#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 -4.55 0.99 4.32 -1.26 -4.99 117.00 111.50 1mfn n LEU 2 Ca 0.00 0.00 -0.39 0.00 -0.02 0.00 0.00 56.01 55.60 1mfn n LEU 2 Cb 0.00 0.00 -0.03 0.00 -1.62 0.00 0.00 43.42 41.77 1mfn n LEU 2 CO 0.00 -0.08 1.36 -1.81 -1.22 0.00 0.00 177.39 175.64 1mfn s ASP 3 N -0.66 5.85 -0.92 -1.43 1.01 -1.26 -4.88 116.67 114.39 1mfn s ASP 3 Ca 0.00 -0.40 -0.33 0.00 0.71 0.00 0.00 52.55 52.53 1mfn s ASP 3 Cb 0.00 -2.55 -0.21 0.00 1.01 0.00 0.00 42.92 41.17 1mfn s ASP 3 CO 0.00 -2.03 2.62 -1.20 0.21 0.00 0.00 175.17 174.76 1mfn n SER 4 N 10.74 0.41 -3.87 0.27 7.64 -1.26 -4.02 113.62 123.53 1mfn n SER 4 Ca 0.16 0.23 -0.42 0.00 1.01 0.00 0.00 58.87 59.85 1mfn n SER 4 Cb 0.50 -0.94 -0.02 0.00 -1.01 0.00 0.00 64.21 62.75 1mfn n SER 4 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 1mfn n PRO 5 N 8.38 2.55 0.00 1.43 -0.04 -1.26 -4.77 135.00 141.29 1mfn n PRO 5 Ca 0.64 -2.53 0.00 0.00 -0.04 0.00 0.00 63.50 61.57 1mfn n PRO 5 Cb 0.04 -3.26 0.00 0.00 -0.04 0.00 0.00 33.50 30.23 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 5.62 0.00 -1.83 0.52 -2.24 -1.26 -4.49 114.28 110.60 1mfn n THR 6 Ca 0.51 0.00 -0.09 0.00 -2.27 0.00 0.00 64.05 62.20 1mfn n THR 6 Cb 0.41 -0.04 -0.02 0.00 -2.10 0.00 0.00 70.33 68.58 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 3.87 0.22 3.55 3.38 0.00 -1.26 -1.87 105.19 113.07 1mfn n GLY 7 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.83 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 0.97 -3.68 1.61 -0.00 -1.26 -3.96 117.46 108.80 1mfn n PHE 8 Ca -0.10 0.02 -0.26 0.00 -0.00 0.00 0.00 57.45 57.11 1mfn n PHE 8 Cb 0.43 -2.23 -0.17 0.00 -0.00 0.00 0.00 39.48 37.51 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 9.05 2.38 0.04 -2.13 -1.08 -0.52 -5.03 116.67 119.38 1mfn s ASP 9 Ca 1.03 -0.58 -0.25 0.00 -0.52 0.00 0.00 52.55 52.23 1mfn s ASP 9 Cb -0.31 -0.39 -0.05 0.00 -1.46 0.00 0.00 42.92 40.70 1mfn s ASP 9 CO 0.21 -0.31 0.78 -0.44 0.52 0.00 0.00 175.17 175.94 1mfn s SER 10 N 2.01 7.23 0.00 -0.34 0.01 -1.26 -1.79 113.70 119.56 1mfn s SER 10 Ca 0.01 1.47 0.00 0.00 1.31 0.00 0.00 55.95 58.74 1mfn s SER 10 Cb -0.16 -2.48 0.00 0.00 0.21 0.00 0.00 66.02 63.60 1mfn s SER 10 CO -0.08 -0.00 0.00 -1.54 0.41 0.00 0.00 173.24 172.03 1mfn n SER 11 N 2.88 0.00 -3.03 2.44 3.41 -0.33 -4.87 113.62 114.13 1mfn n SER 11 Ca -0.02 -0.08 -0.16 0.00 -0.26 0.00 0.00 58.87 58.35 1mfn n SER 11 Cb 0.50 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 64.44 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 -0.17 -2.75 -4.56 4.04 9.92 -1.26 -1.83 116.55 119.94 1mfn n ASP 12 Ca 0.00 -0.09 -0.43 0.00 -0.53 0.00 0.00 54.79 53.74 1mfn n ASP 12 Cb 0.00 -2.36 -0.05 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 -2.62 4.60 0.50 0.53 1.01 -1.26 -1.39 121.20 122.57 1mfn s ILE 13 Ca 0.24 0.65 0.02 0.00 0.00 0.00 0.00 60.65 61.55 1mfn s ILE 13 Cb -0.13 -4.34 0.10 0.00 0.01 0.00 0.00 42.46 38.10 1mfn s ILE 13 CO 0.29 -0.70 0.69 0.41 0.00 0.00 0.00 174.94 175.64 1mfn n THR 14 N 6.16 0.00 0.91 2.92 -1.04 0.70 -4.60 114.28 119.33 1mfn n THR 14 Ca 0.04 -1.20 0.12 0.00 -2.04 0.00 0.00 64.05 60.97 1mfn n THR 14 Cb 0.48 -0.94 0.27 0.00 -1.82 0.00 0.00 70.33 68.33 1mfn n THR 14 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1mfn n ALA 15 N -2.83 3.28 -1.74 2.41 0.00 -1.26 -2.87 120.51 117.50 1mfn n ALA 15 Ca -0.11 -0.30 0.04 0.00 0.00 0.00 0.00 53.44 53.07 1mfn n ALA 15 Cb 0.43 -1.17 0.06 0.00 0.00 0.00 0.00 19.45 18.78 1mfn n ALA 15 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1mfn n ASN 16 N -1.63 1.02 0.00 0.00 4.13 -1.26 -2.35 115.26 115.17 1mfn n ASN 16 Ca 0.05 -2.51 0.00 0.00 1.68 0.00 0.00 54.58 53.80 1mfn n ASN 16 Cb 0.36 -0.31 0.00 0.00 -1.54 0.00 0.00 39.78 38.28 1mfn n ASN 16 CO 0.00 0.00 0.00 -1.54 0.28 0.00 0.00 177.26 176.00 1mfn n SER 17 N -0.49 0.00 -3.99 6.41 3.41 -1.25 -1.37 113.62 116.35 1mfn n SER 17 Ca 0.07 0.00 -0.12 0.00 -0.26 0.00 0.00 58.87 58.57 1mfn n SER 17 Cb 0.74 0.00 -0.12 0.00 -0.26 0.00 0.00 64.21 64.57 1mfn n SER 17 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 1mfn s PHE 18 N 0.00 0.40 0.33 7.33 -0.12 0.07 0.25 117.98 126.25 1mfn s PHE 18 Ca 0.00 -0.37 0.08 0.00 -0.05 0.00 0.00 56.93 56.59 1mfn s PHE 18 Cb 0.00 -0.25 -0.04 0.00 -0.63 0.00 0.00 43.02 42.09 1mfn s PHE 18 CO 0.00 -0.10 0.12 0.99 -0.05 0.00 0.00 175.22 176.19 1mfn s THR 19 N -1.01 3.04 0.24 -4.49 2.01 -0.49 -0.83 115.64 114.11 1mfn s THR 19 Ca -0.09 -1.73 0.06 0.00 0.31 0.00 0.00 61.69 60.25 1mfn s THR 19 Cb -0.07 -2.96 -0.05 0.00 0.01 0.00 0.00 72.50 69.42 1mfn s THR 19 CO -0.00 -0.20 -0.08 -0.69 -0.69 0.00 0.00 174.62 172.95 1mfn s VAL 20 N -2.42 1.55 -0.16 3.82 1.01 -0.44 -1.18 120.40 122.57 1mfn s VAL 20 Ca 0.37 -2.14 -0.13 0.00 0.00 0.00 0.00 61.98 60.08 1mfn s VAL 20 Cb -0.03 -2.25 0.05 0.00 0.00 0.00 0.00 36.38 34.15 1mfn s VAL 20 CO 0.22 -0.44 0.42 -1.00 0.00 0.00 0.00 175.10 174.30 1mfn s HIS 21 N -3.08 -0.50 0.10 5.22 3.76 -0.74 -1.88 115.29 118.17 1mfn s HIS 21 Ca 0.26 1.18 0.03 0.00 -0.15 0.00 0.00 55.06 56.38 1mfn s HIS 21 Cb 0.02 0.19 -0.04 0.00 1.11 0.00 0.00 32.58 33.87 1mfn s HIS 21 CO 0.09 -0.26 -0.09 1.67 -0.85 0.00 0.00 174.74 175.30 1mfn s TRP 22 N 0.53 1.01 0.63 1.40 -2.14 -0.26 -1.44 118.94 118.67 1mfn s TRP 22 Ca -0.02 -0.72 -0.14 0.00 2.66 0.00 0.00 56.10 57.88 1mfn s TRP 22 Cb -0.04 -0.56 -0.02 0.00 -3.10 0.00 0.00 33.47 29.75 1mfn s TRP 22 CO -0.03 -0.03 1.06 0.08 -2.66 0.00 0.00 176.95 175.36 1mfn s VAL 23 N -2.73 3.87 0.12 -0.66 1.01 -0.78 -4.80 120.40 116.44 1mfn s VAL 23 Ca 0.07 0.78 0.02 0.00 0.00 0.00 0.00 61.98 62.85 1mfn s VAL 23 Cb -0.01 -3.37 -0.04 0.00 0.00 0.00 0.00 36.38 32.96 1mfn s VAL 23 CO -0.01 -0.63 0.22 0.00 0.00 0.00 0.00 175.10 174.68 1mfn s ALA 24 N -2.67 3.86 0.09 5.51 0.00 -1.26 -4.11 121.76 123.19 1mfn s ALA 24 Ca 0.62 -1.02 -0.30 0.00 0.00 0.00 0.00 51.96 51.25 1mfn s ALA 24 Cb -0.15 -1.68 -0.05 0.00 0.00 0.00 0.00 23.12 21.24 1mfn s ALA 24 CO 0.43 0.62 0.98 -1.25 0.00 0.00 0.00 175.76 176.54 1mfn s PRO 25 N -2.96 4.66 0.00 0.00 0.04 -1.26 -4.81 135.00 130.68 1mfn s PRO 25 Ca 0.33 1.47 0.14 0.00 0.04 0.00 0.00 61.00 62.98 1mfn s PRO 25 Cb -0.11 -3.39 0.73 0.00 0.04 0.00 0.00 34.50 31.77 1mfn s PRO 25 CO 0.27 0.15 1.39 0.54 0.04 0.00 0.00 177.00 179.39 1mfn n ARG 26 N 2.98 0.20 -2.87 4.56 1.74 -1.26 -4.72 116.66 117.30 1mfn n ARG 26 Ca 0.03 0.15 -0.20 0.00 -0.77 0.00 0.00 57.85 57.06 1mfn n ARG 26 Cb 0.49 -1.50 0.05 0.00 -1.02 0.00 0.00 32.46 30.48 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 -2.57 4.32 -0.53 7.54 0.00 -1.26 -5.03 121.76 124.22 1mfn s ALA 27 Ca 0.14 -1.75 -0.28 0.00 0.00 0.00 0.00 51.96 50.06 1mfn s ALA 27 Cb 0.10 -1.74 0.02 0.00 0.00 0.00 0.00 23.12 21.50 1mfn s ALA 27 CO 0.22 -0.75 1.28 -1.25 0.00 0.00 0.00 175.76 175.26 1mfn s PRO 28 N -4.66 3.50 0.10 0.00 0.04 -1.26 -4.95 135.00 127.76 1mfn s PRO 28 Ca 0.59 0.47 0.01 0.00 0.04 0.00 0.00 61.00 62.12 1mfn s PRO 28 Cb -0.08 -4.03 0.01 0.00 0.04 0.00 0.00 34.50 30.44 1mfn s PRO 28 CO 0.38 -1.68 0.08 0.44 0.04 0.00 0.00 177.00 176.26 1mfn n ILE 29 N 6.83 0.00 0.22 0.56 -5.35 -1.26 -4.92 119.36 115.43 1mfn n ILE 29 Ca 0.12 -0.38 0.02 0.00 -0.27 0.00 0.00 62.75 62.24 1mfn n ILE 29 Cb 0.49 -0.48 -0.01 0.00 -1.74 0.00 0.00 39.64 37.90 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 -0.79 0.00 0.00 7.28 -2.24 -0.24 -4.90 114.28 113.39 1mfn n THR 30 Ca 0.00 -0.42 0.00 0.00 -2.27 0.00 0.00 64.05 61.36 1mfn n THR 30 Cb 0.11 1.03 0.00 0.00 -2.10 0.00 0.00 70.33 69.37 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 0.87 0.93 3.32 3.38 0.00 -1.21 -4.24 105.19 108.24 1mfn n GLY 31 Ca 0.02 -2.11 -0.19 0.00 0.00 0.00 0.00 46.02 43.73 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 -1.01 1.67 -0.09 1.61 1.51 0.72 -2.55 117.35 119.21 1mfn s TYR 32 Ca 0.00 -0.55 0.00 0.00 -1.01 0.00 0.00 57.07 55.51 1mfn s TYR 32 Cb 0.00 -0.81 -0.03 0.00 -0.11 0.00 0.00 41.96 41.02 1mfn s TYR 32 CO 0.00 0.31 -0.09 0.42 -1.11 0.00 0.00 175.55 175.08 1mfn s ILE 33 N -2.64 3.50 -0.14 2.71 1.01 -0.90 0.84 121.20 125.58 1mfn s ILE 33 Ca 0.19 -0.54 0.02 0.00 0.00 0.00 0.00 60.65 60.32 1mfn s ILE 33 Cb -0.02 -2.45 0.01 0.00 0.01 0.00 0.00 42.46 40.01 1mfn s ILE 33 CO 0.06 0.56 -0.20 -0.63 0.00 0.00 0.00 174.94 174.73 1mfn s ILE 34 N -0.37 2.21 -0.09 2.92 -1.09 0.99 -1.84 121.20 123.92 1mfn s ILE 34 Ca 0.05 -0.93 0.03 0.00 -2.23 0.00 0.00 60.65 57.57 1mfn s ILE 34 Cb -0.12 -1.89 0.00 0.00 -1.58 0.00 0.00 42.46 38.87 1mfn s ILE 34 CO 0.02 0.54 -0.20 -0.60 -1.23 0.00 0.00 174.94 173.47 1mfn s ARG 35 N 0.79 2.65 -0.01 2.79 3.52 -0.16 0.23 118.95 128.75 1mfn s ARG 35 Ca -0.07 -0.74 0.06 0.00 -0.13 0.00 0.00 55.73 54.85 1mfn s ARG 35 Cb -0.16 -2.04 -0.02 0.00 -1.56 0.00 0.00 34.95 31.18 1mfn s ARG 35 CO -0.01 0.12 -0.19 -3.38 -0.81 0.00 0.00 175.30 171.03 1mfn s HIS 36 N 0.46 1.74 -0.30 5.12 -3.43 -1.08 0.72 115.29 118.53 1mfn s HIS 36 Ca -0.17 -0.33 -0.14 0.00 -0.80 0.00 0.00 55.06 53.62 1mfn s HIS 36 Cb -0.17 -1.12 0.15 0.00 -1.43 0.00 0.00 32.58 30.01 1mfn s HIS 36 CO 0.07 -0.03 0.87 -3.38 -2.00 0.00 0.00 174.74 170.27 1mfn s HIS 37 N -0.46 -0.88 0.00 0.38 -3.43 0.29 -3.82 115.29 107.36 1mfn s HIS 37 Ca 0.07 1.57 0.00 0.00 -0.80 0.00 0.00 55.06 55.90 1mfn s HIS 37 Cb -0.07 0.53 0.00 0.00 -1.43 0.00 0.00 32.58 31.60 1mfn s HIS 37 CO -0.01 -0.44 0.00 0.00 -2.00 0.00 0.00 174.74 172.30 1mfn n ALA 38 N 4.86 0.00 -0.50 -1.38 0.00 -1.26 0.13 120.51 122.36 1mfn n ALA 38 Ca -0.12 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.32 1mfn n ALA 38 Cb 0.53 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.98 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 -0.65 0.00 -2.72 0.00 4.71 -1.23 -4.20 120.64 116.55 1mfn n GLU 39 Ca 0.00 0.64 -0.07 0.00 -0.01 0.00 0.00 57.16 57.72 1mfn n GLU 39 Cb 0.00 -1.25 0.07 0.00 -1.01 0.00 0.00 31.44 29.25 1mfn n GLU 39 CO 0.00 0.00 0.00 -2.39 0.09 0.00 0.00 177.13 174.83 1mfn n HIS 40 N -1.84 -2.24 -1.54 -0.32 1.44 -1.26 -4.96 115.22 104.51 1mfn n HIS 40 Ca 0.00 -1.47 -0.31 0.00 -2.01 0.00 0.00 57.72 53.93 1mfn n HIS 40 Cb 0.00 1.43 0.07 0.00 0.12 0.00 0.00 29.99 31.60 1mfn n HIS 40 CO 0.00 0.00 0.00 -1.54 -2.81 0.00 0.00 176.34 171.99 1mfn s SER 41 N -1.08 5.00 0.00 4.39 1.04 -1.26 -4.90 113.70 116.89 1mfn s SER 41 Ca 0.27 1.53 0.24 0.00 0.48 0.00 0.00 55.95 58.47 1mfn s SER 41 Cb 0.25 -2.35 1.39 0.00 0.10 0.00 0.00 66.02 65.41 1mfn s SER 41 CO -0.16 -1.67 1.78 0.55 0.98 0.00 0.00 173.24 174.72 1mfn n VAL 42 N -3.27 0.04 -3.05 5.02 3.14 -1.26 -4.61 118.33 114.33 1mfn n VAL 42 Ca 0.07 0.01 -0.43 0.00 -2.96 0.00 0.00 64.34 61.03 1mfn n VAL 42 Cb 0.54 -0.64 -0.06 0.00 -1.06 0.00 0.00 33.84 32.63 1mfn n VAL 42 CO 0.00 0.00 0.00 -0.83 -6.46 0.00 0.00 176.83 169.54 1mfn s GLY 43 N -2.07 1.67 0.12 7.55 0.00 -1.26 -5.00 107.32 108.33 1mfn s GLY 43 Ca 0.34 -1.14 -0.34 0.00 0.00 0.00 0.00 44.72 43.58 1mfn s GLY 43 CO 0.28 1.63 1.02 0.54 0.00 0.00 0.00 173.10 176.57 1mfn n ARG 44 N 6.44 0.56 -2.33 2.90 5.12 -1.26 -4.90 116.66 123.18 1mfn n ARG 44 Ca -0.00 0.20 -0.32 0.00 -1.93 0.00 0.00 57.85 55.80 1mfn n ARG 44 Cb 0.48 -1.61 -0.03 0.00 -1.16 0.00 0.00 32.46 30.14 1mfn n ARG 44 CO 0.00 0.00 0.00 -1.25 -1.93 0.00 0.00 177.63 174.45 1mfn s PRO 45 N -0.32 3.84 0.29 5.56 0.04 -1.26 -5.08 135.00 138.07 1mfn s PRO 45 Ca 0.78 0.99 0.08 0.00 0.04 0.00 0.00 61.00 62.89 1mfn s PRO 45 Cb -1.01 -2.12 -0.04 0.00 0.04 0.00 0.00 34.50 31.37 1mfn s PRO 45 CO 0.54 -0.36 0.13 -0.98 0.04 0.00 0.00 177.00 176.37 1mfn s ARG 46 N -4.10 2.56 -0.35 4.56 1.04 -1.25 -5.01 118.95 116.40 1mfn s ARG 46 Ca 0.59 -1.33 0.04 0.00 -1.04 0.00 0.00 55.73 54.00 1mfn s ARG 46 Cb -0.11 -2.33 0.10 0.00 -2.04 0.00 0.00 34.95 30.58 1mfn s ARG 46 CO 0.33 0.27 0.07 -0.65 -0.04 0.00 0.00 175.30 175.28 1mfn s GLN 47 N -3.81 1.53 -0.54 3.89 -0.21 -1.26 -2.62 119.66 116.62 1mfn s GLN 47 Ca 0.35 -1.92 -0.25 0.00 0.02 0.00 0.00 55.36 53.55 1mfn s GLN 47 Cb -0.06 -3.23 0.04 0.00 1.00 0.00 0.00 33.01 30.76 1mfn s GLN 47 CO 0.23 -0.95 1.00 -0.51 -2.12 0.00 0.00 175.29 172.93 1mfn s ASP 48 N 0.86 6.39 0.11 5.90 1.11 0.63 -4.81 116.67 126.86 1mfn s ASP 48 Ca 0.11 -0.17 -0.25 0.00 0.18 0.00 0.00 52.55 52.42 1mfn s ASP 48 Cb -0.20 -2.47 -0.07 0.00 1.07 0.00 0.00 42.92 41.26 1mfn s ASP 48 CO -0.07 -1.26 0.76 -0.13 1.18 0.00 0.00 175.17 175.65 1mfn s ARG 49 N 4.15 4.52 0.18 8.23 1.81 -1.26 -0.01 118.95 136.58 1mfn s ARG 49 Ca 0.34 1.10 0.09 0.00 -1.72 0.00 0.00 55.73 55.54 1mfn s ARG 49 Cb -0.11 -3.30 -0.04 0.00 -0.45 0.00 0.00 34.95 31.05 1mfn s ARG 49 CO 0.22 0.45 -0.08 0.14 -0.68 0.00 0.00 175.30 175.35 1mfn s VAL 50 N -0.69 3.24 0.96 3.52 -7.23 0.25 -4.82 120.40 115.63 1mfn s VAL 50 Ca 0.37 -1.66 -0.15 0.00 -1.81 0.00 0.00 61.98 58.73 1mfn s VAL 50 Cb -0.22 -2.62 0.18 0.00 0.56 0.00 0.00 36.38 34.28 1mfn s VAL 50 CO 0.24 -0.13 1.24 -2.16 -0.31 0.00 0.00 175.10 173.99 1mfn s PRO 51 N -2.89 0.73 0.28 4.82 0.04 -1.26 -0.20 135.00 136.53 1mfn s PRO 51 Ca 0.25 -0.17 0.26 0.00 0.04 0.00 0.00 61.00 61.38 1mfn s PRO 51 Cb -0.09 -1.83 0.85 0.00 0.04 0.00 0.00 34.50 33.47 1mfn s PRO 51 CO 0.16 -2.39 1.75 -1.00 0.04 0.00 0.00 177.00 175.56 1mfn h PRO 52 N -1.63 0.00 -0.38 0.56 0.13 -1.87 -2.91 132.00 125.89 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 1.27 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.40 1mfn h PRO 52 CO 0.46 0.00 0.00 0.43 -0.23 0.00 0.00 178.00 178.66 1mfn n SER 53 N -2.44 1.89 -3.86 1.44 7.64 -1.26 -4.79 113.62 112.24 1mfn n SER 53 Ca 0.04 -2.05 -0.15 0.00 1.01 0.00 0.00 58.87 57.72 1mfn n SER 53 Cb 0.37 -0.26 -0.15 0.00 -1.01 0.00 0.00 64.21 63.16 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 -1.59 0.24 -0.09 1.43 1.81 -1.10 -5.02 118.95 114.64 1mfn s ARG 54 Ca 0.22 -0.00 0.13 0.00 -1.72 0.00 0.00 55.73 54.35 1mfn s ARG 54 Cb 0.12 -0.33 0.19 0.00 -0.45 0.00 0.00 34.95 34.48 1mfn s ARG 54 CO 0.14 -0.04 1.08 0.27 -0.68 0.00 0.00 175.30 176.07 1mfn n ASN 55 N 3.58 1.76 -3.79 0.23 6.94 -1.26 -4.67 115.26 118.04 1mfn n ASN 55 Ca -0.20 -2.69 -0.13 0.00 -0.02 0.00 0.00 54.58 51.54 1mfn n ASN 55 Cb 0.55 -0.33 -0.12 0.00 -2.36 0.00 0.00 39.78 37.52 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 -2.21 -0.22 -0.18 0.53 1.04 -1.26 -1.10 113.70 110.29 1mfn s SER 56 Ca 0.21 0.43 0.00 0.00 0.48 0.00 0.00 55.95 57.07 1mfn s SER 56 Cb 0.19 0.41 0.02 0.00 0.10 0.00 0.00 66.02 66.74 1mfn s SER 56 CO 0.02 -0.08 -0.18 -0.51 0.98 0.00 0.00 173.24 173.46 1mfn s ILE 57 N 0.27 2.21 -0.06 -1.02 2.07 -0.79 -4.90 121.20 118.98 1mfn s ILE 57 Ca -0.01 -0.89 -0.18 0.00 -1.41 0.00 0.00 60.65 58.15 1mfn s ILE 57 Cb -0.03 -1.93 -0.05 0.00 0.13 0.00 0.00 42.46 40.58 1mfn s ILE 57 CO -0.01 0.53 0.51 -0.89 -1.91 0.00 0.00 174.94 173.17 1mfn s THR 58 N 1.31 5.08 -0.03 4.00 2.01 -1.26 -1.33 115.64 125.41 1mfn s THR 58 Ca 0.05 1.04 0.06 0.00 0.31 0.00 0.00 61.69 63.15 1mfn s THR 58 Cb -0.13 -3.84 -0.02 0.00 0.01 0.00 0.00 72.50 68.51 1mfn s THR 58 CO -0.12 0.39 -0.21 -0.76 -0.69 0.00 0.00 174.62 173.24 1mfn s LEU 59 N 0.12 2.38 0.37 4.42 1.43 -0.01 -4.96 118.68 122.43 1mfn s LEU 59 Ca 0.27 -0.35 0.03 0.00 -1.03 0.00 0.00 54.13 53.05 1mfn s LEU 59 Cb -0.16 -1.44 -0.04 0.00 0.03 0.00 0.00 46.19 44.58 1mfn s LEU 59 CO 0.13 0.33 0.10 0.42 0.23 0.00 0.00 176.35 177.55 1mfn s THR 60 N -0.69 0.84 -0.90 5.49 -4.23 -1.26 -0.75 115.64 114.14 1mfn s THR 60 Ca 0.11 -2.00 -0.07 0.00 -1.18 0.00 0.00 61.69 58.55 1mfn s THR 60 Cb -0.10 -2.52 -0.01 0.00 1.34 0.00 0.00 72.50 71.21 1mfn s THR 60 CO 0.00 0.00 0.72 0.59 -0.54 0.00 0.00 174.62 175.39 1mfn n ASN 61 N -1.03 -6.20 -3.93 3.99 4.13 -0.47 -4.84 115.26 106.90 1mfn n ASN 61 Ca -0.05 -0.64 -0.19 0.00 1.68 0.00 0.00 54.58 55.39 1mfn n ASN 61 Cb 0.66 -3.74 -0.16 0.00 -1.54 0.00 0.00 39.78 35.00 1mfn n ASN 61 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 1mfn s LEU 62 N -5.08 1.61 0.18 3.41 1.43 -1.16 -4.98 118.68 114.09 1mfn s LEU 62 Ca 0.17 -0.13 -0.32 0.00 -1.03 0.00 0.00 54.13 52.82 1mfn s LEU 62 Cb -0.05 -0.42 -0.16 0.00 0.03 0.00 0.00 46.19 45.59 1mfn s LEU 62 CO 0.82 0.01 1.13 0.59 0.23 0.00 0.00 176.35 179.13 1mfn n ASN 63 N 3.57 1.24 -4.70 2.29 3.02 -1.26 -4.18 115.26 115.23 1mfn n ASN 63 Ca -0.21 1.14 -0.42 0.00 -0.03 0.00 0.00 54.58 55.07 1mfn n ASN 63 Cb 0.53 -1.21 -0.03 0.00 -0.61 0.00 0.00 39.78 38.47 1mfn n ASN 63 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 1mfn s PRO 64 N -0.46 4.47 -0.03 3.52 0.04 -0.99 -4.01 135.00 137.53 1mfn s PRO 64 Ca 0.72 1.53 -0.00 0.00 0.04 0.00 0.00 61.00 63.29 1mfn s PRO 64 Cb -0.85 -3.47 -0.00 0.00 0.04 0.00 0.00 34.50 30.22 1mfn s PRO 64 CO 0.53 -0.22 0.03 0.41 0.04 0.00 0.00 177.00 177.79 1mfn n GLY 65 N 3.09 0.75 3.24 0.56 0.00 0.74 -4.73 105.19 108.84 1mfn n GLY 65 Ca 0.08 -0.25 -0.13 0.00 0.00 0.00 0.00 46.02 45.72 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 -3.01 0.01 0.16 2.61 2.01 -1.04 -4.87 115.64 111.51 1mfn s THR 66 Ca 0.01 -0.11 -0.30 0.00 0.31 0.00 0.00 61.69 61.61 1mfn s THR 66 Cb -0.00 -0.51 -0.07 0.00 0.01 0.00 0.00 72.50 71.92 1mfn s THR 66 CO 0.02 -0.06 1.14 -1.61 -0.69 0.00 0.00 174.62 173.43 1mfn s GLU 67 N -0.16 4.54 -0.36 4.92 2.02 -1.26 0.27 118.70 128.67 1mfn s GLU 67 Ca -0.03 1.77 0.03 0.00 0.02 0.00 0.00 54.97 56.75 1mfn s GLU 67 Cb -0.03 -3.28 0.11 0.00 0.10 0.00 0.00 34.13 31.03 1mfn s GLU 67 CO 0.01 -0.02 0.10 0.71 0.02 0.00 0.00 175.26 176.08 1mfn s TYR 68 N 0.01 3.13 0.27 1.61 2.02 0.29 -3.56 117.35 121.12 1mfn s TYR 68 Ca 0.52 -2.72 -0.31 0.00 -0.37 0.00 0.00 57.07 54.19 1mfn s TYR 68 Cb -0.30 -2.58 -0.12 0.00 -0.40 0.00 0.00 41.96 38.56 1mfn s TYR 68 CO 0.35 -0.90 1.63 0.28 -1.57 0.00 0.00 175.55 175.34 1mfn n VAL 69 N 4.19 0.73 -4.00 0.71 0.31 0.12 -2.40 118.33 118.00 1mfn n VAL 69 Ca 0.03 -0.18 -0.15 0.00 -0.01 0.00 0.00 64.34 64.03 1mfn n VAL 69 Cb 0.40 -1.96 -0.15 0.00 -0.91 0.00 0.00 33.84 31.22 1mfn n VAL 69 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 1mfn s VAL 70 N 0.32 0.21 -0.08 2.52 1.01 0.28 0.10 120.40 124.76 1mfn s VAL 70 Ca 0.67 -0.06 0.03 0.00 0.00 0.00 0.00 61.98 62.62 1mfn s VAL 70 Cb -0.50 -0.21 -0.02 0.00 0.00 0.00 0.00 36.38 35.65 1mfn s VAL 70 CO 0.44 0.08 -0.18 -0.94 0.00 0.00 0.00 175.10 174.50 1mfn s SER 71 N 0.22 3.63 0.02 3.32 1.04 0.22 -1.01 113.70 121.14 1mfn s SER 71 Ca -0.02 -0.37 0.09 0.00 0.48 0.00 0.00 55.95 56.13 1mfn s SER 71 Cb -0.04 -1.11 -0.03 0.00 0.10 0.00 0.00 66.02 64.94 1mfn s SER 71 CO -0.01 0.24 -0.26 -0.63 0.98 0.00 0.00 173.24 173.57 1mfn s ILE 72 N -0.14 2.09 0.10 -1.02 -1.09 -1.09 -0.99 121.20 119.07 1mfn s ILE 72 Ca -0.03 -1.29 -0.00 0.00 -2.23 0.00 0.00 60.65 57.10 1mfn s ILE 72 Cb -0.14 -1.77 -0.04 0.00 -1.58 0.00 0.00 42.46 38.93 1mfn s ILE 72 CO 0.04 0.43 -0.01 -0.63 -1.23 0.00 0.00 174.94 173.54 1mfn s ILE 73 N -0.74 0.34 -0.32 2.92 -1.09 -0.77 -1.95 121.20 119.59 1mfn s ILE 73 Ca 0.11 -1.89 -0.01 0.00 -2.23 0.00 0.00 60.65 56.63 1mfn s ILE 73 Cb -0.10 -1.78 0.11 0.00 -1.58 0.00 0.00 42.46 39.11 1mfn s ILE 73 CO 0.01 -0.75 0.13 0.00 -1.23 0.00 0.00 174.94 173.10 1mfn s ALA 74 N -3.86 1.29 0.21 9.38 0.00 -1.26 -2.12 121.76 125.39 1mfn s ALA 74 Ca 0.15 -1.61 -0.01 0.00 0.00 0.00 0.00 51.96 50.49 1mfn s ALA 74 Cb 0.07 -1.58 -0.04 0.00 0.00 0.00 0.00 23.12 21.57 1mfn s ALA 74 CO -0.04 -1.74 0.40 0.14 0.00 0.00 0.00 175.76 174.52 1mfn s VAL 75 N 1.59 5.20 -0.32 0.00 -7.23 -1.06 0.63 120.40 119.21 1mfn s VAL 75 Ca 0.11 -0.36 0.16 0.00 -1.81 0.00 0.00 61.98 60.08 1mfn s VAL 75 Cb -0.18 -3.74 0.47 0.00 0.56 0.00 0.00 36.38 33.49 1mfn s VAL 75 CO -0.24 -0.19 1.06 -3.20 -0.31 0.00 0.00 175.10 172.22 1mfn n ASN 76 N -0.70 2.55 0.00 4.85 5.15 -1.21 -1.08 115.26 124.82 1mfn n ASN 76 Ca -0.05 -2.84 0.00 0.00 -0.60 0.00 0.00 54.58 51.09 1mfn n ASN 76 Cb 0.54 -0.48 0.00 0.00 -0.53 0.00 0.00 39.78 39.31 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 -0.37 2.03 0.76 8.20 0.00 -1.26 -3.25 105.19 111.29 1mfn n GLY 77 Ca 0.19 -0.15 0.12 0.00 0.00 0.00 0.00 46.02 46.18 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 2.01 -2.29 1.61 0.00 -1.26 -4.92 116.66 111.82 1mfn n ARG 78 Ca 0.00 -1.50 -0.09 0.00 -0.00 0.00 0.00 57.85 56.26 1mfn n ARG 78 Cb 0.00 -1.46 0.00 0.00 0.00 0.00 0.00 32.46 31.01 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 0.76 1.20 -3.15 -0.14 1.02 -1.20 -5.13 120.64 114.00 1mfn n GLU 79 Ca 0.17 -1.20 0.04 0.00 -0.02 0.00 0.00 57.16 56.16 1mfn n GLU 79 Cb 0.45 0.12 -0.00 0.00 -0.02 0.00 0.00 31.44 31.99 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 -2.79 0.47 1.44 3.49 2.02 -1.26 -3.31 118.70 118.75 1mfn s GLU 80 Ca 0.11 0.47 -0.24 0.00 0.02 0.00 0.00 54.97 55.33 1mfn s GLU 80 Cb -0.01 0.21 0.37 0.00 0.10 0.00 0.00 34.13 34.81 1mfn s GLU 80 CO 0.07 -0.87 0.84 0.45 0.02 0.00 0.00 175.26 175.77 1mfn n SER 81 N 5.35 -4.14 -4.75 -0.19 2.88 0.21 -4.92 113.62 108.05 1mfn n SER 81 Ca 0.06 -0.85 -0.40 0.00 -1.33 0.00 0.00 58.87 56.35 1mfn n SER 81 Cb 0.55 -0.97 -0.05 0.00 -0.75 0.00 0.00 64.21 62.99 1mfn n SER 81 CO 0.00 0.00 0.00 -2.16 -1.23 0.00 0.00 175.04 171.65 1mfn s PRO 82 N -4.99 4.71 0.25 -1.46 0.04 -1.26 -4.66 135.00 127.63 1mfn s PRO 82 Ca 0.65 1.64 -0.30 0.00 0.04 0.00 0.00 61.00 63.03 1mfn s PRO 82 Cb -0.11 -3.26 -0.09 0.00 0.04 0.00 0.00 34.50 31.07 1mfn s PRO 82 CO 0.54 0.28 1.00 -1.25 0.04 0.00 0.00 177.00 177.61 1mfn s PRO 83 N -0.93 4.78 -0.37 0.56 0.04 -1.26 -4.47 135.00 133.36 1mfn s PRO 83 Ca 0.45 1.61 0.00 0.00 0.04 0.00 0.00 61.00 63.10 1mfn s PRO 83 Cb -0.28 -3.25 0.13 0.00 0.04 0.00 0.00 34.50 31.14 1mfn s PRO 83 CO 0.35 0.40 0.20 -0.48 0.04 0.00 0.00 177.00 177.52 1mfn s LEU 84 N -1.26 1.57 0.28 -3.56 0.05 -0.82 -5.05 118.68 109.88 1mfn s LEU 84 Ca 0.42 -2.18 0.02 0.00 0.05 0.00 0.00 54.13 52.45 1mfn s LEU 84 Cb -0.28 -0.63 -0.03 0.00 -2.05 0.00 0.00 46.19 43.20 1mfn s LEU 84 CO 0.35 -0.32 0.44 -0.63 -0.55 0.00 0.00 176.35 175.65 1mfn s ILE 85 N 1.01 5.19 0.08 1.48 1.01 -1.26 -2.66 121.20 126.04 1mfn s ILE 85 Ca 0.16 -0.66 -0.26 0.00 0.00 0.00 0.00 60.65 59.89 1mfn s ILE 85 Cb -0.22 -3.84 0.08 0.00 0.01 0.00 0.00 42.46 38.49 1mfn s ILE 85 CO -0.05 -0.40 0.72 -0.83 0.00 0.00 0.00 174.94 174.38 1mfn s GLY 86 N -3.87 -0.55 -0.23 6.18 0.00 -0.18 -4.95 107.32 103.71 1mfn s GLY 86 Ca 0.37 0.78 -0.03 0.00 0.00 0.00 0.00 44.72 45.83 1mfn s GLY 86 CO 0.32 0.30 -0.04 1.20 0.00 0.00 0.00 173.10 174.87 1mfn s GLN 87 N -3.29 3.20 0.00 2.90 1.11 -1.26 -0.55 119.66 121.76 1mfn s GLN 87 Ca 0.02 -0.74 0.00 0.00 0.01 0.00 0.00 55.36 54.64 1mfn s GLN 87 Cb -0.01 -3.01 0.00 0.00 -1.01 0.00 0.00 33.01 28.98 1mfn s GLN 87 CO -0.10 -0.27 0.00 1.04 0.01 0.00 0.00 175.29 175.97 1mfn n GLN 88 N 4.76 3.60 -3.55 2.91 1.13 -1.01 -4.88 117.38 120.35 1mfn n GLN 88 Ca -0.18 0.00 -0.15 0.00 -1.94 0.00 0.00 57.00 54.73 1mfn n GLN 88 Cb 0.50 0.00 -0.06 0.00 0.11 0.00 0.00 30.24 30.79 1mfn n GLN 88 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1mfn s ALA 89 N -2.12 -1.82 0.21 -1.58 0.00 -1.26 0.11 121.76 115.30 1mfn s ALA 89 Ca 0.00 1.49 -0.30 0.00 0.00 0.00 0.00 51.96 53.15 1mfn s ALA 89 Cb 0.00 -0.36 -0.08 0.00 0.00 0.00 0.00 23.12 22.68 1mfn s ALA 89 CO 0.00 -0.35 1.12 0.95 0.00 0.00 0.00 175.76 177.49 1mfn s THR 90 N -0.93 3.67 1.04 0.00 -4.23 0.77 -4.81 115.64 111.16 1mfn s THR 90 Ca -0.07 1.51 -0.23 0.00 -1.18 0.00 0.00 61.69 61.72 1mfn s THR 90 Cb -0.01 -3.96 -0.07 0.00 1.34 0.00 0.00 72.50 69.80 1mfn s THR 90 CO 0.06 0.29 -0.82 0.52 -0.54 0.00 0.00 174.62 174.13 1mfn n VAL 91 N 2.02 0.00 -4.04 2.29 0.31 -1.14 -1.70 118.33 116.08 1mfn n VAL 91 Ca 0.02 -0.17 -0.35 0.00 -0.01 0.00 0.00 64.34 63.83 1mfn n VAL 91 Cb 0.45 -0.25 -0.11 0.00 -0.91 0.00 0.00 33.84 33.03 1mfn n VAL 91 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 1mfn s SER 92 N -1.35 5.31 -0.05 4.52 0.15 -1.26 0.26 113.70 121.28 1mfn s SER 92 Ca 0.45 -0.04 -0.23 0.00 0.70 0.00 0.00 55.95 56.83 1mfn s SER 92 Cb -0.02 -1.91 -0.18 0.00 -1.71 0.00 0.00 66.02 62.20 1mfn s SER 92 CO 0.68 0.12 0.95 0.44 1.20 0.00 0.00 173.24 176.62 1mfn h ASP 93 N 7.08 -0.12 -3.63 5.45 3.32 -1.91 -3.35 116.42 123.25 1mfn h ASP 93 Ca -0.36 -0.45 -0.68 0.00 0.02 0.00 0.00 57.03 55.56 1mfn h ASP 93 Cb 1.18 0.03 -0.18 0.00 0.22 0.00 0.00 39.33 40.58 1mfn h ASP 93 CO 0.65 0.47 -0.71 -0.63 -1.72 0.00 0.00 179.24 177.30 1mfn s ILE 94 N -3.46 3.59 0.00 0.35 1.01 -1.26 -4.61 121.20 116.81 1mfn s ILE 94 Ca -0.14 -0.80 0.00 0.00 0.00 0.00 0.00 60.65 59.71 1mfn s ILE 94 Cb 0.00 -2.55 0.00 0.00 0.01 0.00 0.00 42.46 39.92 1mfn s ILE 94 CO 0.54 0.39 0.00 -0.81 0.00 0.00 0.00 174.94 175.06 1mfn n PRO 95 N 1.57 0.81 -3.63 2.79 -0.04 -1.26 -4.79 135.00 130.45 1mfn n PRO 95 Ca -0.15 0.00 -0.08 0.00 -0.04 0.00 0.00 63.50 63.23 1mfn n PRO 95 Cb 0.52 0.00 -0.02 0.00 -0.04 0.00 0.00 33.50 33.97 1mfn n PRO 95 CO 0.00 0.00 0.00 -0.98 -0.04 0.00 0.00 175.50 174.48 1mfn s ARG 96 N -0.44 1.27 -0.08 0.54 1.70 -0.94 -4.95 118.95 116.05 1mfn s ARG 96 Ca 0.00 -0.60 0.00 0.00 -0.47 0.00 0.00 55.73 54.66 1mfn s ARG 96 Cb 0.00 0.50 0.00 0.00 -0.57 0.00 0.00 34.95 34.88 1mfn s ARG 96 CO 0.00 -0.57 0.00 -3.47 -1.08 0.00 0.00 175.30 170.18 1mfn n ASP 97 N -0.39 -2.86 -4.55 -2.89 2.03 -1.26 -0.32 116.55 106.31 1mfn n ASP 97 Ca -0.09 0.02 -0.36 0.00 0.52 0.00 0.00 54.79 54.88 1mfn n ASP 97 Cb 0.62 -0.66 -0.03 0.00 -0.72 0.00 0.00 41.12 40.32 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 -0.18 3.33 0.00 -2.67 0.20 -1.26 -3.96 118.68 114.14 1mfn s LEU 98 Ca 0.00 0.73 -0.02 0.00 0.69 0.00 0.00 54.13 55.53 1mfn s LEU 98 Cb 0.00 -2.51 0.01 0.00 -0.43 0.00 0.00 46.19 43.25 1mfn s LEU 98 CO 0.00 -2.76 0.28 -1.84 -0.29 0.00 0.00 176.35 171.74 1mfn n GLU 99 N 9.06 0.40 -4.29 1.98 0.28 -1.03 -4.81 120.64 122.24 1mfn n GLU 99 Ca 0.32 -1.38 -0.28 0.00 -0.16 0.00 0.00 57.16 55.65 1mfn n GLU 99 Cb 0.53 1.39 -0.10 0.00 1.43 0.00 0.00 31.44 34.69 1mfn n GLU 99 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 1mfn s VAL 100 N -2.61 3.09 -0.02 3.84 0.11 -1.26 -1.02 120.40 122.53 1mfn s VAL 100 Ca 0.14 -1.57 0.01 0.00 -2.93 0.00 0.00 61.98 57.63 1mfn s VAL 100 Cb -0.01 -2.48 -0.01 0.00 -1.53 0.00 0.00 36.38 32.35 1mfn s VAL 100 CO 0.10 -0.02 0.03 2.30 -3.33 0.00 0.00 175.10 174.18 1mfn n ILE 101 N 0.37 0.00 -4.17 7.04 -5.35 0.56 -4.91 119.36 112.91 1mfn n ILE 101 Ca -0.13 -0.20 -0.11 0.00 -0.27 0.00 0.00 62.75 62.04 1mfn n ILE 101 Cb 0.54 0.68 -0.10 0.00 -1.74 0.00 0.00 39.64 39.03 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 -1.69 0.98 -0.29 -1.28 0.00 -1.25 -4.96 121.76 113.28 1mfn s ALA 102 Ca -0.00 -1.57 0.03 0.00 0.00 0.00 0.00 51.96 50.41 1mfn s ALA 102 Cb 0.01 1.24 0.18 0.00 0.00 0.00 0.00 23.12 24.54 1mfn s ALA 102 CO 0.04 -0.58 0.50 0.45 0.00 0.00 0.00 175.76 176.17 1mfn s SER 103 N -3.12 -0.65 0.54 0.00 0.15 -1.26 -2.51 113.70 106.85 1mfn s SER 103 Ca 0.34 0.06 -0.02 0.00 0.70 0.00 0.00 55.95 57.03 1mfn s SER 103 Cb 0.07 1.61 0.02 0.00 -1.71 0.00 0.00 66.02 66.00 1mfn s SER 103 CO 0.09 -0.32 0.80 0.42 1.20 0.00 0.00 173.24 175.43 1mfn s THR 104 N 2.70 3.30 -1.80 6.45 -4.23 0.56 -4.94 115.64 117.67 1mfn s THR 104 Ca 0.11 -0.41 0.15 0.00 -1.18 0.00 0.00 61.69 60.36 1mfn s THR 104 Cb -0.12 -3.27 0.37 0.00 1.34 0.00 0.00 72.50 70.82 1mfn s THR 104 CO -0.26 -0.22 1.34 -0.81 -0.54 0.00 0.00 174.62 174.13 1mfn n PRO 105 N -2.38 0.38 -0.37 3.99 -0.04 -1.26 -2.75 135.00 132.57 1mfn n PRO 105 Ca 0.05 0.05 0.00 0.00 -0.04 0.00 0.00 63.50 63.56 1mfn n PRO 105 Cb 0.59 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.55 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 -1.10 0.00 -3.58 0.52 -2.24 -1.26 -4.21 114.28 102.41 1mfn n THR 106 Ca 0.10 0.00 -0.05 0.00 -2.27 0.00 0.00 64.05 61.82 1mfn n THR 106 Cb 0.07 0.27 -0.02 0.00 -2.10 0.00 0.00 70.33 68.56 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 -0.32 -0.23 0.05 3.42 1.04 -1.11 -2.87 113.70 113.67 1mfn s SER 107 Ca 0.00 -0.07 -0.03 0.00 0.48 0.00 0.00 55.95 56.33 1mfn s SER 107 Cb 0.00 0.29 -0.02 0.00 0.10 0.00 0.00 66.02 66.39 1mfn s SER 107 CO 0.00 -0.49 0.03 -0.76 0.98 0.00 0.00 173.24 173.00 1mfn s LEU 108 N -2.50 2.13 -0.24 2.42 1.43 -0.35 0.21 118.68 121.79 1mfn s LEU 108 Ca 0.08 -0.74 -0.08 0.00 -1.03 0.00 0.00 54.13 52.36 1mfn s LEU 108 Cb -0.00 0.39 -0.04 0.00 0.03 0.00 0.00 46.19 46.57 1mfn s LEU 108 CO -0.06 -0.54 0.10 -0.22 0.23 0.00 0.00 176.35 175.86 1mfn s LEU 109 N -2.44 3.65 0.04 1.79 0.20 -1.04 -1.38 118.68 119.49 1mfn s LEU 109 Ca -0.00 -0.11 0.01 0.00 0.69 0.00 0.00 54.13 54.71 1mfn s LEU 109 Cb 0.02 -1.98 -0.04 0.00 -0.43 0.00 0.00 46.19 43.76 1mfn s LEU 109 CO -0.07 -0.00 0.12 0.27 -0.29 0.00 0.00 176.35 176.38 1mfn s ILE 110 N 1.42 4.88 -0.09 6.68 -4.36 -0.22 -0.32 121.20 129.19 1mfn s ILE 110 Ca 0.06 -0.51 -0.07 0.00 -0.26 0.00 0.00 60.65 59.87 1mfn s ILE 110 Cb -0.15 -3.31 0.03 0.00 1.25 0.00 0.00 42.46 40.28 1mfn s ILE 110 CO 0.05 0.22 0.22 -0.94 0.24 0.00 0.00 174.94 174.73 1mfn s SER 111 N -2.17 -0.23 0.00 4.36 1.04 -0.19 -1.03 113.70 115.48 1mfn s SER 111 Ca 0.28 0.46 0.00 0.00 0.48 0.00 0.00 55.95 57.17 1mfn s SER 111 Cb -0.12 0.43 0.00 0.00 0.10 0.00 0.00 66.02 66.43 1mfn s SER 111 CO 0.21 -0.10 0.00 -2.67 0.98 0.00 0.00 173.24 171.66 1mfn n TRP 112 N 3.28 -0.69 -4.01 5.02 2.14 -0.86 -2.45 117.44 119.87 1mfn n TRP 112 Ca -0.16 0.00 -0.30 0.00 2.07 0.00 0.00 57.50 59.11 1mfn n TRP 112 Cb 0.57 0.00 -0.16 0.00 -0.81 0.00 0.00 31.31 30.91 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 -1.20 2.23 0.51 -2.67 2.02 0.57 -4.68 118.70 115.48 1mfn s GLU 113 Ca 0.00 -0.60 -0.18 0.00 0.02 0.00 0.00 54.97 54.21 1mfn s GLU 113 Cb 0.00 -2.14 -0.07 0.00 0.10 0.00 0.00 34.13 32.01 1mfn s GLU 113 CO 0.00 -0.27 1.02 -1.25 0.02 0.00 0.00 175.26 174.78 1mfn s PRO 114 N 1.48 3.78 0.00 0.39 0.04 -1.26 -2.22 135.00 137.21 1mfn s PRO 114 Ca 0.04 1.18 0.00 0.00 0.04 0.00 0.00 61.00 62.26 1mfn s PRO 114 Cb -0.13 -2.10 0.00 0.00 0.04 0.00 0.00 34.50 32.30 1mfn s PRO 114 CO -0.10 -0.43 0.00 -0.35 0.04 0.00 0.00 177.00 176.16 1mfn n PRO 115 N -1.34 1.03 -0.01 0.56 -0.04 -1.26 -4.94 135.00 129.00 1mfn n PRO 115 Ca 0.08 0.00 0.01 0.00 -0.04 0.00 0.00 63.50 63.55 1mfn n PRO 115 Cb 0.53 0.00 0.02 0.00 -0.04 0.00 0.00 33.50 34.01 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 -3.00 2.02 -2.01 0.55 0.00 -1.26 -4.90 120.51 111.90 1mfn n ALA 116 Ca 0.00 -1.19 -0.21 0.00 0.00 0.00 0.00 53.44 52.03 1mfn n ALA 116 Cb 0.00 -0.05 0.18 0.00 0.00 0.00 0.00 19.45 19.59 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 -0.61 0.00 -0.74 0.00 0.24 -1.26 -4.84 118.33 111.12 1mfn n VAL 117 Ca 0.02 -1.05 -0.23 0.00 -2.04 0.00 0.00 64.34 61.04 1mfn n VAL 117 Cb 0.30 -1.42 -0.02 0.00 -1.47 0.00 0.00 33.84 31.24 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 -3.67 4.46 -4.55 -1.34 7.64 -1.26 -4.84 113.62 110.05 1mfn n SER 118 Ca 0.16 -2.34 -0.39 0.00 1.01 0.00 0.00 58.87 57.31 1mfn n SER 118 Cb 0.56 -1.07 -0.03 0.00 -1.01 0.00 0.00 64.21 62.66 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 3.64 3.66 0.19 0.44 1.01 -1.26 -3.93 120.40 124.15 1mfn s VAL 119 Ca 0.39 0.07 0.04 0.00 0.00 0.00 0.00 61.98 62.49 1mfn s VAL 119 Cb 0.10 -4.66 -0.11 0.00 0.00 0.00 0.00 36.38 31.71 1mfn s VAL 119 CO -0.02 -1.60 1.44 0.03 0.00 0.00 0.00 175.10 174.96 1mfn h ARG 120 N 11.15 0.17 -2.67 2.72 3.08 -1.57 -3.43 114.38 123.84 1mfn h ARG 120 Ca -0.15 -0.16 0.11 0.00 0.07 0.00 0.00 59.98 59.85 1mfn h ARG 120 Cb 1.06 0.04 -0.02 0.00 0.08 0.00 0.00 29.97 31.13 1mfn h ARG 120 CO 1.29 0.87 0.49 1.52 -1.07 0.00 0.00 179.97 183.07 1mfn s TYR 121 N -3.35 0.08 -0.02 3.04 -0.85 -1.06 -3.63 117.35 111.55 1mfn s TYR 121 Ca -0.03 -0.56 0.04 0.00 -0.52 0.00 0.00 57.07 56.01 1mfn s TYR 121 Cb 0.11 0.74 -0.01 0.00 0.38 0.00 0.00 41.96 43.18 1mfn s TYR 121 CO 0.81 -1.11 -0.14 0.71 -1.52 0.00 0.00 175.55 174.31 1mfn s TYR 122 N -2.25 1.30 -0.98 -3.49 1.51 -0.73 -0.69 117.35 112.02 1mfn s TYR 122 Ca 0.20 -0.30 -0.15 0.00 -1.01 0.00 0.00 57.07 55.81 1mfn s TYR 122 Cb -0.03 -0.87 0.19 0.00 -0.11 0.00 0.00 41.96 41.14 1mfn s TYR 122 CO 0.07 -0.08 1.06 0.50 -1.11 0.00 0.00 175.55 175.99 1mfn s ARG 123 N -0.10 3.79 0.32 -0.62 3.52 -1.00 -0.11 118.95 124.76 1mfn s ARG 123 Ca 0.01 -2.40 -0.18 0.00 -0.13 0.00 0.00 55.73 53.03 1mfn s ARG 123 Cb -0.08 -4.72 -0.09 0.00 -1.56 0.00 0.00 34.95 28.50 1mfn s ARG 123 CO 0.00 -1.52 0.79 0.42 -0.81 0.00 0.00 175.30 174.19 1mfn s ILE 124 N 0.95 4.56 0.07 4.11 1.01 -0.07 -0.48 121.20 131.36 1mfn s ILE 124 Ca 0.29 1.19 0.05 0.00 0.00 0.00 0.00 60.65 62.18 1mfn s ILE 124 Cb -0.07 -3.69 -0.03 0.00 0.01 0.00 0.00 42.46 38.68 1mfn s ILE 124 CO -0.07 -0.11 -0.13 0.42 0.00 0.00 0.00 174.94 175.05 1mfn s THR 125 N -1.90 1.04 0.02 2.92 -4.23 0.24 0.19 115.64 113.92 1mfn s THR 125 Ca 0.53 -1.32 -0.24 0.00 -1.18 0.00 0.00 61.69 59.48 1mfn s THR 125 Cb -0.12 -1.05 -0.05 0.00 1.34 0.00 0.00 72.50 72.62 1mfn s THR 125 CO 0.18 -0.28 0.74 -0.31 -0.54 0.00 0.00 174.62 174.41 1mfn s TYR 126 N -1.41 3.70 -0.29 3.99 1.51 -0.13 -2.48 117.35 122.24 1mfn s TYR 126 Ca -0.02 1.41 -0.08 0.00 -1.01 0.00 0.00 57.07 57.37 1mfn s TYR 126 Cb -0.09 -2.81 -0.01 0.00 -0.11 0.00 0.00 41.96 38.94 1mfn s TYR 126 CO 0.02 0.23 0.11 0.20 -1.11 0.00 0.00 175.55 175.00 1mfn s GLY 127 N 0.14 1.82 0.02 0.71 0.00 0.39 -2.62 107.32 107.79 1mfn s GLY 127 Ca 0.38 -1.34 0.01 0.00 0.00 0.00 0.00 44.72 43.78 1mfn s GLY 127 CO 0.22 0.64 0.06 -0.54 0.00 0.00 0.00 173.10 173.48 1mfn s GLU 128 N 1.58 2.94 0.35 2.90 2.02 -1.26 0.03 118.70 127.27 1mfn s GLU 128 Ca 0.05 -0.58 -0.25 0.00 0.02 0.00 0.00 54.97 54.20 1mfn s GLU 128 Cb -0.17 -2.78 -0.13 0.00 0.10 0.00 0.00 34.13 31.16 1mfn s GLU 128 CO 0.05 0.61 0.73 0.25 0.02 0.00 0.00 175.26 176.92 1mfn n THR 129 N 0.98 1.94 -3.22 3.63 -2.24 -0.76 -3.19 114.28 111.42 1mfn n THR 129 Ca -0.12 -0.50 -0.19 0.00 -2.27 0.00 0.00 64.05 60.97 1mfn n THR 129 Cb 0.52 -0.66 0.02 0.00 -2.10 0.00 0.00 70.33 68.11 1mfn n THR 129 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1mfn n GLY 130 N 1.58 -0.81 0.00 3.38 0.00 -1.26 -4.98 105.19 103.11 1mfn n GLY 130 Ca 0.12 1.03 0.00 0.00 0.00 0.00 0.00 46.02 47.17 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 -0.65 0.66 2.42 -0.02 0.00 -1.19 -5.01 105.19 101.40 1mfn n GLY 131 Ca -0.02 -0.05 -0.15 0.00 0.00 0.00 0.00 46.02 45.80 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 0.00 -4.50 0.00 1.61 4.05 -1.26 -4.51 115.26 110.66 1mfn n ASN 132 Ca 0.00 -0.10 0.00 0.00 0.45 0.00 0.00 54.58 54.93 1mfn n ASN 132 Cb 0.00 -3.52 0.00 0.00 1.23 0.00 0.00 39.78 37.49 1mfn n ASN 132 CO 0.00 0.00 0.00 -1.54 -3.05 0.00 0.00 177.26 172.67 1mfn n SER 133 N -0.91 0.00 -4.58 1.20 3.41 -1.26 -5.04 113.62 106.44 1mfn n SER 133 Ca -0.13 0.00 -0.37 0.00 -0.26 0.00 0.00 58.87 58.11 1mfn n SER 133 Cb 0.61 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.53 1mfn n SER 133 CO 0.00 0.00 0.00 -2.16 -0.16 0.00 0.00 175.04 172.72 1mfn s PRO 134 N 0.00 3.41 0.08 4.33 0.04 -1.26 -4.95 135.00 136.66 1mfn s PRO 134 Ca 0.00 -1.51 0.08 0.00 0.04 0.00 0.00 61.00 59.60 1mfn s PRO 134 Cb 0.00 -5.40 -0.04 0.00 0.04 0.00 0.00 34.50 29.11 1mfn s PRO 134 CO 0.00 -2.81 -0.15 0.08 0.04 0.00 0.00 177.00 174.16 1mfn s VAL 135 N 6.65 3.02 -0.97 -0.36 1.01 -1.26 -4.61 120.40 123.87 1mfn s VAL 135 Ca 0.58 -1.30 -0.16 0.00 0.00 0.00 0.00 61.98 61.11 1mfn s VAL 135 Cb 0.01 -2.35 0.18 0.00 0.00 0.00 0.00 36.38 34.22 1mfn s VAL 135 CO 0.06 0.19 1.09 -1.10 0.00 0.00 0.00 175.10 175.34 1mfn s GLN 136 N -1.90 3.76 0.04 2.72 -0.21 -1.08 -4.71 119.66 118.29 1mfn s GLN 136 Ca 0.18 -2.25 -0.30 0.00 0.02 0.00 0.00 55.36 53.00 1mfn s GLN 136 Cb -0.11 -4.78 -0.05 0.00 1.00 0.00 0.00 33.01 29.08 1mfn s GLN 136 CO 0.09 -1.59 1.11 -1.83 -2.12 0.00 0.00 175.29 170.95 1mfn s GLU 137 N 1.40 4.49 0.01 2.91 -1.05 -1.26 -0.95 118.70 124.25 1mfn s GLU 137 Ca 0.30 1.63 0.01 0.00 -0.15 0.00 0.00 54.97 56.77 1mfn s GLU 137 Cb -0.06 -3.39 -0.01 0.00 -0.44 0.00 0.00 34.13 30.23 1mfn s GLU 137 CO -0.07 -0.16 -0.05 -0.59 0.95 0.00 0.00 175.26 175.34 1mfn s PHE 138 N 0.99 0.40 0.83 4.83 -0.71 0.51 -4.93 117.98 119.90 1mfn s PHE 138 Ca 0.56 -0.22 -0.12 0.00 -1.04 0.00 0.00 56.93 56.11 1mfn s PHE 138 Cb -0.26 -0.25 0.09 0.00 -1.21 0.00 0.00 43.02 41.38 1mfn s PHE 138 CO 0.29 -0.05 1.10 0.95 -1.34 0.00 0.00 175.22 176.17 1mfn s THR 139 N -0.57 2.85 -0.00 -4.49 -4.23 -1.26 -0.89 115.64 107.04 1mfn s THR 139 Ca -0.03 0.28 0.01 0.00 -1.18 0.00 0.00 61.69 60.76 1mfn s THR 139 Cb -0.05 -2.99 -0.00 0.00 1.34 0.00 0.00 72.50 70.81 1mfn s THR 139 CO -0.00 -0.36 -0.03 -0.69 -0.54 0.00 0.00 174.62 173.00 1mfn s VAL 140 N -3.14 0.27 -0.04 2.29 1.01 0.84 -4.79 120.40 116.83 1mfn s VAL 140 Ca 0.62 -0.14 -0.30 0.00 0.00 0.00 0.00 61.98 62.16 1mfn s VAL 140 Cb -0.15 -0.24 -0.03 0.00 0.00 0.00 0.00 36.38 35.96 1mfn s VAL 140 CO 0.54 0.08 1.19 -2.16 0.00 0.00 0.00 175.10 174.75 1mfn s PRO 141 N -0.04 4.37 0.00 2.72 0.04 -1.26 -1.78 135.00 139.04 1mfn s PRO 141 Ca 0.01 1.66 0.20 0.00 0.04 0.00 0.00 61.00 62.91 1mfn s PRO 141 Cb -0.02 -3.53 1.13 0.00 0.04 0.00 0.00 34.50 32.11 1mfn s PRO 141 CO -0.00 -0.41 1.59 0.41 0.04 0.00 0.00 177.00 178.62 1mfn n GLY 142 N 3.33 -0.72 0.00 0.56 0.00 -1.24 -2.77 105.19 104.34 1mfn n GLY 142 Ca 0.11 -0.11 0.11 0.00 0.00 0.00 0.00 46.02 46.12 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 -1.09 0.00 -3.70 1.61 3.41 -1.26 -4.75 113.62 107.84 1mfn n SER 143 Ca 0.13 -0.85 -0.15 0.00 -0.26 0.00 0.00 58.87 57.75 1mfn n SER 143 Cb 0.10 0.00 -0.08 0.00 -0.26 0.00 0.00 64.21 63.97 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 -2.00 0.77 0.04 4.33 -0.14 -1.12 -5.03 119.74 116.59 1mfn s LYS 144 Ca 0.33 -0.05 0.23 0.00 -1.36 0.00 0.00 55.97 55.12 1mfn s LYS 144 Cb 0.15 0.35 0.10 0.00 -1.68 0.00 0.00 37.83 36.75 1mfn s LYS 144 CO 0.26 -0.22 1.09 0.43 -0.76 0.00 0.00 175.35 176.14 1mfn n SER 145 N 1.23 0.64 -4.55 2.83 7.64 -1.26 -4.84 113.62 115.30 1mfn n SER 145 Ca -0.21 -0.31 -0.34 0.00 1.01 0.00 0.00 58.87 59.02 1mfn n SER 145 Cb 0.56 0.71 -0.11 0.00 -1.01 0.00 0.00 64.21 64.36 1mfn n SER 145 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 1mfn s THR 146 N -3.14 4.20 0.29 0.44 -4.23 -1.26 -2.03 115.64 109.92 1mfn s THR 146 Ca 0.06 -0.25 0.11 0.00 -1.18 0.00 0.00 61.69 60.42 1mfn s THR 146 Cb 0.15 -2.85 -0.05 0.00 1.34 0.00 0.00 72.50 71.09 1mfn s THR 146 CO 0.79 0.49 -0.13 0.00 -0.54 0.00 0.00 174.62 175.23 1mfn s ALA 147 N 0.27 2.90 0.18 3.99 0.00 -0.20 -4.95 121.76 123.95 1mfn s ALA 147 Ca -0.01 -1.89 0.04 0.00 0.00 0.00 0.00 51.96 50.11 1mfn s ALA 147 Cb -0.13 -0.32 -0.04 0.00 0.00 0.00 0.00 23.12 22.63 1mfn s ALA 147 CO 0.02 0.22 0.22 -0.08 0.00 0.00 0.00 175.76 176.14 1mfn s THR 148 N -2.50 4.86 -0.16 0.00 -1.32 -1.26 -1.06 115.64 114.21 1mfn s THR 148 Ca 0.31 -0.96 -0.02 0.00 -1.21 0.00 0.00 61.69 59.81 1mfn s THR 148 Cb -0.03 -3.52 0.05 0.00 -1.51 0.00 0.00 72.50 67.48 1mfn s THR 148 CO 0.16 -0.15 0.00 -0.63 -2.21 0.00 0.00 174.62 171.80 1mfn s ILE 149 N -1.81 0.67 0.44 5.08 -1.09 -0.48 -4.91 121.20 119.10 1mfn s ILE 149 Ca 0.33 -0.44 0.05 0.00 -2.23 0.00 0.00 60.65 58.35 1mfn s ILE 149 Cb -0.10 -1.01 -0.05 0.00 -1.58 0.00 0.00 42.46 39.72 1mfn s ILE 149 CO 0.26 -0.01 0.01 0.20 -1.23 0.00 0.00 174.94 174.17 1mfn s ASN 150 N 1.81 3.85 -0.88 3.58 -0.87 -1.26 -1.21 114.94 119.97 1mfn s ASN 150 Ca 0.01 -1.49 -0.02 0.00 -1.57 0.00 0.00 52.86 49.79 1mfn s ASN 150 Cb -0.16 -0.01 0.00 0.00 -0.02 0.00 0.00 41.25 41.06 1mfn s ASN 150 CO -0.07 -0.62 0.27 0.59 -2.57 0.00 0.00 177.10 174.70 1mfn n ASN 151 N -1.07 -3.99 -4.93 -1.22 3.02 -1.14 -4.95 115.26 100.97 1mfn n ASN 151 Ca -0.10 -0.13 -0.25 0.00 -0.03 0.00 0.00 54.58 54.07 1mfn n ASN 151 Cb 0.67 -2.94 -0.02 0.00 -0.61 0.00 0.00 39.78 36.88 1mfn n ASN 151 CO 0.00 0.00 0.00 -0.51 -2.62 0.00 0.00 177.26 174.13 1mfn s ILE 152 N -2.82 5.09 -0.34 2.41 2.07 -1.16 -5.06 121.20 121.39 1mfn s ILE 152 Ca 0.13 -0.34 -0.14 0.00 -1.41 0.00 0.00 60.65 58.89 1mfn s ILE 152 Cb -0.06 -3.83 -0.02 0.00 0.13 0.00 0.00 42.46 38.68 1mfn s ILE 152 CO 0.17 -0.50 0.30 -0.54 -1.91 0.00 0.00 174.94 172.46 1mfn s LYS 153 N -4.13 3.56 0.22 3.50 -0.14 -1.26 -4.75 119.74 116.74 1mfn s LYS 153 Ca 0.41 -0.50 -0.30 0.00 -1.36 0.00 0.00 55.97 54.22 1mfn s LYS 153 Cb -0.10 -3.80 -0.08 0.00 -1.68 0.00 0.00 37.83 32.17 1mfn s LYS 153 CO 0.35 -0.47 1.02 -1.25 -0.76 0.00 0.00 175.35 174.24 1mfn s PRO 154 N 1.89 4.71 0.00 -1.68 0.04 -1.26 -4.41 135.00 134.29 1mfn s PRO 154 Ca 0.09 1.62 0.00 0.00 0.04 0.00 0.00 61.00 62.76 1mfn s PRO 154 Cb -0.17 -3.27 0.00 0.00 0.04 0.00 0.00 34.50 31.10 1mfn s PRO 154 CO 0.11 0.29 0.00 0.41 0.04 0.00 0.00 177.00 177.85 1mfn n GLY 155 N 1.66 0.23 0.00 0.56 0.00 0.18 -5.04 105.19 102.78 1mfn n GLY 155 Ca 0.00 -0.39 0.00 0.00 0.00 0.00 0.00 46.02 45.63 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 -0.75 0.00 -0.85 4.61 0.00 -1.26 -4.99 120.51 117.28 1mfn n ALA 156 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 53.44 53.10 1mfn n ALA 156 Cb 0.34 0.00 0.10 0.00 0.00 0.00 0.00 19.45 19.89 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 -3.38 -1.18 0.00 2.03 -1.26 -2.36 116.55 110.40 1mfn n ASP 157 Ca 0.00 0.18 -0.01 0.00 0.52 0.00 0.00 54.79 55.47 1mfn n ASP 157 Cb 0.00 -0.96 -0.01 0.00 -0.72 0.00 0.00 41.12 39.43 1mfn n ASP 157 CO 0.00 0.00 0.00 -1.22 -1.92 0.00 0.00 177.20 174.06 1mfn n TYR 158 N -3.41 -0.22 -3.18 -0.67 4.02 0.21 -1.83 117.16 112.08 1mfn n TYR 158 Ca 0.02 -0.22 0.04 0.00 -0.01 0.00 0.00 57.90 57.74 1mfn n TYR 158 Cb 0.58 0.03 -0.01 0.00 -0.02 0.00 0.00 39.34 39.92 1mfn n TYR 158 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 176.86 176.84 1mfn s THR 159 N -2.23 -0.73 -0.27 -0.72 2.01 0.10 -2.26 115.64 111.54 1mfn s THR 159 Ca 0.03 0.00 -0.15 0.00 0.31 0.00 0.00 61.69 61.88 1mfn s THR 159 Cb 0.00 -1.00 -0.04 0.00 0.01 0.00 0.00 72.50 71.47 1mfn s THR 159 CO 0.02 0.00 0.37 -0.63 -0.69 0.00 0.00 174.62 173.69 1mfn s ILE 160 N 2.88 5.18 0.28 1.82 -1.09 0.20 0.15 121.20 130.61 1mfn s ILE 160 Ca 0.11 0.56 0.07 0.00 -2.23 0.00 0.00 60.65 59.16 1mfn s ILE 160 Cb -0.13 -3.69 -0.06 0.00 -1.58 0.00 0.00 42.46 37.00 1mfn s ILE 160 CO -0.17 0.17 -0.07 -0.89 -1.23 0.00 0.00 174.94 172.74 1mfn s THR 161 N 2.02 1.75 -0.20 2.92 2.01 -1.03 0.57 115.64 123.67 1mfn s THR 161 Ca 0.15 -2.15 -0.26 0.00 0.31 0.00 0.00 61.69 59.74 1mfn s THR 161 Cb -0.16 -2.44 0.07 0.00 0.01 0.00 0.00 72.50 69.98 1mfn s THR 161 CO 0.10 -0.31 0.69 -1.48 -0.69 0.00 0.00 174.62 172.93 1mfn s LEU 162 N -3.46 -0.66 -0.83 4.42 0.05 -0.54 0.82 118.68 118.48 1mfn s LEU 162 Ca 0.29 1.21 0.01 0.00 0.05 0.00 0.00 54.13 55.69 1mfn s LEU 162 Cb 0.03 2.43 0.20 0.00 -2.05 0.00 0.00 46.19 46.81 1mfn s LEU 162 CO 0.12 -0.35 0.69 -0.31 -0.55 0.00 0.00 176.35 175.95 1mfn s TYR 163 N -0.08 3.80 -0.92 3.48 1.51 0.37 -2.09 117.35 123.42 1mfn s TYR 163 Ca -0.03 -3.14 -0.24 0.00 -1.01 0.00 0.00 57.07 52.64 1mfn s TYR 163 Cb -0.04 -3.06 -0.23 0.00 -0.11 0.00 0.00 41.96 38.52 1mfn s TYR 163 CO 0.04 -0.67 2.50 0.00 -1.11 0.00 0.00 175.55 176.30 1mfn n ALA 164 N 2.20 0.59 -2.32 3.71 0.00 -1.26 -2.38 120.51 121.03 1mfn n ALA 164 Ca 0.21 -0.58 -0.40 0.00 0.00 0.00 0.00 53.44 52.67 1mfn n ALA 164 Cb 0.36 -2.49 -0.05 0.00 0.00 0.00 0.00 19.45 17.27 1mfn n ALA 164 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1mfn s VAL 165 N 7.35 4.64 -0.04 0.00 1.01 0.13 -3.59 120.40 129.90 1mfn s VAL 165 Ca 1.27 1.73 -0.03 0.00 0.00 0.00 0.00 61.98 64.96 1mfn s VAL 165 Cb -0.94 -4.16 -0.02 0.00 0.00 0.00 0.00 36.38 31.26 1mfn s VAL 165 CO 0.46 0.37 -0.07 0.35 0.00 0.00 0.00 175.10 176.21 1mfn n THR 166 N 2.67 0.45 -2.24 3.92 -2.24 0.93 -2.36 114.28 115.42 1mfn n THR 166 Ca -0.02 -0.01 -0.36 0.00 -2.27 0.00 0.00 64.05 61.39 1mfn n THR 166 Cb 0.50 -1.60 0.00 0.00 -2.10 0.00 0.00 70.33 67.13 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 -4.96 2.68 0.00 3.38 0.00 -1.18 -3.82 107.32 103.41 1mfn s GLY 167 Ca -0.07 0.87 0.00 0.00 0.00 0.00 0.00 44.72 45.52 1mfn s GLY 167 CO 0.09 1.25 0.00 0.54 0.00 0.00 0.00 173.10 174.99 1mfn n ARG 168 N -1.11 0.00 0.00 2.90 5.12 0.79 -2.78 116.66 121.58 1mfn n ARG 168 Ca 0.11 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 56.03 1mfn n ARG 168 Cb 0.50 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.80 1mfn n ARG 168 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1mfn n GLY 169 N 0.00 0.93 0.12 -0.13 0.00 -1.26 -1.29 105.19 103.56 1mfn n GLY 169 Ca 0.00 0.57 0.01 0.00 0.00 0.00 0.00 46.02 46.61 1mfn n GLY 169 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1mfn n ASP 170 N 2.15 0.83 -3.15 1.61 5.68 -1.26 -4.94 116.55 117.48 1mfn n ASP 170 Ca 0.00 -1.76 -0.07 0.00 -0.50 0.00 0.00 54.79 52.46 1mfn n ASP 170 Cb 0.00 -0.10 -0.03 0.00 -1.14 0.00 0.00 41.12 39.85 1mfn n ASP 170 CO 0.00 0.00 0.00 -0.44 -1.33 0.00 0.00 177.20 175.43 1mfn s SER 171 N -0.87 -0.57 -0.50 -1.12 0.01 -0.41 -5.11 113.70 105.14 1mfn s SER 171 Ca 0.04 -1.44 -0.29 0.00 1.31 0.00 0.00 55.95 55.57 1mfn s SER 171 Cb 0.04 1.38 0.02 0.00 0.21 0.00 0.00 66.02 67.68 1mfn s SER 171 CO 0.00 -0.16 1.23 -2.16 0.41 0.00 0.00 173.24 172.57 1mfn s PRO 172 N 1.32 3.59 0.21 12.44 0.04 -1.25 -0.15 135.00 151.21 1mfn s PRO 172 Ca 0.21 0.53 0.09 0.00 0.04 0.00 0.00 61.00 61.88 1mfn s PRO 172 Cb -0.05 -3.98 -0.04 0.00 0.04 0.00 0.00 34.50 30.46 1mfn s PRO 172 CO -0.06 -1.56 -0.09 0.00 0.04 0.00 0.00 177.00 175.33 1mfn s ALA 173 N 4.94 2.96 -0.30 8.56 0.00 -1.12 -4.81 121.76 132.00 1mfn s ALA 173 Ca 0.49 -1.57 -0.12 0.00 0.00 0.00 0.00 51.96 50.76 1mfn s ALA 173 Cb -0.09 -0.68 0.15 0.00 0.00 0.00 0.00 23.12 22.50 1mfn s ALA 173 CO 0.30 0.39 0.81 -1.54 0.00 0.00 0.00 175.76 175.72 1mfn s SER 174 N -3.11 -0.88 0.67 0.00 1.04 -1.26 -0.04 113.70 110.11 1mfn s SER 174 Ca 0.27 1.18 0.00 0.00 0.48 0.00 0.00 55.95 57.88 1mfn s SER 174 Cb -0.08 1.99 0.00 0.00 0.10 0.00 0.00 66.02 68.03 1mfn s SER 174 CO 0.16 -0.17 0.00 -1.54 0.98 0.00 0.00 173.24 172.67 1mfn n SER 175 N 5.23 -1.34 -4.76 7.02 3.41 -1.24 -4.86 113.62 117.08 1mfn n SER 175 Ca -0.10 0.00 -0.37 0.00 -0.26 0.00 0.00 58.87 58.13 1mfn n SER 175 Cb 0.51 0.00 0.01 0.00 -0.26 0.00 0.00 64.21 64.46 1mfn n SER 175 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1mfn s LYS 176 N -2.01 3.54 -0.13 4.33 1.02 -1.26 -4.78 119.74 120.45 1mfn s LYS 176 Ca 0.00 1.92 -0.29 0.00 0.02 0.00 0.00 55.97 57.62 1mfn s LYS 176 Cb 0.00 -2.35 -0.01 0.00 -0.52 0.00 0.00 37.83 34.95 1mfn s LYS 176 CO 0.00 -0.77 1.14 -1.25 -0.92 0.00 0.00 175.35 173.55 1mfn s PRO 177 N -2.78 4.31 -0.06 -1.68 0.04 -1.26 -4.74 135.00 128.83 1mfn s PRO 177 Ca 0.66 1.54 -0.18 0.00 0.04 0.00 0.00 61.00 63.07 1mfn s PRO 177 Cb -0.32 -3.63 -0.05 0.00 0.04 0.00 0.00 34.50 30.54 1mfn s PRO 177 CO 0.39 -0.53 0.49 0.08 0.04 0.00 0.00 177.00 177.47 1mfn s VAL 178 N 2.74 5.07 0.12 -0.36 1.01 -0.89 -4.86 120.40 123.24 1mfn s VAL 178 Ca 0.51 1.00 0.08 0.00 0.00 0.00 0.00 61.98 63.58 1mfn s VAL 178 Cb -0.20 -3.82 -0.04 0.00 0.00 0.00 0.00 36.38 32.32 1mfn s VAL 178 CO 0.16 0.41 -0.21 -0.94 0.00 0.00 0.00 175.10 174.52 1mfn s SER 179 N 0.01 2.63 0.03 3.32 1.04 -1.26 -1.47 113.70 118.00 1mfn s SER 179 Ca 0.27 -0.74 0.00 0.00 0.48 0.00 0.00 55.95 55.96 1mfn s SER 179 Cb -0.16 -0.15 -0.03 0.00 0.10 0.00 0.00 66.02 65.78 1mfn s SER 179 CO 0.13 0.04 -0.04 0.27 0.98 0.00 0.00 173.24 174.62 1mfn s ILE 180 N -1.39 0.26 0.51 -1.02 -4.36 0.19 -4.96 121.20 110.44 1mfn s ILE 180 Ca 0.09 -1.15 -0.04 0.00 -0.26 0.00 0.00 60.65 59.29 1mfn s ILE 180 Cb -0.09 -0.62 -0.01 0.00 1.25 0.00 0.00 42.46 42.99 1mfn s ILE 180 CO 0.05 -0.58 0.80 0.20 0.24 0.00 0.00 174.94 175.65 1mfn s ASN 181 N -1.81 5.91 0.22 4.36 0.02 -1.26 0.58 114.94 122.95 1mfn s ASN 181 Ca -0.09 0.69 -0.14 0.00 -1.02 0.00 0.00 52.86 52.29 1mfn s ASN 181 Cb -0.06 -1.88 0.01 0.00 0.02 0.00 0.00 41.25 39.34 1mfn s ASN 181 CO -0.02 -0.78 0.47 -0.47 0.02 0.00 0.00 177.10 176.32 1mfn s TYR 182 N -2.78 0.17 -0.07 2.20 5.04 -0.96 -4.66 117.35 116.29 1mfn s TYR 182 Ca 0.50 -0.54 -0.02 0.00 -2.44 0.00 0.00 57.07 54.57 1mfn s TYR 182 Cb -0.10 0.24 0.03 0.00 0.35 0.00 0.00 41.96 42.49 1mfn s TYR 182 CO 0.43 -0.93 0.04 0.21 -1.34 0.00 0.00 175.55 173.96 1mfn s LYS 183 N -3.95 0.19 0.00 4.97 2.20 -1.26 0.66 119.74 122.55 1mfn s LYS 183 Ca 0.16 0.20 0.26 0.00 -0.36 0.00 0.00 55.97 56.23 1mfn s LYS 183 Cb -0.00 -0.89 0.66 0.00 -1.51 0.00 0.00 37.83 36.09 1mfn s LYS 183 CO 0.03 -0.38 1.52 0.25 -0.36 0.00 0.00 175.35 176.42