#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 2.13 0.17 0.99 1.43 -1.26 -5.05 118.68 117.09 2mfn s LEU 2 Ca 0.00 -0.39 -0.30 0.00 -1.03 0.00 0.00 54.13 52.41 2mfn s LEU 2 Cb 0.00 -0.63 -0.07 0.00 0.03 0.00 0.00 46.19 45.52 2mfn s LEU 2 CO 0.00 0.07 0.95 -1.81 0.23 0.00 0.00 176.35 175.79 2mfn s ASP 3 N -0.88 7.57 0.10 2.29 1.01 -1.26 -4.23 116.67 121.27 2mfn s ASP 3 Ca 0.03 1.87 -0.30 0.00 0.71 0.00 0.00 52.55 54.85 2mfn s ASP 3 Cb -0.07 -2.60 -0.06 0.00 1.01 0.00 0.00 42.92 41.21 2mfn s ASP 3 CO 0.01 0.04 1.03 -0.55 0.21 0.00 0.00 175.17 175.91 2mfn s SER 4 N -0.57 7.35 -0.81 0.27 0.15 -1.26 -4.57 113.70 114.26 2mfn s SER 4 Ca 0.44 1.87 -0.24 0.00 0.70 0.00 0.00 55.95 58.72 2mfn s SER 4 Cb -0.25 -2.59 -0.17 0.00 -1.71 0.00 0.00 66.02 61.31 2mfn s SER 4 CO 0.31 -0.20 2.39 -2.65 1.20 0.00 0.00 173.24 174.28 2mfn n PRO 5 N 3.08 0.50 0.00 5.44 -0.01 -1.26 -4.81 135.00 137.93 2mfn n PRO 5 Ca 0.04 -0.72 0.00 0.00 -0.01 0.00 0.00 63.50 62.82 2mfn n PRO 5 Cb 0.48 -3.33 0.00 0.00 -0.01 0.00 0.00 33.50 30.65 2mfn n PRO 5 CO 0.00 0.00 0.00 0.25 -0.01 0.00 0.00 175.50 175.74 2mfn n THR 6 N 8.34 0.00 -1.24 3.45 -2.24 -1.25 -4.38 114.28 116.96 2mfn n THR 6 Ca 0.50 0.00 -0.01 0.00 -2.27 0.00 0.00 64.05 62.26 2mfn n THR 6 Cb 0.39 -1.18 -0.00 0.00 -2.10 0.00 0.00 70.33 67.43 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 0.44 3.71 3.38 0.00 -1.26 0.12 105.19 116.57 2mfn n GLY 7 Ca 0.00 -1.00 -0.43 0.00 0.00 0.00 0.00 46.02 44.59 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 -3.19 2.56 -3.69 1.61 -0.00 -1.25 -4.13 117.46 109.37 2mfn n PHE 8 Ca -0.01 0.23 -0.14 0.00 -0.00 0.00 0.00 57.45 57.53 2mfn n PHE 8 Cb 0.14 -2.58 -0.09 0.00 -0.00 0.00 0.00 39.48 36.95 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 0.74 -0.50 -0.03 -2.13 -1.08 0.33 -4.95 116.67 109.06 2mfn s ASP 9 Ca 0.71 0.88 0.06 0.00 -0.52 0.00 0.00 52.55 53.69 2mfn s ASP 9 Cb -0.57 0.91 -0.02 0.00 -1.46 0.00 0.00 42.92 41.77 2mfn s ASP 9 CO 0.42 -0.25 -0.21 -0.94 0.52 0.00 0.00 175.17 174.70 2mfn s SER 10 N -0.05 3.43 0.26 -0.34 1.04 -1.26 0.20 113.70 116.97 2mfn s SER 10 Ca -0.03 -0.36 -0.09 0.00 0.48 0.00 0.00 55.95 55.95 2mfn s SER 10 Cb -0.03 -0.54 0.04 0.00 0.10 0.00 0.00 66.02 65.59 2mfn s SER 10 CO 0.02 0.33 0.50 -1.54 0.98 0.00 0.00 173.24 173.53 2mfn n SER 11 N 2.39 -1.46 -3.91 7.02 3.41 -0.73 -4.93 113.62 115.41 2mfn n SER 11 Ca -0.16 -2.09 -0.26 0.00 -0.26 0.00 0.00 58.87 56.10 2mfn n SER 11 Cb 0.51 2.46 -0.00 0.00 -0.26 0.00 0.00 64.21 66.92 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 -1.41 -1.10 -4.65 4.04 8.00 -1.26 -1.55 116.55 118.62 2mfn n ASP 12 Ca -0.05 -0.94 -0.42 0.00 0.71 0.00 0.00 54.79 54.09 2mfn n ASP 12 Cb 0.40 -3.34 -0.04 0.00 -0.02 0.00 0.00 41.12 38.11 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 4.87 0.31 0.53 -1.09 -1.26 -1.14 121.20 119.63 2mfn s ILE 13 Ca 0.11 1.54 0.09 0.00 -2.23 0.00 0.00 60.65 60.16 2mfn s ILE 13 Cb -0.06 -4.10 -0.04 0.00 -1.58 0.00 0.00 42.46 36.67 2mfn s ILE 13 CO 0.87 -0.03 0.06 0.42 -1.23 0.00 0.00 174.94 175.03 2mfn s THR 14 N 2.60 3.18 0.07 2.92 -4.23 1.68 -4.78 115.64 117.08 2mfn s THR 14 Ca 0.35 -1.83 -0.33 0.00 -1.18 0.00 0.00 61.69 58.70 2mfn s THR 14 Cb -0.16 -2.90 -0.19 0.00 1.34 0.00 0.00 72.50 70.59 2mfn s THR 14 CO 0.09 -0.27 1.63 0.00 -0.54 0.00 0.00 174.62 175.52 2mfn h ALA 15 N 1.73 -0.90 -0.02 3.99 0.00 -1.74 -2.94 119.26 119.39 2mfn h ALA 15 Ca -0.44 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.27 2mfn h ALA 15 Cb 1.25 0.35 0.00 0.00 0.00 0.00 0.00 17.79 19.39 2mfn h ALA 15 CO 0.62 -1.00 -0.00 0.09 0.00 0.00 0.00 179.25 178.96 2mfn n ASN 16 N -5.48 1.81 -3.73 0.00 3.02 -1.26 -3.73 115.26 105.89 2mfn n ASN 16 Ca -0.14 -1.60 -0.13 0.00 -0.03 0.00 0.00 54.58 52.68 2mfn n ASN 16 Cb 0.37 0.00 -0.08 0.00 -0.61 0.00 0.00 39.78 39.46 2mfn n ASN 16 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 2mfn s SER 17 N -2.00 -0.22 -0.15 6.41 0.15 -1.11 -1.46 113.70 115.32 2mfn s SER 17 Ca 0.36 0.07 -0.29 0.00 0.70 0.00 0.00 55.95 56.79 2mfn s SER 17 Cb 0.21 0.35 0.08 0.00 -1.71 0.00 0.00 66.02 64.95 2mfn s SER 17 CO 0.33 -0.52 0.73 0.72 1.20 0.00 0.00 173.24 175.70 2mfn s PHE 18 N -1.70 -0.68 0.15 3.44 -0.12 -0.90 0.47 117.98 118.64 2mfn s PHE 18 Ca -0.11 1.38 -0.09 0.00 -0.05 0.00 0.00 56.93 58.07 2mfn s PHE 18 Cb -0.03 0.36 -0.06 0.00 -0.63 0.00 0.00 43.02 42.65 2mfn s PHE 18 CO 0.02 -0.49 0.45 0.99 -0.05 0.00 0.00 175.22 176.15 2mfn s THR 19 N -0.55 5.04 0.02 -4.49 2.01 -0.29 -1.90 115.64 115.47 2mfn s THR 19 Ca -0.06 0.37 0.08 0.00 0.31 0.00 0.00 61.69 62.40 2mfn s THR 19 Cb -0.02 -3.64 -0.02 0.00 0.01 0.00 0.00 72.50 68.83 2mfn s THR 19 CO 0.05 0.10 -0.24 -0.69 -0.69 0.00 0.00 174.62 173.15 2mfn s VAL 20 N -1.61 1.95 0.02 3.82 1.01 -0.81 -1.77 120.40 123.00 2mfn s VAL 20 Ca 0.40 -1.20 0.04 0.00 0.00 0.00 0.00 61.98 61.23 2mfn s VAL 20 Cb -0.13 -1.65 -0.02 0.00 0.00 0.00 0.00 36.38 34.59 2mfn s VAL 20 CO 0.21 0.41 -0.14 -1.00 0.00 0.00 0.00 175.10 174.58 2mfn s HIS 21 N -0.70 1.20 0.09 5.22 3.76 0.53 -2.29 115.29 123.10 2mfn s HIS 21 Ca 0.10 -0.29 -0.18 0.00 -0.15 0.00 0.00 55.06 54.54 2mfn s HIS 21 Cb -0.09 -0.74 0.04 0.00 1.11 0.00 0.00 32.58 32.90 2mfn s HIS 21 CO 0.01 0.01 0.43 1.67 -0.85 0.00 0.00 174.74 176.00 2mfn s TRP 22 N -0.60 -0.26 0.41 1.40 -2.14 -0.92 0.12 118.94 116.95 2mfn s TRP 22 Ca 0.03 0.09 -0.04 0.00 2.66 0.00 0.00 56.10 58.84 2mfn s TRP 22 Cb -0.07 0.26 -0.04 0.00 -3.10 0.00 0.00 33.47 30.53 2mfn s TRP 22 CO 0.00 -0.65 0.68 0.08 -2.66 0.00 0.00 176.95 174.40 2mfn s VAL 23 N -3.18 4.98 0.23 -0.66 1.01 0.31 -4.77 120.40 118.32 2mfn s VAL 23 Ca -0.01 0.01 -0.12 0.00 0.00 0.00 0.00 61.98 61.86 2mfn s VAL 23 Cb 0.01 -3.84 -0.08 0.00 0.00 0.00 0.00 36.38 32.47 2mfn s VAL 23 CO -0.07 -0.66 0.60 0.00 0.00 0.00 0.00 175.10 174.96 2mfn s ALA 24 N -2.49 3.50 1.42 5.51 0.00 -1.26 -3.78 121.76 124.67 2mfn s ALA 24 Ca 0.45 -0.15 -0.23 0.00 0.00 0.00 0.00 51.96 52.03 2mfn s ALA 24 Cb -0.10 -2.55 0.37 0.00 0.00 0.00 0.00 23.12 20.83 2mfn s ALA 24 CO 0.39 0.45 0.93 -1.25 0.00 0.00 0.00 175.76 176.28 2mfn s PRO 25 N -2.62 -2.95 0.00 0.00 0.04 -1.26 -4.90 135.00 123.30 2mfn s PRO 25 Ca 0.47 0.13 0.19 0.00 0.04 0.00 0.00 61.00 61.82 2mfn s PRO 25 Cb -0.12 -1.38 0.42 0.00 0.04 0.00 0.00 34.50 33.47 2mfn s PRO 25 CO 0.20 -4.89 1.35 0.54 0.04 0.00 0.00 177.00 174.24 2mfn n ARG 26 N -5.64 2.47 -4.44 4.56 1.74 -1.26 -4.95 116.66 109.13 2mfn n ARG 26 Ca 0.13 -2.23 -0.25 0.00 -0.77 0.00 0.00 57.85 54.73 2mfn n ARG 26 Cb 0.60 -1.44 -0.11 0.00 -1.02 0.00 0.00 32.46 30.49 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 -1.18 2.68 0.29 7.54 0.00 -1.26 -5.09 121.76 124.73 2mfn s ALA 27 Ca 0.35 -1.77 -0.30 0.00 0.00 0.00 0.00 51.96 50.24 2mfn s ALA 27 Cb 0.20 -0.31 -0.12 0.00 0.00 0.00 0.00 23.12 22.88 2mfn s ALA 27 CO 0.27 0.34 1.45 -0.35 0.00 0.00 0.00 175.76 177.47 2mfn n PRO 28 N -0.26 2.31 -4.20 0.00 -0.04 -1.26 -5.01 135.00 126.54 2mfn n PRO 28 Ca -0.08 0.82 -0.12 0.00 -0.04 0.00 0.00 63.50 64.08 2mfn n PRO 28 Cb 0.58 -2.51 -0.10 0.00 -0.04 0.00 0.00 33.50 31.44 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 -0.32 0.00 -1.92 0.52 -4.36 -1.26 -4.87 121.20 108.99 2mfn s ILE 29 Ca 0.63 -2.00 0.16 0.00 -0.26 0.00 0.00 60.65 59.18 2mfn s ILE 29 Cb -0.57 -2.50 0.10 0.00 1.25 0.00 0.00 42.46 40.74 2mfn s ILE 29 CO 0.53 0.00 0.98 0.35 0.24 0.00 0.00 174.94 177.04 2mfn n THR 30 N -0.27 0.00 -0.16 8.37 -2.24 -0.75 -4.96 114.28 114.27 2mfn n THR 30 Ca 0.02 -0.47 0.00 0.00 -2.27 0.00 0.00 64.05 61.33 2mfn n THR 30 Cb 0.66 1.31 0.00 0.00 -2.10 0.00 0.00 70.33 70.20 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 0.95 0.82 3.23 3.38 0.00 -1.23 -4.61 105.19 107.72 2mfn n GLY 31 Ca 0.09 -1.88 -0.20 0.00 0.00 0.00 0.00 46.02 44.02 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 -1.68 1.46 -0.15 1.61 2.02 -0.94 -3.18 117.35 116.49 2mfn s TYR 32 Ca 0.00 -0.47 -0.03 0.00 -0.37 0.00 0.00 57.07 56.21 2mfn s TYR 32 Cb 0.00 -0.80 -0.02 0.00 -0.40 0.00 0.00 41.96 40.74 2mfn s TYR 32 CO 0.00 0.13 -0.06 0.42 -1.57 0.00 0.00 175.55 174.48 2mfn s ILE 33 N -1.44 3.73 -0.18 2.71 -1.09 -0.27 -1.91 121.20 122.75 2mfn s ILE 33 Ca 0.04 -0.42 -0.02 0.00 -2.23 0.00 0.00 60.65 58.02 2mfn s ILE 33 Cb -0.09 -2.62 -0.01 0.00 -1.58 0.00 0.00 42.46 38.16 2mfn s ILE 33 CO 0.03 0.50 -0.10 -0.63 -1.23 0.00 0.00 174.94 173.52 2mfn s ILE 34 N 0.35 3.06 -0.08 2.92 -1.09 0.58 -1.38 121.20 125.55 2mfn s ILE 34 Ca -0.05 -0.62 0.04 0.00 -2.23 0.00 0.00 60.65 57.78 2mfn s ILE 34 Cb -0.15 -2.34 0.00 0.00 -1.58 0.00 0.00 42.46 38.39 2mfn s ILE 34 CO 0.04 0.48 -0.20 -0.13 -1.23 0.00 0.00 174.94 173.89 2mfn s ARG 35 N 1.06 2.48 -0.06 2.79 0.52 -0.50 0.16 118.95 125.40 2mfn s ARG 35 Ca 0.00 -0.71 0.02 0.00 -0.52 0.00 0.00 55.73 54.51 2mfn s ARG 35 Cb -0.15 -1.94 0.02 0.00 0.52 0.00 0.00 34.95 33.40 2mfn s ARG 35 CO -0.02 0.16 -0.09 -3.38 0.02 0.00 0.00 175.30 171.98 2mfn s HIS 36 N 0.37 1.21 0.16 -0.53 -3.43 -0.93 -0.44 115.29 111.69 2mfn s HIS 36 Ca -0.15 -0.43 -0.23 0.00 -0.80 0.00 0.00 55.06 53.45 2mfn s HIS 36 Cb -0.16 -0.93 0.07 0.00 -1.43 0.00 0.00 32.58 30.12 2mfn s HIS 36 CO 0.06 -0.26 0.60 -3.38 -2.00 0.00 0.00 174.74 169.77 2mfn s HIS 37 N 0.80 -0.54 0.54 0.38 -3.43 -0.89 -2.93 115.29 109.22 2mfn s HIS 37 Ca -0.13 0.34 -0.11 0.00 -0.80 0.00 0.00 55.06 54.36 2mfn s HIS 37 Cb -0.15 0.56 -0.05 0.00 -1.43 0.00 0.00 32.58 31.51 2mfn s HIS 37 CO 0.02 -0.85 0.93 0.00 -2.00 0.00 0.00 174.74 172.84 2mfn s ALA 38 N -3.73 3.19 0.25 -1.38 0.00 -1.26 -0.27 121.76 118.56 2mfn s ALA 38 Ca 0.01 -0.13 -0.06 0.00 0.00 0.00 0.00 51.96 51.78 2mfn s ALA 38 Cb -0.01 -2.93 0.26 0.00 0.00 0.00 0.00 23.12 20.44 2mfn s ALA 38 CO -0.13 -0.42 1.93 0.93 0.00 0.00 0.00 175.76 178.07 2mfn h GLU 39 N 0.31 1.32 -0.01 0.00 5.08 -1.91 -0.69 114.58 118.69 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 1.19 -0.30 0.00 0.00 0.50 0.00 0.00 28.75 30.14 2mfn h GLU 39 CO 0.62 0.88 -0.00 -2.39 -1.00 0.00 0.00 179.01 177.12 2mfn n HIS 40 N -4.38 0.00 -3.83 4.33 1.44 -1.26 -4.73 115.22 106.79 2mfn n HIS 40 Ca 0.12 0.00 -0.36 0.00 -2.01 0.00 0.00 57.72 55.47 2mfn n HIS 40 Cb 0.01 -0.00 -0.13 0.00 0.12 0.00 0.00 29.99 29.99 2mfn n HIS 40 CO 0.00 0.00 0.00 -1.54 -2.81 0.00 0.00 176.34 171.99 2mfn s SER 41 N -2.00 4.81 0.00 4.39 1.04 -0.27 -4.88 113.70 116.79 2mfn s SER 41 Ca 0.42 -0.61 0.00 0.00 0.48 0.00 0.00 55.95 56.24 2mfn s SER 41 Cb 0.21 -1.82 0.00 0.00 0.10 0.00 0.00 66.02 64.52 2mfn s SER 41 CO 0.35 -0.12 0.10 1.33 0.98 0.00 0.00 173.24 175.87 2mfn n VAL 42 N 4.82 0.01 0.14 5.02 0.24 -1.26 -4.14 118.33 123.16 2mfn n VAL 42 Ca -0.16 -0.03 -0.06 0.00 -2.04 0.00 0.00 64.34 62.05 2mfn n VAL 42 Cb 0.49 1.81 -0.03 0.00 -1.47 0.00 0.00 33.84 34.64 2mfn n VAL 42 CO 0.00 0.00 0.00 1.23 -2.14 0.00 0.00 176.83 175.92 2mfn h GLY 43 N 0.00 -0.39 -7.02 7.63 0.00 -1.98 -3.40 103.07 97.91 2mfn h GLY 43 Ca 0.00 0.15 -0.62 0.00 0.00 0.00 0.00 47.33 46.86 2mfn h GLY 43 CO 0.00 -0.14 -0.60 0.54 0.00 0.00 0.00 176.54 176.34 2mfn n ARG 44 N -3.56 1.73 -1.93 4.80 1.74 -1.26 -5.09 116.66 113.09 2mfn n ARG 44 Ca -0.05 -4.40 -0.41 0.00 -0.77 0.00 0.00 57.85 52.23 2mfn n ARG 44 Cb 0.15 -2.24 -0.01 0.00 -1.02 0.00 0.00 32.46 29.34 2mfn n ARG 44 CO 0.00 0.00 0.00 -2.14 -1.52 0.00 0.00 177.63 173.97 2mfn s PRO 45 N -1.37 4.12 0.12 5.56 0.02 -1.26 -4.98 135.00 137.21 2mfn s PRO 45 Ca 0.26 2.40 -0.29 0.00 0.02 0.00 0.00 61.00 63.39 2mfn s PRO 45 Cb -0.03 -2.94 -0.06 0.00 0.02 0.00 0.00 34.50 31.49 2mfn s PRO 45 CO -0.17 -0.46 0.90 1.03 -0.33 0.00 0.00 177.00 177.97 2mfn s ARG 46 N -2.07 4.67 -0.26 5.54 1.81 -1.15 -4.99 118.95 122.51 2mfn s ARG 46 Ca 0.53 1.36 0.03 0.00 -1.72 0.00 0.00 55.73 55.92 2mfn s ARG 46 Cb -0.43 -3.35 0.06 0.00 -0.45 0.00 0.00 34.95 30.78 2mfn s ARG 46 CO 0.58 0.31 -0.10 -0.65 -0.68 0.00 0.00 175.30 174.75 2mfn s GLN 47 N -0.31 2.15 -0.09 3.54 -0.21 -1.26 -2.20 119.66 121.28 2mfn s GLN 47 Ca 0.43 -1.30 0.04 0.00 0.02 0.00 0.00 55.36 54.55 2mfn s GLN 47 Cb -0.23 -2.85 0.00 0.00 1.00 0.00 0.00 33.01 30.93 2mfn s GLN 47 CO 0.29 -0.58 -0.21 -0.51 -2.12 0.00 0.00 175.29 172.16 2mfn s ASP 48 N 1.14 2.79 -0.03 5.90 1.01 0.42 -4.99 116.67 122.90 2mfn s ASP 48 Ca -0.08 -0.50 0.04 0.00 0.71 0.00 0.00 52.55 52.71 2mfn s ASP 48 Cb -0.20 -1.28 -0.03 0.00 1.01 0.00 0.00 42.92 42.43 2mfn s ASP 48 CO -0.05 0.13 -0.13 -0.13 0.21 0.00 0.00 175.17 175.20 2mfn s ARG 49 N 0.41 2.48 0.09 8.23 1.81 -1.26 0.21 118.95 130.93 2mfn s ARG 49 Ca -0.18 -0.72 0.10 0.00 -1.72 0.00 0.00 55.73 53.21 2mfn s ARG 49 Cb -0.18 -2.39 -0.03 0.00 -0.45 0.00 0.00 34.95 31.90 2mfn s ARG 49 CO 0.08 0.62 -0.26 0.14 -0.68 0.00 0.00 175.30 175.20 2mfn s VAL 50 N -0.80 2.11 0.84 3.52 -7.23 -0.80 -4.87 120.40 113.16 2mfn s VAL 50 Ca 0.13 -1.56 -0.10 0.00 -1.81 0.00 0.00 61.98 58.63 2mfn s VAL 50 Cb -0.11 -1.85 0.10 0.00 0.56 0.00 0.00 36.38 35.08 2mfn s VAL 50 CO 0.02 0.18 1.12 -2.16 -0.31 0.00 0.00 175.10 173.95 2mfn s PRO 51 N -1.69 1.66 0.32 4.82 0.05 -1.26 -2.22 135.00 136.68 2mfn s PRO 51 Ca 0.12 1.35 0.02 0.00 0.05 0.00 0.00 61.00 62.54 2mfn s PRO 51 Cb -0.10 -1.82 0.58 0.00 0.05 0.00 0.00 34.50 33.21 2mfn s PRO 51 CO 0.04 -2.12 1.94 -1.00 0.05 0.00 0.00 177.00 175.91 2mfn h PRO 52 N -1.49 0.94 0.00 0.56 0.13 -1.88 -1.27 132.00 128.99 2mfn h PRO 52 Ca -0.43 -0.06 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 2mfn h PRO 52 Cb 1.25 -0.21 0.00 0.00 0.13 0.00 0.00 31.00 32.17 2mfn h PRO 52 CO 0.47 0.62 0.00 0.43 -0.23 0.00 0.00 178.00 179.29 2mfn n SER 53 N -4.47 0.36 -4.53 1.44 7.64 -1.26 -4.54 113.62 108.26 2mfn n SER 53 Ca 0.12 0.59 -0.40 0.00 1.01 0.00 0.00 58.87 60.18 2mfn n SER 53 Cb 0.17 -0.66 -0.11 0.00 -1.01 0.00 0.00 64.21 62.60 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 -3.17 3.50 0.00 1.43 1.81 -0.48 -4.90 118.95 117.15 2mfn s ARG 54 Ca 0.06 -0.64 0.19 0.00 -1.72 0.00 0.00 55.73 53.62 2mfn s ARG 54 Cb 0.09 -3.80 0.01 0.00 -0.45 0.00 0.00 34.95 30.81 2mfn s ARG 54 CO 0.33 -0.44 0.99 0.27 -0.68 0.00 0.00 175.30 175.77 2mfn n ASN 55 N 5.10 1.93 -4.04 0.23 6.94 -1.26 -4.70 115.26 119.46 2mfn n ASN 55 Ca -0.13 -1.47 -0.22 0.00 -0.02 0.00 0.00 54.58 52.75 2mfn n ASN 55 Cb 0.50 0.41 -0.16 0.00 -2.36 0.00 0.00 39.78 38.17 2mfn n ASN 55 CO 0.00 0.00 0.00 -0.94 -1.03 0.00 0.00 177.26 175.29 2mfn s SER 56 N -2.11 1.50 -0.03 0.53 1.04 -1.26 -2.16 113.70 111.21 2mfn s SER 56 Ca 0.17 -0.24 0.02 0.00 0.48 0.00 0.00 55.95 56.38 2mfn s SER 56 Cb 0.16 -0.39 0.01 0.00 0.10 0.00 0.00 66.02 65.89 2mfn s SER 56 CO 0.45 0.10 -0.08 -0.51 0.98 0.00 0.00 173.24 174.18 2mfn s ILE 57 N 0.12 0.76 -0.43 -1.02 2.07 -0.97 -4.95 121.20 116.78 2mfn s ILE 57 Ca -0.03 -0.31 -0.18 0.00 -1.41 0.00 0.00 60.65 58.72 2mfn s ILE 57 Cb -0.09 -0.70 0.02 0.00 0.13 0.00 0.00 42.46 41.82 2mfn s ILE 57 CO 0.01 0.25 0.48 -0.89 -1.91 0.00 0.00 174.94 172.88 2mfn s THR 58 N 0.41 5.03 0.30 4.00 2.01 -1.26 -1.93 115.64 124.21 2mfn s THR 58 Ca -0.07 -0.26 -0.16 0.00 0.31 0.00 0.00 61.69 61.51 2mfn s THR 58 Cb -0.11 -4.08 -0.09 0.00 0.01 0.00 0.00 72.50 68.24 2mfn s THR 58 CO 0.01 -0.46 0.74 -0.76 -0.69 0.00 0.00 174.62 173.46 2mfn s LEU 59 N 2.27 4.12 0.36 4.42 1.43 -0.80 -4.89 118.68 125.59 2mfn s LEU 59 Ca 0.14 1.32 0.05 0.00 -1.03 0.00 0.00 54.13 54.61 2mfn s LEU 59 Cb -0.16 -3.99 -0.03 0.00 0.03 0.00 0.00 46.19 42.04 2mfn s LEU 59 CO 0.15 -0.16 0.19 0.42 0.23 0.00 0.00 176.35 177.18 2mfn s THR 60 N -1.89 0.30 -1.33 5.49 -4.23 -1.26 -2.12 115.64 110.61 2mfn s THR 60 Ca 0.52 -2.00 -0.05 0.00 -1.18 0.00 0.00 61.69 58.98 2mfn s THR 60 Cb -0.12 -2.43 0.02 0.00 1.34 0.00 0.00 72.50 71.31 2mfn s THR 60 CO 0.18 0.00 0.98 0.59 -0.54 0.00 0.00 174.62 175.83 2mfn n ASN 61 N -1.31 -3.54 -4.61 3.99 4.13 -0.92 -4.90 115.26 108.09 2mfn n ASN 61 Ca 0.01 -0.67 -0.30 0.00 1.68 0.00 0.00 54.58 55.29 2mfn n ASN 61 Cb 0.64 -4.62 -0.09 0.00 -1.54 0.00 0.00 39.78 34.16 2mfn n ASN 61 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 2mfn s LEU 62 N -6.87 3.17 -0.07 3.41 1.43 -0.54 -5.05 118.68 114.16 2mfn s LEU 62 Ca 0.29 -0.33 -0.29 0.00 -1.03 0.00 0.00 54.13 52.76 2mfn s LEU 62 Cb -0.13 -1.94 -0.07 0.00 0.03 0.00 0.00 46.19 44.08 2mfn s LEU 62 CO 0.77 0.18 1.95 0.21 0.23 0.00 0.00 176.35 179.69 2mfn s ASN 63 N -2.25 6.22 0.22 2.29 2.47 -1.26 -4.32 114.94 118.30 2mfn s ASN 63 Ca 0.23 2.30 -0.31 0.00 0.42 0.00 0.00 52.86 55.50 2mfn s ASN 63 Cb -0.11 -2.53 -0.11 0.00 -1.45 0.00 0.00 41.25 37.05 2mfn s ASN 63 CO 0.15 -1.29 1.61 -2.16 -3.72 0.00 0.00 177.10 171.69 2mfn s PRO 64 N 4.91 4.17 -0.41 0.43 0.05 -1.24 -3.49 135.00 139.42 2mfn s PRO 64 Ca 0.88 2.49 -0.02 0.00 0.05 0.00 0.00 61.00 64.39 2mfn s PRO 64 Cb -0.37 -3.09 -0.02 0.00 0.05 0.00 0.00 34.50 31.06 2mfn s PRO 64 CO 0.37 -0.64 0.37 0.41 0.05 0.00 0.00 177.00 177.56 2mfn n GLY 65 N 3.30 -0.19 2.88 0.56 0.00 1.01 -4.51 105.19 108.25 2mfn n GLY 65 Ca 0.12 0.09 -0.14 0.00 0.00 0.00 0.00 46.02 46.10 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 -3.12 -0.05 -0.20 2.61 2.01 -1.00 -4.87 115.64 111.02 2mfn s THR 66 Ca 0.14 0.18 -0.23 0.00 0.31 0.00 0.00 61.69 62.09 2mfn s THR 66 Cb -0.02 -0.18 -0.02 0.00 0.01 0.00 0.00 72.50 72.29 2mfn s THR 66 CO 0.32 0.07 0.72 -1.83 -0.69 0.00 0.00 174.62 173.21 2mfn s GLU 67 N 1.07 4.22 0.28 4.92 -1.05 -1.26 -1.28 118.70 125.59 2mfn s GLU 67 Ca -0.08 0.78 0.04 0.00 -0.15 0.00 0.00 54.97 55.55 2mfn s GLU 67 Cb -0.11 -3.60 -0.03 0.00 -0.44 0.00 0.00 34.13 29.95 2mfn s GLU 67 CO -0.05 -0.33 0.22 1.52 0.95 0.00 0.00 175.26 177.57 2mfn s TYR 68 N 2.21 1.52 -0.16 4.83 -0.85 -0.74 -4.40 117.35 119.76 2mfn s TYR 68 Ca 0.32 -1.54 -0.04 0.00 -0.52 0.00 0.00 57.07 55.29 2mfn s TYR 68 Cb -0.16 -0.66 -0.03 0.00 0.38 0.00 0.00 41.96 41.49 2mfn s TYR 68 CO 0.10 -0.77 -0.03 0.08 -1.52 0.00 0.00 175.55 173.41 2mfn s VAL 69 N -3.73 3.88 -0.19 -3.49 1.01 0.63 -2.46 120.40 116.04 2mfn s VAL 69 Ca 0.40 -0.36 -0.03 0.00 0.00 0.00 0.00 61.98 61.99 2mfn s VAL 69 Cb 0.04 -2.71 -0.01 0.00 0.00 0.00 0.00 36.38 33.71 2mfn s VAL 69 CO 0.21 0.48 -0.07 -0.69 0.00 0.00 0.00 175.10 175.03 2mfn s VAL 70 N 0.46 3.26 -0.03 2.92 1.01 -0.70 -2.09 120.40 125.24 2mfn s VAL 70 Ca -0.03 -0.55 0.03 0.00 0.00 0.00 0.00 61.98 61.42 2mfn s VAL 70 Cb -0.14 -2.45 -0.03 0.00 0.00 0.00 0.00 36.38 33.76 2mfn s VAL 70 CO 0.03 0.46 -0.08 -0.94 0.00 0.00 0.00 175.10 174.57 2mfn s SER 71 N 1.11 4.55 -0.18 3.32 1.04 0.41 -2.26 113.70 121.69 2mfn s SER 71 Ca 0.01 -0.11 0.01 0.00 0.48 0.00 0.00 55.95 56.34 2mfn s SER 71 Cb -0.15 -1.07 0.02 0.00 0.10 0.00 0.00 66.02 64.92 2mfn s SER 71 CO -0.01 0.32 -0.20 -0.63 0.98 0.00 0.00 173.24 173.70 2mfn s ILE 72 N -0.90 2.08 -0.21 -1.02 -1.09 0.25 -1.41 121.20 118.89 2mfn s ILE 72 Ca 0.15 -0.93 -0.03 0.00 -2.23 0.00 0.00 60.65 57.61 2mfn s ILE 72 Cb -0.11 -1.87 -0.00 0.00 -1.58 0.00 0.00 42.46 38.90 2mfn s ILE 72 CO 0.05 0.54 -0.08 -0.63 -1.23 0.00 0.00 174.94 173.59 2mfn s ILE 73 N 1.29 3.09 -0.05 2.92 -1.09 -0.48 -1.32 121.20 125.56 2mfn s ILE 73 Ca 0.05 -0.59 -0.24 0.00 -2.23 0.00 0.00 60.65 57.64 2mfn s ILE 73 Cb -0.13 -2.39 -0.04 0.00 -1.58 0.00 0.00 42.46 38.32 2mfn s ILE 73 CO -0.13 0.45 0.74 0.00 -1.23 0.00 0.00 174.94 174.77 2mfn s ALA 74 N 1.44 3.31 0.07 9.38 0.00 -1.26 -1.12 121.76 133.58 2mfn s ALA 74 Ca 0.06 0.19 0.07 0.00 0.00 0.00 0.00 51.96 52.28 2mfn s ALA 74 Cb -0.14 -3.01 -0.03 0.00 0.00 0.00 0.00 23.12 19.95 2mfn s ALA 74 CO -0.05 -0.11 -0.18 0.14 0.00 0.00 0.00 175.76 175.55 2mfn s VAL 75 N 0.80 1.49 -0.28 0.00 -7.23 -1.19 -0.12 120.40 113.86 2mfn s VAL 75 Ca 0.39 -1.29 0.14 0.00 -1.81 0.00 0.00 61.98 59.41 2mfn s VAL 75 Cb -0.18 -1.34 0.48 0.00 0.56 0.00 0.00 36.38 35.90 2mfn s VAL 75 CO 0.20 0.01 1.16 -3.20 -0.31 0.00 0.00 175.10 172.95 2mfn n ASN 76 N 1.52 3.50 0.00 4.85 5.15 0.91 -1.80 115.26 129.38 2mfn n ASN 76 Ca -0.19 -3.02 0.00 0.00 -0.60 0.00 0.00 54.58 50.78 2mfn n ASN 76 Cb 0.54 -0.40 0.00 0.00 -0.53 0.00 0.00 39.78 39.39 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 -0.66 1.37 0.20 8.20 0.00 -1.26 -3.88 105.19 109.17 2mfn n GLY 77 Ca 0.28 -0.52 0.13 0.00 0.00 0.00 0.00 46.02 45.91 2mfn n GLY 77 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2mfn n ARG 78 N 0.00 0.68 -4.57 1.61 1.85 -1.26 -4.86 116.66 110.12 2mfn n ARG 78 Ca 0.00 -0.40 -0.32 0.00 -1.00 0.00 0.00 57.85 56.13 2mfn n ARG 78 Cb 0.00 -1.49 -0.11 0.00 -1.05 0.00 0.00 32.46 29.81 2mfn n ARG 78 CO 0.00 0.00 0.00 -1.21 -0.01 0.00 0.00 177.63 176.41 2mfn s GLU 79 N -2.60 2.47 -0.07 2.89 0.41 -1.25 -5.12 118.70 115.44 2mfn s GLU 79 Ca 0.22 -0.75 0.03 0.00 -0.41 0.00 0.00 54.97 54.05 2mfn s GLU 79 Cb 0.19 -2.43 0.01 0.00 -1.78 0.00 0.00 34.13 30.12 2mfn s GLU 79 CO 0.56 0.60 -0.14 -1.21 -0.49 0.00 0.00 175.26 174.57 2mfn s GLU 80 N -1.28 1.89 0.52 1.61 2.02 -1.26 -0.06 118.70 122.14 2mfn s GLU 80 Ca 0.15 -0.49 -0.18 0.00 0.02 0.00 0.00 54.97 54.47 2mfn s GLU 80 Cb -0.11 -1.54 -0.07 0.00 0.10 0.00 0.00 34.13 32.51 2mfn s GLU 80 CO 0.06 0.07 1.03 -1.12 0.02 0.00 0.00 175.26 175.31 2mfn s SER 81 N 0.56 6.25 0.30 -0.19 0.01 0.83 -4.79 113.70 116.67 2mfn s SER 81 Ca -0.14 1.80 -0.28 0.00 1.31 0.00 0.00 55.95 58.64 2mfn s SER 81 Cb -0.16 -2.54 -0.14 0.00 0.21 0.00 0.00 66.02 63.40 2mfn s SER 81 CO 0.04 -0.84 1.09 -2.65 0.41 0.00 0.00 173.24 171.29 2mfn n PRO 82 N -1.43 1.56 -1.68 12.44 -0.01 -1.26 -4.34 135.00 140.28 2mfn n PRO 82 Ca 0.08 0.55 -0.39 0.00 -0.01 0.00 0.00 63.50 63.73 2mfn n PRO 82 Cb 0.53 -1.98 0.04 0.00 -0.01 0.00 0.00 33.50 32.08 2mfn n PRO 82 CO 0.00 0.00 0.00 -0.35 -0.01 0.00 0.00 175.50 175.14 2mfn n PRO 83 N 0.67 1.45 -4.25 0.52 -0.04 -1.26 -4.63 135.00 127.46 2mfn n PRO 83 Ca 0.08 0.53 -0.31 0.00 -0.04 0.00 0.00 63.50 63.76 2mfn n PRO 83 Cb 0.33 -2.35 -0.16 0.00 -0.04 0.00 0.00 33.50 31.28 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 -2.32 1.93 -0.00 1.53 2.96 -0.43 -5.00 118.68 117.35 2mfn s LEU 84 Ca 0.70 -0.56 0.03 0.00 -0.22 0.00 0.00 54.13 54.08 2mfn s LEU 84 Cb -0.45 -1.33 -0.01 0.00 0.50 0.00 0.00 46.19 44.90 2mfn s LEU 84 CO 0.51 0.00 -0.09 -0.63 -1.32 0.00 0.00 176.35 174.82 2mfn s ILE 85 N 1.21 0.70 0.11 6.68 1.01 -1.26 0.85 121.20 130.51 2mfn s ILE 85 Ca 0.01 -0.42 -0.06 0.00 0.00 0.00 0.00 60.65 60.18 2mfn s ILE 85 Cb -0.14 -0.60 -0.02 0.00 0.01 0.00 0.00 42.46 41.72 2mfn s ILE 85 CO -0.09 0.17 0.15 -0.83 0.00 0.00 0.00 174.94 174.34 2mfn s GLY 86 N -0.29 0.46 -0.03 6.18 0.00 -0.96 -5.02 107.32 107.66 2mfn s GLY 86 Ca 0.03 -0.98 0.02 0.00 0.00 0.00 0.00 44.72 43.78 2mfn s GLY 86 CO -0.00 -1.03 -0.07 1.20 0.00 0.00 0.00 173.10 173.20 2mfn s GLN 87 N -3.94 2.65 0.07 2.90 -0.21 -1.26 -1.71 119.66 118.15 2mfn s GLN 87 Ca 0.13 -0.63 -0.07 0.00 0.02 0.00 0.00 55.36 54.80 2mfn s GLN 87 Cb 0.06 -2.54 -0.01 0.00 1.00 0.00 0.00 33.01 31.52 2mfn s GLN 87 CO -0.05 0.63 0.14 -1.14 -2.12 0.00 0.00 175.29 172.75 2mfn s GLN 88 N -1.08 0.74 -0.10 2.91 2.00 -1.03 -4.98 119.66 118.12 2mfn s GLN 88 Ca 0.14 -0.93 0.02 0.00 -2.00 0.00 0.00 55.36 52.60 2mfn s GLN 88 Cb -0.11 0.29 0.01 0.00 0.80 0.00 0.00 33.01 34.00 2mfn s GLN 88 CO 0.04 -0.21 -0.17 0.00 -0.50 0.00 0.00 175.29 174.45 2mfn s ALA 89 N -3.49 1.78 0.34 1.58 0.00 -1.26 -1.78 121.76 118.91 2mfn s ALA 89 Ca 0.02 -0.77 -0.27 0.00 0.00 0.00 0.00 51.96 50.95 2mfn s ALA 89 Cb 0.04 -0.80 -0.09 0.00 0.00 0.00 0.00 23.12 22.27 2mfn s ALA 89 CO -0.09 0.04 1.09 0.99 0.00 0.00 0.00 175.76 177.79 2mfn s THR 90 N 0.78 3.52 0.91 0.00 2.01 -0.41 -4.87 115.64 117.58 2mfn s THR 90 Ca -0.11 1.37 -0.10 0.00 0.31 0.00 0.00 61.69 63.16 2mfn s THR 90 Cb -0.16 -3.81 0.14 0.00 0.01 0.00 0.00 72.50 68.69 2mfn s THR 90 CO 0.01 0.20 1.12 -0.69 -0.69 0.00 0.00 174.62 174.58 2mfn s VAL 91 N -1.36 2.32 0.05 3.82 1.01 -1.24 -2.37 120.40 122.63 2mfn s VAL 91 Ca 0.51 0.10 -0.20 0.00 0.00 0.00 0.00 61.98 62.39 2mfn s VAL 91 Cb -0.28 -2.23 -0.06 0.00 0.00 0.00 0.00 36.38 33.80 2mfn s VAL 91 CO 0.36 -0.13 0.59 -0.44 0.00 0.00 0.00 175.10 175.47 2mfn s SER 92 N -2.82 7.06 0.39 3.32 0.01 -1.26 0.33 113.70 120.72 2mfn s SER 92 Ca 0.66 1.25 0.18 0.00 1.31 0.00 0.00 55.95 59.35 2mfn s SER 92 Cb -0.22 -2.37 0.77 0.00 0.21 0.00 0.00 66.02 64.41 2mfn s SER 92 CO 0.58 0.22 1.79 -0.78 0.41 0.00 0.00 173.24 175.46 2mfn h ASP 93 N 4.85 0.00 -3.96 2.44 1.82 -1.93 -3.37 116.42 116.27 2mfn h ASP 93 Ca -0.48 0.00 -0.54 0.00 -0.39 0.00 0.00 57.03 55.62 2mfn h ASP 93 Cb 1.21 0.00 0.11 0.00 0.68 0.00 0.00 39.33 41.33 2mfn h ASP 93 CO 0.65 0.36 0.77 -0.63 -1.61 0.00 0.00 179.24 178.79 2mfn s ILE 94 N -3.80 2.01 0.00 2.25 1.01 -1.26 -4.69 121.20 116.71 2mfn s ILE 94 Ca -0.01 0.01 0.00 0.00 0.00 0.00 0.00 60.65 60.65 2mfn s ILE 94 Cb 0.12 -3.00 0.00 0.00 0.01 0.00 0.00 42.46 39.59 2mfn s ILE 94 CO 0.69 0.00 0.00 -0.81 0.00 0.00 0.00 174.94 174.82 2mfn n PRO 95 N 0.31 1.12 -3.45 2.79 -0.05 -1.26 -4.71 135.00 129.75 2mfn n PRO 95 Ca 0.02 0.00 -0.12 0.00 -0.05 0.00 0.00 63.50 63.35 2mfn n PRO 95 Cb 0.40 0.00 -0.02 0.00 -0.05 0.00 0.00 33.50 33.83 2mfn n PRO 95 CO 0.00 0.00 0.00 0.50 -0.05 0.00 0.00 175.50 175.95 2mfn s ARG 96 N 0.00 1.31 -1.30 0.54 3.52 -1.14 -4.91 118.95 116.97 2mfn s ARG 96 Ca 0.00 -0.50 -0.06 0.00 -0.13 0.00 0.00 55.73 55.04 2mfn s ARG 96 Cb 0.00 0.59 0.01 0.00 -1.56 0.00 0.00 34.95 33.99 2mfn s ARG 96 CO 0.00 -0.57 1.11 -0.25 -0.81 0.00 0.00 175.30 174.78 2mfn n ASP 97 N -0.38 -4.72 -4.62 -2.12 8.00 -1.26 0.75 116.55 112.20 2mfn n ASP 97 Ca -0.16 -0.57 -0.43 0.00 0.71 0.00 0.00 54.79 54.34 2mfn n ASP 97 Cb 0.65 -5.07 -0.02 0.00 -0.02 0.00 0.00 41.12 36.66 2mfn n ASP 97 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 2mfn s LEU 98 N -6.95 3.74 0.26 0.64 2.96 -1.26 -4.09 118.68 113.98 2mfn s LEU 98 Ca 0.36 1.27 -0.18 0.00 -0.22 0.00 0.00 54.13 55.36 2mfn s LEU 98 Cb -0.16 -3.53 0.01 0.00 0.50 0.00 0.00 46.19 43.01 2mfn s LEU 98 CO 0.73 -1.35 0.63 -1.83 -1.32 0.00 0.00 176.35 173.21 2mfn s GLU 99 N 4.82 1.67 -0.15 1.98 -1.05 -1.01 -4.88 118.70 120.08 2mfn s GLU 99 Ca 0.67 -1.05 -0.05 0.00 -0.15 0.00 0.00 54.97 54.39 2mfn s GLU 99 Cb -0.20 0.56 -0.04 0.00 -0.44 0.00 0.00 34.13 34.02 2mfn s GLU 99 CO 0.30 -0.74 0.04 0.08 0.95 0.00 0.00 175.26 175.88 2mfn s VAL 100 N -3.94 4.61 -0.17 1.83 1.01 -1.26 -1.43 120.40 121.04 2mfn s VAL 100 Ca 0.14 -0.11 0.17 0.00 0.00 0.00 0.00 61.98 62.18 2mfn s VAL 100 Cb -0.04 -3.03 -0.25 0.00 0.00 0.00 0.00 36.38 33.07 2mfn s VAL 100 CO 0.06 0.52 0.17 2.30 0.00 0.00 0.00 175.10 178.15 2mfn n ILE 101 N 3.03 1.43 -4.16 2.22 -5.35 -0.99 -4.95 119.36 110.59 2mfn n ILE 101 Ca -0.18 -0.85 -0.16 0.00 -0.27 0.00 0.00 62.75 61.30 2mfn n ILE 101 Cb 0.53 -0.56 -0.13 0.00 -1.74 0.00 0.00 39.64 37.74 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 -2.51 0.61 -0.17 -1.28 0.00 -1.26 -5.03 121.76 112.12 2mfn s ALA 102 Ca -0.09 -0.52 0.01 0.00 0.00 0.00 0.00 51.96 51.35 2mfn s ALA 102 Cb 0.06 -0.07 0.02 0.00 0.00 0.00 0.00 23.12 23.14 2mfn s ALA 102 CO 0.83 0.08 -0.16 -1.54 0.00 0.00 0.00 175.76 174.97 2mfn s SER 103 N -0.82 3.02 0.23 0.00 1.04 -1.26 -0.95 113.70 114.97 2mfn s SER 103 Ca -0.02 -0.64 0.01 0.00 0.48 0.00 0.00 55.95 55.78 2mfn s SER 103 Cb -0.06 -1.33 -0.04 0.00 0.10 0.00 0.00 66.02 64.69 2mfn s SER 103 CO 0.00 -0.05 0.41 0.42 0.98 0.00 0.00 173.24 175.00 2mfn s THR 104 N 1.38 5.21 0.24 2.02 -4.23 0.24 -4.98 115.64 115.51 2mfn s THR 104 Ca 0.04 -0.52 -0.06 0.00 -1.18 0.00 0.00 61.69 59.97 2mfn s THR 104 Cb -0.14 -3.78 0.23 0.00 1.34 0.00 0.00 72.50 70.15 2mfn s THR 104 CO -0.11 -0.27 1.68 -0.65 -0.54 0.00 0.00 174.62 174.73 2mfn h PRO 105 N 1.63 0.23 0.00 3.99 0.10 -2.00 -2.68 132.00 133.27 2mfn h PRO 105 Ca -0.49 -0.01 0.00 0.00 0.10 0.00 0.00 66.00 65.60 2mfn h PRO 105 Cb 1.20 -0.05 0.00 0.00 0.10 0.00 0.00 31.00 32.25 2mfn h PRO 105 CO 0.66 0.15 -0.02 0.25 0.10 0.00 0.00 178.00 179.14 2mfn n THR 106 N -5.18 1.44 -3.87 -1.15 -2.24 -1.26 -4.48 114.28 97.53 2mfn n THR 106 Ca 0.13 -1.65 -0.09 0.00 -2.27 0.00 0.00 64.05 60.17 2mfn n THR 106 Cb 0.45 0.10 -0.06 0.00 -2.10 0.00 0.00 70.33 68.72 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 -2.02 -0.05 0.02 3.42 1.04 -1.01 -2.69 113.70 112.42 2mfn s SER 107 Ca 0.18 -0.72 0.00 0.00 0.48 0.00 0.00 55.95 55.89 2mfn s SER 107 Cb 0.16 0.47 -0.02 0.00 0.10 0.00 0.00 66.02 66.72 2mfn s SER 107 CO 0.02 -0.92 -0.04 -0.76 0.98 0.00 0.00 173.24 172.52 2mfn s LEU 108 N -2.92 2.24 -0.25 2.42 1.43 -0.92 0.82 118.68 121.49 2mfn s LEU 108 Ca 0.13 -0.51 -0.12 0.00 -1.03 0.00 0.00 54.13 52.61 2mfn s LEU 108 Cb 0.02 0.06 -0.05 0.00 0.03 0.00 0.00 46.19 46.26 2mfn s LEU 108 CO -0.02 -0.29 0.22 -0.22 0.23 0.00 0.00 176.35 176.26 2mfn s LEU 109 N -1.48 4.08 -0.06 1.79 0.20 -0.12 -0.47 118.68 122.61 2mfn s LEU 109 Ca -0.15 0.12 -0.01 0.00 0.69 0.00 0.00 54.13 54.78 2mfn s LEU 109 Cb -0.10 -2.18 -0.03 0.00 -0.43 0.00 0.00 46.19 43.44 2mfn s LEU 109 CO -0.01 -0.02 0.01 0.27 -0.29 0.00 0.00 176.35 176.31 2mfn s ILE 110 N 1.45 4.30 -0.04 6.68 -4.36 0.21 -2.34 121.20 127.09 2mfn s ILE 110 Ca 0.09 -0.33 -0.03 0.00 -0.26 0.00 0.00 60.65 60.12 2mfn s ILE 110 Cb -0.15 -2.84 0.02 0.00 1.25 0.00 0.00 42.46 40.74 2mfn s ILE 110 CO 0.08 0.54 0.11 -0.94 0.24 0.00 0.00 174.94 174.97 2mfn s SER 111 N -1.07 -0.09 0.06 4.36 1.04 -0.51 -0.43 113.70 117.05 2mfn s SER 111 Ca 0.15 0.21 -0.07 0.00 0.48 0.00 0.00 55.95 56.72 2mfn s SER 111 Cb -0.11 0.18 -0.01 0.00 0.10 0.00 0.00 66.02 66.18 2mfn s SER 111 CO 0.05 -0.07 0.14 -1.66 0.98 0.00 0.00 173.24 172.68 2mfn s TRP 112 N 0.44 0.17 0.19 5.02 -2.14 -0.82 -2.41 118.94 119.39 2mfn s TRP 112 Ca -0.03 -0.51 -0.30 0.00 2.66 0.00 0.00 56.10 57.92 2mfn s TRP 112 Cb -0.05 -0.11 -0.08 0.00 -3.10 0.00 0.00 33.47 30.14 2mfn s TRP 112 CO -0.02 -0.44 0.96 -1.21 -2.66 0.00 0.00 176.95 173.58 2mfn s GLU 113 N -3.12 4.78 0.23 3.25 0.41 0.23 -4.73 118.70 119.76 2mfn s GLU 113 Ca -0.01 1.50 -0.31 0.00 -0.41 0.00 0.00 54.97 55.74 2mfn s GLU 113 Cb 0.02 -3.31 -0.11 0.00 -1.78 0.00 0.00 34.13 28.94 2mfn s GLU 113 CO -0.07 0.38 1.63 -1.25 -0.49 0.00 0.00 175.26 175.47 2mfn s PRO 114 N -0.74 4.15 0.00 0.39 0.04 -1.26 -2.91 135.00 134.67 2mfn s PRO 114 Ca 0.44 2.53 0.00 0.00 0.04 0.00 0.00 61.00 64.01 2mfn s PRO 114 Cb -0.25 -3.07 0.00 0.00 0.04 0.00 0.00 34.50 31.21 2mfn s PRO 114 CO 0.32 -0.66 0.00 -0.35 0.04 0.00 0.00 177.00 176.34 2mfn n PRO 115 N 3.27 1.08 -0.11 0.56 -0.04 -1.26 -4.88 135.00 133.62 2mfn n PRO 115 Ca 0.12 0.00 0.12 0.00 -0.04 0.00 0.00 63.50 63.70 2mfn n PRO 115 Cb 0.37 0.00 0.18 0.00 -0.04 0.00 0.00 33.50 34.01 2mfn n PRO 115 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2mfn n ALA 116 N -3.00 2.44 -2.28 0.55 0.00 -1.26 -4.94 120.51 112.02 2mfn n ALA 116 Ca 0.00 -0.85 -0.15 0.00 0.00 0.00 0.00 53.44 52.43 2mfn n ALA 116 Cb 0.00 -0.86 -0.10 0.00 0.00 0.00 0.00 19.45 18.49 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 -1.72 1.35 0.18 0.00 -7.23 -1.26 -4.20 120.40 107.52 2mfn s VAL 117 Ca 0.34 -2.11 -0.30 0.00 -1.81 0.00 0.00 61.98 58.10 2mfn s VAL 117 Cb 0.22 -1.91 -0.08 0.00 0.56 0.00 0.00 36.38 35.17 2mfn s VAL 117 CO 0.31 -0.70 1.14 -0.55 -0.31 0.00 0.00 175.10 174.99 2mfn s SER 118 N -3.21 7.20 -0.11 4.85 0.15 -1.26 -5.02 113.70 116.29 2mfn s SER 118 Ca 0.18 2.13 -0.01 0.00 0.70 0.00 0.00 55.95 58.96 2mfn s SER 118 Cb 0.02 -2.60 -0.03 0.00 -1.71 0.00 0.00 66.02 61.69 2mfn s SER 118 CO 0.02 -0.28 -0.06 -0.69 1.20 0.00 0.00 173.24 173.44 2mfn s VAL 119 N -0.13 3.76 0.03 4.45 1.01 -1.26 -4.77 120.40 123.48 2mfn s VAL 119 Ca 0.51 -0.43 -0.20 0.00 0.00 0.00 0.00 61.98 61.85 2mfn s VAL 119 Cb -0.30 -2.59 -0.16 0.00 0.00 0.00 0.00 36.38 33.33 2mfn s VAL 119 CO 0.35 0.55 1.29 0.03 0.00 0.00 0.00 175.10 177.32 2mfn h ARG 120 N 5.96 0.36 -2.37 2.72 2.47 -1.61 -3.44 114.38 118.47 2mfn h ARG 120 Ca -0.40 -0.23 0.11 0.00 -1.26 0.00 0.00 59.98 58.21 2mfn h ARG 120 Cb 1.18 0.03 -0.13 0.00 -1.65 0.00 0.00 29.97 29.40 2mfn h ARG 120 CO 0.57 0.82 0.46 1.52 0.56 0.00 0.00 179.97 183.90 2mfn s TYR 121 N -4.05 -0.31 -0.04 3.04 1.13 -1.11 -3.71 117.35 112.31 2mfn s TYR 121 Ca -0.14 0.13 0.07 0.00 -1.41 0.00 0.00 57.07 55.72 2mfn s TYR 121 Cb 0.05 0.57 -0.02 0.00 -1.10 0.00 0.00 41.96 41.46 2mfn s TYR 121 CO 0.76 -0.65 -0.26 0.71 -2.51 0.00 0.00 175.55 173.61 2mfn s TYR 122 N -3.23 2.38 -0.25 -3.49 1.51 -0.91 -1.50 117.35 111.85 2mfn s TYR 122 Ca 0.06 -0.56 -0.15 0.00 -1.01 0.00 0.00 57.07 55.42 2mfn s TYR 122 Cb -0.01 -1.54 -0.04 0.00 -0.11 0.00 0.00 41.96 40.26 2mfn s TYR 122 CO -0.07 -0.11 0.37 0.50 -1.11 0.00 0.00 175.55 175.13 2mfn s ARG 123 N -0.43 4.06 -0.13 -0.62 6.06 0.30 -0.12 118.95 128.07 2mfn s ARG 123 Ca 0.04 0.08 -0.02 0.00 -2.50 0.00 0.00 55.73 53.33 2mfn s ARG 123 Cb -0.12 -3.62 -0.03 0.00 0.06 0.00 0.00 34.95 31.25 2mfn s ARG 123 CO 0.01 -0.20 -0.06 0.42 -2.50 0.00 0.00 175.30 172.97 2mfn s ILE 124 N 1.84 3.75 0.02 4.11 1.01 -0.28 0.87 121.20 132.52 2mfn s ILE 124 Ca 0.16 -0.42 0.05 0.00 0.00 0.00 0.00 60.65 60.43 2mfn s ILE 124 Cb -0.15 -2.61 -0.03 0.00 0.01 0.00 0.00 42.46 39.68 2mfn s ILE 124 CO 0.09 0.52 -0.12 0.42 0.00 0.00 0.00 174.94 175.86 2mfn s THR 125 N 0.07 3.28 0.04 2.92 -4.23 0.25 -1.28 115.64 116.68 2mfn s THR 125 Ca -0.01 -0.96 -0.21 0.00 -1.18 0.00 0.00 61.69 59.32 2mfn s THR 125 Cb -0.14 -2.41 -0.06 0.00 1.34 0.00 0.00 72.50 71.23 2mfn s THR 125 CO 0.03 0.36 0.63 -0.31 -0.54 0.00 0.00 174.62 174.79 2mfn s TYR 126 N -0.97 3.74 -0.18 3.99 1.51 0.13 -2.59 117.35 122.98 2mfn s TYR 126 Ca 0.16 1.30 -0.06 0.00 -1.01 0.00 0.00 57.07 57.46 2mfn s TYR 126 Cb -0.11 -2.63 -0.03 0.00 -0.11 0.00 0.00 41.96 39.08 2mfn s TYR 126 CO 0.07 0.41 0.01 0.20 -1.11 0.00 0.00 175.55 175.14 2mfn s GLY 127 N -0.49 1.80 0.05 0.71 0.00 0.41 -2.79 107.32 107.00 2mfn s GLY 127 Ca 0.32 -0.83 0.04 0.00 0.00 0.00 0.00 44.72 44.25 2mfn s GLY 127 CO 0.19 0.05 -0.01 -0.54 0.00 0.00 0.00 173.10 172.79 2mfn s GLU 128 N 0.52 2.60 0.65 2.90 2.02 -1.26 -1.32 118.70 124.80 2mfn s GLU 128 Ca -0.00 -0.76 0.00 0.00 0.02 0.00 0.00 54.97 54.23 2mfn s GLU 128 Cb -0.14 -2.57 0.00 0.00 0.10 0.00 0.00 34.13 31.53 2mfn s GLU 128 CO 0.02 0.57 0.98 0.25 0.02 0.00 0.00 175.26 177.10 2mfn n THR 129 N 0.95 0.00 -2.67 3.63 -2.24 -0.00 0.10 114.28 114.04 2mfn n THR 129 Ca -0.13 0.98 -0.35 0.00 -2.27 0.00 0.00 64.05 62.28 2mfn n THR 129 Cb 0.52 -1.96 -0.00 0.00 -2.10 0.00 0.00 70.33 66.80 2mfn n THR 129 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2mfn n GLY 130 N -1.48 5.91 0.33 3.38 0.00 -1.26 -4.82 105.19 107.25 2mfn n GLY 130 Ca 0.00 -2.65 0.00 0.00 0.00 0.00 0.00 46.02 43.37 2mfn n GLY 130 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2mfn n GLY 131 N -0.19 -0.50 0.38 -0.02 0.00 0.12 0.17 105.19 105.14 2mfn n GLY 131 Ca 0.42 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.42 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 -4.11 1.61 -0.73 -1.87 -3.42 115.58 108.22 2mfn h ASN 132 Ca 0.00 -0.03 -0.50 0.00 1.87 0.00 0.00 56.30 57.64 2mfn h ASN 132 Cb 2.00 -0.29 0.07 0.00 0.27 0.00 0.00 38.32 40.38 2mfn h ASN 132 CO -0.00 0.84 0.42 -0.44 -0.37 0.00 0.00 177.43 177.87 2mfn s SER 133 N -6.12 5.69 0.01 1.15 0.01 0.44 -4.91 113.70 109.97 2mfn s SER 133 Ca -0.13 2.11 -0.34 0.00 1.31 0.00 0.00 55.95 58.90 2mfn s SER 133 Cb 0.18 -2.57 -0.13 0.00 0.21 0.00 0.00 66.02 63.71 2mfn s SER 133 CO 0.82 -1.24 1.75 -2.65 0.41 0.00 0.00 173.24 172.33 2mfn n PRO 134 N -1.47 2.13 -1.18 12.44 -0.01 -1.26 -4.91 135.00 140.73 2mfn n PRO 134 Ca 0.11 0.78 -0.30 0.00 -0.01 0.00 0.00 63.50 64.07 2mfn n PRO 134 Cb 0.51 -2.58 0.12 0.00 -0.01 0.00 0.00 33.50 31.54 2mfn n PRO 134 CO 0.00 0.00 0.00 0.14 -0.01 0.00 0.00 175.50 175.63 2mfn s VAL 135 N 2.76 2.89 -0.39 -1.45 -7.23 -1.26 -4.97 120.40 110.75 2mfn s VAL 135 Ca 0.87 0.29 -0.18 0.00 -1.81 0.00 0.00 61.98 61.15 2mfn s VAL 135 Cb -0.70 -2.74 0.01 0.00 0.56 0.00 0.00 36.38 33.51 2mfn s VAL 135 CO 0.46 -0.38 0.51 -1.10 -0.31 0.00 0.00 175.10 174.28 2mfn s GLN 136 N -4.89 3.41 -0.10 4.82 -0.21 -1.12 -4.70 119.66 116.86 2mfn s GLN 136 Ca 0.63 -0.38 -0.05 0.00 0.02 0.00 0.00 55.36 55.58 2mfn s GLN 136 Cb -0.18 -3.88 -0.04 0.00 1.00 0.00 0.00 33.01 29.91 2mfn s GLN 136 CO 0.57 -0.76 0.09 -1.21 -2.12 0.00 0.00 175.29 171.86 2mfn s GLU 137 N 2.38 3.28 0.03 2.91 8.01 -1.26 0.21 118.70 134.26 2mfn s GLU 137 Ca 0.17 -0.23 -0.05 0.00 0.01 0.00 0.00 54.97 54.87 2mfn s GLU 137 Cb -0.16 -3.05 -0.01 0.00 -4.31 0.00 0.00 34.13 26.60 2mfn s GLU 137 CO 0.14 0.75 0.08 -0.59 0.01 0.00 0.00 175.26 175.65 2mfn s PHE 138 N -0.99 0.21 0.51 1.61 -0.12 -0.40 -4.96 117.98 113.84 2mfn s PHE 138 Ca 0.15 -0.49 -0.04 0.00 -0.05 0.00 0.00 56.93 56.50 2mfn s PHE 138 Cb -0.12 -0.15 -0.01 0.00 -0.63 0.00 0.00 43.02 42.11 2mfn s PHE 138 CO 0.04 -0.33 0.80 0.95 -0.05 0.00 0.00 175.22 176.62 2mfn s THR 139 N -2.38 4.17 -0.28 -4.49 -4.23 -1.26 -1.12 115.64 106.04 2mfn s THR 139 Ca -0.07 -0.08 0.02 0.00 -1.18 0.00 0.00 61.69 60.38 2mfn s THR 139 Cb -0.03 -3.60 0.08 0.00 1.34 0.00 0.00 72.50 70.29 2mfn s THR 139 CO -0.04 -0.55 -0.01 -0.69 -0.54 0.00 0.00 174.62 172.80 2mfn s VAL 140 N -2.78 1.78 0.00 2.29 1.01 0.83 -4.86 120.40 118.66 2mfn s VAL 140 Ca 0.50 -1.68 0.00 0.00 0.00 0.00 0.00 61.98 60.80 2mfn s VAL 140 Cb -0.10 -2.14 0.00 0.00 0.00 0.00 0.00 36.38 34.14 2mfn s VAL 140 CO 0.43 -0.33 0.00 -2.65 0.00 0.00 0.00 175.10 172.55 2mfn n PRO 141 N 4.52 0.00 -1.65 2.72 -0.02 -1.26 -2.15 135.00 137.16 2mfn n PRO 141 Ca -0.06 0.00 -0.01 0.00 -2.02 0.00 0.00 63.50 61.41 2mfn n PRO 141 Cb 0.43 -1.49 -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 1.56 -0.26 0.20 -1.23 0.00 -1.24 -4.62 105.19 99.60 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 -0.03 0.37 -5.56 1.61 4.64 -1.90 -3.46 113.55 109.22 2mfn h SER 143 Ca -0.02 -0.16 -0.27 0.00 -0.47 0.00 0.00 61.79 60.87 2mfn h SER 143 Cb 0.55 -0.10 -0.10 0.00 -0.31 0.00 0.00 62.40 62.43 2mfn h SER 143 CO 0.03 0.75 -0.29 -0.54 -0.87 0.00 0.00 176.83 175.91 2mfn s LYS 144 N -4.14 1.75 0.00 4.77 1.02 -1.26 -5.03 119.74 116.85 2mfn s LYS 144 Ca -0.05 -1.72 0.28 0.00 0.02 0.00 0.00 55.97 54.50 2mfn s LYS 144 Cb 0.13 0.41 1.05 0.00 -0.52 0.00 0.00 37.83 38.89 2mfn s LYS 144 CO 0.79 -0.70 1.74 -1.13 -0.92 0.00 0.00 175.35 175.14 2mfn n SER 145 N -1.15 1.50 -4.07 2.83 3.41 -1.26 -4.87 113.62 110.02 2mfn n SER 145 Ca 0.02 -1.50 -0.13 0.00 -0.26 0.00 0.00 58.87 57.00 2mfn n SER 145 Cb 0.62 -0.00 -0.11 0.00 -0.26 0.00 0.00 64.21 64.46 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 -2.00 0.53 0.33 6.66 -4.23 -1.26 -1.95 115.64 113.72 2mfn s THR 146 Ca 0.38 -1.15 -0.03 0.00 -1.18 0.00 0.00 61.69 59.70 2mfn s THR 146 Cb 0.21 -0.69 0.00 0.00 1.34 0.00 0.00 72.50 73.36 2mfn s THR 146 CO 0.33 -0.44 0.46 0.00 -0.54 0.00 0.00 174.62 174.44 2mfn s ALA 147 N -1.60 0.71 0.34 3.99 0.00 0.43 -4.97 121.76 120.66 2mfn s ALA 147 Ca -0.08 -1.48 0.07 0.00 0.00 0.00 0.00 51.96 50.47 2mfn s ALA 147 Cb -0.09 1.16 -0.07 0.00 0.00 0.00 0.00 23.12 24.13 2mfn s ALA 147 CO -0.00 -0.79 -0.03 0.99 0.00 0.00 0.00 175.76 175.93 2mfn s THR 148 N -3.17 1.87 -0.08 0.00 2.01 -1.26 0.65 115.64 115.66 2mfn s THR 148 Ca 0.30 -2.10 0.03 0.00 0.31 0.00 0.00 61.69 60.24 2mfn s THR 148 Cb -0.00 -2.72 0.00 0.00 0.01 0.00 0.00 72.50 69.79 2mfn s THR 148 CO 0.19 -0.14 -0.19 -0.63 -0.69 0.00 0.00 174.62 173.16 2mfn s ILE 149 N -2.84 1.65 0.41 1.82 1.01 0.38 -4.91 121.20 118.71 2mfn s ILE 149 Ca 0.33 -0.78 0.05 0.00 0.00 0.00 0.00 60.65 60.24 2mfn s ILE 149 Cb 0.06 -1.44 -0.06 0.00 0.01 0.00 0.00 42.46 41.03 2mfn s ILE 149 CO 0.16 0.47 0.03 0.20 0.00 0.00 0.00 174.94 175.80 2mfn s ASN 150 N 0.43 3.40 -1.26 3.58 -0.87 -1.26 -2.16 114.94 116.81 2mfn s ASN 150 Ca -0.16 -1.47 -0.08 0.00 -1.57 0.00 0.00 52.86 49.59 2mfn s ASN 150 Cb -0.17 -0.02 0.01 0.00 -0.02 0.00 0.00 41.25 41.06 2mfn s ASN 150 CO 0.06 -0.63 1.10 0.59 -2.57 0.00 0.00 177.10 175.65 2mfn n ASN 151 N -0.99 -5.95 -4.99 -1.22 5.03 -1.24 -4.98 115.26 100.91 2mfn n ASN 151 Ca -0.07 -0.50 -0.19 0.00 0.87 0.00 0.00 54.58 54.68 2mfn n ASN 151 Cb 0.67 -4.72 0.01 0.00 -1.02 0.00 0.00 39.78 34.72 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 -3.30 3.34 -0.43 2.41 2.07 -1.09 -5.07 121.20 119.12 2mfn s ILE 152 Ca 0.53 -0.87 -0.05 0.00 -1.41 0.00 0.00 60.65 58.85 2mfn s ILE 152 Cb -0.23 -3.17 0.11 0.00 0.13 0.00 0.00 42.46 39.30 2mfn s ILE 152 CO 0.68 -0.08 0.26 -0.75 -1.91 0.00 0.00 174.94 173.13 2mfn s LYS 153 N -4.41 2.18 0.93 3.50 2.47 -1.26 -4.90 119.74 118.25 2mfn s LYS 153 Ca 0.52 -1.80 -0.11 0.00 -1.56 0.00 0.00 55.97 53.02 2mfn s LYS 153 Cb -0.10 -3.71 0.15 0.00 -1.46 0.00 0.00 37.83 32.71 2mfn s LYS 153 CO 0.34 -1.12 1.09 -1.25 0.16 0.00 0.00 175.35 174.58 2mfn s PRO 154 N 1.23 1.00 -0.00 4.03 0.05 -1.26 -3.92 135.00 136.12 2mfn s PRO 154 Ca 0.07 1.00 0.00 0.00 0.05 0.00 0.00 61.00 62.12 2mfn s PRO 154 Cb -0.24 -1.76 0.00 0.00 0.05 0.00 0.00 34.50 32.54 2mfn s PRO 154 CO -0.03 -2.47 0.00 0.41 0.05 0.00 0.00 177.00 174.96 2mfn n GLY 155 N -0.60 0.39 3.25 0.56 0.00 -1.26 -5.03 105.19 102.50 2mfn n GLY 155 Ca 0.08 -1.05 -0.11 0.00 0.00 0.00 0.00 46.02 44.94 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 -2.00 -0.61 0.57 4.61 0.00 -1.25 -5.00 121.76 118.07 2mfn s ALA 156 Ca 0.00 -0.15 -0.18 0.00 0.00 0.00 0.00 51.96 51.63 2mfn s ALA 156 Cb 0.00 0.41 -0.05 0.00 0.00 0.00 0.00 23.12 23.48 2mfn s ALA 156 CO 0.00 -0.47 1.12 0.34 0.00 0.00 0.00 175.76 176.75 2mfn s ASP 157 N -2.35 5.61 0.06 0.00 -1.08 -1.26 -1.46 116.67 116.19 2mfn s ASP 157 Ca -0.02 2.13 -0.03 0.00 -0.52 0.00 0.00 52.55 54.11 2mfn s ASP 157 Cb 0.01 -2.57 -0.03 0.00 -1.46 0.00 0.00 42.92 38.87 2mfn s ASP 157 CO -0.06 -1.29 0.03 -0.31 0.52 0.00 0.00 175.17 174.06 2mfn s TYR 158 N -1.91 0.40 -0.09 -5.34 1.51 0.27 -0.82 117.35 111.37 2mfn s TYR 158 Ca 0.71 -0.89 0.00 0.00 -1.01 0.00 0.00 57.07 55.88 2mfn s TYR 158 Cb -0.23 -0.29 0.02 0.00 -0.11 0.00 0.00 41.96 41.36 2mfn s TYR 158 CO 0.30 -0.41 -0.07 0.99 -1.11 0.00 0.00 175.55 175.24 2mfn s THR 159 N -3.73 0.93 -0.26 -0.71 2.01 -0.43 0.88 115.64 114.33 2mfn s THR 159 Ca 0.05 -0.27 -0.09 0.00 0.31 0.00 0.00 61.69 61.69 2mfn s THR 159 Cb 0.06 -0.94 -0.04 0.00 0.01 0.00 0.00 72.50 71.59 2mfn s THR 159 CO -0.10 0.34 0.12 -0.63 -0.69 0.00 0.00 174.62 173.66 2mfn s ILE 160 N 1.43 4.76 0.01 1.82 -1.09 -0.17 0.15 121.20 128.11 2mfn s ILE 160 Ca -0.01 -0.02 0.04 0.00 -2.23 0.00 0.00 60.65 58.43 2mfn s ILE 160 Cb -0.13 -3.24 -0.01 0.00 -1.58 0.00 0.00 42.46 37.49 2mfn s ILE 160 CO -0.04 0.31 -0.12 -0.89 -1.23 0.00 0.00 174.94 172.97 2mfn s THR 161 N 1.61 0.91 0.07 2.92 2.01 -1.07 -1.01 115.64 121.09 2mfn s THR 161 Ca 0.06 -0.63 0.02 0.00 0.31 0.00 0.00 61.69 61.46 2mfn s THR 161 Cb -0.15 -0.79 -0.03 0.00 0.01 0.00 0.00 72.50 71.53 2mfn s THR 161 CO 0.07 0.16 -0.08 -1.48 -0.69 0.00 0.00 174.62 172.59 2mfn s LEU 162 N -0.53 2.38 -0.01 4.42 2.34 -0.98 0.84 118.68 127.14 2mfn s LEU 162 Ca 0.03 -0.77 0.08 0.00 0.06 0.00 0.00 54.13 53.53 2mfn s LEU 162 Cb -0.05 -0.17 -0.02 0.00 -0.56 0.00 0.00 46.19 45.39 2mfn s LEU 162 CO 0.00 -0.31 -0.26 -0.31 -1.06 0.00 0.00 176.35 174.41 2mfn s TYR 163 N -2.42 2.33 -0.19 3.48 1.51 0.25 -2.76 117.35 119.55 2mfn s TYR 163 Ca 0.01 -0.44 -0.05 0.00 -1.01 0.00 0.00 57.07 55.59 2mfn s TYR 163 Cb -0.03 -1.48 -0.03 0.00 -0.11 0.00 0.00 41.96 40.31 2mfn s TYR 163 CO -0.02 -0.02 0.00 0.00 -1.11 0.00 0.00 175.55 174.41 2mfn s ALA 164 N -0.64 3.07 -0.15 3.71 0.00 -1.26 0.11 121.76 126.60 2mfn s ALA 164 Ca 0.10 -0.95 -0.00 0.00 0.00 0.00 0.00 51.96 51.11 2mfn s ALA 164 Cb -0.10 -1.77 -0.01 0.00 0.00 0.00 0.00 23.12 21.24 2mfn s ALA 164 CO -0.01 -0.08 -0.13 0.08 0.00 0.00 0.00 175.76 175.63 2mfn s VAL 165 N 0.87 2.97 0.01 0.00 1.01 -0.56 -2.79 120.40 121.91 2mfn s VAL 165 Ca 0.01 -0.67 0.00 0.00 0.00 0.00 0.00 61.98 61.32 2mfn s VAL 165 Cb -0.14 -2.26 0.00 0.00 0.00 0.00 0.00 36.38 33.97 2mfn s VAL 165 CO 0.02 0.51 0.00 0.35 0.00 0.00 0.00 175.10 175.98 2mfn n THR 166 N 3.82 0.08 -1.67 3.92 -2.24 -1.26 -1.86 114.28 115.07 2mfn n THR 166 Ca -0.18 0.03 -0.45 0.00 -2.27 0.00 0.00 64.05 61.17 2mfn n THR 166 Cb 0.52 -0.98 -0.04 0.00 -2.10 0.00 0.00 70.33 67.74 2mfn n THR 166 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2mfn n GLY 167 N 3.37 1.60 0.03 3.38 0.00 -1.26 -4.55 105.19 107.75 2mfn n GLY 167 Ca 0.00 0.82 0.03 0.00 0.00 0.00 0.00 46.02 46.87 2mfn n GLY 167 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2mfn n ARG 168 N 6.59 2.51 0.00 1.61 1.74 -1.26 -3.99 116.66 123.86 2mfn n ARG 168 Ca 0.21 -1.82 0.00 0.00 -0.77 0.00 0.00 57.85 55.47 2mfn n ARG 168 Cb 0.34 -1.15 0.00 0.00 -1.02 0.00 0.00 32.46 30.63 2mfn n ARG 168 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2mfn n GLY 169 N -0.76 0.32 0.49 -0.13 0.00 -1.26 -4.85 105.19 99.00 2mfn n GLY 169 Ca 0.05 -0.52 0.13 0.00 0.00 0.00 0.00 46.02 45.68 2mfn n GLY 169 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2mfn n ASP 170 N 0.00 1.53 -3.35 1.61 8.00 -1.26 -4.38 116.55 118.71 2mfn n ASP 170 Ca 0.00 -1.53 -0.26 0.00 0.71 0.00 0.00 54.79 53.71 2mfn n ASP 170 Cb 0.00 -0.02 -0.08 0.00 -0.02 0.00 0.00 41.12 41.01 2mfn n ASP 170 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 2mfn n SER 171 N 0.20 1.89 -4.58 -2.24 7.64 -1.26 -5.07 113.62 110.21 2mfn n SER 171 Ca 0.19 -3.04 -0.40 0.00 1.01 0.00 0.00 58.87 56.63 2mfn n SER 171 Cb 0.35 -0.65 -0.03 0.00 -1.01 0.00 0.00 64.21 62.87 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 -1.70 2.85 -0.01 1.43 0.05 -1.26 -4.76 135.00 131.60 2mfn s PRO 172 Ca 0.36 1.30 0.08 0.00 0.05 0.00 0.00 61.00 62.80 2mfn s PRO 172 Cb 0.14 -4.36 -0.02 0.00 0.05 0.00 0.00 34.50 30.31 2mfn s PRO 172 CO -0.08 -2.43 -0.26 0.00 0.05 0.00 0.00 177.00 174.28 2mfn s ALA 173 N 8.82 2.18 0.04 8.56 0.00 -1.26 -5.05 121.76 135.06 2mfn s ALA 173 Ca 0.83 -1.15 0.09 0.00 0.00 0.00 0.00 51.96 51.74 2mfn s ALA 173 Cb -0.20 -0.54 -0.03 0.00 0.00 0.00 0.00 23.12 22.35 2mfn s ALA 173 CO 0.29 0.53 -0.26 -1.54 0.00 0.00 0.00 175.76 174.78 2mfn s SER 174 N -0.72 3.18 0.64 0.00 1.04 -1.26 -4.06 113.70 112.52 2mfn s SER 174 Ca 0.10 -0.58 -0.17 0.00 0.48 0.00 0.00 55.95 55.79 2mfn s SER 174 Cb -0.10 -0.30 -0.01 0.00 0.10 0.00 0.00 66.02 65.71 2mfn s SER 174 CO -0.00 0.26 1.17 -0.94 0.98 0.00 0.00 173.24 174.71 2mfn s SER 175 N -1.21 4.95 0.23 7.02 1.04 -1.12 -4.87 113.70 119.74 2mfn s SER 175 Ca 0.12 2.24 -0.30 0.00 0.48 0.00 0.00 55.95 58.48 2mfn s SER 175 Cb -0.10 -2.58 -0.15 0.00 0.10 0.00 0.00 66.02 63.29 2mfn s SER 175 CO 0.02 -1.74 1.10 0.29 0.98 0.00 0.00 173.24 173.88 2mfn n LYS 176 N -2.11 1.28 -1.79 4.02 4.76 -1.26 -4.48 118.16 118.57 2mfn n LYS 176 Ca 0.12 0.45 -0.40 0.00 -2.87 0.00 0.00 58.31 55.62 2mfn n LYS 176 Cb 0.51 -1.89 0.01 0.00 -1.84 0.00 0.00 35.03 31.82 2mfn n LYS 176 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 2mfn s PRO 177 N -0.91 3.76 -0.13 1.97 0.04 -1.26 -4.84 135.00 133.63 2mfn s PRO 177 Ca 0.66 2.45 0.01 0.00 0.04 0.00 0.00 61.00 64.16 2mfn s PRO 177 Cb -0.77 -2.71 -0.01 0.00 0.04 0.00 0.00 34.50 31.05 2mfn s PRO 177 CO 0.55 -0.77 -0.16 0.08 0.04 0.00 0.00 177.00 176.74 2mfn s VAL 178 N -1.19 2.73 0.11 -0.36 1.01 -1.11 -4.99 120.40 116.60 2mfn s VAL 178 Ca 0.59 -0.77 0.08 0.00 0.00 0.00 0.00 61.98 61.88 2mfn s VAL 178 Cb -0.44 -2.12 -0.04 0.00 0.00 0.00 0.00 36.38 33.78 2mfn s VAL 178 CO 0.58 0.53 -0.19 -0.94 0.00 0.00 0.00 175.10 175.08 2mfn s SER 179 N 0.42 2.41 0.11 3.32 1.04 -1.26 -2.31 113.70 117.43 2mfn s SER 179 Ca -0.12 -0.70 0.02 0.00 0.48 0.00 0.00 55.95 55.63 2mfn s SER 179 Cb -0.16 -0.13 -0.04 0.00 0.10 0.00 0.00 66.02 65.79 2mfn s SER 179 CO 0.06 0.02 -0.07 0.27 0.98 0.00 0.00 173.24 174.49 2mfn s ILE 180 N -1.32 0.81 -0.08 -1.02 -4.36 -0.18 -4.99 121.20 110.05 2mfn s ILE 180 Ca 0.06 -1.97 -0.09 0.00 -0.26 0.00 0.00 60.65 58.40 2mfn s ILE 180 Cb -0.09 -1.73 -0.05 0.00 1.25 0.00 0.00 42.46 41.85 2mfn s ILE 180 CO 0.04 -0.84 0.23 0.20 0.24 0.00 0.00 174.94 174.81 2mfn s ASN 181 N -3.07 6.52 -0.07 4.36 -0.87 -1.26 -1.00 114.94 119.54 2mfn s ASN 181 Ca 0.13 0.62 -0.02 0.00 -1.57 0.00 0.00 52.86 52.02 2mfn s ASN 181 Cb 0.05 -2.12 0.03 0.00 -0.02 0.00 0.00 41.25 39.18 2mfn s ASN 181 CO -0.03 0.38 0.03 -0.47 -2.57 0.00 0.00 177.10 174.43 2mfn s TYR 182 N -1.06 0.41 -0.03 2.20 6.14 0.25 -4.86 117.35 120.40 2mfn s TYR 182 Ca 0.18 -0.01 -0.20 0.00 0.64 0.00 0.00 57.07 57.68 2mfn s TYR 182 Cb -0.13 -0.67 -0.05 0.00 0.42 0.00 0.00 41.96 41.52 2mfn s TYR 182 CO 0.08 -0.29 0.57 0.15 0.64 0.00 0.00 175.55 176.70 2mfn s LYS 183 N 2.06 4.31 0.00 4.97 -0.14 -1.26 0.97 119.74 130.65 2mfn s LYS 183 Ca 0.05 0.68 0.25 0.00 -1.36 0.00 0.00 55.97 55.58 2mfn s LYS 183 Cb -0.12 -3.36 0.37 0.00 -1.68 0.00 0.00 37.83 33.03 2mfn s LYS 183 CO -0.05 0.32 1.36 0.25 -0.76 0.00 0.00 175.35 176.47