#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2mfn s LEU 2 N 0.00 2.07 0.48 0.99 1.43 -1.26 -4.99 118.68 117.40 2mfn s LEU 2 Ca 0.00 -0.53 -0.21 0.00 -1.03 0.00 0.00 54.13 52.36 2mfn s LEU 2 Cb 0.00 -1.38 -0.08 0.00 0.03 0.00 0.00 46.19 44.75 2mfn s LEU 2 CO 0.00 0.22 1.05 -1.81 0.23 0.00 0.00 176.35 176.04 2mfn s ASP 3 N -0.01 6.35 0.02 2.29 1.01 -1.26 -4.55 116.67 120.53 2mfn s ASP 3 Ca -0.08 1.98 -0.27 0.00 0.71 0.00 0.00 52.55 54.88 2mfn s ASP 3 Cb -0.15 -2.57 -0.04 0.00 1.01 0.00 0.00 42.92 41.17 2mfn s ASP 3 CO 0.05 -0.77 0.87 -0.55 0.21 0.00 0.00 175.17 174.98 2mfn s SER 4 N -1.87 7.28 -1.03 0.27 0.15 -1.26 -4.81 113.70 112.43 2mfn s SER 4 Ca 0.66 1.54 -0.26 0.00 0.70 0.00 0.00 55.95 58.60 2mfn s SER 4 Cb -0.18 -2.52 -0.23 0.00 -1.71 0.00 0.00 66.02 61.38 2mfn s SER 4 CO 0.22 -0.12 2.06 -0.81 1.20 0.00 0.00 173.24 175.79 2mfn n PRO 5 N 3.35 0.08 0.00 5.44 -0.04 -1.26 -4.86 135.00 137.72 2mfn n PRO 5 Ca 0.02 -1.62 0.00 0.00 -0.04 0.00 0.00 63.50 61.85 2mfn n PRO 5 Cb 0.50 -3.81 0.00 0.00 -0.04 0.00 0.00 33.50 30.16 2mfn n PRO 5 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2mfn n THR 6 N 8.90 0.00 -1.02 0.52 -2.24 -1.26 -4.25 114.28 114.93 2mfn n THR 6 Ca 0.39 0.00 -0.01 0.00 -2.27 0.00 0.00 64.05 62.16 2mfn n THR 6 Cb 0.47 -1.63 -0.00 0.00 -2.10 0.00 0.00 70.33 67.07 2mfn n THR 6 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2mfn n GLY 7 N 5.00 0.45 3.75 3.38 0.00 -1.26 0.12 105.19 116.63 2mfn n GLY 7 Ca 0.00 -0.96 -0.42 0.00 0.00 0.00 0.00 46.02 44.65 2mfn n GLY 7 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2mfn n PHE 8 N -2.98 2.90 -3.56 1.61 -0.00 -1.26 -4.17 117.46 110.01 2mfn n PHE 8 Ca -0.01 0.23 -0.17 0.00 -0.00 0.00 0.00 57.45 57.50 2mfn n PHE 8 Cb 0.03 -2.61 -0.06 0.00 -0.00 0.00 0.00 39.48 36.83 2mfn n PHE 8 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.76 177.10 2mfn s ASP 9 N 0.55 -0.63 -0.11 -2.13 -1.08 -0.33 -4.97 116.67 107.97 2mfn s ASP 9 Ca 0.64 0.74 0.01 0.00 -0.52 0.00 0.00 52.55 53.42 2mfn s ASP 9 Cb -0.49 0.62 -0.02 0.00 -1.46 0.00 0.00 42.92 41.58 2mfn s ASP 9 CO 0.47 -0.55 -0.13 -0.94 0.52 0.00 0.00 175.17 174.54 2mfn s SER 10 N -1.02 4.04 0.22 -0.34 1.04 -1.26 -0.63 113.70 115.75 2mfn s SER 10 Ca -0.10 -0.29 -0.02 0.00 0.48 0.00 0.00 55.95 56.03 2mfn s SER 10 Cb -0.01 -1.43 0.01 0.00 0.10 0.00 0.00 66.02 64.68 2mfn s SER 10 CO 0.08 0.21 0.31 -1.54 0.98 0.00 0.00 173.24 173.29 2mfn n SER 11 N 3.22 -0.87 -4.05 7.02 3.41 -0.92 -4.88 113.62 116.56 2mfn n SER 11 Ca -0.18 -2.16 -0.29 0.00 -0.26 0.00 0.00 58.87 55.98 2mfn n SER 11 Cb 0.53 1.61 -0.03 0.00 -0.26 0.00 0.00 64.21 66.07 2mfn n SER 11 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2mfn n ASP 12 N -1.79 -1.21 -4.70 4.04 8.00 -1.26 -1.64 116.55 117.99 2mfn n ASP 12 Ca 0.00 -1.02 -0.41 0.00 0.71 0.00 0.00 54.79 54.07 2mfn n ASP 12 Cb 0.36 -2.92 -0.04 0.00 -0.02 0.00 0.00 41.12 38.51 2mfn n ASP 12 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2mfn s ILE 13 N -3.78 4.90 0.29 0.53 -1.09 -1.26 -0.85 121.20 119.94 2mfn s ILE 13 Ca 0.23 1.81 0.10 0.00 -2.23 0.00 0.00 60.65 60.55 2mfn s ILE 13 Cb -0.12 -4.21 -0.05 0.00 -1.58 0.00 0.00 42.46 36.50 2mfn s ILE 13 CO 0.90 0.13 -0.03 0.42 -1.23 0.00 0.00 174.94 175.13 2mfn s THR 14 N 1.36 3.04 0.04 2.92 -4.23 1.61 -4.63 115.64 115.75 2mfn s THR 14 Ca 0.45 -2.02 -0.27 0.00 -1.18 0.00 0.00 61.69 58.67 2mfn s THR 14 Cb -0.19 -2.73 -0.17 0.00 1.34 0.00 0.00 72.50 70.75 2mfn s THR 14 CO 0.20 -0.33 1.46 0.00 -0.54 0.00 0.00 174.62 175.42 2mfn h ALA 15 N 1.93 -0.50 -0.02 3.99 0.00 -1.81 -2.94 119.26 119.92 2mfn h ALA 15 Ca -0.43 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.32 2mfn h ALA 15 Cb 1.25 0.19 0.00 0.00 0.00 0.00 0.00 17.79 19.24 2mfn h ALA 15 CO 0.62 -0.70 0.00 0.09 0.00 0.00 0.00 179.25 179.26 2mfn n ASN 16 N -5.24 1.66 -3.58 0.00 3.02 -1.26 -3.55 115.26 106.32 2mfn n ASN 16 Ca -0.10 -1.55 -0.11 0.00 -0.03 0.00 0.00 54.58 52.78 2mfn n ASN 16 Cb 0.26 -0.00 -0.04 0.00 -0.61 0.00 0.00 39.78 39.38 2mfn n ASN 16 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 2mfn s SER 17 N -2.00 -0.35 -0.07 6.41 1.04 -1.12 0.41 113.70 118.03 2mfn s SER 17 Ca 0.37 -0.15 -0.30 0.00 0.48 0.00 0.00 55.95 56.35 2mfn s SER 17 Cb 0.21 0.50 0.09 0.00 0.10 0.00 0.00 66.02 66.92 2mfn s SER 17 CO 0.33 -0.85 0.78 0.72 0.98 0.00 0.00 173.24 175.20 2mfn s PHE 18 N -3.51 -0.55 0.28 5.02 -0.12 -0.91 0.46 117.98 118.64 2mfn s PHE 18 Ca 0.01 0.89 -0.00 0.00 -0.05 0.00 0.00 56.93 57.77 2mfn s PHE 18 Cb 0.01 0.44 -0.04 0.00 -0.63 0.00 0.00 43.02 42.79 2mfn s PHE 18 CO -0.10 -0.54 0.48 0.99 -0.05 0.00 0.00 175.22 176.00 2mfn s THR 19 N -1.40 5.14 0.18 -4.49 2.01 -0.03 -2.05 115.64 115.00 2mfn s THR 19 Ca -0.07 -0.38 0.07 0.00 0.31 0.00 0.00 61.69 61.62 2mfn s THR 19 Cb -0.00 -3.79 -0.05 0.00 0.01 0.00 0.00 72.50 68.67 2mfn s THR 19 CO 0.05 -0.36 -0.13 -0.69 -0.69 0.00 0.00 174.62 172.80 2mfn s VAL 20 N -2.09 1.53 0.03 3.82 1.01 -0.72 -2.17 120.40 121.83 2mfn s VAL 20 Ca 0.40 -2.16 -0.15 0.00 0.00 0.00 0.00 61.98 60.07 2mfn s VAL 20 Cb -0.10 -1.97 0.03 0.00 0.00 0.00 0.00 36.38 34.33 2mfn s VAL 20 CO 0.32 -0.65 0.34 -1.00 0.00 0.00 0.00 175.10 174.10 2mfn s HIS 21 N -3.10 -0.16 0.13 5.22 3.76 0.20 -2.34 115.29 118.99 2mfn s HIS 21 Ca 0.20 0.09 -0.16 0.00 -0.15 0.00 0.00 55.06 55.05 2mfn s HIS 21 Cb 0.00 0.13 0.04 0.00 1.11 0.00 0.00 32.58 33.86 2mfn s HIS 21 CO 0.04 -0.51 0.40 1.67 -0.85 0.00 0.00 174.74 175.50 2mfn s TRP 22 N -2.35 -0.21 0.49 1.40 -2.14 -0.94 -1.18 118.94 114.02 2mfn s TRP 22 Ca -0.06 -0.11 -0.09 0.00 2.66 0.00 0.00 56.10 58.49 2mfn s TRP 22 Cb -0.01 0.26 -0.05 0.00 -3.10 0.00 0.00 33.47 30.57 2mfn s TRP 22 CO -0.02 -0.70 0.85 0.08 -2.66 0.00 0.00 176.95 174.50 2mfn s VAL 23 N -3.80 4.79 -0.27 -0.66 1.01 0.33 -4.84 120.40 116.95 2mfn s VAL 23 Ca 0.03 0.58 -0.12 0.00 0.00 0.00 0.00 61.98 62.47 2mfn s VAL 23 Cb 0.02 -3.81 -0.05 0.00 0.00 0.00 0.00 36.38 32.54 2mfn s VAL 23 CO -0.12 -0.80 0.23 0.00 0.00 0.00 0.00 175.10 174.41 2mfn s ALA 24 N -2.71 3.54 0.63 5.51 0.00 -1.26 -4.24 121.76 123.23 2mfn s ALA 24 Ca 0.51 -1.01 -0.18 0.00 0.00 0.00 0.00 51.96 51.28 2mfn s ALA 24 Cb -0.10 -2.52 -0.02 0.00 0.00 0.00 0.00 23.12 20.48 2mfn s ALA 24 CO 0.41 -0.54 1.29 -1.25 0.00 0.00 0.00 175.76 175.67 2mfn s PRO 25 N 1.76 2.67 0.11 0.00 0.05 -1.26 -4.89 135.00 133.44 2mfn s PRO 25 Ca 0.09 2.04 0.27 0.00 0.05 0.00 0.00 61.00 63.45 2mfn s PRO 25 Cb -0.16 -1.89 1.00 0.00 0.05 0.00 0.00 34.50 33.50 2mfn s PRO 25 CO 0.10 -1.50 1.82 0.54 0.05 0.00 0.00 177.00 178.01 2mfn n ARG 26 N -1.78 0.13 -2.34 4.56 1.74 -1.26 -4.81 116.66 112.90 2mfn n ARG 26 Ca 0.15 0.13 -0.34 0.00 -0.77 0.00 0.00 57.85 57.02 2mfn n ARG 26 Cb 0.48 -1.66 -0.01 0.00 -1.02 0.00 0.00 32.46 30.25 2mfn n ARG 26 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2mfn s ALA 27 N -3.06 2.76 0.11 7.54 0.00 -1.26 -4.94 121.76 122.91 2mfn s ALA 27 Ca 0.12 0.69 -0.32 0.00 0.00 0.00 0.00 51.96 52.44 2mfn s ALA 27 Cb 0.15 -3.31 -0.12 0.00 0.00 0.00 0.00 23.12 19.85 2mfn s ALA 27 CO 0.54 -0.61 1.77 -0.35 0.00 0.00 0.00 175.76 177.11 2mfn n PRO 28 N -1.26 2.53 -4.23 0.00 -0.04 -1.26 -4.99 135.00 125.74 2mfn n PRO 28 Ca 0.10 0.92 -0.13 0.00 -0.04 0.00 0.00 63.50 64.35 2mfn n PRO 28 Cb 0.52 -2.77 -0.10 0.00 -0.04 0.00 0.00 33.50 31.11 2mfn n PRO 28 CO 0.00 0.00 0.00 0.96 -0.04 0.00 0.00 175.50 176.42 2mfn s ILE 29 N 2.34 0.44 -0.50 0.52 -4.36 -1.26 -4.71 121.20 113.67 2mfn s ILE 29 Ca 0.82 -1.97 0.05 0.00 -0.26 0.00 0.00 60.65 59.29 2mfn s ILE 29 Cb -0.57 -2.27 0.01 0.00 1.25 0.00 0.00 42.46 40.89 2mfn s ILE 29 CO 0.39 -0.31 0.51 0.35 0.24 0.00 0.00 174.94 176.12 2mfn n THR 30 N -0.26 0.00 -0.89 8.37 -2.24 0.18 -4.89 114.28 114.55 2mfn n THR 30 Ca -0.04 -0.46 0.00 0.00 -2.27 0.00 0.00 64.05 61.28 2mfn n THR 30 Cb 0.64 1.07 0.00 0.00 -2.10 0.00 0.00 70.33 69.95 2mfn n THR 30 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2mfn n GLY 31 N 0.56 -0.60 3.17 3.38 0.00 -1.19 -4.50 105.19 106.00 2mfn n GLY 31 Ca 0.02 -1.61 -0.17 0.00 0.00 0.00 0.00 46.02 44.26 2mfn n GLY 31 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2mfn s TYR 32 N -1.94 1.14 -0.12 1.61 2.02 -0.82 -2.48 117.35 116.76 2mfn s TYR 32 Ca 0.00 -0.51 -0.00 0.00 -0.37 0.00 0.00 57.07 56.19 2mfn s TYR 32 Cb 0.00 -0.64 -0.02 0.00 -0.40 0.00 0.00 41.96 40.90 2mfn s TYR 32 CO 0.00 0.04 -0.11 0.42 -1.57 0.00 0.00 175.55 174.33 2mfn s ILE 33 N -1.57 3.29 -0.10 2.71 1.09 -0.78 -1.15 121.20 124.69 2mfn s ILE 33 Ca -0.01 -0.59 0.03 0.00 -1.10 0.00 0.00 60.65 58.98 2mfn s ILE 33 Cb -0.08 -2.38 -0.01 0.00 -1.06 0.00 0.00 42.46 38.93 2mfn s ILE 33 CO 0.02 0.54 -0.21 -0.63 -0.10 0.00 0.00 174.94 174.56 2mfn s ILE 34 N 0.06 2.37 -0.04 2.92 -1.09 0.67 -0.99 121.20 125.09 2mfn s ILE 34 Ca -0.04 -0.92 0.07 0.00 -2.23 0.00 0.00 60.65 57.53 2mfn s ILE 34 Cb -0.14 -1.93 -0.02 0.00 -1.58 0.00 0.00 42.46 38.79 2mfn s ILE 34 CO 0.04 0.55 -0.25 -0.13 -1.23 0.00 0.00 174.94 173.93 2mfn s ARG 35 N 0.22 2.30 -0.01 2.79 0.52 -0.61 0.21 118.95 124.36 2mfn s ARG 35 Ca -0.13 -0.90 0.04 0.00 -0.52 0.00 0.00 55.73 54.22 2mfn s ARG 35 Cb -0.16 -2.11 -0.01 0.00 0.52 0.00 0.00 34.95 33.18 2mfn s ARG 35 CO 0.07 0.51 -0.13 -1.58 0.02 0.00 0.00 175.30 174.18 2mfn s HIS 36 N -0.47 1.18 -0.04 -0.53 5.65 -0.96 -0.25 115.29 119.87 2mfn s HIS 36 Ca 0.06 -0.22 -0.29 0.00 0.25 0.00 0.00 55.06 54.85 2mfn s HIS 36 Cb -0.11 -0.76 0.09 0.00 -1.18 0.00 0.00 32.58 30.62 2mfn s HIS 36 CO 0.01 -0.02 0.79 -3.38 -0.65 0.00 0.00 174.74 171.48 2mfn s HIS 37 N -0.30 -0.51 0.13 3.88 -3.43 -0.50 -1.94 115.29 112.62 2mfn s HIS 37 Ca 0.05 0.72 -0.05 0.00 -0.80 0.00 0.00 55.06 54.98 2mfn s HIS 37 Cb -0.05 0.47 -0.05 0.00 -1.43 0.00 0.00 32.58 31.51 2mfn s HIS 37 CO -0.00 -0.56 0.36 0.00 -2.00 0.00 0.00 174.74 172.53 2mfn s ALA 38 N -1.88 3.81 0.27 -1.38 0.00 -1.26 0.11 121.76 121.42 2mfn s ALA 38 Ca -0.04 -0.58 -0.05 0.00 0.00 0.00 0.00 51.96 51.29 2mfn s ALA 38 Cb -0.00 -2.10 0.32 0.00 0.00 0.00 0.00 23.12 21.33 2mfn s ALA 38 CO 0.01 0.68 1.94 0.93 0.00 0.00 0.00 175.76 179.32 2mfn h GLU 39 N 2.90 1.25 -0.01 0.00 5.08 -1.93 -0.49 114.58 121.39 2mfn h GLU 39 Ca -0.46 -0.08 0.00 0.00 -1.00 0.00 0.00 59.36 57.82 2mfn h GLU 39 Cb 1.17 -0.28 0.00 0.00 0.50 0.00 0.00 28.75 30.14 2mfn h GLU 39 CO 0.73 0.83 0.00 0.72 -1.00 0.00 0.00 179.01 180.28 2mfn n HIS 40 N -4.39 0.00 -3.26 4.33 8.25 -1.26 -4.79 115.22 114.11 2mfn n HIS 40 Ca 0.11 -0.00 -0.39 0.00 -0.26 0.00 0.00 57.72 57.18 2mfn n HIS 40 Cb 0.02 0.00 -0.07 0.00 1.12 0.00 0.00 29.99 31.06 2mfn n HIS 40 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 2mfn s SER 41 N -1.99 6.57 -0.00 0.41 1.04 -0.19 -4.92 113.70 114.62 2mfn s SER 41 Ca 0.45 0.68 0.21 0.00 0.48 0.00 0.00 55.95 57.77 2mfn s SER 41 Cb 0.22 -2.29 -0.23 0.00 0.10 0.00 0.00 66.02 63.82 2mfn s SER 41 CO 0.36 -0.16 0.90 0.52 0.98 0.00 0.00 173.24 175.84 2mfn n VAL 42 N 4.46 0.00 -0.48 5.02 0.31 -1.26 -4.73 118.33 121.65 2mfn n VAL 42 Ca -0.05 -0.00 -0.29 0.00 -0.01 0.00 0.00 64.34 63.98 2mfn n VAL 42 Cb 0.51 0.99 0.27 0.00 -0.91 0.00 0.00 33.84 34.70 2mfn n VAL 42 CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 2mfn s GLY 43 N -3.01 1.48 0.15 2.92 0.00 -1.26 -4.90 107.32 102.71 2mfn s GLY 43 Ca 0.08 -0.51 -0.31 0.00 0.00 0.00 0.00 44.72 43.99 2mfn s GLY 43 CO 0.87 0.37 1.32 0.50 0.00 0.00 0.00 173.10 176.16 2mfn s ARG 44 N -4.79 4.37 0.30 2.90 3.00 -1.26 -4.95 118.95 118.53 2mfn s ARG 44 Ca 0.69 2.02 -0.30 0.00 0.00 0.00 0.00 55.73 58.14 2mfn s ARG 44 Cb -0.19 -3.23 -0.12 0.00 0.00 0.00 0.00 34.95 31.41 2mfn s ARG 44 CO 0.61 -0.31 1.47 -0.35 0.00 0.00 0.00 175.30 176.72 2mfn n PRO 45 N 3.23 2.42 -1.83 3.54 -0.04 -1.26 -4.96 135.00 136.10 2mfn n PRO 45 Ca 0.08 0.86 -0.32 0.00 -0.04 0.00 0.00 63.50 64.08 2mfn n PRO 45 Cb 0.43 -2.56 0.03 0.00 -0.04 0.00 0.00 33.50 31.36 2mfn n PRO 45 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2mfn s ARG 46 N -1.00 3.08 -0.26 0.54 0.52 -0.82 -4.89 118.95 116.13 2mfn s ARG 46 Ca 0.62 1.15 0.03 0.00 -0.52 0.00 0.00 55.73 57.00 2mfn s ARG 46 Cb -0.55 -2.00 0.06 0.00 0.52 0.00 0.00 34.95 32.98 2mfn s ARG 46 CO 0.54 -0.99 -0.10 -0.65 0.02 0.00 0.00 175.30 174.12 2mfn s GLN 47 N -4.41 2.11 -0.13 3.54 -0.21 -1.26 -2.26 119.66 117.04 2mfn s GLN 47 Ca 0.62 -1.28 0.03 0.00 0.02 0.00 0.00 55.36 54.74 2mfn s GLN 47 Cb -0.16 -2.83 0.01 0.00 1.00 0.00 0.00 33.01 31.03 2mfn s GLN 47 CO 0.44 -0.58 -0.21 -0.51 -2.12 0.00 0.00 175.29 172.31 2mfn s ASP 48 N 1.16 3.00 0.12 5.90 1.01 0.55 -4.98 116.67 123.43 2mfn s ASP 48 Ca -0.08 -0.57 0.06 0.00 0.71 0.00 0.00 52.55 52.66 2mfn s ASP 48 Cb -0.20 -1.39 -0.04 0.00 1.01 0.00 0.00 42.92 42.31 2mfn s ASP 48 CO -0.05 0.08 0.01 -0.13 0.21 0.00 0.00 175.17 175.29 2mfn s ARG 49 N 0.76 2.52 0.03 8.23 1.81 -1.26 0.24 118.95 131.28 2mfn s ARG 49 Ca -0.09 -0.93 0.04 0.00 -1.72 0.00 0.00 55.73 53.04 2mfn s ARG 49 Cb -0.16 -2.49 -0.02 0.00 -0.45 0.00 0.00 34.95 31.84 2mfn s ARG 49 CO -0.00 0.51 -0.13 0.14 -0.68 0.00 0.00 175.30 175.14 2mfn s VAL 50 N -1.46 1.01 0.87 3.52 -7.23 -0.30 -4.82 120.40 111.98 2mfn s VAL 50 Ca 0.26 -0.91 -0.10 0.00 -1.81 0.00 0.00 61.98 59.42 2mfn s VAL 50 Cb -0.11 -0.91 0.12 0.00 0.56 0.00 0.00 36.38 36.04 2mfn s VAL 50 CO 0.19 0.00 1.12 -2.16 -0.31 0.00 0.00 175.10 173.94 2mfn s PRO 51 N -1.03 1.41 0.45 4.82 0.05 -1.26 -1.95 135.00 137.48 2mfn s PRO 51 Ca 0.01 1.38 0.12 0.00 0.05 0.00 0.00 61.00 62.55 2mfn s PRO 51 Cb -0.07 -1.78 1.03 0.00 0.05 0.00 0.00 34.50 33.72 2mfn s PRO 51 CO 0.01 -2.30 2.07 -1.00 0.05 0.00 0.00 177.00 175.82 2mfn h PRO 52 N -1.62 0.34 0.00 0.56 0.13 -1.88 -1.48 132.00 128.04 2mfn h PRO 52 Ca -0.44 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 2mfn h PRO 52 Cb 1.26 -0.08 0.00 0.00 0.13 0.00 0.00 31.00 32.31 2mfn h PRO 52 CO 0.46 0.22 0.00 0.43 -0.23 0.00 0.00 178.00 178.88 2mfn n SER 53 N -4.49 0.15 -4.52 1.44 7.64 -1.26 -4.62 113.62 107.96 2mfn n SER 53 Ca 0.03 0.52 -0.39 0.00 1.01 0.00 0.00 58.87 60.05 2mfn n SER 53 Cb 0.15 -0.56 -0.11 0.00 -1.01 0.00 0.00 64.21 62.67 2mfn n SER 53 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 2mfn s ARG 54 N -3.04 3.65 0.00 1.43 1.81 -0.56 -4.91 118.95 117.33 2mfn s ARG 54 Ca 0.10 -0.51 0.19 0.00 -1.72 0.00 0.00 55.73 53.78 2mfn s ARG 54 Cb 0.13 -3.63 0.15 0.00 -0.45 0.00 0.00 34.95 31.15 2mfn s ARG 54 CO 0.41 -0.30 1.10 0.27 -0.68 0.00 0.00 175.30 176.10 2mfn n ASN 55 N 5.04 2.58 -4.07 0.23 0.23 -1.26 -4.73 115.26 113.28 2mfn n ASN 55 Ca -0.14 -1.79 -0.21 0.00 -0.53 0.00 0.00 54.58 51.91 2mfn n ASN 55 Cb 0.51 0.00 -0.15 0.00 -2.08 0.00 0.00 39.78 38.06 2mfn n ASN 55 CO 0.00 0.00 0.00 -0.94 -0.93 0.00 0.00 177.26 175.39 2mfn s SER 56 N -1.59 1.38 -0.06 0.53 1.04 -1.26 -2.21 113.70 111.54 2mfn s SER 56 Ca 0.22 -0.21 0.02 0.00 0.48 0.00 0.00 55.95 56.46 2mfn s SER 56 Cb 0.16 -0.16 0.01 0.00 0.10 0.00 0.00 66.02 66.13 2mfn s SER 56 CO 0.24 0.14 -0.11 -0.51 0.98 0.00 0.00 173.24 173.99 2mfn s ILE 57 N -0.27 1.00 -0.27 -1.02 2.07 -0.99 -4.94 121.20 116.79 2mfn s ILE 57 Ca 0.04 -0.40 -0.12 0.00 -1.41 0.00 0.00 60.65 58.76 2mfn s ILE 57 Cb -0.05 -0.93 -0.05 0.00 0.13 0.00 0.00 42.46 41.57 2mfn s ILE 57 CO -0.00 0.32 0.23 -0.89 -1.91 0.00 0.00 174.94 172.69 2mfn s THR 58 N 0.69 5.29 -0.09 4.00 2.01 -1.26 -1.75 115.64 124.53 2mfn s THR 58 Ca -0.14 0.27 -0.11 0.00 0.31 0.00 0.00 61.69 62.03 2mfn s THR 58 Cb -0.15 -3.57 -0.05 0.00 0.01 0.00 0.00 72.50 68.74 2mfn s THR 58 CO 0.03 0.24 0.25 -0.76 -0.69 0.00 0.00 174.62 173.69 2mfn s LEU 59 N 1.71 4.39 0.49 4.42 1.43 -0.87 -4.95 118.68 125.30 2mfn s LEU 59 Ca 0.09 0.63 0.02 0.00 -1.03 0.00 0.00 54.13 53.84 2mfn s LEU 59 Cb -0.16 -2.29 -0.01 0.00 0.03 0.00 0.00 46.19 43.77 2mfn s LEU 59 CO 0.10 0.33 0.05 0.42 0.23 0.00 0.00 176.35 177.47 2mfn s THR 60 N -0.77 0.88 -1.34 5.49 -4.23 -1.26 -2.14 115.64 112.27 2mfn s THR 60 Ca 0.18 -2.00 -0.02 0.00 -1.18 0.00 0.00 61.69 58.67 2mfn s THR 60 Cb -0.14 -2.13 0.01 0.00 1.34 0.00 0.00 72.50 71.59 2mfn s THR 60 CO 0.07 0.00 0.73 0.59 -0.54 0.00 0.00 174.62 175.47 2mfn n ASN 61 N -1.35 -1.66 -4.67 3.99 3.02 -1.05 -4.91 115.26 108.63 2mfn n ASN 61 Ca -0.16 -0.82 -0.24 0.00 -0.03 0.00 0.00 54.58 53.33 2mfn n ASN 61 Cb 0.66 -4.01 -0.07 0.00 -0.61 0.00 0.00 39.78 35.75 2mfn n ASN 61 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2mfn s LEU 62 N -6.77 3.30 0.11 3.41 1.43 0.17 -5.03 118.68 115.29 2mfn s LEU 62 Ca 0.10 -0.52 -0.31 0.00 -1.03 0.00 0.00 54.13 52.36 2mfn s LEU 62 Cb -0.05 -1.86 -0.08 0.00 0.03 0.00 0.00 46.19 44.23 2mfn s LEU 62 CO 0.82 0.03 1.36 0.20 0.23 0.00 0.00 176.35 178.98 2mfn s ASN 63 N -3.45 6.87 0.23 2.29 0.02 -1.26 -4.29 114.94 115.34 2mfn s ASN 63 Ca 0.30 2.27 -0.31 0.00 -1.02 0.00 0.00 52.86 54.11 2mfn s ASN 63 Cb -0.07 -2.59 -0.11 0.00 0.02 0.00 0.00 41.25 38.50 2mfn s ASN 63 CO 0.20 -0.62 1.59 -2.16 0.02 0.00 0.00 177.10 176.12 2mfn s PRO 64 N 1.10 4.17 -0.56 -0.60 0.04 -1.23 -3.63 135.00 134.29 2mfn s PRO 64 Ca 0.64 2.48 -0.02 0.00 0.04 0.00 0.00 61.00 64.14 2mfn s PRO 64 Cb -0.36 -3.08 -0.02 0.00 0.04 0.00 0.00 34.50 31.08 2mfn s PRO 64 CO 0.30 -0.61 0.51 0.41 0.04 0.00 0.00 177.00 177.65 2mfn n GLY 65 N 2.98 -0.71 3.25 0.56 0.00 0.29 -4.91 105.19 106.65 2mfn n GLY 65 Ca 0.11 0.25 -0.13 0.00 0.00 0.00 0.00 46.02 46.26 2mfn n GLY 65 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2mfn s THR 66 N -3.10 0.07 -0.26 2.61 2.01 -1.12 -4.85 115.64 110.98 2mfn s THR 66 Ca 0.12 -0.55 -0.18 0.00 0.31 0.00 0.00 61.69 61.40 2mfn s THR 66 Cb -0.02 -0.74 -0.03 0.00 0.01 0.00 0.00 72.50 71.72 2mfn s THR 66 CO 0.48 -0.30 0.50 -1.61 -0.69 0.00 0.00 174.62 173.00 2mfn s GLU 67 N -1.79 4.06 -0.06 4.92 8.01 -1.26 0.20 118.70 132.79 2mfn s GLU 67 Ca -0.10 0.29 0.02 0.00 0.01 0.00 0.00 54.97 55.19 2mfn s GLU 67 Cb -0.03 -3.65 -0.03 0.00 -4.31 0.00 0.00 34.13 26.10 2mfn s GLU 67 CO 0.01 -0.35 -0.08 0.71 0.01 0.00 0.00 175.26 175.56 2mfn s TYR 68 N 2.29 2.88 -0.24 1.61 2.02 0.13 -3.66 117.35 122.39 2mfn s TYR 68 Ca 0.21 -0.02 -0.18 0.00 -0.37 0.00 0.00 57.07 56.71 2mfn s TYR 68 Cb -0.16 -1.68 -0.03 0.00 -0.40 0.00 0.00 41.96 39.69 2mfn s TYR 68 CO 0.09 0.31 0.49 0.08 -1.57 0.00 0.00 175.55 174.95 2mfn s VAL 69 N -0.82 5.10 -0.14 0.71 1.01 0.29 -2.19 120.40 124.36 2mfn s VAL 69 Ca 0.13 0.85 0.02 0.00 0.00 0.00 0.00 61.98 62.98 2mfn s VAL 69 Cb -0.11 -3.81 0.01 0.00 0.00 0.00 0.00 36.38 32.47 2mfn s VAL 69 CO 0.02 0.13 -0.20 -0.69 0.00 0.00 0.00 175.10 174.35 2mfn s VAL 70 N 2.05 2.23 -0.15 2.92 1.01 -0.84 -1.41 120.40 126.21 2mfn s VAL 70 Ca 0.21 -0.93 -0.09 0.00 0.00 0.00 0.00 61.98 61.18 2mfn s VAL 70 Cb -0.15 -1.90 -0.05 0.00 0.00 0.00 0.00 36.38 34.28 2mfn s VAL 70 CO 0.09 0.54 0.15 -0.94 0.00 0.00 0.00 175.10 174.94 2mfn s SER 71 N 0.77 6.33 -0.12 3.32 1.04 0.66 -2.26 113.70 123.44 2mfn s SER 71 Ca -0.08 0.39 0.02 0.00 0.48 0.00 0.00 55.95 56.76 2mfn s SER 71 Cb -0.16 -2.09 -0.01 0.00 0.10 0.00 0.00 66.02 63.86 2mfn s SER 71 CO -0.00 0.30 -0.18 -0.63 0.98 0.00 0.00 173.24 173.71 2mfn s ILE 72 N -0.38 2.64 0.19 -1.02 -1.09 0.52 -1.57 121.20 120.50 2mfn s ILE 72 Ca 0.12 -0.81 0.07 0.00 -2.23 0.00 0.00 60.65 57.81 2mfn s ILE 72 Cb -0.12 -2.08 -0.05 0.00 -1.58 0.00 0.00 42.46 38.64 2mfn s ILE 72 CO 0.02 0.54 -0.13 -0.63 -1.23 0.00 0.00 174.94 173.50 2mfn s ILE 73 N 0.35 1.61 -0.06 2.92 1.01 -0.16 0.68 121.20 127.55 2mfn s ILE 73 Ca -0.14 -2.18 0.03 0.00 0.00 0.00 0.00 60.65 58.36 2mfn s ILE 73 Cb -0.17 -2.00 0.01 0.00 0.01 0.00 0.00 42.46 40.31 2mfn s ILE 73 CO 0.07 -0.63 -0.13 0.00 0.00 0.00 0.00 174.94 174.25 2mfn s ALA 74 N -3.05 1.27 0.10 9.38 0.00 -1.26 -1.86 121.76 126.33 2mfn s ALA 74 Ca 0.21 -0.47 0.06 0.00 0.00 0.00 0.00 51.96 51.77 2mfn s ALA 74 Cb -0.00 -0.52 -0.03 0.00 0.00 0.00 0.00 23.12 22.57 2mfn s ALA 74 CO 0.05 0.15 -0.17 0.14 0.00 0.00 0.00 175.76 175.94 2mfn s VAL 75 N 0.46 1.39 -0.20 0.00 -7.23 -1.03 0.01 120.40 113.80 2mfn s VAL 75 Ca -0.11 -1.50 0.14 0.00 -1.81 0.00 0.00 61.98 58.71 2mfn s VAL 75 Cb -0.14 -1.36 0.44 0.00 0.56 0.00 0.00 36.38 35.88 2mfn s VAL 75 CO 0.03 -0.21 1.19 -3.20 -0.31 0.00 0.00 175.10 172.59 2mfn n ASN 76 N 1.01 2.41 0.00 4.85 5.15 -0.12 0.50 115.26 129.05 2mfn n ASN 76 Ca -0.19 -3.27 0.00 0.00 -0.60 0.00 0.00 54.58 50.52 2mfn n ASN 76 Cb 0.55 -0.43 0.00 0.00 -0.53 0.00 0.00 39.78 39.37 2mfn n ASN 76 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2mfn n GLY 77 N -0.64 1.08 0.11 8.20 0.00 -1.26 -4.10 105.19 108.58 2mfn n GLY 77 Ca 0.22 -0.49 0.12 0.00 0.00 0.00 0.00 46.02 45.86 2mfn n GLY 77 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2mfn h ARG 78 N 0.00 0.00 -6.13 1.61 2.43 -2.03 -3.46 114.38 106.80 2mfn h ARG 78 Ca 0.00 0.00 -0.63 0.00 -0.81 0.00 0.00 59.98 58.54 2mfn h ARG 78 Cb 0.00 0.00 -0.08 0.00 -0.42 0.00 0.00 29.97 29.47 2mfn h ARG 78 CO 0.00 0.00 -0.58 -1.21 -1.51 0.00 0.00 179.97 176.67 2mfn s GLU 79 N -3.34 3.00 0.09 0.20 2.02 -1.26 -5.11 118.70 114.29 2mfn s GLU 79 Ca 0.00 -0.65 0.10 0.00 0.02 0.00 0.00 54.97 54.44 2mfn s GLU 79 Cb 0.10 -2.79 -0.03 0.00 0.10 0.00 0.00 34.13 31.51 2mfn s GLU 79 CO 0.78 0.57 -0.26 -1.21 0.02 0.00 0.00 175.26 175.16 2mfn s GLU 80 N -2.46 1.55 0.26 1.61 2.02 -1.26 -0.95 118.70 119.47 2mfn s GLU 80 Ca 0.31 -1.21 0.07 0.00 0.02 0.00 0.00 54.97 54.15 2mfn s GLU 80 Cb -0.12 -1.87 -0.03 0.00 0.10 0.00 0.00 34.13 32.20 2mfn s GLU 80 CO 0.23 0.46 0.26 -1.12 0.02 0.00 0.00 175.26 175.12 2mfn s SER 81 N -1.66 5.71 0.20 -0.19 0.01 0.10 -4.81 113.70 113.07 2mfn s SER 81 Ca 0.12 -0.20 -0.32 0.00 1.31 0.00 0.00 55.95 56.86 2mfn s SER 81 Cb -0.10 -1.45 -0.12 0.00 0.21 0.00 0.00 66.02 64.56 2mfn s SER 81 CO 0.04 -0.10 1.70 -2.84 0.41 0.00 0.00 173.24 172.44 2mfn s PRO 82 N -3.91 4.14 0.52 12.44 0.01 -1.26 -4.44 135.00 142.50 2mfn s PRO 82 Ca 0.35 2.57 -0.23 0.00 0.01 0.00 0.00 61.00 63.70 2mfn s PRO 82 Cb -0.08 -3.09 -0.06 0.00 0.01 0.00 0.00 34.50 31.28 2mfn s PRO 82 CO 0.26 -0.73 1.39 -0.35 0.01 0.00 0.00 177.00 177.58 2mfn n PRO 83 N 4.00 1.87 -4.11 5.54 -0.04 -1.26 -4.68 135.00 136.31 2mfn n PRO 83 Ca 0.16 0.68 -0.33 0.00 -0.04 0.00 0.00 63.50 63.97 2mfn n PRO 83 Cb 0.36 -2.60 -0.16 0.00 -0.04 0.00 0.00 33.50 31.05 2mfn n PRO 83 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 2mfn s LEU 84 N -3.27 2.23 -0.10 1.53 2.96 0.21 -4.96 118.68 117.28 2mfn s LEU 84 Ca 0.69 -0.70 0.04 0.00 -0.22 0.00 0.00 54.13 53.94 2mfn s LEU 84 Cb -0.42 -1.49 -0.00 0.00 0.50 0.00 0.00 46.19 44.78 2mfn s LEU 84 CO 0.51 -0.01 -0.24 -0.63 -1.32 0.00 0.00 176.35 174.66 2mfn s ILE 85 N 1.28 2.06 0.25 6.68 1.01 -1.26 0.20 121.20 131.42 2mfn s ILE 85 Ca 0.04 -1.02 0.02 0.00 0.00 0.00 0.00 60.65 59.69 2mfn s ILE 85 Cb -0.13 -1.78 -0.05 0.00 0.01 0.00 0.00 42.46 40.50 2mfn s ILE 85 CO -0.12 0.56 0.07 -0.83 0.00 0.00 0.00 174.94 174.61 2mfn s GLY 86 N 0.34 1.70 0.09 6.18 0.00 -0.96 -5.00 107.32 109.67 2mfn s GLY 86 Ca -0.19 -1.85 0.09 0.00 0.00 0.00 0.00 44.72 42.77 2mfn s GLY 86 CO 0.09 -1.63 -0.24 1.20 0.00 0.00 0.00 173.10 172.52 2mfn s GLN 87 N -3.98 1.43 0.06 2.90 -0.21 -1.26 -1.99 119.66 116.62 2mfn s GLN 87 Ca 0.35 -1.18 -0.04 0.00 0.02 0.00 0.00 55.36 54.51 2mfn s GLN 87 Cb 0.07 -1.74 -0.03 0.00 1.00 0.00 0.00 33.01 32.32 2mfn s GLN 87 CO 0.12 0.43 0.04 1.14 -2.12 0.00 0.00 175.29 174.90 2mfn s GLN 88 N -1.68 0.67 -0.06 2.91 1.03 -0.93 -4.95 119.66 116.64 2mfn s GLN 88 Ca 0.11 -1.09 0.05 0.00 0.04 0.00 0.00 55.36 54.47 2mfn s GLN 88 Cb -0.10 0.25 -0.01 0.00 0.03 0.00 0.00 33.01 33.18 2mfn s GLN 88 CO 0.04 -0.16 -0.23 0.00 -2.54 0.00 0.00 175.29 172.40 2mfn s ALA 89 N -3.72 2.24 0.14 2.60 0.00 -1.26 0.21 121.76 121.97 2mfn s ALA 89 Ca 0.05 -1.03 -0.30 0.00 0.00 0.00 0.00 51.96 50.67 2mfn s ALA 89 Cb 0.06 -0.73 -0.07 0.00 0.00 0.00 0.00 23.12 22.37 2mfn s ALA 89 CO -0.10 0.42 1.18 0.95 0.00 0.00 0.00 175.76 178.21 2mfn s THR 90 N -0.18 3.79 0.81 0.00 -4.23 0.53 -4.83 115.64 111.53 2mfn s THR 90 Ca -0.03 1.43 -0.21 0.00 -1.18 0.00 0.00 61.69 61.70 2mfn s THR 90 Cb -0.14 -3.92 -0.15 0.00 1.34 0.00 0.00 72.50 69.64 2mfn s THR 90 CO 0.04 0.20 -1.18 0.52 -0.54 0.00 0.00 174.62 173.65 2mfn n VAL 91 N 2.93 0.00 -4.07 2.29 0.31 -1.16 -2.80 118.33 115.84 2mfn n VAL 91 Ca 0.05 0.00 -0.27 0.00 -0.01 0.00 0.00 64.34 64.11 2mfn n VAL 91 Cb 0.46 0.00 -0.06 0.00 -0.91 0.00 0.00 33.84 33.33 2mfn n VAL 91 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 2mfn s SER 92 N -0.86 5.56 0.25 4.52 0.15 -1.26 -0.55 113.70 121.51 2mfn s SER 92 Ca 0.27 -0.08 -0.06 0.00 0.70 0.00 0.00 55.95 56.78 2mfn s SER 92 Cb 0.08 -1.48 0.26 0.00 -1.71 0.00 0.00 66.02 63.18 2mfn s SER 92 CO 0.50 0.10 1.93 -0.78 1.20 0.00 0.00 173.24 176.18 2mfn h ASP 93 N 2.63 1.16 -3.92 5.45 1.82 -1.92 -3.38 116.42 118.26 2mfn h ASP 93 Ca -0.47 -0.03 -0.50 0.00 -0.39 0.00 0.00 57.03 55.64 2mfn h ASP 93 Cb 1.19 -0.29 0.03 0.00 0.68 0.00 0.00 39.33 40.95 2mfn h ASP 93 CO 0.64 0.84 0.47 -0.63 -1.61 0.00 0.00 179.24 178.95 2mfn s ILE 94 N -6.12 3.38 0.00 2.25 1.01 -1.26 -4.60 121.20 115.86 2mfn s ILE 94 Ca -0.13 1.18 0.00 0.00 0.00 0.00 0.00 60.65 61.70 2mfn s ILE 94 Cb 0.18 -3.67 0.00 0.00 0.01 0.00 0.00 42.46 38.98 2mfn s ILE 94 CO 0.82 0.13 0.00 -2.65 0.00 0.00 0.00 174.94 173.24 2mfn n PRO 95 N 0.29 1.15 -3.85 2.79 -0.01 -1.26 -4.81 135.00 129.30 2mfn n PRO 95 Ca 0.03 0.00 -0.09 0.00 -0.01 0.00 0.00 63.50 63.43 2mfn n PRO 95 Cb 0.47 0.00 -0.04 0.00 -0.01 0.00 0.00 33.50 33.92 2mfn n PRO 95 CO 0.00 0.00 0.00 0.50 -0.01 0.00 0.00 175.50 175.99 2mfn s ARG 96 N 0.00 1.44 -0.40 -0.52 3.52 -1.23 -4.94 118.95 116.83 2mfn s ARG 96 Ca 0.00 -1.02 -0.01 0.00 -0.13 0.00 0.00 55.73 54.57 2mfn s ARG 96 Cb 0.00 0.50 0.00 0.00 -1.56 0.00 0.00 34.95 33.89 2mfn s ARG 96 CO 0.00 -0.61 0.15 -3.47 -0.81 0.00 0.00 175.30 170.57 2mfn n ASP 97 N -0.35 -2.69 -4.59 -2.12 -0.08 -1.26 -0.93 116.55 104.53 2mfn n ASP 97 Ca -0.07 -0.07 -0.41 0.00 -1.51 0.00 0.00 54.79 52.73 2mfn n ASP 97 Cb 0.62 -1.63 -0.03 0.00 2.34 0.00 0.00 41.12 42.42 2mfn n ASP 97 CO 0.00 0.00 0.00 -0.22 0.12 0.00 0.00 177.20 177.10 2mfn s LEU 98 N -2.07 3.45 0.20 -2.67 2.96 -1.26 -4.17 118.68 115.12 2mfn s LEU 98 Ca 0.08 1.09 -0.21 0.00 -0.22 0.00 0.00 54.13 54.87 2mfn s LEU 98 Cb -0.03 -3.22 0.05 0.00 0.50 0.00 0.00 46.19 43.48 2mfn s LEU 98 CO 0.09 -1.94 0.60 -1.83 -1.32 0.00 0.00 176.35 171.95 2mfn s GLU 99 N 6.16 1.41 -0.00 1.98 -1.05 -1.04 -4.98 118.70 121.18 2mfn s GLU 99 Ca 0.79 -0.71 -0.14 0.00 -0.15 0.00 0.00 54.97 54.76 2mfn s GLU 99 Cb -0.20 0.57 -0.06 0.00 -0.44 0.00 0.00 34.13 34.00 2mfn s GLU 99 CO 0.30 -0.62 0.40 0.54 0.95 0.00 0.00 175.26 176.83 2mfn s VAL 100 N -3.82 5.05 -0.04 1.83 0.11 -1.26 -1.00 120.40 121.26 2mfn s VAL 100 Ca 0.06 0.81 0.02 0.00 -2.93 0.00 0.00 61.98 59.94 2mfn s VAL 100 Cb -0.02 -3.70 -0.03 0.00 -1.53 0.00 0.00 36.38 31.10 2mfn s VAL 100 CO -0.06 0.58 0.06 2.30 -3.33 0.00 0.00 175.10 174.66 2mfn n ILE 101 N 1.83 0.00 -3.77 7.04 -5.35 -0.98 -4.95 119.36 113.18 2mfn n ILE 101 Ca -0.14 -0.21 -0.15 0.00 -0.27 0.00 0.00 62.75 61.98 2mfn n ILE 101 Cb 0.52 0.67 -0.16 0.00 -1.74 0.00 0.00 39.64 38.94 2mfn n ILE 101 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2mfn s ALA 102 N -1.76 0.01 -0.19 -1.28 0.00 -1.26 -5.02 121.76 112.26 2mfn s ALA 102 Ca -0.00 0.38 -0.01 0.00 0.00 0.00 0.00 51.96 52.33 2mfn s ALA 102 Cb 0.01 -0.29 0.01 0.00 0.00 0.00 0.00 23.12 22.86 2mfn s ALA 102 CO 0.09 -0.12 -0.15 -1.12 0.00 0.00 0.00 175.76 174.46 2mfn s SER 103 N 1.09 3.53 0.21 0.00 0.01 -1.26 -0.46 113.70 116.82 2mfn s SER 103 Ca -0.09 -0.59 0.05 0.00 1.31 0.00 0.00 55.95 56.63 2mfn s SER 103 Cb -0.13 -1.56 -0.03 0.00 0.21 0.00 0.00 66.02 64.51 2mfn s SER 103 CO -0.04 -0.01 0.28 0.42 0.41 0.00 0.00 173.24 174.30 2mfn s THR 104 N 1.35 5.01 0.41 1.44 -4.23 0.24 -4.99 115.64 114.87 2mfn s THR 104 Ca 0.05 -1.01 0.17 0.00 -1.18 0.00 0.00 61.69 59.72 2mfn s THR 104 Cb -0.14 -3.66 0.38 0.00 1.34 0.00 0.00 72.50 70.42 2mfn s THR 104 CO -0.10 -0.25 1.83 -0.65 -0.54 0.00 0.00 174.62 174.92 2mfn h PRO 105 N 1.64 0.41 0.00 3.99 0.10 -2.01 -2.71 132.00 133.43 2mfn h PRO 105 Ca -0.50 -0.02 0.00 0.00 0.10 0.00 0.00 66.00 65.58 2mfn h PRO 105 Cb 1.22 -0.09 0.00 0.00 0.10 0.00 0.00 31.00 32.23 2mfn h PRO 105 CO 0.63 0.27 -0.21 0.25 0.10 0.00 0.00 178.00 179.04 2mfn n THR 106 N -4.55 0.86 -3.62 -1.15 -2.24 -1.26 -4.40 114.28 97.92 2mfn n THR 106 Ca 0.21 -1.02 -0.11 0.00 -2.27 0.00 0.00 64.05 60.87 2mfn n THR 106 Cb 0.74 0.23 -0.04 0.00 -2.10 0.00 0.00 70.33 69.16 2mfn n THR 106 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2mfn s SER 107 N -1.70 -0.26 0.06 3.42 1.04 -1.02 -3.02 113.70 112.22 2mfn s SER 107 Ca 0.13 -0.30 0.04 0.00 0.48 0.00 0.00 55.95 56.30 2mfn s SER 107 Cb 0.12 0.48 -0.03 0.00 0.10 0.00 0.00 66.02 66.69 2mfn s SER 107 CO 0.01 -0.86 -0.11 -0.76 0.98 0.00 0.00 173.24 172.50 2mfn s LEU 108 N -2.80 2.27 -0.25 2.42 1.43 -0.76 0.82 118.68 121.80 2mfn s LEU 108 Ca 0.03 -0.59 -0.08 0.00 -1.03 0.00 0.00 54.13 52.46 2mfn s LEU 108 Cb 0.02 -0.34 -0.03 0.00 0.03 0.00 0.00 46.19 45.87 2mfn s LEU 108 CO -0.12 -0.14 0.09 -0.22 0.23 0.00 0.00 176.35 176.18 2mfn s LEU 109 N -1.68 3.53 -0.13 1.79 0.20 0.39 -0.79 118.68 122.00 2mfn s LEU 109 Ca -0.06 -0.17 -0.07 0.00 0.69 0.00 0.00 54.13 54.51 2mfn s LEU 109 Cb -0.10 -1.95 -0.04 0.00 -0.43 0.00 0.00 46.19 43.67 2mfn s LEU 109 CO 0.01 -0.04 0.14 0.27 -0.29 0.00 0.00 176.35 176.45 2mfn s ILE 110 N 1.63 5.49 -0.03 6.68 -4.36 -0.70 -2.31 121.20 127.60 2mfn s ILE 110 Ca 0.06 0.21 0.02 0.00 -0.26 0.00 0.00 60.65 60.68 2mfn s ILE 110 Cb -0.15 -3.41 0.01 0.00 1.25 0.00 0.00 42.46 40.16 2mfn s ILE 110 CO 0.05 0.59 -0.08 -0.55 0.24 0.00 0.00 174.94 175.19 2mfn s SER 111 N -0.84 1.17 -0.04 4.36 0.15 -0.17 -1.77 113.70 116.56 2mfn s SER 111 Ca 0.14 -0.18 -0.08 0.00 0.70 0.00 0.00 55.95 56.53 2mfn s SER 111 Cb -0.12 -0.40 0.01 0.00 -1.71 0.00 0.00 66.02 63.81 2mfn s SER 111 CO 0.03 0.03 0.19 -1.66 1.20 0.00 0.00 173.24 173.04 2mfn s TRP 112 N 0.40 -0.12 0.43 3.44 -2.14 -0.99 -2.49 118.94 117.46 2mfn s TRP 112 Ca -0.06 0.26 -0.24 0.00 2.66 0.00 0.00 56.10 58.72 2mfn s TRP 112 Cb -0.10 0.03 -0.08 0.00 -3.10 0.00 0.00 33.47 30.21 2mfn s TRP 112 CO 0.01 -0.21 1.11 -1.83 -2.66 0.00 0.00 176.95 173.37 2mfn s GLU 113 N -0.62 3.97 0.31 3.25 -1.05 -0.11 -4.67 118.70 119.78 2mfn s GLU 113 Ca -0.07 1.66 -0.30 0.00 -0.15 0.00 0.00 54.97 56.12 2mfn s GLU 113 Cb -0.04 -2.50 -0.12 0.00 -0.44 0.00 0.00 34.13 31.03 2mfn s GLU 113 CO 0.01 -0.34 1.52 -0.35 0.95 0.00 0.00 175.26 177.05 2mfn n PRO 114 N -0.24 2.54 0.00 -4.83 -0.04 -1.26 -3.48 135.00 127.69 2mfn n PRO 114 Ca 0.06 0.90 0.00 0.00 -0.04 0.00 0.00 63.50 64.42 2mfn n PRO 114 Cb 0.49 -2.63 0.00 0.00 -0.04 0.00 0.00 33.50 31.31 2mfn n PRO 114 CO 0.00 0.00 0.00 -0.35 -0.04 0.00 0.00 175.50 175.11 2mfn n PRO 115 N 1.62 0.09 -0.16 0.54 -0.05 -1.26 -4.83 135.00 130.95 2mfn n PRO 115 Ca 0.07 0.00 0.05 0.00 -0.05 0.00 0.00 63.50 63.57 2mfn n PRO 115 Cb 0.36 0.00 0.12 0.00 -0.05 0.00 0.00 33.50 33.94 2mfn n PRO 115 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 175.50 175.45 2mfn n ALA 116 N -3.00 2.23 -2.28 0.55 0.00 -1.26 -5.00 120.51 111.75 2mfn n ALA 116 Ca 0.00 -1.32 -0.16 0.00 0.00 0.00 0.00 53.44 51.97 2mfn n ALA 116 Cb 0.00 -0.35 -0.10 0.00 0.00 0.00 0.00 19.45 19.00 2mfn n ALA 116 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 2mfn s VAL 117 N -1.31 1.35 0.16 0.00 -7.23 -1.26 -3.68 120.40 108.43 2mfn s VAL 117 Ca 0.20 -2.11 -0.30 0.00 -1.81 0.00 0.00 61.98 57.95 2mfn s VAL 117 Cb 0.12 -1.91 -0.08 0.00 0.56 0.00 0.00 36.38 35.07 2mfn s VAL 117 CO 0.10 -0.70 1.27 -0.55 -0.31 0.00 0.00 175.10 174.92 2mfn s SER 118 N -3.21 6.97 -0.06 4.85 0.15 -1.26 -5.02 113.70 116.12 2mfn s SER 118 Ca 0.19 2.28 0.05 0.00 0.70 0.00 0.00 55.95 59.16 2mfn s SER 118 Cb 0.01 -2.60 -0.01 0.00 -1.71 0.00 0.00 66.02 61.72 2mfn s SER 118 CO 0.03 -0.50 -0.21 -0.69 1.20 0.00 0.00 173.24 173.07 2mfn s VAL 119 N 0.40 1.76 -0.05 4.45 1.01 -1.26 -4.91 120.40 121.81 2mfn s VAL 119 Ca 0.57 -0.90 -0.24 0.00 0.00 0.00 0.00 61.98 61.42 2mfn s VAL 119 Cb -0.34 -1.51 -0.19 0.00 0.00 0.00 0.00 36.38 34.34 2mfn s VAL 119 CO 0.35 0.50 1.02 0.03 0.00 0.00 0.00 175.10 176.99 2mfn h ARG 120 N 6.24 -0.12 -2.32 2.72 2.47 -1.74 -3.43 114.38 118.20 2mfn h ARG 120 Ca -0.31 0.01 0.18 0.00 -1.26 0.00 0.00 59.98 58.60 2mfn h ARG 120 Cb 1.18 0.03 -0.08 0.00 -1.65 0.00 0.00 29.97 29.45 2mfn h ARG 120 CO 0.47 0.40 0.49 1.52 0.56 0.00 0.00 179.97 183.41 2mfn s TYR 121 N -3.64 -0.12 0.03 3.04 1.13 -1.08 -3.32 117.35 113.39 2mfn s TYR 121 Ca -0.15 -0.18 0.08 0.00 -1.41 0.00 0.00 57.07 55.41 2mfn s TYR 121 Cb 0.01 0.64 -0.03 0.00 -1.10 0.00 0.00 41.96 41.48 2mfn s TYR 121 CO 0.58 -0.82 -0.24 0.71 -2.51 0.00 0.00 175.55 173.27 2mfn s TYR 122 N -3.25 2.08 -0.21 -3.49 1.51 -0.50 -0.19 117.35 113.30 2mfn s TYR 122 Ca 0.12 -0.39 -0.08 0.00 -1.01 0.00 0.00 57.07 55.71 2mfn s TYR 122 Cb -0.01 -1.26 -0.04 0.00 -0.11 0.00 0.00 41.96 40.54 2mfn s TYR 122 CO 0.02 0.09 0.08 0.50 -1.11 0.00 0.00 175.55 175.13 2mfn s ARG 123 N -1.11 3.90 0.03 -0.62 3.52 0.49 -0.37 118.95 124.79 2mfn s ARG 123 Ca 0.10 -0.37 0.07 0.00 -0.13 0.00 0.00 55.73 55.39 2mfn s ARG 123 Cb -0.09 -3.31 -0.03 0.00 -1.56 0.00 0.00 34.95 29.96 2mfn s ARG 123 CO 0.01 0.09 -0.19 0.42 -0.81 0.00 0.00 175.30 174.83 2mfn s ILE 124 N 0.88 2.71 0.04 4.11 1.01 -0.71 0.14 121.20 129.38 2mfn s ILE 124 Ca 0.04 -1.15 0.08 0.00 0.00 0.00 0.00 60.65 59.63 2mfn s ILE 124 Cb -0.14 -2.11 -0.03 0.00 0.01 0.00 0.00 42.46 40.19 2mfn s ILE 124 CO 0.03 0.39 -0.23 0.42 0.00 0.00 0.00 174.94 175.55 2mfn s THR 125 N -0.87 2.42 -0.05 2.92 -4.23 0.38 -1.56 115.64 114.65 2mfn s THR 125 Ca 0.14 -1.29 -0.22 0.00 -1.18 0.00 0.00 61.69 59.14 2mfn s THR 125 Cb -0.10 -1.98 -0.04 0.00 1.34 0.00 0.00 72.50 71.72 2mfn s THR 125 CO 0.04 0.36 0.64 -0.31 -0.54 0.00 0.00 174.62 174.81 2mfn s TYR 126 N -0.85 3.60 -0.30 3.99 1.51 0.67 -2.57 117.35 123.40 2mfn s TYR 126 Ca 0.13 1.19 -0.08 0.00 -1.01 0.00 0.00 57.07 57.30 2mfn s TYR 126 Cb -0.10 -2.72 0.00 0.00 -0.11 0.00 0.00 41.96 39.03 2mfn s TYR 126 CO 0.03 0.17 0.11 0.20 -1.11 0.00 0.00 175.55 174.96 2mfn s GLY 127 N 0.50 1.82 -0.47 0.71 0.00 0.33 -2.81 107.32 107.40 2mfn s GLY 127 Ca 0.34 -1.42 -0.06 0.00 0.00 0.00 0.00 44.72 43.58 2mfn s GLY 127 CO 0.17 0.67 0.31 -0.54 0.00 0.00 0.00 173.10 173.70 2mfn s GLU 128 N 1.55 2.31 0.26 2.90 2.02 -1.26 -0.14 118.70 126.34 2mfn s GLU 128 Ca 0.04 -1.90 -0.05 0.00 0.02 0.00 0.00 54.97 53.08 2mfn s GLU 128 Cb -0.17 -3.77 0.29 0.00 0.10 0.00 0.00 34.13 30.57 2mfn s GLU 128 CO 0.04 -1.14 1.92 1.79 0.02 0.00 0.00 175.26 177.89 2mfn h THR 129 N 6.10 1.25 -1.00 3.63 1.35 -1.80 -2.00 112.91 120.44 2mfn h THR 129 Ca -0.15 -0.49 0.20 0.00 -0.55 0.00 0.00 66.41 65.43 2mfn h THR 129 Cb 1.05 -0.13 -0.10 0.00 -1.73 0.00 0.00 68.15 67.23 2mfn h THR 129 CO 0.77 0.25 0.61 1.23 -0.25 0.00 0.00 175.52 178.14 2mfn h GLY 130 N 1.30 1.65 0.00 5.82 0.00 -1.93 -3.45 103.07 106.46 2mfn h GLY 130 Ca 0.35 -0.33 0.00 0.00 0.00 0.00 0.00 47.33 47.35 2mfn h GLY 130 CO -0.07 -0.07 0.00 0.61 0.00 0.00 0.00 176.54 177.00 2mfn n GLY 131 N -1.36 0.66 0.38 4.60 0.00 -0.75 -4.93 105.19 103.79 2mfn n GLY 131 Ca 0.23 -0.01 -0.02 0.00 0.00 0.00 0.00 46.02 46.22 2mfn n GLY 131 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 2mfn h ASN 132 N 0.00 1.16 -4.76 1.61 -0.00 -1.88 -3.43 115.58 108.29 2mfn h ASN 132 Ca 0.00 -0.03 -0.27 0.00 -0.00 0.00 0.00 56.30 56.00 2mfn h ASN 132 Cb 0.00 -0.29 -0.21 0.00 -0.00 0.00 0.00 38.32 37.82 2mfn h ASN 132 CO 0.00 0.84 -0.73 -0.44 -0.00 0.00 0.00 177.43 177.09 2mfn s SER 133 N -6.12 0.83 1.11 1.15 0.01 -1.26 -5.15 113.70 104.27 2mfn s SER 133 Ca -0.13 -0.54 -0.13 0.00 1.31 0.00 0.00 55.95 56.47 2mfn s SER 133 Cb 0.18 0.04 0.24 0.00 0.21 0.00 0.00 66.02 66.69 2mfn s SER 133 CO 0.82 -0.20 0.97 -0.81 0.41 0.00 0.00 173.24 174.42 2mfn n PRO 134 N 1.49 -1.93 -1.46 12.44 -0.04 -1.26 -4.75 135.00 139.49 2mfn n PRO 134 Ca -0.23 -0.53 -0.35 0.00 -0.04 0.00 0.00 63.50 62.35 2mfn n PRO 134 Cb 0.55 -2.18 0.10 0.00 -0.04 0.00 0.00 33.50 31.92 2mfn n PRO 134 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 2mfn s VAL 135 N -2.45 2.00 -0.06 0.52 -7.23 -1.26 -4.87 120.40 107.06 2mfn s VAL 135 Ca 0.67 0.00 0.05 0.00 -1.81 0.00 0.00 61.98 60.89 2mfn s VAL 135 Cb -0.24 -2.75 -0.02 0.00 0.56 0.00 0.00 36.38 33.94 2mfn s VAL 135 CO 0.64 -0.00 -0.21 -1.10 -0.31 0.00 0.00 175.10 174.11 2mfn s GLN 136 N -3.70 2.56 0.04 4.82 -0.21 -1.12 -4.82 119.66 117.22 2mfn s GLN 136 Ca 0.79 -0.84 0.08 0.00 0.02 0.00 0.00 55.36 55.41 2mfn s GLN 136 Cb -0.34 -2.25 -0.03 0.00 1.00 0.00 0.00 33.01 31.40 2mfn s GLN 136 CO 0.45 0.45 -0.22 -1.83 -2.12 0.00 0.00 175.29 172.01 2mfn s GLU 137 N -0.32 1.54 0.06 2.91 -1.05 -1.26 0.24 118.70 120.83 2mfn s GLU 137 Ca 0.01 -0.98 0.00 0.00 -0.15 0.00 0.00 54.97 53.86 2mfn s GLU 137 Cb -0.13 -1.66 -0.04 0.00 -0.44 0.00 0.00 34.13 31.87 2mfn s GLU 137 CO 0.02 0.43 -0.04 -0.59 0.95 0.00 0.00 175.26 176.03 2mfn s PHE 138 N -0.78 0.63 0.48 4.83 -0.71 -0.60 -4.97 117.98 116.85 2mfn s PHE 138 Ca 0.09 -0.96 0.02 0.00 -1.04 0.00 0.00 56.93 55.04 2mfn s PHE 138 Cb -0.09 -0.42 0.01 0.00 -1.21 0.00 0.00 43.02 41.31 2mfn s PHE 138 CO 0.02 -0.28 0.69 0.95 -1.34 0.00 0.00 175.22 175.25 2mfn s THR 139 N -3.55 3.43 -0.43 -4.49 -4.23 -1.26 -1.74 115.64 103.37 2mfn s THR 139 Ca 0.06 -0.63 0.02 0.00 -1.18 0.00 0.00 61.69 59.96 2mfn s THR 139 Cb 0.05 -3.26 0.15 0.00 1.34 0.00 0.00 72.50 70.78 2mfn s THR 139 CO -0.07 -0.17 0.29 -0.69 -0.54 0.00 0.00 174.62 173.44 2mfn s VAL 140 N -2.59 0.82 0.00 2.29 1.01 0.50 -4.90 120.40 117.54 2mfn s VAL 140 Ca 0.52 -2.51 0.00 0.00 0.00 0.00 0.00 61.98 59.99 2mfn s VAL 140 Cb -0.10 -1.58 0.00 0.00 0.00 0.00 0.00 36.38 34.70 2mfn s VAL 140 CO 0.37 -1.05 0.50 -2.65 0.00 0.00 0.00 175.10 172.27 2mfn n PRO 141 N 3.30 0.00 -1.31 2.72 -0.02 -1.26 -1.40 135.00 137.02 2mfn n PRO 141 Ca 0.18 -0.03 0.00 0.00 -2.02 0.00 0.00 63.50 61.63 2mfn n PRO 141 Cb 0.40 -1.47 0.00 0.00 -0.02 0.00 0.00 33.50 32.41 2mfn n PRO 141 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2mfn n GLY 142 N 2.97 -0.17 0.36 -1.23 0.00 -1.21 -4.63 105.19 101.28 2mfn n GLY 142 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.98 2mfn n GLY 142 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2mfn h SER 143 N 0.00 1.13 -5.45 1.61 4.64 -1.90 -3.45 113.55 110.13 2mfn h SER 143 Ca 0.00 -0.10 -0.18 0.00 -0.47 0.00 0.00 61.79 61.04 2mfn h SER 143 Cb 0.34 -0.29 -0.12 0.00 -0.31 0.00 0.00 62.40 62.02 2mfn h SER 143 CO 0.00 0.91 -0.37 -0.54 -0.87 0.00 0.00 176.83 175.96 2mfn s LYS 144 N -5.83 1.43 0.00 4.77 1.02 -1.26 -5.02 119.74 114.85 2mfn s LYS 144 Ca -0.13 -1.50 0.30 0.00 0.02 0.00 0.00 55.97 54.66 2mfn s LYS 144 Cb 0.17 0.37 1.46 0.00 -0.52 0.00 0.00 37.83 39.31 2mfn s LYS 144 CO 0.83 -0.54 1.98 -1.13 -0.92 0.00 0.00 175.35 175.57 2mfn n SER 145 N -0.47 0.60 -4.18 2.83 3.41 -1.26 -4.81 113.62 109.74 2mfn n SER 145 Ca 0.01 -1.05 -0.18 0.00 -0.26 0.00 0.00 58.87 57.38 2mfn n SER 145 Cb 0.64 -0.02 -0.12 0.00 -0.26 0.00 0.00 64.21 64.45 2mfn n SER 145 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 2mfn s THR 146 N -2.12 1.13 0.08 6.66 -4.23 -1.26 -2.35 115.64 113.55 2mfn s THR 146 Ca 0.40 -1.41 0.07 0.00 -1.18 0.00 0.00 61.69 59.57 2mfn s THR 146 Cb 0.21 -1.17 -0.03 0.00 1.34 0.00 0.00 72.50 72.85 2mfn s THR 146 CO 0.38 -0.29 -0.19 0.00 -0.54 0.00 0.00 174.62 173.99 2mfn s ALA 147 N -1.54 1.59 0.05 3.99 0.00 -0.73 -4.98 121.76 120.15 2mfn s ALA 147 Ca 0.01 -1.12 -0.11 0.00 0.00 0.00 0.00 51.96 50.73 2mfn s ALA 147 Cb -0.08 -0.22 -0.06 0.00 0.00 0.00 0.00 23.12 22.76 2mfn s ALA 147 CO 0.02 0.31 0.40 0.99 0.00 0.00 0.00 175.76 177.48 2mfn s THR 148 N -1.11 5.08 -0.19 0.00 2.01 -1.26 -1.72 115.64 118.45 2mfn s THR 148 Ca 0.04 0.58 -0.02 0.00 0.31 0.00 0.00 61.69 62.61 2mfn s THR 148 Cb -0.10 -3.66 0.00 0.00 0.01 0.00 0.00 72.50 68.75 2mfn s THR 148 CO 0.03 0.40 -0.11 -0.63 -0.69 0.00 0.00 174.62 173.62 2mfn s ILE 149 N -1.28 2.85 0.34 1.82 -1.09 0.03 -4.96 121.20 118.90 2mfn s ILE 149 Ca 0.29 -0.68 0.04 0.00 -2.23 0.00 0.00 60.65 58.07 2mfn s ILE 149 Cb -0.15 -2.25 -0.07 0.00 -1.58 0.00 0.00 42.46 38.41 2mfn s ILE 149 CO 0.16 0.48 0.05 0.20 -1.23 0.00 0.00 174.94 174.60 2mfn s ASN 150 N 1.26 2.55 -0.71 3.58 -0.87 -1.26 -1.83 114.94 117.66 2mfn s ASN 150 Ca 0.03 -1.38 -0.01 0.00 -1.57 0.00 0.00 52.86 49.94 2mfn s ASN 150 Cb -0.14 -0.12 0.00 0.00 -0.02 0.00 0.00 41.25 40.97 2mfn s ASN 150 CO -0.05 -0.59 0.60 0.59 -2.57 0.00 0.00 177.10 175.08 2mfn n ASN 151 N -0.72 -2.38 -4.54 -1.22 5.03 -1.24 -5.00 115.26 105.19 2mfn n ASN 151 Ca -0.03 -0.35 -0.30 0.00 0.87 0.00 0.00 54.58 54.77 2mfn n ASN 151 Cb 0.67 -3.19 -0.11 0.00 -1.02 0.00 0.00 39.78 36.13 2mfn n ASN 151 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.26 174.92 2mfn s ILE 152 N -3.21 3.21 -0.41 2.41 2.07 -1.17 -5.07 121.20 119.04 2mfn s ILE 152 Ca 0.05 -1.16 -0.18 0.00 -1.41 0.00 0.00 60.65 57.95 2mfn s ILE 152 Cb -0.02 -2.44 0.02 0.00 0.13 0.00 0.00 42.46 40.15 2mfn s ILE 152 CO 0.43 0.24 0.48 -0.75 -1.91 0.00 0.00 174.94 173.42 2mfn s LYS 153 N -1.81 3.24 0.94 3.50 2.20 -1.26 -4.78 119.74 121.76 2mfn s LYS 153 Ca 0.18 -0.58 -0.11 0.00 -0.36 0.00 0.00 55.97 55.10 2mfn s LYS 153 Cb -0.11 -3.93 0.15 0.00 -1.51 0.00 0.00 37.83 32.44 2mfn s LYS 153 CO 0.10 -0.83 1.10 -1.25 -0.36 0.00 0.00 175.35 174.11 2mfn s PRO 154 N 2.29 0.91 -0.71 4.03 0.05 -1.26 -3.77 135.00 136.54 2mfn s PRO 154 Ca 0.15 1.13 0.00 0.00 0.05 0.00 0.00 61.00 62.32 2mfn s PRO 154 Cb -0.16 -1.74 0.00 0.00 0.05 0.00 0.00 34.50 32.64 2mfn s PRO 154 CO 0.14 -2.57 0.00 0.41 0.05 0.00 0.00 177.00 175.03 2mfn n GLY 155 N -0.32 0.42 3.14 0.56 0.00 -1.26 -5.02 105.19 102.72 2mfn n GLY 155 Ca 0.08 -0.63 -0.12 0.00 0.00 0.00 0.00 46.02 45.35 2mfn n GLY 155 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2mfn s ALA 156 N -2.34 -0.51 0.57 4.61 0.00 -1.25 -4.98 121.76 117.87 2mfn s ALA 156 Ca 0.00 0.22 -0.18 0.00 0.00 0.00 0.00 51.96 52.00 2mfn s ALA 156 Cb 0.00 -0.05 -0.04 0.00 0.00 0.00 0.00 23.12 23.03 2mfn s ALA 156 CO 0.00 -0.19 1.12 0.34 0.00 0.00 0.00 175.76 177.03 2mfn s ASP 157 N -0.89 5.57 0.26 0.00 -1.08 -1.26 -2.13 116.67 117.14 2mfn s ASP 157 Ca -0.10 2.11 0.02 0.00 -0.52 0.00 0.00 52.55 54.06 2mfn s ASP 157 Cb -0.05 -2.57 -0.04 0.00 -1.46 0.00 0.00 42.92 38.80 2mfn s ASP 157 CO 0.02 -1.32 0.16 -0.31 0.52 0.00 0.00 175.17 174.24 2mfn s TYR 158 N -1.95 1.45 -0.16 -5.34 1.51 0.51 -2.43 117.35 110.94 2mfn s TYR 158 Ca 0.71 -1.41 -0.04 0.00 -1.01 0.00 0.00 57.07 55.31 2mfn s TYR 158 Cb -0.23 -0.72 0.06 0.00 -0.11 0.00 0.00 41.96 40.97 2mfn s TYR 158 CO 0.31 -0.62 0.12 0.99 -1.11 0.00 0.00 175.55 175.24 2mfn s THR 159 N -3.81 -0.15 -0.23 -0.71 2.01 0.81 -0.83 115.64 112.72 2mfn s THR 159 Ca 0.38 -0.07 -0.09 0.00 0.31 0.00 0.00 61.69 62.23 2mfn s THR 159 Cb 0.06 -0.54 -0.04 0.00 0.01 0.00 0.00 72.50 71.98 2mfn s THR 159 CO 0.17 -0.20 0.11 -0.63 -0.69 0.00 0.00 174.62 173.39 2mfn s ILE 160 N 2.19 4.89 -0.02 1.82 -1.09 -0.31 0.12 121.20 128.81 2mfn s ILE 160 Ca 0.03 0.02 0.06 0.00 -2.23 0.00 0.00 60.65 58.53 2mfn s ILE 160 Cb -0.15 -3.27 -0.02 0.00 -1.58 0.00 0.00 42.46 37.44 2mfn s ILE 160 CO -0.09 0.36 -0.20 -0.89 -1.23 0.00 0.00 174.94 172.89 2mfn s THR 161 N 1.16 1.56 -0.05 2.92 2.01 -1.06 -0.86 115.64 121.31 2mfn s THR 161 Ca 0.06 -0.84 0.06 0.00 0.31 0.00 0.00 61.69 61.28 2mfn s THR 161 Cb -0.14 -1.29 -0.01 0.00 0.01 0.00 0.00 72.50 71.06 2mfn s THR 161 CO 0.04 0.44 -0.25 -0.22 -0.69 0.00 0.00 174.62 173.95 2mfn s LEU 162 N -0.46 2.10 0.00 4.42 2.96 -0.74 -0.47 118.68 126.50 2mfn s LEU 162 Ca 0.07 -0.49 0.08 0.00 -0.22 0.00 0.00 54.13 53.57 2mfn s LEU 162 Cb -0.08 -1.38 -0.02 0.00 0.50 0.00 0.00 46.19 45.22 2mfn s LEU 162 CO -0.01 0.27 -0.24 -0.31 -1.32 0.00 0.00 176.35 174.74 2mfn s TYR 163 N -0.28 2.14 -0.23 5.38 1.51 0.38 -2.73 117.35 123.52 2mfn s TYR 163 Ca 0.00 -0.40 -0.08 0.00 -1.01 0.00 0.00 57.07 55.58 2mfn s TYR 163 Cb -0.13 -1.35 -0.04 0.00 -0.11 0.00 0.00 41.96 40.34 2mfn s TYR 163 CO 0.02 0.01 0.10 0.00 -1.11 0.00 0.00 175.55 174.58 2mfn s ALA 164 N -0.64 3.35 -0.23 3.71 0.00 -1.26 0.18 121.76 126.88 2mfn s ALA 164 Ca 0.10 -0.98 -0.05 0.00 0.00 0.00 0.00 51.96 51.03 2mfn s ALA 164 Cb -0.09 -2.13 -0.01 0.00 0.00 0.00 0.00 23.12 20.88 2mfn s ALA 164 CO 0.00 -0.26 -0.01 0.08 0.00 0.00 0.00 175.76 175.57 2mfn s VAL 165 N 1.20 3.63 -0.22 0.00 1.01 0.73 -2.20 120.40 124.54 2mfn s VAL 165 Ca 0.05 -0.41 -0.07 0.00 0.00 0.00 0.00 61.98 61.56 2mfn s VAL 165 Cb -0.14 -2.67 -0.18 0.00 0.00 0.00 0.00 36.38 33.39 2mfn s VAL 165 CO 0.04 0.40 -0.06 0.35 0.00 0.00 0.00 175.10 175.83 2mfn n THR 166 N 4.83 1.58 -2.88 3.92 -2.24 -1.24 -2.64 114.28 115.60 2mfn n THR 166 Ca -0.18 -0.48 -0.23 0.00 -2.27 0.00 0.00 64.05 60.89 2mfn n THR 166 Cb 0.51 -1.68 0.01 0.00 -2.10 0.00 0.00 70.33 67.07 2mfn n THR 166 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2mfn s GLY 167 N -5.85 1.58 0.00 3.38 0.00 -1.25 -4.38 107.32 100.80 2mfn s GLY 167 Ca -0.32 -1.01 0.00 0.00 0.00 0.00 0.00 44.72 43.39 2mfn s GLY 167 CO 0.61 -0.82 0.00 0.54 0.00 0.00 0.00 173.10 173.44 2mfn n ARG 168 N -2.17 0.00 0.06 2.90 1.74 -1.26 -4.42 116.66 113.52 2mfn n ARG 168 Ca 0.02 0.00 -0.05 0.00 -0.77 0.00 0.00 57.85 57.05 2mfn n ARG 168 Cb 0.58 0.00 -0.09 0.00 -1.02 0.00 0.00 32.46 31.93 2mfn n ARG 168 CO 0.00 0.00 0.00 0.78 -1.52 0.00 0.00 177.63 176.89 2mfn h GLY 169 N 0.00 0.00 0.81 -0.13 0.00 -1.98 -1.35 103.07 100.42 2mfn h GLY 169 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 47.33 47.21 2mfn h GLY 169 CO 0.00 0.00 -0.39 -0.55 0.00 0.00 0.00 176.54 175.60 2mfn h ASP 170 N 0.00 0.54 -1.85 0.19 3.32 -2.02 -3.39 116.42 113.21 2mfn h ASP 170 Ca -0.07 -0.61 -0.51 0.00 0.02 0.00 0.00 57.03 55.86 2mfn h ASP 170 Cb 1.72 -0.16 -0.38 0.00 0.22 0.00 0.00 39.33 40.74 2mfn h ASP 170 CO 0.10 1.06 -1.09 -1.20 -1.72 0.00 0.00 179.24 176.39 2mfn n SER 171 N -4.33 0.18 -4.57 6.45 7.64 -1.25 -5.05 113.62 112.69 2mfn n SER 171 Ca -0.08 -2.86 -0.22 0.00 1.01 0.00 0.00 58.87 56.73 2mfn n SER 171 Cb 0.53 -0.45 -0.08 0.00 -1.01 0.00 0.00 64.21 63.21 2mfn n SER 171 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 2mfn s PRO 172 N -1.48 1.97 -0.02 1.43 0.05 -0.51 -3.84 135.00 132.59 2mfn s PRO 172 Ca 0.36 -0.64 0.08 0.00 0.05 0.00 0.00 61.00 60.85 2mfn s PRO 172 Cb 0.24 -5.08 -0.02 0.00 0.05 0.00 0.00 34.50 29.68 2mfn s PRO 172 CO -0.10 -4.47 -0.26 0.00 0.05 0.00 0.00 177.00 172.22 2mfn s ALA 173 N 13.31 2.17 0.37 8.56 0.00 -1.26 -5.00 121.76 139.91 2mfn s ALA 173 Ca 0.75 -1.11 0.07 0.00 0.00 0.00 0.00 51.96 51.67 2mfn s ALA 173 Cb -0.04 -0.57 -0.01 0.00 0.00 0.00 0.00 23.12 22.50 2mfn s ALA 173 CO 0.12 0.52 0.45 -1.54 0.00 0.00 0.00 175.76 175.32 2mfn s SER 174 N -0.58 5.66 0.26 0.00 1.04 -1.26 -3.71 113.70 115.10 2mfn s SER 174 Ca 0.09 -0.37 0.07 0.00 0.48 0.00 0.00 55.95 56.22 2mfn s SER 174 Cb -0.10 -0.95 -0.03 0.00 0.10 0.00 0.00 66.02 65.03 2mfn s SER 174 CO -0.01 -0.53 0.22 -0.94 0.98 0.00 0.00 173.24 172.96 2mfn s SER 175 N -4.18 5.60 -0.95 7.02 1.04 -0.93 -4.96 113.70 116.33 2mfn s SER 175 Ca 0.47 -0.23 -0.30 0.00 0.48 0.00 0.00 55.95 56.38 2mfn s SER 175 Cb -0.08 -1.43 -0.21 0.00 0.10 0.00 0.00 66.02 64.40 2mfn s SER 175 CO 0.30 -0.06 2.57 2.29 0.98 0.00 0.00 173.24 179.32 2mfn n LYS 176 N -1.22 0.00 -0.91 4.02 2.85 -1.26 -4.53 118.16 117.12 2mfn n LYS 176 Ca -0.08 0.00 -0.31 0.00 -1.05 0.00 0.00 58.31 56.87 2mfn n LYS 176 Cb 0.58 -1.43 0.14 0.00 -0.65 0.00 0.00 35.03 33.67 2mfn n LYS 176 CO 0.00 0.00 0.00 -2.14 -0.05 0.00 0.00 177.40 175.21 2mfn s PRO 177 N 8.55 1.42 -0.08 -1.58 0.02 -1.26 -4.76 135.00 137.31 2mfn s PRO 177 Ca 1.30 1.50 0.03 0.00 0.02 0.00 0.00 61.00 63.84 2mfn s PRO 177 Cb -1.20 -1.78 0.01 0.00 0.02 0.00 0.00 34.50 31.55 2mfn s PRO 177 CO 0.47 -2.32 -0.18 0.08 -0.33 0.00 0.00 177.00 174.71 2mfn s VAL 178 N -2.62 1.61 0.13 3.83 1.01 -1.10 -5.02 120.40 118.24 2mfn s VAL 178 Ca 0.66 -0.76 0.11 0.00 0.00 0.00 0.00 61.98 61.99 2mfn s VAL 178 Cb -0.22 -1.42 -0.04 0.00 0.00 0.00 0.00 36.38 34.70 2mfn s VAL 178 CO 0.56 0.46 -0.27 -0.94 0.00 0.00 0.00 175.10 174.91 2mfn s SER 179 N 0.49 3.28 0.09 3.32 1.04 -1.26 -1.79 113.70 118.88 2mfn s SER 179 Ca -0.17 -0.75 0.00 0.00 0.48 0.00 0.00 55.95 55.51 2mfn s SER 179 Cb -0.17 -0.22 -0.04 0.00 0.10 0.00 0.00 66.02 65.69 2mfn s SER 179 CO 0.06 0.17 -0.03 0.27 0.98 0.00 0.00 173.24 174.70 2mfn s ILE 180 N -1.09 0.39 -0.19 -1.02 -4.36 -0.04 -4.99 121.20 109.89 2mfn s ILE 180 Ca 0.14 -1.88 -0.07 0.00 -0.26 0.00 0.00 60.65 58.58 2mfn s ILE 180 Cb -0.10 -1.70 -0.04 0.00 1.25 0.00 0.00 42.46 41.88 2mfn s ILE 180 CO 0.06 -0.84 0.06 0.20 0.24 0.00 0.00 174.94 174.66 2mfn s ASN 181 N -3.00 5.52 -0.10 4.36 0.01 -1.26 -1.16 114.94 119.31 2mfn s ASN 181 Ca 0.12 0.03 0.03 0.00 -0.71 0.00 0.00 52.86 52.33 2mfn s ASN 181 Cb 0.07 -1.95 0.01 0.00 0.41 0.00 0.00 41.25 39.79 2mfn s ASN 181 CO -0.06 0.15 -0.19 -0.47 -1.51 0.00 0.00 177.10 175.03 2mfn s TYR 182 N 0.52 2.14 -0.13 2.20 6.14 -0.01 -4.91 117.35 123.30 2mfn s TYR 182 Ca 0.03 -0.92 -0.07 0.00 0.64 0.00 0.00 57.07 56.75 2mfn s TYR 182 Cb -0.13 -1.48 -0.04 0.00 0.42 0.00 0.00 41.96 40.73 2mfn s TYR 182 CO 0.01 -0.42 0.12 0.15 0.64 0.00 0.00 175.55 176.05 2mfn s LYS 183 N 0.64 3.53 0.00 4.97 1.02 -1.26 0.19 119.74 128.82 2mfn s LYS 183 Ca -0.13 -0.18 0.12 0.00 0.02 0.00 0.00 55.97 55.79 2mfn s LYS 183 Cb -0.16 -3.19 0.09 0.00 -0.52 0.00 0.00 37.83 34.05 2mfn s LYS 183 CO 0.04 0.68 0.87 0.25 -0.92 0.00 0.00 175.35 176.26