CO -0.21 0.00 0.20 0.78 -1.18 0.00 0.00 179.01 178.60 2fk5 h GLY 111 N 0.00 1.21 1.09 1.92 0.00 -1.82 -0.93 103.07 104.54 2fk5 h GLY 111 Ca 0.11 -0.74 -0.09 0.00 0.00 0.00 0.00 47.33 46.61 2fk5 h GLY 111 CO -0.23 0.69 0.05 1.46 0.00 0.00 0.00 176.54 178.51 2fk5 h GLN 112 N 1.07 1.10 -0.12 4.80 4.20 -0.71 0.77 115.11 126.21 2fk5 h GLN 112 Ca 0.23 -0.32 -0.06 0.00 0.06 0.00 0.00 58.65 58.56 2fk5 h GLN 112 Cb 0.34 -0.11 -0.00 0.00 0.30 0.00 0.00 27.48 28.00 2fk5 h GLN 112 CO -0.00 1.04 -0.14 1.25 -0.67 0.00 0.00 178.83 180.31 2fk5 h HIS 113 N 1.02 0.38 0.13 2.96 2.76 -0.81 -2.15 115.15 119.43 2fk5 h HIS 113 Ca 0.19 -0.12 -0.33 0.00 -2.20 0.00 0.00 60.37 57.91 2fk5 h HIS 113 Cb 0.51 -0.08 -0.01 0.00 1.55 0.00 0.00 27.41 29.38 2fk5 h HIS 113 CO 0.04 0.73 -1.69 1.88 -1.30 0.00 0.00 177.93 177.60 2fk5 h TYR 114 N -0.09 0.49 0.00 5.26 0.05 -1.19 -3.41 116.97 118.08 2fk5 h TYR 114 Ca 0.02 -0.35 -0.38 0.00 0.05 0.00 0.00 58.73 58.06 2fk5 h TYR 114 Cb 0.68 -0.02 -0.07 0.00 1.01 0.00 0.00 36.73 38.33 2fk5 h TYR 114 CO 0.09 1.49 -2.45 1.28 -1.05 0.00 0.00 178.16 177.52 2fk5 n LEU 115 N -3.46 2.47 0.00 3.88 4.77 0.18 -4.87 117.00 119.98 2fk5 n LEU 115 Ca -0.21 -0.12 0.00 0.00 -0.03 0.00 0.00 56.01 55.65 2fk5 n LEU 115 Cb 1.05 -0.67 0.00 0.00 -2.33 0.00 0.00 43.42 41.48 2fk5 n LEU 115 CO 0.49 0.86 0.00 0.29 -1.33 0.00 0.00 177.39 177.70 2fk5 n LYS 116 N -3.17 0.00 -3.68 3.23 5.02 -0.67 -4.55 118.16 114.34 2fk5 n LYS 116 Ca -0.43 0.00 -0.13 0.00 -2.02 0.00 0.00 58.31 55.73 2fk5 n LYS 116 Cb 1.01 0.00 -0.09 0.00 -0.02 0.00 0.00 35.03 35.94 2fk5 n LYS 116 CO 0.00 0.00 0.00 -1.83 -0.52 0.00 0.00 177.40 175.05 2fk5 s GLU 117 N 0.00 0.63 -0.32 1.97 -1.05 -1.26 -4.42 118.70 114.25 2fk5 s GLU 117 Ca 0.00 0.80 -0.06 0.00 -0.15 0.00 0.00 54.97 55.56 2fk5 s GLU 117 Cb 0.00 0.27 0.03 0.00 -0.44 0.00 0.00 34.13 34.00 2fk5 s GLU 117 CO 0.00 -0.09 0.08 0.08 0.95 0.00 0.00 175.26 176.28 2fk5 s VAL 118 N 0.48 3.69 0.46 1.83 1.01 0.08 -4.85 120.40 123.10 2fk5 s VAL 118 Ca -0.02 -1.06 -0.22 0.00 0.00 0.00 0.00 61.98 60.68 2fk5 s VAL 118 Cb -0.04 -3.04 -0.08 0.00 0.00 0.00 0.00 36.38 33.22 2fk5 s VAL 118 CO -0.02 -0.09 1.11 -2.16 0.00 0.00 0.00 175.10 173.94 2fk5 s PRO 119 N 1.40 3.79 -0.26 2.72 0.04 -1.26 0.14 135.00 141.58 2fk5 s PRO 119 Ca -0.01 1.62 -0.07 0.00 0.04 0.00 0.00 61.00 62.58 2fk5 s PRO 119 Cb -0.19 -2.33 -0.02 0.00 0.04 0.00 0.00 34.50 32.01 2fk5 s PRO 119 CO 0.02 -0.49 0.06 0.08 0.04 0.00 0.00 177.00 176.72 2fk5 s VAL 120 N -1.67 4.18 -0.12 -0.36 1.01 -0.63 -0.42 120.40 122.39 2fk5 s VAL 120 Ca 0.64 -0.29 -0.06 0.00 0.00 0.00 0.00 61.98 62.27 2fk5 s VAL 120 Cb -0.24 -2.99 -0.04 0.00 0.00 0.00 0.00 36.38 33.11 2fk5 s VAL 120 CO 0.29 0.30 0.11 -0.76 0.00 0.00 0.00 175.10 175.04 2fk5 s LEU 121 N 1.59 4.19 -0.46 3.92 1.43 0.21 -4.82 118.68 124.74 2fk5 s LEU 121 Ca 0.06 0.37 0.09 0.00 -1.03 0.00 0.00 54.13 53.62 2fk5 s LEU 121 Cb -0.15 -2.02 0.35 0.00 0.03 0.00 0.00 46.19 44.40 2fk5 s LEU 121 CO 0.03 0.38 0.86 0.00 0.23 0.00 0.00 176.35 177.84 2fk5 n ALA 122 N 2.20 3.42 -1.51 4.21 0.00 -1.26 0.03 120.51 127.60 2fk5 n ALA 122 Ca -0.19 -4.02 -0.33 0.00 0.00 0.00 0.00 53.44 48.90 2fk5 n ALA 122 Cb 0.54 -0.82 0.05 0.00 0.00 0.00 0.00 19.45 19.22 2fk5 n ALA 122 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2fk5 s PRO 123 N -2.99 2.83 0.24 0.00 0.04 -1.26 -4.91 135.00 128.95 2fk5 s PRO 123 Ca 0.44 1.31 -0.08 0.00 0.04 0.00 0.00 61.00 62.70 2fk5 s PRO 123 Cb 0.33 -1.96 0.41 0.00 0.04 0.00 0.00 34.50 33.32 2fk5 s PRO 123 CO -0.11 -1.22 1.62 -0.22 0.04 0.00 0.00 177.00 177.12 2fk5 h LYS 124 N -0.09 0.06 -6.33 4.56 3.64 -1.99 -3.37 116.57 113.05 2fk5 h LYS 124 Ca -0.46 -0.00 -0.69 0.00 -1.27 0.00 0.00 60.65 58.23 2fk5 h LYS 124 Cb 1.24 -0.01 -0.22 0.00 -0.41 0.00 0.00 32.23 32.83 2fk5 h LYS 124 CO 0.54 0.04 -0.76 0.95 -2.27 0.00 0.00 179.45 177.95 2fk5 s THR 125 N -6.16 3.17 -0.24 1.00 -4.23 -1.26 -5.02 115.64 102.90 2fk5 s THR 125 Ca -0.14 -0.76 0.03 0.00 -1.18 0.00 0.00 61.69 59.64 2fk5 s THR 125 Cb 0.23 -2.28 -0.01 0.00 1.34 0.00 0.00 72.50 71.78 2fk5 s THR 125 CO 0.75 0.54 0.30 1.33 -0.54 0.00 0.00 174.62 177.00 2fk5 n VAL 126 N 2.11 0.00 -4.29 2.29 0.24 -1.26 -3.93 118.33 113.49 2fk5 n VAL 126 Ca -0.17 -0.46 -0.19 0.00 -2.04 0.00 0.00 64.34 61.49 2fk5 n VAL 126 Cb 0.52 1.03 -0.15 0.00 -1.47 0.00 0.00 33.84 33.77 2fk5 n VAL 126 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 2fk5 s SER 127 N -0.92 0.98 -1.53 -1.34 0.15 -1.26 -4.86 113.70 104.92 2fk5 s SER 127 Ca 0.02 -0.15 -0.08 0.00 0.70 0.00 0.00 55.95 56.44 2fk5 s SER 127 Cb 0.02 -0.24 0.07 0.00 -1.71 0.00 0.00 66.02 64.16 2fk5 s SER 127 CO 0.09 0.05 0.62 0.00 1.20 0.00 0.00 173.24 175.20 2fk5 n ALA 128 N 3.26 -1.65 -2.19 5.45 0.00 -1.26 -4.95 120.51 119.17 2fk5 n ALA 128 Ca -0.17 -0.12 -0.08 0.00 0.00 0.00 0.00 53.44 53.07 2fk5 n ALA 128 Cb 0.55 -2.57 -0.10 0.00 0.00 0.00 0.00 19.45 17.33 2fk5 n ALA 128 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2fk5 s THR 129 N -3.64 0.26 0.27 0.00 -4.23 -1.26 -5.01 115.64 102.03 2fk5 s THR 129 Ca 0.35 -1.73 0.21 0.00 -1.18 0.00 0.00 61.69 59.34 2fk5 s THR 129 Cb -0.19 -1.41 0.18 0.00 1.34 0.00 0.00 72.50 72.43 2fk5 s THR 129 CO 0.90 -0.93 1.86 -0.33 -0.54 0.00 0.00 174.62 175.57 2fk5 h GLU 130 N 3.29 0.00 0.05 3.99 5.08 -1.94 -0.84 114.58 124.20 2fk5 h GLU 130 Ca -0.34 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.02 2fk5 h GLU 130 Cb 1.15 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.40 2fk5 h GLU 130 CO 0.63 0.28 -0.03 1.49 -1.00 0.00 0.00 179.01 180.39 2fk5 h GLU 131 N 0.00 -0.07 -0.57 2.33 4.81 -1.95 0.27 114.58 119.40 2fk5 h GLU 131 Ca -0.00 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.22 2fk5 h GLU 131 Cb 0.67 0.02 -0.03 0.00 0.63 0.00 0.00 28.75 30.04 2fk5 h GLU 131 CO 0.04 0.16 0.30 0.00 -0.73 0.00 0.00 179.01 178.77 2fk5 h ALA 132 N 0.65 0.73 -0.42 2.92 0.00 -1.61 -2.48 119.26 119.06 2fk5 h ALA 132 Ca -0.01 -0.11 0.05 0.00 0.00 0.00 0.00 54.91 54.84 2fk5 h ALA 132 Cb 0.26 -0.23 -0.05 0.00 0.00 0.00 0.00 17.79 17.78 2fk5 h ALA 132 CO 0.01 0.27 0.15 0.00 0.00 0.00 0.00 179.25 179.68 2fk5 h ALA 133 N 1.13 0.50 -0.48 0.00 0.00 -0.94 -0.58 119.26 118.88 2fk5 h ALA 133 Ca 0.20 0.05 -0.08 0.00 0.00 0.00 0.00 54.91 55.08 2fk5 h ALA 133 Cb 0.08 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 2fk5 h ALA 133 CO -0.03 -0.23 0.01 1.25 0.00 0.00 0.00 179.25 180.24 2fk5 h LEU 134 N 0.32 0.83 0.06 0.00 5.85 -0.78 0.10 115.31 121.70 2fk5 h LEU 134 Ca 0.19 -0.30 -0.00 0.00 0.84 0.00 0.00 57.88 58.61 2fk5 h LEU 134 Cb 0.17 -0.22 0.00 0.00 0.37 0.00 0.00 40.66 40.98 2fk5 h LEU 134 CO -0.19 0.93 -0.03 -1.28 -0.34 0.00 0.00 178.44 177.53 2fk5 h SER 135 N 0.71 -0.07 -0.13 1.25 0.87 -1.16 -1.75 113.55 113.26 2fk5 h SER 135 Ca 0.14 -0.07 -0.01 0.00 -1.23 0.00 0.00 61.79 60.63 2fk5 h SER 135 Cb 0.50 0.02 -0.01 0.00 -0.44 0.00 0.00 62.40 62.47 2fk5 h SER 135 CO 0.02 0.02 0.06 0.58 -0.53 0.00 0.00 176.83 176.98 2fk5 h VAL 136 N -0.16 1.13 -0.64 2.23 2.07 -1.06 -2.13 116.25 117.68 2fk5 h VAL 136 Ca -0.01 -0.37 0.05 0.00 0.82 0.00 0.00 66.70 67.19 2fk5 h VAL 136 Cb 0.13 1.14 -0.05 0.00 -1.52 0.00 0.00 31.29 30.99 2fk5 h VAL 136 CO 0.01 0.11 0.35 0.00 0.02 0.00 0.00 177.57 178.07 2fk5 h ALA 137 N 0.92 0.85 -0.26 1.67 0.00 -0.92 -0.81 119.26 120.71 2fk5 h ALA 137 Ca 0.04 0.01 -0.12 0.00 0.00 0.00 0.00 54.91 54.85 2fk5 h ALA 137 Cb 0.13 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 2fk5 h ALA 137 CO -0.01 0.04 -0.33 0.93 0.00 0.00 0.00 179.25 179.88 2fk5 h GLU 138 N 0.66 0.55 -0.39 0.00 4.39 -1.26 -2.79 114.58 115.75 2fk5 h GLU 138 Ca 0.28 -0.25 -0.06 0.00 0.34 0.00 0.00 59.36 59.67 2fk5 h GLU 138 Cb 0.16 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.78 2fk5 h GLU 138 CO -0.17 0.81 -0.01 0.00 -1.16 0.00 0.00 179.01 178.49 2fk5 h ALA 139 N 1.17 0.53 0.00 3.43 0.00 -0.89 -2.68 119.26 120.82 2fk5 h ALA 139 Ca 0.05 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.70 2fk5 h ALA 139 Cb 0.81 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.45 2fk5 h ALA 139 CO 0.07 0.32 0.00 1.28 0.00 0.00 0.00 179.25 180.91 2fk5 n LEU 140 N -4.44 0.00 0.09 0.00 4.77 -0.35 -1.43 117.00 115.63 2fk5 n LEU 140 Ca -0.01 0.00 -0.08 0.00 -0.03 0.00 0.00 56.01 55.89 2fk5 n LEU 140 Cb 0.29 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.38 2fk5 n LEU 140 CO 0.41 0.00 0.26 0.03 -1.33 0.00 0.00 177.39 176.76 2fk5 h ARG 141 N 0.00 0.16 -0.00 3.23 3.08 -1.20 -3.34 114.38 116.31 2fk5 h ARG 141 Ca 0.00 -0.18 0.00 0.00 0.07 0.00 0.00 59.98 59.87 2fk5 h ARG 141 Cb 0.00 0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.10 2fk5 h ARG 141 CO 0.00 0.93 -0.24 0.39 -1.07 0.00 0.00 179.97 179.98 2fk5 n GLU 142 N -3.65 3.61 -4.18 0.04 -0.58 -0.91 -5.03 120.64 109.94 2fk5 n GLU 142 Ca -0.03 -0.24 -0.17 0.00 -0.42 0.00 0.00 57.16 56.30 2fk5 n GLU 142 Cb 0.80 -0.90 -0.12 0.00 -0.57 0.00 0.00 31.44 30.65 2fk5 n GLU 142 CO 0.00 0.00 0.00 -1.01 -0.48 0.00 0.00 177.13 175.64 2fk5 s HIS 143 N -1.39 1.21 -0.46 -0.32 3.76 -0.51 -5.04 115.29 112.53 2fk5 s HIS 143 Ca 0.04 -0.51 0.23 0.00 -0.15 0.00 0.00 55.06 54.67 2fk5 s HIS 143 Cb 0.05 -0.67 0.37 0.00 1.11 0.00 0.00 32.58 33.44 2fk5 s HIS 143 CO 0.23 0.06 1.57 0.00 -0.85 0.00 0.00 174.74 175.75 2fk5 h ARG 144 N 4.01 0.00 -3.62 1.40 2.47 -1.85 -3.38 114.38 113.41 2fk5 h ARG 144 Ca -0.40 0.00 -0.09 0.00 -1.26 0.00 0.00 59.98 58.24 2fk5 h ARG 144 Cb 1.19 0.00 -0.15 0.00 -1.65 0.00 0.00 29.97 29.36 2fk5 h ARG 144 CO 0.44 0.00 -0.31 0.00 0.56 0.00 0.00 179.97 180.66 2fk5 s ALA 145 N -3.21 -0.42 -0.00 0.04 0.00 -1.26 -0.55 121.76 116.36 2fk5 s ALA 145 Ca 0.07 -0.38 -0.18 0.00 0.00 0.00 0.00 51.96 51.47 2fk5 s ALA 145 Cb 0.07 0.46 0.03 0.00 0.00 0.00 0.00 23.12 23.67 2fk5 s ALA 145 CO 0.67 -0.49 0.38 0.00 0.00 0.00 0.00 175.76 176.32 2fk5 s LEU 147 N -1.50 3.40 -0.33 0.00 1.43 0.44 -1.25 118.68 120.86 2fk5 s LEU 147 Ca -0.11 0.06 -0.09 0.00 -1.03 0.00 0.00 54.13 52.97 2fk5 s LEU 147 Cb -0.03 -1.78 0.02 0.00 0.03 0.00 0.00 46.19 44.43 2fk5 s LEU 147 CO 0.03 0.36 0.14 -0.76 0.23 0.00 0.00 176.35 176.36 2fk5 s LEU 148 N -0.90 4.27 -0.36 1.79 1.43 0.13 0.68 118.68 125.71 2fk5 s LEU 148 Ca 0.13 -0.83 -0.42 0.00 -1.03 0.00 0.00 54.13 51.99 2fk5 s LEU 148 Cb -0.11 -1.95 -0.17 0.00 0.03 0.00 0.00 46.19 43.99 2fk5 s LEU 148 CO 0.02 -0.28 1.74 -1.14 0.23 0.00 0.00 176.35 176.93 2fk5 n ARG 149 N 4.93 0.75 -0.89 1.70 0.63 0.10 -0.72 116.66 123.17 2fk5 n ARG 149 Ca -0.13 0.27 0.00 0.00 -0.92 0.00 0.00 57.85 57.07 2fk5 n ARG 149 Cb 0.47 -1.91 0.00 0.00 0.45 0.00 0.00 32.46 31.47 2fk5 n ARG 149 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2fk5 n GLY 150 N 4.40 0.71 0.62 5.14 0.00 -1.26 -4.83 105.19 109.97 2fk5 n GLY 150 Ca 0.30 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.31 2fk5 n GLY 150 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 2fk5 n HIS 151 N -2.08 0.00 0.00 1.61 -0.00 0.10 -5.10 115.22 109.76 2fk5 n HIS 151 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.72 2fk5 n HIS 151 Cb 0.01 -0.06 0.00 0.00 -0.00 0.00 0.00 29.99 29.95 2fk5 n HIS 151 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2fk5 n GLY 152 N 2.69 -0.82 3.18 1.57 0.00 -1.10 -4.82 105.19 105.91 2fk5 n GLY 152 Ca -0.02 -0.26 -0.09 0.00 0.00 0.00 0.00 46.02 45.65 2fk5 n GLY 152 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fk5 s ALA 153 N -1.00 -0.18 0.01 4.61 0.00 -0.52 -0.69 121.76 123.99 2fk5 s ALA 153 Ca 0.00 -0.60 0.08 0.00 0.00 0.00 0.00 51.96 51.44 2fk5 s ALA 153 Cb 0.00 0.41 -0.02 0.00 0.00 0.00 0.00 23.12 23.51 2fk5 s ALA 153 CO 0.00 -0.46 -0.23 -0.06 0.00 0.00 0.00 175.76 175.01 2fk5 s PHE 154 N -3.53 2.08 -0.01 0.00 0.40 -0.38 -1.63 117.98 114.91 2fk5 s PHE 154 Ca 0.02 -0.39 0.01 0.00 -0.60 0.00 0.00 56.93 55.97 2fk5 s PHE 154 Cb 0.04 -1.30 0.00 0.00 0.51 0.00 0.00 43.02 42.27 2fk5 s PHE 154 CO -0.09 0.03 -0.04 0.00 0.70 0.00 0.00 175.22 175.82 2fk5 s ALA 155 N -0.66 0.42 -0.06 5.36 0.00 -0.27 -1.40 121.76 125.15 2fk5 s ALA 155 Ca 0.09 -0.15 -0.02 0.00 0.00 0.00 0.00 51.96 51.89 2fk5 s ALA 155 Cb -0.09 -0.16 -0.04 0.00 0.00 0.00 0.00 23.12 22.83 2fk5 s ALA 155 CO 0.00 0.07 0.04 0.08 0.00 0.00 0.00 175.76 175.95 2fk5 s VAL 156 N 0.13 4.55 -0.05 0.00 1.01 0.29 -1.12 120.40 125.20 2fk5 s VAL 156 Ca -0.01 -0.28 0.03 0.00 0.00 0.00 0.00 61.98 61.71 2fk5 s VAL 156 Cb -0.05 -2.99 -0.03 0.00 0.00 0.00 0.00 36.38 33.32 2fk5 s VAL 156 CO -0.00 0.51 -0.11 -0.83 0.00 0.00 0.00 175.10 174.66 2fk5 s GLY 157 N -1.23 1.60 -0.00 4.51 0.00 -0.09 -4.40 107.32 107.71 2fk5 s GLY 157 Ca 0.17 -0.95 0.02 0.00 0.00 0.00 0.00 44.72 43.96 2fk5 s GLY 157 CO 0.07 -0.73 0.09 1.04 0.00 0.00 0.00 173.10 173.56 2fk5 n LEU 158 N 2.25 0.10 -4.62 0.66 4.77 -1.26 -0.32 117.00 118.57 2fk5 n LEU 158 Ca -0.17 -0.45 -0.37 0.00 -0.03 0.00 0.00 56.01 54.98 2fk5 n LEU 158 Cb 0.52 0.00 0.06 0.00 -2.33 0.00 0.00 43.42 41.68 2fk5 n LEU 158 CO 0.26 0.02 0.57 0.29 -1.33 0.00 0.00 177.39 177.20 2fk5 n LYS 159 N -1.10 0.82 0.16 3.23 5.02 -1.26 -4.71 118.16 120.31 2fk5 n LYS 159 Ca 0.00 0.33 -0.14 0.00 -2.02 0.00 0.00 58.31 56.48 2fk5 n LYS 159 Cb 0.04 -2.21 -0.07 0.00 -0.02 0.00 0.00 35.03 32.77 2fk5 n LYS 159 CO 0.00 0.00 0.00 1.49 -0.52 0.00 0.00 177.40 178.37 2fk5 h GLU 160 N 0.32 -0.36 -6.40 1.97 4.81 -1.97 -3.39 114.58 109.55 2fk5 h GLU 160 Ca -0.49 0.02 -0.54 0.00 -0.13 0.00 0.00 59.36 58.23 2fk5 h GLU 160 Cb 1.36 0.08 0.00 0.00 0.63 0.00 0.00 28.75 30.82 2fk5 h GLU 160 CO 0.50 -0.24 0.84 0.00 -0.73 0.00 0.00 179.01 179.38 2fk5 s ALA 161 N -6.13 3.59 0.26 2.92 0.00 -1.26 -4.92 121.76 116.22 2fk5 s ALA 161 Ca -0.15 0.94 -0.02 0.00 0.00 0.00 0.00 51.96 52.73 2fk5 s ALA 161 Cb 0.06 -3.60 0.48 0.00 0.00 0.00 0.00 23.12 20.06 2fk5 s ALA 161 CO 0.65 -0.90 1.78 -1.35 0.00 0.00 0.00 175.76 175.94 2fk5 h PRO 162 N 7.77 0.65 -0.70 0.00 0.11 -1.90 0.14 132.00 138.08 2fk5 h PRO 162 Ca -0.39 -0.04 -0.04 0.00 0.11 0.00 0.00 66.00 65.65 2fk5 h PRO 162 Cb 1.18 -0.15 -0.03 0.00 0.11 0.00 0.00 31.00 32.12 2fk5 h PRO 162 CO 0.90 0.43 0.29 0.93 -0.21 0.00 0.00 178.00 180.35 2fk5 h GLU 163 N 0.67 1.03 -0.16 1.05 3.07 -1.93 -0.59 114.58 117.73 2fk5 h GLU 163 Ca 0.44 -0.18 -0.16 0.00 -0.50 0.00 0.00 59.36 58.96 2fk5 h GLU 163 Cb 0.55 -0.17 -0.01 0.00 -0.84 0.00 0.00 28.75 28.28 2fk5 h GLU 163 CO -0.32 0.84 -0.58 0.93 -1.40 0.00 0.00 179.01 178.48 2fk5 h GLU 164 N 0.99 0.51 -0.49 2.33 5.08 -1.65 -1.87 114.58 119.47 2fk5 h GLU 164 Ca 0.23 -0.33 -0.10 0.00 -1.00 0.00 0.00 59.36 58.16 2fk5 h GLU 164 Cb 0.18 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.46 2fk5 h GLU 164 CO -0.02 0.94 -0.09 0.00 -1.00 0.00 0.00 179.01 178.84 2fk5 h ALA 165 N 0.99 0.91 -0.38 3.43 0.00 -0.47 -0.11 119.26 123.63 2fk5 h ALA 165 Ca 0.00 -0.33 -0.09 0.00 0.00 0.00 0.00 54.91 54.49 2fk5 h ALA 165 Cb 1.12 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.71 2fk5 h ALA 165 CO 0.11 0.63 -0.13 1.25 0.00 0.00 0.00 179.25 181.11 2fk5 h LEU 166 N 0.80 0.78 -1.41 0.00 5.85 -0.99 -0.63 115.31 119.70 2fk5 h LEU 166 Ca 0.13 -0.38 -0.06 0.00 0.84 0.00 0.00 57.88 58.41 2fk5 h LEU 166 Cb 0.61 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.42 2fk5 h LEU 166 CO 0.04 0.98 -0.29 -0.07 -0.34 0.00 0.00 178.44 178.76 2fk5 h LEU 167 N 0.57 0.00 -0.16 2.25 3.38 -1.17 -0.52 115.31 119.66 2fk5 h LEU 167 Ca 0.09 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.99 2fk5 h LEU 167 Cb 0.66 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.41 2fk5 h LEU 167 CO 0.05 0.29 -0.18 -0.08 0.09 0.00 0.00 178.44 178.60 2fk5 h GLU 168 N 0.00 0.41 -0.71 1.13 4.81 -0.59 -1.26 114.58 118.38 2fk5 h GLU 168 Ca -0.00 -0.23 -0.07 0.00 -0.13 0.00 0.00 59.36 58.93 2fk5 h GLU 168 Cb 0.57 0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.93 2fk5 h GLU 168 CO 0.04 0.79 0.17 0.00 -0.73 0.00 0.00 179.01 179.28 2fk5 h ALA 169 N 0.61 0.93 -0.63 2.92 0.00 -0.80 -1.79 119.26 120.50 2fk5 h ALA 169 Ca 0.02 -0.25 0.01 0.00 0.00 0.00 0.00 54.91 54.70 2fk5 h ALA 169 Cb 0.73 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 18.21 2fk5 h ALA 169 CO 0.04 0.66 0.41 -0.92 0.00 0.00 0.00 179.25 179.44 2fk5 h TYR 170 N 1.07 0.77 -0.63 0.00 5.03 -1.05 -1.59 116.97 120.57 2fk5 h TYR 170 Ca 0.22 0.02 -0.05 0.00 2.58 0.00 0.00 58.73 61.50 2fk5 h TYR 170 Cb 0.37 -0.26 -0.03 0.00 1.55 0.00 0.00 36.73 38.37 2fk5 h TYR 170 CO 0.03 0.47 0.18 0.78 -1.32 0.00 0.00 178.16 178.30 2fk5 h GLY 171 N 0.82 1.03 1.57 1.82 0.00 -0.81 -1.67 103.07 105.84 2fk5 h GLY 171 Ca 0.24 -0.59 -0.10 0.00 0.00 0.00 0.00 47.33 46.87 2fk5 h GLY 171 CO -0.07 0.56 -0.28 1.41 0.00 0.00 0.00 176.54 178.16 2fk5 h LEU 172 N 0.93 0.50 -0.31 3.11 3.38 -0.98 -0.26 115.31 121.68 2fk5 h LEU 172 Ca 0.20 -0.18 -0.07 0.00 0.09 0.00 0.00 57.88 57.93 2fk5 h LEU 172 Cb 0.29 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 2fk5 h LEU 172 CO -0.01 0.77 -0.08 -0.03 0.09 0.00 0.00 178.44 179.18 2fk5 h MET 173 N 0.43 0.59 -0.30 1.13 4.05 -0.80 -0.41 114.93 119.63 2fk5 h MET 173 Ca 0.06 -0.23 -0.09 0.00 -0.28 0.00 0.00 59.70 59.16 2fk5 h MET 173 Cb 0.71 -0.03 -0.01 0.00 -0.80 0.00 0.00 31.60 31.46 2fk5 h MET 173 CO 0.05 0.78 -0.20 1.79 0.23 0.00 0.00 176.91 179.57 2fk5 h THR 174 N 0.36 1.26 -0.56 -0.77 1.35 -1.16 -2.33 112.91 111.06 2fk5 h THR 174 Ca 0.08 -1.19 -0.07 0.00 -0.55 0.00 0.00 66.41 64.67 2fk5 h THR 174 Cb 0.56 1.24 -0.02 0.00 -1.73 0.00 0.00 68.15 68.20 2fk5 h THR 174 CO 0.03 0.39 0.07 0.74 -0.25 0.00 0.00 175.52 176.49 2fk5 h THR 175 N 0.49 1.25 0.00 6.82 2.02 -0.82 -1.18 112.91 121.49 2fk5 h THR 175 Ca 0.08 -0.97 -0.00 0.00 0.77 0.00 0.00 66.41 66.29 2fk5 h THR 175 Cb 0.62 0.75 0.00 0.00 -1.74 0.00 0.00 68.15 67.77 2fk5 h THR 175 CO 0.04 0.35 -0.00 0.25 0.37 0.00 0.00 175.52 176.54 2fk5 h LEU 176 N 0.85 -0.00 -0.81 2.58 5.85 -0.58 0.65 115.31 123.84 2fk5 h LEU 176 Ca 0.17 -0.12 -0.07 0.00 0.84 0.00 0.00 57.88 58.70 2fk5 h LEU 176 Cb 0.41 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.42 2fk5 h LEU 176 CO 0.01 0.12 0.09 -0.08 -0.34 0.00 0.00 178.44 178.23 2fk5 h GLU 177 N -0.12 0.98 -0.62 1.25 4.57 -1.33 -0.04 114.58 119.26 2fk5 h GLU 177 Ca -0.00 -0.25 -0.03 0.00 -1.18 0.00 0.00 59.36 57.90 2fk5 h GLU 177 Cb 0.12 -0.12 -0.03 0.00 -0.16 0.00 0.00 28.75 28.56 2fk5 h GLU 177 CO 0.00 0.91 0.28 0.93 -1.18 0.00 0.00 179.01 179.95 2fk5 h GLU 178 N 0.92 0.90 -0.55 1.92 5.08 -1.03 0.69 114.58 122.51 2fk5 h GLU 178 Ca 0.18 -0.15 -0.08 0.00 -1.00 0.00 0.00 59.36 58.32 2fk5 h GLU 178 Cb 0.42 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.49 2fk5 h GLU 178 CO 0.01 0.74 0.03 0.77 -1.00 0.00 0.00 179.01 179.57 2fk5 h SER 179 N 0.85 0.88 -0.52 1.42 0.02 -0.44 -0.62 113.55 115.14 2fk5 h SER 179 Ca 0.21 -0.22 -0.07 0.00 -0.84 0.00 0.00 61.79 60.88 2fk5 h SER 179 Cb 0.15 -0.23 -0.02 0.00 0.14 0.00 0.00 62.40 62.44 2fk5 h SER 179 CO -0.02 0.92 0.06 0.00 -1.14 0.00 0.00 176.83 176.65 2fk5 h ALA 180 N 1.18 0.70 -0.54 3.77 0.00 -0.58 -0.96 119.26 122.83 2fk5 h ALA 180 Ca 0.17 -0.26 -0.03 0.00 0.00 0.00 0.00 54.91 54.79 2fk5 h ALA 180 Cb 0.46 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 2fk5 h ALA 180 CO 0.02 0.46 0.22 1.96 0.00 0.00 0.00 179.25 181.91 2fk5 h GLN 181 N 0.76 0.81 -0.69 0.00 4.20 -0.52 -1.24 115.11 118.43 2fk5 h GLN 181 Ca 0.16 -0.14 -0.01 0.00 0.06 0.00 0.00 58.65 58.71 2fk5 h GLN 181 Cb 0.44 -0.13 -0.03 0.00 0.30 0.00 0.00 27.48 28.05 2fk5 h GLN 181 CO 0.01 0.70 0.38 0.82 -0.67 0.00 0.00 178.83 180.08 2fk5 h ILE 182 N 0.74 1.21 -0.68 2.54 2.04 -0.93 0.36 117.51 122.80 2fk5 h ILE 182 Ca 0.18 -0.52 0.01 0.00 1.00 0.00 0.00 64.86 65.53 2fk5 h ILE 182 Cb 0.19 0.30 -0.04 0.00 -0.74 0.00 0.00 36.82 36.53 2fk5 h ILE 182 CO -0.02 0.23 0.44 -0.07 0.00 0.00 0.00 178.15 178.74 2fk5 h LEU 183 N 0.95 0.76 -0.05 1.44 3.38 -0.86 -0.27 115.31 120.66 2fk5 h LEU 183 Ca 0.24 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.19 2fk5 h LEU 183 Cb 0.03 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 40.59 2fk5 h LEU 183 CO -0.04 0.54 0.00 0.25 0.09 0.00 0.00 178.44 179.29 2fk5 h LEU 184 N 0.90 0.09 -1.01 1.67 5.85 -0.68 -1.73 115.31 120.40 2fk5 h LEU 184 Ca 0.26 -0.29 -0.01 0.00 0.84 0.00 0.00 57.88 58.68 2fk5 h LEU 184 Cb -0.07 -0.02 -0.04 0.00 0.37 0.00 0.00 40.66 40.89 2fk5 h LEU 184 CO -0.07 0.36 0.52 1.88 -0.34 0.00 0.00 178.44 180.79 2fk5 h TYR 185 N -0.18 1.17 -0.38 1.25 0.99 -0.81 0.77 116.97 119.78 2fk5 h TYR 185 Ca 0.02 -0.01 -0.01 0.00 2.00 0.00 0.00 58.73 60.73 2fk5 h TYR 185 Cb 0.31 -0.38 -0.02 0.00 1.00 0.00 0.00 36.73 37.64 2fk5 h TYR 185 CO 0.03 0.78 0.19 1.25 -0.00 0.00 0.00 178.16 180.41 2fk5 h HIS 186 N 1.22 0.55 -0.40 4.88 2.76 -0.97 -1.56 115.15 121.62 2fk5 h HIS 186 Ca 0.32 -0.02 -0.10 0.00 -2.20 0.00 0.00 60.37 58.36 2fk5 h HIS 186 Cb -0.04 -0.17 -0.01 0.00 1.55 0.00 0.00 27.41 28.74 2fk5 h HIS 186 CO 0.01 0.45 -0.13 -0.09 -1.30 0.00 0.00 177.93 176.87 2fk5 h ARG 187 N 0.48 0.79 -0.65 5.26 2.43 -0.77 -2.46 114.38 119.46 2fk5 h ARG 187 Ca 0.13 -0.32 -0.08 0.00 -0.81 0.00 0.00 59.98 58.90 2fk5 h ARG 187 Cb 0.11 -0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 29.59 2fk5 h ARG 187 CO -0.02 0.94 0.08 -0.07 -1.51 0.00 0.00 179.97 179.39 2fk5 h LEU 188 N 0.60 1.05 -0.30 3.80 3.38 -0.75 0.11 115.31 123.19 2fk5 h LEU 188 Ca 0.10 -0.26 -0.01 0.00 0.09 0.00 0.00 57.88 57.79 2fk5 h LEU 188 Cb 0.67 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.12 2fk5 h LEU 188 CO 0.05 1.05 0.14 -0.25 0.09 0.00 0.00 178.44 179.52 2fk5 h TRP 189 N 1.01 0.44 -0.59 1.13 2.91 -1.27 -1.22 115.95 118.36 2fk5 h TRP 189 Ca 0.19 -0.02 -0.05 0.00 1.13 0.00 0.00 58.89 60.14 2fk5 h TRP 189 Cb 0.47 -0.13 -0.03 0.00 -0.51 0.00 0.00 29.16 28.96 2fk5 h TRP 189 CO 0.03 0.40 0.19 0.37 -1.03 0.00 0.00 178.44 178.40 2fk5 h GLN 190 N 0.35 0.92 0.00 2.65 5.75 -1.22 -2.81 115.11 120.75 2fk5 h GLN 190 Ca 0.10 -0.20 -0.04 0.00 -0.15 0.00 0.00 58.65 58.37 2fk5 h GLN 190 Cb 0.13 -0.13 -0.01 0.00 1.07 0.00 0.00 27.48 28.54 2fk5 h GLN 190 CO -0.01 0.82 -0.19 0.78 -2.65 0.00 0.00 178.83 177.58 2fk5 h GLY 191 N 0.84 0.00 0.89 2.39 0.00 -0.52 -2.47 103.07 104.20 2fk5 h GLY 191 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.52 2fk5 h GLY 191 CO -0.01 0.00 -0.05 0.00 0.00 0.00 0.00 176.54 176.48 2fk5 n ALA 192 N -2.32 2.68 -3.33 3.60 0.00 -0.48 -4.86 120.51 115.79 2fk5 n ALA 192 Ca -0.02 -0.25 -0.20 0.00 0.00 0.00 0.00 53.44 52.97 2fk5 n ALA 192 Cb 0.30 -1.39 0.03 0.00 0.00 0.00 0.00 19.45 18.40 2fk5 n ALA 192 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2fk5 n GLY 193 N 1.20 2.29 3.77 0.00 0.00 -0.93 -4.60 105.19 106.91 2fk5 n GLY 193 Ca 0.17 -2.23 -0.36 0.00 0.00 0.00 0.00 46.02 43.60 2fk5 n GLY 193 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2fk5 s PRO 194 N -3.95 3.69 0.00 1.61 0.04 -1.26 -5.04 135.00 130.09 2fk5 s PRO 194 Ca 0.39 1.72 0.00 0.00 0.04 0.00 0.00 61.00 63.14 2fk5 s PRO 194 Cb -0.03 -2.32 0.00 0.00 0.04 0.00 0.00 34.50 32.19 2fk5 s PRO 194 CO 0.25 -0.59 0.00 0.00 0.04 0.00 0.00 177.00 176.70