#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1mfn n LEU 2 N 0.00 0.00 -4.80 0.99 4.32 -1.26 -5.06 117.00 111.18 1mfn n LEU 2 Ca 0.00 0.00 -0.33 0.00 -0.02 0.00 0.00 56.01 55.66 1mfn n LEU 2 Cb 0.00 0.00 -0.00 0.00 -1.62 0.00 0.00 43.42 41.80 1mfn n LEU 2 CO 0.00 0.00 0.71 -1.81 -1.22 0.00 0.00 177.39 175.07 1mfn s ASP 3 N -0.59 5.99 -0.46 -1.43 1.11 -1.26 -4.97 116.67 115.07 1mfn s ASP 3 Ca 0.00 1.82 -0.18 0.00 0.18 0.00 0.00 52.55 54.38 1mfn s ASP 3 Cb 0.00 -2.54 0.04 0.00 1.07 0.00 0.00 42.92 41.49 1mfn s ASP 3 CO 0.00 -1.02 0.49 -0.94 1.18 0.00 0.00 175.17 174.88 1mfn s SER 4 N -2.61 6.20 -1.33 0.27 1.04 -1.26 -4.64 113.70 111.35 1mfn s SER 4 Ca 0.64 -0.86 -0.17 0.00 0.48 0.00 0.00 55.95 56.04 1mfn s SER 4 Cb -0.16 -2.24 0.06 0.00 0.10 0.00 0.00 66.02 63.79 1mfn s SER 4 CO 0.32 -0.69 1.85 -0.81 0.98 0.00 0.00 173.24 174.89 1mfn n PRO 5 N 5.70 3.13 0.00 4.02 -0.04 -1.26 -4.81 135.00 141.73 1mfn n PRO 5 Ca -0.08 -3.14 0.00 0.00 -0.04 0.00 0.00 63.50 60.25 1mfn n PRO 5 Cb 0.46 -3.45 0.00 0.00 -0.04 0.00 0.00 33.50 30.48 1mfn n PRO 5 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1mfn n THR 6 N 6.07 0.00 -1.55 0.52 -2.24 -1.24 -4.35 114.28 111.49 1mfn n THR 6 Ca 0.49 0.00 -0.17 0.00 -2.27 0.00 0.00 64.05 62.11 1mfn n THR 6 Cb 0.44 0.00 -0.07 0.00 -2.10 0.00 0.00 70.33 68.61 1mfn n THR 6 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1mfn n GLY 7 N 4.47 1.43 3.59 3.38 0.00 -1.26 -0.55 105.19 116.26 1mfn n GLY 7 Ca 0.00 0.00 -0.57 0.00 0.00 0.00 0.00 46.02 45.45 1mfn n GLY 7 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1mfn n PHE 8 N -2.22 1.33 -3.15 1.61 -0.00 -1.26 -3.60 117.46 110.17 1mfn n PHE 8 Ca -0.17 0.81 0.04 0.00 -0.00 0.00 0.00 57.45 58.14 1mfn n PHE 8 Cb 0.55 -2.26 -0.01 0.00 -0.00 0.00 0.00 39.48 37.77 1mfn n PHE 8 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.76 177.10 1mfn s ASP 9 N 0.99 -1.29 -0.10 -2.13 -1.08 -0.04 -4.91 116.67 108.12 1mfn s ASP 9 Ca 0.91 0.51 -0.25 0.00 -0.52 0.00 0.00 52.55 53.19 1mfn s ASP 9 Cb -1.13 1.96 -0.03 0.00 -1.46 0.00 0.00 42.92 42.27 1mfn s ASP 9 CO 0.56 -0.24 0.79 -0.44 0.52 0.00 0.00 175.17 176.36 1mfn s SER 10 N 2.87 7.02 0.00 -0.34 0.01 -1.26 0.87 113.70 122.87 1mfn s SER 10 Ca 0.15 1.24 0.00 0.00 1.31 0.00 0.00 55.95 58.65 1mfn s SER 10 Cb -0.12 -2.45 0.00 0.00 0.21 0.00 0.00 66.02 63.66 1mfn s SER 10 CO -0.22 -0.25 0.00 -1.54 0.41 0.00 0.00 173.24 171.64 1mfn n SER 11 N 4.40 0.00 -4.06 2.44 3.41 -0.15 -4.91 113.62 114.76 1mfn n SER 11 Ca 0.02 -0.32 -0.34 0.00 -0.26 0.00 0.00 58.87 57.98 1mfn n SER 11 Cb 0.50 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.42 1mfn n SER 11 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1mfn n ASP 12 N -0.49 -2.85 -4.71 4.04 9.92 -1.26 -1.78 116.55 119.42 1mfn n ASP 12 Ca 0.00 -0.87 -0.42 0.00 -0.53 0.00 0.00 54.79 52.97 1mfn n ASP 12 Cb 0.00 -2.38 -0.03 0.00 -0.64 0.00 0.00 41.12 38.07 1mfn n ASP 12 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 1mfn s ILE 13 N -3.13 4.09 0.48 0.53 -1.09 -1.26 -1.06 121.20 119.76 1mfn s ILE 13 Ca 0.67 1.50 0.03 0.00 -2.23 0.00 0.00 60.65 60.62 1mfn s ILE 13 Cb -0.37 -3.96 -0.03 0.00 -1.58 0.00 0.00 42.46 36.51 1mfn s ILE 13 CO 0.82 0.12 0.03 -0.89 -1.23 0.00 0.00 174.94 173.79 1mfn s THR 14 N 1.05 1.47 0.00 2.92 2.01 0.85 -4.72 115.64 119.23 1mfn s THR 14 Ca 0.58 -1.97 0.00 0.00 0.31 0.00 0.00 61.69 60.61 1mfn s THR 14 Cb -0.29 -2.44 0.00 0.00 0.01 0.00 0.00 72.50 69.78 1mfn s THR 14 CO 0.29 0.00 0.47 0.00 -0.69 0.00 0.00 174.62 174.69 1mfn n ALA 15 N -1.20 -0.14 1.63 7.40 0.00 -1.24 -2.40 120.51 124.56 1mfn n ALA 15 Ca -0.14 0.00 0.14 0.00 0.00 0.00 0.00 53.44 53.45 1mfn n ALA 15 Cb 0.67 0.00 0.81 0.00 0.00 0.00 0.00 19.45 20.93 1mfn n ALA 15 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1mfn n ASN 16 N -1.17 0.00 -3.99 0.00 6.94 -1.26 -3.71 115.26 112.07 1mfn n ASN 16 Ca 0.00 -0.57 -0.08 0.00 -0.02 0.00 0.00 54.58 53.90 1mfn n ASN 16 Cb 0.00 -0.13 -0.09 0.00 -2.36 0.00 0.00 39.78 37.21 1mfn n ASN 16 CO 0.00 0.00 0.00 -0.55 -1.03 0.00 0.00 177.26 175.68 1mfn s SER 17 N -2.25 0.30 -0.20 0.53 0.15 -1.24 0.04 113.70 111.02 1mfn s SER 17 Ca 0.37 -0.87 -0.28 0.00 0.70 0.00 0.00 55.95 55.87 1mfn s SER 17 Cb 0.20 0.28 0.12 0.00 -1.71 0.00 0.00 66.02 64.91 1mfn s SER 17 CO 0.38 -0.68 0.97 0.72 1.20 0.00 0.00 173.24 175.83 1mfn s PHE 18 N -3.91 -0.45 0.21 3.44 -0.12 0.07 0.29 117.98 117.51 1mfn s PHE 18 Ca 0.08 0.94 0.08 0.00 -0.05 0.00 0.00 56.93 57.98 1mfn s PHE 18 Cb 0.06 0.40 -0.04 0.00 -0.63 0.00 0.00 43.02 42.82 1mfn s PHE 18 CO -0.09 -0.32 0.05 0.99 -0.05 0.00 0.00 175.22 175.80 1mfn s THR 19 N -0.53 3.86 0.33 -4.49 2.01 -0.22 -0.60 115.64 116.00 1mfn s THR 19 Ca -0.01 -1.52 0.07 0.00 0.31 0.00 0.00 61.69 60.54 1mfn s THR 19 Cb -0.02 -3.01 -0.07 0.00 0.01 0.00 0.00 72.50 69.41 1mfn s THR 19 CO -0.01 -0.23 -0.04 -0.69 -0.69 0.00 0.00 174.62 172.96 1mfn s VAL 20 N -1.97 1.84 0.08 3.82 1.01 -0.73 -0.97 120.40 123.47 1mfn s VAL 20 Ca 0.30 -2.11 0.00 0.00 0.00 0.00 0.00 61.98 60.18 1mfn s VAL 20 Cb -0.08 -2.67 -0.04 0.00 0.00 0.00 0.00 36.38 33.58 1mfn s VAL 20 CO 0.21 -0.17 -0.05 -1.00 0.00 0.00 0.00 175.10 174.09 1mfn s HIS 21 N -2.87 0.74 0.00 5.22 3.76 0.25 -2.19 115.29 120.20 1mfn s HIS 21 Ca 0.33 -0.99 0.00 0.00 -0.15 0.00 0.00 55.06 54.24 1mfn s HIS 21 Cb 0.05 -0.47 0.00 0.00 1.11 0.00 0.00 32.58 33.28 1mfn s HIS 21 CO 0.15 -0.26 0.00 -2.67 -0.85 0.00 0.00 174.74 171.11 1mfn n TRP 22 N 0.02 0.00 -1.61 1.40 2.14 0.12 -0.86 117.44 118.65 1mfn n TRP 22 Ca -0.13 0.00 -0.31 0.00 2.07 0.00 0.00 57.50 59.13 1mfn n TRP 22 Cb 0.61 0.00 0.05 0.00 -0.81 0.00 0.00 31.31 31.16 1mfn n TRP 22 CO 0.00 0.00 0.00 0.08 2.07 0.00 0.00 177.69 179.84 1mfn s VAL 23 N -0.96 3.92 0.40 -1.67 1.01 0.29 -4.50 120.40 118.89 1mfn s VAL 23 Ca 0.00 0.67 0.04 0.00 0.00 0.00 0.00 61.98 62.68 1mfn s VAL 23 Cb 0.00 -3.35 -0.00 0.00 0.00 0.00 0.00 36.38 33.03 1mfn s VAL 23 CO 0.00 -0.78 0.58 0.00 0.00 0.00 0.00 175.10 174.90 1mfn s ALA 24 N -2.94 4.04 0.35 5.51 0.00 -1.26 -3.62 121.76 123.83 1mfn s ALA 24 Ca 0.59 -1.30 -0.25 0.00 0.00 0.00 0.00 51.96 51.00 1mfn s ALA 24 Cb -0.15 -1.89 -0.10 0.00 0.00 0.00 0.00 23.12 20.99 1mfn s ALA 24 CO 0.52 -0.24 0.96 -1.25 0.00 0.00 0.00 175.76 175.75 1mfn s PRO 25 N -4.38 4.49 0.00 0.00 0.04 -1.26 -4.53 135.00 129.36 1mfn s PRO 25 Ca 0.48 1.31 0.14 0.00 0.04 0.00 0.00 61.00 62.98 1mfn s PRO 25 Cb -0.10 -2.68 0.85 0.00 0.04 0.00 0.00 34.50 32.61 1mfn s PRO 25 CO 0.34 0.19 1.55 0.54 0.04 0.00 0.00 177.00 179.67 1mfn n ARG 26 N 0.32 1.02 -3.70 4.56 3.00 -1.26 -4.81 116.66 115.78 1mfn n ARG 26 Ca 0.03 -0.02 -0.23 0.00 -0.01 0.00 0.00 57.85 57.61 1mfn n ARG 26 Cb 0.51 -1.23 -0.02 0.00 0.00 0.00 0.00 32.46 31.72 1mfn n ARG 26 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1mfn s ALA 27 N -1.99 4.19 -1.04 7.54 0.00 -1.26 -4.99 121.76 124.20 1mfn s ALA 27 Ca 0.22 -1.70 -0.23 0.00 0.00 0.00 0.00 51.96 50.25 1mfn s ALA 27 Cb 0.10 -0.87 0.03 0.00 0.00 0.00 0.00 23.12 22.38 1mfn s ALA 27 CO 0.17 -0.34 1.58 -1.25 0.00 0.00 0.00 175.76 175.91 1mfn s PRO 28 N -4.20 3.44 0.62 0.00 0.04 -1.26 -4.97 135.00 128.67 1mfn s PRO 28 Ca 0.43 -1.09 0.07 0.00 0.04 0.00 0.00 61.00 60.46 1mfn s PRO 28 Cb -0.02 -5.33 0.11 0.00 0.04 0.00 0.00 34.50 29.30 1mfn s PRO 28 CO 0.26 -2.46 0.86 0.44 0.04 0.00 0.00 177.00 176.14 1mfn n ILE 29 N 7.02 0.00 -0.02 0.56 -5.35 -1.26 -4.85 119.36 115.46 1mfn n ILE 29 Ca 0.36 -1.87 0.07 0.00 -0.27 0.00 0.00 62.75 61.05 1mfn n ILE 29 Cb 0.50 -0.60 -0.15 0.00 -1.74 0.00 0.00 39.64 37.64 1mfn n ILE 29 CO 0.00 0.00 0.00 0.35 -1.76 0.00 0.00 176.55 175.14 1mfn n THR 30 N -2.43 0.18 0.00 7.28 -2.24 0.32 -4.83 114.28 112.58 1mfn n THR 30 Ca 0.17 -0.49 0.00 0.00 -2.27 0.00 0.00 64.05 61.45 1mfn n THR 30 Cb 0.60 -0.03 0.00 0.00 -2.10 0.00 0.00 70.33 68.80 1mfn n THR 30 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1mfn n GLY 31 N 1.47 3.71 3.86 3.38 0.00 -1.19 -4.18 105.19 112.24 1mfn n GLY 31 Ca -0.07 -1.66 -0.33 0.00 0.00 0.00 0.00 46.02 43.96 1mfn n GLY 31 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1mfn s TYR 32 N -2.04 3.47 -0.48 1.61 2.02 0.46 -1.36 117.35 121.04 1mfn s TYR 32 Ca 0.00 0.94 -0.13 0.00 -0.37 0.00 0.00 57.07 57.50 1mfn s TYR 32 Cb 0.00 -2.30 0.09 0.00 -0.40 0.00 0.00 41.96 39.35 1mfn s TYR 32 CO 0.00 0.31 0.38 0.42 -1.57 0.00 0.00 175.55 175.09 1mfn s ILE 33 N -1.73 4.88 -0.30 2.71 1.09 0.81 0.25 121.20 128.92 1mfn s ILE 33 Ca 0.45 -1.32 -0.22 0.00 -1.10 0.00 0.00 60.65 58.46 1mfn s ILE 33 Cb -0.12 -4.01 -0.01 0.00 -1.06 0.00 0.00 42.46 37.26 1mfn s ILE 33 CO 0.20 -0.65 0.71 -0.63 -0.10 0.00 0.00 174.94 174.48 1mfn s ILE 34 N 1.55 4.87 -0.23 2.92 -1.09 0.38 -2.03 121.20 127.57 1mfn s ILE 34 Ca 0.04 1.06 0.02 0.00 -2.23 0.00 0.00 60.65 59.54 1mfn s ILE 34 Cb -0.25 -4.07 0.05 0.00 -1.58 0.00 0.00 42.46 36.61 1mfn s ILE 34 CO 0.04 -0.18 -0.10 -0.13 -1.23 0.00 0.00 174.94 173.35 1mfn s ARG 35 N 2.78 2.06 -0.23 2.79 0.52 -0.16 0.19 118.95 126.89 1mfn s ARG 35 Ca 0.29 -1.09 -0.07 0.00 -0.52 0.00 0.00 55.73 54.34 1mfn s ARG 35 Cb -0.15 -2.67 -0.03 0.00 0.52 0.00 0.00 34.95 32.63 1mfn s ARG 35 CO 0.12 -0.52 0.06 -3.38 0.02 0.00 0.00 175.30 171.60 1mfn s HIS 36 N 1.27 3.10 -0.03 -0.53 -3.43 -0.85 0.23 115.29 115.05 1mfn s HIS 36 Ca -0.05 -0.34 -0.01 0.00 -0.80 0.00 0.00 55.06 53.85 1mfn s HIS 36 Cb -0.18 -2.20 0.03 0.00 -1.43 0.00 0.00 32.58 28.80 1mfn s HIS 36 CO -0.07 -0.27 0.06 -3.38 -2.00 0.00 0.00 174.74 169.09 1mfn s HIS 37 N 1.37 -0.00 0.56 0.38 -3.43 -0.67 -1.93 115.29 111.56 1mfn s HIS 37 Ca 0.05 0.23 -0.17 0.00 -0.80 0.00 0.00 55.06 54.37 1mfn s HIS 37 Cb -0.15 -0.26 -0.15 0.00 -1.43 0.00 0.00 32.58 30.60 1mfn s HIS 37 CO 0.03 -0.13 -0.22 0.00 -2.00 0.00 0.00 174.74 172.43 1mfn n ALA 38 N 4.45 -3.38 -0.44 -1.38 0.00 -1.26 0.19 120.51 118.69 1mfn n ALA 38 Ca -0.22 -0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.09 1mfn n ALA 38 Cb 0.50 -1.33 0.00 0.00 0.00 0.00 0.00 19.45 18.62 1mfn n ALA 38 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1mfn n GLU 39 N 1.60 0.00 -0.01 0.00 -0.58 -0.80 -4.23 120.64 116.62 1mfn n GLU 39 Ca 0.06 0.38 -0.01 0.00 -0.42 0.00 0.00 57.16 57.18 1mfn n GLU 39 Cb 0.47 -1.28 -0.00 0.00 -0.57 0.00 0.00 31.44 30.06 1mfn n GLU 39 CO 0.00 0.00 0.00 0.45 -0.48 0.00 0.00 177.13 177.10 1mfn h HIS 40 N 0.00 0.00 -1.26 -0.32 3.86 -1.89 -3.47 115.15 112.07 1mfn h HIS 40 Ca 0.00 0.00 0.14 0.00 -1.16 0.00 0.00 60.37 59.35 1mfn h HIS 40 Cb 0.00 0.00 -0.22 0.00 1.06 0.00 0.00 27.41 28.25 1mfn h HIS 40 CO -0.01 0.00 0.04 -1.54 0.86 0.00 0.00 177.93 177.28 1mfn s SER 41 N -3.74 -0.85 0.00 2.45 1.04 -1.26 -5.12 113.70 106.23 1mfn s SER 41 Ca -0.02 1.01 0.00 0.00 0.48 0.00 0.00 55.95 57.42 1mfn s SER 41 Cb 0.00 1.90 0.00 0.00 0.10 0.00 0.00 66.02 68.02 1mfn s SER 41 CO 0.02 -0.16 0.00 0.52 0.98 0.00 0.00 173.24 174.60 1mfn n VAL 42 N 5.23 0.00 0.00 5.02 0.31 -1.26 -5.03 118.33 122.60 1mfn n VAL 42 Ca -0.09 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.24 1mfn n VAL 42 Cb 0.51 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.44 1mfn n VAL 42 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1mfn n GLY 43 N 0.00 -3.24 3.30 2.92 0.00 -1.26 -4.97 105.19 101.95 1mfn n GLY 43 Ca 0.00 -0.94 -0.31 0.00 0.00 0.00 0.00 46.02 44.77 1mfn n GLY 43 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1mfn s ARG 44 N 0.00 2.36 -1.14 1.61 3.00 -1.26 -4.75 118.95 118.76 1mfn s ARG 44 Ca 0.00 -0.90 -0.21 0.00 0.00 0.00 0.00 55.73 54.62 1mfn s ARG 44 Cb 0.00 -2.12 0.04 0.00 0.00 0.00 0.00 34.95 32.87 1mfn s ARG 44 CO 0.00 0.47 1.63 -1.25 0.00 0.00 0.00 175.30 176.16 1mfn s PRO 45 N -0.39 3.62 0.24 3.54 0.04 -1.25 -4.61 135.00 136.18 1mfn s PRO 45 Ca 0.03 -1.44 0.00 0.00 0.04 0.00 0.00 61.00 59.64 1mfn s PRO 45 Cb -0.12 -5.41 -0.04 0.00 0.04 0.00 0.00 34.50 28.97 1mfn s PRO 45 CO 0.01 -2.42 0.42 1.03 0.04 0.00 0.00 177.00 176.08 1mfn s ARG 46 N 4.89 3.50 -0.38 4.56 1.81 -0.81 -4.92 118.95 127.60 1mfn s ARG 46 Ca 0.52 -0.39 -0.03 0.00 -1.72 0.00 0.00 55.73 54.11 1mfn s ARG 46 Cb 0.01 -2.81 0.09 0.00 -0.45 0.00 0.00 34.95 31.80 1mfn s ARG 46 CO -0.00 0.35 0.16 1.14 -0.68 0.00 0.00 175.30 176.27 1mfn s GLN 47 N -3.62 2.11 -0.30 3.54 -2.07 -1.26 -2.02 119.66 116.06 1mfn s GLN 47 Ca 0.38 -1.68 -0.08 0.00 -1.82 0.00 0.00 55.36 52.16 1mfn s GLN 47 Cb -0.10 -3.50 -0.00 0.00 -1.09 0.00 0.00 33.01 28.31 1mfn s GLN 47 CO 0.30 -0.97 0.11 -0.51 -1.32 0.00 0.00 175.29 172.91 1mfn s ASP 48 N 1.69 5.31 0.02 12.60 1.11 0.51 -4.95 116.67 132.97 1mfn s ASP 48 Ca 0.05 -0.57 -0.15 0.00 0.18 0.00 0.00 52.55 52.06 1mfn s ASP 48 Cb -0.22 -1.94 -0.06 0.00 1.07 0.00 0.00 42.92 41.77 1mfn s ASP 48 CO -0.03 -0.17 0.44 -0.13 1.18 0.00 0.00 175.17 176.45 1mfn s ARG 49 N 1.56 3.95 0.14 8.23 3.00 -1.26 0.14 118.95 134.72 1mfn s ARG 49 Ca 0.04 0.45 0.09 0.00 0.00 0.00 0.00 55.73 56.31 1mfn s ARG 49 Cb -0.17 -3.20 -0.04 0.00 0.00 0.00 0.00 34.95 31.54 1mfn s ARG 49 CO 0.04 0.67 -0.15 0.14 0.00 0.00 0.00 175.30 176.00 1mfn s VAL 50 N -1.12 2.98 0.94 3.52 -7.23 0.70 -4.81 120.40 115.39 1mfn s VAL 50 Ca 0.26 -1.56 -0.15 0.00 -1.81 0.00 0.00 61.98 58.72 1mfn s VAL 50 Cb -0.17 -2.41 0.17 0.00 0.56 0.00 0.00 36.38 34.53 1mfn s VAL 50 CO 0.15 0.02 1.22 -2.16 -0.31 0.00 0.00 175.10 174.02 1mfn s PRO 51 N -2.40 0.85 0.26 4.82 0.04 -1.26 0.17 135.00 137.49 1mfn s PRO 51 Ca 0.21 -0.09 0.26 0.00 0.04 0.00 0.00 61.00 61.41 1mfn s PRO 51 Cb -0.10 -1.84 0.83 0.00 0.04 0.00 0.00 34.50 33.43 1mfn s PRO 51 CO 0.12 -2.32 1.75 -1.00 0.04 0.00 0.00 177.00 175.59 1mfn h PRO 52 N -1.58 0.00 -0.58 0.56 0.13 -1.89 -3.00 132.00 125.64 1mfn h PRO 52 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1mfn h PRO 52 Cb 1.29 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.42 1mfn h PRO 52 CO 0.50 0.00 0.00 0.43 -0.23 0.00 0.00 178.00 178.70 1mfn n SER 53 N -2.39 2.76 -3.88 1.44 7.64 -1.26 -4.78 113.62 113.14 1mfn n SER 53 Ca 0.04 -2.23 -0.22 0.00 1.01 0.00 0.00 58.87 57.47 1mfn n SER 53 Cb 0.39 -0.42 -0.17 0.00 -1.01 0.00 0.00 64.21 63.00 1mfn n SER 53 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 1mfn s ARG 54 N -1.69 0.95 0.00 1.43 1.81 -1.13 -4.99 118.95 115.32 1mfn s ARG 54 Ca 0.27 -0.11 0.11 0.00 -1.72 0.00 0.00 55.73 54.29 1mfn s ARG 54 Cb 0.18 -1.01 -0.01 0.00 -0.45 0.00 0.00 34.95 33.65 1mfn s ARG 54 CO 0.13 -0.14 0.67 0.27 -0.68 0.00 0.00 175.30 175.55 1mfn n ASN 55 N 4.38 1.27 -4.13 0.23 6.94 -1.26 -4.76 115.26 117.92 1mfn n ASN 55 Ca -0.19 -1.13 -0.20 0.00 -0.02 0.00 0.00 54.58 53.04 1mfn n ASN 55 Cb 0.51 0.50 -0.13 0.00 -2.36 0.00 0.00 39.78 38.29 1mfn n ASN 55 CO 0.00 0.00 0.00 -0.94 -1.03 0.00 0.00 177.26 175.29 1mfn s SER 56 N -1.51 1.58 -0.13 0.53 1.04 -1.26 -0.70 113.70 113.25 1mfn s SER 56 Ca 0.09 -0.44 -0.00 0.00 0.48 0.00 0.00 55.95 56.08 1mfn s SER 56 Cb 0.09 -0.10 0.03 0.00 0.10 0.00 0.00 66.02 66.14 1mfn s SER 56 CO 0.30 0.03 -0.07 -0.51 0.98 0.00 0.00 173.24 173.96 1mfn s ILE 57 N -0.82 1.08 -0.57 -1.02 2.07 -0.93 -4.90 121.20 116.11 1mfn s ILE 57 Ca 0.01 -0.39 -0.21 0.00 -1.41 0.00 0.00 60.65 58.66 1mfn s ILE 57 Cb -0.08 -1.13 0.07 0.00 0.13 0.00 0.00 42.46 41.46 1mfn s ILE 57 CO 0.01 0.32 0.77 -0.89 -1.91 0.00 0.00 174.94 173.24 1mfn s THR 58 N 1.68 4.66 0.24 4.00 2.01 -1.26 -1.78 115.64 125.20 1mfn s THR 58 Ca 0.04 -0.46 -0.20 0.00 0.31 0.00 0.00 61.69 61.38 1mfn s THR 58 Cb -0.13 -4.47 -0.08 0.00 0.01 0.00 0.00 72.50 67.83 1mfn s THR 58 CO -0.08 -1.07 0.76 -0.76 -0.69 0.00 0.00 174.62 172.77 1mfn s LEU 59 N 3.17 4.32 0.00 4.42 1.43 0.23 -4.87 118.68 127.39 1mfn s LEU 59 Ca 0.18 1.47 0.03 0.00 -1.03 0.00 0.00 54.13 54.78 1mfn s LEU 59 Cb -0.19 -3.67 -0.01 0.00 0.03 0.00 0.00 46.19 42.34 1mfn s LEU 59 CO 0.11 0.00 0.12 0.35 0.23 0.00 0.00 176.35 177.17 1mfn n THR 60 N 0.64 0.00 -1.51 5.49 -2.24 -1.26 -0.75 114.28 114.65 1mfn n THR 60 Ca -0.01 -1.19 -0.17 0.00 -2.27 0.00 0.00 64.05 60.40 1mfn n THR 60 Cb 0.51 0.55 -0.07 0.00 -2.10 0.00 0.00 70.33 69.22 1mfn n THR 60 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1mfn n ASN 61 N -2.22 -4.54 -4.94 3.42 3.02 -0.98 -4.86 115.26 104.16 1mfn n ASN 61 Ca 0.02 0.42 -0.25 0.00 -0.03 0.00 0.00 54.58 54.74 1mfn n ASN 61 Cb 0.30 -4.09 -0.02 0.00 -0.61 0.00 0.00 39.78 35.35 1mfn n ASN 61 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1mfn s LEU 62 N -4.29 4.18 0.24 3.41 1.43 0.11 -4.96 118.68 118.79 1mfn s LEU 62 Ca 0.00 0.37 -0.31 0.00 -1.03 0.00 0.00 54.13 53.17 1mfn s LEU 62 Cb 0.00 -3.17 -0.11 0.00 0.03 0.00 0.00 46.19 42.94 1mfn s LEU 62 CO 0.00 -0.12 1.62 0.21 0.23 0.00 0.00 176.35 178.29 1mfn s ASN 63 N -3.52 6.43 -0.09 2.29 2.47 -1.26 -4.14 114.94 117.11 1mfn s ASN 63 Ca 0.38 2.85 -0.30 0.00 0.42 0.00 0.00 52.86 56.21 1mfn s ASN 63 Cb -0.10 -2.62 -0.02 0.00 -1.45 0.00 0.00 41.25 37.06 1mfn s ASN 63 CO 0.31 -0.90 1.12 -2.16 -3.72 0.00 0.00 177.10 171.75 1mfn s PRO 64 N 0.29 4.37 -0.11 0.43 0.04 -1.24 -3.95 135.00 134.83 1mfn s PRO 64 Ca 0.68 1.54 -0.01 0.00 0.04 0.00 0.00 61.00 63.25 1mfn s PRO 64 Cb -0.47 -3.57 -0.01 0.00 0.04 0.00 0.00 34.50 30.49 1mfn s PRO 64 CO 0.40 -0.42 0.10 0.41 0.04 0.00 0.00 177.00 177.52 1mfn n GLY 65 N 3.27 0.58 3.33 0.56 0.00 0.78 -4.81 105.19 108.90 1mfn n GLY 65 Ca 0.10 -0.18 -0.10 0.00 0.00 0.00 0.00 46.02 45.85 1mfn n GLY 65 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1mfn s THR 66 N -3.04 0.05 -0.13 2.61 2.01 -0.83 -4.82 115.64 111.48 1mfn s THR 66 Ca 0.05 -1.58 0.01 0.00 0.31 0.00 0.00 61.69 60.47 1mfn s THR 66 Cb -0.01 -2.06 0.02 0.00 0.01 0.00 0.00 72.50 70.47 1mfn s THR 66 CO 0.08 -0.21 -0.14 -1.83 -0.69 0.00 0.00 174.62 171.83 1mfn s GLU 67 N -4.02 2.20 0.12 4.92 1.03 -1.26 0.18 118.70 121.86 1mfn s GLU 67 Ca 0.23 -0.53 0.01 0.00 0.03 0.00 0.00 54.97 54.71 1mfn s GLU 67 Cb 0.04 -1.99 -0.00 0.00 -0.80 0.00 0.00 34.13 31.37 1mfn s GLU 67 CO 0.04 -0.19 0.02 0.66 -1.33 0.00 0.00 175.26 174.46 1mfn n TYR 68 N 4.63 0.19 -4.02 4.83 4.02 -0.73 -1.90 117.16 124.18 1mfn n TYR 68 Ca -0.17 -0.69 -0.31 0.00 -0.01 0.00 0.00 57.90 56.72 1mfn n TYR 68 Cb 0.50 -0.05 -0.15 0.00 -0.02 0.00 0.00 39.34 39.62 1mfn n TYR 68 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 176.86 175.93 1mfn s VAL 69 N -1.70 1.91 -0.20 -0.72 1.01 0.51 -2.10 120.40 119.11 1mfn s VAL 69 Ca 0.03 -1.43 -0.14 0.00 0.00 0.00 0.00 61.98 60.44 1mfn s VAL 69 Cb 0.00 -2.06 -0.04 0.00 0.00 0.00 0.00 36.38 34.28 1mfn s VAL 69 CO 0.02 -0.02 0.29 -0.69 0.00 0.00 0.00 175.10 174.70 1mfn s VAL 70 N 1.23 5.28 -0.13 2.92 1.01 0.62 -1.68 120.40 129.66 1mfn s VAL 70 Ca -0.07 0.50 -0.03 0.00 0.00 0.00 0.00 61.98 62.38 1mfn s VAL 70 Cb -0.19 -3.63 -0.03 0.00 0.00 0.00 0.00 36.38 32.53 1mfn s VAL 70 CO -0.06 0.33 -0.02 -0.94 0.00 0.00 0.00 175.10 174.41 1mfn s SER 71 N 0.81 5.00 -0.35 3.32 1.04 0.14 -0.45 113.70 123.20 1mfn s SER 71 Ca 0.15 -0.01 -0.01 0.00 0.48 0.00 0.00 55.95 56.56 1mfn s SER 71 Cb -0.14 -1.64 0.08 0.00 0.10 0.00 0.00 66.02 64.43 1mfn s SER 71 CO 0.05 0.25 0.08 -0.63 0.98 0.00 0.00 173.24 173.97 1mfn s ILE 72 N -0.13 2.90 -0.34 -1.02 -1.09 -1.25 -0.99 121.20 119.28 1mfn s ILE 72 Ca 0.03 -1.85 -0.06 0.00 -2.23 0.00 0.00 60.65 56.54 1mfn s ILE 72 Cb -0.13 -2.88 0.04 0.00 -1.58 0.00 0.00 42.46 37.91 1mfn s ILE 72 CO 0.02 -0.42 0.11 -0.63 -1.23 0.00 0.00 174.94 172.79 1mfn s ILE 73 N 1.13 3.75 0.29 2.92 -1.09 -0.86 -2.84 121.20 124.49 1mfn s ILE 73 Ca 0.03 -1.18 -0.29 0.00 -2.23 0.00 0.00 60.65 56.98 1mfn s ILE 73 Cb -0.21 -3.14 -0.09 0.00 -1.58 0.00 0.00 42.46 37.44 1mfn s ILE 73 CO -0.04 -0.20 1.05 0.00 -1.23 0.00 0.00 174.94 174.52 1mfn s ALA 74 N 1.39 3.35 0.37 9.38 0.00 -1.26 -0.13 121.76 134.86 1mfn s ALA 74 Ca -0.01 0.80 0.04 0.00 0.00 0.00 0.00 51.96 52.79 1mfn s ALA 74 Cb -0.20 -3.29 -0.03 0.00 0.00 0.00 0.00 23.12 19.60 1mfn s ALA 74 CO 0.02 -0.07 0.13 0.14 0.00 0.00 0.00 175.76 175.99 1mfn s VAL 75 N -1.24 0.59 -0.35 0.00 -7.23 -0.47 -1.66 120.40 110.04 1mfn s VAL 75 Ca 0.45 -2.00 0.13 0.00 -1.81 0.00 0.00 61.98 58.76 1mfn s VAL 75 Cb -0.29 -2.44 0.42 0.00 0.56 0.00 0.00 36.38 34.63 1mfn s VAL 75 CO 0.37 0.00 1.40 -3.20 -0.31 0.00 0.00 175.10 173.36 1mfn n ASN 76 N -1.17 -1.07 0.00 4.85 5.15 -1.25 0.12 115.26 121.89 1mfn n ASN 76 Ca -0.03 -2.30 0.00 0.00 -0.60 0.00 0.00 54.58 51.64 1mfn n ASN 76 Cb 0.65 0.58 0.00 0.00 -0.53 0.00 0.00 39.78 40.48 1mfn n ASN 76 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1mfn n GLY 77 N -1.06 2.13 0.00 8.20 0.00 -1.26 -3.83 105.19 109.37 1mfn n GLY 77 Ca -0.09 -0.34 0.00 0.00 0.00 0.00 0.00 46.02 45.59 1mfn n GLY 77 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1mfn n ARG 78 N 0.00 0.21 -2.02 1.61 -4.01 -1.26 -5.05 116.66 106.14 1mfn n ARG 78 Ca 0.00 -0.65 -0.10 0.00 -1.04 0.00 0.00 57.85 56.06 1mfn n ARG 78 Cb 0.00 -0.87 0.03 0.00 -3.04 0.00 0.00 32.46 28.58 1mfn n ARG 78 CO 0.00 0.00 0.00 0.39 -3.04 0.00 0.00 177.63 174.98 1mfn n GLU 79 N -0.12 0.81 -3.75 2.89 1.02 -1.25 -5.14 120.64 115.10 1mfn n GLU 79 Ca 0.00 -1.59 -0.13 0.00 -0.02 0.00 0.00 57.16 55.42 1mfn n GLU 79 Cb 0.15 -0.11 -0.10 0.00 -0.02 0.00 0.00 31.44 31.36 1mfn n GLU 79 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 1mfn s GLU 80 N -3.33 0.52 0.50 3.49 2.02 -1.26 -3.84 118.70 116.80 1mfn s GLU 80 Ca 0.30 0.23 0.04 0.00 0.02 0.00 0.00 54.97 55.57 1mfn s GLU 80 Cb -0.02 0.24 0.04 0.00 0.10 0.00 0.00 34.13 34.49 1mfn s GLU 80 CO 0.19 -0.10 0.35 0.43 0.02 0.00 0.00 175.26 176.15 1mfn n SER 81 N 2.25 2.63 -4.72 -0.19 7.64 -0.66 -4.56 113.62 116.00 1mfn n SER 81 Ca -0.16 -2.73 -0.42 0.00 1.01 0.00 0.00 58.87 56.57 1mfn n SER 81 Cb 0.57 -0.02 -0.03 0.00 -1.01 0.00 0.00 64.21 63.72 1mfn n SER 81 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 1mfn s PRO 82 N -4.02 4.54 0.50 1.43 0.04 -1.26 -4.66 135.00 131.56 1mfn s PRO 82 Ca 0.27 1.57 -0.18 0.00 0.04 0.00 0.00 61.00 62.69 1mfn s PRO 82 Cb -0.02 -3.40 -0.08 0.00 0.04 0.00 0.00 34.50 31.04 1mfn s PRO 82 CO 0.17 -0.07 1.00 -1.25 0.04 0.00 0.00 177.00 176.88 1mfn s PRO 83 N 0.77 3.91 -0.37 0.56 0.04 -1.26 -4.51 135.00 134.14 1mfn s PRO 83 Ca 0.53 1.11 0.13 0.00 0.04 0.00 0.00 61.00 62.81 1mfn s PRO 83 Cb -0.25 -2.13 0.40 0.00 0.04 0.00 0.00 34.50 32.56 1mfn s PRO 83 CO 0.29 -0.31 0.99 1.28 0.04 0.00 0.00 177.00 179.29 1mfn n LEU 84 N -1.27 0.10 -4.55 -3.56 4.32 -1.13 -5.02 117.00 105.90 1mfn n LEU 84 Ca 0.07 -4.02 -0.31 0.00 -0.02 0.00 0.00 56.01 51.73 1mfn n LEU 84 Cb 0.54 0.50 0.18 0.00 -1.62 0.00 0.00 43.42 43.01 1mfn n LEU 84 CO 0.43 1.90 0.40 -0.38 -1.22 0.00 0.00 177.39 178.51 1mfn n ILE 85 N -0.01 0.00 -3.50 -0.08 5.41 -1.26 -4.34 119.36 115.58 1mfn n ILE 85 Ca 0.11 -0.16 -0.09 0.00 1.00 0.00 0.00 62.75 63.61 1mfn n ILE 85 Cb 0.77 -0.89 -0.02 0.00 -0.71 0.00 0.00 39.64 38.78 1mfn n ILE 85 CO 0.00 0.00 0.00 -0.83 0.00 0.00 0.00 176.55 175.72 1mfn s GLY 86 N -2.40 -0.49 -0.18 7.39 0.00 0.40 -4.94 107.32 107.11 1mfn s GLY 86 Ca 0.64 0.78 -0.14 0.00 0.00 0.00 0.00 44.72 46.00 1mfn s GLY 86 CO 0.62 0.26 0.32 1.20 0.00 0.00 0.00 173.10 175.50 1mfn s GLN 87 N -3.32 4.21 -0.09 2.90 1.11 -1.26 -0.28 119.66 122.93 1mfn s GLN 87 Ca 0.04 0.11 0.02 0.00 0.01 0.00 0.00 55.36 55.55 1mfn s GLN 87 Cb -0.01 -3.48 0.01 0.00 -1.01 0.00 0.00 33.01 28.52 1mfn s GLN 87 CO -0.09 0.12 -0.16 -1.14 0.01 0.00 0.00 175.29 174.03 1mfn s GLN 88 N 0.83 2.22 -0.16 2.91 -0.44 -0.89 -4.94 119.66 119.20 1mfn s GLN 88 Ca 0.17 -0.58 -0.05 0.00 -2.50 0.00 0.00 55.36 52.40 1mfn s GLN 88 Cb -0.14 -1.80 -0.03 0.00 -1.64 0.00 0.00 33.01 29.40 1mfn s GLN 88 CO 0.06 0.03 -0.01 0.00 0.50 0.00 0.00 175.29 175.87 1mfn s ALA 89 N 0.71 3.13 0.19 1.58 0.00 -1.26 -1.77 121.76 124.34 1mfn s ALA 89 Ca -0.13 -0.80 -0.30 0.00 0.00 0.00 0.00 51.96 50.74 1mfn s ALA 89 Cb -0.16 -1.66 -0.08 0.00 0.00 0.00 0.00 23.12 21.23 1mfn s ALA 89 CO 0.03 0.22 1.13 0.95 0.00 0.00 0.00 175.76 178.10 1mfn s THR 90 N 0.31 3.73 0.82 0.00 -4.23 0.46 -4.84 115.64 111.89 1mfn s THR 90 Ca -0.01 1.50 -0.16 0.00 -1.18 0.00 0.00 61.69 61.83 1mfn s THR 90 Cb -0.14 -3.96 -0.10 0.00 1.34 0.00 0.00 72.50 69.65 1mfn s THR 90 CO 0.02 0.26 -0.17 0.52 -0.54 0.00 0.00 174.62 174.71 1mfn n VAL 91 N 2.31 0.41 -1.36 2.29 0.31 -1.01 -1.97 118.33 119.31 1mfn n VAL 91 Ca 0.03 -0.43 -0.19 0.00 -0.01 0.00 0.00 64.34 63.74 1mfn n VAL 91 Cb 0.45 -0.26 0.17 0.00 -0.91 0.00 0.00 33.84 33.29 1mfn n VAL 91 CO 0.00 0.00 0.00 -1.20 -1.32 0.00 0.00 176.83 174.31 1mfn n SER 92 N 1.69 3.84 -0.96 4.52 7.64 -1.26 0.27 113.62 129.36 1mfn n SER 92 Ca 0.04 -3.71 -0.09 0.00 1.01 0.00 0.00 58.87 56.12 1mfn n SER 92 Cb 0.52 -0.76 -0.04 0.00 -1.01 0.00 0.00 64.21 62.92 1mfn n SER 92 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 1mfn n ASP 93 N -1.09 -3.64 -4.66 6.43 8.00 -1.26 -4.67 116.55 115.65 1mfn n ASP 93 Ca 0.50 0.23 -0.33 0.00 0.71 0.00 0.00 54.79 55.90 1mfn n ASP 93 Cb 1.29 -3.03 -0.09 0.00 -0.02 0.00 0.00 41.12 39.27 1mfn n ASP 93 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1mfn s ILE 94 N -1.67 4.05 -1.23 0.53 1.01 -1.26 -4.83 121.20 117.79 1mfn s ILE 94 Ca 0.00 -0.59 -0.19 0.00 0.00 0.00 0.00 60.65 59.87 1mfn s ILE 94 Cb 0.00 -2.78 0.05 0.00 0.01 0.00 0.00 42.46 39.75 1mfn s ILE 94 CO 0.00 0.42 1.71 -2.16 0.00 0.00 0.00 174.94 174.91 1mfn s PRO 95 N -1.41 3.77 1.30 2.79 0.04 -1.26 -4.38 135.00 135.86 1mfn s PRO 95 Ca 0.18 -1.75 -0.22 0.00 0.04 0.00 0.00 61.00 59.25 1mfn s PRO 95 Cb -0.11 -5.48 0.33 0.00 0.04 0.00 0.00 34.50 29.28 1mfn s PRO 95 CO 0.08 -2.42 0.92 2.89 0.04 0.00 0.00 177.00 178.52 1mfn n ARG 96 N 8.48 -4.02 -1.20 4.56 1.85 -1.24 -4.11 116.66 120.98 1mfn n ARG 96 Ca 0.46 -1.51 -0.03 0.00 -1.00 0.00 0.00 57.85 55.76 1mfn n ARG 96 Cb 0.47 -1.70 -0.01 0.00 -1.05 0.00 0.00 32.46 30.17 1mfn n ARG 96 CO 0.00 0.00 0.00 -3.47 -0.01 0.00 0.00 177.63 174.15 1mfn n ASP 97 N -5.30 -3.18 -4.56 2.89 2.03 -1.26 0.24 116.55 107.40 1mfn n ASP 97 Ca 0.14 0.07 -0.40 0.00 0.52 0.00 0.00 54.79 55.12 1mfn n ASP 97 Cb 0.57 -1.15 -0.03 0.00 -0.72 0.00 0.00 41.12 39.79 1mfn n ASP 97 CO 0.00 0.00 0.00 -0.22 -1.92 0.00 0.00 177.20 175.06 1mfn s LEU 98 N -0.72 3.35 0.00 -2.67 2.96 -1.26 -3.68 118.68 116.66 1mfn s LEU 98 Ca 0.00 0.55 -0.01 0.00 -0.22 0.00 0.00 54.13 54.45 1mfn s LEU 98 Cb 0.00 -2.79 0.00 0.00 0.50 0.00 0.00 46.19 43.91 1mfn s LEU 98 CO 0.00 -2.18 0.21 -1.84 -1.32 0.00 0.00 176.35 171.22 1mfn n GLU 99 N 8.97 0.30 -4.25 1.98 0.28 -1.02 -4.88 120.64 122.02 1mfn n GLU 99 Ca 0.20 -1.17 -0.21 0.00 -0.16 0.00 0.00 57.16 55.83 1mfn n GLU 99 Cb 0.51 1.14 -0.12 0.00 1.43 0.00 0.00 31.44 34.39 1mfn n GLU 99 CO 0.00 0.00 0.00 0.08 -0.16 0.00 0.00 177.13 177.05 1mfn s VAL 100 N -2.59 1.47 -0.03 3.84 1.01 -1.26 -1.12 120.40 121.71 1mfn s VAL 100 Ca 0.12 -1.53 0.01 0.00 0.00 0.00 0.00 61.98 60.58 1mfn s VAL 100 Cb -0.00 -1.42 -0.01 0.00 0.00 0.00 0.00 36.38 34.94 1mfn s VAL 100 CO 0.09 -0.19 0.03 2.30 0.00 0.00 0.00 175.10 177.33 1mfn n ILE 101 N 0.99 0.00 -3.92 2.22 -5.35 -0.93 -4.97 119.36 107.40 1mfn n ILE 101 Ca -0.19 -0.29 -0.10 0.00 -0.27 0.00 0.00 62.75 61.90 1mfn n ILE 101 Cb 0.55 0.78 -0.11 0.00 -1.74 0.00 0.00 39.64 39.12 1mfn n ILE 101 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1mfn s ALA 102 N -1.50 -0.11 -0.24 -1.28 0.00 -1.26 -5.01 121.76 112.37 1mfn s ALA 102 Ca 0.00 -0.33 -0.03 0.00 0.00 0.00 0.00 51.96 51.61 1mfn s ALA 102 Cb 0.01 0.11 0.08 0.00 0.00 0.00 0.00 23.12 23.32 1mfn s ALA 102 CO 0.04 -0.17 0.07 0.45 0.00 0.00 0.00 175.76 176.14 1mfn s SER 103 N -1.33 3.26 0.36 0.00 0.15 -1.26 -1.73 113.70 113.16 1mfn s SER 103 Ca -0.14 -1.09 -0.03 0.00 0.70 0.00 0.00 55.95 55.39 1mfn s SER 103 Cb -0.08 -0.62 -0.04 0.00 -1.71 0.00 0.00 66.02 63.57 1mfn s SER 103 CO 0.00 -0.35 0.62 0.42 1.20 0.00 0.00 173.24 175.12 1mfn s THR 104 N 1.84 5.02 -1.75 6.45 -4.23 0.55 -4.95 115.64 118.58 1mfn s THR 104 Ca 0.03 -0.11 0.16 0.00 -1.18 0.00 0.00 61.69 60.60 1mfn s THR 104 Cb -0.17 -3.82 0.38 0.00 1.34 0.00 0.00 72.50 70.23 1mfn s THR 104 CO -0.16 -0.56 1.41 -0.81 -0.54 0.00 0.00 174.62 173.96 1mfn n PRO 105 N -1.62 0.39 -0.45 3.99 -0.04 -1.26 -2.73 135.00 133.27 1mfn n PRO 105 Ca -0.02 0.06 0.00 0.00 -0.04 0.00 0.00 63.50 63.50 1mfn n PRO 105 Cb 0.55 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.51 1mfn n PRO 105 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1mfn n THR 106 N -1.13 0.00 -3.70 0.52 -2.24 -1.26 -4.13 114.28 102.34 1mfn n THR 106 Ca 0.10 0.00 -0.03 0.00 -2.27 0.00 0.00 64.05 61.85 1mfn n THR 106 Cb 0.09 0.26 -0.01 0.00 -2.10 0.00 0.00 70.33 68.57 1mfn n THR 106 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1mfn s SER 107 N -0.44 -0.18 0.03 3.42 1.04 -1.11 -2.72 113.70 113.75 1mfn s SER 107 Ca 0.00 -0.31 -0.02 0.00 0.48 0.00 0.00 55.95 56.09 1mfn s SER 107 Cb 0.00 0.43 -0.02 0.00 0.10 0.00 0.00 66.02 66.52 1mfn s SER 107 CO 0.00 -0.78 0.02 -0.76 0.98 0.00 0.00 173.24 172.70 1mfn s LEU 108 N -2.88 2.15 -0.41 2.42 1.43 -0.91 -0.33 118.68 120.15 1mfn s LEU 108 Ca 0.12 -0.64 -0.10 0.00 -1.03 0.00 0.00 54.13 52.48 1mfn s LEU 108 Cb -0.00 0.30 0.06 0.00 0.03 0.00 0.00 46.19 46.58 1mfn s LEU 108 CO -0.00 -0.45 0.25 -0.22 0.23 0.00 0.00 176.35 176.17 1mfn s LEU 109 N -2.06 5.05 -0.10 1.79 0.20 -0.71 -0.97 118.68 121.88 1mfn s LEU 109 Ca -0.06 -1.32 -0.06 0.00 0.69 0.00 0.00 54.13 53.38 1mfn s LEU 109 Cb -0.02 -2.02 -0.04 0.00 -0.43 0.00 0.00 46.19 43.68 1mfn s LEU 109 CO -0.04 -0.50 0.13 0.27 -0.29 0.00 0.00 176.35 175.92 1mfn s ILE 110 N 1.49 5.37 -0.10 6.68 -4.36 -0.61 -2.18 121.20 127.50 1mfn s ILE 110 Ca 0.03 0.11 -0.04 0.00 -0.26 0.00 0.00 60.65 60.49 1mfn s ILE 110 Cb -0.22 -3.35 0.05 0.00 1.25 0.00 0.00 42.46 40.19 1mfn s ILE 110 CO 0.04 0.58 0.19 -0.94 0.24 0.00 0.00 174.94 175.05 1mfn s SER 111 N -1.13 0.59 0.35 4.36 1.04 -0.28 -1.24 113.70 117.38 1mfn s SER 111 Ca 0.16 0.41 0.06 0.00 0.48 0.00 0.00 55.95 57.06 1mfn s SER 111 Cb -0.12 0.40 -0.07 0.00 0.10 0.00 0.00 66.02 66.33 1mfn s SER 111 CO 0.06 -0.24 0.02 -1.66 0.98 0.00 0.00 173.24 172.39 1mfn s TRP 112 N 2.28 2.16 0.42 5.02 -2.14 -0.75 -2.43 118.94 123.50 1mfn s TRP 112 Ca 0.02 -0.80 -0.02 0.00 2.66 0.00 0.00 56.10 57.96 1mfn s TRP 112 Cb -0.12 -1.42 -0.03 0.00 -3.10 0.00 0.00 33.47 28.79 1mfn s TRP 112 CO -0.07 0.22 0.67 -1.21 -2.66 0.00 0.00 176.95 173.91 1mfn s GLU 113 N -3.79 3.51 0.31 3.25 2.02 0.65 -4.55 118.70 120.09 1mfn s GLU 113 Ca 0.35 -0.06 -0.27 0.00 0.02 0.00 0.00 54.97 55.01 1mfn s GLU 113 Cb 0.08 -2.51 -0.09 0.00 0.10 0.00 0.00 34.13 31.70 1mfn s GLU 113 CO 0.16 -0.04 1.01 -1.25 0.02 0.00 0.00 175.26 175.16 1mfn s PRO 114 N -4.54 4.57 0.13 0.39 0.04 -1.26 -3.69 135.00 130.63 1mfn s PRO 114 Ca 0.44 1.54 -0.02 0.00 0.04 0.00 0.00 61.00 63.00 1mfn s PRO 114 Cb -0.10 -2.96 0.03 0.00 0.04 0.00 0.00 34.50 31.51 1mfn s PRO 114 CO 0.41 0.22 0.16 -0.35 0.04 0.00 0.00 177.00 177.48 1mfn n PRO 115 N 0.81 -0.41 -1.22 0.56 -0.04 -1.26 -4.78 135.00 128.66 1mfn n PRO 115 Ca 0.01 -0.25 -0.23 0.00 -0.04 0.00 0.00 63.50 62.99 1mfn n PRO 115 Cb 0.48 -0.18 0.15 0.00 -0.04 0.00 0.00 33.50 33.91 1mfn n PRO 115 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1mfn n ALA 116 N -3.13 5.52 -3.53 0.55 0.00 -1.26 -4.95 120.51 113.70 1mfn n ALA 116 Ca -0.03 -3.14 -0.10 0.00 0.00 0.00 0.00 53.44 50.17 1mfn n ALA 116 Cb 0.07 -1.34 -0.02 0.00 0.00 0.00 0.00 19.45 18.16 1mfn n ALA 116 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 1mfn s VAL 117 N -3.74 0.00 -0.07 0.00 -7.23 -1.26 -3.67 120.40 104.44 1mfn s VAL 117 Ca 0.56 -0.38 -0.30 0.00 -1.81 0.00 0.00 61.98 60.05 1mfn s VAL 117 Cb 0.47 -1.36 -0.05 0.00 0.56 0.00 0.00 36.38 36.01 1mfn s VAL 117 CO 0.05 -0.02 1.49 -0.44 -0.31 0.00 0.00 175.10 175.88 1mfn s SER 118 N -2.81 6.78 -0.12 4.85 0.01 -1.26 -4.99 113.70 116.16 1mfn s SER 118 Ca 0.05 2.07 -0.07 0.00 1.31 0.00 0.00 55.95 59.31 1mfn s SER 118 Cb -0.02 -2.54 -0.04 0.00 0.21 0.00 0.00 66.02 63.62 1mfn s SER 118 CO -0.06 -0.83 0.15 -0.69 0.41 0.00 0.00 173.24 172.21 1mfn s VAL 119 N 3.46 5.49 -0.14 3.43 1.01 -1.26 -4.80 120.40 127.59 1mfn s VAL 119 Ca 0.66 0.23 -0.26 0.00 0.00 0.00 0.00 61.98 62.61 1mfn s VAL 119 Cb -0.30 -3.41 -0.25 0.00 0.00 0.00 0.00 36.38 32.41 1mfn s VAL 119 CO 0.25 0.61 0.66 -0.09 0.00 0.00 0.00 175.10 176.54 1mfn h ARG 120 N 5.02 0.05 -2.50 2.72 9.65 -1.16 -3.45 114.38 124.71 1mfn h ARG 120 Ca -0.54 -0.09 0.15 0.00 -1.10 0.00 0.00 59.98 58.39 1mfn h ARG 120 Cb 1.23 0.03 -0.07 0.00 -1.39 0.00 0.00 29.97 29.77 1mfn h ARG 120 CO 0.59 1.04 0.44 1.52 2.80 0.00 0.00 179.97 186.36 1mfn s TYR 121 N -2.29 -0.11 -0.11 2.20 1.13 -0.94 -3.78 117.35 113.46 1mfn s TYR 121 Ca -0.20 -0.26 0.00 0.00 -1.41 0.00 0.00 57.07 55.20 1mfn s TYR 121 Cb -0.00 0.67 0.02 0.00 -1.10 0.00 0.00 41.96 41.55 1mfn s TYR 121 CO 0.69 -0.95 -0.09 0.71 -2.51 0.00 0.00 175.55 173.40 1mfn s TYR 122 N -3.24 1.56 -0.53 -3.49 1.51 -1.01 -1.59 117.35 110.57 1mfn s TYR 122 Ca 0.13 -0.76 -0.22 0.00 -1.01 0.00 0.00 57.07 55.22 1mfn s TYR 122 Cb -0.02 -1.24 0.05 0.00 -0.11 0.00 0.00 41.96 40.63 1mfn s TYR 122 CO 0.04 -0.48 0.79 0.50 -1.11 0.00 0.00 175.55 175.29 1mfn s ARG 123 N 1.45 3.24 0.65 -0.62 3.52 0.49 0.95 118.95 128.63 1mfn s ARG 123 Ca 0.01 -0.54 -0.07 0.00 -0.13 0.00 0.00 55.73 54.99 1mfn s ARG 123 Cb -0.13 -4.07 0.03 0.00 -1.56 0.00 0.00 34.95 29.21 1mfn s ARG 123 CO -0.06 -1.36 0.98 0.42 -0.81 0.00 0.00 175.30 174.47 1mfn s ILE 124 N 3.33 3.16 -0.03 4.11 1.01 -0.30 0.14 121.20 132.62 1mfn s ILE 124 Ca 0.23 0.00 -0.02 0.00 0.00 0.00 0.00 60.65 60.87 1mfn s ILE 124 Cb -0.16 -3.31 0.01 0.00 0.01 0.00 0.00 42.46 39.02 1mfn s ILE 124 CO 0.16 -0.34 0.07 0.42 0.00 0.00 0.00 174.94 175.25 1mfn s THR 125 N -3.15 -0.02 -0.09 2.92 -4.23 0.53 -1.49 115.64 110.12 1mfn s THR 125 Ca 0.57 0.06 -0.18 0.00 -1.18 0.00 0.00 61.69 60.96 1mfn s THR 125 Cb -0.11 -0.12 -0.05 0.00 1.34 0.00 0.00 72.50 73.57 1mfn s THR 125 CO 0.46 0.02 0.47 -0.31 -0.54 0.00 0.00 174.62 174.72 1mfn s TYR 126 N 0.34 3.57 -0.36 3.99 1.51 0.97 -2.15 117.35 125.22 1mfn s TYR 126 Ca -0.03 0.92 -0.11 0.00 -1.01 0.00 0.00 57.07 56.85 1mfn s TYR 126 Cb -0.04 -2.50 0.01 0.00 -0.11 0.00 0.00 41.96 39.33 1mfn s TYR 126 CO -0.01 0.28 0.21 0.20 -1.11 0.00 0.00 175.55 175.11 1mfn s GLY 127 N 0.21 1.92 -0.11 0.71 0.00 0.41 -2.39 107.32 108.07 1mfn s GLY 127 Ca 0.25 -1.59 -0.03 0.00 0.00 0.00 0.00 44.72 43.36 1mfn s GLY 127 CO 0.11 0.80 -0.00 -0.54 0.00 0.00 0.00 173.10 173.47 1mfn s GLU 128 N 1.60 3.25 0.30 2.90 2.02 -1.26 0.23 118.70 127.75 1mfn s GLU 128 Ca 0.04 -0.43 -0.14 0.00 0.02 0.00 0.00 54.97 54.45 1mfn s GLU 128 Cb -0.18 -2.87 -0.09 0.00 0.10 0.00 0.00 34.13 31.09 1mfn s GLU 128 CO 0.07 0.55 0.70 0.95 0.02 0.00 0.00 175.26 177.55 1mfn s THR 129 N -0.45 4.71 0.00 3.63 -4.23 -1.08 -4.46 115.64 113.76 1mfn s THR 129 Ca 0.08 0.90 0.00 0.00 -1.18 0.00 0.00 61.69 61.49 1mfn s THR 129 Cb -0.12 -3.63 0.00 0.00 1.34 0.00 0.00 72.50 70.09 1mfn s THR 129 CO 0.02 -0.13 0.00 0.61 -0.54 0.00 0.00 174.62 174.58 1mfn n GLY 130 N -0.23 -1.32 0.00 3.99 0.00 -1.26 -4.92 105.19 101.45 1mfn n GLY 130 Ca 0.02 0.45 0.00 0.00 0.00 0.00 0.00 46.02 46.49 1mfn n GLY 130 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1mfn n GLY 131 N 0.00 -0.58 0.00 -0.02 0.00 -1.26 -4.89 105.19 98.44 1mfn n GLY 131 Ca 0.00 0.29 0.07 0.00 0.00 0.00 0.00 46.02 46.38 1mfn n GLY 131 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1mfn n ASN 132 N -0.28 0.00 -3.37 1.61 5.15 -1.26 -4.90 115.26 112.21 1mfn n ASN 132 Ca 0.00 0.25 -0.31 0.00 -0.60 0.00 0.00 54.58 53.92 1mfn n ASN 132 Cb 0.00 -0.37 0.03 0.00 -0.53 0.00 0.00 39.78 38.91 1mfn n ASN 132 CO 0.00 0.00 0.00 -0.24 1.40 0.00 0.00 177.26 178.42 1mfn n SER 133 N -1.37 -6.06 -4.02 1.20 2.88 -1.26 -4.74 113.62 100.25 1mfn n SER 133 Ca 0.05 -0.05 -0.42 0.00 -1.33 0.00 0.00 58.87 57.13 1mfn n SER 133 Cb 0.12 -2.56 -0.01 0.00 -0.75 0.00 0.00 64.21 61.01 1mfn n SER 133 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 1mfn n PRO 134 N -0.38 2.69 -1.25 -1.46 -0.04 -1.26 -4.85 135.00 128.45 1mfn n PRO 134 Ca -0.05 -2.69 -0.35 0.00 -0.04 0.00 0.00 63.50 60.37 1mfn n PRO 134 Cb 0.63 -3.33 0.11 0.00 -0.04 0.00 0.00 33.50 30.87 1mfn n PRO 134 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 1mfn n VAL 135 N 5.79 2.57 -3.99 0.52 0.24 -1.26 -4.76 118.33 117.44 1mfn n VAL 135 Ca 0.50 -0.29 -0.30 0.00 -2.04 0.00 0.00 64.34 62.21 1mfn n VAL 135 Cb 0.42 -1.19 -0.16 0.00 -1.47 0.00 0.00 33.84 31.44 1mfn n VAL 135 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1mfn s GLN 136 N -3.77 2.09 0.16 7.34 -2.07 -1.01 -4.81 119.66 117.59 1mfn s GLN 136 Ca 0.74 -0.65 -0.02 0.00 -1.82 0.00 0.00 55.36 53.61 1mfn s GLN 136 Cb -0.32 -2.19 -0.05 0.00 -1.09 0.00 0.00 33.01 29.37 1mfn s GLN 136 CO 0.50 -0.33 0.36 -1.21 -1.32 0.00 0.00 175.29 173.29 1mfn s GLU 137 N 1.48 3.55 -0.05 9.60 2.02 -1.26 -0.02 118.70 134.01 1mfn s GLU 137 Ca 0.02 -0.26 -0.05 0.00 0.02 0.00 0.00 54.97 54.70 1mfn s GLU 137 Cb -0.14 -2.87 0.01 0.00 0.10 0.00 0.00 34.13 31.23 1mfn s GLU 137 CO -0.09 0.45 0.14 -0.59 0.02 0.00 0.00 175.26 175.19 1mfn s PHE 138 N -1.74 -0.15 0.37 1.61 -0.12 -0.55 -4.95 117.98 112.45 1mfn s PHE 138 Ca 0.39 0.38 -0.25 0.00 -0.05 0.00 0.00 56.93 57.39 1mfn s PHE 138 Cb -0.12 0.05 -0.09 0.00 -0.63 0.00 0.00 43.02 42.23 1mfn s PHE 138 CO 0.27 -0.07 1.08 0.95 -0.05 0.00 0.00 175.22 177.40 1mfn s THR 139 N 0.09 3.57 0.02 -4.49 -4.23 -1.26 -1.15 115.64 108.18 1mfn s THR 139 Ca -0.00 1.30 0.03 0.00 -1.18 0.00 0.00 61.69 61.83 1mfn s THR 139 Cb -0.01 -3.72 -0.04 0.00 1.34 0.00 0.00 72.50 70.08 1mfn s THR 139 CO 0.00 0.10 -0.02 -0.69 -0.54 0.00 0.00 174.62 173.48 1mfn s VAL 140 N -1.51 4.01 0.39 2.29 1.01 0.27 -4.89 120.40 121.96 1mfn s VAL 140 Ca 0.55 -0.73 -0.24 0.00 0.00 0.00 0.00 61.98 61.56 1mfn s VAL 140 Cb -0.26 -2.80 -0.09 0.00 0.00 0.00 0.00 36.38 33.22 1mfn s VAL 140 CO 0.32 0.32 1.01 -2.16 0.00 0.00 0.00 175.10 174.59 1mfn s PRO 141 N -1.69 4.27 -0.07 2.72 0.04 -1.26 -2.42 135.00 136.58 1mfn s PRO 141 Ca 0.20 1.40 0.04 0.00 0.04 0.00 0.00 61.00 62.69 1mfn s PRO 141 Cb -0.11 -2.54 0.25 0.00 0.04 0.00 0.00 34.50 32.14 1mfn s PRO 141 CO 0.11 -0.03 0.90 0.41 0.04 0.00 0.00 177.00 178.43 1mfn n GLY 142 N 0.23 1.89 1.05 0.56 0.00 -1.25 -3.62 105.19 104.05 1mfn n GLY 142 Ca 0.05 -0.29 0.09 0.00 0.00 0.00 0.00 46.02 45.87 1mfn n GLY 142 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1mfn n SER 143 N 0.19 3.57 -3.71 1.61 7.64 -1.26 -4.93 113.62 116.74 1mfn n SER 143 Ca 0.09 -2.06 -0.12 0.00 1.01 0.00 0.00 58.87 57.79 1mfn n SER 143 Cb 0.53 -0.39 -0.10 0.00 -1.01 0.00 0.00 64.21 63.25 1mfn n SER 143 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 1mfn s LYS 144 N -1.11 0.48 0.00 1.43 -0.14 -1.24 -5.01 119.74 114.15 1mfn s LYS 144 Ca 0.38 0.71 0.26 0.00 -1.36 0.00 0.00 55.97 55.96 1mfn s LYS 144 Cb 0.20 0.15 1.35 0.00 -1.68 0.00 0.00 37.83 37.85 1mfn s LYS 144 CO 0.24 -0.10 1.89 -1.13 -0.76 0.00 0.00 175.35 175.50 1mfn n SER 145 N 3.42 0.56 -4.00 2.83 3.41 -1.26 -4.79 113.62 113.79 1mfn n SER 145 Ca -0.17 -1.32 -0.13 0.00 -0.26 0.00 0.00 58.87 56.99 1mfn n SER 145 Cb 0.56 -0.02 -0.12 0.00 -0.26 0.00 0.00 64.21 64.38 1mfn n SER 145 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1mfn s THR 146 N -1.97 0.35 0.07 6.66 -4.23 -1.26 -1.81 115.64 113.44 1mfn s THR 146 Ca 0.38 -0.72 0.00 0.00 -1.18 0.00 0.00 61.69 60.18 1mfn s THR 146 Cb 0.19 -0.40 -0.00 0.00 1.34 0.00 0.00 72.50 73.63 1mfn s THR 146 CO 0.31 -0.25 0.01 0.00 -0.54 0.00 0.00 174.62 174.15 1mfn n ALA 147 N 2.03 0.08 -2.22 3.99 0.00 -0.37 -4.95 120.51 119.06 1mfn n ALA 147 Ca -0.19 -0.32 -0.13 0.00 0.00 0.00 0.00 53.44 52.80 1mfn n ALA 147 Cb 0.56 0.20 -0.10 0.00 0.00 0.00 0.00 19.45 20.11 1mfn n ALA 147 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1mfn s THR 148 N -1.55 0.30 0.00 0.00 2.01 -1.26 -1.57 115.64 113.57 1mfn s THR 148 Ca 0.02 -1.97 0.06 0.00 0.31 0.00 0.00 61.69 60.10 1mfn s THR 148 Cb 0.00 -2.33 -0.02 0.00 0.01 0.00 0.00 72.50 70.17 1mfn s THR 148 CO 0.01 -0.23 -0.18 -0.63 -0.69 0.00 0.00 174.62 172.91 1mfn s ILE 149 N -3.93 1.42 0.34 1.82 1.01 -0.14 -4.90 121.20 116.82 1mfn s ILE 149 Ca 0.31 -0.86 0.04 0.00 0.00 0.00 0.00 60.65 60.14 1mfn s ILE 149 Cb 0.07 -1.20 -0.03 0.00 0.01 0.00 0.00 42.46 41.31 1mfn s ILE 149 CO 0.08 0.33 0.17 0.20 0.00 0.00 0.00 174.94 175.71 1mfn s ASN 150 N -0.62 1.95 -1.44 3.58 0.01 -1.26 -2.14 114.94 115.03 1mfn s ASN 150 Ca 0.06 -1.62 -0.10 0.00 -0.71 0.00 0.00 52.86 50.50 1mfn s ASN 150 Cb -0.07 0.43 0.01 0.00 0.41 0.00 0.00 41.25 42.03 1mfn s ASN 150 CO -0.00 -0.92 0.24 -0.46 -1.51 0.00 0.00 177.10 174.45 1mfn n ASN 151 N -1.13 -0.65 -4.95 -1.22 0.23 -1.10 -4.87 115.26 101.57 1mfn n ASN 151 Ca -0.00 -1.26 -0.20 0.00 -0.53 0.00 0.00 54.58 52.59 1mfn n ASN 151 Cb 0.65 -1.77 -0.02 0.00 -2.08 0.00 0.00 39.78 36.56 1mfn n ASN 151 CO 0.00 0.00 0.00 -0.51 -0.93 0.00 0.00 177.26 175.82 1mfn s ILE 152 N -4.10 4.17 -0.44 1.53 2.07 -1.14 -5.04 121.20 118.25 1mfn s ILE 152 Ca 0.14 -1.10 -0.15 0.00 -1.41 0.00 0.00 60.65 58.13 1mfn s ILE 152 Cb -0.08 -3.43 0.04 0.00 0.13 0.00 0.00 42.46 39.12 1mfn s ILE 152 CO 0.98 -0.20 0.34 -0.54 -1.91 0.00 0.00 174.94 173.62 1mfn s LYS 153 N -4.09 2.98 0.91 3.50 -0.14 -1.26 -4.74 119.74 116.90 1mfn s LYS 153 Ca 0.42 -1.15 -0.14 0.00 -1.36 0.00 0.00 55.97 53.73 1mfn s LYS 153 Cb -0.09 -4.04 0.16 0.00 -1.68 0.00 0.00 37.83 32.18 1mfn s LYS 153 CO 0.29 -0.87 1.25 -1.25 -0.76 0.00 0.00 175.35 174.02 1mfn s PRO 154 N 1.68 1.08 -0.84 -1.68 0.04 -1.26 -4.53 135.00 129.49 1mfn s PRO 154 Ca 0.05 -0.17 -0.03 0.00 0.04 0.00 0.00 61.00 60.89 1mfn s PRO 154 Cb -0.21 -1.87 -0.03 0.00 0.04 0.00 0.00 34.50 32.42 1mfn s PRO 154 CO 0.09 -2.16 0.72 0.41 0.04 0.00 0.00 177.00 176.10 1mfn n GLY 155 N -3.42 -0.46 0.00 0.56 0.00 -1.26 -5.01 105.19 95.59 1mfn n GLY 155 Ca 0.12 0.21 0.00 0.00 0.00 0.00 0.00 46.02 46.35 1mfn n GLY 155 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1mfn n ALA 156 N -3.02 0.00 -0.74 4.61 0.00 -1.26 -5.03 120.51 115.07 1mfn n ALA 156 Ca -0.12 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 53.00 1mfn n ALA 156 Cb 0.61 0.00 0.14 0.00 0.00 0.00 0.00 19.45 20.20 1mfn n ALA 156 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1mfn n ASP 157 N 0.00 -1.42 -3.60 0.00 -0.08 -1.26 -2.34 116.55 107.85 1mfn n ASP 157 Ca 0.00 0.30 -0.17 0.00 -1.51 0.00 0.00 54.79 53.41 1mfn n ASP 157 Cb 0.00 -1.27 -0.09 0.00 2.34 0.00 0.00 41.12 42.11 1mfn n ASP 157 CO 0.00 0.00 0.00 -0.31 0.12 0.00 0.00 177.20 177.01 1mfn s TYR 158 N -2.45 1.56 -0.21 -0.67 1.51 0.56 -2.64 117.35 115.00 1mfn s TYR 158 Ca 0.60 -1.57 -0.04 0.00 -1.01 0.00 0.00 57.07 55.06 1mfn s TYR 158 Cb -0.21 -0.65 0.10 0.00 -0.11 0.00 0.00 41.96 41.09 1mfn s TYR 158 CO 0.65 -0.81 0.25 0.99 -1.11 0.00 0.00 175.55 175.51 1mfn s THR 159 N -3.64 -0.37 0.12 -0.71 2.01 0.14 -2.36 115.64 110.82 1mfn s THR 159 Ca 0.40 -0.13 -0.16 0.00 0.31 0.00 0.00 61.69 62.11 1mfn s THR 159 Cb 0.04 -0.71 -0.07 0.00 0.01 0.00 0.00 72.50 71.76 1mfn s THR 159 CO 0.23 -0.20 0.56 -0.63 -0.69 0.00 0.00 174.62 173.88 1mfn s ILE 160 N 2.36 4.81 0.12 1.82 -1.09 -0.59 0.16 121.20 128.80 1mfn s ILE 160 Ca 0.08 0.97 -0.15 0.00 -2.23 0.00 0.00 60.65 59.32 1mfn s ILE 160 Cb -0.16 -3.79 0.03 0.00 -1.58 0.00 0.00 42.46 36.97 1mfn s ILE 160 CO -0.13 0.35 0.38 -0.89 -1.23 0.00 0.00 174.94 173.42 1mfn s THR 161 N -1.34 0.08 -0.10 2.92 2.01 -0.91 0.11 115.64 118.39 1mfn s THR 161 Ca 0.35 -0.62 -0.30 0.00 0.31 0.00 0.00 61.69 61.43 1mfn s THR 161 Cb -0.17 -1.18 0.08 0.00 0.01 0.00 0.00 72.50 71.25 1mfn s THR 161 CO 0.19 -0.34 0.74 -1.48 -0.69 0.00 0.00 174.62 173.04 1mfn s LEU 162 N -2.81 -0.62 0.33 4.42 0.05 -0.60 0.20 118.68 119.65 1mfn s LEU 162 Ca 0.03 0.77 0.09 0.00 0.05 0.00 0.00 54.13 55.07 1mfn s LEU 162 Cb 0.02 2.42 -0.05 0.00 -2.05 0.00 0.00 46.19 46.53 1mfn s LEU 162 CO -0.12 -0.51 0.09 -0.31 -0.55 0.00 0.00 176.35 174.94 1mfn s TYR 163 N -0.94 2.66 -0.27 3.48 1.51 0.38 -2.22 117.35 121.94 1mfn s TYR 163 Ca -0.08 -0.38 -0.02 0.00 -1.01 0.00 0.00 57.07 55.58 1mfn s TYR 163 Cb -0.01 -1.55 0.09 0.00 -0.11 0.00 0.00 41.96 40.38 1mfn s TYR 163 CO 0.07 0.41 0.09 0.00 -1.11 0.00 0.00 175.55 175.01 1mfn s ALA 164 N -2.44 1.20 0.22 3.71 0.00 -1.16 -0.38 121.76 122.91 1mfn s ALA 164 Ca 0.36 -1.28 0.01 0.00 0.00 0.00 0.00 51.96 51.05 1mfn s ALA 164 Cb -0.02 -1.45 -0.04 0.00 0.00 0.00 0.00 23.12 21.61 1mfn s ALA 164 CO 0.21 -1.52 0.39 0.08 0.00 0.00 0.00 175.76 174.92 1mfn s VAL 165 N 1.78 5.22 0.17 0.00 1.01 -0.62 -3.36 120.40 124.60 1mfn s VAL 165 Ca 0.07 -0.51 0.00 0.00 0.00 0.00 0.00 61.98 61.53 1mfn s VAL 165 Cb -0.17 -3.77 0.00 0.00 0.00 0.00 0.00 36.38 32.44 1mfn s VAL 165 CO -0.23 -0.24 0.00 0.35 0.00 0.00 0.00 175.10 174.99 1mfn n THR 166 N -0.90 0.17 -2.29 3.92 -2.24 -1.19 -0.76 114.28 110.98 1mfn n THR 166 Ca -0.06 0.06 -0.41 0.00 -2.27 0.00 0.00 64.05 61.37 1mfn n THR 166 Cb 0.55 -0.72 -0.03 0.00 -2.10 0.00 0.00 70.33 68.03 1mfn n THR 166 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1mfn s GLY 167 N -4.86 2.60 -0.39 3.38 0.00 -1.23 -4.41 107.32 102.41 1mfn s GLY 167 Ca 0.00 1.04 0.10 0.00 0.00 0.00 0.00 44.72 45.86 1mfn s GLY 167 CO 0.00 1.95 0.77 0.54 0.00 0.00 0.00 173.10 176.36 1mfn n ARG 168 N 2.42 0.94 0.00 2.90 1.74 -1.26 -3.76 116.66 119.64 1mfn n ARG 168 Ca 0.05 -3.08 0.00 0.00 -0.77 0.00 0.00 57.85 54.05 1mfn n ARG 168 Cb 0.44 -1.53 0.00 0.00 -1.02 0.00 0.00 32.46 30.35 1mfn n ARG 168 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1mfn n GLY 169 N 0.49 -0.00 0.01 -0.13 0.00 -1.26 -4.96 105.19 99.33 1mfn n GLY 169 Ca 0.21 -0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.22 1mfn n GLY 169 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1mfn n ASP 170 N -1.10 0.12 -2.71 1.61 2.03 -1.26 -4.95 116.55 110.29 1mfn n ASP 170 Ca 0.00 -1.07 -0.04 0.00 0.52 0.00 0.00 54.79 54.19 1mfn n ASP 170 Cb 0.00 -0.00 0.04 0.00 -0.72 0.00 0.00 41.12 40.43 1mfn n ASP 170 CO 0.00 0.00 0.00 -1.20 -1.92 0.00 0.00 177.20 174.08 1mfn n SER 171 N -0.03 -2.28 -4.57 1.67 7.64 -1.26 -5.08 113.62 109.71 1mfn n SER 171 Ca 0.00 -2.09 -0.39 0.00 1.01 0.00 0.00 58.87 57.40 1mfn n SER 171 Cb 0.49 1.22 -0.02 0.00 -1.01 0.00 0.00 64.21 64.89 1mfn n SER 171 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 1mfn s PRO 172 N 0.74 3.57 0.35 1.43 0.04 -1.25 -3.49 135.00 136.40 1mfn s PRO 172 Ca 0.27 -1.46 0.08 0.00 0.04 0.00 0.00 61.00 59.93 1mfn s PRO 172 Cb 0.12 -5.41 -0.03 0.00 0.04 0.00 0.00 34.50 29.22 1mfn s PRO 172 CO -0.11 -2.51 0.25 0.00 0.04 0.00 0.00 177.00 174.67 1mfn s ALA 173 N 5.69 3.74 0.00 8.56 0.00 -1.26 -5.00 121.76 133.50 1mfn s ALA 173 Ca 0.54 -1.77 0.16 0.00 0.00 0.00 0.00 51.96 50.89 1mfn s ALA 173 Cb 0.01 -0.96 0.27 0.00 0.00 0.00 0.00 23.12 22.44 1mfn s ALA 173 CO 0.01 -0.03 1.09 -1.13 0.00 0.00 0.00 175.76 175.71 1mfn n SER 174 N -1.32 0.33 -0.06 0.00 3.41 -1.26 -3.18 113.62 111.55 1mfn n SER 174 Ca -0.01 -1.98 0.00 0.00 -0.26 0.00 0.00 58.87 56.62 1mfn n SER 174 Cb 0.61 -0.11 0.00 0.00 -0.26 0.00 0.00 64.21 64.45 1mfn n SER 174 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1mfn n SER 175 N 0.31 -0.48 -4.81 4.04 3.41 -1.21 -2.98 113.62 111.89 1mfn n SER 175 Ca -0.05 0.00 -0.38 0.00 -0.26 0.00 0.00 58.87 58.18 1mfn n SER 175 Cb 0.98 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 64.87 1mfn n SER 175 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 1mfn s LYS 176 N 0.00 4.20 0.03 4.33 2.20 -1.26 -4.81 119.74 124.43 1mfn s LYS 176 Ca 0.00 0.74 -0.30 0.00 -0.36 0.00 0.00 55.97 56.04 1mfn s LYS 176 Cb 0.00 -3.20 -0.04 0.00 -1.51 0.00 0.00 37.83 33.08 1mfn s LYS 176 CO 0.00 0.62 1.07 -1.25 -0.36 0.00 0.00 175.35 175.43 1mfn s PRO 177 N -1.21 4.51 -0.16 4.03 0.04 -1.26 -4.75 135.00 136.20 1mfn s PRO 177 Ca 0.30 1.57 -0.08 0.00 0.04 0.00 0.00 61.00 62.84 1mfn s PRO 177 Cb -0.19 -3.41 -0.04 0.00 0.04 0.00 0.00 34.50 30.90 1mfn s PRO 177 CO 0.19 -0.13 0.11 0.08 0.04 0.00 0.00 177.00 177.29 1mfn s VAL 178 N 0.98 5.20 0.16 -0.36 1.01 -0.94 -4.90 120.40 121.55 1mfn s VAL 178 Ca 0.55 0.11 0.08 0.00 0.00 0.00 0.00 61.98 62.71 1mfn s VAL 178 Cb -0.25 -3.31 -0.04 0.00 0.00 0.00 0.00 36.38 32.78 1mfn s VAL 178 CO 0.29 0.52 -0.16 -0.94 0.00 0.00 0.00 175.10 174.80 1mfn s SER 179 N -0.23 2.45 0.33 3.32 1.04 -1.26 -1.56 113.70 117.79 1mfn s SER 179 Ca 0.10 -0.87 0.05 0.00 0.48 0.00 0.00 55.95 55.71 1mfn s SER 179 Cb -0.12 -0.13 -0.02 0.00 0.10 0.00 0.00 66.02 65.85 1mfn s SER 179 CO 0.01 -0.09 0.31 0.27 0.98 0.00 0.00 173.24 174.72 1mfn s ILE 180 N -2.20 0.00 0.10 -1.02 -4.36 0.29 -4.95 121.20 109.07 1mfn s ILE 180 Ca 0.14 -1.92 0.03 0.00 -0.26 0.00 0.00 60.65 58.64 1mfn s ILE 180 Cb -0.05 -2.53 -0.04 0.00 1.25 0.00 0.00 42.46 41.09 1mfn s ILE 180 CO 0.05 0.00 0.15 0.20 0.24 0.00 0.00 174.94 175.58 1mfn s ASN 181 N -3.34 5.84 -0.23 4.36 0.02 -1.26 -1.53 114.94 118.80 1mfn s ASN 181 Ca 0.39 0.06 -0.09 0.00 -1.02 0.00 0.00 52.86 52.20 1mfn s ASN 181 Cb 0.02 -1.65 0.10 0.00 0.02 0.00 0.00 41.25 39.73 1mfn s ASN 181 CO 0.26 0.13 0.52 -0.47 0.02 0.00 0.00 177.10 177.56 1mfn s TYR 182 N -1.54 -0.96 -0.21 2.20 5.04 -1.00 -4.74 117.35 116.14 1mfn s TYR 182 Ca 0.32 1.80 -0.11 0.00 -2.44 0.00 0.00 57.07 56.63 1mfn s TYR 182 Cb -0.12 0.48 -0.05 0.00 0.35 0.00 0.00 41.96 42.63 1mfn s TYR 182 CO 0.25 -0.52 0.17 -1.59 -1.34 0.00 0.00 175.55 172.52 1mfn s LYS 183 N 2.41 4.15 0.00 4.97 0.00 -1.26 0.21 119.74 130.22 1mfn s LYS 183 Ca -0.05 -0.18 0.23 0.00 0.00 0.00 0.00 55.97 55.97 1mfn s LYS 183 Cb -0.11 -3.47 0.18 0.00 0.00 0.00 0.00 37.83 34.44 1mfn s LYS 183 CO -0.15 0.19 1.23 0.25 0.00 0.00 0.00 175.35 176.87