#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fn6 s VAL 17 N 0.00 5.44 -0.56 1.39 1.01 0.33 -4.12 120.40 123.89 1fn6 s VAL 17 Ca 0.00 0.22 0.00 0.00 0.00 0.00 0.00 61.98 62.20 1fn6 s VAL 17 Cb 0.00 -3.45 0.00 0.00 0.00 0.00 0.00 36.38 32.93 1fn6 s VAL 17 CO 0.00 0.52 0.00 0.61 0.00 0.00 0.00 175.10 176.23 1fn6 n GLY 18 N 2.84 0.64 0.00 4.51 0.00 -1.25 -2.28 105.19 109.64 1fn6 n GLY 18 Ca -0.18 -0.77 0.00 0.00 0.00 0.00 0.00 46.02 45.08 1fn6 n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1fn6 n GLY 19 N -1.97 1.31 3.05 -0.02 0.00 -1.26 -4.88 105.19 101.42 1fn6 n GLY 19 Ca -0.06 -1.93 -0.09 0.00 0.00 0.00 0.00 46.02 43.94 1fn6 n GLY 19 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1fn6 s TYR 20 N 1.59 0.46 -0.05 1.61 1.13 -0.42 -4.94 117.35 116.74 1fn6 s TYR 20 Ca 0.00 -0.77 -0.30 0.00 -1.41 0.00 0.00 57.07 54.59 1fn6 s TYR 20 Cb 0.00 -0.32 -0.06 0.00 -1.10 0.00 0.00 41.96 40.49 1fn6 s TYR 20 CO 0.00 -0.25 1.62 0.99 -2.51 0.00 0.00 175.55 175.40 1fn6 s THR 21 N -2.61 3.58 0.50 -3.49 2.01 -1.26 -0.40 115.64 113.96 1fn6 s THR 21 Ca -0.04 0.75 -0.23 0.00 0.31 0.00 0.00 61.69 62.47 1fn6 s THR 21 Cb -0.02 -3.48 -0.07 0.00 0.01 0.00 0.00 72.50 68.95 1fn6 s THR 21 CO -0.05 -0.06 1.37 0.00 -0.69 0.00 0.00 174.62 175.20 1fn6 n ALA 23 N -0.60 1.02 -2.00 0.00 0.00 -1.26 -4.85 120.51 112.81 1fn6 n ALA 23 Ca 0.08 0.17 -0.42 0.00 0.00 0.00 0.00 53.44 53.27 1fn6 n ALA 23 Cb 0.44 -2.24 -0.03 0.00 0.00 0.00 0.00 19.45 17.62 1fn6 n ALA 23 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1fn6 s ALA 24 N -1.29 3.61 -2.04 0.00 0.00 -1.26 -2.10 121.76 118.68 1fn6 s ALA 24 Ca 0.67 1.21 0.00 0.00 0.00 0.00 0.00 51.96 53.84 1fn6 s ALA 24 Cb -0.47 -3.54 0.00 0.00 0.00 0.00 0.00 23.12 19.11 1fn6 s ALA 24 CO 0.53 -0.65 0.00 0.09 0.00 0.00 0.00 175.76 175.73 1fn6 n ASN 25 N 3.10 -5.71 -0.18 0.00 4.13 -1.26 -4.86 115.26 110.47 1fn6 n ASN 25 Ca 0.09 0.29 0.13 0.00 1.68 0.00 0.00 54.58 56.76 1fn6 n ASN 25 Cb 0.41 -4.91 0.39 0.00 -1.54 0.00 0.00 39.78 34.14 1fn6 n ASN 25 CO 0.00 0.00 0.00 -1.54 0.28 0.00 0.00 177.26 176.00 1fn6 n SER 26 N -1.66 0.85 -3.53 6.41 3.41 -0.89 -4.18 113.62 114.02 1fn6 n SER 26 Ca -0.23 -0.72 -0.27 0.00 -0.26 0.00 0.00 58.87 57.40 1fn6 n SER 26 Cb 0.69 0.12 -0.09 0.00 -0.26 0.00 0.00 64.21 64.66 1fn6 n SER 26 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 1fn6 n ILE 27 N -0.85 1.37 1.02 -1.33 2.08 -1.26 -4.97 119.36 115.42 1fn6 n ILE 27 Ca 0.11 -4.77 0.13 0.00 0.56 0.00 0.00 62.75 58.78 1fn6 n ILE 27 Cb 0.34 -2.06 0.60 0.00 -0.75 0.00 0.00 39.64 37.77 1fn6 n ILE 27 CO 0.00 0.00 0.00 -0.81 0.56 0.00 0.00 176.55 176.30 1fn6 n PRO 28 N 1.46 0.11 0.00 0.38 -0.04 -1.26 -1.87 135.00 133.78 1fn6 n PRO 28 Ca 0.26 0.04 0.13 0.00 -0.04 0.00 0.00 63.50 63.89 1fn6 n PRO 28 Cb 0.42 -1.50 0.47 0.00 -0.04 0.00 0.00 33.50 32.84 1fn6 n PRO 28 CO 0.00 0.00 0.00 2.48 -0.04 0.00 0.00 175.50 177.94 1fn6 n TYR 29 N -1.44 0.00 -2.66 0.54 0.18 -1.19 -2.28 117.16 110.31 1fn6 n TYR 29 Ca 0.08 0.00 -0.41 0.00 1.88 0.00 0.00 57.90 59.45 1fn6 n TYR 29 Cb 0.29 -0.11 -0.04 0.00 -0.38 0.00 0.00 39.34 39.10 1fn6 n TYR 29 CO 0.00 0.00 0.00 -1.14 -2.08 0.00 0.00 176.86 173.64 1fn6 s GLN 30 N -2.40 4.63 0.18 -3.48 2.00 -0.78 -1.30 119.66 118.51 1fn6 s GLN 30 Ca 0.28 1.52 0.10 0.00 -2.00 0.00 0.00 55.36 55.26 1fn6 s GLN 30 Cb 0.20 -3.37 -0.04 0.00 0.80 0.00 0.00 33.01 30.59 1fn6 s GLN 30 CO 0.47 0.09 -0.22 0.14 -0.50 0.00 0.00 175.29 175.28 1fn6 s VAL 31 N 0.27 2.13 -0.15 1.34 -7.23 -0.64 -4.46 120.40 111.66 1fn6 s VAL 31 Ca 0.49 -1.96 -0.03 0.00 -1.81 0.00 0.00 61.98 58.67 1fn6 s VAL 31 Cb -0.24 -1.99 -0.03 0.00 0.56 0.00 0.00 36.38 34.68 1fn6 s VAL 31 CO 0.30 -0.19 -0.04 -0.55 -0.31 0.00 0.00 175.10 174.31 1fn6 s SER 32 N -2.63 4.76 -0.12 4.85 0.15 -0.85 -2.68 113.70 117.19 1fn6 s SER 32 Ca 0.18 -0.12 -0.14 0.00 0.70 0.00 0.00 55.95 56.57 1fn6 s SER 32 Cb -0.07 -1.72 -0.05 0.00 -1.71 0.00 0.00 66.02 62.47 1fn6 s SER 32 CO 0.08 0.19 0.33 -0.76 1.20 0.00 0.00 173.24 174.29 1fn6 s LEU 33 N 0.23 4.31 -0.06 3.45 1.43 0.26 -0.70 118.68 127.60 1fn6 s LEU 33 Ca -0.03 0.65 0.02 0.00 -1.03 0.00 0.00 54.13 53.74 1fn6 s LEU 33 Cb -0.14 -2.45 0.01 0.00 0.03 0.00 0.00 46.19 43.65 1fn6 s LEU 33 CO 0.03 0.15 -0.12 0.21 0.23 0.00 0.00 176.35 176.85 1fn6 s ASN 34 N 0.07 1.72 -0.48 2.29 3.84 0.58 -1.51 114.94 121.45 1fn6 s ASN 34 Ca 0.19 -0.29 0.04 0.00 0.21 0.00 0.00 52.86 53.02 1fn6 s ASN 34 Cb -0.14 -0.78 0.17 0.00 -0.55 0.00 0.00 41.25 39.95 1fn6 s ASN 34 CO 0.07 0.03 0.37 -0.94 -2.79 0.00 0.00 177.10 173.84 1fn6 s SER 37 N 0.63 2.25 0.00 -4.21 1.04 -1.26 -1.02 113.70 111.14 1fn6 s SER 37 Ca -0.14 -3.23 0.00 0.00 0.48 0.00 0.00 55.95 53.07 1fn6 s SER 37 Cb -0.15 -0.72 0.00 0.00 0.10 0.00 0.00 66.02 65.25 1fn6 s SER 37 CO 0.03 -0.15 0.00 0.61 0.98 0.00 0.00 173.24 174.71 1fn6 n GLY 38 N 2.67 2.81 3.53 7.32 0.00 -1.26 -4.95 105.19 115.31 1fn6 n GLY 38 Ca 0.27 -0.72 -0.11 0.00 0.00 0.00 0.00 46.02 45.46 1fn6 n GLY 38 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1fn6 s SER 39 N 0.00 0.26 0.27 1.61 1.04 -1.26 -5.13 113.70 110.48 1fn6 s SER 39 Ca 0.00 -1.16 -0.30 0.00 0.48 0.00 0.00 55.95 54.97 1fn6 s SER 39 Cb 0.00 0.61 -0.10 0.00 0.10 0.00 0.00 66.02 66.62 1fn6 s SER 39 CO 0.00 -1.19 1.49 -2.28 0.98 0.00 0.00 173.24 172.23 1fn6 s HIS 40 N -3.63 2.92 0.00 5.02 2.46 -1.26 -4.36 115.29 116.45 1fn6 s HIS 40 Ca 0.26 0.96 0.00 0.00 0.47 0.00 0.00 55.06 56.75 1fn6 s HIS 40 Cb -0.00 -3.90 0.00 0.00 -0.13 0.00 0.00 32.58 28.55 1fn6 s HIS 40 CO 0.13 -2.95 0.00 1.97 -2.47 0.00 0.00 174.74 171.42 1fn6 n PHE 41 N 2.21 0.00 -3.71 3.88 -1.74 -0.57 -4.93 117.46 112.60 1fn6 n PHE 41 Ca 0.07 0.00 -0.10 0.00 -0.56 0.00 0.00 57.45 56.86 1fn6 n PHE 41 Cb 0.39 0.00 -0.04 0.00 1.52 0.00 0.00 39.48 41.35 1fn6 n PHE 41 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 1fn6 n GLY 43 N -0.29 1.54 3.93 0.00 0.00 -0.13 -0.57 105.19 109.67 1fn6 n GLY 43 Ca -0.12 -2.11 0.00 0.00 0.00 0.00 0.00 46.02 43.79 1fn6 n GLY 43 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1fn6 s GLY 44 N -3.26 -0.04 -0.02 -0.02 0.00 -1.09 -3.77 107.32 99.11 1fn6 s GLY 44 Ca 0.27 -0.09 0.01 0.00 0.00 0.00 0.00 44.72 44.91 1fn6 s GLY 44 CO 0.17 4.00 -0.03 -0.56 0.00 0.00 0.00 173.10 176.69 1fn6 s SER 45 N -3.60 0.50 -0.23 1.64 0.01 -0.59 -1.63 113.70 109.80 1fn6 s SER 45 Ca 0.25 -0.06 -0.28 0.00 1.31 0.00 0.00 55.95 57.18 1fn6 s SER 45 Cb -0.01 -0.16 0.01 0.00 0.21 0.00 0.00 66.02 66.06 1fn6 s SER 45 CO 0.02 -0.02 0.97 -0.22 0.41 0.00 0.00 173.24 174.40 1fn6 s LEU 46 N 0.42 4.09 -0.01 2.44 2.96 -0.42 -0.84 118.68 127.33 1fn6 s LEU 46 Ca -0.04 1.27 0.09 0.00 -0.22 0.00 0.00 54.13 55.23 1fn6 s LEU 46 Cb -0.07 -3.43 -0.12 0.00 0.50 0.00 0.00 46.19 43.06 1fn6 s LEU 46 CO -0.01 -0.62 0.32 2.30 -1.32 0.00 0.00 176.35 177.02 1fn6 n ILE 47 N 5.30 0.00 -3.27 6.68 -5.35 -0.87 -1.48 119.36 120.38 1fn6 n ILE 47 Ca 0.10 -0.25 -0.01 0.00 -0.27 0.00 0.00 62.75 62.31 1fn6 n ILE 47 Cb 0.46 0.70 0.00 0.00 -1.74 0.00 0.00 39.64 39.07 1fn6 n ILE 47 CO 0.00 0.00 0.00 -0.46 -1.76 0.00 0.00 176.55 174.33 1fn6 n ASN 48 N -1.48 -0.20 0.20 7.28 0.23 -1.18 -4.70 115.26 115.42 1fn6 n ASN 48 Ca 0.00 -1.17 0.14 0.00 -0.53 0.00 0.00 54.58 53.02 1fn6 n ASN 48 Cb 0.19 0.34 0.48 0.00 -2.08 0.00 0.00 39.78 38.71 1fn6 n ASN 48 CO 0.00 0.00 0.00 0.77 -0.93 0.00 0.00 177.26 177.10 1fn6 h SER 49 N 0.20 0.00 -0.02 0.53 4.64 -1.96 -3.06 113.55 113.88 1fn6 h SER 49 Ca -0.03 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.29 1fn6 h SER 49 Cb 0.12 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.21 1fn6 h SER 49 CO 0.04 0.00 -0.02 0.00 -0.87 0.00 0.00 176.83 175.98 1fn6 n GLN 50 N -2.71 0.82 -3.85 4.77 6.02 -1.26 0.07 117.38 121.23 1fn6 n GLN 50 Ca 0.03 -1.21 -0.15 0.00 -0.01 0.00 0.00 57.00 55.66 1fn6 n GLN 50 Cb 0.35 -1.23 -0.15 0.00 1.02 0.00 0.00 30.24 30.22 1fn6 n GLN 50 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 177.06 174.47 1fn6 s TRP 51 N -1.08 0.10 -0.05 1.08 0.52 -1.16 -1.24 118.94 117.12 1fn6 s TRP 51 Ca 0.14 0.05 0.04 0.00 0.02 0.00 0.00 56.10 56.36 1fn6 s TRP 51 Cb 0.10 -0.20 -0.02 0.00 -1.15 0.00 0.00 33.47 32.20 1fn6 s TRP 51 CO 0.17 -0.07 -0.16 0.08 0.02 0.00 0.00 176.95 176.99 1fn6 s VAL 52 N 0.67 2.89 -0.07 4.03 1.01 -0.17 -2.05 120.40 126.71 1fn6 s VAL 52 Ca -0.06 -0.79 -0.03 0.00 0.00 0.00 0.00 61.98 61.11 1fn6 s VAL 52 Cb -0.09 -2.12 -0.04 0.00 0.00 0.00 0.00 36.38 34.14 1fn6 s VAL 52 CO -0.02 0.59 0.05 0.54 0.00 0.00 0.00 175.10 176.26 1fn6 s VAL 53 N -0.66 4.69 0.00 2.92 0.11 -0.02 -0.61 120.40 126.83 1fn6 s VAL 53 Ca 0.10 -0.19 0.00 0.00 -2.93 0.00 0.00 61.98 58.96 1fn6 s VAL 53 Cb -0.11 -3.04 0.00 0.00 -1.53 0.00 0.00 36.38 31.71 1fn6 s VAL 53 CO 0.01 0.54 0.00 -0.24 -3.33 0.00 0.00 175.10 172.08 1fn6 n SER 54 N 1.86 0.00 -4.73 3.54 2.88 -0.47 -1.54 113.62 115.16 1fn6 n SER 54 Ca -0.18 -0.98 -0.38 0.00 -1.33 0.00 0.00 58.87 56.00 1fn6 n SER 54 Cb 0.54 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.94 1fn6 n SER 54 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1fn6 s ALA 55 N -1.76 3.49 0.40 -1.46 0.00 -1.26 -1.62 121.76 119.55 1fn6 s ALA 55 Ca 0.00 -0.19 0.13 0.00 0.00 0.00 0.00 51.96 51.90 1fn6 s ALA 55 Cb 0.00 -2.63 0.96 0.00 0.00 0.00 0.00 23.12 21.45 1fn6 s ALA 55 CO 0.00 0.05 1.91 0.00 0.00 0.00 0.00 175.76 177.71 1fn6 h ALA 56 N 6.52 1.99 0.00 0.00 0.00 -1.70 -0.86 119.26 125.22 1fn6 h ALA 56 Ca -0.42 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.49 1fn6 h ALA 56 Cb 1.18 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.88 1fn6 h ALA 56 CO 0.74 -0.20 0.00 -2.39 0.00 0.00 0.00 179.25 177.40 1fn6 n HIS 57 N -4.50 0.00 1.64 0.00 1.44 -1.26 -1.86 115.22 110.68 1fn6 n HIS 57 Ca 0.15 0.00 0.15 0.00 -2.01 0.00 0.00 57.72 56.01 1fn6 n HIS 57 Cb 0.49 -0.22 0.66 0.00 0.12 0.00 0.00 29.99 31.04 1fn6 n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1fn6 n TYR 59 N -0.35 2.21 -3.99 0.00 9.36 -0.78 -5.01 117.16 118.60 1fn6 n TYR 59 Ca 0.20 0.43 -0.09 0.00 3.32 0.00 0.00 57.90 61.76 1fn6 n TYR 59 Cb 0.27 -2.46 -0.08 0.00 -0.63 0.00 0.00 39.34 36.43 1fn6 n TYR 59 CO 0.00 0.00 0.00 0.15 0.22 0.00 0.00 176.86 177.23 1fn6 s LYS 60 N -0.53 0.86 0.18 2.98 1.02 -1.26 -5.08 119.74 117.91 1fn6 s LYS 60 Ca 0.67 -1.16 0.23 0.00 0.02 0.00 0.00 55.97 55.72 1fn6 s LYS 60 Cb -0.63 0.30 0.04 0.00 -0.52 0.00 0.00 37.83 37.01 1fn6 s LYS 60 CO 0.51 -0.26 1.06 -1.13 -0.92 0.00 0.00 175.35 174.61 1fn6 n SER 61 N -0.06 0.79 -4.22 2.83 3.41 -1.26 -4.70 113.62 110.42 1fn6 n SER 61 Ca -0.11 0.25 -0.33 0.00 -0.26 0.00 0.00 58.87 58.42 1fn6 n SER 61 Cb 0.62 0.47 -0.16 0.00 -0.26 0.00 0.00 64.21 64.89 1fn6 n SER 61 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1fn6 s ARG 62 N -3.33 3.11 -0.02 4.33 3.03 -1.26 -5.04 118.95 119.76 1fn6 s ARG 62 Ca 0.00 -0.81 0.01 0.00 2.03 0.00 0.00 55.73 56.96 1fn6 s ARG 62 Cb 0.10 -2.51 0.02 0.00 -1.03 0.00 0.00 34.95 31.54 1fn6 s ARG 62 CO 0.78 0.02 -0.02 0.42 -1.13 0.00 0.00 175.30 175.38 1fn6 s ILE 63 N 0.76 0.26 -0.18 4.99 1.01 -1.26 -4.77 121.20 122.01 1fn6 s ILE 63 Ca -0.07 -0.01 -0.08 0.00 0.00 0.00 0.00 60.65 60.48 1fn6 s ILE 63 Cb -0.16 -0.31 -0.04 0.00 0.01 0.00 0.00 42.46 41.96 1fn6 s ILE 63 CO -0.00 0.14 0.08 -1.58 0.00 0.00 0.00 174.94 173.58 1fn6 s GLN 64 N 0.69 4.02 -0.26 2.79 0.74 -0.19 -1.62 119.66 125.82 1fn6 s GLN 64 Ca -0.07 -0.31 -0.21 0.00 0.05 0.00 0.00 55.36 54.82 1fn6 s GLN 64 Cb -0.10 -3.26 -0.02 0.00 1.10 0.00 0.00 33.01 30.73 1fn6 s GLN 64 CO -0.01 0.29 0.64 0.08 -0.55 0.00 0.00 175.29 175.74 1fn6 s VAL 65 N 0.34 4.97 -0.31 1.34 1.01 -0.04 -0.31 120.40 127.39 1fn6 s VAL 65 Ca 0.04 1.11 -0.06 0.00 0.00 0.00 0.00 61.98 63.07 1fn6 s VAL 65 Cb -0.12 -3.96 0.03 0.00 0.00 0.00 0.00 36.38 32.33 1fn6 s VAL 65 CO -0.00 -0.01 0.08 -0.13 0.00 0.00 0.00 175.10 175.03 1fn6 s ARG 66 N 2.55 2.81 0.26 2.72 0.52 0.12 -1.05 118.95 126.88 1fn6 s ARG 66 Ca 0.27 -1.04 -0.03 0.00 -0.52 0.00 0.00 55.73 54.41 1fn6 s ARG 66 Cb -0.15 -3.37 -0.05 0.00 0.52 0.00 0.00 34.95 31.90 1fn6 s ARG 66 CO 0.09 -0.55 0.49 -0.51 0.02 0.00 0.00 175.30 174.84 1fn6 s LEU 67 N 1.43 4.12 -0.60 2.53 1.43 -0.34 -2.00 118.68 125.25 1fn6 s LEU 67 Ca -0.00 0.56 0.00 0.00 -1.03 0.00 0.00 54.13 53.66 1fn6 s LEU 67 Cb -0.18 -3.36 0.00 0.00 0.03 0.00 0.00 46.19 42.67 1fn6 s LEU 67 CO 0.02 -0.15 0.00 0.61 0.23 0.00 0.00 176.35 177.06 1fn6 n GLY 69 N -0.93 0.79 3.79 -3.19 0.00 -1.26 -1.14 105.19 103.25 1fn6 n GLY 69 Ca -0.03 -0.44 -0.35 0.00 0.00 0.00 0.00 46.02 45.20 1fn6 n GLY 69 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1fn6 s GLU 70 N -2.08 3.98 0.08 1.61 0.41 -1.26 -4.40 118.70 117.04 1fn6 s GLU 70 Ca 0.00 1.45 0.00 0.00 -0.41 0.00 0.00 54.97 56.01 1fn6 s GLU 70 Cb 0.00 -2.33 0.00 0.00 -1.78 0.00 0.00 34.13 30.02 1fn6 s GLU 70 CO 0.00 -0.29 0.00 1.58 -0.49 0.00 0.00 175.26 176.06 1fn6 n HIS 71 N -0.50 -0.48 -3.53 1.61 -0.00 -1.26 -4.72 115.22 106.34 1fn6 n HIS 71 Ca 0.07 0.08 -0.41 0.00 -0.00 0.00 0.00 57.72 57.46 1fn6 n HIS 71 Cb 0.51 0.23 -0.11 0.00 -0.00 0.00 0.00 29.99 30.62 1fn6 n HIS 71 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 176.34 177.55 1fn6 s ASN 72 N -5.24 5.97 0.30 0.26 3.84 -1.26 -2.33 114.94 116.48 1fn6 s ASN 72 Ca 0.00 -0.66 0.26 0.00 0.21 0.00 0.00 52.86 52.67 1fn6 s ASN 72 Cb 0.00 -2.11 0.84 0.00 -0.55 0.00 0.00 41.25 39.42 1fn6 s ASN 72 CO 0.00 -0.32 1.75 0.16 -2.79 0.00 0.00 177.10 175.91 1fn6 h ILE 73 N 5.60 0.00 0.00 -5.21 3.07 -1.63 -3.08 117.51 116.27 1fn6 h ILE 73 Ca -0.29 -0.50 0.00 0.00 1.55 0.00 0.00 64.86 65.61 1fn6 h ILE 73 Cb 1.14 1.43 0.00 0.00 -0.27 0.00 0.00 36.82 39.12 1fn6 h ILE 73 CO 0.67 0.00 -0.55 0.47 -1.05 0.00 0.00 178.15 177.69 1fn6 n ASP 74 N -2.49 0.56 -4.04 2.16 8.00 -1.26 -4.91 116.55 114.56 1fn6 n ASP 74 Ca 0.04 -0.06 -0.18 0.00 0.71 0.00 0.00 54.79 55.29 1fn6 n ASP 74 Cb 0.38 0.20 -0.14 0.00 -0.02 0.00 0.00 41.12 41.54 1fn6 n ASP 74 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1fn6 s VAL 75 N -3.08 0.75 -0.17 2.53 1.01 -1.17 -5.12 120.40 115.16 1fn6 s VAL 75 Ca 0.09 -0.51 -0.27 0.00 0.00 0.00 0.00 61.98 61.28 1fn6 s VAL 75 Cb 0.16 -0.65 -0.01 0.00 0.00 0.00 0.00 36.38 35.88 1fn6 s VAL 75 CO 0.70 0.14 0.92 -0.76 0.00 0.00 0.00 175.10 176.10 1fn6 s LEU 76 N -0.43 4.17 -0.06 3.92 1.43 -1.26 -4.78 118.68 121.67 1fn6 s LEU 76 Ca 0.02 1.29 0.09 0.00 -1.03 0.00 0.00 54.13 54.50 1fn6 s LEU 76 Cb -0.05 -3.37 -0.13 0.00 0.03 0.00 0.00 46.19 42.68 1fn6 s LEU 76 CO -0.00 -0.48 0.11 -0.62 0.23 0.00 0.00 176.35 175.59 1fn6 n GLU 77 N 5.47 1.60 0.00 1.70 1.02 -1.26 -5.03 120.64 124.14 1fn6 n GLU 77 Ca 0.07 -0.04 0.00 0.00 -0.02 0.00 0.00 57.16 57.17 1fn6 n GLU 77 Cb 0.48 -1.23 0.00 0.00 -0.02 0.00 0.00 31.44 30.67 1fn6 n GLU 77 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1fn6 n GLY 78 N 2.24 0.87 1.09 0.62 0.00 -1.26 -4.95 105.19 103.80 1fn6 n GLY 78 Ca -0.09 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.04 1fn6 n GLY 78 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1fn6 n ASN 79 N 0.00 3.27 -4.83 1.61 5.03 -1.26 -5.02 115.26 114.05 1fn6 n ASN 79 Ca 0.00 -1.97 -0.33 0.00 0.87 0.00 0.00 54.58 53.15 1fn6 n ASN 79 Cb 0.00 -0.24 -0.06 0.00 -1.02 0.00 0.00 39.78 38.46 1fn6 n ASN 79 CO 0.00 0.00 0.00 -1.61 -1.83 0.00 0.00 177.26 173.82 1fn6 s GLU 80 N -1.52 4.13 -0.10 3.52 8.01 -1.26 -4.59 118.70 126.88 1fn6 s GLU 80 Ca 0.38 0.87 0.04 0.00 0.01 0.00 0.00 54.97 56.27 1fn6 s GLU 80 Cb 0.22 -2.39 0.00 0.00 -4.31 0.00 0.00 34.13 27.65 1fn6 s GLU 80 CO 0.31 0.11 -0.22 -0.65 0.01 0.00 0.00 175.26 174.82 1fn6 s GLN 81 N -2.93 2.88 -0.25 1.61 -0.21 -0.29 -4.99 119.66 115.47 1fn6 s GLN 81 Ca 0.56 -0.82 -0.06 0.00 0.02 0.00 0.00 55.36 55.06 1fn6 s GLN 81 Cb -0.11 -2.21 -0.01 0.00 1.00 0.00 0.00 33.01 31.68 1fn6 s GLN 81 CO 0.16 0.13 0.04 -0.06 -2.12 0.00 0.00 175.29 173.45 1fn6 s PHE 82 N 0.46 3.07 -0.04 0.91 0.08 -1.26 -1.20 117.98 119.99 1fn6 s PHE 82 Ca -0.17 -0.70 0.01 0.00 0.12 0.00 0.00 56.93 56.20 1fn6 s PHE 82 Cb -0.17 -2.21 0.02 0.00 -0.57 0.00 0.00 43.02 40.09 1fn6 s PHE 82 CO 0.07 -0.46 -0.05 0.42 -0.10 0.00 0.00 175.22 175.09 1fn6 s ILE 83 N 1.55 0.59 0.39 0.64 1.01 -0.21 -4.99 121.20 120.17 1fn6 s ILE 83 Ca 0.05 -0.16 -0.22 0.00 0.00 0.00 0.00 60.65 60.32 1fn6 s ILE 83 Cb -0.15 -0.60 -0.10 0.00 0.01 0.00 0.00 42.46 41.61 1fn6 s ILE 83 CO 0.01 0.23 0.93 0.20 0.00 0.00 0.00 174.94 176.32 1fn6 s ASN 84 N 0.84 7.05 0.23 3.58 0.02 -1.26 -0.86 114.94 124.55 1fn6 s ASN 84 Ca -0.12 1.70 -0.30 0.00 -1.02 0.00 0.00 52.86 53.13 1fn6 s ASN 84 Cb -0.14 -2.54 -0.09 0.00 0.02 0.00 0.00 41.25 38.50 1fn6 s ASN 84 CO 0.01 -0.25 1.26 0.00 0.02 0.00 0.00 177.10 178.13 1fn6 s ALA 85 N -1.98 3.49 -0.22 0.60 0.00 -0.64 -1.35 121.76 121.66 1fn6 s ALA 85 Ca 0.58 1.08 0.06 0.00 0.00 0.00 0.00 51.96 53.68 1fn6 s ALA 85 Cb -0.12 -3.45 -0.17 0.00 0.00 0.00 0.00 23.12 19.38 1fn6 s ALA 85 CO 0.17 -0.48 -0.12 0.00 0.00 0.00 0.00 175.76 175.33 1fn6 n ALA 86 N 2.04 1.52 -2.83 0.00 0.00 0.72 -4.78 120.51 117.18 1fn6 n ALA 86 Ca 0.04 -1.05 -0.13 0.00 0.00 0.00 0.00 53.44 52.29 1fn6 n ALA 86 Cb 0.43 -0.06 -0.14 0.00 0.00 0.00 0.00 19.45 19.68 1fn6 n ALA 86 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1fn6 s LYS 87 N -2.45 0.21 -0.12 0.00 1.02 -0.95 -4.99 119.74 112.45 1fn6 s LYS 87 Ca -0.24 -0.13 -0.00 0.00 0.02 0.00 0.00 55.97 55.61 1fn6 s LYS 87 Cb 0.07 -0.18 0.03 0.00 -0.52 0.00 0.00 37.83 37.23 1fn6 s LYS 87 CO 0.60 0.05 -0.07 0.42 -0.92 0.00 0.00 175.35 175.42 1fn6 s ILE 88 N -0.17 1.03 -0.22 2.17 1.01 -1.26 -0.77 121.20 123.00 1fn6 s ILE 88 Ca -0.00 -0.32 -0.00 0.00 0.00 0.00 0.00 60.65 60.32 1fn6 s ILE 88 Cb -0.02 -1.07 0.06 0.00 0.01 0.00 0.00 42.46 41.44 1fn6 s ILE 88 CO -0.00 0.35 -0.03 -0.63 0.00 0.00 0.00 174.94 174.63 1fn6 s ILE 89 N 1.70 1.19 0.23 2.92 1.01 -0.18 -4.99 121.20 123.08 1fn6 s ILE 89 Ca 0.05 -0.96 -0.06 0.00 0.00 0.00 0.00 60.65 59.68 1fn6 s ILE 89 Cb -0.13 -1.52 -0.06 0.00 0.01 0.00 0.00 42.46 40.77 1fn6 s ILE 89 CO -0.08 -0.11 0.49 0.42 0.00 0.00 0.00 174.94 175.66 1fn6 s THR 90 N 1.56 5.06 0.29 2.92 -4.23 -1.26 -0.54 115.64 119.44 1fn6 s THR 90 Ca -0.04 0.11 -0.29 0.00 -1.18 0.00 0.00 61.69 60.28 1fn6 s THR 90 Cb -0.18 -3.68 -0.10 0.00 1.34 0.00 0.00 72.50 69.88 1fn6 s THR 90 CO -0.07 -0.15 1.44 -2.28 -0.54 0.00 0.00 174.62 173.02 1fn6 s HIS 91 N -1.89 2.92 0.31 3.99 2.46 -0.99 -4.87 115.29 117.22 1fn6 s HIS 91 Ca 0.43 1.09 0.38 0.00 0.47 0.00 0.00 55.06 57.43 1fn6 s HIS 91 Cb -0.11 -3.86 1.83 0.00 -0.13 0.00 0.00 32.58 30.30 1fn6 s HIS 91 CO 0.26 -2.70 2.13 -1.00 -2.47 0.00 0.00 174.74 170.96 1fn6 h PRO 92 N 4.36 0.00 -0.31 2.88 0.13 -1.94 -2.33 132.00 134.80 1fn6 h PRO 92 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 1fn6 h PRO 92 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 1fn6 h PRO 92 CO 0.73 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.59 1fn6 n ASN 93 N -2.99 4.14 -4.72 1.44 5.03 -1.26 -5.01 115.26 111.88 1fn6 n ASN 93 Ca -0.01 -2.98 -0.43 0.00 0.87 0.00 0.00 54.58 52.03 1fn6 n ASN 93 Cb 0.18 -0.56 -0.02 0.00 -1.02 0.00 0.00 39.78 38.36 1fn6 n ASN 93 CO 0.00 0.00 0.00 0.33 -1.83 0.00 0.00 177.26 175.76 1fn6 n PHE 94 N -0.32 2.63 -4.05 3.10 7.35 -0.88 -4.64 117.46 120.65 1fn6 n PHE 94 Ca 0.22 0.26 -0.33 0.00 -0.76 0.00 0.00 57.45 56.85 1fn6 n PHE 94 Cb 0.93 -2.57 -0.15 0.00 0.35 0.00 0.00 39.48 38.03 1fn6 n PHE 94 CO 0.00 0.00 0.00 1.21 -0.76 0.00 0.00 176.76 177.21 1fn6 s ASN 95 N 0.59 4.18 0.63 -2.13 3.84 -0.65 -5.01 114.94 116.40 1fn6 s ASN 95 Ca 0.68 -1.16 0.35 0.00 0.21 0.00 0.00 52.86 52.94 1fn6 s ASN 95 Cb -0.55 -1.56 1.98 0.00 -0.55 0.00 0.00 41.25 40.57 1fn6 s ASN 95 CO 0.45 -0.15 2.20 1.23 -2.79 0.00 0.00 177.10 178.05 1fn6 h GLY 96 N 7.86 0.00 0.01 1.21 0.00 -1.93 0.36 103.07 110.58 1fn6 h GLY 96 Ca -0.27 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.06 1fn6 h GLY 96 CO 0.52 0.00 -0.00 -0.57 0.00 0.00 0.00 176.54 176.49 1fn6 h ASN 97 N 0.00 -0.00 1.33 0.19 -0.73 -1.99 -3.39 115.58 110.99 1fn6 h ASN 97 Ca 0.02 -0.67 0.00 0.00 1.87 0.00 0.00 56.30 57.52 1fn6 h ASN 97 Cb 0.25 0.00 0.00 0.00 0.27 0.00 0.00 38.32 38.84 1fn6 h ASN 97 CO -0.00 0.83 -0.24 0.71 -0.37 0.00 0.00 177.43 178.36 1fn6 h THR 98 N -1.00 0.00 -0.95 -3.57 1.35 -1.96 -3.47 112.91 103.31 1fn6 h THR 98 Ca -0.00 -0.57 -0.38 0.00 -0.55 0.00 0.00 66.41 64.91 1fn6 h THR 98 Cb 0.67 1.42 -0.15 0.00 -1.73 0.00 0.00 68.15 68.36 1fn6 h THR 98 CO 0.00 0.00 -0.35 0.18 -0.25 0.00 0.00 175.52 175.10 1fn6 n LEU 99 N -2.34 -1.28 -4.77 3.87 4.77 0.13 -4.99 117.00 112.39 1fn6 n LEU 99 Ca 0.04 0.46 -0.38 0.00 -0.03 0.00 0.00 56.01 56.11 1fn6 n LEU 99 Cb 0.45 -2.77 -0.01 0.00 -2.33 0.00 0.00 43.42 38.77 1fn6 n LEU 99 CO 0.33 -1.05 0.86 -0.62 -1.33 0.00 0.00 177.39 175.58 1fn6 s ASP 100 N -2.65 6.14 -1.25 -1.43 2.15 -1.22 -3.23 116.67 115.18 1fn6 s ASP 100 Ca 0.00 2.39 -0.01 0.00 0.43 0.00 0.00 52.55 55.36 1fn6 s ASP 100 Cb 0.00 -2.61 0.00 0.00 -0.30 0.00 0.00 42.92 40.01 1fn6 s ASP 100 CO 0.00 -0.94 0.94 0.59 -0.17 0.00 0.00 175.17 175.59 1fn6 n ASN 101 N -0.40 -2.24 -4.51 -0.34 4.13 -1.26 -1.63 115.26 109.00 1fn6 n ASN 101 Ca 0.07 -0.67 -0.43 0.00 1.68 0.00 0.00 54.58 55.23 1fn6 n ASN 101 Cb 0.47 -4.82 -0.01 0.00 -1.54 0.00 0.00 39.78 33.88 1fn6 n ASN 101 CO 0.00 0.00 0.00 -0.62 0.28 0.00 0.00 177.26 176.92 1fn6 s ASP 102 N -4.25 6.83 -0.11 6.41 2.15 -1.20 -4.33 116.67 122.17 1fn6 s ASP 102 Ca 0.07 -2.41 -0.22 0.00 0.43 0.00 0.00 52.55 50.42 1fn6 s ASP 102 Cb -0.03 -2.49 0.05 0.00 -0.30 0.00 0.00 42.92 40.15 1fn6 s ASP 102 CO 0.75 -1.06 0.52 -0.51 -0.17 0.00 0.00 175.17 174.71 1fn6 s ILE 103 N 3.18 0.02 -0.10 4.11 2.07 -1.26 -4.01 121.20 125.20 1fn6 s ILE 103 Ca 0.45 -0.12 -0.11 0.00 -1.41 0.00 0.00 60.65 59.46 1fn6 s ILE 103 Cb -0.00 -0.79 0.03 0.00 0.13 0.00 0.00 42.46 41.82 1fn6 s ILE 103 CO -0.01 -0.07 0.30 -0.32 -1.91 0.00 0.00 174.94 172.94 1fn6 s MET 104 N -0.58 0.41 -0.02 3.50 -2.45 -0.64 -2.34 119.30 117.18 1fn6 s MET 104 Ca -0.07 0.30 0.03 0.00 -1.25 0.00 0.00 55.69 54.70 1fn6 s MET 104 Cb -0.03 0.20 -0.03 0.00 1.25 0.00 0.00 34.83 36.21 1fn6 s MET 104 CO 0.04 -0.07 -0.09 -0.51 1.05 0.00 0.00 175.02 175.45 1fn6 s LEU 105 N -0.12 3.04 -0.15 4.11 1.43 0.30 -1.36 118.68 125.92 1fn6 s LEU 105 Ca -0.03 -0.14 0.02 0.00 -1.03 0.00 0.00 54.13 52.95 1fn6 s LEU 105 Cb -0.03 -1.70 0.02 0.00 0.03 0.00 0.00 46.19 44.50 1fn6 s LEU 105 CO 0.01 0.31 -0.20 -0.63 0.23 0.00 0.00 176.35 176.07 1fn6 s ILE 106 N -0.89 1.98 -0.07 -0.59 1.01 0.22 -1.01 121.20 121.84 1fn6 s ILE 106 Ca 0.14 -0.91 -0.20 0.00 0.00 0.00 0.00 60.65 59.69 1fn6 s ILE 106 Cb -0.11 -1.77 -0.04 0.00 0.01 0.00 0.00 42.46 40.54 1fn6 s ILE 106 CO 0.04 0.53 0.56 -0.75 0.00 0.00 0.00 174.94 175.32 1fn6 s LYS 107 N 1.07 4.34 0.55 2.79 2.20 0.05 -1.00 119.74 129.75 1fn6 s LYS 107 Ca -0.01 0.62 -0.16 0.00 -0.36 0.00 0.00 55.97 56.06 1fn6 s LYS 107 Cb -0.14 -3.41 -0.06 0.00 -1.51 0.00 0.00 37.83 32.71 1fn6 s LYS 107 CO -0.07 0.21 1.02 -0.51 -0.36 0.00 0.00 175.35 175.63 1fn6 s LEU 108 N 0.40 3.55 0.40 5.43 1.43 -0.37 -0.20 118.68 129.31 1fn6 s LEU 108 Ca 0.30 1.66 0.22 0.00 -1.03 0.00 0.00 54.13 55.28 1fn6 s LEU 108 Cb -0.17 -4.52 0.27 0.00 0.03 0.00 0.00 46.19 41.81 1fn6 s LEU 108 CO 0.14 -0.85 1.53 0.77 0.23 0.00 0.00 176.35 178.17 1fn6 h SER 109 N 0.64 0.00 -5.32 2.29 4.64 -1.52 -3.41 113.55 110.87 1fn6 h SER 109 Ca -0.47 0.00 -0.17 0.00 -0.47 0.00 0.00 61.79 60.68 1fn6 h SER 109 Cb 1.20 0.00 -0.15 0.00 -0.31 0.00 0.00 62.40 63.14 1fn6 h SER 109 CO 0.60 0.06 -0.66 -0.94 -0.87 0.00 0.00 176.83 175.02 1fn6 s SER 110 N -6.15 0.41 0.28 4.97 1.04 -1.26 -5.01 113.70 107.97 1fn6 s SER 110 Ca 0.06 -1.15 -0.29 0.00 0.48 0.00 0.00 55.95 55.04 1fn6 s SER 110 Cb 0.06 0.26 -0.10 0.00 0.10 0.00 0.00 66.02 66.34 1fn6 s SER 110 CO 0.69 -0.68 1.35 -2.16 0.98 0.00 0.00 173.24 173.41 1fn6 s PRO 111 N -4.01 4.34 0.43 4.02 0.04 -1.26 -4.93 135.00 133.63 1fn6 s PRO 111 Ca 0.20 2.21 -0.25 0.00 0.04 0.00 0.00 61.00 63.19 1fn6 s PRO 111 Cb 0.08 -3.11 -0.08 0.00 0.04 0.00 0.00 34.50 31.42 1fn6 s PRO 111 CO -0.01 -0.27 1.33 0.00 0.04 0.00 0.00 177.00 178.09 1fn6 s ALA 112 N -0.52 3.21 -0.22 8.56 0.00 0.11 -5.00 121.76 127.90 1fn6 s ALA 112 Ca 0.54 1.28 -0.20 0.00 0.00 0.00 0.00 51.96 53.58 1fn6 s ALA 112 Cb -0.40 -3.51 -0.03 0.00 0.00 0.00 0.00 23.12 19.19 1fn6 s ALA 112 CO 0.47 -0.94 0.59 0.99 0.00 0.00 0.00 175.76 176.87 1fn6 s THR 113 N -1.26 5.04 0.04 0.00 2.01 -1.26 -4.85 115.64 115.35 1fn6 s THR 113 Ca 0.59 1.08 -0.20 0.00 0.31 0.00 0.00 61.69 63.47 1fn6 s THR 113 Cb -0.39 -3.90 -0.06 0.00 0.01 0.00 0.00 72.50 68.15 1fn6 s THR 113 CO 0.50 0.10 0.59 -0.76 -0.69 0.00 0.00 174.62 174.36 1fn6 s LEU 114 N 2.04 4.48 0.00 4.42 2.01 -1.26 -4.81 118.68 125.56 1fn6 s LEU 114 Ca 0.26 1.24 0.00 0.00 0.01 0.00 0.00 54.13 55.64 1fn6 s LEU 114 Cb -0.16 -2.93 0.00 0.00 0.01 0.00 0.00 46.19 43.11 1fn6 s LEU 114 CO 0.10 0.19 0.00 -0.46 1.01 0.00 0.00 176.35 177.19 1fn6 n ASN 115 N 2.17 0.00 0.15 2.29 0.23 -0.26 -4.99 115.26 114.85 1fn6 n ASN 115 Ca -0.08 -0.29 0.13 0.00 -0.53 0.00 0.00 54.58 53.81 1fn6 n ASN 115 Cb 0.51 0.00 0.36 0.00 -2.08 0.00 0.00 39.78 38.56 1fn6 n ASN 115 CO 0.00 0.00 0.00 0.77 -0.93 0.00 0.00 177.26 177.10 1fn6 h SER 116 N 0.00 0.00 0.00 0.53 4.64 -2.00 -3.02 113.55 113.70 1fn6 h SER 116 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1fn6 h SER 116 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1fn6 h SER 116 CO 0.00 0.00 -0.74 0.54 -0.87 0.00 0.00 176.83 175.76 1fn6 n ARG 117 N -2.55 1.85 -3.64 4.77 3.00 -1.26 -4.87 116.66 113.95 1fn6 n ARG 117 Ca 0.05 -0.00 -0.19 0.00 -0.01 0.00 0.00 57.85 57.69 1fn6 n ARG 117 Cb 0.44 -1.24 -0.16 0.00 0.00 0.00 0.00 32.46 31.50 1fn6 n ARG 117 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.63 177.71 1fn6 s VAL 118 N -2.47 -0.19 0.02 1.55 1.01 -1.14 -4.16 120.40 115.02 1fn6 s VAL 118 Ca 0.06 0.26 -0.25 0.00 0.00 0.00 0.00 61.98 62.05 1fn6 s VAL 118 Cb 0.12 -0.32 0.06 0.00 0.00 0.00 0.00 36.38 36.24 1fn6 s VAL 118 CO 0.64 0.06 0.58 0.00 0.00 0.00 0.00 175.10 176.38 1fn6 s ALA 119 N 2.23 -1.49 0.37 5.51 0.00 -0.97 -1.10 121.76 126.32 1fn6 s ALA 119 Ca 0.04 0.85 -0.07 0.00 0.00 0.00 0.00 51.96 52.77 1fn6 s ALA 119 Cb -0.13 0.27 -0.05 0.00 0.00 0.00 0.00 23.12 23.20 1fn6 s ALA 119 CO -0.06 -0.46 0.69 0.95 0.00 0.00 0.00 175.76 176.88 1fn6 s THR 120 N -2.02 4.90 -0.02 0.00 -4.23 -1.26 -3.18 115.64 109.82 1fn6 s THR 120 Ca -0.07 0.33 0.03 0.00 -1.18 0.00 0.00 61.69 60.79 1fn6 s THR 120 Cb -0.01 -3.76 -0.03 0.00 1.34 0.00 0.00 72.50 70.04 1fn6 s THR 120 CO 0.02 -0.50 -0.08 0.54 -0.54 0.00 0.00 174.62 174.06 1fn6 s VAL 121 N -2.32 3.59 0.46 2.29 0.11 -0.55 -4.87 120.40 119.11 1fn6 s VAL 121 Ca 0.48 -0.69 -0.23 0.00 -2.93 0.00 0.00 61.98 58.61 1fn6 s VAL 121 Cb -0.10 -2.52 -0.07 0.00 -1.53 0.00 0.00 36.38 32.15 1fn6 s VAL 121 CO 0.33 0.47 1.14 -0.44 -3.33 0.00 0.00 175.10 173.28 1fn6 s SER 122 N -1.17 6.21 0.77 3.54 0.01 -1.26 -4.64 113.70 117.16 1fn6 s SER 122 Ca 0.15 2.25 -0.11 0.00 1.31 0.00 0.00 55.95 59.55 1fn6 s SER 122 Cb -0.11 -2.60 0.05 0.00 0.21 0.00 0.00 66.02 63.57 1fn6 s SER 122 CO 0.05 -0.89 1.09 -0.76 0.41 0.00 0.00 173.24 173.14 1fn6 s LEU 123 N -3.06 2.76 0.22 2.44 1.43 -1.26 -1.32 118.68 119.89 1fn6 s LEU 123 Ca 0.64 1.40 -0.30 0.00 -1.03 0.00 0.00 54.13 54.84 1fn6 s LEU 123 Cb -0.27 -4.09 -0.08 0.00 0.03 0.00 0.00 46.19 41.77 1fn6 s LEU 123 CO 0.33 -1.81 1.06 -2.16 0.23 0.00 0.00 176.35 174.00 1fn6 s PRO 124 N -5.12 4.67 0.26 1.29 0.04 -1.26 -4.68 135.00 130.20 1fn6 s PRO 124 Ca 0.60 1.68 0.12 0.00 0.04 0.00 0.00 61.00 63.44 1fn6 s PRO 124 Cb -0.14 -3.26 0.27 0.00 0.04 0.00 0.00 34.50 31.41 1fn6 s PRO 124 CO 0.54 0.21 1.55 0.00 0.04 0.00 0.00 177.00 179.34 1fn6 h ARG 125 N 4.54 0.00 -3.30 4.56 -0.00 -1.95 -3.48 114.38 114.75 1fn6 h ARG 125 Ca -0.45 0.00 -0.09 0.00 -0.50 0.00 0.00 59.98 58.94 1fn6 h ARG 125 Cb 1.21 0.00 -0.02 0.00 0.00 0.00 0.00 29.97 31.16 1fn6 h ARG 125 CO 0.70 0.65 0.15 -1.54 0.00 0.00 0.00 179.97 179.93 1fn6 s SER 127 N -6.69 0.27 0.80 7.04 1.04 -1.26 -5.17 113.70 109.73 1fn6 s SER 127 Ca -0.00 -1.26 -0.12 0.00 0.48 0.00 0.00 55.95 55.05 1fn6 s SER 127 Cb 0.11 0.81 0.07 0.00 0.10 0.00 0.00 66.02 67.11 1fn6 s SER 127 CO 0.76 -1.60 1.13 0.00 0.98 0.00 0.00 173.24 174.50 1fn6 s ALA 129 N -3.35 4.00 0.44 0.00 0.00 -1.26 -5.07 121.76 116.53 1fn6 s ALA 129 Ca 0.61 -0.83 -0.24 0.00 0.00 0.00 0.00 51.96 51.50 1fn6 s ALA 129 Cb -0.13 -1.84 -0.08 0.00 0.00 0.00 0.00 23.12 21.08 1fn6 s ALA 129 CO 0.52 0.82 1.18 0.00 0.00 0.00 0.00 175.76 178.28 1fn6 s ALA 130 N -1.50 3.03 0.24 0.00 0.00 -1.26 -5.00 121.76 117.27 1fn6 s ALA 130 Ca 0.34 0.97 -0.30 0.00 0.00 0.00 0.00 51.96 52.97 1fn6 s ALA 130 Cb -0.13 -3.39 -0.14 0.00 0.00 0.00 0.00 23.12 19.45 1fn6 s ALA 130 CO 0.27 -0.65 1.13 0.00 0.00 0.00 0.00 175.76 176.51 1fn6 n ALA 132 N -0.34 -0.19 -0.14 0.00 0.00 -1.26 -2.40 120.51 116.17 1fn6 n ALA 132 Ca 0.06 0.42 0.00 0.00 0.00 0.00 0.00 53.44 53.92 1fn6 n ALA 132 Cb 0.47 -2.07 0.00 0.00 0.00 0.00 0.00 19.45 17.86 1fn6 n ALA 132 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1fn6 n GLY 133 N 1.65 1.15 3.71 0.00 0.00 0.63 -4.98 105.19 107.36 1fn6 n GLY 133 Ca 0.12 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.72 1fn6 n GLY 133 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1fn6 s THR 134 N -2.59 3.00 0.22 2.61 2.01 -1.01 -4.61 115.64 115.26 1fn6 s THR 134 Ca 0.00 0.70 -0.30 0.00 0.31 0.00 0.00 61.69 62.40 1fn6 s THR 134 Cb 0.00 -3.45 -0.08 0.00 0.01 0.00 0.00 72.50 68.98 1fn6 s THR 134 CO 0.00 0.05 0.94 -0.70 -0.69 0.00 0.00 174.62 174.23 1fn6 s GLU 135 N 1.22 4.83 0.28 4.92 2.12 -1.26 -0.73 118.70 130.08 1fn6 s GLU 135 Ca 0.67 1.48 0.02 0.00 0.36 0.00 0.00 54.97 57.51 1fn6 s GLU 135 Cb -0.40 -3.30 -0.05 0.00 0.26 0.00 0.00 34.13 30.64 1fn6 s GLU 135 CO 0.31 0.46 0.10 0.00 -0.54 0.00 0.00 175.26 175.59 1fn6 s LEU 137 N -3.36 2.57 -0.03 0.00 2.96 0.32 -1.34 118.68 119.80 1fn6 s LEU 137 Ca 0.37 -0.38 0.05 0.00 -0.22 0.00 0.00 54.13 53.95 1fn6 s LEU 137 Cb 0.08 -1.56 -0.03 0.00 0.50 0.00 0.00 46.19 45.18 1fn6 s LEU 137 CO 0.14 0.16 -0.18 -0.63 -1.32 0.00 0.00 176.35 174.53 1fn6 s ILE 138 N 0.35 2.77 0.00 6.68 1.01 0.90 -1.70 121.20 131.20 1fn6 s ILE 138 Ca -0.13 -0.90 -0.05 0.00 0.00 0.00 0.00 60.65 59.58 1fn6 s ILE 138 Cb -0.16 -2.07 -0.00 0.00 0.01 0.00 0.00 42.46 40.23 1fn6 s ILE 138 CO 0.06 0.54 0.08 -0.94 0.00 0.00 0.00 174.94 174.69 1fn6 s SER 139 N -0.83 0.08 0.00 3.58 1.04 -1.24 -1.06 113.70 115.27 1fn6 s SER 139 Ca 0.12 -0.26 0.00 0.00 0.48 0.00 0.00 55.95 56.29 1fn6 s SER 139 Cb -0.10 0.17 0.00 0.00 0.10 0.00 0.00 66.02 66.19 1fn6 s SER 139 CO 0.01 -0.32 0.00 0.61 0.98 0.00 0.00 173.24 174.52 1fn6 n GLY 140 N 1.64 -0.15 1.58 7.32 0.00 -0.68 -4.40 105.19 110.51 1fn6 n GLY 140 Ca -0.22 -1.11 -0.13 0.00 0.00 0.00 0.00 46.02 44.57 1fn6 n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1fn6 n TRP 141 N -0.55 1.86 -1.45 1.61 8.01 -1.26 -2.46 117.44 123.20 1fn6 n TRP 141 Ca 0.00 -1.78 -0.18 0.00 -1.31 0.00 0.00 57.50 54.22 1fn6 n TRP 141 Cb 0.00 -0.68 0.13 0.00 -2.01 0.00 0.00 31.31 28.76 1fn6 n TRP 141 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1fn6 n GLY 142 N -1.11 -1.57 3.74 6.99 0.00 -1.25 -4.37 105.19 107.62 1fn6 n GLY 142 Ca 0.43 -1.66 -0.41 0.00 0.00 0.00 0.00 46.02 44.39 1fn6 n GLY 142 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1fn6 n ASN 143 N -3.63 3.21 -0.34 1.61 2.85 -0.36 -3.12 115.26 115.47 1fn6 n ASN 143 Ca 0.10 1.16 0.07 0.00 -0.11 0.00 0.00 54.58 55.80 1fn6 n ASN 143 Cb 0.36 -1.57 0.00 0.00 1.24 0.00 0.00 39.78 39.81 1fn6 n ASN 143 CO 0.00 0.00 0.00 0.35 -2.11 0.00 0.00 177.26 175.50 1fn6 n THR 144 N 0.03 0.00 -4.76 -0.44 -2.24 -0.99 -0.83 114.28 105.05 1fn6 n THR 144 Ca 0.04 -0.36 -0.33 0.00 -2.27 0.00 0.00 64.05 61.13 1fn6 n THR 144 Cb 0.40 1.18 -0.15 0.00 -2.10 0.00 0.00 70.33 69.66 1fn6 n THR 144 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1fn6 s LYS 145 N -1.71 3.31 0.00 -0.78 1.02 -1.26 -4.34 119.74 115.98 1fn6 s LYS 145 Ca 0.12 -0.72 0.00 0.00 0.02 0.00 0.00 55.97 55.39 1fn6 s LYS 145 Cb 0.12 -2.60 0.00 0.00 -0.52 0.00 0.00 37.83 34.83 1fn6 s LYS 145 CO 0.35 0.16 0.77 0.43 -0.92 0.00 0.00 175.35 176.14 1fn6 n SER 146 N 3.67 0.00 -4.66 2.83 7.64 -1.26 -4.67 113.62 117.16 1fn6 n SER 146 Ca -0.18 0.77 -0.43 0.00 1.01 0.00 0.00 58.87 60.04 1fn6 n SER 146 Cb 0.52 -0.27 -0.02 0.00 -1.01 0.00 0.00 64.21 63.43 1fn6 n SER 146 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1fn6 s SER 147 N -2.19 6.88 0.41 6.43 0.01 -1.26 -4.79 113.70 119.18 1fn6 s SER 147 Ca 0.00 1.85 0.00 0.00 1.31 0.00 0.00 55.95 59.11 1fn6 s SER 147 Cb 0.00 -2.54 0.00 0.00 0.21 0.00 0.00 66.02 63.69 1fn6 s SER 147 CO 0.00 -0.79 0.00 0.61 0.41 0.00 0.00 173.24 173.47 1fn6 n GLY 148 N 3.73 -1.68 0.19 3.44 0.00 -1.26 -4.98 105.19 104.63 1fn6 n GLY 148 Ca 0.15 -1.25 -0.01 0.00 0.00 0.00 0.00 46.02 44.90 1fn6 n GLY 148 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1fn6 n SER 149 N -1.53 1.59 0.00 1.61 7.64 -1.26 -4.46 113.62 117.21 1fn6 n SER 149 Ca 0.00 -1.10 0.00 0.00 1.01 0.00 0.00 58.87 58.78 1fn6 n SER 149 Cb 0.10 0.01 0.00 0.00 -1.01 0.00 0.00 64.21 63.31 1fn6 n SER 149 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1fn6 n SER 150 N -1.49 0.00 -4.63 6.43 2.88 -1.26 -4.70 113.62 110.85 1fn6 n SER 150 Ca -0.01 0.00 -0.43 0.00 -1.33 0.00 0.00 58.87 57.11 1fn6 n SER 150 Cb 0.03 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.46 1fn6 n SER 150 CO 0.00 0.00 0.00 -0.31 -1.23 0.00 0.00 175.04 173.50 1fn6 s TYR 151 N 0.00 3.19 0.53 0.66 2.02 -1.26 -2.33 117.35 120.16 1fn6 s TYR 151 Ca 0.00 1.06 -0.19 0.00 -0.37 0.00 0.00 57.07 57.57 1fn6 s TYR 151 Cb 0.00 -3.47 -0.06 0.00 -0.40 0.00 0.00 41.96 38.03 1fn6 s TYR 151 CO 0.00 -0.66 1.10 -1.25 -1.57 0.00 0.00 175.55 173.16 1fn6 s PRO 152 N 3.34 3.46 0.06 -1.71 0.04 -1.26 -4.98 135.00 133.95 1fn6 s PRO 152 Ca 0.40 1.50 -0.16 0.00 0.04 0.00 0.00 61.00 62.78 1fn6 s PRO 152 Cb -0.13 -2.03 -0.21 0.00 0.04 0.00 0.00 34.50 32.17 1fn6 s PRO 152 CO 0.13 -0.74 1.20 0.77 0.04 0.00 0.00 177.00 178.41 1fn6 h SER 153 N 1.20 0.78 -2.82 6.66 0.02 -1.94 -3.47 113.55 113.98 1fn6 h SER 153 Ca -0.49 -0.70 -0.64 0.00 -0.84 0.00 0.00 61.79 59.12 1fn6 h SER 153 Cb 1.25 -0.24 -0.06 0.00 0.14 0.00 0.00 62.40 63.49 1fn6 h SER 153 CO 0.57 1.37 -0.44 -0.76 -1.14 0.00 0.00 176.83 176.43 1fn6 s LEU 154 N -8.33 4.38 0.21 5.07 1.43 -1.26 -1.55 118.68 118.63 1fn6 s LEU 154 Ca -0.11 0.47 -0.32 0.00 -1.03 0.00 0.00 54.13 53.14 1fn6 s LEU 154 Cb 0.06 -2.53 -0.11 0.00 0.03 0.00 0.00 46.19 43.63 1fn6 s LEU 154 CO 0.88 0.29 1.66 -0.22 0.23 0.00 0.00 176.35 179.18 1fn6 s LEU 155 N -1.68 4.37 0.13 1.79 2.96 -0.98 -4.89 118.68 120.38 1fn6 s LEU 155 Ca 0.25 2.81 0.04 0.00 -0.22 0.00 0.00 54.13 57.01 1fn6 s LEU 155 Cb -0.13 -3.60 -0.04 0.00 0.50 0.00 0.00 46.19 42.92 1fn6 s LEU 155 CO 0.15 -0.92 0.12 -1.10 -1.32 0.00 0.00 176.35 173.28 1fn6 s GLN 156 N 0.87 2.93 0.13 1.98 -1.52 -1.03 -0.62 119.66 122.40 1fn6 s GLN 156 Ca 0.71 -0.78 0.06 0.00 -1.95 0.00 0.00 55.36 53.40 1fn6 s GLN 156 Cb -0.48 -2.70 -0.04 0.00 -0.22 0.00 0.00 33.01 29.57 1fn6 s GLN 156 CO 0.35 0.52 -0.13 0.00 -0.25 0.00 0.00 175.29 175.77 1fn6 s LEU 158 N -2.68 -0.93 -0.06 0.00 2.96 -0.23 -1.30 118.68 116.45 1fn6 s LEU 158 Ca 0.12 1.17 -0.22 0.00 -0.22 0.00 0.00 54.13 54.98 1fn6 s LEU 158 Cb -0.03 1.81 -0.04 0.00 0.50 0.00 0.00 46.19 48.43 1fn6 s LEU 158 CO 0.03 -0.23 0.62 -0.54 -1.32 0.00 0.00 176.35 174.91 1fn6 s LYS 159 N 2.75 4.39 0.02 1.98 1.02 -1.26 -0.07 119.74 128.57 1fn6 s LYS 159 Ca -0.00 0.75 -0.22 0.00 0.02 0.00 0.00 55.97 56.52 1fn6 s LYS 159 Cb -0.13 -3.42 0.05 0.00 -0.52 0.00 0.00 37.83 33.81 1fn6 s LYS 159 CO -0.16 0.15 0.50 0.00 -0.92 0.00 0.00 175.35 174.91 1fn6 s ALA 160 N 0.54 -1.26 0.16 5.17 0.00 -0.45 -4.95 121.76 120.97 1fn6 s ALA 160 Ca 0.33 0.63 -0.12 0.00 0.00 0.00 0.00 51.96 52.80 1fn6 s ALA 160 Cb -0.17 0.26 -0.07 0.00 0.00 0.00 0.00 23.12 23.14 1fn6 s ALA 160 CO 0.16 -0.43 0.53 -1.25 0.00 0.00 0.00 175.76 174.76 1fn6 s PRO 161 N -2.06 3.90 0.07 0.00 0.04 -1.26 -0.54 135.00 135.15 1fn6 s PRO 161 Ca -0.08 0.38 -0.31 0.00 0.04 0.00 0.00 61.00 61.04 1fn6 s PRO 161 Cb -0.01 -2.87 -0.08 0.00 0.04 0.00 0.00 34.50 31.58 1fn6 s PRO 161 CO 0.01 0.45 1.71 0.08 0.04 0.00 0.00 177.00 179.29 1fn6 s VAL 162 N -1.55 2.99 0.34 -0.36 1.01 0.09 -1.60 120.40 121.32 1fn6 s VAL 162 Ca 0.40 0.39 -0.08 0.00 0.00 0.00 0.00 61.98 62.68 1fn6 s VAL 162 Cb -0.14 -3.25 -0.06 0.00 0.00 0.00 0.00 36.38 32.93 1fn6 s VAL 162 CO 0.20 -0.01 0.66 -0.76 0.00 0.00 0.00 175.10 175.19 1fn6 s LEU 163 N 2.93 3.97 0.95 3.92 1.43 0.15 -0.27 118.68 131.76 1fn6 s LEU 163 Ca 0.76 0.95 -0.11 0.00 -1.03 0.00 0.00 54.13 54.70 1fn6 s LEU 163 Cb -0.41 -3.78 0.16 0.00 0.03 0.00 0.00 46.19 42.19 1fn6 s LEU 163 CO 0.34 -0.27 1.09 -0.94 0.23 0.00 0.00 176.35 176.79 1fn6 s SER 164 N -3.04 2.83 0.14 2.29 1.04 -1.26 -4.61 113.70 111.09 1fn6 s SER 164 Ca 0.48 1.72 -0.20 0.00 0.48 0.00 0.00 55.95 58.43 1fn6 s SER 164 Cb -0.11 -2.34 0.01 0.00 0.10 0.00 0.00 66.02 63.68 1fn6 s SER 164 CO 0.29 -3.08 1.67 -1.13 0.98 0.00 0.00 173.24 171.97 1fn6 h ASN 165 N -1.85 -0.39 -0.43 7.02 -1.24 -1.97 -1.79 115.58 114.94 1fn6 h ASN 165 Ca -0.50 0.09 0.08 0.00 0.71 0.00 0.00 56.30 56.68 1fn6 h ASN 165 Cb 1.29 0.21 -0.07 0.00 0.73 0.00 0.00 38.32 40.48 1fn6 h ASN 165 CO 0.50 -0.15 0.02 0.77 -1.29 0.00 0.00 177.43 177.28 1fn6 h SER 166 N -0.09 -0.13 0.79 1.15 4.64 -1.98 0.12 113.55 118.05 1fn6 h SER 166 Ca 0.12 0.09 -0.11 0.00 -0.47 0.00 0.00 61.79 61.42 1fn6 h SER 166 Cb 0.28 0.16 -0.02 0.00 -0.31 0.00 0.00 62.40 62.51 1fn6 h SER 166 CO -0.29 -0.03 -0.55 0.28 -0.87 0.00 0.00 176.83 175.37 1fn6 h SER 167 N 0.13 0.00 0.06 4.97 0.02 -1.77 0.73 113.55 117.70 1fn6 h SER 167 Ca 0.21 0.00 -0.10 0.00 -0.84 0.00 0.00 61.79 61.06 1fn6 h SER 167 Cb 0.29 0.00 0.01 0.00 0.14 0.00 0.00 62.40 62.85 1fn6 h SER 167 CO -0.33 0.55 -0.43 0.00 -1.14 0.00 0.00 176.83 175.48 1fn6 h LYS 169 N -0.60 0.50 0.00 0.00 1.57 -0.57 -2.75 116.57 114.72 1fn6 h LYS 169 Ca -0.07 -0.23 -0.05 0.00 -1.87 0.00 0.00 60.65 58.43 1fn6 h LYS 169 Cb 1.30 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 33.60 1fn6 h LYS 169 CO 0.08 0.78 -0.24 0.66 -0.57 0.00 0.00 179.45 180.16 1fn6 h SER 170 N 0.42 0.00 0.52 0.86 4.64 -0.96 -2.78 113.55 116.25 1fn6 h SER 170 Ca 0.05 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.26 1fn6 h SER 170 Cb 0.81 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.88 1fn6 h SER 170 CO 0.07 0.24 -0.52 0.28 -0.87 0.00 0.00 176.83 176.02 1fn6 h SER 171 N 0.00 0.00 -2.03 4.97 0.02 -1.37 -3.39 113.55 111.76 1fn6 h SER 171 Ca -0.00 -0.00 -0.52 0.00 -0.84 0.00 0.00 61.79 60.43 1fn6 h SER 171 Cb 0.57 -0.00 -0.40 0.00 0.14 0.00 0.00 62.40 62.71 1fn6 h SER 171 CO 0.03 0.52 -1.10 -1.22 -1.14 0.00 0.00 176.83 173.93 1fn6 n TYR 172 N -3.92 0.47 -1.70 3.45 4.01 -1.06 -4.94 117.16 113.48 1fn6 n TYR 172 Ca -0.01 -3.77 -0.44 0.00 -0.16 0.00 0.00 57.90 53.52 1fn6 n TYR 172 Cb 0.53 -0.41 -0.03 0.00 -0.31 0.00 0.00 39.34 39.12 1fn6 n TYR 172 CO 0.00 0.00 0.00 -2.30 -0.46 0.00 0.00 176.86 174.10 1fn6 n PRO 173 N 0.63 2.44 -0.90 -0.72 -0.02 -1.14 -1.11 135.00 134.18 1fn6 n PRO 173 Ca 0.24 0.88 0.00 0.00 -2.02 0.00 0.00 63.50 62.60 1fn6 n PRO 173 Cb 0.58 -2.66 0.00 0.00 -0.02 0.00 0.00 33.50 31.40 1fn6 n PRO 173 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1fn6 n GLY 174 N 3.30 0.42 0.04 -1.23 0.00 -1.26 -4.87 105.19 101.59 1fn6 n GLY 174 Ca 0.15 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.19 1fn6 n GLY 174 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1fn6 n GLN 175 N -1.61 4.19 -3.48 1.61 6.02 -0.27 -4.97 117.38 118.88 1fn6 n GLN 175 Ca 0.00 -0.19 -0.39 0.00 -0.01 0.00 0.00 57.00 56.42 1fn6 n GLN 175 Cb 0.11 -0.79 -0.10 0.00 1.02 0.00 0.00 30.24 30.49 1fn6 n GLN 175 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 1fn6 s ILE 176 N -1.15 5.23 0.51 5.09 -1.09 -1.25 -5.04 121.20 123.51 1fn6 s ILE 176 Ca 0.02 0.38 0.09 0.00 -2.23 0.00 0.00 60.65 58.91 1fn6 s ILE 176 Cb 0.03 -3.63 0.06 0.00 -1.58 0.00 0.00 42.46 37.34 1fn6 s ILE 176 CO 0.14 0.19 0.70 0.42 -1.23 0.00 0.00 174.94 175.16 1fn6 s THR 177 N 1.93 2.48 -1.83 2.92 -4.23 -1.26 -4.97 115.64 110.67 1fn6 s THR 177 Ca 0.11 -1.01 0.14 0.00 -1.18 0.00 0.00 61.69 59.76 1fn6 s THR 177 Cb -0.16 -2.48 0.36 0.00 1.34 0.00 0.00 72.50 71.55 1fn6 s THR 177 CO 0.10 0.00 1.29 0.61 -0.54 0.00 0.00 174.62 176.09 1fn6 n GLY 178 N -2.08 -0.53 1.64 3.99 0.00 -1.26 -2.35 105.19 104.60 1fn6 n GLY 178 Ca 0.12 -0.08 -0.08 0.00 0.00 0.00 0.00 46.02 45.98 1fn6 n GLY 178 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1fn6 n ASN 179 N -1.08 3.64 -3.97 1.61 3.02 -1.26 -4.97 115.26 112.24 1fn6 n ASN 179 Ca 0.09 -3.48 -0.15 0.00 -0.03 0.00 0.00 54.58 51.01 1fn6 n ASN 179 Cb 0.07 -0.71 -0.14 0.00 -0.61 0.00 0.00 39.78 38.39 1fn6 n ASN 179 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 1fn6 s MET 180 N -3.14 0.43 0.11 3.52 -1.94 -0.99 -1.44 119.30 115.84 1fn6 s MET 180 Ca 0.50 -0.27 0.08 0.00 -1.71 0.00 0.00 55.69 54.29 1fn6 s MET 180 Cb 0.43 -0.38 -0.04 0.00 2.01 0.00 0.00 34.83 36.86 1fn6 s MET 180 CO 0.08 0.10 -0.19 0.96 -0.01 0.00 0.00 175.02 175.95 1fn6 s ILE 181 N -0.32 1.61 -0.15 2.53 -4.36 -0.43 -4.79 121.20 115.29 1fn6 s ILE 181 Ca 0.00 -1.56 -0.08 0.00 -0.26 0.00 0.00 60.65 58.74 1fn6 s ILE 181 Cb -0.03 -1.52 -0.04 0.00 1.25 0.00 0.00 42.46 42.12 1fn6 s ILE 181 CO -0.00 -0.14 0.14 0.00 0.24 0.00 0.00 174.94 175.18 1fn6 s VAL 183 N -0.49 0.48 -0.96 0.00 1.01 -1.02 -0.68 120.40 118.74 1fn6 s VAL 183 Ca 0.12 -0.07 0.00 0.00 0.00 0.00 0.00 61.98 62.03 1fn6 s VAL 183 Cb -0.12 -0.53 0.00 0.00 0.00 0.00 0.00 36.38 35.73 1fn6 s VAL 183 CO 0.02 0.22 0.00 0.61 0.00 0.00 0.00 175.10 175.95 1fn6 n GLY 184 N 4.20 0.45 2.87 4.51 0.00 -0.62 -3.75 105.19 112.86 1fn6 n GLY 184 Ca -0.23 -1.29 -0.15 0.00 0.00 0.00 0.00 46.02 44.35 1fn6 n GLY 184 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1fn6 s PHE 184 N -4.00 -0.12 0.04 1.61 0.08 -1.26 -4.34 117.98 109.99 1fn6 s PHE 184 Ca 0.00 0.43 0.30 0.00 0.12 0.00 0.00 56.93 57.78 1fn6 s PHE 184 Cb 0.00 -0.16 1.13 0.00 -0.57 0.00 0.00 43.02 43.42 1fn6 s PHE 184 CO 0.00 -0.17 1.90 -0.07 -0.10 0.00 0.00 175.22 176.78 1fn6 h LEU 185 N 7.49 0.00 0.00 -0.37 3.38 -1.96 -2.23 115.31 121.62 1fn6 h LEU 185 Ca -0.38 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.59 1fn6 h LEU 185 Cb 1.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.88 1fn6 h LEU 185 CO 0.38 0.06 0.00 0.00 0.09 0.00 0.00 178.44 178.96 1fn6 n GLN 186 N -3.16 0.07 -0.43 1.13 3.00 -1.26 0.40 117.38 117.13 1fn6 n GLN 186 Ca 0.01 0.13 0.06 0.00 -0.01 0.00 0.00 57.00 57.18 1fn6 n GLN 186 Cb 0.37 -1.50 -0.02 0.00 0.00 0.00 0.00 30.24 29.09 1fn6 n GLN 186 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1fn6 n GLY 187 N 0.63 -1.69 1.54 1.08 0.00 -0.84 -4.41 105.19 101.51 1fn6 n GLY 187 Ca 0.06 -1.41 0.00 0.00 0.00 0.00 0.00 46.02 44.67 1fn6 n GLY 187 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1fn6 n GLY 188 N -2.32 2.62 2.88 -0.02 0.00 0.35 -4.93 105.19 103.78 1fn6 n GLY 188 Ca -0.00 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.74 1fn6 n GLY 188 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1fn6 s LYS 188 N -0.58 1.40 0.12 1.61 1.02 -1.26 -3.87 119.74 118.18 1fn6 s LYS 188 Ca 0.00 -0.44 -0.25 0.00 0.02 0.00 0.00 55.97 55.31 1fn6 s LYS 188 Cb 0.00 -1.89 0.08 0.00 -0.52 0.00 0.00 37.83 35.51 1fn6 s LYS 188 CO 0.00 -0.40 1.10 0.34 -0.92 0.00 0.00 175.35 175.47 1fn6 s ASP 189 N 1.67 -0.03 0.56 2.83 2.15 -0.96 -4.39 116.67 118.49 1fn6 s ASP 189 Ca 0.02 -0.48 -0.01 0.00 0.43 0.00 0.00 52.55 52.51 1fn6 s ASP 189 Cb -0.15 0.39 0.03 0.00 -0.30 0.00 0.00 42.92 42.90 1fn6 s ASP 189 CO -0.08 -0.77 0.80 -0.94 -0.17 0.00 0.00 175.17 174.01 1fn6 s SER 190 N -3.36 5.33 0.36 -0.34 1.04 -1.26 -0.51 113.70 114.97 1fn6 s SER 190 Ca 0.21 0.16 -0.06 0.00 0.48 0.00 0.00 55.95 56.74 1fn6 s SER 190 Cb -0.01 -1.09 0.02 0.00 0.10 0.00 0.00 66.02 65.05 1fn6 s SER 190 CO 0.03 -1.12 0.58 0.00 0.98 0.00 0.00 173.24 173.71 1fn6 n GLN 192 N -0.56 0.73 0.00 0.00 3.00 -1.26 -1.24 117.38 118.05 1fn6 n GLN 192 Ca -0.02 0.26 0.00 0.00 -0.01 0.00 0.00 57.00 57.23 1fn6 n GLN 192 Cb 0.59 -1.59 0.00 0.00 0.00 0.00 0.00 30.24 29.23 1fn6 n GLN 192 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1fn6 n GLY 193 N 1.78 2.94 0.07 1.08 0.00 -1.26 -1.22 105.19 108.57 1fn6 n GLY 193 Ca 0.15 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.30 1fn6 n GLY 193 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1fn6 n ASP 194 N 0.25 0.72 -4.63 1.61 8.00 -0.37 -3.83 116.55 118.30 1fn6 n ASP 194 Ca 0.00 0.22 -0.44 0.00 0.71 0.00 0.00 54.79 55.29 1fn6 n ASP 194 Cb 0.00 -0.07 -0.01 0.00 -0.02 0.00 0.00 41.12 41.02 1fn6 n ASP 194 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1fn6 n SER 195 N -2.13 1.80 0.00 -2.24 7.64 -1.25 -1.85 113.62 115.58 1fn6 n SER 195 Ca 0.04 1.18 0.00 0.00 1.01 0.00 0.00 58.87 61.10 1fn6 n SER 195 Cb 0.43 -1.36 0.00 0.00 -1.01 0.00 0.00 64.21 62.27 1fn6 n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1fn6 n GLY 196 N 1.06 3.30 3.96 0.23 0.00 -0.47 -0.95 105.19 112.32 1fn6 n GLY 196 Ca 0.08 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.82 1fn6 n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1fn6 s GLY 197 N -2.71 1.78 0.10 -0.02 0.00 -0.77 -3.41 107.32 102.29 1fn6 s GLY 197 Ca 0.00 -1.43 -0.11 0.00 0.00 0.00 0.00 44.72 43.18 1fn6 s GLY 197 CO 0.00 -0.72 0.45 2.56 0.00 0.00 0.00 173.10 175.39 1fn6 s PRO 198 N -5.63 3.82 -0.29 2.90 0.04 -1.26 -1.55 135.00 133.03 1fn6 s PRO 198 Ca 0.72 0.27 0.01 0.00 0.04 0.00 0.00 61.00 62.04 1fn6 s PRO 198 Cb -0.04 -2.97 0.06 0.00 0.04 0.00 0.00 34.50 31.60 1fn6 s PRO 198 CO 0.50 0.53 -0.05 0.08 0.04 0.00 0.00 177.00 178.10 1fn6 s VAL 199 N -1.43 2.49 -0.16 -0.36 1.01 -0.79 -3.70 120.40 117.46 1fn6 s VAL 199 Ca 0.35 -1.64 -0.04 0.00 0.00 0.00 0.00 61.98 60.65 1fn6 s VAL 199 Cb -0.14 -2.50 -0.03 0.00 0.00 0.00 0.00 36.38 33.72 1fn6 s VAL 199 CO 0.19 -0.13 -0.04 -0.69 0.00 0.00 0.00 175.10 174.42 1fn6 s VAL 200 N 1.13 3.85 -0.04 2.92 1.01 -0.69 -0.95 120.40 127.62 1fn6 s VAL 200 Ca -0.05 -0.37 0.02 0.00 0.00 0.00 0.00 61.98 61.57 1fn6 s VAL 200 Cb -0.20 -2.69 0.01 0.00 0.00 0.00 0.00 36.38 33.51 1fn6 s VAL 200 CO -0.04 0.49 -0.08 0.00 0.00 0.00 0.00 175.10 175.47 1fn6 n ASN 202 N 3.78 -0.71 0.00 0.00 3.02 -1.26 -1.36 115.26 118.73 1fn6 n ASN 202 Ca -0.23 -1.18 0.00 0.00 -0.03 0.00 0.00 54.58 53.14 1fn6 n ASN 202 Cb 0.52 -2.04 0.00 0.00 -0.61 0.00 0.00 39.78 37.65 1fn6 n ASN 202 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1fn6 n GLY 203 N -1.88 0.76 3.10 7.41 0.00 -1.26 -5.02 105.19 108.30 1fn6 n GLY 203 Ca -0.14 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.68 1fn6 n GLY 203 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1fn6 s GLN 204 N -0.31 0.97 -0.39 1.61 -0.21 -0.46 -4.04 119.66 116.83 1fn6 s GLN 204 Ca 0.00 -0.55 -0.29 0.00 0.02 0.00 0.00 55.36 54.54 1fn6 s GLN 204 Cb 0.00 -0.95 0.02 0.00 1.00 0.00 0.00 33.01 33.08 1fn6 s GLN 204 CO 0.00 0.25 1.18 -1.17 -2.12 0.00 0.00 175.29 173.43 1fn6 s LEU 209 N -0.59 3.77 -0.01 2.90 2.96 -0.44 -0.50 118.68 126.78 1fn6 s LEU 209 Ca 0.03 0.84 0.06 0.00 -0.22 0.00 0.00 54.13 54.84 1fn6 s LEU 209 Cb -0.06 -3.54 -0.08 0.00 0.50 0.00 0.00 46.19 43.00 1fn6 s LEU 209 CO 0.00 -1.12 0.15 0.00 -1.32 0.00 0.00 176.35 174.06 1fn6 n GLN 210 N 7.45 1.36 -4.11 1.98 1.13 -0.13 -4.00 117.38 121.06 1fn6 n GLN 210 Ca 0.13 -0.04 -0.11 0.00 -1.94 0.00 0.00 57.00 55.04 1fn6 n GLN 210 Cb 0.48 -1.05 -0.11 0.00 0.11 0.00 0.00 30.24 29.67 1fn6 n GLN 210 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 1fn6 s GLY 211 N -2.40 0.61 -0.07 1.08 0.00 -1.07 -1.43 107.32 104.05 1fn6 s GLY 211 Ca -0.01 -1.07 0.04 0.00 0.00 0.00 0.00 44.72 43.68 1fn6 s GLY 211 CO 0.24 -1.15 -0.17 -0.42 0.00 0.00 0.00 173.10 171.59 1fn6 s ILE 212 N -2.65 2.74 0.08 0.90 1.01 -0.96 -1.88 121.20 120.45 1fn6 s ILE 212 Ca 0.01 -0.82 -0.31 0.00 0.00 0.00 0.00 60.65 59.53 1fn6 s ILE 212 Cb -0.01 -2.07 -0.10 0.00 0.01 0.00 0.00 42.46 40.29 1fn6 s ILE 212 CO -0.03 0.57 1.91 0.52 0.00 0.00 0.00 174.94 177.91 1fn6 n VAL 213 N 2.73 0.56 0.02 2.92 0.31 -0.60 -1.75 118.33 122.52 1fn6 n VAL 213 Ca -0.17 -0.10 0.00 0.00 -0.01 0.00 0.00 64.34 64.06 1fn6 n VAL 213 Cb 0.52 -2.21 0.00 0.00 -0.91 0.00 0.00 33.84 31.24 1fn6 n VAL 213 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1fn6 n SER 214 N 6.54 0.19 -2.39 4.52 2.88 -1.13 -1.36 113.62 122.86 1fn6 n SER 214 Ca 0.19 0.06 -0.08 0.00 -1.33 0.00 0.00 58.87 57.71 1fn6 n SER 214 Cb 0.39 -0.03 0.01 0.00 -0.75 0.00 0.00 64.21 63.82 1fn6 n SER 214 CO 0.00 0.00 0.00 -2.67 -1.23 0.00 0.00 175.04 171.14 1fn6 n TRP 215 N -2.74 -1.78 0.00 0.66 4.27 -0.79 -4.97 117.44 112.09 1fn6 n TRP 215 Ca 0.00 -1.52 0.00 0.00 -3.89 0.00 0.00 57.50 52.09 1fn6 n TRP 215 Cb 0.00 0.61 0.00 0.00 -1.36 0.00 0.00 31.31 30.56 1fn6 n TRP 215 CO 0.00 0.00 0.00 0.41 -2.29 0.00 0.00 177.69 175.81 1fn6 n GLY 216 N -0.41 1.00 3.25 -1.67 0.00 -1.26 -1.20 105.19 104.90 1fn6 n GLY 216 Ca -0.04 -0.92 -0.43 0.00 0.00 0.00 0.00 46.02 44.62 1fn6 n GLY 216 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1fn6 s TYR 217 N -2.00 3.38 0.00 1.61 6.14 -1.26 -4.98 117.35 120.24 1fn6 s TYR 217 Ca 0.00 -1.68 0.00 0.00 0.64 0.00 0.00 57.07 56.03 1fn6 s TYR 217 Cb 0.00 -3.62 0.00 0.00 0.42 0.00 0.00 41.96 38.76 1fn6 s TYR 217 CO 0.00 -1.00 0.00 0.41 0.64 0.00 0.00 175.55 175.60 1fn6 n GLY 219 N 4.96 -0.61 2.83 8.97 0.00 -1.26 -4.65 105.19 115.43 1fn6 n GLY 219 Ca -0.09 -1.12 -0.18 0.00 0.00 0.00 0.00 46.02 44.63 1fn6 n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fn6 n ALA 221 N 4.18 -0.08 -1.84 0.00 0.00 -1.26 -4.76 120.51 116.75 1fn6 n ALA 221 Ca -0.25 0.09 -0.41 0.00 0.00 0.00 0.00 53.44 52.87 1fn6 n ALA 221 Cb 0.50 -0.92 -0.02 0.00 0.00 0.00 0.00 19.45 19.02 1fn6 n ALA 221 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.50 178.64 1fn6 s GLN 221 N -2.04 4.29 0.13 0.00 -2.07 -1.26 -0.50 119.66 118.21 1fn6 s GLN 221 Ca 0.00 2.28 -0.34 0.00 -1.82 0.00 0.00 55.36 55.48 1fn6 s GLN 221 Cb 0.00 -3.09 -0.16 0.00 -1.09 0.00 0.00 33.01 28.67 1fn6 s GLN 221 CO 0.00 -0.35 1.17 1.17 -1.32 0.00 0.00 175.29 175.97 1fn6 n LYS 222 N 1.71 0.98 -1.37 9.60 3.00 -1.26 -2.14 118.16 128.68 1fn6 n LYS 222 Ca 0.04 0.35 -0.13 0.00 -0.00 0.00 0.00 58.31 58.57 1fn6 n LYS 222 Cb 0.41 -1.87 -0.06 0.00 0.00 0.00 0.00 35.03 33.52 1fn6 n LYS 222 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 1fn6 n ASN 223 N 2.10 -5.31 -3.33 3.14 3.02 0.16 -4.90 115.26 110.15 1fn6 n ASN 223 Ca 0.17 0.32 -0.26 0.00 -0.03 0.00 0.00 54.58 54.78 1fn6 n ASN 223 Cb 0.21 -3.94 -0.09 0.00 -0.61 0.00 0.00 39.78 35.36 1fn6 n ASN 223 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1fn6 n LYS 224 N -1.62 0.62 -0.87 3.52 4.76 -0.91 -4.75 118.16 118.91 1fn6 n LYS 224 Ca -0.13 -3.34 -0.30 0.00 -2.87 0.00 0.00 58.31 51.67 1fn6 n LYS 224 Cb 0.55 -1.53 0.16 0.00 -1.84 0.00 0.00 35.03 32.36 1fn6 n LYS 224 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 1fn6 s PRO 225 N -0.69 1.09 0.49 1.97 0.04 -1.26 -4.45 135.00 132.18 1fn6 s PRO 225 Ca 0.34 1.28 -0.23 0.00 0.04 0.00 0.00 61.00 62.43 1fn6 s PRO 225 Cb 0.10 -1.75 -0.07 0.00 0.04 0.00 0.00 34.50 32.82 1fn6 s PRO 225 CO -0.15 -2.49 1.30 0.20 0.04 0.00 0.00 177.00 175.90 1fn6 s GLY 226 N -2.92 2.87 -0.08 0.56 0.00 -1.25 -4.72 107.32 101.78 1fn6 s GLY 226 Ca 0.65 1.22 -0.01 0.00 0.00 0.00 0.00 44.72 46.58 1fn6 s GLY 226 CO 0.58 1.74 -0.02 0.14 0.00 0.00 0.00 173.10 175.55 1fn6 s VAL 227 N -1.35 4.16 0.04 1.40 1.01 -0.34 -2.43 120.40 122.90 1fn6 s VAL 227 Ca 0.66 -0.30 0.04 0.00 0.00 0.00 0.00 61.98 62.37 1fn6 s VAL 227 Cb -0.37 -2.74 -0.02 0.00 0.00 0.00 0.00 36.38 33.25 1fn6 s VAL 227 CO 0.45 0.60 -0.11 -0.31 0.00 0.00 0.00 175.10 175.74 1fn6 s TYR 228 N -0.82 0.93 0.20 5.22 1.51 0.19 -1.89 117.35 122.69 1fn6 s TYR 228 Ca 0.12 -0.39 -0.30 0.00 -1.01 0.00 0.00 57.07 55.49 1fn6 s TYR 228 Cb -0.11 -0.55 -0.08 0.00 -0.11 0.00 0.00 41.96 41.10 1fn6 s TYR 228 CO 0.02 -0.01 1.22 0.99 -1.11 0.00 0.00 175.55 176.66 1fn6 s THR 229 N -1.03 3.44 -0.96 -0.71 2.01 -0.71 -1.32 115.64 116.36 1fn6 s THR 229 Ca -0.03 1.23 -0.22 0.00 0.31 0.00 0.00 61.69 62.98 1fn6 s THR 229 Cb -0.08 -3.78 0.08 0.00 0.01 0.00 0.00 72.50 68.72 1fn6 s THR 229 CO 0.01 0.21 1.31 -0.75 -0.69 0.00 0.00 174.62 174.71 1fn6 s LYS 230 N -0.38 3.55 0.52 4.92 2.20 -0.52 -2.27 119.74 127.76 1fn6 s LYS 230 Ca 0.53 -1.27 0.19 0.00 -0.36 0.00 0.00 55.97 55.06 1fn6 s LYS 230 Cb -0.34 -5.09 1.34 0.00 -1.51 0.00 0.00 37.83 32.23 1fn6 s LYS 230 CO 0.38 -2.04 2.13 0.28 -0.36 0.00 0.00 175.35 175.74 1fn6 h VAL 231 N 6.39 0.91 0.00 4.02 2.07 -1.54 -2.51 116.25 125.59 1fn6 h VAL 231 Ca 0.14 -0.16 0.00 0.00 0.82 0.00 0.00 66.70 67.49 1fn6 h VAL 231 Cb 1.02 1.09 0.00 0.00 -1.52 0.00 0.00 31.29 31.88 1fn6 h VAL 231 CO 1.30 0.04 0.00 0.00 0.02 0.00 0.00 177.57 178.94 1fn6 n ASN 233 N -1.61 0.13 -0.31 0.00 3.02 -0.95 -4.37 115.26 111.18 1fn6 n ASN 233 Ca 0.02 0.27 0.03 0.00 -0.03 0.00 0.00 54.58 54.87 1fn6 n ASN 233 Cb 0.12 -0.30 0.07 0.00 -0.61 0.00 0.00 39.78 39.06 1fn6 n ASN 233 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1fn6 n TYR 234 N -1.48 0.22 -0.22 3.10 4.01 0.10 -4.75 117.16 118.14 1fn6 n TYR 234 Ca 0.07 -0.48 -0.08 0.00 -0.16 0.00 0.00 57.90 57.24 1fn6 n TYR 234 Cb 0.33 -0.04 0.03 0.00 -0.31 0.00 0.00 39.34 39.36 1fn6 n TYR 234 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 1fn6 h VAL 235 N 0.98 1.26 -0.61 -0.72 2.07 -1.76 -1.21 116.25 116.26 1fn6 h VAL 235 Ca 0.00 -1.04 0.00 0.00 0.82 0.00 0.00 66.70 66.48 1fn6 h VAL 235 Cb 0.60 0.70 -0.03 0.00 -1.52 0.00 0.00 31.29 31.04 1fn6 h VAL 235 CO 0.00 0.39 0.40 0.78 0.02 0.00 0.00 177.57 179.15 1fn6 h ASN 236 N 0.97 0.71 -0.30 0.57 -0.26 -1.93 -1.67 115.58 113.67 1fn6 h ASN 236 Ca 0.19 -0.03 -0.10 0.00 -0.56 0.00 0.00 56.30 55.80 1fn6 h ASN 236 Cb 0.46 -0.18 -0.02 0.00 -1.06 0.00 0.00 38.32 37.52 1fn6 h ASN 236 CO 0.02 0.52 -0.16 -0.25 -1.06 0.00 0.00 177.43 176.50 1fn6 h TRP 237 N 0.83 0.83 -0.25 1.19 7.01 -1.77 -1.51 115.95 122.28 1fn6 h TRP 237 Ca 0.22 -0.17 -0.04 0.00 2.11 0.00 0.00 58.89 61.02 1fn6 h TRP 237 Cb -0.08 -0.21 -0.01 0.00 -2.10 0.00 0.00 29.16 26.76 1fn6 h TRP 237 CO -0.03 0.86 0.02 0.82 -2.79 0.00 0.00 178.44 177.32 1fn6 h ILE 238 N 0.67 1.24 -0.27 2.65 2.04 -1.02 -0.78 117.51 122.04 1fn6 h ILE 238 Ca 0.11 -0.85 -0.03 0.00 1.00 0.00 0.00 64.86 65.09 1fn6 h ILE 238 Cb 0.64 1.31 -0.01 0.00 -0.74 0.00 0.00 36.82 38.02 1fn6 h ILE 238 CO 0.05 0.27 0.05 -0.61 0.00 0.00 0.00 178.15 177.90 1fn6 h GLN 239 N 0.23 0.45 -0.81 2.37 5.75 -1.15 -1.56 115.11 120.38 1fn6 h GLN 239 Ca 0.07 -0.12 -0.02 0.00 -0.15 0.00 0.00 58.65 58.44 1fn6 h GLN 239 Cb 0.38 -0.05 -0.04 0.00 1.07 0.00 0.00 27.48 28.84 1fn6 h GLN 239 CO 0.01 0.57 0.45 1.96 -2.65 0.00 0.00 178.83 179.16 1fn6 h GLN 240 N 0.27 1.13 -0.35 1.69 4.20 -1.25 -0.53 115.11 120.28 1fn6 h GLN 240 Ca 0.08 -0.13 -0.11 0.00 0.06 0.00 0.00 58.65 58.55 1fn6 h GLN 240 Cb 0.33 -0.22 -0.01 0.00 0.30 0.00 0.00 27.48 27.88 1fn6 h GLN 240 CO 0.00 0.83 -0.22 1.15 -0.67 0.00 0.00 178.83 179.93 1fn6 h THR 241 N 1.13 1.29 -0.76 -0.54 2.02 -0.98 -2.22 112.91 112.85 1fn6 h THR 241 Ca 0.29 -1.36 0.04 0.00 0.77 0.00 0.00 66.41 66.14 1fn6 h THR 241 Cb 0.03 1.41 -0.05 0.00 -1.74 0.00 0.00 68.15 67.80 1fn6 h THR 241 CO -0.05 0.45 0.48 0.40 0.37 0.00 0.00 175.52 177.17 1fn6 h ILE 242 N 0.54 1.09 -0.36 3.11 2.04 -1.11 -2.90 117.51 119.93 1fn6 h ILE 242 Ca 0.07 -0.32 -0.08 0.00 1.00 0.00 0.00 64.86 65.53 1fn6 h ILE 242 Cb 0.78 0.09 -0.02 0.00 -0.74 0.00 0.00 36.82 36.93 1fn6 h ILE 242 CO 0.06 0.17 -0.12 0.00 0.00 0.00 0.00 178.15 178.26 1fn6 h ALA 243 N 1.33 1.12 -0.03 1.87 0.00 -0.98 -2.96 119.26 119.61 1fn6 h ALA 243 Ca 0.31 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1fn6 h ALA 243 Cb 0.04 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.68 1fn6 h ALA 243 CO -0.12 0.55 0.00 0.00 0.00 0.00 0.00 179.25 179.68 1fn6 n ALA 244 N -2.48 2.62 -0.78 0.00 0.00 -0.85 -5.10 120.51 113.92 1fn6 n ALA 244 Ca 0.01 -0.29 0.00 0.00 0.00 0.00 0.00 53.44 53.16 1fn6 n ALA 244 Cb 0.35 -1.31 0.00 0.00 0.00 0.00 0.00 19.45 18.48 1fn6 n ALA 244 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59