#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1f5l s ILE 17 N 0.00 4.76 0.00 1.39 -1.09 0.70 -4.15 121.20 122.81 1f5l s ILE 17 Ca 0.00 1.80 0.00 0.00 -2.23 0.00 0.00 60.65 60.22 1f5l s ILE 17 Cb 0.00 -4.20 0.00 0.00 -1.58 0.00 0.00 42.46 36.68 1f5l s ILE 17 CO 0.00 0.29 0.00 0.61 -1.23 0.00 0.00 174.94 174.61 1f5l n GLY 18 N 2.58 0.45 7.00 6.18 0.00 -1.26 -2.59 105.19 117.55 1f5l n GLY 18 Ca 0.01 -0.81 0.00 0.00 0.00 0.00 0.00 46.02 45.22 1f5l n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1f5l n GLY 19 N 0.00 -0.45 3.14 -0.02 0.00 -1.26 -4.89 105.19 101.70 1f5l n GLY 19 Ca 0.00 -1.10 -0.10 0.00 0.00 0.00 0.00 46.02 44.82 1f5l n GLY 19 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1f5l s GLU 20 N 0.00 0.75 0.33 1.61 2.02 -0.41 -4.98 118.70 118.01 1f5l s GLU 20 Ca 0.00 -1.23 -0.27 0.00 0.02 0.00 0.00 54.97 53.49 1f5l s GLU 20 Cb 0.00 -0.14 -0.09 0.00 0.10 0.00 0.00 34.13 34.00 1f5l s GLU 20 CO 0.00 -0.03 1.01 -0.06 0.02 0.00 0.00 175.26 176.21 1f5l s PHE 21 N -3.36 3.57 0.29 1.61 0.40 -1.26 -1.31 117.98 117.91 1f5l s PHE 21 Ca 0.08 1.74 0.06 0.00 -0.60 0.00 0.00 56.93 58.21 1f5l s PHE 21 Cb 0.04 -3.07 -0.02 0.00 0.51 0.00 0.00 43.02 40.47 1f5l s PHE 21 CO -0.05 -0.19 0.26 -2.37 0.70 0.00 0.00 175.22 173.56 1f5l n THR 22 N 0.60 0.00 -4.44 0.64 5.66 -0.53 -4.89 114.28 111.32 1f5l n THR 22 Ca 0.02 -2.04 -0.22 0.00 -3.05 0.00 0.00 64.05 58.76 1f5l n THR 22 Cb 0.48 1.03 -0.10 0.00 -1.55 0.00 0.00 70.33 70.20 1f5l n THR 22 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 1f5l s THR 23 N -3.13 2.24 0.59 1.09 -4.23 -1.26 -4.35 115.64 106.58 1f5l s THR 23 Ca 0.33 -2.34 0.32 0.00 -1.18 0.00 0.00 61.69 58.83 1f5l s THR 23 Cb 0.01 -2.25 0.37 0.00 1.34 0.00 0.00 72.50 71.97 1f5l s THR 23 CO 0.24 -0.44 2.26 -0.29 -0.54 0.00 0.00 174.62 175.84 1f5l h ILE 24 N 2.34 0.44 0.00 2.99 6.09 -1.89 -1.25 117.51 126.23 1f5l h ILE 24 Ca -0.40 -0.05 -0.01 0.00 -1.37 0.00 0.00 64.86 63.03 1f5l h ILE 24 Cb 1.25 1.03 -0.00 0.00 0.47 0.00 0.00 36.82 39.57 1f5l h ILE 24 CO 0.61 0.01 -0.05 -0.33 -3.07 0.00 0.00 178.15 175.32 1f5l h GLU 25 N 0.00 0.00 0.00 2.19 3.07 -1.87 -0.09 114.58 117.88 1f5l h GLU 25 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1f5l h GLU 25 Cb 0.03 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.94 1f5l h GLU 25 CO 0.00 0.05 -0.60 0.09 -1.40 0.00 0.00 179.01 177.16 1f5l n ASN 26 N -3.96 0.59 -3.01 1.42 3.02 -0.47 -4.31 115.26 108.54 1f5l n ASN 26 Ca -0.03 -0.07 -0.15 0.00 -0.03 0.00 0.00 54.58 54.31 1f5l n ASN 26 Cb 0.14 0.25 -0.01 0.00 -0.61 0.00 0.00 39.78 39.56 1f5l n ASN 26 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1f5l n GLN 27 N -1.81 1.03 0.30 3.52 1.13 -0.21 -4.99 117.38 116.34 1f5l n GLN 27 Ca 0.04 -3.31 0.16 0.00 -1.94 0.00 0.00 57.00 51.95 1f5l n GLN 27 Cb 0.39 -1.54 0.80 0.00 0.11 0.00 0.00 30.24 30.01 1f5l n GLN 27 CO 0.00 0.00 0.00 -1.00 -1.44 0.00 0.00 177.06 174.62 1f5l h PRO 28 N 2.99 0.00 -0.00 -1.09 0.13 -1.30 -0.64 132.00 132.09 1f5l h PRO 28 Ca 0.03 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.16 1f5l h PRO 28 Cb 1.04 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.17 1f5l h PRO 28 CO 0.49 0.00 -0.24 -2.67 -0.23 0.00 0.00 178.00 175.35 1f5l n TRP 29 N -3.00 0.00 -2.26 1.56 2.14 -1.16 -1.65 117.44 113.08 1f5l n TRP 29 Ca -0.01 0.00 -0.42 0.00 2.07 0.00 0.00 57.50 59.14 1f5l n TRP 29 Cb 0.42 -0.19 -0.03 0.00 -0.81 0.00 0.00 31.31 30.70 1f5l n TRP 29 CO 0.00 0.00 0.00 0.12 2.07 0.00 0.00 177.69 179.88 1f5l s PHE 30 N -2.62 3.10 -0.13 -2.67 2.19 -0.25 -1.21 117.98 116.39 1f5l s PHE 30 Ca 0.22 0.97 -0.00 0.00 0.33 0.00 0.00 56.93 58.45 1f5l s PHE 30 Cb 0.19 -3.61 -0.01 0.00 -1.31 0.00 0.00 43.02 38.28 1f5l s PHE 30 CO 0.54 -2.15 -0.13 0.00 1.83 0.00 0.00 175.22 175.31 1f5l s ALA 31 N 1.74 2.62 -0.29 11.12 0.00 -0.39 -4.34 121.76 132.22 1f5l s ALA 31 Ca 0.63 -0.89 -0.13 0.00 0.00 0.00 0.00 51.96 51.56 1f5l s ALA 31 Cb -0.32 -1.21 -0.04 0.00 0.00 0.00 0.00 23.12 21.55 1f5l s ALA 31 CO 0.28 0.26 0.30 0.00 0.00 0.00 0.00 175.76 176.59 1f5l s ALA 32 N 0.33 3.54 -0.22 0.00 0.00 -0.40 -1.13 121.76 123.88 1f5l s ALA 32 Ca -0.11 -1.01 -0.06 0.00 0.00 0.00 0.00 51.96 50.78 1f5l s ALA 32 Cb -0.16 -2.64 -0.03 0.00 0.00 0.00 0.00 23.12 20.29 1f5l s ALA 32 CO 0.06 -0.70 0.04 0.42 0.00 0.00 0.00 175.76 175.58 1f5l s ILE 33 N 1.93 4.18 0.26 0.00 1.01 -0.70 -0.14 121.20 127.74 1f5l s ILE 33 Ca 0.11 -0.23 0.11 0.00 0.00 0.00 0.00 60.65 60.65 1f5l s ILE 33 Cb -0.16 -2.92 -0.05 0.00 0.01 0.00 0.00 42.46 39.34 1f5l s ILE 33 CO 0.11 0.39 -0.15 -0.31 0.00 0.00 0.00 174.94 174.98 1f5l s TYR 34 N 1.25 2.41 -0.08 3.97 2.02 0.65 -0.83 117.35 126.74 1f5l s TYR 34 Ca 0.04 -0.30 0.04 0.00 -0.37 0.00 0.00 57.07 56.48 1f5l s TYR 34 Cb -0.15 -1.07 -0.01 0.00 -0.40 0.00 0.00 41.96 40.33 1f5l s TYR 34 CO 0.02 0.66 -0.22 0.50 -1.57 0.00 0.00 175.55 174.95 1f5l s ARG 35 N -3.43 2.79 0.22 -0.62 3.52 -0.08 -0.72 118.95 120.63 1f5l s ARG 35 Ca 0.29 -0.84 -0.28 0.00 -0.13 0.00 0.00 55.73 54.77 1f5l s ARG 35 Cb -0.06 -2.30 -0.09 0.00 -1.56 0.00 0.00 34.95 30.95 1f5l s ARG 35 CO 0.16 0.34 0.89 1.03 -0.81 0.00 0.00 175.30 176.90 1f5l s ARG 36 N -0.04 4.76 0.39 5.12 0.52 0.22 -2.16 118.95 127.75 1f5l s ARG 36 Ca -0.06 1.38 0.08 0.00 -0.52 0.00 0.00 55.73 56.60 1f5l s ARG 36 Cb -0.15 -3.27 -0.07 0.00 0.52 0.00 0.00 34.95 31.99 1f5l s ARG 36 CO 0.05 0.53 0.02 -1.01 0.02 0.00 0.00 175.30 174.91 1f5l s HIS 37 N -1.18 2.52 -0.93 -0.53 3.76 -0.98 -4.94 115.29 113.02 1f5l s HIS 37 Ca 0.39 -0.59 -0.16 0.00 -0.15 0.00 0.00 55.06 54.55 1f5l s HIS 37 Cb -0.25 -1.70 -0.10 0.00 1.11 0.00 0.00 32.58 31.64 1f5l s HIS 37 CO 0.30 0.43 2.05 0.54 -0.85 0.00 0.00 174.74 177.21 1f5l n ARG 37 N -0.98 1.91 0.00 1.40 3.00 -1.26 -4.23 116.66 116.50 1f5l n ARG 37 Ca -0.04 -1.85 0.03 0.00 -0.01 0.00 0.00 57.85 55.98 1f5l n ARG 37 Cb 0.65 -2.84 0.18 0.00 0.00 0.00 0.00 32.46 30.46 1f5l n ARG 37 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1f5l n GLY 37 N 4.24 -0.22 3.61 -0.13 0.00 -1.26 -5.11 105.19 106.32 1f5l n GLY 37 Ca 0.50 -0.04 -0.43 0.00 0.00 0.00 0.00 46.02 46.05 1f5l n GLY 37 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1f5l s SER 37 N -2.05 6.73 -0.13 1.61 1.04 -1.26 -5.04 113.70 114.61 1f5l s SER 37 Ca 0.09 0.71 -0.08 0.00 0.48 0.00 0.00 55.95 57.15 1f5l s SER 37 Cb 0.04 -2.47 -0.04 0.00 0.10 0.00 0.00 66.02 63.65 1f5l s SER 37 CO 0.07 -0.81 0.16 -0.69 0.98 0.00 0.00 173.24 172.95 1f5l s VAL 38 N 3.41 5.46 0.07 5.02 1.01 -1.26 -2.31 120.40 131.80 1f5l s VAL 38 Ca 0.39 0.25 0.07 0.00 0.00 0.00 0.00 61.98 62.69 1f5l s VAL 38 Cb -0.12 -3.44 -0.03 0.00 0.00 0.00 0.00 36.38 32.79 1f5l s VAL 38 CO 0.17 0.58 -0.18 0.42 0.00 0.00 0.00 175.10 176.08 1f5l s THR 39 N -0.76 1.48 0.28 3.92 -4.23 -0.92 -4.97 115.64 110.44 1f5l s THR 39 Ca 0.14 -1.33 -0.29 0.00 -1.18 0.00 0.00 61.69 59.03 1f5l s THR 39 Cb -0.12 -1.34 -0.10 0.00 1.34 0.00 0.00 72.50 72.28 1f5l s THR 39 CO 0.04 -0.03 1.17 -0.47 -0.54 0.00 0.00 174.62 174.79 1f5l s TYR 40 N -1.06 3.41 -0.02 3.99 5.04 -1.26 -0.90 117.35 126.54 1f5l s TYR 40 Ca 0.04 1.58 -0.07 0.00 -2.44 0.00 0.00 57.07 56.18 1f5l s TYR 40 Cb -0.09 -3.41 -0.02 0.00 0.35 0.00 0.00 41.96 38.78 1f5l s TYR 40 CO 0.03 -1.00 -0.14 0.28 -1.34 0.00 0.00 175.55 173.38 1f5l n VAL 41 N 1.24 1.15 -3.85 3.14 0.31 -0.01 -4.86 118.33 115.46 1f5l n VAL 41 Ca -0.00 0.28 -0.08 0.00 -0.01 0.00 0.00 64.34 64.52 1f5l n VAL 41 Cb 0.44 -1.83 -0.00 0.00 -0.91 0.00 0.00 33.84 31.53 1f5l n VAL 41 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1f5l s GLY 43 N -3.00 1.75 0.15 0.00 0.00 -0.05 -1.72 107.32 104.46 1f5l s GLY 43 Ca 0.14 -1.78 -0.24 0.00 0.00 0.00 0.00 44.72 42.83 1f5l s GLY 43 CO 0.09 -1.19 1.04 -0.32 0.00 0.00 0.00 173.10 172.72 1f5l s GLY 44 N -4.76 -0.10 -0.01 0.20 0.00 -0.28 -3.80 107.32 98.57 1f5l s GLY 44 Ca 0.67 -0.02 0.01 0.00 0.00 0.00 0.00 44.72 45.38 1f5l s GLY 44 CO 0.45 1.14 -0.04 -0.56 0.00 0.00 0.00 173.10 174.09 1f5l s SER 45 N -3.16 0.62 -0.52 1.64 0.01 -0.40 -1.27 113.70 110.63 1f5l s SER 45 Ca 0.17 -0.09 -0.27 0.00 1.31 0.00 0.00 55.95 57.07 1f5l s SER 45 Cb -0.01 -0.15 0.03 0.00 0.21 0.00 0.00 66.02 66.10 1f5l s SER 45 CO 0.03 0.02 1.06 -0.22 0.41 0.00 0.00 173.24 174.54 1f5l s LEU 46 N 0.19 3.78 0.07 2.44 2.96 -0.35 -0.27 118.68 127.50 1f5l s LEU 46 Ca -0.02 0.09 0.23 0.00 -0.22 0.00 0.00 54.13 54.21 1f5l s LEU 46 Cb -0.05 -3.19 0.02 0.00 0.50 0.00 0.00 46.19 43.47 1f5l s LEU 46 CO -0.00 -1.26 0.99 2.30 -1.32 0.00 0.00 176.35 177.06 1f5l n ILE 47 N 6.55 0.24 -3.60 6.68 -5.35 -0.34 -1.57 119.36 121.98 1f5l n ILE 47 Ca 0.07 -0.32 -0.10 0.00 -0.27 0.00 0.00 62.75 62.13 1f5l n ILE 47 Cb 0.49 0.07 -0.02 0.00 -1.74 0.00 0.00 39.64 38.44 1f5l n ILE 47 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 1f5l s SER 48 N -4.25 -0.44 0.40 7.28 1.04 -1.18 -4.60 113.70 111.94 1f5l s SER 48 Ca 0.02 -0.24 0.17 0.00 0.48 0.00 0.00 55.95 56.37 1f5l s SER 48 Cb 0.13 0.65 1.05 0.00 0.10 0.00 0.00 66.02 67.95 1f5l s SER 48 CO 0.81 -1.12 1.81 -0.65 0.98 0.00 0.00 173.24 175.07 1f5l h PRO 49 N 2.00 0.44 -0.03 4.02 0.11 -1.93 -2.16 132.00 134.45 1f5l h PRO 49 Ca -0.28 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.80 1f5l h PRO 49 Cb 1.29 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.30 1f5l h PRO 49 CO 0.32 0.29 0.00 0.00 -0.21 0.00 0.00 178.00 178.40 1f5l s TRP 51 N -1.67 1.62 -0.09 0.00 0.52 -0.81 -1.31 118.94 117.19 1f5l s TRP 51 Ca 0.23 -0.56 0.03 0.00 0.02 0.00 0.00 56.10 55.83 1f5l s TRP 51 Cb 0.17 -1.14 -0.01 0.00 -1.15 0.00 0.00 33.47 31.34 1f5l s TRP 51 CO 0.25 -0.25 -0.18 0.08 0.02 0.00 0.00 176.95 176.87 1f5l s VAL 52 N 0.41 2.62 -0.10 4.03 1.01 -0.60 -1.19 120.40 126.57 1f5l s VAL 52 Ca -0.11 -0.85 -0.02 0.00 0.00 0.00 0.00 61.98 61.01 1f5l s VAL 52 Cb -0.14 -2.03 -0.03 0.00 0.00 0.00 0.00 36.38 34.17 1f5l s VAL 52 CO 0.04 0.56 -0.03 -0.51 0.00 0.00 0.00 175.10 175.16 1f5l s ILE 53 N -0.02 4.06 0.00 2.22 2.07 0.63 -0.34 121.20 129.82 1f5l s ILE 53 Ca -0.06 -0.33 0.00 0.00 -1.41 0.00 0.00 60.65 58.85 1f5l s ILE 53 Cb -0.15 -2.71 0.00 0.00 0.13 0.00 0.00 42.46 39.73 1f5l s ILE 53 CO 0.05 0.57 0.00 -0.24 -1.91 0.00 0.00 174.94 173.41 1f5l n SER 54 N 2.54 0.00 -4.48 4.50 2.88 0.65 -1.27 113.62 118.44 1f5l n SER 54 Ca -0.18 0.00 -0.33 0.00 -1.33 0.00 0.00 58.87 57.03 1f5l n SER 54 Cb 0.53 0.00 -0.13 0.00 -0.75 0.00 0.00 64.21 63.86 1f5l n SER 54 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1f5l s ALA 55 N -1.67 2.73 0.35 -1.46 0.00 -1.26 -0.58 121.76 119.87 1f5l s ALA 55 Ca 0.00 -0.94 0.02 0.00 0.00 0.00 0.00 51.96 51.04 1f5l s ALA 55 Cb 0.00 -1.07 0.63 0.00 0.00 0.00 0.00 23.12 22.68 1f5l s ALA 55 CO 0.00 0.50 2.01 1.15 0.00 0.00 0.00 175.76 179.42 1f5l h THR 56 N 4.51 1.16 0.00 0.00 2.02 -1.75 -2.79 112.91 116.07 1f5l h THR 56 Ca -0.43 -0.31 0.00 0.00 0.77 0.00 0.00 66.41 66.43 1f5l h THR 56 Cb 1.17 0.25 0.00 0.00 -1.74 0.00 0.00 68.15 67.83 1f5l h THR 56 CO 0.52 0.16 0.00 1.12 0.37 0.00 0.00 175.52 177.69 1f5l h HIS 57 N 0.85 0.00 0.00 3.16 2.07 -1.93 -0.61 115.15 118.69 1f5l h HIS 57 Ca 0.23 0.00 -0.12 0.00 -2.85 0.00 0.00 60.37 57.63 1f5l h HIS 57 Cb -0.08 0.00 -0.02 0.00 2.57 0.00 0.00 27.41 29.88 1f5l h HIS 57 CO 0.00 0.00 -0.55 0.00 -3.07 0.00 0.00 177.93 174.31 1f5l n PHE 59 N -3.81 0.00 -0.31 0.00 3.72 -0.36 -4.80 117.46 111.89 1f5l n PHE 59 Ca -0.01 0.00 0.27 0.00 -0.05 0.00 0.00 57.45 57.66 1f5l n PHE 59 Cb 0.57 -0.00 0.60 0.00 -0.94 0.00 0.00 39.48 39.71 1f5l n PHE 59 CO 0.00 0.00 0.00 0.97 -0.05 0.00 0.00 176.76 177.68 1f5l h ILE 60 N 0.00 0.48 0.00 4.37 6.09 -1.38 -0.74 117.51 126.34 1f5l h ILE 60 Ca 0.00 -0.08 -0.08 0.00 -1.37 0.00 0.00 64.86 63.33 1f5l h ILE 60 Cb 0.02 0.22 -0.01 0.00 0.47 0.00 0.00 36.82 37.51 1f5l h ILE 60 CO 0.00 0.04 -0.47 0.44 -3.07 0.00 0.00 178.15 175.10 1f5l h ASP 60 N 0.24 0.00 -2.47 2.19 3.32 -1.87 -3.39 116.42 114.45 1f5l h ASP 60 Ca 0.58 0.00 -0.59 0.00 0.02 0.00 0.00 57.03 57.03 1f5l h ASP 60 Cb 1.76 0.00 -0.39 0.00 0.22 0.00 0.00 39.33 40.92 1f5l h ASP 60 CO -0.19 0.35 -0.89 -1.22 -1.72 0.00 0.00 179.24 175.57 1f5l n TYR 60 N -3.14 0.19 1.01 4.55 4.02 -0.30 -4.99 117.16 118.50 1f5l n TYR 60 Ca 0.02 -3.58 0.00 0.00 -0.01 0.00 0.00 57.90 54.33 1f5l n TYR 60 Cb 0.68 -0.02 0.00 0.00 -0.02 0.00 0.00 39.34 39.98 1f5l n TYR 60 CO 0.00 0.00 0.00 -2.30 -1.01 0.00 0.00 176.86 173.55 1f5l n PRO 60 N 2.42 0.56 -2.56 -0.72 -0.02 -1.11 -4.77 135.00 128.80 1f5l n PRO 60 Ca 0.27 0.00 -0.42 0.00 -2.02 0.00 0.00 63.50 61.32 1f5l n PRO 60 Cb 0.45 -1.05 -0.02 0.00 -0.02 0.00 0.00 33.50 32.86 1f5l n PRO 60 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 1f5l s LYS 61 N -1.82 3.56 0.41 -0.52 1.02 -1.26 -4.91 119.74 116.23 1f5l s LYS 61 Ca 0.00 0.39 0.08 0.00 0.02 0.00 0.00 55.97 56.46 1f5l s LYS 61 Cb 0.00 -3.99 0.88 0.00 -0.52 0.00 0.00 37.83 34.19 1f5l s LYS 61 CO 0.00 -1.62 2.05 1.57 -0.92 0.00 0.00 175.35 176.43 1f5l h LYS 62 N 9.65 0.46 0.00 1.68 2.10 -1.91 -2.53 116.57 126.03 1f5l h LYS 62 Ca -0.25 -0.04 -0.01 0.00 -2.00 0.00 0.00 60.65 58.36 1f5l h LYS 62 Cb 1.06 -0.10 -0.00 0.00 -0.90 0.00 0.00 32.23 32.29 1f5l h LYS 62 CO 1.17 0.34 -0.04 1.49 -2.00 0.00 0.00 179.45 180.41 1f5l h GLU 62 N 0.47 0.00 -0.00 0.07 4.81 -1.91 -2.55 114.58 115.46 1f5l h GLU 62 Ca 0.12 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.35 1f5l h GLU 62 Cb 0.00 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.38 1f5l h GLU 62 CO -0.02 0.04 -0.02 -0.25 -0.73 0.00 0.00 179.01 178.03 1f5l n ASP 63 N -3.80 0.47 -4.75 1.04 8.00 -0.95 -4.89 116.55 111.67 1f5l n ASP 63 Ca -0.03 -1.03 -0.32 0.00 0.71 0.00 0.00 54.79 54.13 1f5l n ASP 63 Cb 0.13 -0.02 -0.07 0.00 -0.02 0.00 0.00 41.12 41.13 1f5l n ASP 63 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 1f5l s TYR 64 N -2.10 3.18 -0.08 1.24 1.51 -0.96 0.69 117.35 120.83 1f5l s TYR 64 Ca 0.42 0.11 0.01 0.00 -1.01 0.00 0.00 57.07 56.60 1f5l s TYR 64 Cb 0.21 -1.66 0.02 0.00 -0.11 0.00 0.00 41.96 40.42 1f5l s TYR 64 CO 0.38 0.52 -0.10 0.42 -1.11 0.00 0.00 175.55 175.65 1f5l s ILE 65 N -1.27 1.06 -0.15 2.71 1.01 0.10 -4.15 121.20 120.52 1f5l s ILE 65 Ca 0.25 -0.40 -0.03 0.00 0.00 0.00 0.00 60.65 60.47 1f5l s ILE 65 Cb -0.12 -1.01 -0.03 0.00 0.01 0.00 0.00 42.46 41.32 1f5l s ILE 65 CO 0.17 0.35 -0.06 -0.69 0.00 0.00 0.00 174.94 174.71 1f5l s VAL 66 N 0.97 3.72 -0.08 2.92 1.01 -0.42 -0.25 120.40 128.27 1f5l s VAL 66 Ca -0.09 -0.42 0.02 0.00 0.00 0.00 0.00 61.98 61.49 1f5l s VAL 66 Cb -0.15 -2.61 -0.02 0.00 0.00 0.00 0.00 36.38 33.60 1f5l s VAL 66 CO 0.00 0.51 -0.13 -0.31 0.00 0.00 0.00 175.10 175.17 1f5l s TYR 67 N 0.29 2.76 0.06 5.22 2.02 0.80 -0.76 117.35 127.74 1f5l s TYR 67 Ca -0.05 -0.30 0.08 0.00 -0.37 0.00 0.00 57.07 56.44 1f5l s TYR 67 Cb -0.14 -1.71 -0.03 0.00 -0.40 0.00 0.00 41.96 39.68 1f5l s TYR 67 CO 0.03 0.07 -0.22 -0.51 -1.57 0.00 0.00 175.55 173.35 1f5l s LEU 68 N -0.37 2.20 -0.57 -1.29 1.43 -0.39 -1.27 118.68 118.41 1f5l s LEU 68 Ca 0.04 -0.58 0.00 0.00 -1.03 0.00 0.00 54.13 52.56 1f5l s LEU 68 Cb -0.12 -1.04 0.00 0.00 0.03 0.00 0.00 46.19 45.06 1f5l s LEU 68 CO 0.02 0.16 0.00 0.61 0.23 0.00 0.00 176.35 177.38 1f5l n GLY 69 N 1.64 0.50 3.50 -3.19 0.00 -1.24 -0.54 105.19 105.86 1f5l n GLY 69 Ca -0.18 -0.72 -0.35 0.00 0.00 0.00 0.00 46.02 44.78 1f5l n GLY 69 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1f5l s ARG 70 N -3.36 3.70 -0.06 1.61 3.52 -1.26 -3.98 118.95 119.12 1f5l s ARG 70 Ca 0.00 -0.49 0.21 0.00 -0.13 0.00 0.00 55.73 55.33 1f5l s ARG 70 Cb 0.00 -3.07 -0.32 0.00 -1.56 0.00 0.00 34.95 30.01 1f5l s ARG 70 CO 0.00 0.12 0.41 0.43 -0.81 0.00 0.00 175.30 175.46 1f5l n SER 71 N 3.93 0.01 -4.37 -2.12 7.64 -1.26 -4.69 113.62 112.75 1f5l n SER 71 Ca -0.17 0.01 -0.30 0.00 1.01 0.00 0.00 58.87 59.42 1f5l n SER 71 Cb 0.52 1.79 -0.14 0.00 -1.01 0.00 0.00 64.21 65.38 1f5l n SER 71 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 1f5l s ARG 72 N -3.33 1.71 0.05 1.43 0.52 -1.26 -1.84 118.95 116.23 1f5l s ARG 72 Ca -0.08 -1.17 -0.26 0.00 -0.52 0.00 0.00 55.73 53.70 1f5l s ARG 72 Cb 0.12 -1.98 -0.17 0.00 0.52 0.00 0.00 34.95 33.44 1f5l s ARG 72 CO 0.89 0.50 1.55 1.25 0.02 0.00 0.00 175.30 179.51 1f5l h LEU 73 N 4.46 -0.22 -3.08 2.53 6.46 -1.23 -3.35 115.31 120.89 1f5l h LEU 73 Ca -0.48 -0.10 0.00 0.00 -0.12 0.00 0.00 57.88 57.18 1f5l h LEU 73 Cb 1.15 0.06 0.00 0.00 -0.73 0.00 0.00 40.66 41.14 1f5l h LEU 73 CO 0.43 -0.03 0.00 0.59 -0.62 0.00 0.00 178.44 178.81 1f5l n ASN 74 N -5.14 2.98 -4.16 1.25 3.02 -1.26 -5.02 115.26 106.93 1f5l n ASN 74 Ca -0.09 -2.70 -0.10 0.00 -0.03 0.00 0.00 54.58 51.66 1f5l n ASN 74 Cb 0.18 -0.37 -0.10 0.00 -0.61 0.00 0.00 39.78 38.87 1f5l n ASN 74 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 1f5l s SER 75 N -1.89 1.09 0.31 6.41 1.04 -1.26 -5.15 113.70 114.25 1f5l s SER 75 Ca 0.29 -1.00 -0.20 0.00 0.48 0.00 0.00 55.95 55.52 1f5l s SER 75 Cb 0.23 0.10 -0.09 0.00 0.10 0.00 0.00 66.02 66.36 1f5l s SER 75 CO 0.07 -0.48 0.82 0.20 0.98 0.00 0.00 173.24 174.84 1f5l s ASN 76 N -3.03 7.03 -0.04 7.02 0.01 -1.26 -4.52 114.94 120.15 1f5l s ASN 76 Ca 0.11 1.54 0.06 0.00 -0.71 0.00 0.00 52.86 53.86 1f5l s ASN 76 Cb 0.05 -2.47 -0.02 0.00 0.41 0.00 0.00 41.25 39.23 1f5l s ASN 76 CO -0.05 -0.12 -0.21 -0.89 -1.51 0.00 0.00 177.10 174.32 1f5l s THR 77 N -1.78 2.49 0.14 1.60 2.01 -1.26 -4.96 115.64 113.88 1f5l s THR 77 Ca 0.51 -0.93 -0.31 0.00 0.31 0.00 0.00 61.69 61.27 1f5l s THR 77 Cb -0.14 -1.93 -0.10 0.00 0.01 0.00 0.00 72.50 70.34 1f5l s THR 77 CO 0.19 0.58 1.76 -1.58 -0.69 0.00 0.00 174.62 174.88 1f5l s GLN 78 N -0.53 4.15 0.00 4.92 0.74 -1.26 -2.05 119.66 125.63 1f5l s GLN 78 Ca 0.07 2.55 0.00 0.00 0.05 0.00 0.00 55.36 58.03 1f5l s GLN 78 Cb -0.11 -3.44 0.00 0.00 1.10 0.00 0.00 33.01 30.56 1f5l s GLN 78 CO 0.01 -0.79 0.00 0.41 -0.55 0.00 0.00 175.29 174.37 1f5l n GLY 79 N 4.11 0.76 3.76 2.59 0.00 -1.26 -5.03 105.19 110.12 1f5l n GLY 79 Ca 0.17 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.87 1f5l n GLY 79 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1f5l s GLU 80 N -0.60 2.37 -0.03 1.61 -1.05 -0.87 -4.82 118.70 115.32 1f5l s GLU 80 Ca 0.00 1.33 0.02 0.00 -0.15 0.00 0.00 54.97 56.17 1f5l s GLU 80 Cb 0.00 -1.90 0.01 0.00 -0.44 0.00 0.00 34.13 31.80 1f5l s GLU 80 CO 0.00 -1.57 -0.08 -1.64 0.95 0.00 0.00 175.26 172.92 1f5l s MET 81 N -4.49 0.96 -0.13 -4.83 -1.94 0.30 -4.99 119.30 104.18 1f5l s MET 81 Ca 0.65 -0.26 -0.07 0.00 -1.71 0.00 0.00 55.69 54.30 1f5l s MET 81 Cb -0.20 -0.90 -0.04 0.00 2.01 0.00 0.00 34.83 35.70 1f5l s MET 81 CO 0.50 0.05 0.13 0.21 -0.01 0.00 0.00 175.02 175.90 1f5l s LYS 82 N 0.40 3.56 0.04 2.03 2.20 -1.26 -1.26 119.74 125.46 1f5l s LYS 82 Ca -0.06 -0.17 0.01 0.00 -0.36 0.00 0.00 55.97 55.39 1f5l s LYS 82 Cb -0.10 -3.21 -0.02 0.00 -1.51 0.00 0.00 37.83 32.98 1f5l s LYS 82 CO 0.01 0.68 -0.06 -0.06 -0.36 0.00 0.00 175.35 175.56 1f5l s PHE 83 N -0.74 0.53 0.42 4.03 0.08 0.06 -4.62 117.98 117.74 1f5l s PHE 83 Ca 0.13 -0.54 0.06 0.00 0.12 0.00 0.00 56.93 56.70 1f5l s PHE 83 Cb -0.12 -0.33 0.01 0.00 -0.57 0.00 0.00 43.02 42.01 1f5l s PHE 83 CO 0.03 -0.13 0.59 -1.21 -0.10 0.00 0.00 175.22 174.39 1f5l s GLU 84 N -1.69 2.88 -0.29 0.44 0.41 -0.09 -1.30 118.70 119.05 1f5l s GLU 84 Ca -0.11 -1.02 -0.09 0.00 -0.41 0.00 0.00 54.97 53.35 1f5l s GLU 84 Cb -0.09 -2.71 -0.02 0.00 -1.78 0.00 0.00 34.13 29.54 1f5l s GLU 84 CO -0.01 -0.26 0.12 0.08 -0.49 0.00 0.00 175.26 174.71 1f5l s VAL 85 N -2.40 4.52 0.07 2.63 1.01 -1.26 -2.07 120.40 122.89 1f5l s VAL 85 Ca 0.52 -0.32 -0.05 0.00 0.00 0.00 0.00 61.98 62.12 1f5l s VAL 85 Cb -0.10 -3.24 -0.29 0.00 0.00 0.00 0.00 36.38 32.75 1f5l s VAL 85 CO 0.34 0.17 1.11 -0.08 0.00 0.00 0.00 175.10 176.63 1f5l h GLU 86 N 8.31 0.30 -2.69 2.72 4.81 0.11 -3.43 114.58 124.71 1f5l h GLU 86 Ca -0.34 -0.51 -0.14 0.00 -0.13 0.00 0.00 59.36 58.24 1f5l h GLU 86 Cb 1.16 0.19 -0.28 0.00 0.63 0.00 0.00 28.75 30.45 1f5l h GLU 86 CO 0.60 1.24 -0.38 1.21 -0.73 0.00 0.00 179.01 180.95 1f5l s ASN 87 N -7.19 -0.27 -0.42 1.04 3.04 -1.13 -4.97 114.94 105.04 1f5l s ASN 87 Ca -0.05 0.82 -0.08 0.00 0.04 0.00 0.00 52.86 53.59 1f5l s ASN 87 Cb 0.07 0.88 0.09 0.00 -1.54 0.00 0.00 41.25 40.74 1f5l s ASN 87 CO 0.89 -0.21 0.26 -0.22 -3.04 0.00 0.00 177.10 174.78 1f5l s LEU 88 N 1.89 5.20 -0.41 3.21 2.96 -1.26 -0.50 118.68 129.77 1f5l s LEU 88 Ca -0.06 -1.59 -0.13 0.00 -0.22 0.00 0.00 54.13 52.13 1f5l s LEU 88 Cb -0.10 -1.97 0.04 0.00 0.50 0.00 0.00 46.19 44.65 1f5l s LEU 88 CO -0.12 -0.55 0.28 -0.63 -1.32 0.00 0.00 176.35 174.02 1f5l s ILE 89 N 1.39 4.94 0.06 6.68 1.01 0.16 -5.01 121.20 130.44 1f5l s ILE 89 Ca 0.04 -0.86 -0.01 0.00 0.00 0.00 0.00 60.65 59.81 1f5l s ILE 89 Cb -0.23 -3.81 -0.04 0.00 0.01 0.00 0.00 42.46 38.38 1f5l s ILE 89 CO 0.01 -0.35 0.23 -0.76 0.00 0.00 0.00 174.94 174.07 1f5l s LEU 90 N 1.61 4.35 0.11 2.97 1.43 -1.26 -1.05 118.68 126.83 1f5l s LEU 90 Ca 0.04 0.32 -0.31 0.00 -1.03 0.00 0.00 54.13 53.15 1f5l s LEU 90 Cb -0.20 -2.97 -0.07 0.00 0.03 0.00 0.00 46.19 42.98 1f5l s LEU 90 CO 0.08 0.16 1.23 -2.28 0.23 0.00 0.00 176.35 175.77 1f5l s HIS 91 N -1.51 3.40 0.20 0.29 5.65 -1.20 -4.95 115.29 117.18 1f5l s HIS 91 Ca 0.35 1.28 -0.11 0.00 0.25 0.00 0.00 55.06 56.83 1f5l s HIS 91 Cb -0.13 -3.47 0.16 0.00 -1.18 0.00 0.00 32.58 27.96 1f5l s HIS 91 CO 0.27 -1.44 1.85 -0.22 -0.65 0.00 0.00 174.74 174.54 1f5l h LYS 92 N 6.35 0.83 -0.90 2.88 3.64 -1.94 -2.94 116.57 124.50 1f5l h LYS 92 Ca -0.42 -0.05 -0.13 0.00 -1.27 0.00 0.00 60.65 58.78 1f5l h LYS 92 Cb 1.21 -0.19 -0.08 0.00 -0.41 0.00 0.00 32.23 32.77 1f5l h LYS 92 CO 0.80 0.55 0.16 -0.25 -2.27 0.00 0.00 179.45 178.44 1f5l n ASP 93 N -4.66 3.34 -4.76 4.20 8.00 -1.26 -4.94 116.55 116.47 1f5l n ASP 93 Ca 0.07 -2.62 -0.41 0.00 0.71 0.00 0.00 54.79 52.54 1f5l n ASP 93 Cb 0.06 -0.63 -0.03 0.00 -0.02 0.00 0.00 41.12 40.51 1f5l n ASP 93 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 1f5l s TYR 94 N -1.72 3.19 0.03 1.24 5.04 -1.11 -4.65 117.35 119.37 1f5l s TYR 94 Ca 0.27 1.36 -0.21 0.00 -2.44 0.00 0.00 57.07 56.04 1f5l s TYR 94 Cb 0.22 -3.61 0.05 0.00 0.35 0.00 0.00 41.96 38.96 1f5l s TYR 94 CO 0.06 -1.75 0.49 -1.54 -1.34 0.00 0.00 175.55 171.47 1f5l s SER 95 N -0.19 -0.40 -0.09 4.32 1.04 -1.16 -5.01 113.70 112.22 1f5l s SER 95 Ca 0.52 0.17 0.01 0.00 0.48 0.00 0.00 55.95 57.12 1f5l s SER 95 Cb -0.38 0.47 0.02 0.00 0.10 0.00 0.00 66.02 66.23 1f5l s SER 95 CO 0.45 -0.68 -0.09 0.00 0.98 0.00 0.00 173.24 173.91 1f5l s ALA 96 N -2.27 1.21 0.32 5.32 0.00 -1.26 -0.11 121.76 124.96 1f5l s ALA 96 Ca -0.06 -0.43 0.00 0.00 0.00 0.00 0.00 51.96 51.47 1f5l s ALA 96 Cb -0.01 -0.73 0.00 0.00 0.00 0.00 0.00 23.12 22.38 1f5l s ALA 96 CO -0.00 -0.19 0.00 -0.25 0.00 0.00 0.00 175.76 175.31 1f5l n ASP 97 N 4.47 0.00 -0.05 0.00 9.92 0.61 -4.99 116.55 126.50 1f5l n ASP 97 Ca -0.17 0.00 -0.08 0.00 -0.53 0.00 0.00 54.79 54.01 1f5l n ASP 97 Cb 0.51 0.00 -0.02 0.00 -0.64 0.00 0.00 41.12 40.97 1f5l n ASP 97 CO 0.00 0.00 0.00 0.74 0.13 0.00 0.00 177.20 178.07 1f5l h THR 97 N 0.00 0.38 0.00 -3.53 2.02 -2.03 -3.39 112.91 106.36 1f5l h THR 97 Ca 0.00 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.14 1f5l h THR 97 Cb 0.00 0.38 -0.01 0.00 -1.74 0.00 0.00 68.15 66.78 1f5l h THR 97 CO 0.00 0.00 -1.14 0.18 0.37 0.00 0.00 175.52 174.93 1f5l n LEU 97 N -5.38 0.26 -4.76 2.58 4.77 -1.26 -5.07 117.00 108.13 1f5l n LEU 97 Ca -0.01 0.03 -0.41 0.00 -0.03 0.00 0.00 56.01 55.59 1f5l n LEU 97 Cb 0.29 -0.08 -0.02 0.00 -2.33 0.00 0.00 43.42 41.29 1f5l n LEU 97 CO 0.14 0.07 1.04 0.00 -1.33 0.00 0.00 177.39 177.31 1f5l s ALA 98 N -2.05 3.54 -0.13 -1.18 0.00 -1.26 -4.77 121.76 115.92 1f5l s ALA 98 Ca -0.04 1.33 -0.00 0.00 0.00 0.00 0.00 51.96 53.26 1f5l s ALA 98 Cb 0.01 -3.52 -0.01 0.00 0.00 0.00 0.00 23.12 19.60 1f5l s ALA 98 CO 0.05 -0.74 -0.13 -1.01 0.00 0.00 0.00 175.76 173.92 1f5l s HIS 99 N -0.84 2.81 -0.01 0.00 3.76 -1.26 -0.29 115.29 119.46 1f5l s HIS 99 Ca 0.52 -0.65 -0.00 0.00 -0.15 0.00 0.00 55.06 54.78 1f5l s HIS 99 Cb -0.41 -1.84 -0.04 0.00 1.11 0.00 0.00 32.58 31.40 1f5l s HIS 99 CO 0.52 -0.22 0.06 -1.01 -0.85 0.00 0.00 174.74 173.25 1f5l s HIS 100 N 0.35 3.25 -1.60 1.40 3.76 0.85 -4.51 115.29 118.78 1f5l s HIS 100 Ca -0.11 0.19 -0.13 0.00 -0.15 0.00 0.00 55.06 54.86 1f5l s HIS 100 Cb -0.16 -1.73 0.11 0.00 1.11 0.00 0.00 32.58 31.91 1f5l s HIS 100 CO 0.06 0.54 0.73 0.09 -0.85 0.00 0.00 174.74 175.30 1f5l n ASN 101 N 1.27 -2.81 -4.29 1.40 3.02 -1.26 -2.96 115.26 109.64 1f5l n ASN 101 Ca -0.14 -0.97 -0.41 0.00 -0.03 0.00 0.00 54.58 53.03 1f5l n ASN 101 Cb 0.53 -3.02 -0.01 0.00 -0.61 0.00 0.00 39.78 36.67 1f5l n ASN 101 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1f5l n ASP 102 N -2.77 4.36 -3.77 6.41 2.03 -1.26 -4.57 116.55 116.99 1f5l n ASP 102 Ca -0.03 -2.87 -0.13 0.00 0.52 0.00 0.00 54.79 52.29 1f5l n ASP 102 Cb 0.55 -1.69 -0.11 0.00 -0.72 0.00 0.00 41.12 39.14 1f5l n ASP 102 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 1f5l s ILE 103 N 4.53 -0.00 -0.00 5.18 2.07 -1.26 -4.29 121.20 127.43 1f5l s ILE 103 Ca 0.53 0.01 -0.07 0.00 -1.41 0.00 0.00 60.65 59.71 1f5l s ILE 103 Cb 0.07 -0.43 0.00 0.00 0.13 0.00 0.00 42.46 42.24 1f5l s ILE 103 CO 0.04 0.00 0.14 0.00 -1.91 0.00 0.00 174.94 173.21 1f5l s ALA 104 N 0.26 -0.33 -0.10 1.50 0.00 0.26 -3.24 121.76 120.11 1f5l s ALA 104 Ca -0.01 -0.09 0.02 0.00 0.00 0.00 0.00 51.96 51.88 1f5l s ALA 104 Cb -0.03 0.08 -0.02 0.00 0.00 0.00 0.00 23.12 23.16 1f5l s ALA 104 CO -0.01 -0.20 -0.16 -0.51 0.00 0.00 0.00 175.76 174.88 1f5l s LEU 105 N -1.28 2.56 -0.26 0.00 1.43 -0.22 -0.25 118.68 120.66 1f5l s LEU 105 Ca -0.14 -0.35 0.02 0.00 -1.03 0.00 0.00 54.13 52.64 1f5l s LEU 105 Cb -0.07 -1.54 0.07 0.00 0.03 0.00 0.00 46.19 44.67 1f5l s LEU 105 CO 0.01 0.22 -0.06 -0.76 0.23 0.00 0.00 176.35 176.00 1f5l s LEU 106 N 0.02 3.16 -0.18 1.79 1.02 0.54 -0.66 118.68 124.37 1f5l s LEU 106 Ca -0.06 -1.40 -0.28 0.00 0.02 0.00 0.00 54.13 52.41 1f5l s LEU 106 Cb -0.15 -1.37 -0.00 0.00 0.02 0.00 0.00 46.19 44.70 1f5l s LEU 106 CO 0.05 -0.24 0.98 -0.75 0.02 0.00 0.00 176.35 176.40 1f5l s LYS 107 N 1.23 4.32 0.20 1.70 2.20 0.34 -1.56 119.74 128.17 1f5l s LYS 107 Ca -0.05 1.28 0.05 0.00 -0.36 0.00 0.00 55.97 56.90 1f5l s LYS 107 Cb -0.19 -3.60 -0.04 0.00 -1.51 0.00 0.00 37.83 32.50 1f5l s LYS 107 CO -0.07 -0.46 0.19 0.96 -0.36 0.00 0.00 175.35 175.61 1f5l s ILE 108 N 2.58 4.62 -0.26 5.43 -4.36 -0.43 0.82 121.20 129.61 1f5l s ILE 108 Ca 0.44 -1.14 -0.22 0.00 -0.26 0.00 0.00 60.65 59.47 1f5l s ILE 108 Cb -0.16 -3.42 0.07 0.00 1.25 0.00 0.00 42.46 40.20 1f5l s ILE 108 CO 0.11 -0.20 0.68 0.00 0.24 0.00 0.00 174.94 175.77 1f5l s ARG 109 N -3.43 0.77 0.99 0.37 1.70 -0.88 -4.69 118.95 113.79 1f5l s ARG 109 Ca 0.32 0.98 -0.16 0.00 -0.47 0.00 0.00 55.73 56.40 1f5l s ARG 109 Cb -0.09 0.35 0.21 0.00 -0.57 0.00 0.00 34.95 34.84 1f5l s ARG 109 CO 0.25 -0.10 1.29 -1.54 -1.08 0.00 0.00 175.30 174.12 1f5l s SER 110 N 0.55 2.89 0.32 -2.89 1.04 0.47 -0.92 113.70 115.16 1f5l s SER 110 Ca -0.02 0.33 0.02 0.00 0.48 0.00 0.00 55.95 56.76 1f5l s SER 110 Cb -0.05 -0.42 0.57 0.00 0.10 0.00 0.00 66.02 66.23 1f5l s SER 110 CO -0.02 -2.88 1.94 0.11 0.98 0.00 0.00 173.24 173.37 1f5l h LYS 110 N -1.74 0.94 0.00 4.02 1.79 -1.89 -1.04 116.57 118.64 1f5l h LYS 110 Ca -0.45 -0.06 0.00 0.00 -2.18 0.00 0.00 60.65 57.97 1f5l h LYS 110 Cb 1.24 -0.21 0.00 0.00 -1.58 0.00 0.00 32.23 31.68 1f5l h LYS 110 CO 0.39 0.62 0.00 0.39 -1.08 0.00 0.00 179.45 179.76 1f5l n GLU 110 N -4.47 0.93 -1.01 3.15 4.71 -1.26 -4.88 120.64 117.81 1f5l n GLU 110 Ca 0.12 0.00 -0.01 0.00 -0.01 0.00 0.00 57.16 57.26 1f5l n GLU 110 Cb 0.16 -1.27 -0.00 0.00 -1.01 0.00 0.00 31.44 29.32 1f5l n GLU 110 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1f5l n GLY 110 N 0.66 0.47 3.90 0.62 0.00 -0.40 -5.05 105.19 105.40 1f5l n GLY 110 Ca 0.12 -0.44 -0.24 0.00 0.00 0.00 0.00 46.02 45.47 1f5l n GLY 110 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1f5l s ARG 110 N -0.96 3.24 0.07 1.61 0.52 -1.26 -4.74 118.95 117.43 1f5l s ARG 110 Ca 0.00 -0.79 -0.00 0.00 -0.52 0.00 0.00 55.73 54.42 1f5l s ARG 110 Cb 0.00 -2.80 0.01 0.00 0.52 0.00 0.00 34.95 32.68 1f5l s ARG 110 CO 0.00 0.46 0.10 0.00 0.02 0.00 0.00 175.30 175.88 1f5l s ALA 112 N -2.86 3.47 -0.26 0.00 0.00 -0.26 -4.86 121.76 116.99 1f5l s ALA 112 Ca 0.06 1.25 -0.03 0.00 0.00 0.00 0.00 51.96 53.24 1f5l s ALA 112 Cb -0.00 -3.47 0.02 0.00 0.00 0.00 0.00 23.12 19.66 1f5l s ALA 112 CO 0.04 -0.64 -0.01 -0.65 0.00 0.00 0.00 175.76 174.50 1f5l s GLN 113 N -1.83 2.92 0.34 0.00 -1.52 -1.26 -4.77 119.66 113.54 1f5l s GLN 113 Ca 0.50 -0.94 -0.27 0.00 -1.95 0.00 0.00 55.36 52.70 1f5l s GLN 113 Cb -0.39 -3.12 -0.12 0.00 -0.22 0.00 0.00 33.01 29.15 1f5l s GLN 113 CO 0.52 -0.42 1.11 -2.30 -0.25 0.00 0.00 175.29 173.96 1f5l n PRO 114 N 4.74 1.63 -1.87 2.91 -0.02 -1.26 -4.87 135.00 136.26 1f5l n PRO 114 Ca -0.16 0.57 -0.03 0.00 -2.02 0.00 0.00 63.50 61.87 1f5l n PRO 114 Cb 0.47 -2.07 -0.00 0.00 -0.02 0.00 0.00 33.50 31.89 1f5l n PRO 114 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1f5l n SER 115 N 0.87 -0.42 0.21 2.55 3.41 0.14 -4.95 113.62 115.44 1f5l n SER 115 Ca 0.08 -1.40 0.06 0.00 -0.26 0.00 0.00 58.87 57.35 1f5l n SER 115 Cb 0.35 0.73 0.47 0.00 -0.26 0.00 0.00 64.21 65.50 1f5l n SER 115 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 1f5l h ARG 116 N 0.00 0.00 -0.04 4.33 2.43 -1.99 -2.92 114.38 116.19 1f5l h ARG 116 Ca -0.07 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.10 1f5l h ARG 116 Cb 0.28 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.83 1f5l h ARG 116 CO 0.09 0.29 0.00 0.25 -1.51 0.00 0.00 179.97 179.09 1f5l n THR 117 N -3.85 0.03 -3.68 0.20 -2.24 -1.26 -4.70 114.28 98.78 1f5l n THR 117 Ca -0.02 -0.52 -0.26 0.00 -2.27 0.00 0.00 64.05 60.99 1f5l n THR 117 Cb 0.37 1.35 -0.17 0.00 -2.10 0.00 0.00 70.33 69.78 1f5l n THR 117 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1f5l s ILE 118 N -1.51 0.19 0.07 2.28 1.01 -1.10 -3.73 121.20 118.40 1f5l s ILE 118 Ca 0.22 -0.24 -0.07 0.00 0.00 0.00 0.00 60.65 60.56 1f5l s ILE 118 Cb 0.15 -0.71 -0.01 0.00 0.01 0.00 0.00 42.46 41.90 1f5l s ILE 118 CO 0.23 -0.17 0.13 -1.10 0.00 0.00 0.00 174.94 174.03 1f5l s GLN 119 N 2.02 0.74 0.38 2.79 -0.21 -0.66 -0.68 119.66 124.04 1f5l s GLN 119 Ca 0.01 -0.95 -0.00 0.00 0.02 0.00 0.00 55.36 54.44 1f5l s GLN 119 Cb -0.16 0.29 -0.03 0.00 1.00 0.00 0.00 33.01 34.11 1f5l s GLN 119 CO -0.08 -0.21 0.60 0.95 -2.12 0.00 0.00 175.29 174.43 1f5l s THR 120 N -3.56 4.96 0.14 -0.19 -4.23 -1.26 -2.97 115.64 108.53 1f5l s THR 120 Ca 0.03 -0.36 0.08 0.00 -1.18 0.00 0.00 61.69 60.26 1f5l s THR 120 Cb 0.04 -3.82 -0.04 0.00 1.34 0.00 0.00 72.50 70.02 1f5l s THR 120 CO -0.09 -0.58 -0.13 0.27 -0.54 0.00 0.00 174.62 173.55 1f5l s ILE 121 N -2.41 3.13 0.27 2.99 -5.25 -0.61 -4.86 121.20 114.47 1f5l s ILE 121 Ca 0.42 -1.49 -0.29 0.00 -0.99 0.00 0.00 60.65 58.30 1f5l s ILE 121 Cb -0.10 -2.49 -0.09 0.00 2.95 0.00 0.00 42.46 42.73 1f5l s ILE 121 CO 0.38 0.03 0.96 -0.44 -1.79 0.00 0.00 174.94 174.08 1f5l s SER 122 N -2.41 7.48 0.52 4.36 0.01 -1.25 -4.63 113.70 117.79 1f5l s SER 122 Ca 0.22 1.96 -0.08 0.00 1.31 0.00 0.00 55.95 59.35 1f5l s SER 122 Cb -0.10 -2.60 -0.04 0.00 0.21 0.00 0.00 66.02 63.49 1f5l s SER 122 CO 0.13 0.04 0.87 -0.76 0.41 0.00 0.00 173.24 173.93 1f5l s LEU 123 N -1.52 3.51 0.91 2.44 1.43 -1.26 -1.20 118.68 122.99 1f5l s LEU 123 Ca 0.45 1.12 -0.14 0.00 -1.03 0.00 0.00 54.13 54.52 1f5l s LEU 123 Cb -0.24 -4.10 0.15 0.00 0.03 0.00 0.00 46.19 42.03 1f5l s LEU 123 CO 0.30 -0.67 1.22 -2.84 0.23 0.00 0.00 176.35 174.60 1f5l s PRO 124 N -4.82 1.10 0.43 1.29 0.02 -1.26 -4.83 135.00 126.92 1f5l s PRO 124 Ca 0.50 -0.05 -0.05 0.00 0.02 0.00 0.00 61.00 61.42 1f5l s PRO 124 Cb -0.11 -1.87 -0.04 0.00 0.02 0.00 0.00 34.50 32.51 1f5l s PRO 124 CO 0.47 -2.16 0.72 -1.12 -0.33 0.00 0.00 177.00 174.58 1f5l s SER 125 N -4.53 6.33 -0.22 2.53 0.01 -1.26 -4.97 113.70 111.60 1f5l s SER 125 Ca 0.67 0.87 -0.36 0.00 1.31 0.00 0.00 55.95 58.44 1f5l s SER 125 Cb -0.09 -2.22 -0.13 0.00 0.21 0.00 0.00 66.02 63.79 1f5l s SER 125 CO 0.52 -0.46 1.91 0.80 0.41 0.00 0.00 173.24 176.41 1f5l n MET 126 N -1.88 1.58 -3.86 12.44 1.56 -1.26 -2.16 117.12 123.55 1f5l n MET 126 Ca -0.00 0.56 -0.25 0.00 -0.27 0.00 0.00 57.70 57.74 1f5l n MET 126 Cb 0.55 -2.43 -0.00 0.00 2.15 0.00 0.00 33.22 33.49 1f5l n MET 126 CO 0.00 0.00 0.00 0.66 -0.73 0.00 0.00 175.97 175.90 1f5l n TYR 127 N 6.98 -1.74 -3.52 1.12 4.02 -1.25 -4.96 117.16 117.82 1f5l n TYR 127 Ca 0.28 0.74 -0.28 0.00 -0.01 0.00 0.00 57.90 58.63 1f5l n TYR 127 Cb 0.22 -3.87 -0.11 0.00 -0.02 0.00 0.00 39.34 35.56 1f5l n TYR 127 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 176.86 177.06 1f5l s ASN 128 N -4.28 2.63 0.29 7.72 2.47 -0.92 -5.12 114.94 117.73 1f5l s ASN 128 Ca 0.05 -2.80 0.07 0.00 0.42 0.00 0.00 52.86 50.60 1f5l s ASN 128 Cb -0.02 -0.65 -0.03 0.00 -1.45 0.00 0.00 41.25 39.10 1f5l s ASN 128 CO 0.87 -0.22 0.31 -1.81 -3.72 0.00 0.00 177.10 172.52 1f5l s ASP 129 N 0.27 5.69 0.62 -4.21 1.01 -1.26 -4.40 116.67 114.39 1f5l s ASP 129 Ca 0.25 -0.25 -0.16 0.00 0.71 0.00 0.00 52.55 53.10 1f5l s ASP 129 Cb -0.10 -1.34 -0.02 0.00 1.01 0.00 0.00 42.92 42.47 1f5l s ASP 129 CO -0.10 -0.21 1.11 -2.84 0.21 0.00 0.00 175.17 173.34 1f5l s PRO 130 N -3.97 3.01 0.57 8.23 0.02 -1.26 -4.98 135.00 136.61 1f5l s PRO 130 Ca 0.38 1.43 -0.19 0.00 0.02 0.00 0.00 61.00 62.63 1f5l s PRO 130 Cb -0.08 -1.98 -0.05 0.00 0.02 0.00 0.00 34.50 32.42 1f5l s PRO 130 CO 0.27 -1.09 1.16 -0.65 -0.33 0.00 0.00 177.00 176.36 1f5l s GLN 131 N -3.87 3.19 0.47 5.54 -1.52 -1.26 -4.96 119.66 117.25 1f5l s GLN 131 Ca 0.68 1.69 -0.24 0.00 -1.95 0.00 0.00 55.36 55.54 1f5l s GLN 131 Cb -0.21 -1.97 -0.07 0.00 -0.22 0.00 0.00 33.01 30.54 1f5l s GLN 131 CO 0.37 -1.00 1.32 -0.06 -0.25 0.00 0.00 175.29 175.67 1f5l s PHE 132 N -1.72 2.58 0.00 0.91 0.40 -1.26 -2.61 117.98 116.28 1f5l s PHE 132 Ca 0.74 1.40 0.00 0.00 -0.60 0.00 0.00 56.93 58.47 1f5l s PHE 132 Cb -0.26 -3.70 0.00 0.00 0.51 0.00 0.00 43.02 39.56 1f5l s PHE 132 CO 0.30 -2.41 0.00 0.41 0.70 0.00 0.00 175.22 174.22 1f5l n GLY 133 N 0.63 0.17 3.73 4.36 0.00 -0.00 -4.99 105.19 109.08 1f5l n GLY 133 Ca 0.07 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.68 1f5l n GLY 133 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1f5l s THR 134 N -2.00 4.03 0.16 2.61 2.01 -1.07 -4.72 115.64 116.66 1f5l s THR 134 Ca 0.00 1.68 -0.30 0.00 0.31 0.00 0.00 61.69 63.38 1f5l s THR 134 Cb 0.00 -4.07 -0.07 0.00 0.01 0.00 0.00 72.50 68.37 1f5l s THR 134 CO 0.00 0.26 0.98 -0.44 -0.69 0.00 0.00 174.62 174.72 1f5l s SER 135 N 0.12 7.51 0.09 3.53 0.01 -1.26 -1.81 113.70 121.89 1f5l s SER 135 Ca 0.50 1.89 0.01 0.00 1.31 0.00 0.00 55.95 59.66 1f5l s SER 135 Cb -0.28 -2.60 -0.04 0.00 0.21 0.00 0.00 66.02 63.31 1f5l s SER 135 CO 0.33 -0.02 -0.04 0.00 0.41 0.00 0.00 173.24 173.92 1f5l s GLU 137 N -3.88 1.95 0.11 0.00 -1.05 0.27 -0.52 118.70 115.59 1f5l s GLU 137 Ca 0.12 -1.22 0.06 0.00 -0.15 0.00 0.00 54.97 53.78 1f5l s GLU 137 Cb 0.06 -2.15 -0.04 0.00 -0.44 0.00 0.00 34.13 31.57 1f5l s GLU 137 CO -0.06 0.46 -0.14 0.96 0.95 0.00 0.00 175.26 177.43 1f5l s ILE 138 N -1.46 1.29 0.02 1.83 -4.36 -0.61 -0.52 121.20 117.39 1f5l s ILE 138 Ca 0.22 -1.65 -0.00 0.00 -0.26 0.00 0.00 60.65 58.96 1f5l s ILE 138 Cb -0.10 -1.46 -0.02 0.00 1.25 0.00 0.00 42.46 42.13 1f5l s ILE 138 CO 0.13 -0.39 -0.03 -0.89 0.24 0.00 0.00 174.94 174.00 1f5l s THR 139 N -2.01 0.13 0.00 8.37 2.01 -1.24 -2.02 115.64 120.87 1f5l s THR 139 Ca 0.07 -1.04 0.00 0.00 0.31 0.00 0.00 61.69 61.03 1f5l s THR 139 Cb -0.06 -0.45 0.00 0.00 0.01 0.00 0.00 72.50 72.01 1f5l s THR 139 CO 0.03 -0.57 0.00 0.61 -0.69 0.00 0.00 174.62 174.00 1f5l n GLY 140 N 1.38 1.12 1.55 4.40 0.00 -0.89 -4.47 105.19 108.28 1f5l n GLY 140 Ca -0.23 -0.90 0.08 0.00 0.00 0.00 0.00 46.02 44.98 1f5l n GLY 140 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1f5l n PHE 141 N -0.40 1.55 -0.85 1.61 3.72 -1.26 -2.42 117.46 119.41 1f5l n PHE 141 Ca 0.00 -0.67 -0.30 0.00 -0.05 0.00 0.00 57.45 56.43 1f5l n PHE 141 Cb 0.00 -0.32 0.25 0.00 -0.94 0.00 0.00 39.48 38.46 1f5l n PHE 141 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 1f5l s GLY 142 N -1.01 1.53 0.50 1.37 0.00 -1.26 -3.99 107.32 104.46 1f5l s GLY 142 Ca 0.50 -0.76 -0.23 0.00 0.00 0.00 0.00 44.72 44.23 1f5l s GLY 142 CO 0.20 0.11 1.29 0.28 0.00 0.00 0.00 173.10 174.98 1f5l n LYS 143 N -4.94 1.75 0.06 2.90 5.02 -0.48 -2.76 118.16 119.72 1f5l n LYS 143 Ca 0.11 0.64 0.08 0.00 -2.02 0.00 0.00 58.31 57.11 1f5l n LYS 143 Cb 0.59 -2.47 -0.05 0.00 -0.02 0.00 0.00 35.03 33.08 1f5l n LYS 143 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1f5l n GLU 144 N -0.55 0.62 -3.79 1.97 1.02 -1.26 -0.82 120.64 117.83 1f5l n GLU 144 Ca 0.09 0.09 -0.11 0.00 -0.02 0.00 0.00 57.16 57.21 1f5l n GLU 144 Cb 0.43 -1.77 -0.08 0.00 -0.02 0.00 0.00 31.44 30.00 1f5l n GLU 144 CO 0.00 0.00 0.00 -0.80 1.18 0.00 0.00 177.13 177.51 1f5l s ASN 145 N -5.33 -0.08 0.43 1.62 -0.87 -1.26 -4.30 114.94 105.15 1f5l s ASN 145 Ca -0.03 -0.22 0.17 0.00 -1.57 0.00 0.00 52.86 51.22 1f5l s ASN 145 Cb 0.10 0.33 0.97 0.00 -0.02 0.00 0.00 41.25 42.63 1f5l s ASN 145 CO 0.82 -0.57 1.93 0.28 -2.57 0.00 0.00 177.10 176.98 1f5l h SER 146 N 3.39 0.00 0.81 -1.22 0.02 -1.92 -2.76 113.55 111.88 1f5l h SER 146 Ca -0.32 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.63 1f5l h SER 146 Cb 1.19 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.73 1f5l h SER 146 CO 0.46 0.25 -0.06 0.35 -1.14 0.00 0.00 176.83 176.69 1f5l n THR 147 N -4.04 0.00 -2.60 -2.27 -2.24 -1.26 -4.87 114.28 97.00 1f5l n THR 147 Ca -0.02 -0.00 -0.35 0.00 -2.27 0.00 0.00 64.05 61.41 1f5l n THR 147 Cb 0.32 -0.39 -0.04 0.00 -2.10 0.00 0.00 70.33 68.12 1f5l n THR 147 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1f5l s ASP 148 N -2.88 6.66 0.00 3.42 1.01 -1.04 -4.96 116.67 118.88 1f5l s ASP 148 Ca 0.18 1.93 0.07 0.00 0.71 0.00 0.00 52.55 55.44 1f5l s ASP 148 Cb 0.19 -2.57 -0.04 0.00 1.01 0.00 0.00 42.92 41.51 1f5l s ASP 148 CO 0.53 -0.56 0.42 0.00 0.21 0.00 0.00 175.17 175.77 1f5l n TYR 149 N -0.48 0.00 -4.35 4.23 4.11 -1.26 -4.98 117.16 114.44 1f5l n TYR 149 Ca 0.07 0.00 -0.27 0.00 -0.00 0.00 0.00 57.90 57.70 1f5l n TYR 149 Cb 0.51 0.00 -0.10 0.00 -0.00 0.00 0.00 39.34 39.75 1f5l n TYR 149 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.86 176.35 1f5l s LEU 150 N -1.92 2.75 0.19 -3.48 1.43 -1.26 -5.14 118.68 111.24 1f5l s LEU 150 Ca 0.04 -0.70 -0.05 0.00 -1.03 0.00 0.00 54.13 52.40 1f5l s LEU 150 Cb 0.06 -1.45 -0.06 0.00 0.03 0.00 0.00 46.19 44.77 1f5l s LEU 150 CO 0.25 0.11 0.43 -0.31 0.23 0.00 0.00 176.35 177.06 1f5l s TYR 151 N -1.70 3.47 0.52 0.29 2.02 -1.26 -4.78 117.35 115.90 1f5l s TYR 151 Ca 0.23 0.58 -0.22 0.00 -0.37 0.00 0.00 57.07 57.29 1f5l s TYR 151 Cb -0.08 -2.03 -0.06 0.00 -0.40 0.00 0.00 41.96 39.39 1f5l s TYR 151 CO 0.13 0.36 1.34 -1.25 -1.57 0.00 0.00 175.55 174.55 1f5l s PRO 152 N -2.94 3.33 0.26 -1.71 0.04 -1.26 -4.92 135.00 127.80 1f5l s PRO 152 Ca 0.42 2.18 0.12 0.00 0.04 0.00 0.00 61.00 63.76 1f5l s PRO 152 Cb -0.12 -2.34 0.28 0.00 0.04 0.00 0.00 34.50 32.36 1f5l s PRO 152 CO 0.26 -1.03 1.55 1.49 0.04 0.00 0.00 177.00 179.31 1f5l h GLU 153 N 1.69 0.00 -6.00 4.56 4.57 -1.97 -3.43 114.58 114.00 1f5l h GLU 153 Ca -0.51 0.00 -0.68 0.00 -1.18 0.00 0.00 59.36 57.00 1f5l h GLU 153 Cb 1.29 0.00 -0.15 0.00 -0.16 0.00 0.00 28.75 29.73 1f5l h GLU 153 CO 0.58 0.64 -0.62 -1.14 -1.18 0.00 0.00 179.01 177.29 1f5l s GLN 154 N -3.35 2.96 0.55 1.92 2.00 -1.26 -0.78 119.66 121.70 1f5l s GLN 154 Ca -0.00 -0.43 -0.22 0.00 -2.00 0.00 0.00 55.36 52.71 1f5l s GLN 154 Cb 0.11 -2.78 -0.05 0.00 0.80 0.00 0.00 33.01 31.10 1f5l s GLN 154 CO 0.76 0.69 1.35 -0.11 -0.50 0.00 0.00 175.29 177.48 1f5l n LEU 155 N 2.02 5.52 -4.39 3.68 7.94 -0.77 -4.89 117.00 126.11 1f5l n LEU 155 Ca -0.18 0.97 -0.20 0.00 -1.11 0.00 0.00 56.01 55.49 1f5l n LEU 155 Cb 0.53 -1.57 -0.10 0.00 0.53 0.00 0.00 43.42 42.81 1f5l n LEU 155 CO 0.29 -0.62 -0.31 -0.54 -1.11 0.00 0.00 177.39 175.10 1f5l s LYS 156 N -2.90 1.50 0.08 1.96 1.02 -1.01 -1.46 119.74 118.93 1f5l s LYS 156 Ca 0.72 -1.79 -0.18 0.00 0.02 0.00 0.00 55.97 54.75 1f5l s LYS 156 Cb -0.42 -0.80 0.04 0.00 -0.52 0.00 0.00 37.83 36.13 1f5l s LYS 156 CO 0.49 -0.11 0.42 0.00 -0.92 0.00 0.00 175.35 175.23 1f5l s MET 157 N -3.85 1.01 0.23 1.68 0.23 -0.43 -2.10 119.30 116.08 1f5l s MET 157 Ca 0.32 -0.51 -0.17 0.00 -1.03 0.00 0.00 55.69 54.30 1f5l s MET 157 Cb 0.06 0.45 0.02 0.00 -1.53 0.00 0.00 34.83 33.83 1f5l s MET 157 CO 0.12 -0.37 0.55 -0.08 -2.03 0.00 0.00 175.02 173.21 1f5l s THR 158 N -3.12 0.01 -0.11 3.16 -1.32 -0.86 -1.29 115.64 112.11 1f5l s THR 158 Ca -0.01 -1.04 0.01 0.00 -1.21 0.00 0.00 61.69 59.44 1f5l s THR 158 Cb 0.00 -1.88 -0.01 0.00 -1.51 0.00 0.00 72.50 69.10 1f5l s THR 158 CO -0.07 -0.06 -0.15 -0.69 -2.21 0.00 0.00 174.62 171.44 1f5l s VAL 159 N -3.93 2.86 0.24 5.08 1.01 -1.26 -1.58 120.40 122.83 1f5l s VAL 159 Ca 0.14 -0.74 0.04 0.00 0.00 0.00 0.00 61.98 61.42 1f5l s VAL 159 Cb -0.02 -2.17 -0.05 0.00 0.00 0.00 0.00 36.38 34.13 1f5l s VAL 159 CO 0.03 0.54 -0.02 0.68 0.00 0.00 0.00 175.10 176.33 1f5l s VAL 160 N 0.21 1.22 -0.09 2.92 -7.23 0.33 -4.80 120.40 112.94 1f5l s VAL 160 Ca -0.09 -2.06 0.00 0.00 -1.81 0.00 0.00 61.98 58.02 1f5l s VAL 160 Cb -0.16 -2.36 -0.03 0.00 0.56 0.00 0.00 36.38 34.40 1f5l s VAL 160 CO 0.06 -0.33 -0.09 -0.54 -0.31 0.00 0.00 175.10 173.89 1f5l s LYS 161 N -3.82 3.01 0.20 4.82 1.02 0.32 -0.47 119.74 124.81 1f5l s LYS 161 Ca 0.28 -0.59 -0.31 0.00 0.02 0.00 0.00 55.97 55.37 1f5l s LYS 161 Cb 0.05 -2.62 -0.10 0.00 -0.52 0.00 0.00 37.83 34.64 1f5l s LYS 161 CO 0.09 0.49 1.45 -0.51 -0.92 0.00 0.00 175.35 175.96 1f5l s LEU 162 N -0.35 4.38 -0.09 3.17 1.02 -0.75 -1.42 118.68 124.64 1f5l s LEU 162 Ca 0.05 2.57 -0.00 0.00 0.02 0.00 0.00 54.13 56.76 1f5l s LEU 162 Cb -0.12 -3.61 -0.03 0.00 0.02 0.00 0.00 46.19 42.45 1f5l s LEU 162 CO 0.02 -0.71 -0.05 -0.63 0.02 0.00 0.00 176.35 175.00 1f5l s ILE 163 N 0.47 3.81 0.75 -0.59 1.01 -0.14 -0.82 121.20 125.69 1f5l s ILE 163 Ca 0.63 -0.43 -0.14 0.00 0.00 0.00 0.00 60.65 60.70 1f5l s ILE 163 Cb -0.41 -2.58 0.05 0.00 0.01 0.00 0.00 42.46 39.53 1f5l s ILE 163 CO 0.38 0.58 1.20 -0.94 0.00 0.00 0.00 174.94 176.16 1f5l s SER 164 N -0.61 4.07 0.26 3.58 1.04 -1.26 -4.15 113.70 116.62 1f5l s SER 164 Ca 0.09 2.34 -0.05 0.00 0.48 0.00 0.00 55.95 58.82 1f5l s SER 164 Cb -0.12 -2.59 0.29 0.00 0.10 0.00 0.00 66.02 63.71 1f5l s SER 164 CO 0.02 -2.35 1.88 -0.74 0.98 0.00 0.00 173.24 173.03 1f5l h HIS 165 N -0.45 1.14 -0.68 5.02 2.76 -1.96 -1.79 115.15 119.19 1f5l h HIS 165 Ca -0.47 -0.03 0.01 0.00 -2.20 0.00 0.00 60.37 57.68 1f5l h HIS 165 Cb 1.29 -0.36 -0.03 0.00 1.55 0.00 0.00 27.41 29.86 1f5l h HIS 165 CO 0.47 0.79 0.45 -0.09 -1.30 0.00 0.00 177.93 178.25 1f5l h ARG 166 N 1.16 0.88 -0.47 5.26 2.43 -1.97 -0.15 114.38 121.51 1f5l h ARG 166 Ca 0.29 -0.05 -0.14 0.00 -0.81 0.00 0.00 59.98 59.27 1f5l h ARG 166 Cb 0.04 -0.20 -0.01 0.00 -0.42 0.00 0.00 29.97 29.38 1f5l h ARG 166 CO -0.05 0.58 -0.24 1.49 -1.51 0.00 0.00 179.97 180.25 1f5l h GLU 167 N 0.90 1.00 0.00 0.20 4.81 -1.84 -2.97 114.58 116.68 1f5l h GLU 167 Ca 0.25 -0.44 -0.02 0.00 -0.13 0.00 0.00 59.36 59.02 1f5l h GLU 167 Cb -0.09 -0.03 -0.00 0.00 0.63 0.00 0.00 28.75 29.26 1f5l h GLU 167 CO -0.06 1.12 -0.07 0.00 -0.73 0.00 0.00 179.01 179.27 1f5l n GLN 169 N -3.18 1.72 -1.68 0.00 6.02 -0.10 -2.10 117.38 118.06 1f5l n GLN 169 Ca 0.01 -1.10 -0.33 0.00 -0.01 0.00 0.00 57.00 55.57 1f5l n GLN 169 Cb 0.37 -1.36 0.06 0.00 1.02 0.00 0.00 30.24 30.34 1f5l n GLN 169 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 1f5l s GLN 170 N -1.73 2.63 0.23 -1.09 -1.52 -1.06 -3.71 119.66 113.41 1f5l s GLN 170 Ca 0.30 1.48 -0.06 0.00 -1.95 0.00 0.00 55.36 55.12 1f5l s GLN 170 Cb 0.16 -1.92 0.34 0.00 -0.22 0.00 0.00 33.01 31.37 1f5l s GLN 170 CO 0.23 -1.39 1.79 -1.35 -0.25 0.00 0.00 175.29 174.31 1f5l h PRO 170 N -0.05 0.62 0.00 2.91 0.11 -1.91 -1.26 132.00 132.42 1f5l h PRO 170 Ca -0.47 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.60 1f5l h PRO 170 Cb 1.26 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 32.23 1f5l h PRO 170 CO 0.53 0.41 0.00 0.72 -0.21 0.00 0.00 178.00 179.45 1f5l n HIS 170 N -4.84 0.52 0.00 0.65 8.25 -1.26 -4.46 115.22 114.07 1f5l n HIS 170 Ca 0.11 0.17 0.00 0.00 -0.26 0.00 0.00 57.72 57.75 1f5l n HIS 170 Cb 0.27 -0.78 0.00 0.00 1.12 0.00 0.00 29.99 30.60 1f5l n HIS 170 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 1f5l n TYR 171 N -1.94 0.00 -0.02 4.41 4.02 -0.79 -4.80 117.16 118.04 1f5l n TYR 171 Ca 0.05 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.94 1f5l n TYR 171 Cb 0.31 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.63 1f5l n TYR 171 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 176.86 176.51 1f5l n TYR 172 N 0.00 0.00 -4.81 -0.72 4.01 -0.89 -4.91 117.16 109.83 1f5l n TYR 172 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 1f5l n TYR 172 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.03 1f5l n TYR 172 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1f5l n GLY 173 N 0.64 1.65 0.00 2.72 0.00 -0.54 -2.74 105.19 106.91 1f5l n GLY 173 Ca 0.00 -0.58 0.06 0.00 0.00 0.00 0.00 46.02 45.50 1f5l n GLY 173 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1f5l n SER 174 N -0.29 0.00 0.12 1.61 7.64 -1.26 -3.59 113.62 117.85 1f5l n SER 174 Ca 0.00 -1.24 -0.02 0.00 1.01 0.00 0.00 58.87 58.61 1f5l n SER 174 Cb 0.00 0.00 0.13 0.00 -1.01 0.00 0.00 64.21 63.33 1f5l n SER 174 CO 0.00 0.00 0.00 -0.33 -3.01 0.00 0.00 175.04 171.70 1f5l h GLU 175 N 0.00 0.03 -6.13 1.43 5.08 -1.90 -3.42 114.58 109.66 1f5l h GLU 175 Ca 0.00 -0.02 -0.57 0.00 -1.00 0.00 0.00 59.36 57.77 1f5l h GLU 175 Cb 0.00 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.20 1f5l h GLU 175 CO 0.00 0.68 -0.01 0.14 -1.00 0.00 0.00 179.01 178.82 1f5l s VAL 176 N -3.53 4.86 0.50 3.13 -7.23 -1.24 -4.89 120.40 112.00 1f5l s VAL 176 Ca -0.01 1.26 0.02 0.00 -1.81 0.00 0.00 61.98 61.44 1f5l s VAL 176 Cb 0.12 -3.93 0.02 0.00 0.56 0.00 0.00 36.38 33.15 1f5l s VAL 176 CO 0.77 0.45 0.19 0.35 -0.31 0.00 0.00 175.10 176.55 1f5l n THR 177 N 2.50 0.00 0.54 5.32 -2.24 -1.26 -4.95 114.28 114.19 1f5l n THR 177 Ca -0.07 -2.15 0.10 0.00 -2.27 0.00 0.00 64.05 59.66 1f5l n THR 177 Cb 0.51 0.20 0.42 0.00 -2.10 0.00 0.00 70.33 69.36 1f5l n THR 177 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1f5l n THR 178 N -1.44 0.77 1.43 4.28 -2.24 -1.26 -1.95 114.28 113.87 1f5l n THR 178 Ca -0.11 0.16 0.10 0.00 -2.27 0.00 0.00 64.05 61.93 1f5l n THR 178 Cb 0.59 -0.95 0.42 0.00 -2.10 0.00 0.00 70.33 68.30 1f5l n THR 178 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1f5l n LYS 179 N -1.83 1.54 -4.36 -0.78 5.02 -1.26 -4.88 118.16 111.62 1f5l n LYS 179 Ca 0.04 -0.81 -0.19 0.00 -2.02 0.00 0.00 58.31 55.32 1f5l n LYS 179 Cb 0.24 -1.37 -0.10 0.00 -0.02 0.00 0.00 35.03 33.78 1f5l n LYS 179 CO 0.00 0.00 0.00 -1.64 -0.52 0.00 0.00 177.40 175.24 1f5l s MET 180 N -1.85 1.36 -0.00 1.97 -1.94 -0.82 -1.67 119.30 116.36 1f5l s MET 180 Ca 0.31 -1.59 0.05 0.00 -1.71 0.00 0.00 55.69 52.74 1f5l s MET 180 Cb 0.16 -1.21 -0.01 0.00 2.01 0.00 0.00 34.83 35.77 1f5l s MET 180 CO 0.25 0.21 -0.15 -0.51 -0.01 0.00 0.00 175.02 174.81 1f5l s LEU 181 N -3.28 2.05 0.04 -0.03 1.43 0.76 -4.79 118.68 114.86 1f5l s LEU 181 Ca 0.23 -0.29 0.02 0.00 -1.03 0.00 0.00 54.13 53.06 1f5l s LEU 181 Cb -0.02 -0.74 -0.04 0.00 0.03 0.00 0.00 46.19 45.43 1f5l s LEU 181 CO 0.08 0.16 0.03 0.00 0.23 0.00 0.00 176.35 176.85 1f5l s ALA 183 N -1.23 -1.46 0.19 0.00 0.00 -0.70 -0.96 121.76 117.60 1f5l s ALA 183 Ca 0.24 1.54 -0.24 0.00 0.00 0.00 0.00 51.96 53.50 1f5l s ALA 183 Cb -0.12 -0.79 0.06 0.00 0.00 0.00 0.00 23.12 22.28 1f5l s ALA 183 CO 0.15 -0.29 0.94 0.00 0.00 0.00 0.00 175.76 176.57 1f5l s ALA 184 N 0.03 -1.54 -0.10 0.00 0.00 -0.51 -1.16 121.76 118.48 1f5l s ALA 184 Ca -0.02 -0.05 -0.22 0.00 0.00 0.00 0.00 51.96 51.67 1f5l s ALA 184 Cb -0.04 0.68 -0.04 0.00 0.00 0.00 0.00 23.12 23.73 1f5l s ALA 184 CO 0.02 -1.04 0.64 0.34 0.00 0.00 0.00 175.76 175.72 1f5l s ASP 185 N -3.03 6.87 0.62 0.00 2.15 -1.26 -0.53 116.67 121.50 1f5l s ASP 185 Ca 0.14 1.04 0.31 0.00 0.43 0.00 0.00 52.55 54.47 1f5l s ASP 185 Cb -0.02 -2.37 1.67 0.00 -0.30 0.00 0.00 42.92 41.89 1f5l s ASP 185 CO 0.04 -0.12 2.01 1.55 -0.17 0.00 0.00 175.17 178.48 1f5l h PRO 185 N 6.87 0.00 -0.14 4.34 0.13 -1.95 0.51 132.00 141.77 1f5l h PRO 185 Ca -0.39 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.74 1f5l h PRO 185 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 1f5l h PRO 185 CO 0.76 0.00 0.00 1.04 -0.23 0.00 0.00 178.00 179.57 1f5l n GLN 185 N -3.42 2.32 -3.27 0.86 6.02 -1.26 -4.99 117.38 113.64 1f5l n GLN 185 Ca 0.02 -2.01 -0.24 0.00 -0.01 0.00 0.00 57.00 54.76 1f5l n GLN 185 Cb 0.41 -1.47 0.03 0.00 1.02 0.00 0.00 30.24 30.23 1f5l n GLN 185 CO 0.00 0.00 0.00 0.91 -1.01 0.00 0.00 177.06 176.96 1f5l n TRP 186 N 1.36 -2.08 -0.11 1.08 7.02 0.17 -4.89 117.44 119.99 1f5l n TRP 186 Ca 0.15 0.61 -0.14 0.00 -1.02 0.00 0.00 57.50 57.11 1f5l n TRP 186 Cb 0.59 -4.14 -0.13 0.00 -2.42 0.00 0.00 31.31 25.22 1f5l n TRP 186 CO 0.00 0.00 0.00 1.63 -2.02 0.00 0.00 177.69 177.30 1f5l n LYS 187 N -4.16 0.72 -4.52 -0.99 4.76 -1.26 -4.69 118.16 108.02 1f5l n LYS 187 Ca -0.06 0.08 -0.29 0.00 -2.87 0.00 0.00 58.31 55.17 1f5l n LYS 187 Cb 0.58 -1.49 -0.13 0.00 -1.84 0.00 0.00 35.03 32.15 1f5l n LYS 187 CO 0.00 0.00 0.00 -0.08 -1.37 0.00 0.00 177.40 175.95 1f5l s THR 188 N -2.48 2.28 -0.05 -0.18 -1.32 -1.26 -4.42 115.64 108.22 1f5l s THR 188 Ca -0.24 -1.63 -0.31 0.00 -1.21 0.00 0.00 61.69 58.30 1f5l s THR 188 Cb 0.07 -1.98 0.12 0.00 -1.51 0.00 0.00 72.50 69.20 1f5l s THR 188 CO 0.65 0.17 1.20 -0.62 -2.21 0.00 0.00 174.62 173.81 1f5l s ASP 189 N -1.84 -0.12 0.62 8.08 2.15 -1.07 -4.02 116.67 120.47 1f5l s ASP 189 Ca 0.14 -0.11 -0.10 0.00 0.43 0.00 0.00 52.55 52.90 1f5l s ASP 189 Cb -0.10 0.21 -0.03 0.00 -0.30 0.00 0.00 42.92 42.69 1f5l s ASP 189 CO 0.05 -0.37 1.02 -0.94 -0.17 0.00 0.00 175.17 174.76 1f5l s SER 190 N -2.68 6.12 0.13 -0.34 1.04 -1.26 -0.21 113.70 116.50 1f5l s SER 190 Ca 0.12 1.33 0.01 0.00 0.48 0.00 0.00 55.95 57.88 1f5l s SER 190 Cb 0.02 -2.37 -0.00 0.00 0.10 0.00 0.00 66.02 63.77 1f5l s SER 190 CO -0.04 -0.91 0.16 0.00 0.98 0.00 0.00 173.24 173.43 1f5l n GLN 192 N -0.22 2.11 0.00 0.00 7.27 -1.26 -1.33 117.38 123.95 1f5l n GLN 192 Ca 0.01 0.76 0.00 0.00 0.07 0.00 0.00 57.00 57.84 1f5l n GLN 192 Cb 0.22 -2.53 0.00 0.00 2.41 0.00 0.00 30.24 30.34 1f5l n GLN 192 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1f5l n GLY 193 N 3.43 2.41 0.03 1.69 0.00 -1.26 -1.38 105.19 110.11 1f5l n GLY 193 Ca 0.17 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.32 1f5l n GLY 193 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1f5l n ASP 194 N 0.00 0.39 -4.56 1.61 8.00 -0.44 -4.02 116.55 117.53 1f5l n ASP 194 Ca 0.00 0.28 -0.43 0.00 0.71 0.00 0.00 54.79 55.35 1f5l n ASP 194 Cb 0.00 -0.28 -0.00 0.00 -0.02 0.00 0.00 41.12 40.82 1f5l n ASP 194 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1f5l n SER 195 N -1.75 0.76 0.00 -2.24 7.64 -1.26 -1.85 113.62 114.93 1f5l n SER 195 Ca 0.06 1.08 0.00 0.00 1.01 0.00 0.00 58.87 61.02 1f5l n SER 195 Cb 0.37 -1.26 0.00 0.00 -1.01 0.00 0.00 64.21 62.31 1f5l n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1f5l n GLY 196 N 1.35 2.84 3.68 0.23 0.00 -0.23 -0.87 105.19 112.20 1f5l n GLY 196 Ca 0.10 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.83 1f5l n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1f5l s GLY 197 N -1.73 1.57 0.24 -0.02 0.00 -0.77 -3.27 107.32 103.35 1f5l s GLY 197 Ca 0.00 -0.54 -0.11 0.00 0.00 0.00 0.00 44.72 44.07 1f5l s GLY 197 CO 0.00 0.13 0.58 2.56 0.00 0.00 0.00 173.10 176.37 1f5l s PRO 198 N -5.13 3.85 -0.36 2.90 0.04 -1.26 -1.43 135.00 133.62 1f5l s PRO 198 Ca 0.67 0.36 -0.00 0.00 0.04 0.00 0.00 61.00 62.06 1f5l s PRO 198 Cb -0.16 -2.62 0.09 0.00 0.04 0.00 0.00 34.50 31.85 1f5l s PRO 198 CO 0.57 0.29 0.10 -1.17 0.04 0.00 0.00 177.00 176.82 1f5l s LEU 199 N -2.81 4.72 -0.19 -3.56 2.96 0.04 -3.70 118.68 116.15 1f5l s LEU 199 Ca 0.48 -1.89 -0.09 0.00 -0.22 0.00 0.00 54.13 52.41 1f5l s LEU 199 Cb -0.11 -1.73 -0.05 0.00 0.50 0.00 0.00 46.19 44.81 1f5l s LEU 199 CO 0.20 -0.41 0.12 -0.69 -1.32 0.00 0.00 176.35 174.25 1f5l s VAL 200 N 1.08 5.30 -0.02 1.68 1.01 0.32 -1.57 120.40 128.21 1f5l s VAL 200 Ca 0.05 0.15 0.04 0.00 0.00 0.00 0.00 61.98 62.22 1f5l s VAL 200 Cb -0.21 -3.40 -0.01 0.00 0.00 0.00 0.00 36.38 32.76 1f5l s VAL 200 CO -0.05 0.46 -0.14 0.00 0.00 0.00 0.00 175.10 175.37 1f5l s SER 202 N -0.21 6.16 -0.28 0.00 0.15 -1.26 -1.08 113.70 117.19 1f5l s SER 202 Ca 0.03 -0.47 -0.09 0.00 0.70 0.00 0.00 55.95 56.12 1f5l s SER 202 Cb -0.07 -2.56 -0.03 0.00 -1.71 0.00 0.00 66.02 61.66 1f5l s SER 202 CO -0.00 -1.83 0.12 -0.22 1.20 0.00 0.00 173.24 172.52 1f5l s LEU 203 N 5.68 3.78 -1.41 3.45 0.20 0.12 -4.60 118.68 125.91 1f5l s LEU 203 Ca 0.35 -0.27 -0.01 0.00 0.69 0.00 0.00 54.13 54.88 1f5l s LEU 203 Cb -0.08 -1.99 0.01 0.00 -0.43 0.00 0.00 46.19 43.70 1f5l s LEU 203 CO 0.15 -0.09 0.47 0.00 -0.29 0.00 0.00 176.35 176.59 1f5l n GLN 204 N 4.97 -3.53 -3.30 1.98 6.02 -1.26 -2.08 117.38 120.18 1f5l n GLN 204 Ca -0.15 0.43 -0.16 0.00 -0.01 0.00 0.00 57.00 57.12 1f5l n GLN 204 Cb 0.51 -4.65 0.08 0.00 1.02 0.00 0.00 30.24 27.20 1f5l n GLN 204 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1f5l n GLY 205 N -1.91 -0.63 3.60 1.08 0.00 -1.26 -5.02 105.19 101.05 1f5l n GLY 205 Ca -0.29 0.27 -0.02 0.00 0.00 0.00 0.00 46.02 45.98 1f5l n GLY 205 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1f5l s ARG 206 N -4.93 0.38 0.01 1.61 3.52 -0.88 -5.13 118.95 113.53 1f5l s ARG 206 Ca 0.17 0.72 -0.30 0.00 -0.13 0.00 0.00 55.73 56.19 1f5l s ARG 206 Cb -0.02 0.17 -0.07 0.00 -1.56 0.00 0.00 34.95 33.47 1f5l s ARG 206 CO 0.71 -0.09 1.56 -1.64 -0.81 0.00 0.00 175.30 175.03 1f5l s MET 207 N 1.61 4.22 -0.02 5.12 -1.94 -1.26 -0.70 119.30 126.33 1f5l s MET 207 Ca -0.08 2.16 0.04 0.00 -1.71 0.00 0.00 55.69 56.10 1f5l s MET 207 Cb -0.04 -3.69 -0.01 0.00 2.01 0.00 0.00 34.83 33.10 1f5l s MET 207 CO -0.16 -0.71 -0.13 0.99 -0.01 0.00 0.00 175.02 175.00 1f5l s THR 208 N 2.92 1.06 -0.93 2.05 2.01 -0.24 -3.77 115.64 118.73 1f5l s THR 208 Ca 0.70 -0.56 -0.24 0.00 0.31 0.00 0.00 61.69 61.90 1f5l s THR 208 Cb -0.35 -0.90 0.04 0.00 0.01 0.00 0.00 72.50 71.30 1f5l s THR 208 CO 0.29 0.31 1.45 -0.22 -0.69 0.00 0.00 174.62 175.76 1f5l s LEU 209 N -0.20 3.39 0.03 4.42 0.20 -0.34 -1.72 118.68 124.46 1f5l s LEU 209 Ca 0.03 -1.11 0.04 0.00 0.69 0.00 0.00 54.13 53.78 1f5l s LEU 209 Cb -0.06 -2.57 -0.24 0.00 -0.43 0.00 0.00 46.19 42.89 1f5l s LEU 209 CO -0.00 -1.70 0.95 0.74 -0.29 0.00 0.00 176.35 176.06 1f5l h THR 210 N 6.65 1.27 -3.67 3.68 2.02 -1.62 -3.39 112.91 117.86 1f5l h THR 210 Ca 0.06 -2.98 -0.06 0.00 0.77 0.00 0.00 66.41 64.20 1f5l h THR 210 Cb 1.02 2.71 -0.10 0.00 -1.74 0.00 0.00 68.15 70.05 1f5l h THR 210 CO 1.37 0.79 -0.15 -0.83 0.37 0.00 0.00 175.52 177.08 1f5l s GLY 211 N -4.91 0.45 -0.09 2.16 0.00 -0.96 -2.57 107.32 101.40 1f5l s GLY 211 Ca -0.05 -0.80 0.03 0.00 0.00 0.00 0.00 44.72 43.90 1f5l s GLY 211 CO 0.84 -0.63 -0.17 -0.42 0.00 0.00 0.00 173.10 172.72 1f5l s ILE 212 N -3.99 1.57 -0.06 0.90 1.01 -1.01 -0.78 121.20 118.85 1f5l s ILE 212 Ca 0.20 -0.71 -0.33 0.00 0.00 0.00 0.00 60.65 59.80 1f5l s ILE 212 Cb 0.00 -1.40 -0.11 0.00 0.01 0.00 0.00 42.46 40.96 1f5l s ILE 212 CO 0.05 0.45 1.92 0.52 0.00 0.00 0.00 174.94 177.88 1f5l n VAL 213 N 3.87 0.64 0.03 2.92 0.31 -0.51 -0.88 118.33 124.71 1f5l n VAL 213 Ca -0.20 -0.12 -0.01 0.00 -0.01 0.00 0.00 64.34 64.00 1f5l n VAL 213 Cb 0.52 -2.01 -0.00 0.00 -0.91 0.00 0.00 33.84 31.44 1f5l n VAL 213 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1f5l n SER 214 N 6.96 0.99 -3.30 4.52 2.88 -0.71 -1.07 113.62 123.90 1f5l n SER 214 Ca 0.22 0.13 -0.09 0.00 -1.33 0.00 0.00 58.87 57.81 1f5l n SER 214 Cb 0.33 -0.32 0.00 0.00 -0.75 0.00 0.00 64.21 63.47 1f5l n SER 214 CO 0.00 0.00 0.00 -1.66 -1.23 0.00 0.00 175.04 172.15 1f5l s TRP 215 N -2.08 0.11 0.00 0.66 1.48 -0.90 -4.94 118.94 113.27 1f5l s TRP 215 Ca -0.03 -0.67 0.00 0.00 -1.06 0.00 0.00 56.10 54.34 1f5l s TRP 215 Cb 0.01 0.70 0.00 0.00 -1.16 0.00 0.00 33.47 33.01 1f5l s TRP 215 CO 0.04 -1.41 0.00 0.41 -4.06 0.00 0.00 176.95 171.94 1f5l n GLY 216 N -0.50 1.65 3.56 3.67 0.00 -1.26 0.04 105.19 112.34 1f5l n GLY 216 Ca -0.06 -0.53 -0.43 0.00 0.00 0.00 0.00 46.02 45.00 1f5l n GLY 216 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1f5l s ARG 217 N -2.00 3.51 3.11 1.61 6.06 -1.26 -4.88 118.95 125.09 1f5l s ARG 217 Ca 0.00 0.12 0.00 0.00 -2.50 0.00 0.00 55.73 53.35 1f5l s ARG 217 Cb 0.00 -3.93 0.00 0.00 0.06 0.00 0.00 34.95 31.08 1f5l s ARG 217 CO 0.00 -1.23 0.00 0.41 -2.50 0.00 0.00 175.30 171.98 1f5l n GLY 219 N 4.95 0.68 2.73 8.12 0.00 -1.26 -4.63 105.19 115.78 1f5l n GLY 219 Ca 0.06 -0.84 -0.19 0.00 0.00 0.00 0.00 46.02 45.05 1f5l n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1f5l n ALA 221 N 4.82 -0.94 -2.42 0.00 0.00 -1.26 -4.92 120.51 115.80 1f5l n ALA 221 Ca -0.13 0.28 -0.38 0.00 0.00 0.00 0.00 53.44 53.21 1f5l n ALA 221 Cb 0.50 -3.83 -0.06 0.00 0.00 0.00 0.00 19.45 16.06 1f5l n ALA 221 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1f5l s LEU 222 N -6.35 4.49 0.22 0.00 1.43 -1.26 -4.73 118.68 112.49 1f5l s LEU 222 Ca 0.31 1.07 -0.32 0.00 -1.03 0.00 0.00 54.13 54.16 1f5l s LEU 222 Cb -0.13 -2.71 -0.13 0.00 0.03 0.00 0.00 46.19 43.24 1f5l s LEU 222 CO 0.38 0.30 1.49 1.17 0.23 0.00 0.00 176.35 179.92 1f5l n LYS 223 N 1.76 2.15 -1.30 1.70 4.81 -1.26 -1.82 118.16 124.20 1f5l n LYS 223 Ca -0.12 0.77 -0.10 0.00 -0.87 0.00 0.00 58.31 57.98 1f5l n LYS 223 Cb 0.52 -2.48 -0.04 0.00 0.02 0.00 0.00 35.03 33.04 1f5l n LYS 223 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 1f5l n ASP 223 N 2.60 -5.13 -3.65 3.14 8.00 -1.26 -4.92 116.55 115.33 1f5l n ASP 223 Ca 0.13 0.26 -0.27 0.00 0.71 0.00 0.00 54.79 55.62 1f5l n ASP 223 Cb 0.31 -3.54 -0.10 0.00 -0.02 0.00 0.00 41.12 37.76 1f5l n ASP 223 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1f5l n LYS 224 N -1.53 1.50 -1.03 -1.24 4.76 -0.76 -4.21 118.16 115.65 1f5l n LYS 224 Ca -0.10 -4.13 -0.30 0.00 -2.87 0.00 0.00 58.31 50.90 1f5l n LYS 224 Cb 0.49 -2.06 0.14 0.00 -1.84 0.00 0.00 35.03 31.76 1f5l n LYS 224 CO 0.00 0.00 0.00 -2.14 -1.37 0.00 0.00 177.40 173.89 1f5l s PRO 225 N -1.28 1.39 0.34 1.97 0.02 -1.26 -4.41 135.00 131.76 1f5l s PRO 225 Ca 0.30 1.15 -0.26 0.00 0.02 0.00 0.00 61.00 62.21 1f5l s PRO 225 Cb 0.03 -1.80 -0.10 0.00 0.02 0.00 0.00 34.50 32.65 1f5l s PRO 225 CO -0.14 -2.24 1.00 0.20 -0.33 0.00 0.00 177.00 175.48 1f5l s GLY 226 N -3.13 2.83 -0.10 0.52 0.00 -0.30 -4.61 107.32 102.53 1f5l s GLY 226 Ca 0.64 0.63 -0.00 0.00 0.00 0.00 0.00 44.72 45.99 1f5l s GLY 226 CO 0.57 1.10 -0.08 0.14 0.00 0.00 0.00 173.10 174.83 1f5l s VAL 227 N -1.55 3.55 0.09 1.40 1.01 0.11 -1.72 120.40 123.30 1f5l s VAL 227 Ca 0.51 -0.51 0.08 0.00 0.00 0.00 0.00 61.98 62.06 1f5l s VAL 227 Cb -0.22 -2.48 -0.03 0.00 0.00 0.00 0.00 36.38 33.65 1f5l s VAL 227 CO 0.28 0.55 -0.21 -0.31 0.00 0.00 0.00 175.10 175.41 1f5l s TYR 228 N -0.25 1.80 0.03 5.22 1.51 0.19 -1.73 117.35 124.12 1f5l s TYR 228 Ca 0.03 -0.41 -0.30 0.00 -1.01 0.00 0.00 57.07 55.38 1f5l s TYR 228 Cb -0.13 -1.00 -0.05 0.00 -0.11 0.00 0.00 41.96 40.67 1f5l s TYR 228 CO 0.03 0.19 1.28 0.99 -1.11 0.00 0.00 175.55 176.92 1f5l s THR 229 N -1.10 3.90 -0.90 -0.71 2.01 -0.06 -0.17 115.64 118.61 1f5l s THR 229 Ca 0.07 1.32 -0.25 0.00 0.31 0.00 0.00 61.69 63.14 1f5l s THR 229 Cb -0.10 -3.85 0.03 0.00 0.01 0.00 0.00 72.50 68.59 1f5l s THR 229 CO 0.04 0.05 1.49 -0.60 -0.69 0.00 0.00 174.62 174.91 1f5l s ARG 230 N 1.65 3.29 0.34 4.92 3.52 -0.67 -2.39 118.95 129.60 1f5l s ARG 230 Ca 0.60 -0.66 0.10 0.00 -0.13 0.00 0.00 55.73 55.64 1f5l s ARG 230 Cb -0.30 -4.93 0.85 0.00 -1.56 0.00 0.00 34.95 29.01 1f5l s ARG 230 CO 0.27 -2.37 1.79 0.28 -0.81 0.00 0.00 175.30 174.46 1f5l h VAL 231 N 6.65 0.67 0.00 7.11 2.07 -1.79 -1.98 116.25 128.97 1f5l h VAL 231 Ca 0.02 -0.22 -0.00 0.00 0.82 0.00 0.00 66.70 67.32 1f5l h VAL 231 Cb 1.03 -0.03 -0.00 0.00 -1.52 0.00 0.00 31.29 30.77 1f5l h VAL 231 CO 1.35 0.12 -0.00 0.77 0.02 0.00 0.00 177.57 179.82 1f5l h SER 232 N 0.65 0.00 0.03 0.57 4.64 -1.87 -1.35 113.55 116.21 1f5l h SER 232 Ca 0.57 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.89 1f5l h SER 232 Cb 1.04 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.13 1f5l h SER 232 CO -0.34 0.00 -0.03 1.41 -0.87 0.00 0.00 176.83 177.01 1f5l n HIS 233 N -3.86 0.00 -0.05 4.77 8.25 -0.74 -3.78 115.22 119.80 1f5l n HIS 233 Ca -0.03 0.00 0.02 0.00 -0.26 0.00 0.00 57.72 57.45 1f5l n HIS 233 Cb 0.09 -0.02 0.06 0.00 1.12 0.00 0.00 29.99 31.24 1f5l n HIS 233 CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 1f5l n PHE 234 N -0.09 0.18 -0.31 4.41 3.01 -0.51 -4.76 117.46 119.39 1f5l n PHE 234 Ca 0.19 -0.47 0.07 0.00 1.01 0.00 0.00 57.45 58.25 1f5l n PHE 234 Cb 0.32 -0.04 0.23 0.00 -0.01 0.00 0.00 39.48 39.98 1f5l n PHE 234 CO 0.00 0.00 0.00 -0.07 1.01 0.00 0.00 176.76 177.70 1f5l h LEU 235 N 0.84 0.61 -0.58 4.37 3.38 -1.68 0.34 115.31 122.59 1f5l h LEU 235 Ca 0.00 0.08 -0.01 0.00 0.09 0.00 0.00 57.88 58.04 1f5l h LEU 235 Cb 0.57 -0.02 -0.03 0.00 0.09 0.00 0.00 40.66 41.27 1f5l h LEU 235 CO 0.00 0.27 0.31 -0.65 0.09 0.00 0.00 178.44 178.46 1f5l h PRO 236 N 0.69 0.82 -0.48 1.13 0.11 -1.91 -0.47 132.00 131.90 1f5l h PRO 236 Ca 0.47 -0.10 -0.04 0.00 0.11 0.00 0.00 66.00 66.43 1f5l h PRO 236 Cb 0.62 -0.16 -0.02 0.00 0.11 0.00 0.00 31.00 31.56 1f5l h PRO 236 CO -0.34 0.64 0.12 2.35 -0.21 0.00 0.00 178.00 180.56 1f5l h TRP 237 N 0.79 0.79 0.02 0.65 7.01 -1.65 -1.12 115.95 122.44 1f5l h TRP 237 Ca 0.20 -0.09 -0.00 0.00 2.11 0.00 0.00 58.89 61.11 1f5l h TRP 237 Cb 0.07 -0.23 0.00 0.00 -2.10 0.00 0.00 29.16 26.90 1f5l h TRP 237 CO -0.01 0.71 -0.01 0.82 -2.79 0.00 0.00 178.44 177.17 1f5l h ILE 238 N 0.64 1.06 -0.75 2.65 2.04 -0.76 -2.78 117.51 119.62 1f5l h ILE 238 Ca 0.15 -0.25 -0.04 0.00 1.00 0.00 0.00 64.86 65.72 1f5l h ILE 238 Cb 0.31 1.23 -0.03 0.00 -0.74 0.00 0.00 36.82 37.60 1f5l h ILE 238 CO 0.00 0.06 0.31 0.03 0.00 0.00 0.00 178.15 178.56 1f5l h ARG 239 N -0.13 1.12 0.00 2.37 3.08 -1.03 -2.01 114.38 117.77 1f5l h ARG 239 Ca -0.00 -0.19 -0.06 0.00 0.07 0.00 0.00 59.98 59.79 1f5l h ARG 239 Cb 0.12 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 29.98 1f5l h ARG 239 CO 0.00 0.90 -0.28 0.66 -1.07 0.00 0.00 179.97 180.18 1f5l h SER 240 N 1.08 0.00 0.56 7.04 4.64 -1.17 -3.12 113.55 122.58 1f5l h SER 240 Ca 0.25 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.50 1f5l h SER 240 Cb 0.19 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.27 1f5l h SER 240 CO -0.02 0.28 -1.50 1.41 -0.87 0.00 0.00 176.83 176.13 1f5l n HIS 241 N -3.84 0.63 1.50 4.77 8.25 -1.05 -5.10 115.22 120.38 1f5l n HIS 241 Ca -0.01 0.19 0.14 0.00 -0.26 0.00 0.00 57.72 57.78 1f5l n HIS 241 Cb 0.37 -0.87 0.53 0.00 1.12 0.00 0.00 29.99 31.14 1f5l n HIS 241 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23