#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1mfn s LEU 2 N 0.00 0.33 0.85 0.99 1.43 -1.26 -4.96 118.68 116.06 1mfn s LEU 2 Ca 0.00 0.66 -0.12 0.00 -1.03 0.00 0.00 54.13 53.64 1mfn s LEU 2 Cb 0.00 1.58 0.10 0.00 0.03 0.00 0.00 46.19 47.90 1mfn s LEU 2 CO 0.00 -0.29 1.11 -1.81 0.23 0.00 0.00 176.35 175.60 1mfn s ASP 3 N -0.36 4.08 -0.22 2.29 1.01 -1.26 -4.53 116.67 117.68 1mfn s ASP 3 Ca -0.05 1.15 -0.15 0.00 0.71 0.00 0.00 52.55 54.21 1mfn s ASP 3 Cb -0.03 -1.82 -0.04 0.00 1.01 0.00 0.00 42.92 42.04 1mfn s ASP 3 CO 0.03 -2.21 0.39 -0.55 0.21 0.00 0.00 175.17 173.03 1mfn s SER 4 N -3.97 6.39 -1.18 0.27 0.15 -1.26 -4.63 113.70 109.47 1mfn s SER 4 Ca 0.62 0.45 -0.20 0.00 0.70 0.00 0.00 55.95 57.52 1mfn s SER 4 Cb -0.14 -2.22 0.05 0.00 -1.71 0.00 0.00 66.02 61.99 1mfn s SER 4 CO 0.54 -0.10 1.67 -2.16 1.20 0.00 0.00 173.24 174.39 1mfn s PRO 5 N 1.47 3.68 0.00 5.44 0.04 -1.26 -4.58 135.00 139.79 1mfn s PRO 5 Ca 0.18 -1.57 0.00 0.00 0.04 0.00 0.00 61.00 59.65 1mfn s PRO 5 Cb -0.15 -5.44 0.00 0.00 0.04 0.00 0.00 34.50 28.95 1mfn s PRO 5 CO 0.08 -2.42 0.00 0.25 0.04 0.00 0.00 177.00 174.95 1mfn n THR 6 N 6.73 0.00 -1.97 1.26 -2.24 -1.24 -4.05 114.28 112.77 1mfn n THR 6 Ca 0.43 0.00 -0.06 0.00 -2.27 0.00 0.00 64.05 62.15 1mfn n THR 6 Cb 0.48 -0.10 -0.01 0.00 -2.10 0.00 0.00 70.33 68.59 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 3.97 -0.10 3.68 3.38 0.00 -1.26 0.90 105.19 115.75 1mfn n GLY 7 Ca 0.00 0.00 -0.48 0.00 0.00 0.00 0.00 46.02 45.54 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 -2.33 2.33 -3.37 1.61 -0.00 -1.26 -3.16 117.46 111.28 1mfn n PHE 8 Ca -0.06 0.01 -0.13 0.00 -0.00 0.00 0.00 57.45 57.26 1mfn n PHE 8 Cb 0.41 -2.66 -0.09 0.00 -0.00 0.00 0.00 39.48 37.15 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 3.78 0.96 -0.15 -2.13 -1.08 0.16 -4.90 116.67 113.30 1mfn s ASP 9 Ca 0.91 -0.37 -0.25 0.00 -0.52 0.00 0.00 52.55 52.32 1mfn s ASP 9 Cb -0.68 0.80 -0.02 0.00 -1.46 0.00 0.00 42.92 41.56 1mfn s ASP 9 CO 0.50 -0.35 0.82 -0.94 0.52 0.00 0.00 175.17 175.72 1mfn s SER 10 N 2.45 6.98 0.00 -0.34 1.04 -1.26 0.26 113.70 122.82 1mfn s SER 10 Ca 0.10 1.19 0.00 0.00 0.48 0.00 0.00 55.95 57.72 1mfn s SER 10 Cb -0.14 -2.45 0.00 0.00 0.10 0.00 0.00 66.02 63.53 1mfn s SER 10 CO -0.26 -0.35 0.00 -1.54 0.98 0.00 0.00 173.24 172.07 1mfn n SER 11 N 4.97 0.00 -3.98 7.02 3.41 -0.29 -4.91 113.62 119.85 1mfn n SER 11 Ca 0.04 -0.22 -0.32 0.00 -0.26 0.00 0.00 58.87 58.11 1mfn n SER 11 Cb 0.49 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.41 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 -0.32 -2.81 -4.81 4.04 9.92 -1.26 -1.86 116.55 119.44 1mfn n ASP 12 Ca 0.00 -0.81 -0.38 0.00 -0.53 0.00 0.00 54.79 53.07 1mfn n ASP 12 Cb 0.00 -2.35 -0.06 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 -3.08 4.67 0.16 0.53 1.01 -1.26 -0.87 121.20 122.36 1mfn s ILE 13 Ca 0.63 1.25 0.07 0.00 0.00 0.00 0.00 60.65 62.60 1mfn s ILE 13 Cb -0.35 -3.91 -0.04 0.00 0.01 0.00 0.00 42.46 38.17 1mfn s ILE 13 CO 0.78 0.46 -0.15 0.42 0.00 0.00 0.00 174.94 176.45 1mfn s THR 14 N -1.22 1.58 0.34 2.92 -4.23 1.17 -4.78 115.64 111.42 1mfn s THR 14 Ca 0.33 -1.95 0.02 0.00 -1.18 0.00 0.00 61.69 58.91 1mfn s THR 14 Cb -0.19 -1.80 0.27 0.00 1.34 0.00 0.00 72.50 72.12 1mfn s THR 14 CO 0.20 -0.47 1.98 0.00 -0.54 0.00 0.00 174.62 175.79 1mfn h ALA 15 N 3.09 1.57 -0.76 3.99 0.00 -1.72 -2.28 119.26 123.13 1mfn h ALA 15 Ca -0.40 -0.04 -0.53 0.00 0.00 0.00 0.00 54.91 53.95 1mfn h ALA 15 Cb 1.21 -0.25 -0.33 0.00 0.00 0.00 0.00 17.79 18.41 1mfn h ALA 15 CO 0.55 0.36 -0.15 0.09 0.00 0.00 0.00 179.25 180.11 1mfn n ASN 16 N -4.45 5.36 0.00 0.00 3.02 -1.26 -1.53 115.26 116.40 1mfn n ASN 16 Ca 0.09 -3.77 0.00 0.00 -0.03 0.00 0.00 54.58 50.87 1mfn n ASN 16 Cb 0.11 -0.60 0.00 0.00 -0.61 0.00 0.00 39.78 38.69 1mfn n ASN 16 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40 1mfn n SER 17 N -0.85 0.00 -3.54 6.41 2.88 -0.86 -2.77 113.62 114.88 1mfn n SER 17 Ca 0.48 0.00 -0.12 0.00 -1.33 0.00 0.00 58.87 57.90 1mfn n SER 17 Cb 0.89 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 64.30 1mfn n SER 17 CO 0.00 0.00 0.00 0.72 -1.23 0.00 0.00 175.04 174.53 1mfn s PHE 18 N -2.00 -0.45 0.15 0.66 -0.12 -0.82 0.37 117.98 115.77 1mfn s PHE 18 Ca 0.00 0.68 0.06 0.00 -0.05 0.00 0.00 56.93 57.62 1mfn s PHE 18 Cb 0.00 0.46 -0.04 0.00 -0.63 0.00 0.00 43.02 42.81 1mfn s PHE 18 CO 0.00 -0.47 0.03 0.99 -0.05 0.00 0.00 175.22 175.73 1mfn s THR 19 N -1.57 3.98 0.40 -4.49 2.01 -0.05 0.90 115.64 116.81 1mfn s THR 19 Ca -0.03 -1.24 0.07 0.00 0.31 0.00 0.00 61.69 60.81 1mfn s THR 19 Cb -0.00 -2.98 -0.07 0.00 0.01 0.00 0.00 72.50 69.45 1mfn s THR 19 CO 0.01 -0.06 0.04 -0.69 -0.69 0.00 0.00 174.62 173.24 1mfn s VAL 20 N -1.63 2.11 0.05 3.82 1.01 0.03 -1.14 120.40 124.66 1mfn s VAL 20 Ca 0.28 -1.94 -0.05 0.00 0.00 0.00 0.00 61.98 60.26 1mfn s VAL 20 Cb -0.10 -2.97 -0.02 0.00 0.00 0.00 0.00 36.38 33.30 1mfn s VAL 20 CO 0.20 -0.02 0.09 -1.00 0.00 0.00 0.00 175.10 174.36 1mfn s HIS 21 N -2.67 0.27 -0.16 5.22 3.76 0.14 -1.71 115.29 120.13 1mfn s HIS 21 Ca 0.36 -0.67 -0.29 0.00 -0.15 0.00 0.00 55.06 54.32 1mfn s HIS 21 Cb 0.08 -0.18 0.10 0.00 1.11 0.00 0.00 32.58 33.69 1mfn s HIS 21 CO 0.19 -0.42 0.87 1.67 -0.85 0.00 0.00 174.74 176.20 1mfn s TRP 22 N -3.29 -0.54 0.86 1.40 -2.14 -0.45 0.36 118.94 115.15 1mfn s TRP 22 Ca 0.01 1.07 -0.12 0.00 2.66 0.00 0.00 56.10 59.72 1mfn s TRP 22 Cb 0.03 0.39 0.11 0.00 -3.10 0.00 0.00 33.47 30.90 1mfn s TRP 22 CO -0.08 -0.41 1.12 0.08 -2.66 0.00 0.00 176.95 175.00 1mfn s VAL 23 N -0.66 2.50 0.33 -0.66 1.01 0.26 -4.81 120.40 118.37 1mfn s VAL 23 Ca -0.03 0.16 0.02 0.00 0.00 0.00 0.00 61.98 62.13 1mfn s VAL 23 Cb -0.02 -2.90 -0.03 0.00 0.00 0.00 0.00 36.38 33.44 1mfn s VAL 23 CO 0.03 -0.21 0.51 0.00 0.00 0.00 0.00 175.10 175.43 1mfn s ALA 24 N -3.21 3.79 0.64 5.51 0.00 -1.26 -3.72 121.76 123.51 1mfn s ALA 24 Ca 0.62 -1.03 -0.11 0.00 0.00 0.00 0.00 51.96 51.44 1mfn s ALA 24 Cb -0.15 -2.00 -0.03 0.00 0.00 0.00 0.00 23.12 20.95 1mfn s ALA 24 CO 0.54 0.00 1.04 -1.25 0.00 0.00 0.00 175.76 176.09 1mfn s PRO 25 N -4.26 3.44 -0.16 0.00 0.04 -1.26 -4.64 135.00 128.17 1mfn s PRO 25 Ca 0.40 0.77 -0.03 0.00 0.04 0.00 0.00 61.00 62.17 1mfn s PRO 25 Cb -0.09 -2.06 -0.06 0.00 0.04 0.00 0.00 34.50 32.33 1mfn s PRO 25 CO 0.34 -0.69 2.83 0.54 0.04 0.00 0.00 177.00 180.07 1mfn n ARG 26 N -2.83 1.85 -3.87 4.56 1.74 -1.26 -4.83 116.66 112.02 1mfn n ARG 26 Ca 0.06 -1.20 -0.08 0.00 -0.77 0.00 0.00 57.85 55.86 1mfn n ARG 26 Cb 0.54 -1.76 -0.01 0.00 -1.02 0.00 0.00 32.46 30.21 1mfn n ARG 26 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1mfn s ALA 27 N -0.30 -0.83 0.16 7.54 0.00 -1.26 -4.86 121.76 122.21 1mfn s ALA 27 Ca 0.45 -0.59 -0.30 0.00 0.00 0.00 0.00 51.96 51.52 1mfn s ALA 27 Cb 0.26 0.84 -0.07 0.00 0.00 0.00 0.00 23.12 24.14 1mfn s ALA 27 CO -0.05 -0.99 1.01 -1.25 0.00 0.00 0.00 175.76 174.48 1mfn s PRO 28 N -3.36 4.69 0.01 0.00 0.04 -1.26 -4.96 135.00 130.16 1mfn s PRO 28 Ca 0.15 1.56 0.00 0.00 0.04 0.00 0.00 61.00 62.75 1mfn s PRO 28 Cb -0.05 -3.32 -0.00 0.00 0.04 0.00 0.00 34.50 31.17 1mfn s PRO 28 CO 0.09 0.22 0.01 0.44 0.04 0.00 0.00 177.00 177.81 1mfn n ILE 29 N 2.37 0.00 -0.62 0.56 -5.35 -1.26 -4.85 119.36 110.21 1mfn n ILE 29 Ca 0.02 -0.09 0.00 0.00 -0.27 0.00 0.00 62.75 62.40 1mfn n ILE 29 Cb 0.48 0.05 0.00 0.00 -1.74 0.00 0.00 39.64 38.42 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 -0.02 0.09 -1.50 7.28 -2.24 -0.15 -4.89 114.28 112.84 1mfn n THR 30 Ca 0.00 -0.24 0.00 0.00 -2.27 0.00 0.00 64.05 61.55 1mfn n THR 30 Cb 0.02 1.42 0.00 0.00 -2.10 0.00 0.00 70.33 69.68 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 -0.05 0.15 3.07 3.38 0.00 -1.17 -3.67 105.19 106.90 1mfn n GLY 31 Ca 0.00 -1.65 -0.13 0.00 0.00 0.00 0.00 46.02 44.25 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 -2.46 -0.29 -0.19 1.61 1.51 -0.93 -2.48 117.35 114.12 1mfn s TYR 32 Ca 0.00 0.71 -0.23 0.00 -1.01 0.00 0.00 57.07 56.54 1mfn s TYR 32 Cb 0.00 0.05 -0.02 0.00 -0.11 0.00 0.00 41.96 41.88 1mfn s TYR 32 CO 0.00 -0.19 0.71 0.42 -1.11 0.00 0.00 175.55 175.38 1mfn s ILE 33 N 0.87 4.97 0.23 2.71 1.09 0.15 -1.20 121.20 130.02 1mfn s ILE 33 Ca -0.06 1.36 0.08 0.00 -1.10 0.00 0.00 60.65 60.93 1mfn s ILE 33 Cb -0.07 -4.02 -0.04 0.00 -1.06 0.00 0.00 42.46 37.27 1mfn s ILE 33 CO -0.05 0.08 0.08 -0.63 -0.10 0.00 0.00 174.94 174.31 1mfn s ILE 34 N 2.00 3.95 -0.09 2.92 -1.09 0.51 0.17 121.20 129.56 1mfn s ILE 34 Ca 0.32 -1.55 -0.22 0.00 -2.23 0.00 0.00 60.65 56.97 1mfn s ILE 34 Cb -0.16 -3.08 0.05 0.00 -1.58 0.00 0.00 42.46 37.69 1mfn s ILE 34 CO 0.11 -0.28 0.53 -0.60 -1.23 0.00 0.00 174.94 173.48 1mfn s ARG 35 N -3.50 0.81 0.10 2.79 3.52 -0.27 0.22 118.95 122.62 1mfn s ARG 35 Ca 0.31 0.30 0.06 0.00 -0.13 0.00 0.00 55.73 56.27 1mfn s ARG 35 Cb -0.08 0.38 -0.03 0.00 -1.56 0.00 0.00 34.95 33.66 1mfn s ARG 35 CO 0.22 -0.20 -0.16 -3.38 -0.81 0.00 0.00 175.30 170.97 1mfn s HIS 36 N -0.73 1.42 -0.30 5.12 -3.43 -1.05 0.45 115.29 116.77 1mfn s HIS 36 Ca -0.08 -0.49 -0.10 0.00 -0.80 0.00 0.00 55.06 53.59 1mfn s HIS 36 Cb -0.03 -0.77 0.18 0.00 -1.43 0.00 0.00 32.58 30.54 1mfn s HIS 36 CO 0.05 0.13 0.94 -3.38 -2.00 0.00 0.00 174.74 170.49 1mfn s HIS 37 N -1.62 -0.79 0.98 0.38 -0.00 0.45 -3.68 115.29 111.02 1mfn s HIS 37 Ca 0.04 0.79 -0.15 0.00 -0.00 0.00 0.00 55.06 55.74 1mfn s HIS 37 Cb -0.08 0.26 -0.06 0.00 -0.00 0.00 0.00 32.58 32.70 1mfn s HIS 37 CO 0.03 -0.43 -0.24 0.00 -0.00 0.00 0.00 174.74 174.09 1mfn n ALA 38 N 5.43 -4.15 0.54 -1.38 0.00 -1.25 -1.40 120.51 118.30 1mfn n ALA 38 Ca -0.04 -0.67 0.07 0.00 0.00 0.00 0.00 53.44 52.80 1mfn n ALA 38 Cb 0.53 -1.45 0.31 0.00 0.00 0.00 0.00 19.45 18.85 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 0.49 0.07 -0.50 0.00 1.02 -1.21 -1.74 120.64 118.78 1mfn n GLU 39 Ca 0.02 0.23 0.08 0.00 -0.02 0.00 0.00 57.16 57.47 1mfn n GLU 39 Cb 0.55 -1.50 0.28 0.00 -0.02 0.00 0.00 31.44 30.75 1mfn n GLU 39 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 1mfn n HIS 40 N -1.42 1.11 -3.15 -0.32 8.25 -1.26 -4.84 115.22 113.59 1mfn n HIS 40 Ca 0.05 -0.77 0.04 0.00 -0.26 0.00 0.00 57.72 56.77 1mfn n HIS 40 Cb 0.14 -0.30 -0.00 0.00 1.12 0.00 0.00 29.99 30.95 1mfn n HIS 40 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 1mfn s SER 41 N -1.52 -1.61 0.00 0.41 1.04 -0.71 -4.99 113.70 106.32 1mfn s SER 41 Ca 0.42 0.25 0.00 0.00 0.48 0.00 0.00 55.95 57.11 1mfn s SER 41 Cb 0.32 2.05 0.00 0.00 0.10 0.00 0.00 66.02 68.49 1mfn s SER 41 CO 0.12 -0.30 0.48 0.55 0.98 0.00 0.00 173.24 175.08 1mfn n VAL 42 N 5.42 0.23 -0.04 5.02 3.14 -1.26 -3.78 118.33 127.06 1mfn n VAL 42 Ca 0.04 -0.34 -0.10 0.00 -2.96 0.00 0.00 64.34 60.99 1mfn n VAL 42 Cb 0.54 1.16 -0.08 0.00 -1.06 0.00 0.00 33.84 34.39 1mfn n VAL 42 CO 0.00 0.00 0.00 1.23 -6.46 0.00 0.00 176.83 171.60 1mfn h GLY 43 N 0.00 -0.04 -5.58 7.55 0.00 -1.96 -3.39 103.07 99.64 1mfn h GLY 43 Ca 0.00 0.01 -0.58 0.00 0.00 0.00 0.00 47.33 46.76 1mfn h GLY 43 CO 0.00 -0.01 -0.69 0.54 0.00 0.00 0.00 176.54 176.38 1mfn n ARG 44 N -4.72 2.81 -2.17 4.80 3.00 -1.26 -5.08 116.66 114.05 1mfn n ARG 44 Ca -0.07 -4.65 -0.32 0.00 -0.01 0.00 0.00 57.85 52.80 1mfn n ARG 44 Cb 0.30 -2.17 -0.01 0.00 0.00 0.00 0.00 32.46 30.59 1mfn n ARG 44 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.63 176.38 1mfn s PRO 45 N -3.09 3.64 0.11 5.56 0.04 -1.26 -5.06 135.00 134.94 1mfn s PRO 45 Ca 0.46 1.01 -0.03 0.00 0.04 0.00 0.00 61.00 62.48 1mfn s PRO 45 Cb 0.25 -2.09 -0.05 0.00 0.04 0.00 0.00 34.50 32.66 1mfn s PRO 45 CO -0.10 -0.53 0.31 -0.98 0.04 0.00 0.00 177.00 175.73 1mfn s ARG 46 N -4.27 3.55 -0.24 4.56 1.70 -1.24 -5.00 118.95 118.00 1mfn s ARG 46 Ca 0.60 -0.22 -0.07 0.00 -0.47 0.00 0.00 55.73 55.57 1mfn s ARG 46 Cb -0.12 -2.93 -0.03 0.00 -0.57 0.00 0.00 34.95 31.30 1mfn s ARG 46 CO 0.37 0.53 0.05 -0.65 -1.08 0.00 0.00 175.30 174.52 1mfn s GLN 47 N -2.58 3.62 -0.29 3.89 -0.21 -1.26 -2.53 119.66 120.29 1mfn s GLN 47 Ca 0.38 -0.50 -0.10 0.00 0.02 0.00 0.00 55.36 55.17 1mfn s GLN 47 Cb -0.12 -3.27 -0.03 0.00 1.00 0.00 0.00 33.01 30.58 1mfn s GLN 47 CO 0.26 -0.18 0.16 -0.51 -2.12 0.00 0.00 175.29 172.90 1mfn s ASP 48 N 1.56 5.71 0.19 5.90 1.11 0.60 -4.89 116.67 126.85 1mfn s ASP 48 Ca 0.06 -0.27 0.01 0.00 0.18 0.00 0.00 52.55 52.53 1mfn s ASP 48 Cb -0.15 -2.05 -0.04 0.00 1.07 0.00 0.00 42.92 41.75 1mfn s ASP 48 CO 0.03 -0.12 0.36 -0.13 1.18 0.00 0.00 175.17 176.48 1mfn s ARG 49 N 1.68 3.48 0.09 8.23 3.00 -1.25 0.19 118.95 134.37 1mfn s ARG 49 Ca 0.06 -0.46 0.02 0.00 0.00 0.00 0.00 55.73 55.34 1mfn s ARG 49 Cb -0.16 -2.88 -0.04 0.00 0.00 0.00 0.00 34.95 31.86 1mfn s ARG 49 CO 0.08 0.44 -0.06 0.14 0.00 0.00 0.00 175.30 175.89 1mfn s VAL 50 N -1.85 0.65 0.96 3.52 -7.23 -0.34 -4.80 120.40 111.32 1mfn s VAL 50 Ca 0.37 -1.84 -0.15 0.00 -1.81 0.00 0.00 61.98 58.55 1mfn s VAL 50 Cb -0.11 -1.56 0.18 0.00 0.56 0.00 0.00 36.38 35.44 1mfn s VAL 50 CO 0.29 -0.83 1.20 -2.16 -0.31 0.00 0.00 175.10 173.29 1mfn s PRO 51 N -3.61 0.67 0.28 4.82 0.04 -1.26 -2.18 135.00 133.76 1mfn s PRO 51 Ca 0.09 -0.04 0.26 0.00 0.04 0.00 0.00 61.00 61.35 1mfn s PRO 51 Cb 0.04 -1.81 0.81 0.00 0.04 0.00 0.00 34.50 33.57 1mfn s PRO 51 CO -0.05 -2.45 1.75 -1.00 0.04 0.00 0.00 177.00 175.29 1mfn h PRO 52 N -1.67 0.00 -0.57 0.56 0.13 -1.88 -2.99 132.00 125.58 1mfn h PRO 52 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 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 -1.13 -0.23 0.00 0.00 178.00 177.14 1mfn n SER 53 N -2.45 3.44 -4.13 1.44 3.41 -1.26 -4.79 113.62 109.28 1mfn n SER 53 Ca 0.04 -1.98 -0.34 0.00 -0.26 0.00 0.00 58.87 56.33 1mfn n SER 53 Cb 0.40 -0.38 -0.14 0.00 -0.26 0.00 0.00 64.21 63.83 1mfn n SER 53 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 1mfn s ARG 54 N -1.24 2.17 0.00 4.33 1.81 -1.13 -4.93 118.95 119.96 1mfn s ARG 54 Ca 0.42 -1.49 0.29 0.00 -1.72 0.00 0.00 55.73 53.23 1mfn s ARG 54 Cb 0.23 -3.24 1.29 0.00 -0.45 0.00 0.00 34.95 32.77 1mfn s ARG 54 CO 0.30 -0.77 1.88 0.27 -0.68 0.00 0.00 175.30 176.31 1mfn n ASN 55 N 4.54 0.68 -3.96 0.23 6.94 -1.26 -4.72 115.26 117.70 1mfn n ASN 55 Ca -0.08 -0.92 -0.13 0.00 -0.02 0.00 0.00 54.58 53.43 1mfn n ASN 55 Cb 0.42 -0.02 -0.13 0.00 -2.36 0.00 0.00 39.78 37.69 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 -2.26 0.42 -0.13 0.53 1.04 -1.26 -1.34 113.70 110.72 1mfn s SER 56 Ca 0.35 -0.27 0.02 0.00 0.48 0.00 0.00 55.95 56.53 1mfn s SER 56 Cb 0.21 0.01 0.00 0.00 0.10 0.00 0.00 66.02 66.34 1mfn s SER 56 CO 0.42 -0.10 -0.20 -0.51 0.98 0.00 0.00 173.24 173.83 1mfn s ILE 57 N -0.69 2.30 -0.37 -1.02 2.07 -0.69 -4.86 121.20 117.94 1mfn s ILE 57 Ca -0.05 -0.92 -0.21 0.00 -1.41 0.00 0.00 60.65 58.06 1mfn s ILE 57 Cb -0.05 -1.92 0.01 0.00 0.13 0.00 0.00 42.46 40.63 1mfn s ILE 57 CO -0.00 0.54 0.67 -0.89 -1.91 0.00 0.00 174.94 173.35 1mfn s THR 58 N 0.56 4.85 0.30 4.00 2.01 -1.26 -0.79 115.64 125.31 1mfn s THR 58 Ca -0.12 0.58 -0.18 0.00 0.31 0.00 0.00 61.69 62.28 1mfn s THR 58 Cb -0.17 -4.12 -0.09 0.00 0.01 0.00 0.00 72.50 68.13 1mfn s THR 58 CO 0.04 -0.38 0.76 -0.76 -0.69 0.00 0.00 174.62 173.59 1mfn s LEU 59 N 2.81 4.16 0.14 4.42 1.02 0.26 -4.90 118.68 126.58 1mfn s LEU 59 Ca 0.25 1.40 0.08 0.00 0.02 0.00 0.00 54.13 55.88 1mfn s LEU 59 Cb -0.14 -3.95 -0.04 0.00 0.02 0.00 0.00 46.19 42.08 1mfn s LEU 59 CO 0.16 -0.13 -0.17 0.42 0.02 0.00 0.00 176.35 176.65 1mfn s THR 60 N -1.82 1.65 -0.40 5.49 -4.23 -1.26 -1.94 115.64 113.12 1mfn s THR 60 Ca 0.51 -1.79 -0.14 0.00 -1.18 0.00 0.00 61.69 59.09 1mfn s THR 60 Cb -0.13 -1.70 0.02 0.00 1.34 0.00 0.00 72.50 72.03 1mfn s THR 60 CO 0.19 -0.31 0.55 0.59 -0.54 0.00 0.00 174.62 175.10 1mfn n ASN 61 N 0.50 -7.41 -3.79 3.99 5.03 -1.12 -4.92 115.26 107.55 1mfn n ASN 61 Ca -0.15 0.47 -0.13 0.00 0.87 0.00 0.00 54.58 55.64 1mfn n ASN 61 Cb 0.56 -5.00 -0.14 0.00 -1.02 0.00 0.00 39.78 34.19 1mfn n ASN 61 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 1mfn s LEU 62 N -2.52 1.11 0.17 3.41 1.43 -1.22 -4.92 118.68 116.15 1mfn s LEU 62 Ca 0.22 0.27 -0.34 0.00 -1.03 0.00 0.00 54.13 53.25 1mfn s LEU 62 Cb -0.06 0.37 -0.14 0.00 0.03 0.00 0.00 46.19 46.39 1mfn s LEU 62 CO 0.70 -0.10 1.55 -3.20 0.23 0.00 0.00 176.35 175.53 1mfn n ASN 63 N 3.65 3.00 -4.70 2.29 2.85 -1.26 -4.00 115.26 117.09 1mfn n ASN 63 Ca -0.20 1.09 -0.42 0.00 -0.11 0.00 0.00 54.58 54.94 1mfn n ASN 63 Cb 0.55 -1.42 -0.03 0.00 1.24 0.00 0.00 39.78 40.12 1mfn n ASN 63 CO 0.00 0.00 0.00 -2.16 -2.11 0.00 0.00 177.26 172.99 1mfn s PRO 64 N 0.72 4.47 0.00 1.20 0.04 -0.58 -4.04 135.00 136.81 1mfn s PRO 64 Ca 0.78 1.53 0.00 0.00 0.04 0.00 0.00 61.00 63.34 1mfn s PRO 64 Cb -0.68 -3.47 0.00 0.00 0.04 0.00 0.00 34.50 30.39 1mfn s PRO 64 CO 0.40 -0.21 0.00 0.41 0.04 0.00 0.00 177.00 177.64 1mfn n GLY 65 N 3.07 0.86 3.50 0.56 0.00 0.84 -4.75 105.19 109.27 1mfn n GLY 65 Ca 0.08 -0.35 -0.15 0.00 0.00 0.00 0.00 46.02 45.60 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 -2.88 0.01 0.06 2.61 2.01 -0.99 -4.89 115.64 111.57 1mfn s THR 66 Ca 0.00 -0.04 -0.31 0.00 0.31 0.00 0.00 61.69 61.65 1mfn s THR 66 Cb 0.00 -0.88 -0.06 0.00 0.01 0.00 0.00 72.50 71.58 1mfn s THR 66 CO 0.00 -0.02 1.19 -1.61 -0.69 0.00 0.00 174.62 173.48 1mfn s GLU 67 N -0.20 4.44 -0.33 4.92 2.02 -1.26 0.25 118.70 128.54 1mfn s GLU 67 Ca -0.04 1.76 0.03 0.00 0.02 0.00 0.00 54.97 56.74 1mfn s GLU 67 Cb -0.03 -3.35 0.10 0.00 0.10 0.00 0.00 34.13 30.95 1mfn s GLU 67 CO 0.03 -0.24 0.04 0.71 0.02 0.00 0.00 175.26 175.83 1mfn s TYR 68 N 0.99 3.46 0.13 1.61 2.02 0.50 -3.30 117.35 122.76 1mfn s TYR 68 Ca 0.58 -2.77 -0.31 0.00 -0.37 0.00 0.00 57.07 54.20 1mfn s TYR 68 Cb -0.29 -2.67 -0.08 0.00 -0.40 0.00 0.00 41.96 38.52 1mfn s TYR 68 CO 0.29 -0.93 1.43 0.08 -1.57 0.00 0.00 175.55 174.85 1mfn s VAL 69 N 1.01 3.14 -0.03 0.71 1.01 -0.49 -2.38 120.40 123.37 1mfn s VAL 69 Ca 0.09 0.82 0.05 0.00 0.00 0.00 0.00 61.98 62.94 1mfn s VAL 69 Cb -0.19 -3.53 -0.01 0.00 0.00 0.00 0.00 36.38 32.66 1mfn s VAL 69 CO -0.10 0.06 -0.18 -0.69 0.00 0.00 0.00 175.10 174.20 1mfn s VAL 70 N 1.09 1.43 -0.19 2.92 1.01 0.65 0.17 120.40 127.48 1mfn s VAL 70 Ca 0.66 -0.74 -0.03 0.00 0.00 0.00 0.00 61.98 61.87 1mfn s VAL 70 Cb -0.38 -1.22 -0.01 0.00 0.00 0.00 0.00 36.38 34.77 1mfn s VAL 70 CO 0.31 0.41 -0.05 -0.94 0.00 0.00 0.00 175.10 174.82 1mfn s SER 71 N -0.13 4.38 -0.18 3.32 1.04 0.17 -0.22 113.70 122.08 1mfn s SER 71 Ca 0.00 -0.32 -0.09 0.00 0.48 0.00 0.00 55.95 56.02 1mfn s SER 71 Cb -0.10 -1.73 -0.05 0.00 0.10 0.00 0.00 66.02 64.24 1mfn s SER 71 CO 0.01 0.05 0.12 -0.63 0.98 0.00 0.00 173.24 173.77 1mfn s ILE 72 N 1.05 5.32 0.27 -1.02 -1.09 0.51 -1.11 121.20 125.12 1mfn s ILE 72 Ca 0.01 0.15 0.07 0.00 -2.23 0.00 0.00 60.65 58.65 1mfn s ILE 72 Cb -0.15 -3.40 -0.06 0.00 -1.58 0.00 0.00 42.46 37.28 1mfn s ILE 72 CO -0.00 0.48 -0.07 -0.63 -1.23 0.00 0.00 174.94 173.49 1mfn s ILE 73 N 0.10 1.62 0.01 2.92 1.09 0.45 0.98 121.20 128.37 1mfn s ILE 73 Ca 0.09 -2.13 0.05 0.00 -1.10 0.00 0.00 60.65 57.55 1mfn s ILE 73 Cb -0.11 -2.38 -0.02 0.00 -1.06 0.00 0.00 42.46 38.89 1mfn s ILE 73 CO -0.01 -0.34 -0.15 0.00 -0.10 0.00 0.00 174.94 174.34 1mfn s ALA 74 N -3.03 1.29 -0.02 9.38 0.00 -1.26 0.31 121.76 128.42 1mfn s ALA 74 Ca 0.28 -0.74 0.01 0.00 0.00 0.00 0.00 51.96 51.52 1mfn s ALA 74 Cb 0.03 -0.29 0.01 0.00 0.00 0.00 0.00 23.12 22.87 1mfn s ALA 74 CO 0.11 0.30 -0.04 0.14 0.00 0.00 0.00 175.76 176.26 1mfn s VAL 75 N -0.52 0.45 -0.61 0.00 -7.23 -1.04 -2.28 120.40 109.17 1mfn s VAL 75 Ca 0.05 -0.14 0.01 0.00 -1.81 0.00 0.00 61.98 60.09 1mfn s VAL 75 Cb -0.07 -0.44 0.41 0.00 0.56 0.00 0.00 36.38 36.84 1mfn s VAL 75 CO 0.00 0.17 1.63 -3.20 -0.31 0.00 0.00 175.10 173.40 1mfn n ASN 76 N 3.58 6.35 0.00 4.85 4.05 -1.24 -0.98 115.26 131.86 1mfn n ASN 76 Ca -0.21 -3.78 0.00 0.00 0.45 0.00 0.00 54.58 51.04 1mfn n ASN 76 Cb 0.54 -0.76 0.00 0.00 1.23 0.00 0.00 39.78 40.79 1mfn n ASN 76 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1mfn n GLY 77 N -0.62 2.25 0.25 8.20 0.00 -1.26 -3.64 105.19 110.37 1mfn n GLY 77 Ca 0.50 -0.21 0.04 0.00 0.00 0.00 0.00 46.02 46.35 1mfn n GLY 77 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1mfn n ARG 78 N 0.00 0.99 -0.59 1.61 0.00 -1.26 -5.01 116.66 112.40 1mfn n ARG 78 Ca 0.00 -0.77 0.00 0.00 -0.00 0.00 0.00 57.85 57.08 1mfn n ARG 78 Cb 0.00 -1.09 0.00 0.00 0.00 0.00 0.00 32.46 31.37 1mfn n ARG 78 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.63 178.02 1mfn n GLU 79 N 0.12 1.88 -1.45 -0.14 4.71 -1.24 -5.13 120.64 119.40 1mfn n GLU 79 Ca 0.04 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.19 1mfn n GLU 79 Cb 0.18 0.00 0.00 0.00 -1.01 0.00 0.00 31.44 30.61 1mfn n GLU 79 CO 0.00 0.00 0.00 0.39 0.09 0.00 0.00 177.13 177.61 1mfn n GLU 80 N -0.56 0.00 -3.58 3.49 1.02 -1.26 -3.72 120.64 116.03 1mfn n GLU 80 Ca 0.00 0.00 -0.09 0.00 -0.02 0.00 0.00 57.16 57.05 1mfn n GLU 80 Cb 0.00 0.00 0.02 0.00 -0.02 0.00 0.00 31.44 31.44 1mfn n GLU 80 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 1mfn n SER 81 N -2.03 -2.09 -4.76 1.62 3.41 -0.97 -4.16 113.62 104.64 1mfn n SER 81 Ca 0.00 -2.49 -0.39 0.00 -0.26 0.00 0.00 58.87 55.73 1mfn n SER 81 Cb 0.00 3.49 -0.05 0.00 -0.26 0.00 0.00 64.21 67.39 1mfn n SER 81 CO 0.00 0.00 0.00 -2.16 -0.16 0.00 0.00 175.04 172.72 1mfn s PRO 82 N -2.12 4.61 -1.03 4.33 0.04 -1.26 -4.67 135.00 134.90 1mfn s PRO 82 Ca 0.15 1.56 -0.23 0.00 0.04 0.00 0.00 61.00 62.53 1mfn s PRO 82 Cb -0.04 -3.03 0.03 0.00 0.04 0.00 0.00 34.50 31.50 1mfn s PRO 82 CO 0.11 0.26 1.59 -1.25 0.04 0.00 0.00 177.00 177.75 1mfn s PRO 83 N -1.67 3.39 -0.57 0.56 0.04 -1.26 -4.27 135.00 131.22 1mfn s PRO 83 Ca 0.47 -1.04 -0.28 0.00 0.04 0.00 0.00 61.00 60.19 1mfn s PRO 83 Cb -0.26 -5.31 0.01 0.00 0.04 0.00 0.00 34.50 28.98 1mfn s PRO 83 CO 0.32 -2.49 1.50 -1.17 0.04 0.00 0.00 177.00 175.20 1mfn s LEU 84 N 6.08 3.37 0.30 -3.56 2.96 0.28 -4.79 118.68 123.32 1mfn s LEU 84 Ca 0.52 0.29 0.07 0.00 -0.22 0.00 0.00 54.13 54.79 1mfn s LEU 84 Cb -0.01 -2.95 -0.03 0.00 0.50 0.00 0.00 46.19 43.70 1mfn s LEU 84 CO -0.06 -1.83 0.29 -0.63 -1.32 0.00 0.00 176.35 172.80 1mfn s ILE 85 N 6.57 3.97 0.14 6.68 1.01 -1.26 0.19 121.20 138.50 1mfn s ILE 85 Ca 0.55 -1.31 -0.23 0.00 0.00 0.00 0.00 60.65 59.66 1mfn s ILE 85 Cb -0.12 -3.32 0.07 0.00 0.01 0.00 0.00 42.46 39.10 1mfn s ILE 85 CO 0.24 -0.23 0.59 -0.83 0.00 0.00 0.00 174.94 174.70 1mfn s GLY 86 N -3.97 -0.58 -0.10 6.18 0.00 0.70 -4.87 107.32 104.67 1mfn s GLY 86 Ca 0.39 0.50 0.03 0.00 0.00 0.00 0.00 44.72 45.63 1mfn s GLY 86 CO 0.27 0.17 -0.20 1.20 0.00 0.00 0.00 173.10 174.54 1mfn s GLN 87 N -3.56 3.06 0.00 2.90 -0.21 -1.26 -0.25 119.66 120.33 1mfn s GLN 87 Ca 0.00 -0.81 0.00 0.00 0.02 0.00 0.00 55.36 54.57 1mfn s GLN 87 Cb -0.01 -2.39 0.00 0.00 1.00 0.00 0.00 33.01 31.61 1mfn s GLN 87 CO -0.11 0.24 0.00 0.00 -2.12 0.00 0.00 175.29 173.30 1mfn n GLN 88 N 3.37 0.52 -3.66 2.91 10.64 -1.00 -4.95 117.38 125.22 1mfn n GLN 88 Ca -0.18 0.00 -0.15 0.00 -1.83 0.00 0.00 57.00 54.84 1mfn n GLN 88 Cb 0.53 0.00 -0.08 0.00 -0.86 0.00 0.00 30.24 29.83 1mfn n GLN 88 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 1mfn s ALA 89 N -2.00 -1.29 0.12 2.61 0.00 -1.26 0.19 121.76 120.13 1mfn s ALA 89 Ca 0.00 1.05 -0.30 0.00 0.00 0.00 0.00 51.96 52.71 1mfn s ALA 89 Cb 0.00 -0.27 -0.07 0.00 0.00 0.00 0.00 23.12 22.78 1mfn s ALA 89 CO 0.00 -0.29 1.14 0.95 0.00 0.00 0.00 175.76 177.56 1mfn s THR 90 N -0.73 3.96 0.20 0.00 -4.23 0.68 -4.80 115.64 110.72 1mfn s THR 90 Ca -0.08 1.54 -0.31 0.00 -1.18 0.00 0.00 61.69 61.66 1mfn s THR 90 Cb -0.03 -3.99 -0.16 0.00 1.34 0.00 0.00 72.50 69.67 1mfn s THR 90 CO 0.05 0.19 1.02 1.33 -0.54 0.00 0.00 174.62 176.68 1mfn n VAL 91 N 3.13 1.28 -4.10 2.29 0.24 -1.25 -0.51 118.33 119.41 1mfn n VAL 91 Ca 0.06 -0.32 -0.29 0.00 -2.04 0.00 0.00 64.34 61.75 1mfn n VAL 91 Cb 0.46 -0.71 -0.07 0.00 -1.47 0.00 0.00 33.84 32.06 1mfn n VAL 91 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 1mfn s SER 92 N -0.29 5.27 0.60 -1.34 0.15 -1.23 -0.11 113.70 116.74 1mfn s SER 92 Ca 0.69 -0.14 0.28 0.00 0.70 0.00 0.00 55.95 57.48 1mfn s SER 92 Cb -0.85 -1.32 1.30 0.00 -1.71 0.00 0.00 66.02 63.44 1mfn s SER 92 CO 0.55 0.14 1.69 -2.24 1.20 0.00 0.00 173.24 174.58 1mfn h ASP 93 N 3.03 0.00 -3.28 5.45 2.03 -1.88 -3.21 116.42 118.56 1mfn h ASP 93 Ca -0.47 0.00 -0.65 0.00 -0.73 0.00 0.00 57.03 55.17 1mfn h ASP 93 Cb 1.18 0.00 -0.11 0.00 -0.83 0.00 0.00 39.33 39.56 1mfn h ASP 93 CO 0.62 0.00 -0.63 -0.63 -1.03 0.00 0.00 179.24 177.57 1mfn s ILE 94 N -4.53 4.27 -0.90 4.15 1.01 -1.26 -4.53 121.20 119.41 1mfn s ILE 94 Ca -0.04 -0.75 -0.06 0.00 0.00 0.00 0.00 60.65 59.81 1mfn s ILE 94 Cb 0.15 -2.99 -0.06 0.00 0.01 0.00 0.00 42.46 39.56 1mfn s ILE 94 CO 0.51 0.22 2.20 -0.81 0.00 0.00 0.00 174.94 177.06 1mfn n PRO 95 N 0.85 2.15 -0.31 2.79 -0.04 -1.24 -4.33 135.00 134.87 1mfn n PRO 95 Ca -0.12 -1.45 -0.30 0.00 -0.04 0.00 0.00 63.50 61.60 1mfn n PRO 95 Cb 0.52 -2.42 0.29 0.00 -0.04 0.00 0.00 33.50 31.85 1mfn n PRO 95 CO 0.00 0.00 0.00 0.50 -0.04 0.00 0.00 175.50 175.96 1mfn s ARG 96 N 3.17 -2.83 -1.38 0.54 3.52 -0.13 -3.75 118.95 118.09 1mfn s ARG 96 Ca 0.42 0.29 0.00 0.00 -0.13 0.00 0.00 55.73 56.31 1mfn s ARG 96 Cb 0.12 -1.37 0.00 0.00 -1.56 0.00 0.00 34.95 32.13 1mfn s ARG 96 CO -0.03 -4.85 0.00 -0.25 -0.81 0.00 0.00 175.30 169.36 1mfn n ASP 97 N -5.64 -4.55 -4.56 -2.12 8.00 -1.26 0.24 116.55 106.65 1mfn n ASP 97 Ca 0.11 0.18 -0.38 0.00 0.71 0.00 0.00 54.79 55.40 1mfn n ASP 97 Cb 0.59 -3.50 -0.03 0.00 -0.02 0.00 0.00 41.12 38.16 1mfn n ASP 97 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1mfn s LEU 98 N -3.66 3.40 0.27 0.64 1.98 -1.25 -3.51 118.68 116.55 1mfn s LEU 98 Ca 0.00 1.16 -0.14 0.00 -2.89 0.00 0.00 54.13 52.27 1mfn s LEU 98 Cb 0.00 -2.75 0.01 0.00 0.66 0.00 0.00 46.19 44.10 1mfn s LEU 98 CO 0.00 -2.60 0.55 -1.83 -1.89 0.00 0.00 176.35 170.59 1mfn s GLU 99 N 7.64 1.69 0.21 1.98 -1.05 -0.84 -4.89 118.70 123.43 1mfn s GLU 99 Ca 0.94 -1.26 0.09 0.00 -0.15 0.00 0.00 54.97 54.59 1mfn s GLU 99 Cb -0.20 0.51 -0.04 0.00 -0.44 0.00 0.00 34.13 33.96 1mfn s GLU 99 CO 0.27 -0.73 -0.10 0.08 0.95 0.00 0.00 175.26 175.74 1mfn s VAL 100 N -3.76 3.11 0.00 1.83 1.01 -1.26 0.19 120.40 121.52 1mfn s VAL 100 Ca 0.20 -1.80 0.00 0.00 0.00 0.00 0.00 61.98 60.39 1mfn s VAL 100 Cb -0.02 -2.57 0.00 0.00 0.00 0.00 0.00 36.38 33.79 1mfn s VAL 100 CO 0.10 -0.18 0.08 2.30 0.00 0.00 0.00 175.10 177.40 1mfn n ILE 101 N -0.16 0.00 -3.81 2.22 -5.35 0.33 -4.79 119.36 107.80 1mfn n ILE 101 Ca -0.10 -0.30 -0.21 0.00 -0.27 0.00 0.00 62.75 61.87 1mfn n ILE 101 Cb 0.56 1.10 -0.17 0.00 -1.74 0.00 0.00 39.64 39.39 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 -0.45 0.57 -0.84 -1.28 0.00 -1.22 -4.90 121.76 113.65 1mfn s ALA 102 Ca 0.00 -0.03 0.01 0.00 0.00 0.00 0.00 51.96 51.94 1mfn s ALA 102 Cb 0.00 -0.64 0.24 0.00 0.00 0.00 0.00 23.12 22.72 1mfn s ALA 102 CO 0.00 -0.37 0.86 -1.13 0.00 0.00 0.00 175.76 175.11 1mfn n SER 103 N 4.94 4.31 -4.81 0.00 3.41 -1.26 0.22 113.62 120.43 1mfn n SER 103 Ca -0.10 -3.28 -0.31 0.00 -0.26 0.00 0.00 58.87 54.92 1mfn n SER 103 Cb 0.50 -0.95 0.05 0.00 -0.26 0.00 0.00 64.21 63.56 1mfn n SER 103 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1mfn s THR 104 N -1.94 3.89 -1.81 6.66 -4.23 0.25 -4.89 115.64 113.56 1mfn s THR 104 Ca 0.31 0.63 0.14 0.00 -1.18 0.00 0.00 61.69 61.60 1mfn s THR 104 Cb 0.01 -3.31 0.36 0.00 1.34 0.00 0.00 72.50 70.90 1mfn s THR 104 CO -0.06 -0.78 1.31 -0.81 -0.54 0.00 0.00 174.62 173.73 1mfn n PRO 105 N -3.12 0.37 -0.46 3.99 -0.04 -1.26 -2.76 135.00 131.72 1mfn n PRO 105 Ca 0.08 0.05 0.00 0.00 -0.04 0.00 0.00 63.50 63.59 1mfn n PRO 105 Cb 0.53 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.49 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 -1.09 0.00 -3.62 0.52 -2.24 -1.26 -3.89 114.28 102.69 1mfn n THR 106 Ca 0.09 0.00 -0.06 0.00 -2.27 0.00 0.00 64.05 61.81 1mfn n THR 106 Cb 0.07 0.21 -0.05 0.00 -2.10 0.00 0.00 70.33 68.46 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 -0.35 -0.21 0.17 3.42 1.04 -1.11 -2.66 113.70 113.99 1mfn s SER 107 Ca 0.00 0.28 0.09 0.00 0.48 0.00 0.00 55.95 56.80 1mfn s SER 107 Cb 0.00 0.24 -0.04 0.00 0.10 0.00 0.00 66.02 66.32 1mfn s SER 107 CO 0.00 -0.16 -0.19 -0.76 0.98 0.00 0.00 173.24 173.10 1mfn s LEU 108 N -0.77 2.43 -0.40 2.42 1.43 -0.99 0.84 118.68 123.63 1mfn s LEU 108 Ca 0.04 -0.85 -0.10 0.00 -1.03 0.00 0.00 54.13 52.18 1mfn s LEU 108 Cb -0.02 -0.88 0.06 0.00 0.03 0.00 0.00 46.19 45.38 1mfn s LEU 108 CO -0.05 -0.01 0.25 -0.22 0.23 0.00 0.00 176.35 176.55 1mfn s LEU 109 N -2.62 5.00 -0.07 1.79 2.96 0.13 -0.16 118.68 125.72 1mfn s LEU 109 Ca 0.16 -1.27 -0.24 0.00 -0.22 0.00 0.00 54.13 52.55 1mfn s LEU 109 Cb -0.06 -2.02 -0.03 0.00 0.50 0.00 0.00 46.19 44.58 1mfn s LEU 109 CO 0.07 -0.48 0.74 0.27 -1.32 0.00 0.00 176.35 175.62 1mfn s ILE 110 N 1.50 5.02 -0.12 6.68 -4.36 0.13 0.12 121.20 130.17 1mfn s ILE 110 Ca 0.02 1.52 0.01 0.00 -0.26 0.00 0.00 60.65 61.94 1mfn s ILE 110 Cb -0.21 -4.07 0.02 0.00 1.25 0.00 0.00 42.46 39.44 1mfn s ILE 110 CO 0.04 0.23 -0.13 -0.94 0.24 0.00 0.00 174.94 174.38 1mfn s SER 111 N 0.85 2.38 0.22 4.36 1.04 0.50 -0.22 113.70 122.83 1mfn s SER 111 Ca 0.39 -0.40 -0.04 0.00 0.48 0.00 0.00 55.95 56.38 1mfn s SER 111 Cb -0.18 -1.03 0.02 0.00 0.10 0.00 0.00 66.02 64.92 1mfn s SER 111 CO 0.19 -0.03 0.35 -2.67 0.98 0.00 0.00 173.24 172.06 1mfn n TRP 112 N 4.47 -1.31 -3.51 5.02 2.14 -1.07 -2.00 117.44 121.19 1mfn n TRP 112 Ca -0.17 -1.29 -0.42 0.00 2.07 0.00 0.00 57.50 57.69 1mfn n TRP 112 Cb 0.51 0.40 -0.08 0.00 -0.81 0.00 0.00 31.31 31.33 1mfn n TRP 112 CO 0.00 0.00 0.00 -1.21 2.07 0.00 0.00 177.69 178.55 1mfn s GLU 113 N -2.33 2.58 0.84 -2.67 0.41 0.66 -4.75 118.70 113.45 1mfn s GLU 113 Ca 0.14 -1.73 -0.12 0.00 -0.41 0.00 0.00 54.97 52.86 1mfn s GLU 113 Cb -0.01 -3.98 0.10 0.00 -1.78 0.00 0.00 34.13 28.45 1mfn s GLU 113 CO 0.10 -1.20 1.10 -1.25 -0.49 0.00 0.00 175.26 173.53 1mfn s PRO 114 N 1.41 1.70 -1.12 0.39 0.04 -1.26 -0.95 135.00 135.20 1mfn s PRO 114 Ca 0.05 0.66 -0.20 0.00 0.04 0.00 0.00 61.00 61.55 1mfn s PRO 114 Cb -0.27 -1.87 0.08 0.00 0.04 0.00 0.00 34.50 32.48 1mfn s PRO 114 CO 0.00 -1.89 1.51 -1.25 0.04 0.00 0.00 177.00 175.41 1mfn s PRO 115 N -5.09 3.78 -0.77 0.56 0.04 -1.21 -3.58 135.00 128.72 1mfn s PRO 115 Ca 0.62 -1.64 -0.07 0.00 0.04 0.00 0.00 61.00 59.96 1mfn s PRO 115 Cb -0.16 -5.34 -0.06 0.00 0.04 0.00 0.00 34.50 28.98 1mfn s PRO 115 CO 0.55 -2.14 1.93 0.00 0.04 0.00 0.00 177.00 177.39 1mfn n ALA 116 N 8.15 4.03 -3.08 8.56 0.00 -1.26 -4.58 120.51 132.34 1mfn n ALA 116 Ca 0.38 -1.85 0.00 0.00 0.00 0.00 0.00 53.44 51.97 1mfn n ALA 116 Cb 0.48 -3.00 0.00 0.00 0.00 0.00 0.00 19.45 16.94 1mfn n ALA 116 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 1mfn n VAL 117 N 4.51 0.00 -1.14 0.00 0.24 -1.26 -3.52 118.33 117.16 1mfn n VAL 117 Ca 0.39 0.00 -0.42 0.00 -2.04 0.00 0.00 64.34 62.27 1mfn n VAL 117 Cb 0.14 0.00 -0.07 0.00 -1.47 0.00 0.00 33.84 32.44 1mfn n VAL 117 CO 0.00 0.00 0.00 -1.20 -2.14 0.00 0.00 176.83 173.49 1mfn n SER 118 N -0.57 2.34 -4.68 -1.34 7.64 -1.26 -4.87 113.62 110.88 1mfn n SER 118 Ca 0.00 -2.65 -0.33 0.00 1.01 0.00 0.00 58.87 56.89 1mfn n SER 118 Cb 0.00 -1.09 -0.09 0.00 -1.01 0.00 0.00 64.21 62.02 1mfn n SER 118 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1mfn s VAL 119 N 5.93 4.21 -0.20 0.44 1.01 -1.26 -4.51 120.40 126.02 1mfn s VAL 119 Ca 0.60 -0.46 -0.19 0.00 0.00 0.00 0.00 61.98 61.92 1mfn s VAL 119 Cb 0.13 -2.84 -0.16 0.00 0.00 0.00 0.00 36.38 33.51 1mfn s VAL 119 CO 0.15 0.47 0.14 0.03 0.00 0.00 0.00 175.10 175.89 1mfn h ARG 120 N 4.65 0.00 0.00 2.72 2.47 0.14 -3.47 114.38 120.90 1mfn h ARG 120 Ca -0.50 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.22 1mfn h ARG 120 Cb 1.18 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.50 1mfn h ARG 120 CO 0.56 0.83 0.00 2.48 0.56 0.00 0.00 179.97 184.41 1mfn n TYR 121 N -4.46 -0.62 -3.84 3.04 4.11 -1.02 -4.37 117.16 110.00 1mfn n TYR 121 Ca -0.28 0.00 -0.13 0.00 -0.00 0.00 0.00 57.90 57.49 1mfn n TYR 121 Cb 0.61 0.00 -0.14 0.00 -0.00 0.00 0.00 39.34 39.81 1mfn n TYR 121 CO 0.00 0.00 0.00 0.71 -0.00 0.00 0.00 176.86 177.57 1mfn s TYR 122 N -6.44 -0.00 -0.55 -3.48 1.51 -0.80 0.20 117.35 107.78 1mfn s TYR 122 Ca 0.00 0.05 -0.18 0.00 -1.01 0.00 0.00 57.07 55.93 1mfn s TYR 122 Cb 0.00 -0.06 0.09 0.00 -0.11 0.00 0.00 41.96 41.89 1mfn s TYR 122 CO 0.00 -0.03 0.63 0.50 -1.11 0.00 0.00 175.55 175.55 1mfn s ARG 123 N 0.27 3.05 -0.29 -0.62 3.52 0.67 0.39 118.95 125.94 1mfn s ARG 123 Ca -0.02 -1.25 -0.24 0.00 -0.13 0.00 0.00 55.73 54.08 1mfn s ARG 123 Cb -0.03 -4.21 0.00 0.00 -1.56 0.00 0.00 34.95 29.15 1mfn s ARG 123 CO -0.01 -1.39 0.84 0.42 -0.81 0.00 0.00 175.30 174.35 1mfn s ILE 124 N 2.46 4.76 -0.13 4.11 1.01 0.17 -0.91 121.20 132.67 1mfn s ILE 124 Ca 0.11 1.34 -0.16 0.00 0.00 0.00 0.00 60.65 61.93 1mfn s ILE 124 Cb -0.24 -4.18 -0.04 0.00 0.01 0.00 0.00 42.46 38.01 1mfn s ILE 124 CO 0.07 -0.25 0.40 0.42 0.00 0.00 0.00 174.94 175.59 1mfn s THR 125 N 3.03 5.23 -0.17 2.92 -4.23 0.53 0.26 115.64 123.20 1mfn s THR 125 Ca 0.35 0.79 -0.28 0.00 -1.18 0.00 0.00 61.69 61.37 1mfn s THR 125 Cb -0.14 -3.74 -0.00 0.00 1.34 0.00 0.00 72.50 69.95 1mfn s THR 125 CO 0.12 0.35 0.97 -0.31 -0.54 0.00 0.00 174.62 175.21 1mfn s TYR 126 N 0.55 3.42 -0.54 3.99 1.51 0.32 -1.80 117.35 124.80 1mfn s TYR 126 Ca 0.22 1.44 -0.14 0.00 -1.01 0.00 0.00 57.07 57.59 1mfn s TYR 126 Cb -0.14 -3.17 0.13 0.00 -0.11 0.00 0.00 41.96 38.67 1mfn s TYR 126 CO 0.08 -0.33 0.47 0.20 -1.11 0.00 0.00 175.55 174.86 1mfn s GLY 127 N 1.16 2.12 -0.72 0.71 0.00 0.50 -2.46 107.32 108.63 1mfn s GLY 127 Ca 0.44 -2.60 -0.07 0.00 0.00 0.00 0.00 44.72 42.48 1mfn s GLY 127 CO 0.12 1.17 0.59 -0.54 0.00 0.00 0.00 173.10 174.44 1mfn s GLU 128 N 1.40 3.02 0.40 2.90 2.02 -1.26 0.12 118.70 127.30 1mfn s GLU 128 Ca 0.05 -2.54 -0.24 0.00 0.02 0.00 0.00 54.97 52.26 1mfn s GLU 128 Cb -0.27 -4.02 -0.08 0.00 0.10 0.00 0.00 34.13 29.85 1mfn s GLU 128 CO 0.01 -1.22 1.11 0.95 0.02 0.00 0.00 175.26 176.13 1mfn s THR 129 N -0.04 3.40 0.00 3.63 -4.23 -1.04 -4.51 115.64 112.86 1mfn s THR 129 Ca 0.18 1.12 0.00 0.00 -1.18 0.00 0.00 61.69 61.81 1mfn s THR 129 Cb -0.16 -3.60 0.00 0.00 1.34 0.00 0.00 72.50 70.08 1mfn s THR 129 CO -0.06 0.05 0.00 0.61 -0.54 0.00 0.00 174.62 174.68 1mfn n GLY 130 N 0.51 -1.20 2.36 3.99 0.00 -1.26 -4.37 105.19 105.21 1mfn n GLY 130 Ca 0.05 0.42 -0.29 0.00 0.00 0.00 0.00 46.02 46.20 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 6.07 2.05 -0.02 0.00 -1.26 -4.88 105.19 107.15 1mfn n GLY 131 Ca 0.00 -2.64 -0.11 0.00 0.00 0.00 0.00 46.02 43.27 1mfn n GLY 131 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1mfn n ASN 132 N -0.62 -3.14 -4.15 1.61 3.02 -1.26 -4.88 115.26 105.83 1mfn n ASN 132 Ca 0.46 0.26 -0.29 0.00 -0.03 0.00 0.00 54.58 54.97 1mfn n ASN 132 Cb 0.71 -2.90 0.22 0.00 -0.61 0.00 0.00 39.78 37.20 1mfn n ASN 132 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1mfn n SER 133 N -0.76 -2.49 -4.16 6.41 7.64 -1.26 -4.99 113.62 114.00 1mfn n SER 133 Ca -0.12 -0.28 -0.30 0.00 1.01 0.00 0.00 58.87 59.19 1mfn n SER 133 Cb 0.44 -1.04 0.18 0.00 -1.01 0.00 0.00 64.21 62.79 1mfn n SER 133 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 1mfn s PRO 134 N -3.96 0.51 -0.01 1.43 0.04 -1.26 -4.95 135.00 126.80 1mfn s PRO 134 Ca 0.60 -0.31 0.00 0.00 0.04 0.00 0.00 61.00 61.33 1mfn s PRO 134 Cb -0.16 -1.82 -0.04 0.00 0.04 0.00 0.00 34.50 32.52 1mfn s PRO 134 CO 0.62 -2.52 0.05 0.14 0.04 0.00 0.00 177.00 175.33 1mfn s VAL 135 N -3.74 4.54 -0.56 -0.36 -7.23 -1.26 -4.62 120.40 107.17 1mfn s VAL 135 Ca 0.73 -0.46 -0.13 0.00 -1.81 0.00 0.00 61.98 60.31 1mfn s VAL 135 Cb -0.05 -3.05 0.14 0.00 0.56 0.00 0.00 36.38 33.97 1mfn s VAL 135 CO 0.53 0.37 0.48 -1.58 -0.31 0.00 0.00 175.10 174.59 1mfn s GLN 136 N -1.63 2.88 -0.02 4.82 0.74 -1.03 -4.78 119.66 120.64 1mfn s GLN 136 Ca 0.21 -1.85 -0.16 0.00 0.05 0.00 0.00 55.36 53.61 1mfn s GLN 136 Cb -0.12 -4.18 -0.05 0.00 1.10 0.00 0.00 33.01 29.76 1mfn s GLN 136 CO 0.12 -1.28 0.45 -1.83 -0.55 0.00 0.00 175.29 172.21 1mfn s GLU 137 N 1.30 4.09 0.04 1.67 -1.05 -1.26 0.12 118.70 123.60 1mfn s GLU 137 Ca 0.06 0.47 0.03 0.00 -0.15 0.00 0.00 54.97 55.38 1mfn s GLU 137 Cb -0.26 -3.29 -0.02 0.00 -0.44 0.00 0.00 34.13 30.12 1mfn s GLU 137 CO 0.00 0.53 -0.09 -0.59 0.95 0.00 0.00 175.26 176.07 1mfn s PHE 138 N -0.60 0.75 0.95 4.83 -0.12 0.14 -4.92 117.98 119.01 1mfn s PHE 138 Ca 0.25 -0.40 -0.13 0.00 -0.05 0.00 0.00 56.93 56.60 1mfn s PHE 138 Cb -0.17 -0.45 0.16 0.00 -0.63 0.00 0.00 43.02 41.94 1mfn s PHE 138 CO 0.13 -0.04 1.14 0.95 -0.05 0.00 0.00 175.22 177.35 1mfn s THR 139 N -1.05 1.97 -0.04 -4.49 -4.23 -1.26 0.45 115.64 106.99 1mfn s THR 139 Ca -0.05 0.00 -0.04 0.00 -1.18 0.00 0.00 61.69 60.41 1mfn s THR 139 Cb -0.08 -2.71 0.01 0.00 1.34 0.00 0.00 72.50 71.06 1mfn s THR 139 CO 0.01 0.00 0.11 -0.69 -0.54 0.00 0.00 174.62 173.51 1mfn s VAL 140 N -3.25 0.00 0.28 2.29 1.01 0.16 -4.69 120.40 116.21 1mfn s VAL 140 Ca 0.65 -0.03 -0.28 0.00 0.00 0.00 0.00 61.98 62.32 1mfn s VAL 140 Cb -0.14 -0.18 -0.09 0.00 0.00 0.00 0.00 36.38 35.97 1mfn s VAL 140 CO 0.54 -0.02 0.94 -2.16 0.00 0.00 0.00 175.10 174.41 1mfn s PRO 141 N -0.01 4.71 -0.16 2.72 0.04 -1.26 -1.91 135.00 139.14 1mfn s PRO 141 Ca -0.01 1.41 -0.03 0.00 0.04 0.00 0.00 61.00 62.41 1mfn s PRO 141 Cb -0.01 -3.02 -0.04 0.00 0.04 0.00 0.00 34.50 31.46 1mfn s PRO 141 CO 0.00 0.39 2.76 0.41 0.04 0.00 0.00 177.00 180.59 1mfn n GLY 142 N 0.99 3.37 0.00 0.56 0.00 -1.26 -4.44 105.19 104.41 1mfn n GLY 142 Ca 0.00 -1.04 0.00 0.00 0.00 0.00 0.00 46.02 44.98 1mfn n GLY 142 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1mfn n SER 143 N 1.51 0.00 -4.85 1.61 3.41 -1.26 -5.04 113.62 109.00 1mfn n SER 143 Ca 0.31 0.00 -0.32 0.00 -0.26 0.00 0.00 58.87 58.61 1mfn n SER 143 Cb 0.68 0.00 -0.00 0.00 -0.26 0.00 0.00 64.21 64.62 1mfn n SER 143 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1mfn s LYS 144 N 0.00 3.62 0.00 4.33 -0.14 -1.26 -4.96 119.74 121.33 1mfn s LYS 144 Ca 0.00 0.88 0.25 0.00 -1.36 0.00 0.00 55.97 55.74 1mfn s LYS 144 Cb 0.00 -2.09 0.44 0.00 -1.68 0.00 0.00 37.83 34.50 1mfn s LYS 144 CO 0.00 -0.55 1.37 0.45 -0.76 0.00 0.00 175.35 175.87 1mfn n SER 145 N -2.33 1.82 -4.42 2.83 2.88 -1.26 -4.87 113.62 108.27 1mfn n SER 145 Ca 0.07 -1.42 -0.31 0.00 -1.33 0.00 0.00 58.87 55.88 1mfn n SER 145 Cb 0.54 0.21 -0.14 0.00 -0.75 0.00 0.00 64.21 64.07 1mfn n SER 145 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 1mfn s THR 146 N -2.32 2.66 0.06 2.46 -4.23 -1.26 -2.59 115.64 110.42 1mfn s THR 146 Ca 0.25 -1.02 0.03 0.00 -1.18 0.00 0.00 61.69 59.77 1mfn s THR 146 Cb 0.19 -2.05 -0.03 0.00 1.34 0.00 0.00 72.50 71.96 1mfn s THR 146 CO 0.47 0.49 -0.09 0.00 -0.54 0.00 0.00 174.62 174.94 1mfn s ALA 147 N -0.77 0.77 0.07 3.99 0.00 0.69 -4.94 121.76 121.56 1mfn s ALA 147 Ca 0.12 -0.88 -0.07 0.00 0.00 0.00 0.00 51.96 51.13 1mfn s ALA 147 Cb -0.10 0.02 -0.05 0.00 0.00 0.00 0.00 23.12 22.98 1mfn s ALA 147 CO 0.02 0.01 0.33 -0.08 0.00 0.00 0.00 175.76 176.04 1mfn s THR 148 N -1.54 5.21 -0.58 0.00 -1.32 -1.26 0.20 115.64 116.34 1mfn s THR 148 Ca -0.06 0.19 0.06 0.00 -1.21 0.00 0.00 61.69 60.67 1mfn s THR 148 Cb -0.09 -3.61 0.22 0.00 -1.51 0.00 0.00 72.50 67.52 1mfn s THR 148 CO 0.01 0.25 0.61 -0.38 -2.21 0.00 0.00 174.62 172.89 1mfn n ILE 149 N 0.75 1.23 -0.48 5.08 2.08 0.78 -4.93 119.36 123.87 1mfn n ILE 149 Ca -0.08 -4.72 0.00 0.00 0.56 0.00 0.00 62.75 58.51 1mfn n ILE 149 Cb 0.52 -2.05 0.00 0.00 -0.75 0.00 0.00 39.64 37.37 1mfn n ILE 149 CO 0.00 0.00 0.00 0.59 0.56 0.00 0.00 176.55 177.70 1mfn n ASN 150 N 1.39 -0.04 -1.60 4.38 3.02 -1.26 -2.35 115.26 118.80 1mfn n ASN 150 Ca 0.26 -0.48 -0.19 0.00 -0.03 0.00 0.00 54.58 54.14 1mfn n ASN 150 Cb 0.43 0.00 -0.08 0.00 -0.61 0.00 0.00 39.78 39.52 1mfn n ASN 150 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1mfn n ASN 151 N -1.51 -4.99 -4.92 6.41 5.03 -1.09 -4.84 115.26 109.35 1mfn n ASN 151 Ca 0.00 0.44 -0.26 0.00 0.87 0.00 0.00 54.58 55.63 1mfn n ASN 151 Cb 0.00 -4.44 0.00 0.00 -1.02 0.00 0.00 39.78 34.33 1mfn n ASN 151 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.26 174.92 1mfn s ILE 152 N -2.62 4.72 -0.22 2.41 2.07 -1.11 -5.05 121.20 121.40 1mfn s ILE 152 Ca 0.00 -0.07 -0.07 0.00 -1.41 0.00 0.00 60.65 59.10 1mfn s ILE 152 Cb 0.00 -3.78 -0.03 0.00 0.13 0.00 0.00 42.46 38.79 1mfn s ILE 152 CO 0.00 -0.67 0.05 -0.54 -1.91 0.00 0.00 174.94 171.86 1mfn s LYS 153 N -4.64 3.69 0.36 3.50 -0.14 -1.26 -4.68 119.74 116.57 1mfn s LYS 153 Ca 0.46 -0.47 -0.25 0.00 -1.36 0.00 0.00 55.97 54.35 1mfn s LYS 153 Cb -0.10 -3.23 -0.10 0.00 -1.68 0.00 0.00 37.83 32.72 1mfn s LYS 153 CO 0.42 -0.06 1.00 -1.25 -0.76 0.00 0.00 175.35 174.69 1mfn s PRO 154 N 1.24 4.38 0.00 -1.68 0.04 -1.25 -4.42 135.00 133.32 1mfn s PRO 154 Ca 0.04 1.41 0.00 0.00 0.04 0.00 0.00 61.00 62.49 1mfn s PRO 154 Cb -0.15 -2.66 0.00 0.00 0.04 0.00 0.00 34.50 31.74 1mfn s PRO 154 CO 0.03 0.08 0.00 0.41 0.04 0.00 0.00 177.00 177.55 1mfn n GLY 155 N 0.40 0.26 0.00 0.56 0.00 0.62 -5.02 105.19 102.01 1mfn n GLY 155 Ca 0.03 -0.26 0.00 0.00 0.00 0.00 0.00 46.02 45.79 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 -1.15 0.00 -0.76 4.61 0.00 0.70 -4.97 120.51 118.94 1mfn n ALA 156 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.11 1mfn n ALA 156 Cb 0.47 0.00 0.13 0.00 0.00 0.00 0.00 19.45 20.06 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 -2.58 -3.83 0.00 -0.08 -1.26 -2.45 116.55 106.34 1mfn n ASP 157 Ca 0.00 0.06 -0.13 0.00 -1.51 0.00 0.00 54.79 53.21 1mfn n ASP 157 Cb 0.00 -0.99 -0.07 0.00 2.34 0.00 0.00 41.12 42.40 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 -2.25 1.03 -0.30 -0.67 1.51 0.55 -2.49 117.35 114.73 1mfn s TYR 158 Ca 0.53 -1.24 0.00 0.00 -1.01 0.00 0.00 57.07 55.35 1mfn s TYR 158 Cb -0.13 -0.30 0.14 0.00 -0.11 0.00 0.00 41.96 41.55 1mfn s TYR 158 CO 0.68 -0.86 0.31 0.99 -1.11 0.00 0.00 175.55 175.55 1mfn s THR 159 N -3.80 -0.41 -0.18 -0.71 2.01 0.32 -2.54 115.64 110.33 1mfn s THR 159 Ca 0.33 -0.51 -0.13 0.00 0.31 0.00 0.00 61.69 61.70 1mfn s THR 159 Cb 0.03 -0.97 -0.05 0.00 0.01 0.00 0.00 72.50 71.52 1mfn s THR 159 CO 0.15 -0.46 0.24 -0.63 -0.69 0.00 0.00 174.62 173.23 1mfn s ILE 160 N 2.31 5.34 -0.01 1.82 1.01 -0.23 0.19 121.20 131.62 1mfn s ILE 160 Ca 0.10 0.43 0.02 0.00 0.00 0.00 0.00 60.65 61.21 1mfn s ILE 160 Cb -0.14 -3.58 -0.00 0.00 0.01 0.00 0.00 42.46 38.74 1mfn s ILE 160 CO -0.31 0.40 -0.08 -0.89 0.00 0.00 0.00 174.94 174.06 1mfn s THR 161 N 0.50 0.63 0.03 2.92 2.01 -0.75 0.41 115.64 121.40 1mfn s THR 161 Ca 0.14 -0.33 0.04 0.00 0.31 0.00 0.00 61.69 61.84 1mfn s THR 161 Cb -0.12 -0.54 -0.04 0.00 0.01 0.00 0.00 72.50 71.81 1mfn s THR 161 CO 0.02 0.18 -0.06 -0.76 -0.69 0.00 0.00 174.62 173.32 1mfn s LEU 162 N -0.11 3.20 -0.50 4.42 1.02 0.04 0.20 118.68 126.96 1mfn s LEU 162 Ca 0.02 -0.17 0.03 0.00 0.02 0.00 0.00 54.13 54.03 1mfn s LEU 162 Cb -0.04 -1.87 0.16 0.00 0.02 0.00 0.00 46.19 44.46 1mfn s LEU 162 CO -0.00 0.26 0.34 -0.31 0.02 0.00 0.00 176.35 176.66 1mfn s TYR 163 N -1.06 2.02 0.05 0.29 1.51 -0.09 -2.74 117.35 117.33 1mfn s TYR 163 Ca 0.19 -2.59 -0.30 0.00 -1.01 0.00 0.00 57.07 53.35 1mfn s TYR 163 Cb -0.11 -1.71 -0.08 0.00 -0.11 0.00 0.00 41.96 39.95 1mfn s TYR 163 CO 0.10 -0.74 1.74 0.00 -1.11 0.00 0.00 175.55 175.53 1mfn s ALA 164 N -0.20 3.67 -0.18 3.71 0.00 -1.26 -0.24 121.76 127.25 1mfn s ALA 164 Ca 0.25 1.21 -0.07 0.00 0.00 0.00 0.00 51.96 53.35 1mfn s ALA 164 Cb -0.09 -3.74 -0.04 0.00 0.00 0.00 0.00 23.12 19.25 1mfn s ALA 164 CO -0.12 -1.26 0.05 0.08 0.00 0.00 0.00 175.76 174.52 1mfn s VAL 165 N 3.24 4.68 0.02 0.00 1.01 0.52 -3.47 120.40 126.40 1mfn s VAL 165 Ca 0.77 -0.07 -0.00 0.00 0.00 0.00 0.00 61.98 62.68 1mfn s VAL 165 Cb -0.40 -3.11 -0.00 0.00 0.00 0.00 0.00 36.38 32.87 1mfn s VAL 165 CO 0.34 0.45 -0.00 0.35 0.00 0.00 0.00 175.10 176.24 1mfn n THR 166 N 3.64 0.28 -1.05 3.92 -2.24 -1.22 0.17 114.28 117.77 1mfn n THR 166 Ca -0.17 0.09 -0.36 0.00 -2.27 0.00 0.00 64.05 61.34 1mfn n THR 166 Cb 0.52 -1.52 0.05 0.00 -2.10 0.00 0.00 70.33 67.28 1mfn n THR 166 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1mfn n GLY 167 N 3.11 -3.73 2.62 3.38 0.00 -1.05 -4.44 105.19 105.09 1mfn n GLY 167 Ca -0.00 -0.62 -0.25 0.00 0.00 0.00 0.00 46.02 45.15 1mfn n GLY 167 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1mfn s ARG 168 N -2.07 0.15 0.00 1.61 3.00 -1.26 -4.61 118.95 115.76 1mfn s ARG 168 Ca 0.48 -0.18 0.00 0.00 0.00 0.00 0.00 55.73 56.04 1mfn s ARG 168 Cb -0.27 -1.42 0.00 0.00 0.00 0.00 0.00 34.95 33.27 1mfn s ARG 168 CO 0.75 -0.81 0.00 0.41 0.00 0.00 0.00 175.30 175.65 1mfn n GLY 169 N 5.28 -0.51 0.00 -3.53 0.00 -1.26 -4.90 105.19 100.27 1mfn n GLY 169 Ca -0.06 -0.91 0.12 0.00 0.00 0.00 0.00 46.02 45.17 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 0.00 0.00 -3.21 1.61 2.03 -1.26 -4.11 116.55 111.61 1mfn n ASP 170 Ca 0.00 -0.50 -0.18 0.00 0.52 0.00 0.00 54.79 54.63 1mfn n ASP 170 Cb 0.00 -0.10 -0.06 0.00 -0.72 0.00 0.00 41.12 40.23 1mfn n ASP 170 CO 0.00 0.00 0.00 -0.44 -1.92 0.00 0.00 177.20 174.84 1mfn s SER 171 N -2.20 0.56 -0.59 1.67 0.01 -1.26 -5.09 113.70 106.79 1mfn s SER 171 Ca 0.31 -2.32 -0.28 0.00 1.31 0.00 0.00 55.95 54.97 1mfn s SER 171 Cb 0.16 0.47 0.02 0.00 0.21 0.00 0.00 66.02 66.88 1mfn s SER 171 CO 0.30 -0.16 1.35 -2.16 0.41 0.00 0.00 173.24 172.99 1mfn s PRO 172 N 0.64 3.33 -0.06 12.44 0.04 -1.26 -4.67 135.00 145.45 1mfn s PRO 172 Ca 0.28 0.32 -0.24 0.00 0.04 0.00 0.00 61.00 61.40 1mfn s PRO 172 Cb -0.02 -4.11 -0.04 0.00 0.04 0.00 0.00 34.50 30.37 1mfn s PRO 172 CO -0.11 -1.92 0.74 0.00 0.04 0.00 0.00 177.00 175.75 1mfn s ALA 173 N 5.81 3.32 -0.13 8.56 0.00 -1.26 -4.78 121.76 133.28 1mfn s ALA 173 Ca 0.48 0.18 -0.03 0.00 0.00 0.00 0.00 51.96 52.59 1mfn s ALA 173 Cb -0.10 -3.00 -0.03 0.00 0.00 0.00 0.00 23.12 19.99 1mfn s ALA 173 CO 0.24 -0.13 -0.03 -1.54 0.00 0.00 0.00 175.76 174.30 1mfn s SER 174 N 0.83 4.92 1.03 0.00 1.04 -1.26 -2.52 113.70 117.74 1mfn s SER 174 Ca 0.39 -0.04 -0.23 0.00 0.48 0.00 0.00 55.95 56.56 1mfn s SER 174 Cb -0.18 -1.62 -0.08 0.00 0.10 0.00 0.00 66.02 64.24 1mfn s SER 174 CO 0.19 0.25 -0.85 -1.54 0.98 0.00 0.00 173.24 172.27 1mfn n SER 175 N 2.99 -3.15 -4.58 7.02 3.41 -1.23 -4.64 113.62 113.46 1mfn n SER 175 Ca -0.18 0.01 -0.50 0.00 -0.26 0.00 0.00 58.87 57.94 1mfn n SER 175 Cb 0.53 -0.72 -0.05 0.00 -0.26 0.00 0.00 64.21 63.71 1mfn n SER 175 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1mfn n LYS 176 N 0.80 1.11 -1.93 4.33 5.02 -1.26 -4.77 118.16 121.45 1mfn n LYS 176 Ca -0.01 0.39 -0.32 0.00 -2.02 0.00 0.00 58.31 56.36 1mfn n LYS 176 Cb 0.68 -1.92 0.01 0.00 -0.02 0.00 0.00 35.03 33.78 1mfn n LYS 176 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 1mfn s PRO 177 N -0.18 3.37 -0.01 1.97 0.04 -1.26 -4.81 135.00 134.11 1mfn s PRO 177 Ca 0.76 1.00 -0.00 0.00 0.04 0.00 0.00 61.00 62.80 1mfn s PRO 177 Cb -0.89 -2.05 0.01 0.00 0.04 0.00 0.00 34.50 31.61 1mfn s PRO 177 CO 0.51 -0.76 0.02 0.08 0.04 0.00 0.00 177.00 176.89 1mfn s VAL 178 N -2.80 -0.02 0.40 -0.36 1.01 -1.11 -5.02 120.40 112.50 1mfn s VAL 178 Ca 0.59 0.06 0.02 0.00 0.00 0.00 0.00 61.98 62.66 1mfn s VAL 178 Cb -0.13 -0.05 -0.01 0.00 0.00 0.00 0.00 36.38 36.19 1mfn s VAL 178 CO 0.44 0.03 0.08 -1.20 0.00 0.00 0.00 175.10 174.45 1mfn n SER 179 N 3.40 1.95 -3.54 3.32 7.64 -1.26 -0.78 113.62 124.36 1mfn n SER 179 Ca -0.17 -2.98 -0.16 0.00 1.01 0.00 0.00 58.87 56.58 1mfn n SER 179 Cb 0.57 0.71 -0.06 0.00 -1.01 0.00 0.00 64.21 64.42 1mfn n SER 179 CO 0.00 0.00 0.00 0.27 -3.01 0.00 0.00 175.04 172.30 1mfn s ILE 180 N -2.83 0.01 0.17 0.44 -4.36 0.17 -4.95 121.20 109.85 1mfn s ILE 180 Ca 0.12 -0.10 -0.04 0.00 -0.26 0.00 0.00 60.65 60.37 1mfn s ILE 180 Cb 0.01 -0.96 -0.05 0.00 1.25 0.00 0.00 42.46 42.71 1mfn s ILE 180 CO 0.08 -0.06 0.39 0.20 0.24 0.00 0.00 174.94 175.80 1mfn s ASN 181 N -1.57 6.45 -0.11 4.36 -0.87 -1.26 -1.07 114.94 120.87 1mfn s ASN 181 Ca -0.08 0.54 -0.06 0.00 -1.57 0.00 0.00 52.86 51.68 1mfn s ASN 181 Cb -0.01 -2.07 0.04 0.00 -0.02 0.00 0.00 41.25 39.20 1mfn s ASN 181 CO 0.04 0.01 0.26 -0.47 -2.57 0.00 0.00 177.10 174.37 1mfn s TYR 182 N -1.75 -0.35 -0.27 2.20 5.04 -1.05 -4.90 117.35 116.28 1mfn s TYR 182 Ca 0.40 0.82 -0.09 0.00 -2.44 0.00 0.00 57.07 55.77 1mfn s TYR 182 Cb -0.12 0.08 -0.03 0.00 0.35 0.00 0.00 41.96 42.23 1mfn s TYR 182 CO 0.26 -0.23 0.12 0.21 -1.34 0.00 0.00 175.55 174.57 1mfn s LYS 183 N 1.13 3.73 0.00 4.97 2.20 -1.26 0.21 119.74 130.72 1mfn s LYS 183 Ca -0.08 -0.44 0.26 0.00 -0.36 0.00 0.00 55.97 55.35 1mfn s LYS 183 Cb -0.09 -3.46 0.71 0.00 -1.51 0.00 0.00 37.83 33.47 1mfn s LYS 183 CO -0.08 -0.20 1.55 0.25 -0.36 0.00 0.00 175.35 176.51