#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 2.08 0.00 0.99 1.43 -1.26 -5.08 118.68 116.84 2mfn s LEU 2 Ca 0.00 -0.54 -0.30 0.00 -1.03 0.00 0.00 54.13 52.26 2mfn s LEU 2 Cb 0.00 -1.39 -0.03 0.00 0.03 0.00 0.00 46.19 44.80 2mfn s LEU 2 CO 0.00 0.18 0.98 -1.81 0.23 0.00 0.00 176.35 175.93 2mfn s ASP 3 N 0.24 7.37 0.34 2.29 1.01 -1.26 -3.99 116.67 122.67 2mfn s ASP 3 Ca -0.16 1.66 -0.16 0.00 0.71 0.00 0.00 52.55 54.61 2mfn s ASP 3 Cb -0.17 -2.57 -0.09 0.00 1.01 0.00 0.00 42.92 41.10 2mfn s ASP 3 CO 0.08 -0.26 0.77 -0.94 0.21 0.00 0.00 175.17 175.03 2mfn s SER 4 N 0.99 6.81 0.53 0.27 1.04 -1.26 -4.58 113.70 117.50 2mfn s SER 4 Ca 0.52 1.35 -0.22 0.00 0.48 0.00 0.00 55.95 58.08 2mfn s SER 4 Cb -0.21 -2.40 -0.06 0.00 0.10 0.00 0.00 66.02 63.45 2mfn s SER 4 CO 0.28 -0.22 1.24 -2.65 0.98 0.00 0.00 173.24 172.86 2mfn n PRO 5 N -0.37 1.53 0.00 4.02 -0.01 -1.26 -4.62 135.00 134.28 2mfn n PRO 5 Ca 0.04 0.56 0.00 0.00 -0.01 0.00 0.00 63.50 64.09 2mfn n PRO 5 Cb 0.53 -2.42 0.00 0.00 -0.01 0.00 0.00 33.50 31.60 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 -1.01 0.00 -1.56 3.45 -2.24 -1.00 -4.83 114.28 107.09 2mfn n THR 6 Ca 0.10 0.00 -0.19 0.00 -2.27 0.00 0.00 64.05 61.69 2mfn n THR 6 Cb 0.44 0.00 -0.08 0.00 -2.10 0.00 0.00 70.33 68.59 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 0.00 1.83 3.67 3.38 0.00 -1.26 -0.51 105.19 112.30 2mfn n GLY 7 Ca 0.00 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.57 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 -2.36 2.13 -3.59 1.61 7.35 -1.26 -4.39 117.46 116.95 2mfn n PHE 8 Ca -0.19 0.45 -0.16 0.00 -0.76 0.00 0.00 57.45 56.78 2mfn n PHE 8 Cb 0.67 -2.45 -0.07 0.00 0.35 0.00 0.00 39.48 37.98 2mfn n PHE 8 CO 0.00 0.00 0.00 0.34 -0.76 0.00 0.00 176.76 176.34 2mfn s ASP 9 N 0.26 -0.59 -0.07 -2.13 -1.08 -0.15 -5.00 116.67 107.90 2mfn s ASP 9 Ca 0.68 0.77 0.04 0.00 -0.52 0.00 0.00 52.55 53.51 2mfn s ASP 9 Cb -0.65 0.70 -0.02 0.00 -1.46 0.00 0.00 42.92 41.48 2mfn s ASP 9 CO 0.50 -0.49 -0.19 -0.44 0.52 0.00 0.00 175.17 175.07 2mfn s SER 10 N -0.84 3.58 0.04 -0.34 0.01 -1.26 -0.65 113.70 114.24 2mfn s SER 10 Ca -0.09 -0.37 -0.01 0.00 1.31 0.00 0.00 55.95 56.79 2mfn s SER 10 Cb -0.02 -1.05 0.00 0.00 0.21 0.00 0.00 66.02 65.17 2mfn s SER 10 CO 0.07 0.25 0.06 -1.54 0.41 0.00 0.00 173.24 172.49 2mfn n SER 11 N 2.92 -0.17 -4.04 2.44 3.41 -0.95 -4.89 113.62 112.33 2mfn n SER 11 Ca -0.18 -1.19 -0.32 0.00 -0.26 0.00 0.00 58.87 56.92 2mfn n SER 11 Cb 0.52 0.31 -0.00 0.00 -0.26 0.00 0.00 64.21 64.78 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 -1.77 -3.54 -4.71 4.04 8.00 -1.26 -1.81 116.55 115.49 2mfn n ASP 12 Ca -0.00 -0.90 -0.42 0.00 0.71 0.00 0.00 54.79 54.18 2mfn n ASP 12 Cb 0.06 -3.33 -0.03 0.00 -0.02 0.00 0.00 41.12 37.80 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 -3.38 4.58 0.25 0.53 -1.09 -1.26 -1.70 121.20 119.13 2mfn s ILE 13 Ca 0.60 1.90 0.07 0.00 -2.23 0.00 0.00 60.65 60.99 2mfn s ILE 13 Cb -0.31 -4.21 -0.05 0.00 -1.58 0.00 0.00 42.46 36.30 2mfn s ILE 13 CO 0.88 0.17 -0.10 0.42 -1.23 0.00 0.00 174.94 175.08 2mfn s THR 14 N 0.84 1.74 0.07 2.92 -4.23 1.54 -4.84 115.64 113.68 2mfn s THR 14 Ca 0.53 -2.18 -0.37 0.00 -1.18 0.00 0.00 61.69 58.49 2mfn s THR 14 Cb -0.24 -2.30 -0.20 0.00 1.34 0.00 0.00 72.50 71.11 2mfn s THR 14 CO 0.29 -0.41 1.56 0.00 -0.54 0.00 0.00 174.62 175.52 2mfn h ALA 15 N 2.38 -1.32 -0.02 3.99 0.00 -1.81 -2.97 119.26 119.51 2mfn h ALA 15 Ca -0.39 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.24 2mfn h ALA 15 Cb 1.23 0.58 0.00 0.00 0.00 0.00 0.00 17.79 19.60 2mfn h ALA 15 CO 0.65 -1.25 -0.00 0.27 0.00 0.00 0.00 179.25 178.92 2mfn n ASN 16 N -5.63 1.72 -3.78 0.00 0.23 -1.26 -3.57 115.26 102.97 2mfn n ASN 16 Ca -0.16 -1.57 -0.11 0.00 -0.53 0.00 0.00 54.58 52.21 2mfn n ASN 16 Cb 0.52 0.00 -0.07 0.00 -2.08 0.00 0.00 39.78 38.15 2mfn n ASN 16 CO 0.00 0.00 0.00 -0.94 -0.93 0.00 0.00 177.26 175.39 2mfn s SER 17 N -2.00 -0.06 -0.20 0.53 1.04 -1.12 -0.84 113.70 111.05 2mfn s SER 17 Ca 0.37 -0.30 -0.28 0.00 0.48 0.00 0.00 55.95 56.22 2mfn s SER 17 Cb 0.21 0.34 0.10 0.00 0.10 0.00 0.00 66.02 66.78 2mfn s SER 17 CO 0.33 -0.63 0.89 0.72 0.98 0.00 0.00 173.24 175.53 2mfn s PHE 18 N -2.79 -0.55 0.13 5.02 -0.12 -0.96 0.44 117.98 119.16 2mfn s PHE 18 Ca -0.03 1.16 -0.03 0.00 -0.05 0.00 0.00 56.93 57.98 2mfn s PHE 18 Cb -0.00 0.38 -0.05 0.00 -0.63 0.00 0.00 43.02 42.72 2mfn s PHE 18 CO -0.05 -0.36 0.33 0.99 -0.05 0.00 0.00 175.22 176.08 2mfn s THR 19 N -0.38 5.23 -0.08 -4.49 2.01 -0.69 -2.51 115.64 114.73 2mfn s THR 19 Ca -0.02 -0.13 0.05 0.00 0.31 0.00 0.00 61.69 61.90 2mfn s THR 19 Cb -0.03 -3.64 -0.00 0.00 0.01 0.00 0.00 72.50 68.84 2mfn s THR 19 CO 0.01 0.04 -0.24 -0.69 -0.69 0.00 0.00 174.62 173.04 2mfn s VAL 20 N -1.65 2.06 0.03 3.82 1.01 -0.77 -2.24 120.40 122.65 2mfn s VAL 20 Ca 0.39 -1.04 0.07 0.00 0.00 0.00 0.00 61.98 61.40 2mfn s VAL 20 Cb -0.12 -1.76 -0.02 0.00 0.00 0.00 0.00 36.38 34.48 2mfn s VAL 20 CO 0.26 0.56 -0.19 -1.00 0.00 0.00 0.00 175.10 174.73 2mfn s HIS 21 N 0.11 1.72 0.02 5.22 3.76 0.17 -1.94 115.29 124.36 2mfn s HIS 21 Ca -0.12 -0.36 -0.11 0.00 -0.15 0.00 0.00 55.06 54.32 2mfn s HIS 21 Cb -0.16 -1.05 0.01 0.00 1.11 0.00 0.00 32.58 32.49 2mfn s HIS 21 CO 0.07 0.05 0.24 1.67 -0.85 0.00 0.00 174.74 175.91 2mfn s TRP 22 N -0.70 -0.04 0.01 1.40 -2.14 -0.82 -0.98 118.94 115.68 2mfn s TRP 22 Ca 0.07 -0.07 -0.11 0.00 2.66 0.00 0.00 56.10 58.64 2mfn s TRP 22 Cb -0.08 0.02 -0.05 0.00 -3.10 0.00 0.00 33.47 30.26 2mfn s TRP 22 CO 0.01 -0.42 0.35 0.08 -2.66 0.00 0.00 176.95 174.32 2mfn s VAL 23 N -2.10 5.15 0.23 -0.66 1.01 0.34 -4.79 120.40 119.57 2mfn s VAL 23 Ca -0.08 0.55 -0.30 0.00 0.00 0.00 0.00 61.98 62.15 2mfn s VAL 23 Cb -0.03 -3.63 -0.09 0.00 0.00 0.00 0.00 36.38 32.63 2mfn s VAL 23 CO -0.01 0.47 1.17 0.00 0.00 0.00 0.00 175.10 176.72 2mfn s ALA 24 N -1.20 3.43 1.00 5.51 0.00 -1.26 -2.38 121.76 126.86 2mfn s ALA 24 Ca 0.26 0.95 0.00 0.00 0.00 0.00 0.00 51.96 53.17 2mfn s ALA 24 Cb -0.15 -3.39 0.00 0.00 0.00 0.00 0.00 23.12 19.59 2mfn s ALA 24 CO 0.14 -0.31 0.00 -0.35 0.00 0.00 0.00 175.76 175.24 2mfn n PRO 25 N 1.95 -0.30 -0.34 0.00 -0.04 -1.26 -4.86 135.00 130.15 2mfn n PRO 25 Ca 0.02 0.00 0.08 0.00 -0.04 0.00 0.00 63.50 63.56 2mfn n PRO 25 Cb 0.45 0.00 0.22 0.00 -0.04 0.00 0.00 33.50 34.12 2mfn n PRO 25 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2mfn n ARG 26 N -0.88 2.73 -4.39 0.54 1.74 -1.26 -5.00 116.66 110.14 2mfn n ARG 26 Ca 0.00 -2.63 -0.29 0.00 -0.77 0.00 0.00 57.85 54.16 2mfn n ARG 26 Cb 0.00 -1.67 -0.13 0.00 -1.02 0.00 0.00 32.46 29.64 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 -2.45 2.41 0.14 7.54 0.00 -1.26 -5.05 121.76 123.09 2mfn s ALA 27 Ca 0.36 -1.47 -0.32 0.00 0.00 0.00 0.00 51.96 50.53 2mfn s ALA 27 Cb 0.28 -0.40 -0.12 0.00 0.00 0.00 0.00 23.12 22.89 2mfn s ALA 27 CO 0.09 0.54 1.76 -0.35 0.00 0.00 0.00 175.76 177.80 2mfn n PRO 28 N 0.87 2.61 -4.34 0.00 -0.04 -1.26 -4.96 135.00 127.89 2mfn n PRO 28 Ca -0.18 0.95 -0.17 0.00 -0.04 0.00 0.00 63.50 64.06 2mfn n PRO 28 Cb 0.53 -2.80 -0.10 0.00 -0.04 0.00 0.00 33.50 31.09 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 2.04 0.66 -1.10 0.52 -4.36 -1.26 -4.81 121.20 112.88 2mfn s ILE 29 Ca 0.80 -2.00 0.15 0.00 -0.26 0.00 0.00 60.65 59.34 2mfn s ILE 29 Cb -0.54 -2.66 -0.07 0.00 1.25 0.00 0.00 42.46 40.43 2mfn s ILE 29 CO 0.37 0.00 0.74 0.35 0.24 0.00 0.00 174.94 176.65 2mfn n THR 30 N -0.50 0.00 0.00 8.37 -2.24 0.22 -4.92 114.28 115.21 2mfn n THR 30 Ca -0.00 -0.25 0.00 0.00 -2.27 0.00 0.00 64.05 61.52 2mfn n THR 30 Cb 0.66 1.10 0.00 0.00 -2.10 0.00 0.00 70.33 70.00 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 1.23 0.97 3.35 3.38 0.00 -1.18 -4.46 105.19 108.48 2mfn n GLY 31 Ca 0.05 -1.55 -0.30 0.00 0.00 0.00 0.00 46.02 44.21 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 2.32 -0.20 1.61 2.02 -1.06 -2.07 117.35 118.28 2mfn s TYR 32 Ca 0.00 -0.41 -0.09 0.00 -0.37 0.00 0.00 57.07 56.21 2mfn s TYR 32 Cb 0.00 -1.36 -0.04 0.00 -0.40 0.00 0.00 41.96 40.15 2mfn s TYR 32 CO 0.00 0.17 0.10 0.42 -1.57 0.00 0.00 175.55 174.67 2mfn s ILE 33 N -0.86 5.06 -0.24 2.71 -1.09 -0.05 -2.24 121.20 124.49 2mfn s ILE 33 Ca 0.12 0.07 -0.05 0.00 -2.23 0.00 0.00 60.65 58.56 2mfn s ILE 33 Cb -0.10 -3.30 -0.01 0.00 -1.58 0.00 0.00 42.46 37.47 2mfn s ILE 33 CO 0.03 0.43 0.00 -0.63 -1.23 0.00 0.00 174.94 173.55 2mfn s ILE 34 N 0.51 3.68 -0.18 2.92 -1.09 0.77 -1.25 121.20 126.56 2mfn s ILE 34 Ca 0.05 -0.47 -0.05 0.00 -2.23 0.00 0.00 60.65 57.96 2mfn s ILE 34 Cb -0.12 -2.73 -0.03 0.00 -1.58 0.00 0.00 42.46 38.00 2mfn s ILE 34 CO 0.00 0.34 -0.01 -0.13 -1.23 0.00 0.00 174.94 173.90 2mfn s ARG 35 N 1.51 3.68 -0.05 2.79 1.81 0.08 0.16 118.95 128.93 2mfn s ARG 35 Ca 0.05 -0.50 0.06 0.00 -1.72 0.00 0.00 55.73 53.62 2mfn s ARG 35 Cb -0.15 -3.01 -0.01 0.00 -0.45 0.00 0.00 34.95 31.33 2mfn s ARG 35 CO -0.01 0.16 -0.25 -1.58 -0.68 0.00 0.00 175.30 172.94 2mfn s HIS 36 N 0.61 2.43 -0.15 -0.53 5.65 -1.01 0.91 115.29 123.20 2mfn s HIS 36 Ca -0.01 -0.70 -0.30 0.00 0.25 0.00 0.00 55.06 54.30 2mfn s HIS 36 Cb -0.14 -1.59 0.12 0.00 -1.18 0.00 0.00 32.58 29.79 2mfn s HIS 36 CO 0.02 -0.20 0.97 -3.38 -0.65 0.00 0.00 174.74 171.50 2mfn s HIS 37 N -0.20 -0.40 0.65 3.88 -3.43 -0.40 -2.31 115.29 113.08 2mfn s HIS 37 Ca -0.02 0.68 -0.05 0.00 -0.80 0.00 0.00 55.06 54.86 2mfn s HIS 37 Cb -0.13 0.45 0.04 0.00 -1.43 0.00 0.00 32.58 31.50 2mfn s HIS 37 CO 0.03 -0.37 0.95 0.00 -2.00 0.00 0.00 174.74 173.36 2mfn s ALA 38 N -1.11 3.29 0.12 -1.38 0.00 -1.26 0.56 121.76 121.97 2mfn s ALA 38 Ca -0.03 -0.91 -0.20 0.00 0.00 0.00 0.00 51.96 50.83 2mfn s ALA 38 Cb -0.00 -2.54 -0.08 0.00 0.00 0.00 0.00 23.12 20.50 2mfn s ALA 38 CO 0.02 -1.09 1.77 0.93 0.00 0.00 0.00 175.76 177.40 2mfn h GLU 39 N -0.40 0.23 -0.34 0.00 5.08 -1.93 -3.34 114.58 113.88 2mfn h GLU 39 Ca -0.44 -0.01 -0.25 0.00 -1.00 0.00 0.00 59.36 57.65 2mfn h GLU 39 Cb 1.30 -0.05 -0.38 0.00 0.50 0.00 0.00 28.75 30.12 2mfn h GLU 39 CO 0.59 0.15 -1.02 0.72 -1.00 0.00 0.00 179.01 178.45 2mfn n HIS 40 N -4.97 1.08 -2.52 4.33 8.25 -1.26 -5.09 115.22 115.04 2mfn n HIS 40 Ca -0.04 -1.71 -0.34 0.00 -0.26 0.00 0.00 57.72 55.37 2mfn n HIS 40 Cb 0.03 -0.23 -0.03 0.00 1.12 0.00 0.00 29.99 30.88 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 -3.31 6.29 0.11 0.41 1.04 -1.25 -4.95 113.70 112.04 2mfn s SER 41 Ca 0.33 1.94 -0.12 0.00 0.48 0.00 0.00 55.95 58.58 2mfn s SER 41 Cb 0.35 -2.56 -0.12 0.00 0.10 0.00 0.00 66.02 63.79 2mfn s SER 41 CO -0.06 -0.82 1.36 0.58 0.98 0.00 0.00 173.24 175.28 2mfn h VAL 42 N 1.51 1.27 -2.67 5.02 2.07 -1.98 -3.45 116.25 118.03 2mfn h VAL 42 Ca -0.49 -1.85 -0.60 0.00 0.82 0.00 0.00 66.70 64.58 2mfn h VAL 42 Cb 1.22 1.80 0.11 0.00 -1.52 0.00 0.00 31.29 32.90 2mfn h VAL 42 CO 0.59 0.60 0.22 0.61 0.02 0.00 0.00 177.57 179.61 2mfn n GLY 43 N 0.53 -0.05 3.77 2.17 0.00 -1.26 -4.91 105.19 105.45 2mfn n GLY 43 Ca -0.06 0.33 -0.35 0.00 0.00 0.00 0.00 46.02 45.94 2mfn n GLY 43 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2mfn s ARG 44 N -1.62 3.26 -0.11 1.61 3.00 -1.26 -4.90 118.95 118.93 2mfn s ARG 44 Ca 0.58 1.55 -0.34 0.00 0.00 0.00 0.00 55.73 57.52 2mfn s ARG 44 Cb -0.67 -2.00 -0.11 0.00 0.00 0.00 0.00 34.95 32.17 2mfn s ARG 44 CO 0.60 -0.91 1.92 -2.30 0.00 0.00 0.00 175.30 174.61 2mfn n PRO 45 N -1.52 2.13 -2.88 3.54 -0.01 -1.26 -4.95 135.00 130.04 2mfn n PRO 45 Ca 0.11 0.77 -0.31 0.00 -0.01 0.00 0.00 63.50 64.06 2mfn n PRO 45 Cb 0.51 -2.67 -0.04 0.00 -0.01 0.00 0.00 33.50 31.29 2mfn n PRO 45 CO 0.00 0.00 0.00 -0.98 -0.01 0.00 0.00 175.50 174.51 2mfn s ARG 46 N 4.31 3.87 -0.29 -0.52 1.70 -0.98 -4.96 118.95 122.08 2mfn s ARG 46 Ca 0.94 0.59 -0.08 0.00 -0.47 0.00 0.00 55.73 56.71 2mfn s ARG 46 Cb -0.68 -2.37 -0.01 0.00 -0.57 0.00 0.00 34.95 31.32 2mfn s ARG 46 CO 0.51 -0.01 0.12 -0.65 -1.08 0.00 0.00 175.30 174.19 2mfn s GLN 47 N -3.62 3.36 -0.13 3.89 -0.21 -1.26 -2.40 119.66 119.28 2mfn s GLN 47 Ca 0.53 -0.69 0.02 0.00 0.02 0.00 0.00 55.36 55.24 2mfn s GLN 47 Cb -0.10 -3.46 -0.00 0.00 1.00 0.00 0.00 33.01 30.44 2mfn s GLN 47 CO 0.27 -0.37 -0.19 -0.51 -2.12 0.00 0.00 175.29 172.37 2mfn s ASP 48 N 1.59 3.43 0.10 5.90 1.01 0.43 -4.98 116.67 124.15 2mfn s ASP 48 Ca 0.05 -0.50 0.10 0.00 0.71 0.00 0.00 52.55 52.90 2mfn s ASP 48 Cb -0.17 -1.50 -0.04 0.00 1.01 0.00 0.00 42.92 42.23 2mfn s ASP 48 CO 0.05 0.12 -0.25 -0.13 0.21 0.00 0.00 175.17 175.17 2mfn s ARG 49 N 0.59 1.41 -0.01 8.23 3.00 -1.26 0.27 118.95 131.18 2mfn s ARG 49 Ca -0.11 -1.23 0.03 0.00 0.00 0.00 0.00 55.73 54.41 2mfn s ARG 49 Cb -0.16 -1.77 -0.00 0.00 0.00 0.00 0.00 34.95 33.01 2mfn s ARG 49 CO 0.03 0.43 -0.09 0.14 0.00 0.00 0.00 175.30 175.82 2mfn s VAL 50 N -1.01 0.70 1.07 3.52 -7.23 -0.95 -4.86 120.40 111.64 2mfn s VAL 50 Ca 0.11 -0.35 -0.12 0.00 -1.81 0.00 0.00 61.98 59.81 2mfn s VAL 50 Cb -0.10 -0.60 0.23 0.00 0.56 0.00 0.00 36.38 36.47 2mfn s VAL 50 CO 0.05 0.21 1.07 -2.16 -0.31 0.00 0.00 175.10 173.95 2mfn s PRO 51 N -0.05 -0.23 0.35 4.82 0.04 -1.26 -2.57 135.00 136.10 2mfn s PRO 51 Ca 0.01 1.07 0.03 0.00 0.04 0.00 0.00 61.00 62.15 2mfn s PRO 51 Cb -0.05 -1.62 0.66 0.00 0.04 0.00 0.00 34.50 33.53 2mfn s PRO 51 CO -0.00 -3.33 2.00 -1.00 0.04 0.00 0.00 177.00 174.71 2mfn h PRO 52 N -2.35 0.81 0.00 0.56 0.13 -1.91 -1.48 132.00 127.77 2mfn h PRO 52 Ca -0.55 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 64.53 2mfn h PRO 52 Cb 1.31 -0.18 0.00 0.00 0.13 0.00 0.00 31.00 32.26 2mfn h PRO 52 CO 0.48 0.54 0.00 -1.13 -0.23 0.00 0.00 178.00 177.65 2mfn n SER 53 N -4.45 0.15 -4.52 1.44 3.41 -1.26 -4.58 113.62 103.81 2mfn n SER 53 Ca 0.07 0.54 -0.37 0.00 -0.26 0.00 0.00 58.87 58.85 2mfn n SER 53 Cb 0.08 -0.57 -0.12 0.00 -0.26 0.00 0.00 64.21 63.35 2mfn n SER 53 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 2mfn s ARG 54 N -3.07 3.82 0.00 4.33 1.81 -0.56 -4.92 118.95 120.36 2mfn s ARG 54 Ca 0.07 -0.39 0.12 0.00 -1.72 0.00 0.00 55.73 53.80 2mfn s ARG 54 Cb 0.10 -3.51 -0.01 0.00 -0.45 0.00 0.00 34.95 31.08 2mfn s ARG 54 CO 0.30 -0.18 0.68 0.27 -0.68 0.00 0.00 175.30 175.69 2mfn n ASN 55 N 5.00 1.29 -4.07 0.23 0.23 -1.26 -4.71 115.26 111.96 2mfn n ASN 55 Ca -0.15 -1.14 -0.22 0.00 -0.53 0.00 0.00 54.58 52.54 2mfn n ASN 55 Cb 0.52 0.49 -0.15 0.00 -2.08 0.00 0.00 39.78 38.56 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 -1.52 1.51 -0.06 0.53 1.04 -1.26 -1.94 113.70 112.00 2mfn s SER 56 Ca 0.09 -0.23 0.02 0.00 0.48 0.00 0.00 55.95 56.31 2mfn s SER 56 Cb 0.09 -0.24 0.01 0.00 0.10 0.00 0.00 66.02 65.99 2mfn s SER 56 CO 0.30 0.14 -0.11 -0.51 0.98 0.00 0.00 173.24 174.04 2mfn s ILE 57 N -0.17 1.00 -0.17 -1.02 2.07 -0.82 -4.96 121.20 117.13 2mfn s ILE 57 Ca 0.03 -0.40 -0.09 0.00 -1.41 0.00 0.00 60.65 58.78 2mfn s ILE 57 Cb -0.06 -0.93 -0.05 0.00 0.13 0.00 0.00 42.46 41.55 2mfn s ILE 57 CO -0.00 0.32 0.13 -0.89 -1.91 0.00 0.00 174.94 172.59 2mfn s THR 58 N 0.71 5.40 0.03 4.00 2.01 -1.26 -1.84 115.64 124.69 2mfn s THR 58 Ca -0.14 0.18 0.05 0.00 0.31 0.00 0.00 61.69 62.09 2mfn s THR 58 Cb -0.15 -3.43 -0.03 0.00 0.01 0.00 0.00 72.50 68.89 2mfn s THR 58 CO 0.03 0.50 -0.11 -0.76 -0.69 0.00 0.00 174.62 173.59 2mfn s LEU 59 N -0.10 2.94 0.00 4.42 1.43 -1.04 -4.98 118.68 121.35 2mfn s LEU 59 Ca 0.10 -0.29 0.04 0.00 -1.03 0.00 0.00 54.13 52.96 2mfn s LEU 59 Cb -0.11 -1.71 -0.02 0.00 0.03 0.00 0.00 46.19 44.37 2mfn s LEU 59 CO 0.00 0.25 0.16 0.35 0.23 0.00 0.00 176.35 177.35 2mfn n THR 60 N 1.41 0.00 -3.72 5.49 -2.24 -1.26 -2.26 114.28 111.70 2mfn n THR 60 Ca -0.15 -2.18 -0.26 0.00 -2.27 0.00 0.00 64.05 59.18 2mfn n THR 60 Cb 0.52 0.85 0.06 0.00 -2.10 0.00 0.00 70.33 69.66 2mfn n THR 60 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2mfn n ASN 61 N -1.62 -5.65 -4.80 3.42 5.03 -0.97 -4.91 115.26 105.77 2mfn n ASN 61 Ca -0.03 -0.64 -0.26 0.00 0.87 0.00 0.00 54.58 54.53 2mfn n ASN 61 Cb 0.56 -4.59 -0.05 0.00 -1.02 0.00 0.00 39.78 34.67 2mfn n ASN 61 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 2mfn s LEU 62 N -7.28 3.80 -0.08 3.41 1.43 -0.02 -5.05 118.68 114.89 2mfn s LEU 62 Ca 0.60 -0.14 -0.30 0.00 -1.03 0.00 0.00 54.13 53.27 2mfn s LEU 62 Cb -0.28 -2.41 -0.04 0.00 0.03 0.00 0.00 46.19 43.49 2mfn s LEU 62 CO 0.77 0.06 1.50 0.20 0.23 0.00 0.00 176.35 179.11 2mfn s ASN 63 N -3.14 6.78 0.11 2.29 -0.87 -1.26 -4.27 114.94 114.57 2mfn s ASN 63 Ca 0.31 2.05 -0.31 0.00 -1.57 0.00 0.00 52.86 53.34 2mfn s ASN 63 Cb -0.10 -2.54 -0.10 0.00 -0.02 0.00 0.00 41.25 38.49 2mfn s ASN 63 CO 0.23 -0.85 1.79 -2.16 -2.57 0.00 0.00 177.10 173.54 2mfn s PRO 64 N 3.67 4.15 0.00 -0.60 0.04 -1.23 -3.45 135.00 137.58 2mfn s PRO 64 Ca 0.66 2.53 0.00 0.00 0.04 0.00 0.00 61.00 64.24 2mfn s PRO 64 Cb -0.29 -3.60 0.00 0.00 0.04 0.00 0.00 34.50 30.64 2mfn s PRO 64 CO 0.24 -0.82 0.00 0.41 0.04 0.00 0.00 177.00 176.88 2mfn n GLY 65 N 4.18 0.86 3.16 0.56 0.00 0.76 -4.82 105.19 109.89 2mfn n GLY 65 Ca 0.17 -0.38 -0.10 0.00 0.00 0.00 0.00 46.02 45.71 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 -2.81 0.11 -0.28 2.61 2.01 -0.95 -4.87 115.64 111.46 2mfn s THR 66 Ca 0.00 -0.88 -0.20 0.00 0.31 0.00 0.00 61.69 60.91 2mfn s THR 66 Cb 0.00 -0.84 -0.01 0.00 0.01 0.00 0.00 72.50 71.66 2mfn s THR 66 CO 0.00 -0.49 0.63 -1.61 -0.69 0.00 0.00 174.62 172.46 2mfn s GLU 67 N -2.38 4.01 -0.07 4.92 2.02 -1.26 0.16 118.70 126.10 2mfn s GLU 67 Ca -0.07 0.43 0.01 0.00 0.02 0.00 0.00 54.97 55.36 2mfn s GLU 67 Cb -0.02 -3.69 -0.03 0.00 0.10 0.00 0.00 34.13 30.49 2mfn s GLU 67 CO -0.03 -0.49 -0.06 0.71 0.02 0.00 0.00 175.26 175.41 2mfn s TYR 68 N 2.56 2.96 -0.25 1.61 2.02 0.20 -3.55 117.35 122.89 2mfn s TYR 68 Ca 0.26 0.04 -0.09 0.00 -0.37 0.00 0.00 57.07 56.91 2mfn s TYR 68 Cb -0.15 -1.72 -0.04 0.00 -0.40 0.00 0.00 41.96 39.65 2mfn s TYR 68 CO 0.10 0.35 0.13 0.08 -1.57 0.00 0.00 175.55 174.63 2mfn s VAL 69 N -0.82 4.86 -0.17 0.71 1.01 0.19 -0.35 120.40 125.83 2mfn s VAL 69 Ca 0.13 0.01 0.00 0.00 0.00 0.00 0.00 61.98 62.12 2mfn s VAL 69 Cb -0.11 -3.28 0.01 0.00 0.00 0.00 0.00 36.38 32.99 2mfn s VAL 69 CO 0.02 0.31 -0.17 -0.69 0.00 0.00 0.00 175.10 174.57 2mfn s VAL 70 N 1.50 2.40 -0.11 2.92 1.01 -0.47 -1.27 120.40 126.38 2mfn s VAL 70 Ca 0.06 -0.84 -0.13 0.00 0.00 0.00 0.00 61.98 61.08 2mfn s VAL 70 Cb -0.15 -2.02 -0.05 0.00 0.00 0.00 0.00 36.38 34.17 2mfn s VAL 70 CO 0.06 0.52 0.29 -0.94 0.00 0.00 0.00 175.10 175.03 2mfn s SER 71 N 1.11 6.51 -0.16 3.32 1.04 0.26 -1.73 113.70 124.06 2mfn s SER 71 Ca 0.00 0.61 0.00 0.00 0.48 0.00 0.00 55.95 57.04 2mfn s SER 71 Cb -0.14 -2.17 0.00 0.00 0.10 0.00 0.00 66.02 63.81 2mfn s SER 71 CO -0.06 0.22 -0.16 -0.63 0.98 0.00 0.00 173.24 173.59 2mfn s ILE 72 N -0.22 2.54 0.19 -1.02 -1.09 1.04 -0.74 121.20 121.91 2mfn s ILE 72 Ca 0.18 -0.81 0.05 0.00 -2.23 0.00 0.00 60.65 57.84 2mfn s ILE 72 Cb -0.14 -2.07 -0.05 0.00 -1.58 0.00 0.00 42.46 38.62 2mfn s ILE 72 CO 0.06 0.52 -0.08 -0.63 -1.23 0.00 0.00 174.94 173.58 2mfn s ILE 73 N 0.91 1.27 -0.04 2.92 1.01 -0.38 0.12 121.20 127.00 2mfn s ILE 73 Ca -0.04 -2.09 0.06 0.00 0.00 0.00 0.00 60.65 58.59 2mfn s ILE 73 Cb -0.15 -2.08 -0.01 0.00 0.01 0.00 0.00 42.46 40.23 2mfn s ILE 73 CO -0.02 -0.56 -0.23 0.00 0.00 0.00 0.00 174.94 174.13 2mfn s ALA 74 N -3.26 2.01 -0.01 9.38 0.00 -1.26 -0.87 121.76 127.75 2mfn s ALA 74 Ca 0.22 -0.99 0.04 0.00 0.00 0.00 0.00 51.96 51.23 2mfn s ALA 74 Cb 0.03 -0.60 -0.01 0.00 0.00 0.00 0.00 23.12 22.54 2mfn s ALA 74 CO 0.05 0.41 -0.12 0.14 0.00 0.00 0.00 175.76 176.25 2mfn s VAL 75 N -0.24 0.91 -0.31 0.00 -7.23 -0.88 -1.40 120.40 111.26 2mfn s VAL 75 Ca -0.00 -0.51 0.10 0.00 -1.81 0.00 0.00 61.98 59.76 2mfn s VAL 75 Cb -0.12 -0.77 0.46 0.00 0.56 0.00 0.00 36.38 36.52 2mfn s VAL 75 CO 0.02 0.25 1.15 -3.20 -0.31 0.00 0.00 175.10 173.01 2mfn n ASN 76 N 2.77 4.12 0.00 4.85 2.85 -0.97 0.71 115.26 129.59 2mfn n ASN 76 Ca -0.14 -3.38 0.00 0.00 -0.11 0.00 0.00 54.58 50.95 2mfn n ASN 76 Cb 0.56 -0.39 0.00 0.00 1.24 0.00 0.00 39.78 41.19 2mfn n ASN 76 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2mfn n GLY 77 N -0.63 0.97 0.87 8.20 0.00 -1.26 -4.15 105.19 109.20 2mfn n GLY 77 Ca 0.35 -0.84 0.12 0.00 0.00 0.00 0.00 46.02 45.65 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 2.20 -4.06 1.61 1.85 -1.26 -4.93 116.66 112.07 2mfn n ARG 78 Ca 0.00 -1.75 -0.25 0.00 -1.00 0.00 0.00 57.85 54.84 2mfn n ARG 78 Cb 0.00 -1.46 -0.05 0.00 -1.05 0.00 0.00 32.46 29.90 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 -2.00 3.01 0.12 2.89 0.41 -1.26 -5.12 118.70 116.74 2mfn s GLU 79 Ca 0.30 -0.84 0.07 0.00 -0.41 0.00 0.00 54.97 54.08 2mfn s GLU 79 Cb 0.20 -2.70 -0.04 0.00 -1.78 0.00 0.00 34.13 29.82 2mfn s GLU 79 CO 0.31 0.48 -0.16 -1.21 -0.49 0.00 0.00 175.26 174.19 2mfn s GLU 80 N -3.25 1.05 0.44 1.61 2.02 -1.26 -2.29 118.70 117.02 2mfn s GLU 80 Ca 0.32 -1.21 0.07 0.00 0.02 0.00 0.00 54.97 54.17 2mfn s GLU 80 Cb -0.10 -1.05 -0.01 0.00 0.10 0.00 0.00 34.13 33.07 2mfn s GLU 80 CO 0.25 0.22 0.35 -1.54 0.02 0.00 0.00 175.26 174.55 2mfn s SER 81 N -2.28 4.83 0.13 -0.19 1.04 -0.49 -4.61 113.70 112.13 2mfn s SER 81 Ca 0.08 -0.92 -0.31 0.00 0.48 0.00 0.00 55.95 55.28 2mfn s SER 81 Cb -0.07 -0.34 -0.10 0.00 0.10 0.00 0.00 66.02 65.61 2mfn s SER 81 CO 0.04 -0.73 1.75 -2.84 0.98 0.00 0.00 173.24 172.43 2mfn s PRO 82 N -4.12 4.16 0.14 4.02 0.02 -1.26 -4.59 135.00 133.37 2mfn s PRO 82 Ca 0.44 2.51 -0.31 0.00 0.02 0.00 0.00 61.00 63.66 2mfn s PRO 82 Cb -0.01 -3.48 -0.11 0.00 0.02 0.00 0.00 34.50 30.92 2mfn s PRO 82 CO 0.26 -0.78 1.80 -1.25 -0.33 0.00 0.00 177.00 176.69 2mfn s PRO 83 N 2.33 4.14 -0.25 5.54 0.04 -1.26 -4.56 135.00 140.97 2mfn s PRO 83 Ca 0.77 2.59 -0.07 0.00 0.04 0.00 0.00 61.00 64.33 2mfn s PRO 83 Cb -0.45 -3.47 -0.03 0.00 0.04 0.00 0.00 34.50 30.59 2mfn s PRO 83 CO 0.34 -0.82 0.07 -1.17 0.04 0.00 0.00 177.00 175.47 2mfn s LEU 84 N 2.37 3.44 -0.02 -3.56 2.96 0.32 -4.96 118.68 119.23 2mfn s LEU 84 Ca 0.79 -0.21 0.06 0.00 -0.22 0.00 0.00 54.13 54.55 2mfn s LEU 84 Cb -0.47 -1.92 -0.01 0.00 0.50 0.00 0.00 46.19 44.29 2mfn s LEU 84 CO 0.35 -0.03 -0.19 -0.63 -1.32 0.00 0.00 176.35 174.52 2mfn s ILE 85 N 1.61 1.54 0.05 6.68 1.01 -1.26 0.34 121.20 131.16 2mfn s ILE 85 Ca 0.06 -0.82 0.01 0.00 0.00 0.00 0.00 60.65 59.90 2mfn s ILE 85 Cb -0.15 -1.28 -0.03 0.00 0.01 0.00 0.00 42.46 41.01 2mfn s ILE 85 CO 0.04 0.44 -0.06 -0.83 0.00 0.00 0.00 174.94 174.52 2mfn s GLY 86 N -0.39 0.49 -0.15 6.18 0.00 -0.70 -4.96 107.32 107.78 2mfn s GLY 86 Ca 0.06 -0.86 -0.03 0.00 0.00 0.00 0.00 44.72 43.89 2mfn s GLY 86 CO -0.00 -0.93 -0.05 1.20 0.00 0.00 0.00 173.10 173.32 2mfn s GLN 87 N -2.12 3.63 -0.09 2.90 -0.21 -1.26 -1.37 119.66 121.15 2mfn s GLN 87 Ca -0.06 -0.54 0.03 0.00 0.02 0.00 0.00 55.36 54.81 2mfn s GLN 87 Cb -0.06 -2.88 0.01 0.00 1.00 0.00 0.00 33.01 31.08 2mfn s GLN 87 CO -0.02 0.24 -0.19 -1.14 -2.12 0.00 0.00 175.29 172.06 2mfn s GLN 88 N 0.36 2.50 -0.20 2.91 -0.44 0.52 -4.94 119.66 120.37 2mfn s GLN 88 Ca -0.05 -0.69 -0.10 0.00 -2.50 0.00 0.00 55.36 52.02 2mfn s GLN 88 Cb -0.14 -1.94 -0.05 0.00 -1.64 0.00 0.00 33.01 29.23 2mfn s GLN 88 CO 0.03 0.11 0.13 0.00 0.50 0.00 0.00 175.29 176.07 2mfn s ALA 89 N 0.49 3.68 0.17 1.58 0.00 -1.26 0.60 121.76 127.02 2mfn s ALA 89 Ca -0.17 -0.71 -0.30 0.00 0.00 0.00 0.00 51.96 50.79 2mfn s ALA 89 Cb -0.17 -2.18 -0.08 0.00 0.00 0.00 0.00 23.12 20.69 2mfn s ALA 89 CO 0.06 0.13 1.14 0.95 0.00 0.00 0.00 175.76 178.05 2mfn s THR 90 N 0.41 3.77 0.80 0.00 -4.23 0.41 -4.85 115.64 111.96 2mfn s THR 90 Ca 0.08 1.49 -0.17 0.00 -1.18 0.00 0.00 61.69 61.91 2mfn s THR 90 Cb -0.11 -3.95 -0.13 0.00 1.34 0.00 0.00 72.50 69.65 2mfn s THR 90 CO -0.02 0.24 -0.38 0.52 -0.54 0.00 0.00 174.62 174.44 2mfn n VAL 91 N 2.56 0.17 -1.09 2.29 0.31 -1.24 -2.23 118.33 119.09 2mfn n VAL 91 Ca 0.04 -0.47 -0.01 0.00 -0.01 0.00 0.00 64.34 63.88 2mfn n VAL 91 Cb 0.46 -0.10 0.28 0.00 -0.91 0.00 0.00 33.84 33.57 2mfn n VAL 91 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 2mfn n SER 92 N 2.55 4.28 -0.72 4.52 3.41 -1.26 0.27 113.62 126.66 2mfn n SER 92 Ca 0.03 -3.24 -0.09 0.00 -0.26 0.00 0.00 58.87 55.31 2mfn n SER 92 Cb 0.52 -0.67 -0.04 0.00 -0.26 0.00 0.00 64.21 63.76 2mfn n SER 92 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2mfn n ASP 93 N -0.37 -5.38 -4.73 4.04 8.00 -1.26 -4.73 116.55 112.12 2mfn n ASP 93 Ca 0.34 0.22 -0.35 0.00 0.71 0.00 0.00 54.79 55.71 2mfn n ASP 93 Cb 1.20 -3.88 -0.09 0.00 -0.02 0.00 0.00 41.12 38.33 2mfn n ASP 93 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2mfn s ILE 94 N -1.73 4.73 1.43 0.53 1.01 -1.26 -4.66 121.20 121.25 2mfn s ILE 94 Ca 0.00 -0.08 -0.23 0.00 0.00 0.00 0.00 60.65 60.34 2mfn s ILE 94 Cb 0.00 -3.03 0.37 0.00 0.01 0.00 0.00 42.46 39.81 2mfn s ILE 94 CO 0.00 0.59 0.92 -2.84 0.00 0.00 0.00 174.94 173.60 2mfn s PRO 95 N -0.74 -3.03 0.24 2.79 0.02 -1.26 -4.63 135.00 128.40 2mfn s PRO 95 Ca 0.12 0.20 -0.01 0.00 0.02 0.00 0.00 61.00 61.32 2mfn s PRO 95 Cb -0.12 -1.36 -0.03 0.00 0.02 0.00 0.00 34.50 33.01 2mfn s PRO 95 CO 0.03 -4.95 0.22 1.03 -0.33 0.00 0.00 177.00 173.00 2mfn s ARG 96 N -5.01 1.38 -1.36 5.54 0.52 -1.05 -4.85 118.95 114.13 2mfn s ARG 96 Ca 0.68 -1.65 -0.09 0.00 -0.52 0.00 0.00 55.73 54.16 2mfn s ARG 96 Cb -0.14 0.32 0.01 0.00 0.52 0.00 0.00 34.95 35.65 2mfn s ARG 96 CO 0.58 -0.49 1.19 -0.25 0.02 0.00 0.00 175.30 176.35 2mfn n ASP 97 N -0.56 -6.34 -4.56 0.23 8.00 -1.26 0.90 116.55 112.96 2mfn n ASP 97 Ca 0.02 -0.54 -0.34 0.00 0.71 0.00 0.00 54.79 54.65 2mfn n ASP 97 Cb 0.65 -5.04 -0.04 0.00 -0.02 0.00 0.00 41.12 36.67 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 -7.30 3.26 0.23 0.64 2.96 -1.24 -3.99 118.68 113.24 2mfn s LEU 98 Ca 0.58 -0.57 -0.09 0.00 -0.22 0.00 0.00 54.13 53.84 2mfn s LEU 98 Cb -0.26 -2.55 -0.02 0.00 0.50 0.00 0.00 46.19 43.86 2mfn s LEU 98 CO 0.73 -2.34 0.36 -1.61 -1.32 0.00 0.00 176.35 172.18 2mfn s GLU 99 N 6.51 1.43 -0.13 1.98 2.02 -1.08 -4.87 118.70 124.56 2mfn s GLU 99 Ca 0.61 -1.38 -0.12 0.00 0.02 0.00 0.00 54.97 54.11 2mfn s GLU 99 Cb -0.07 0.40 -0.05 0.00 0.10 0.00 0.00 34.13 34.52 2mfn s GLU 99 CO 0.04 -0.56 0.26 0.08 0.02 0.00 0.00 175.26 175.10 2mfn s VAL 100 N -4.06 5.31 -0.16 2.63 1.01 -1.26 -1.85 120.40 122.02 2mfn s VAL 100 Ca 0.28 0.48 0.18 0.00 0.00 0.00 0.00 61.98 62.92 2mfn s VAL 100 Cb 0.02 -3.58 -0.25 0.00 0.00 0.00 0.00 36.38 32.57 2mfn s VAL 100 CO 0.10 0.48 0.23 2.30 0.00 0.00 0.00 175.10 178.21 2mfn n ILE 101 N 2.94 1.26 -4.16 2.22 -5.35 -0.89 -4.91 119.36 110.47 2mfn n ILE 101 Ca -0.14 -0.81 -0.18 0.00 -0.27 0.00 0.00 62.75 61.35 2mfn n ILE 101 Cb 0.53 -0.50 -0.15 0.00 -1.74 0.00 0.00 39.64 37.77 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 -2.63 0.54 -0.12 -1.28 0.00 -1.26 -5.02 121.76 111.99 2mfn s ALA 102 Ca -0.09 -0.13 0.03 0.00 0.00 0.00 0.00 51.96 51.77 2mfn s ALA 102 Cb 0.07 -0.26 0.01 0.00 0.00 0.00 0.00 23.12 22.94 2mfn s ALA 102 CO 0.84 0.05 -0.21 -1.54 0.00 0.00 0.00 175.76 174.90 2mfn s SER 103 N 0.39 2.91 0.23 0.00 1.04 -1.26 -1.32 113.70 115.68 2mfn s SER 103 Ca -0.05 -0.54 0.09 0.00 0.48 0.00 0.00 55.95 55.93 2mfn s SER 103 Cb -0.08 -1.34 -0.04 0.00 0.10 0.00 0.00 66.02 64.66 2mfn s SER 103 CO -0.00 0.08 -0.01 0.42 0.98 0.00 0.00 173.24 174.71 2mfn s THR 104 N 0.72 3.52 0.31 2.02 -4.23 0.29 -4.99 115.64 113.29 2mfn s THR 104 Ca -0.10 -1.72 0.08 0.00 -1.18 0.00 0.00 61.69 58.77 2mfn s THR 104 Cb -0.16 -2.83 0.31 0.00 1.34 0.00 0.00 72.50 71.16 2mfn s THR 104 CO 0.01 -0.26 1.75 -0.65 -0.54 0.00 0.00 174.62 174.93 2mfn h PRO 105 N 2.27 0.63 0.00 3.99 0.10 -2.00 -2.57 132.00 134.42 2mfn h PRO 105 Ca -0.46 -0.04 0.00 0.00 0.10 0.00 0.00 66.00 65.61 2mfn h PRO 105 Cb 1.23 -0.14 0.00 0.00 0.10 0.00 0.00 31.00 32.19 2mfn h PRO 105 CO 0.59 0.42 0.00 0.25 0.10 0.00 0.00 178.00 179.36 2mfn n THR 106 N -4.84 0.96 -3.70 -1.15 -2.24 -1.26 -3.93 114.28 98.13 2mfn n THR 106 Ca 0.25 -0.96 -0.10 0.00 -2.27 0.00 0.00 64.05 60.97 2mfn n THR 106 Cb 0.67 0.52 -0.04 0.00 -2.10 0.00 0.00 70.33 69.38 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 -0.96 -0.23 0.02 3.42 1.04 -0.97 -1.68 113.70 114.34 2mfn s SER 107 Ca 0.00 -0.42 -0.07 0.00 0.48 0.00 0.00 55.95 55.94 2mfn s SER 107 Cb 0.00 0.51 -0.00 0.00 0.10 0.00 0.00 66.02 66.63 2mfn s SER 107 CO 0.00 -0.94 0.13 -0.76 0.98 0.00 0.00 173.24 172.65 2mfn s LEU 108 N -2.84 1.63 -0.26 2.42 1.43 -0.26 0.11 118.68 120.90 2mfn s LEU 108 Ca 0.07 -0.38 -0.09 0.00 -1.03 0.00 0.00 54.13 52.70 2mfn s LEU 108 Cb 0.01 0.69 -0.04 0.00 0.03 0.00 0.00 46.19 46.88 2mfn s LEU 108 CO -0.07 -0.46 0.13 -0.22 0.23 0.00 0.00 176.35 175.96 2mfn s LEU 109 N -1.82 3.76 0.02 1.79 0.20 -0.43 -0.26 118.68 121.92 2mfn s LEU 109 Ca -0.09 -0.10 -0.00 0.00 0.69 0.00 0.00 54.13 54.63 2mfn s LEU 109 Cb -0.04 -2.03 -0.04 0.00 -0.43 0.00 0.00 46.19 43.65 2mfn s LEU 109 CO -0.02 -0.04 0.12 0.27 -0.29 0.00 0.00 176.35 176.40 2mfn s ILE 110 N 1.67 4.97 0.02 6.68 -4.36 0.11 -2.09 121.20 128.20 2mfn s ILE 110 Ca 0.07 -0.40 0.00 0.00 -0.26 0.00 0.00 60.65 60.06 2mfn s ILE 110 Cb -0.16 -3.33 -0.02 0.00 1.25 0.00 0.00 42.46 40.21 2mfn s ILE 110 CO 0.07 0.28 -0.03 -0.94 0.24 0.00 0.00 174.94 174.57 2mfn s SER 111 N -2.00 0.23 0.13 4.36 1.04 -0.77 -0.77 113.70 115.92 2mfn s SER 111 Ca 0.27 -0.46 -0.16 0.00 0.48 0.00 0.00 55.95 56.07 2mfn s SER 111 Cb -0.12 0.09 0.04 0.00 0.10 0.00 0.00 66.02 66.13 2mfn s SER 111 CO 0.18 -0.28 0.41 -1.66 0.98 0.00 0.00 173.24 172.88 2mfn s TRP 112 N -1.35 -0.22 0.20 5.02 -2.14 -1.01 -2.63 118.94 116.81 2mfn s TRP 112 Ca -0.15 -0.09 -0.20 0.00 2.66 0.00 0.00 56.10 58.33 2mfn s TRP 112 Cb -0.09 0.28 -0.08 0.00 -3.10 0.00 0.00 33.47 30.48 2mfn s TRP 112 CO -0.01 -0.71 0.70 -1.21 -2.66 0.00 0.00 176.95 173.06 2mfn s GLU 113 N -3.80 4.25 0.34 3.25 0.41 0.26 -4.76 118.70 118.64 2mfn s GLU 113 Ca 0.03 0.85 -0.29 0.00 -0.41 0.00 0.00 54.97 55.15 2mfn s GLU 113 Cb 0.02 -2.93 -0.11 0.00 -1.78 0.00 0.00 34.13 29.32 2mfn s GLU 113 CO -0.12 0.43 1.55 -1.25 -0.49 0.00 0.00 175.26 175.38 2mfn s PRO 114 N -1.86 4.10 0.00 0.39 0.04 -1.26 -2.52 135.00 133.89 2mfn s PRO 114 Ca 0.41 2.60 0.00 0.00 0.04 0.00 0.00 61.00 64.05 2mfn s PRO 114 Cb -0.17 -2.99 0.00 0.00 0.04 0.00 0.00 34.50 31.38 2mfn s PRO 114 CO 0.21 -0.60 0.00 -0.35 0.04 0.00 0.00 177.00 176.30 2mfn n PRO 115 N 1.33 -0.90 0.00 0.56 -0.04 -1.26 -4.82 135.00 129.87 2mfn n PRO 115 Ca 0.05 0.00 0.08 0.00 -0.04 0.00 0.00 63.50 63.59 2mfn n PRO 115 Cb 0.38 0.00 0.05 0.00 -0.04 0.00 0.00 33.50 33.89 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 2.73 -2.33 0.55 0.00 -1.26 -4.98 120.51 112.22 2mfn n ALA 116 Ca 0.00 -0.60 -0.17 0.00 0.00 0.00 0.00 53.44 52.66 2mfn n ALA 116 Cb 0.00 -0.58 -0.10 0.00 0.00 0.00 0.00 19.45 18.76 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 -1.62 1.20 0.55 0.00 -7.23 -1.26 -4.49 120.40 107.55 2mfn s VAL 117 Ca 0.18 -2.06 -0.19 0.00 -1.81 0.00 0.00 61.98 58.09 2mfn s VAL 117 Cb 0.14 -2.26 -0.05 0.00 0.56 0.00 0.00 36.38 34.77 2mfn s VAL 117 CO 0.29 -0.41 1.15 -0.44 -0.31 0.00 0.00 175.10 175.38 2mfn s SER 118 N -3.31 5.61 0.00 4.85 0.01 -1.26 -5.04 113.70 114.56 2mfn s SER 118 Ca 0.26 2.22 0.02 0.00 1.31 0.00 0.00 55.95 59.77 2mfn s SER 118 Cb 0.04 -2.58 -0.01 0.00 0.21 0.00 0.00 66.02 63.68 2mfn s SER 118 CO 0.08 -1.30 -0.07 -0.69 0.41 0.00 0.00 173.24 171.66 2mfn s VAL 119 N -1.73 0.58 -0.04 3.43 1.01 -1.26 -4.75 120.40 117.64 2mfn s VAL 119 Ca 0.74 -0.43 -0.25 0.00 0.00 0.00 0.00 61.98 62.03 2mfn s VAL 119 Cb -0.25 -0.51 -0.20 0.00 0.00 0.00 0.00 36.38 35.42 2mfn s VAL 119 CO 0.28 0.08 1.15 0.03 0.00 0.00 0.00 175.10 176.64 2mfn h ARG 120 N 5.74 -0.06 -2.65 2.72 2.47 -0.52 -3.45 114.38 118.63 2mfn h ARG 120 Ca -0.30 0.00 0.12 0.00 -1.26 0.00 0.00 59.98 58.54 2mfn h ARG 120 Cb 1.19 0.01 -0.02 0.00 -1.65 0.00 0.00 29.97 29.50 2mfn h ARG 120 CO 0.48 0.46 0.52 1.52 0.56 0.00 0.00 179.97 183.51 2mfn s TYR 121 N -3.94 0.09 -0.02 3.04 1.13 -1.09 -3.64 117.35 112.92 2mfn s TYR 121 Ca -0.16 -0.56 0.08 0.00 -1.41 0.00 0.00 57.07 55.02 2mfn s TYR 121 Cb 0.01 0.74 -0.02 0.00 -1.10 0.00 0.00 41.96 41.59 2mfn s TYR 121 CO 0.63 -1.08 -0.26 0.71 -2.51 0.00 0.00 175.55 173.05 2mfn s TYR 122 N -2.15 2.33 -0.21 -3.49 2.02 -0.81 -1.15 117.35 113.89 2mfn s TYR 122 Ca 0.21 -0.44 -0.07 0.00 -0.37 0.00 0.00 57.07 56.40 2mfn s TYR 122 Cb -0.03 -1.50 -0.03 0.00 -0.40 0.00 0.00 41.96 40.00 2mfn s TYR 122 CO 0.07 -0.04 0.05 0.50 -1.57 0.00 0.00 175.55 174.55 2mfn s ARG 123 N -0.60 3.74 0.08 -0.62 3.52 0.14 -1.11 118.95 124.10 2mfn s ARG 123 Ca 0.10 -0.45 0.10 0.00 -0.13 0.00 0.00 55.73 55.35 2mfn s ARG 123 Cb -0.10 -3.21 -0.03 0.00 -1.56 0.00 0.00 34.95 30.05 2mfn s ARG 123 CO -0.01 0.02 -0.27 0.42 -0.81 0.00 0.00 175.30 174.66 2mfn s ILE 124 N 1.02 2.19 0.12 4.11 1.01 -0.74 0.11 121.20 129.03 2mfn s ILE 124 Ca 0.03 -1.55 0.10 0.00 0.00 0.00 0.00 60.65 59.24 2mfn s ILE 124 Cb -0.14 -1.90 -0.04 0.00 0.01 0.00 0.00 42.46 40.39 2mfn s ILE 124 CO 0.03 0.25 -0.23 0.42 0.00 0.00 0.00 174.94 175.40 2mfn s THR 125 N -0.91 2.48 -0.05 2.92 -4.23 0.49 -1.08 115.64 115.26 2mfn s THR 125 Ca 0.13 -1.62 -0.16 0.00 -1.18 0.00 0.00 61.69 58.86 2mfn s THR 125 Cb -0.10 -2.11 -0.05 0.00 1.34 0.00 0.00 72.50 71.58 2mfn s THR 125 CO 0.04 0.12 0.42 -0.31 -0.54 0.00 0.00 174.62 174.34 2mfn s TYR 126 N -1.07 3.65 -0.26 3.99 1.51 0.26 -2.66 117.35 122.77 2mfn s TYR 126 Ca 0.15 0.93 -0.07 0.00 -1.01 0.00 0.00 57.07 57.08 2mfn s TYR 126 Cb -0.10 -2.37 -0.01 0.00 -0.11 0.00 0.00 41.96 39.37 2mfn s TYR 126 CO 0.07 0.48 0.06 0.20 -1.11 0.00 0.00 175.55 175.25 2mfn s GLY 127 N -0.48 1.75 0.00 0.71 0.00 0.51 -2.79 107.32 107.03 2mfn s GLY 127 Ca 0.24 -1.23 0.02 0.00 0.00 0.00 0.00 44.72 43.75 2mfn s GLY 127 CO 0.12 0.56 -0.03 -0.54 0.00 0.00 0.00 173.10 173.20 2mfn s GLU 128 N 1.56 2.66 0.59 2.90 2.02 -1.26 -1.31 118.70 125.86 2mfn s GLU 128 Ca 0.05 -0.67 -0.11 0.00 0.02 0.00 0.00 54.97 54.25 2mfn s GLU 128 Cb -0.16 -2.58 -0.10 0.00 0.10 0.00 0.00 34.13 31.39 2mfn s GLU 128 CO 0.02 0.61 -0.44 0.25 0.02 0.00 0.00 175.26 175.73 2mfn n THR 129 N 1.44 0.00 -2.15 3.63 -2.24 0.81 -4.35 114.28 111.42 2mfn n THR 129 Ca -0.15 -0.33 -0.00 0.00 -2.27 0.00 0.00 64.05 61.30 2mfn n THR 129 Cb 0.53 0.00 -0.00 0.00 -2.10 0.00 0.00 70.33 68.75 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 2.15 -3.68 0.44 3.38 0.00 -1.26 -4.18 105.19 102.04 2mfn n GLY 130 Ca 0.00 0.18 0.21 0.00 0.00 0.00 0.00 46.02 46.41 2mfn n GLY 130 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2mfn h GLY 131 N 1.69 0.00 2.00 -0.02 0.00 -2.00 4.20 103.07 108.94 2mfn h GLY 131 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.31 2mfn h GLY 131 CO 0.05 0.00 0.00 1.16 0.00 0.00 0.00 176.54 177.75 2mfn n ASN 132 N -3.23 0.00 -4.76 0.19 6.94 -1.26 -4.78 115.26 108.36 2mfn n ASN 132 Ca 0.13 0.50 -0.40 0.00 -0.02 0.00 0.00 54.58 54.79 2mfn n ASN 132 Cb 1.09 -0.50 -0.04 0.00 -2.36 0.00 0.00 39.78 37.97 2mfn n ASN 132 CO 0.00 0.00 0.00 -0.44 -1.03 0.00 0.00 177.26 175.79 2mfn s SER 133 N -3.00 7.17 0.53 0.53 0.01 1.38 -4.98 113.70 115.34 2mfn s SER 133 Ca 0.12 2.32 -0.22 0.00 1.31 0.00 0.00 55.95 59.47 2mfn s SER 133 Cb 0.16 -2.63 -0.06 0.00 0.21 0.00 0.00 66.02 63.70 2mfn s SER 133 CO 0.44 -0.23 1.28 -0.81 0.41 0.00 0.00 173.24 174.32 2mfn n PRO 134 N 1.38 1.60 -4.00 12.44 -0.04 -1.26 -4.75 135.00 140.37 2mfn n PRO 134 Ca -0.00 0.59 -0.30 0.00 -0.04 0.00 0.00 63.50 63.75 2mfn n PRO 134 Cb 0.44 -2.47 -0.05 0.00 -0.04 0.00 0.00 33.50 31.38 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 -1.31 4.86 -0.24 0.52 -7.23 -1.26 -4.52 120.40 111.22 2mfn s VAL 135 Ca 0.70 -0.67 -0.09 0.00 -1.81 0.00 0.00 61.98 60.12 2mfn s VAL 135 Cb -0.44 -3.37 -0.04 0.00 0.56 0.00 0.00 36.38 33.09 2mfn s VAL 135 CO 0.50 0.10 0.12 -1.10 -0.31 0.00 0.00 175.10 174.42 2mfn s GLN 136 N -2.54 3.90 -0.20 4.82 -0.21 -1.12 -4.73 119.66 119.57 2mfn s GLN 136 Ca 0.32 -0.36 -0.10 0.00 0.02 0.00 0.00 55.36 55.24 2mfn s GLN 136 Cb -0.12 -3.45 -0.05 0.00 1.00 0.00 0.00 33.01 30.39 2mfn s GLN 136 CO 0.24 -0.04 0.13 -2.00 -2.12 0.00 0.00 175.29 171.50 2mfn s GLU 137 N 1.29 4.19 0.02 2.91 2.12 -1.26 0.89 118.70 128.86 2mfn s GLU 137 Ca 0.06 -0.22 0.02 0.00 0.36 0.00 0.00 54.97 55.19 2mfn s GLU 137 Cb -0.14 -3.42 -0.01 0.00 0.26 0.00 0.00 34.13 30.81 2mfn s GLU 137 CO 0.05 0.30 -0.07 -0.59 -0.54 0.00 0.00 175.26 174.41 2mfn s PHE 138 N 0.36 0.66 0.69 5.30 -0.12 -0.24 -4.98 117.98 119.65 2mfn s PHE 138 Ca 0.08 -0.26 -0.07 0.00 -0.05 0.00 0.00 56.93 56.63 2mfn s PHE 138 Cb -0.11 -0.41 0.05 0.00 -0.63 0.00 0.00 43.02 41.92 2mfn s PHE 138 CO -0.02 -0.03 1.01 0.95 -0.05 0.00 0.00 175.22 177.08 2mfn s THR 139 N -0.61 2.69 -0.06 -4.49 -4.23 -1.26 -1.79 115.64 105.88 2mfn s THR 139 Ca -0.02 -0.12 -0.02 0.00 -1.18 0.00 0.00 61.69 60.35 2mfn s THR 139 Cb -0.05 -3.15 0.04 0.00 1.34 0.00 0.00 72.50 70.67 2mfn s THR 139 CO 0.00 -0.17 0.12 -0.69 -0.54 0.00 0.00 174.62 173.35 2mfn s VAL 140 N -3.22 -0.07 0.65 2.29 1.01 -0.27 -4.89 120.40 115.90 2mfn s VAL 140 Ca 0.59 0.21 -0.18 0.00 0.00 0.00 0.00 61.98 62.60 2mfn s VAL 140 Cb -0.11 -0.22 -0.01 0.00 0.00 0.00 0.00 36.38 36.04 2mfn s VAL 140 CO 0.46 0.09 1.14 -2.65 0.00 0.00 0.00 175.10 174.14 2mfn n PRO 141 N 4.35 0.91 0.00 2.72 -0.01 -1.26 -1.93 135.00 139.78 2mfn n PRO 141 Ca -0.24 0.37 0.09 0.00 -0.01 0.00 0.00 63.50 63.70 2mfn n PRO 141 Cb 0.51 -2.38 0.41 0.00 -0.01 0.00 0.00 33.50 32.03 2mfn n PRO 141 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 175.50 175.90 2mfn n GLY 142 N 1.05 -1.03 0.48 -1.23 0.00 -1.24 -2.41 105.19 100.81 2mfn n GLY 142 Ca 0.15 -0.07 0.14 0.00 0.00 0.00 0.00 46.02 46.24 2mfn n GLY 142 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2mfn n SER 143 N -1.42 1.49 -4.49 1.61 7.64 -1.26 -4.81 113.62 112.37 2mfn n SER 143 Ca 0.06 -1.49 -0.35 0.00 1.01 0.00 0.00 58.87 58.09 2mfn n SER 143 Cb 0.18 0.00 -0.12 0.00 -1.01 0.00 0.00 64.21 63.27 2mfn n SER 143 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 2mfn s LYS 144 N -2.00 3.71 0.00 1.43 -0.14 -1.01 -4.94 119.74 116.78 2mfn s LYS 144 Ca 0.38 -0.47 0.25 0.00 -1.36 0.00 0.00 55.97 54.77 2mfn s LYS 144 Cb 0.21 -3.15 0.50 0.00 -1.68 0.00 0.00 37.83 33.70 2mfn s LYS 144 CO 0.34 0.04 1.40 -1.13 -0.76 0.00 0.00 175.35 175.24 2mfn n SER 145 N 4.20 1.27 -3.99 2.83 3.41 -1.26 -4.90 113.62 115.18 2mfn n SER 145 Ca -0.17 -1.03 -0.08 0.00 -0.26 0.00 0.00 58.87 57.33 2mfn n SER 145 Cb 0.52 0.27 -0.09 0.00 -0.26 0.00 0.00 64.21 64.65 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 -2.54 0.19 0.17 6.66 -4.23 -1.26 -2.41 115.64 112.21 2mfn s THR 146 Ca 0.21 -1.53 -0.02 0.00 -1.18 0.00 0.00 61.69 59.18 2mfn s THR 146 Cb 0.19 -1.42 -0.04 0.00 1.34 0.00 0.00 72.50 72.57 2mfn s THR 146 CO 0.56 -0.85 0.12 0.00 -0.54 0.00 0.00 174.62 173.91 2mfn s ALA 147 N -3.85 0.92 -0.06 3.99 0.00 0.05 -4.98 121.76 117.84 2mfn s ALA 147 Ca 0.06 -1.52 0.05 0.00 0.00 0.00 0.00 51.96 50.55 2mfn s ALA 147 Cb 0.06 1.11 -0.02 0.00 0.00 0.00 0.00 23.12 24.28 2mfn s ALA 147 CO -0.10 -0.56 -0.21 -0.08 0.00 0.00 0.00 175.76 174.81 2mfn s THR 148 N -4.09 2.40 -0.21 0.00 -1.32 -1.26 0.05 115.64 111.21 2mfn s THR 148 Ca 0.30 -0.95 -0.05 0.00 -1.21 0.00 0.00 61.69 59.79 2mfn s THR 148 Cb 0.07 -1.90 -0.02 0.00 -1.51 0.00 0.00 72.50 69.14 2mfn s THR 148 CO 0.07 0.57 -0.01 -0.63 -2.21 0.00 0.00 174.62 172.41 2mfn s ILE 149 N -0.32 3.79 0.37 5.08 -1.09 0.64 -4.95 121.20 124.71 2mfn s ILE 149 Ca 0.02 -0.36 0.05 0.00 -2.23 0.00 0.00 60.65 58.13 2mfn s ILE 149 Cb -0.13 -2.72 -0.07 0.00 -1.58 0.00 0.00 42.46 37.96 2mfn s ILE 149 CO 0.02 0.42 0.03 0.20 -1.23 0.00 0.00 174.94 174.39 2mfn s ASN 150 N 1.16 3.13 -0.50 3.58 0.01 -1.26 -1.10 114.94 119.96 2mfn s ASN 150 Ca 0.03 -1.37 -0.00 0.00 -0.71 0.00 0.00 52.86 50.80 2mfn s ASN 150 Cb -0.14 -0.24 0.00 0.00 0.41 0.00 0.00 41.25 41.27 2mfn s ASN 150 CO 0.01 -0.53 0.42 0.59 -1.51 0.00 0.00 177.10 176.08 2mfn n ASN 151 N -0.83 -2.06 -4.34 -1.22 3.02 -1.08 -4.96 115.26 103.78 2mfn n ASN 151 Ca -0.04 -0.26 -0.33 0.00 -0.03 0.00 0.00 54.58 53.93 2mfn n ASN 151 Cb 0.67 -2.42 -0.15 0.00 -0.61 0.00 0.00 39.78 37.27 2mfn n ASN 151 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2mfn s ILE 152 N -3.15 2.80 -0.18 2.41 1.01 -0.68 -5.05 121.20 118.36 2mfn s ILE 152 Ca 0.01 -0.76 -0.29 0.00 0.00 0.00 0.00 60.65 59.61 2mfn s ILE 152 Cb -0.00 -2.15 -0.02 0.00 0.01 0.00 0.00 42.46 40.30 2mfn s ILE 152 CO 0.30 0.54 1.34 -0.54 0.00 0.00 0.00 174.94 176.58 2mfn s LYS 153 N 0.27 4.15 1.04 2.79 1.02 -1.26 -4.39 119.74 123.35 2mfn s LYS 153 Ca -0.11 1.66 -0.12 0.00 0.02 0.00 0.00 55.97 57.42 2mfn s LYS 153 Cb -0.16 -3.83 0.21 0.00 -0.52 0.00 0.00 37.83 33.53 2mfn s LYS 153 CO 0.06 -0.83 1.07 -1.25 -0.92 0.00 0.00 175.35 173.48 2mfn s PRO 154 N 3.75 0.09 -1.88 -1.68 0.05 -1.25 -3.65 135.00 130.43 2mfn s PRO 154 Ca 0.58 0.84 0.00 0.00 0.05 0.00 0.00 61.00 62.48 2mfn s PRO 154 Cb -0.22 -1.67 0.00 0.00 0.05 0.00 0.00 34.50 32.65 2mfn s PRO 154 CO 0.19 -3.04 0.00 0.41 0.05 0.00 0.00 177.00 174.60 2mfn n GLY 155 N -0.14 -0.04 2.86 0.56 0.00 1.14 -4.94 105.19 104.63 2mfn n GLY 155 Ca 0.05 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.95 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 -3.00 0.01 0.39 4.61 0.00 0.77 -4.90 121.76 119.63 2mfn s ALA 156 Ca 0.00 0.02 -0.28 0.00 0.00 0.00 0.00 51.96 51.70 2mfn s ALA 156 Cb 0.00 -0.02 -0.11 0.00 0.00 0.00 0.00 23.12 22.99 2mfn s ALA 156 CO 0.00 -0.01 1.49 -3.47 0.00 0.00 0.00 175.76 173.77 2mfn n ASP 157 N 3.16 3.81 -4.18 0.00 -0.08 -1.26 -0.90 116.55 117.09 2mfn n ASP 157 Ca -0.13 1.22 -0.12 0.00 -1.51 0.00 0.00 54.79 54.25 2mfn n ASP 157 Cb 0.59 -1.63 -0.10 0.00 2.34 0.00 0.00 41.12 42.32 2mfn n ASP 157 CO 0.00 0.00 0.00 -0.31 0.12 0.00 0.00 177.20 177.01 2mfn s TYR 158 N -1.13 0.97 -0.11 -0.67 1.51 0.88 -0.13 117.35 118.67 2mfn s TYR 158 Ca 0.54 -0.84 -0.01 0.00 -1.01 0.00 0.00 57.07 55.75 2mfn s TYR 158 Cb -0.47 -0.54 0.03 0.00 -0.11 0.00 0.00 41.96 40.86 2mfn s TYR 158 CO 0.63 -0.09 -0.07 0.99 -1.11 0.00 0.00 175.55 175.91 2mfn s THR 159 N -3.37 0.95 -0.21 -0.71 2.01 -0.42 -0.87 115.64 113.03 2mfn s THR 159 Ca 0.11 -0.24 -0.05 0.00 0.31 0.00 0.00 61.69 61.82 2mfn s THR 159 Cb 0.03 -0.99 -0.02 0.00 0.01 0.00 0.00 72.50 71.53 2mfn s THR 159 CO -0.03 0.36 0.01 -0.63 -0.69 0.00 0.00 174.62 173.63 2mfn s ILE 160 N 1.74 3.99 -0.01 1.82 -1.09 -0.69 0.19 121.20 127.15 2mfn s ILE 160 Ca 0.05 -0.30 0.05 0.00 -2.23 0.00 0.00 60.65 58.22 2mfn s ILE 160 Cb -0.12 -2.82 -0.01 0.00 -1.58 0.00 0.00 42.46 37.93 2mfn s ILE 160 CO -0.08 0.41 -0.16 -0.89 -1.23 0.00 0.00 174.94 172.99 2mfn s THR 161 N 1.12 1.27 -0.03 2.92 2.01 -1.09 -0.97 115.64 120.87 2mfn s THR 161 Ca 0.03 -0.69 0.06 0.00 0.31 0.00 0.00 61.69 61.40 2mfn s THR 161 Cb -0.14 -1.06 -0.01 0.00 0.01 0.00 0.00 72.50 71.30 2mfn s THR 161 CO 0.02 0.36 -0.22 -0.22 -0.69 0.00 0.00 174.62 173.86 2mfn s LEU 162 N -0.38 2.03 0.16 4.42 2.96 -0.99 -0.38 118.68 126.50 2mfn s LEU 162 Ca 0.06 -0.43 0.10 0.00 -0.22 0.00 0.00 54.13 53.64 2mfn s LEU 162 Cb -0.06 -1.20 -0.04 0.00 0.50 0.00 0.00 46.19 45.39 2mfn s LEU 162 CO -0.01 0.25 -0.21 -0.31 -1.32 0.00 0.00 176.35 174.75 2mfn s TYR 163 N -0.32 2.02 -0.09 5.38 1.51 0.31 -2.69 117.35 123.46 2mfn s TYR 163 Ca 0.03 -0.41 0.04 0.00 -1.01 0.00 0.00 57.07 55.71 2mfn s TYR 163 Cb -0.11 -1.03 -0.00 0.00 -0.11 0.00 0.00 41.96 40.71 2mfn s TYR 163 CO 0.01 0.36 -0.23 0.00 -1.11 0.00 0.00 175.55 174.59 2mfn s ALA 164 N -1.67 2.23 -0.22 3.71 0.00 -1.26 0.26 121.76 124.81 2mfn s ALA 164 Ca 0.15 -0.98 -0.04 0.00 0.00 0.00 0.00 51.96 51.10 2mfn s ALA 164 Cb -0.08 -0.83 -0.01 0.00 0.00 0.00 0.00 23.12 22.20 2mfn s ALA 164 CO 0.07 0.31 -0.04 0.08 0.00 0.00 0.00 175.76 176.19 2mfn s VAL 165 N 0.23 3.42 -0.21 0.00 1.01 -0.30 -3.04 120.40 121.51 2mfn s VAL 165 Ca -0.15 -0.47 -0.11 0.00 0.00 0.00 0.00 61.98 61.25 2mfn s VAL 165 Cb -0.17 -2.56 -0.09 0.00 0.00 0.00 0.00 36.38 33.56 2mfn s VAL 165 CO 0.07 0.42 -0.28 0.35 0.00 0.00 0.00 175.10 175.67 2mfn n THR 166 N 4.80 1.17 0.00 3.92 -2.24 -1.15 0.10 114.28 120.88 2mfn n THR 166 Ca -0.18 -0.29 0.00 0.00 -2.27 0.00 0.00 64.05 61.30 2mfn n THR 166 Cb 0.51 -1.79 0.00 0.00 -2.10 0.00 0.00 70.33 66.95 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 1.66 -3.10 3.35 3.38 0.00 -1.24 -4.27 105.19 104.96 2mfn n GLY 167 Ca -0.42 -1.05 -0.21 0.00 0.00 0.00 0.00 46.02 44.34 2mfn n GLY 167 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2mfn s ARG 168 N -0.23 1.78 0.55 1.61 0.52 -1.00 -4.78 118.95 117.40 2mfn s ARG 168 Ca 0.00 -2.05 0.35 0.00 -0.52 0.00 0.00 55.73 53.51 2mfn s ARG 168 Cb 0.00 0.06 1.52 0.00 0.52 0.00 0.00 34.95 37.04 2mfn s ARG 168 CO 0.00 -0.59 1.82 0.78 0.02 0.00 0.00 175.30 177.33 2mfn h GLY 169 N 2.06 0.00 1.15 -3.53 0.00 -1.98 0.87 103.07 101.64 2mfn h GLY 169 Ca -0.28 0.00 -0.19 0.00 0.00 0.00 0.00 47.33 46.86 2mfn h GLY 169 CO 0.43 0.00 -0.57 -0.55 0.00 0.00 0.00 176.54 175.85 2mfn h ASP 170 N 0.00 0.99 -2.04 0.19 3.32 -2.03 -3.36 116.42 113.49 2mfn h ASP 170 Ca 0.50 -0.54 -0.56 0.00 0.02 0.00 0.00 57.03 56.45 2mfn h ASP 170 Cb 2.06 -0.28 -0.40 0.00 0.22 0.00 0.00 39.33 40.93 2mfn h ASP 170 CO -0.01 1.34 -1.01 -1.20 -1.72 0.00 0.00 179.24 176.65 2mfn n SER 171 N -4.00 0.94 -4.56 6.45 7.64 0.24 -5.05 113.62 115.28 2mfn n SER 171 Ca -0.05 -2.87 -0.19 0.00 1.01 0.00 0.00 58.87 56.78 2mfn n SER 171 Cb 0.64 -0.64 -0.07 0.00 -1.01 0.00 0.00 64.21 63.13 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 -1.54 1.90 -0.09 1.43 0.05 0.19 -2.38 135.00 134.57 2mfn s PRO 172 Ca 0.36 -0.04 -0.01 0.00 0.05 0.00 0.00 61.00 61.36 2mfn s PRO 172 Cb 0.18 -4.94 -0.03 0.00 0.05 0.00 0.00 34.50 29.76 2mfn s PRO 172 CO -0.09 -4.26 -0.02 0.00 0.05 0.00 0.00 177.00 172.68 2mfn s ALA 173 N 13.40 3.16 0.08 8.56 0.00 -1.26 -4.97 121.76 140.73 2mfn s ALA 173 Ca 0.82 -0.83 0.06 0.00 0.00 0.00 0.00 51.96 52.00 2mfn s ALA 173 Cb -0.09 -1.41 -0.03 0.00 0.00 0.00 0.00 23.12 21.59 2mfn s ALA 173 CO 0.07 0.53 -0.15 -1.54 0.00 0.00 0.00 175.76 174.67 2mfn s SER 174 N -0.70 1.87 0.82 0.00 1.04 -1.26 -2.94 113.70 112.54 2mfn s SER 174 Ca 0.11 -0.66 -0.12 0.00 0.48 0.00 0.00 55.95 55.76 2mfn s SER 174 Cb -0.12 -0.07 0.09 0.00 0.10 0.00 0.00 66.02 66.02 2mfn s SER 174 CO 0.02 -0.06 1.17 -0.94 0.98 0.00 0.00 173.24 174.41 2mfn s SER 175 N -1.87 4.39 0.03 7.02 1.04 -1.17 -4.92 113.70 118.21 2mfn s SER 175 Ca 0.01 0.80 -0.30 0.00 0.48 0.00 0.00 55.95 56.94 2mfn s SER 175 Cb -0.09 -1.30 -0.09 0.00 0.10 0.00 0.00 66.02 64.64 2mfn s SER 175 CO 0.03 -1.98 1.99 -0.75 0.98 0.00 0.00 173.24 173.50 2mfn s LYS 176 N -5.54 4.09 0.59 4.02 2.20 -1.26 -4.68 119.74 119.15 2mfn s LYS 176 Ca 0.62 2.60 -0.20 0.00 -0.36 0.00 0.00 55.97 58.63 2mfn s LYS 176 Cb -0.11 -4.18 -0.03 0.00 -1.51 0.00 0.00 37.83 31.99 2mfn s LYS 176 CO 0.50 -1.02 1.32 -2.14 -0.36 0.00 0.00 175.35 173.64 2mfn s PRO 177 N 4.58 2.91 -0.21 4.03 0.02 -1.26 -4.93 135.00 140.13 2mfn s PRO 177 Ca 0.90 2.12 -0.03 0.00 0.02 0.00 0.00 61.00 64.01 2mfn s PRO 177 Cb -0.42 -2.07 -0.01 0.00 0.02 0.00 0.00 34.50 32.02 2mfn s PRO 177 CO 0.42 -1.34 -0.06 0.08 -0.33 0.00 0.00 177.00 175.77 2mfn s VAL 178 N -1.37 3.21 0.16 3.83 1.01 -1.09 -5.00 120.40 121.15 2mfn s VAL 178 Ca 0.76 -0.55 0.08 0.00 0.00 0.00 0.00 61.98 62.27 2mfn s VAL 178 Cb -0.38 -2.45 -0.04 0.00 0.00 0.00 0.00 36.38 33.51 2mfn s VAL 178 CO 0.43 0.44 -0.06 -0.94 0.00 0.00 0.00 175.10 174.97 2mfn s SER 179 N 1.44 4.50 0.11 3.32 1.04 -1.26 -2.34 113.70 120.52 2mfn s SER 179 Ca 0.06 -0.46 0.02 0.00 0.48 0.00 0.00 55.95 56.05 2mfn s SER 179 Cb -0.14 -0.87 -0.04 0.00 0.10 0.00 0.00 66.02 65.07 2mfn s SER 179 CO -0.04 0.12 -0.07 0.27 0.98 0.00 0.00 173.24 174.49 2mfn s ILE 180 N -1.60 0.82 -0.12 -1.02 -4.36 -0.15 -5.00 121.20 109.77 2mfn s ILE 180 Ca 0.25 -1.97 -0.01 0.00 -0.26 0.00 0.00 60.65 58.66 2mfn s ILE 180 Cb -0.10 -1.73 -0.03 0.00 1.25 0.00 0.00 42.46 41.86 2mfn s ILE 180 CO 0.16 -0.84 -0.07 0.20 0.24 0.00 0.00 174.94 174.63 2mfn s ASN 181 N -3.08 4.57 -0.03 4.36 0.01 -1.26 -1.70 114.94 117.81 2mfn s ASN 181 Ca 0.13 -0.14 -0.01 0.00 -0.71 0.00 0.00 52.86 52.14 2mfn s ASN 181 Cb 0.05 -1.55 0.03 0.00 0.41 0.00 0.00 41.25 40.19 2mfn s ASN 181 CO -0.03 0.23 0.03 -0.47 -1.51 0.00 0.00 177.10 175.34 2mfn s TYR 182 N -0.01 0.15 0.30 2.20 6.14 -0.04 -4.95 117.35 121.14 2mfn s TYR 182 Ca -0.00 0.11 -0.18 0.00 0.64 0.00 0.00 57.07 57.64 2mfn s TYR 182 Cb -0.14 -0.39 -0.09 0.00 0.42 0.00 0.00 41.96 41.77 2mfn s TYR 182 CO 0.03 -0.14 0.77 0.15 0.64 0.00 0.00 175.55 177.00 2mfn s LYS 183 N 1.42 4.16 0.00 4.97 1.02 -1.26 -0.08 119.74 129.96 2mfn s LYS 183 Ca -0.04 0.84 0.00 0.00 0.02 0.00 0.00 55.97 56.78 2mfn s LYS 183 Cb -0.13 -2.59 0.00 0.00 -0.52 0.00 0.00 37.83 34.59 2mfn s LYS 183 CO -0.03 0.23 0.33 0.25 -0.92 0.00 0.00 175.35 175.21