#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3mef s GLY 3 N 0.00 0.69 0.00 5.00 0.00 -1.26 -5.18 107.32 106.58 3mef s GLY 3 Ca 0.00 -1.26 0.00 0.00 0.00 0.00 0.00 44.72 43.46 3mef s GLY 3 CO 0.00 -1.36 0.00 0.28 0.00 0.00 0.00 173.10 172.02 3mef n LYS 4 N 0.17 0.38 -4.84 2.90 4.76 -1.26 -5.05 118.16 115.22 3mef n LYS 4 Ca -0.14 0.00 -0.28 0.00 -2.87 0.00 0.00 58.31 55.02 3mef n LYS 4 Cb 0.60 0.00 -0.15 0.00 -1.84 0.00 0.00 35.03 33.64 3mef n LYS 4 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3mef s MET 5 N -2.60 1.66 0.17 1.97 0.23 0.38 -4.94 119.30 116.17 3mef s MET 5 Ca 0.00 -1.01 -0.26 0.00 -1.03 0.00 0.00 55.69 53.39 3mef s MET 5 Cb 0.00 -1.78 -0.08 0.00 -1.53 0.00 0.00 34.83 31.44 3mef s MET 5 CO 0.00 0.46 0.80 0.95 -2.03 0.00 0.00 175.02 175.20 3mef s THR 6 N -0.77 4.35 -0.30 3.16 -4.23 -1.26 0.40 115.64 116.99 3mef s THR 6 Ca 0.10 1.76 -0.14 0.00 -1.18 0.00 0.00 61.69 62.23 3mef s THR 6 Cb -0.09 -4.17 0.18 0.00 1.34 0.00 0.00 72.50 69.75 3mef s THR 6 CO 0.02 0.51 1.04 -0.83 -0.54 0.00 0.00 174.62 174.82 3mef s GLY 7 N -1.06 -0.26 0.26 3.99 0.00 0.50 -4.28 107.32 106.47 3mef s GLY 7 Ca 0.37 2.91 -0.30 0.00 0.00 0.00 0.00 44.72 47.71 3mef s GLY 7 CO 0.27 3.59 1.13 -0.26 0.00 0.00 0.00 173.10 177.83 3mef s ILE 8 N 2.71 3.47 0.08 0.90 -4.36 -0.84 -1.57 121.20 121.59 3mef s ILE 8 Ca -0.00 1.42 -0.10 0.00 -0.26 0.00 0.00 60.65 61.71 3mef s ILE 8 Cb -0.08 -3.90 -0.06 0.00 1.25 0.00 0.00 42.46 39.67 3mef s ILE 8 CO -0.14 0.31 0.40 0.68 0.24 0.00 0.00 174.94 176.43 3mef s VAL 9 N -0.90 5.10 -0.21 8.37 -7.23 -0.36 0.59 120.40 125.76 3mef s VAL 9 Ca 0.47 0.43 -0.17 0.00 -1.81 0.00 0.00 61.98 60.89 3mef s VAL 9 Cb -0.32 -3.64 -0.19 0.00 0.56 0.00 0.00 36.38 32.79 3mef s VAL 9 CO 0.41 0.28 0.11 0.29 -0.31 0.00 0.00 175.10 175.88 3mef n LYS 10 N 0.88 0.60 -4.49 4.82 4.76 -1.18 0.51 118.16 124.05 3mef n LYS 10 Ca -0.08 0.46 -0.24 0.00 -2.87 0.00 0.00 58.31 55.59 3mef n LYS 10 Cb 0.52 -1.69 -0.10 0.00 -1.84 0.00 0.00 35.03 31.92 3mef n LYS 10 CO 0.00 0.00 0.00 -1.58 -1.37 0.00 0.00 177.40 174.45 3mef s TRP 11 N -2.42 2.19 -0.30 2.13 0.51 -1.15 -3.75 118.94 116.16 3mef s TRP 11 Ca -0.30 -0.58 -0.16 0.00 -2.12 0.00 0.00 56.10 52.93 3mef s TRP 11 Cb 0.08 -1.24 0.18 0.00 -0.81 0.00 0.00 33.47 31.68 3mef s TRP 11 CO 0.60 0.45 1.12 0.12 -0.51 0.00 0.00 176.95 178.73 3mef s PHE 12 N -2.79 -0.40 -0.08 -1.98 5.36 -1.26 -3.41 117.98 113.41 3mef s PHE 12 Ca 0.31 0.61 -0.07 0.00 -0.96 0.00 0.00 56.93 56.82 3mef s PHE 12 Cb 0.03 0.21 0.02 0.00 -0.34 0.00 0.00 43.02 42.94 3mef s PHE 12 CO 0.14 -0.21 0.22 -0.80 -1.46 0.00 0.00 175.22 173.12 3mef s ASN 13 N 2.46 -0.23 -0.41 6.13 0.01 -1.19 -4.94 114.94 116.77 3mef s ASN 13 Ca -0.01 0.44 0.05 0.00 -0.71 0.00 0.00 52.86 52.63 3mef s ASN 13 Cb -0.05 0.44 0.53 0.00 0.41 0.00 0.00 41.25 42.58 3mef s ASN 13 CO -0.15 -0.08 1.67 0.00 -1.51 0.00 0.00 177.10 177.02 3mef n ALA 14 N 3.09 5.18 0.07 0.60 0.00 -1.26 -1.56 120.51 126.63 3mef n ALA 14 Ca -0.14 -3.24 0.00 0.00 0.00 0.00 0.00 53.44 50.06 3mef n ALA 14 Cb 0.58 -1.08 0.00 0.00 0.00 0.00 0.00 19.45 18.95 3mef n ALA 14 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 3mef n ASP 15 N -1.04 0.26 0.47 0.00 9.92 -1.26 -4.91 116.55 119.99 3mef n ASP 15 Ca 0.48 0.22 -0.19 0.00 -0.53 0.00 0.00 54.79 54.77 3mef n ASP 15 Cb 1.12 0.05 -0.09 0.00 -0.64 0.00 0.00 41.12 41.56 3mef n ASP 15 CO 0.00 0.00 0.00 0.07 0.13 0.00 0.00 177.20 177.40 3mef h LYS 16 N 0.00 -1.17 0.00 -1.24 -0.00 -2.01 -3.46 116.57 108.69 3mef h LYS 16 Ca 0.00 0.08 0.00 0.00 -0.00 0.00 0.00 60.65 60.73 3mef h LYS 16 Cb 0.17 0.27 0.00 0.00 -0.00 0.00 0.00 32.23 32.66 3mef h LYS 16 CO 0.00 -0.78 0.00 0.41 -0.00 0.00 0.00 179.45 179.08 3mef n GLY 17 N -1.61 -1.81 7.00 0.07 0.00 -1.26 -5.15 105.19 102.44 3mef n GLY 17 Ca -0.15 0.71 0.00 0.00 0.00 0.00 0.00 46.02 46.58 3mef n GLY 17 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3mef n PHE 18 N 0.00 -0.38 -3.93 1.61 3.72 -0.60 -4.98 117.46 112.90 3mef n PHE 18 Ca 0.00 0.00 -0.11 0.00 -0.05 0.00 0.00 57.45 57.29 3mef n PHE 18 Cb 0.00 0.08 -0.02 0.00 -0.94 0.00 0.00 39.48 38.60 3mef n PHE 18 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3mef n GLY 19 N 0.00 2.16 3.44 1.37 0.00 0.09 -3.17 105.19 109.09 3mef n GLY 19 Ca 0.00 -1.53 -0.32 0.00 0.00 0.00 0.00 46.02 44.17 3mef n GLY 19 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3mef s PHE 20 N -3.33 2.62 0.35 1.61 0.40 -1.22 -1.62 117.98 116.79 3mef s PHE 20 Ca 0.22 -0.22 0.05 0.00 -0.60 0.00 0.00 56.93 56.38 3mef s PHE 20 Cb -0.01 -1.59 -0.01 0.00 0.51 0.00 0.00 43.02 41.92 3mef s PHE 20 CO 0.16 0.15 0.50 0.42 0.70 0.00 0.00 175.22 177.16 3mef s ILE 21 N -0.73 4.21 -0.47 0.64 1.01 0.46 -2.91 121.20 123.41 3mef s ILE 21 Ca 0.12 -0.88 0.03 0.00 0.00 0.00 0.00 60.65 59.91 3mef s ILE 21 Cb -0.10 -3.48 0.13 0.00 0.01 0.00 0.00 42.46 39.01 3mef s ILE 21 CO 0.01 -0.22 0.24 -0.89 0.00 0.00 0.00 174.94 174.08 3mef s THR 22 N -2.23 1.86 0.31 2.92 2.01 0.20 -2.69 115.64 118.01 3mef s THR 22 Ca 0.44 -2.82 -0.28 0.00 0.31 0.00 0.00 61.69 59.35 3mef s THR 22 Cb -0.10 -2.30 -0.09 0.00 0.01 0.00 0.00 72.50 70.02 3mef s THR 22 CO 0.32 -0.85 1.08 -2.16 -0.69 0.00 0.00 174.62 172.32 3mef s PRO 23 N 0.15 4.52 0.00 4.92 0.04 -1.26 -1.99 135.00 141.38 3mef s PRO 23 Ca 0.17 1.71 0.00 0.00 0.04 0.00 0.00 61.00 62.92 3mef s PRO 23 Cb -0.25 -3.02 0.00 0.00 0.04 0.00 0.00 34.50 31.27 3mef s PRO 23 CO -0.00 0.13 0.00 -0.40 0.04 0.00 0.00 177.00 176.77 3mef n ASP 24 N 0.86 0.00 0.00 6.66 5.75 -1.26 -3.76 116.55 124.80 3mef n ASP 24 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.78 3mef n ASP 24 Cb 0.46 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.55 3mef n ASP 24 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 3mef n ASP 25 N 0.00 0.00 -2.59 -1.12 8.00 -1.26 0.04 116.55 119.62 3mef n ASP 25 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.50 3mef n ASP 25 Cb 0.00 0.00 0.05 0.00 -0.02 0.00 0.00 41.12 41.15 3mef n ASP 25 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3mef n GLY 26 N 0.00 1.77 3.08 0.44 0.00 -1.26 -5.13 105.19 104.10 3mef n GLY 26 Ca 0.00 -1.06 0.00 0.00 0.00 0.00 0.00 46.02 44.96 3mef n GLY 26 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3mef n SER 27 N -0.43 0.00 0.00 1.61 3.41 0.11 -5.11 113.62 113.21 3mef n SER 27 Ca 0.08 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.69 3mef n SER 27 Cb 0.86 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.81 3mef n SER 27 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 3mef n LYS 28 N 0.00 0.00 -3.45 4.33 4.81 -1.26 -4.64 118.16 117.94 3mef n LYS 28 Ca 0.00 0.00 -0.14 0.00 -0.87 0.00 0.00 58.31 57.30 3mef n LYS 28 Cb 0.00 0.00 -0.03 0.00 0.02 0.00 0.00 35.03 35.02 3mef n LYS 28 CO 0.00 0.00 0.00 0.16 1.17 0.00 0.00 177.40 178.73 3mef s ASP 29 N -1.85 -0.60 0.08 3.14 1.47 -1.26 -4.13 116.67 113.52 3mef s ASP 29 Ca 0.00 0.24 0.04 0.00 1.18 0.00 0.00 52.55 54.01 3mef s ASP 29 Cb 0.00 0.58 -0.03 0.00 -0.34 0.00 0.00 42.92 43.13 3mef s ASP 29 CO 0.00 -0.85 -0.12 0.68 0.68 0.00 0.00 175.17 175.56 3mef s VAL 30 N -2.90 1.03 -0.13 2.11 -7.23 -1.10 -4.91 120.40 107.28 3mef s VAL 30 Ca -0.03 -1.42 -0.20 0.00 -1.81 0.00 0.00 61.98 58.52 3mef s VAL 30 Cb -0.01 -1.15 -0.04 0.00 0.56 0.00 0.00 36.38 35.74 3mef s VAL 30 CO -0.05 -0.36 0.56 0.72 -0.31 0.00 0.00 175.10 175.66 3mef s PHE 31 N -1.71 3.48 0.12 2.82 -0.12 -1.22 -0.40 117.98 120.96 3mef s PHE 31 Ca 0.00 0.96 -0.24 0.00 -0.05 0.00 0.00 56.93 57.60 3mef s PHE 31 Cb -0.07 -2.67 0.07 0.00 -0.63 0.00 0.00 43.02 39.72 3mef s PHE 31 CO 0.02 0.05 0.63 0.54 -0.05 0.00 0.00 175.22 176.41 3mef s VAL 32 N 1.04 0.00 0.00 -2.49 0.11 -0.64 -2.87 120.40 115.55 3mef s VAL 32 Ca 0.29 0.00 0.00 0.00 -2.93 0.00 0.00 61.98 59.34 3mef s VAL 32 Cb -0.16 -1.00 0.00 0.00 -1.53 0.00 0.00 36.38 33.69 3mef s VAL 32 CO 0.12 0.00 0.00 0.00 -3.33 0.00 0.00 175.10 171.89 3mef n HIS 33 N -0.22 0.00 -1.23 1.54 1.44 -1.26 -0.73 115.22 114.76 3mef n HIS 33 Ca -0.17 0.00 0.07 0.00 -2.01 0.00 0.00 57.72 55.62 3mef n HIS 33 Cb 0.64 0.00 0.18 0.00 0.12 0.00 0.00 29.99 30.93 3mef n HIS 33 CO 0.00 0.00 0.00 1.97 -2.81 0.00 0.00 176.34 175.50 3mef n PHE 34 N 0.00 0.28 0.28 -1.40 -1.74 -1.26 -4.54 117.46 109.08 3mef n PHE 34 Ca 0.00 -1.17 0.11 0.00 -0.56 0.00 0.00 57.45 55.83 3mef n PHE 34 Cb 0.00 -0.24 -0.13 0.00 1.52 0.00 0.00 39.48 40.63 3mef n PHE 34 CO 0.00 0.00 0.00 0.45 -0.56 0.00 0.00 176.76 176.65 3mef n SER 35 N -1.17 0.32 -1.29 5.98 2.88 -1.26 -4.06 113.62 115.02 3mef n SER 35 Ca 0.20 -0.23 0.07 0.00 -1.33 0.00 0.00 58.87 57.58 3mef n SER 35 Cb 0.74 1.59 0.28 0.00 -0.75 0.00 0.00 64.21 66.07 3mef n SER 35 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3mef n ALA 36 N -2.05 2.93 -1.27 -1.46 0.00 -1.26 -4.95 120.51 112.46 3mef n ALA 36 Ca -0.01 -1.22 -0.20 0.00 0.00 0.00 0.00 53.44 52.01 3mef n ALA 36 Cb 0.50 -1.02 0.24 0.00 0.00 0.00 0.00 19.45 19.17 3mef n ALA 36 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 3mef n ILE 37 N 0.87 0.00 -3.67 0.00 -6.64 -1.26 -2.92 119.36 105.74 3mef n ILE 37 Ca 0.20 -0.60 -0.28 0.00 -1.77 0.00 0.00 62.75 60.30 3mef n ILE 37 Cb 0.71 -1.31 -0.11 0.00 -1.44 0.00 0.00 39.64 37.49 3mef n ILE 37 CO 0.00 0.00 0.00 -1.10 -1.77 0.00 0.00 176.55 173.68 3mef s GLN 38 N -5.57 1.67 -0.12 6.28 1.11 -1.26 -4.84 119.66 116.93 3mef s GLN 38 Ca 0.72 -2.66 -0.30 0.00 0.01 0.00 0.00 55.36 53.13 3mef s GLN 38 Cb -0.06 -2.46 0.12 0.00 -1.01 0.00 0.00 33.01 29.60 3mef s GLN 38 CO 0.54 -1.31 1.00 1.21 0.01 0.00 0.00 175.29 176.74 3mef s ASN 39 N -0.58 -0.33 -0.44 5.90 2.47 -1.26 -4.98 114.94 115.72 3mef s ASN 39 Ca 0.27 0.22 0.02 0.00 0.42 0.00 0.00 52.86 53.79 3mef s ASN 39 Cb -0.04 0.30 0.13 0.00 -1.45 0.00 0.00 41.25 40.18 3mef s ASN 39 CO -0.15 -0.40 0.22 -0.62 -3.72 0.00 0.00 177.10 172.42 3mef s ASP 40 N -1.64 3.92 0.00 -4.21 2.15 -1.26 -4.93 116.67 110.69 3mef s ASP 40 Ca 0.02 -2.59 0.00 0.00 0.43 0.00 0.00 52.55 50.41 3mef s ASP 40 Cb -0.01 -1.20 0.00 0.00 -0.30 0.00 0.00 42.92 41.41 3mef s ASP 40 CO -0.03 -0.28 0.00 0.61 -0.17 0.00 0.00 175.17 175.30 3mef n GLY 41 N 3.61 -0.15 3.57 2.66 0.00 -1.26 -5.02 105.19 108.60 3mef n GLY 41 Ca 0.06 0.02 -0.24 0.00 0.00 0.00 0.00 46.02 45.86 3mef n GLY 41 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3mef s TYR 42 N 0.00 1.72 -1.15 1.61 5.04 -1.26 -4.85 117.35 118.46 3mef s TYR 42 Ca 0.00 0.92 -0.21 0.00 -2.44 0.00 0.00 57.07 55.34 3mef s TYR 42 Cb 0.00 -3.87 0.03 0.00 0.35 0.00 0.00 41.96 38.47 3mef s TYR 42 CO 0.00 -1.37 1.67 0.15 -1.34 0.00 0.00 175.55 174.67 3mef s LYS 43 N 7.17 3.55 -0.19 4.97 3.01 -1.26 -4.85 119.74 132.14 3mef s LYS 43 Ca 0.73 -1.44 -0.29 0.00 -1.01 0.00 0.00 55.97 53.96 3mef s LYS 43 Cb -0.05 -5.40 0.14 0.00 -1.01 0.00 0.00 37.83 31.51 3mef s LYS 43 CO 0.08 -2.53 1.05 -1.12 0.51 0.00 0.00 175.35 173.34 3mef s SER 44 N 5.09 -0.33 0.00 2.83 0.01 -1.26 -5.10 113.70 114.94 3mef s SER 44 Ca 0.54 0.40 0.00 0.00 1.31 0.00 0.00 55.95 58.20 3mef s SER 44 Cb 0.01 0.33 0.00 0.00 0.21 0.00 0.00 66.02 66.57 3mef s SER 44 CO 0.01 -0.28 0.00 0.18 0.41 0.00 0.00 173.24 173.56 3mef n LEU 45 N 0.88 0.00 -3.95 2.44 4.77 -1.26 -5.16 117.00 114.73 3mef n LEU 45 Ca -0.09 0.00 -0.21 0.00 -0.03 0.00 0.00 56.01 55.67 3mef n LEU 45 Cb 0.58 0.00 -0.16 0.00 -2.33 0.00 0.00 43.42 41.50 3mef n LEU 45 CO 0.13 -0.03 -0.43 -1.81 -1.33 0.00 0.00 177.39 173.92 3mef s ASP 46 N 0.09 1.22 -0.02 -1.43 1.01 -1.26 -5.11 116.67 111.17 3mef s ASP 46 Ca 0.00 -0.19 -0.30 0.00 0.71 0.00 0.00 52.55 52.77 3mef s ASP 46 Cb 0.00 -0.56 -0.07 0.00 1.01 0.00 0.00 42.92 43.30 3mef s ASP 46 CO 0.00 -0.01 1.88 -1.61 0.21 0.00 0.00 175.17 175.64 3mef s GLU 47 N 0.74 4.06 0.00 8.23 2.02 -1.26 -3.45 118.70 129.04 3mef s GLU 47 Ca -0.12 2.40 0.00 0.00 0.02 0.00 0.00 54.97 57.27 3mef s GLU 47 Cb -0.14 -4.12 0.00 0.00 0.10 0.00 0.00 34.13 29.97 3mef s GLU 47 CO 0.01 -1.02 0.00 0.41 0.02 0.00 0.00 175.26 174.68 3mef n GLY 48 N 4.51 0.22 3.32 -1.39 0.00 0.18 -4.99 105.19 107.05 3mef n GLY 48 Ca 0.20 -0.37 -0.13 0.00 0.00 0.00 0.00 46.02 45.72 3mef n GLY 48 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 3mef s GLN 49 N -2.72 0.49 0.04 1.61 -2.07 -1.14 -4.91 119.66 110.96 3mef s GLN 49 Ca 0.00 0.64 -0.31 0.00 -1.82 0.00 0.00 55.36 53.88 3mef s GLN 49 Cb 0.00 0.20 -0.07 0.00 -1.09 0.00 0.00 33.01 32.05 3mef s GLN 49 CO 0.00 -0.08 1.46 0.21 -1.32 0.00 0.00 175.29 175.56 3mef s LYS 50 N 0.44 4.27 -0.01 9.60 2.20 -1.26 -1.22 119.74 133.76 3mef s LYS 50 Ca -0.02 2.08 0.06 0.00 -0.36 0.00 0.00 55.97 57.73 3mef s LYS 50 Cb -0.04 -3.51 -0.02 0.00 -1.51 0.00 0.00 37.83 32.75 3mef s LYS 50 CO -0.02 -0.59 -0.20 0.14 -0.36 0.00 0.00 175.35 174.32 3mef s VAL 51 N 2.20 1.59 -1.39 4.02 -7.23 -0.61 -0.95 120.40 118.03 3mef s VAL 51 Ca 0.66 -0.91 -0.11 0.00 -1.81 0.00 0.00 61.98 59.82 3mef s VAL 51 Cb -0.35 -1.33 0.09 0.00 0.56 0.00 0.00 36.38 35.35 3mef s VAL 51 CO 0.29 0.41 2.19 -1.54 -0.31 0.00 0.00 175.10 176.13 3mef n SER 52 N 2.48 5.46 -2.92 4.85 3.41 0.18 -0.37 113.62 126.69 3mef n SER 52 Ca -0.15 -2.96 0.00 0.00 -0.26 0.00 0.00 58.87 55.49 3mef n SER 52 Cb 0.53 -1.53 0.00 0.00 -0.26 0.00 0.00 64.21 62.95 3mef n SER 52 CO 0.00 0.00 0.00 2.22 -0.16 0.00 0.00 175.04 177.10 3mef n PHE 53 N 4.32 -1.52 -2.79 7.33 -1.74 0.16 -4.33 117.46 118.89 3mef n PHE 53 Ca 0.51 0.00 -0.09 0.00 -0.56 0.00 0.00 57.45 57.32 3mef n PHE 53 Cb 0.34 0.00 0.03 0.00 1.52 0.00 0.00 39.48 41.37 3mef n PHE 53 CO 0.00 0.00 0.00 -2.37 -0.56 0.00 0.00 176.76 173.83 3mef n THR 54 N -1.11 -0.07 -0.35 1.97 5.66 0.31 0.14 114.28 120.83 3mef n THR 54 Ca 0.00 -1.59 -0.14 0.00 -3.05 0.00 0.00 64.05 59.27 3mef n THR 54 Cb 0.00 1.12 -0.02 0.00 -1.55 0.00 0.00 70.33 69.88 3mef n THR 54 CO 0.00 0.00 0.00 -0.38 -3.05 0.00 0.00 175.07 171.64 3mef n ILE 55 N 1.93 0.00 -3.96 1.09 2.08 -1.26 -3.28 119.36 115.96 3mef n ILE 55 Ca 0.12 0.00 -0.01 0.00 0.56 0.00 0.00 62.75 63.42 3mef n ILE 55 Cb 0.61 -0.04 -0.00 0.00 -0.75 0.00 0.00 39.64 39.45 3mef n ILE 55 CO 0.00 0.00 0.00 -0.62 0.56 0.00 0.00 176.55 176.49 3mef n GLU 56 N 0.55 0.03 -3.70 0.38 1.02 -0.61 -4.79 120.64 113.52 3mef n GLU 56 Ca 0.05 -0.20 -0.13 0.00 -0.02 0.00 0.00 57.16 56.86 3mef n GLU 56 Cb 0.01 0.17 -0.09 0.00 -0.02 0.00 0.00 31.44 31.50 3mef n GLU 56 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 3mef s SER 57 N -1.14 -0.53 -0.29 1.62 0.15 -1.26 -2.40 113.70 109.85 3mef s SER 57 Ca 0.02 1.02 0.08 0.00 0.70 0.00 0.00 55.95 57.78 3mef s SER 57 Cb 0.00 1.03 0.46 0.00 -1.71 0.00 0.00 66.02 65.81 3mef s SER 57 CO 0.02 -0.18 1.18 0.61 1.20 0.00 0.00 173.24 176.07 3mef n GLY 58 N 2.79 6.01 4.29 9.45 0.00 -1.26 -4.95 105.19 121.52 3mef n GLY 58 Ca -0.13 -2.54 -0.35 0.00 0.00 0.00 0.00 46.02 42.99 3mef n GLY 58 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3mef n ALA 59 N -0.69 -1.55 -2.67 4.61 0.00 -1.26 -4.80 120.51 114.15 3mef n ALA 59 Ca 0.41 -0.20 -0.04 0.00 0.00 0.00 0.00 53.44 53.60 3mef n ALA 59 Cb 0.94 -2.25 0.10 0.00 0.00 0.00 0.00 19.45 18.25 3mef n ALA 59 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 3mef n LYS 60 N -4.35 0.28 0.00 0.00 2.85 -1.26 -5.15 118.16 110.53 3mef n LYS 60 Ca -0.08 -0.90 0.00 0.00 -1.05 0.00 0.00 58.31 56.29 3mef n LYS 60 Cb 0.56 -0.32 0.00 0.00 -0.65 0.00 0.00 35.03 34.62 3mef n LYS 60 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 3mef n GLY 61 N 0.66 0.54 3.60 2.58 0.00 -1.26 -4.90 105.19 106.41 3mef n GLY 61 Ca -0.03 -1.67 -0.43 0.00 0.00 0.00 0.00 46.02 43.89 3mef n GLY 61 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3mef s PRO 62 N -3.47 3.53 0.52 1.61 0.04 -1.26 -4.08 135.00 131.89 3mef s PRO 62 Ca 0.00 0.88 0.08 0.00 0.04 0.00 0.00 61.00 62.01 3mef s PRO 62 Cb 0.00 -4.04 0.05 0.00 0.04 0.00 0.00 34.50 30.55 3mef s PRO 62 CO 0.00 -1.62 0.63 0.00 0.04 0.00 0.00 177.00 176.05 3mef s ALA 63 N 5.56 4.56 -0.27 8.56 0.00 -1.01 -3.37 121.76 135.78 3mef s ALA 63 Ca 0.61 -1.87 -0.00 0.00 0.00 0.00 0.00 51.96 50.70 3mef s ALA 63 Cb -0.13 -1.30 0.14 0.00 0.00 0.00 0.00 23.12 21.83 3mef s ALA 63 CO 0.32 -0.61 0.37 0.00 0.00 0.00 0.00 175.76 175.84 3mef s ALA 64 N -2.61 -1.00 0.90 0.00 0.00 -1.14 -1.57 121.76 116.35 3mef s ALA 64 Ca 0.54 0.35 -0.12 0.00 0.00 0.00 0.00 51.96 52.73 3mef s ALA 64 Cb -0.06 -1.87 0.13 0.00 0.00 0.00 0.00 23.12 21.32 3mef s ALA 64 CO 0.33 -1.57 1.12 0.20 0.00 0.00 0.00 175.76 175.85 3mef s GLY 65 N 2.50 1.58 0.09 0.00 0.00 -1.20 -4.68 107.32 105.61 3mef s GLY 65 Ca 0.11 -0.43 0.00 0.00 0.00 0.00 0.00 44.72 44.39 3mef s GLY 65 CO -0.25 0.10 0.00 0.70 0.00 0.00 0.00 173.10 173.65 3mef n ASN 66 N -3.76 -8.95 0.00 1.64 3.02 -1.21 0.11 115.26 106.11 3mef n ASN 66 Ca 0.06 1.58 0.00 0.00 -0.03 0.00 0.00 54.58 56.20 3mef n ASN 66 Cb 0.58 -4.94 0.00 0.00 -0.61 0.00 0.00 39.78 34.82 3mef n ASN 66 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 3mef n VAL 67 N 1.76 0.52 -1.00 2.41 0.31 -1.15 -3.11 118.33 118.08 3mef n VAL 67 Ca 0.00 -0.61 -0.29 0.00 -0.01 0.00 0.00 64.34 63.43 3mef n VAL 67 Cb 0.00 0.82 0.19 0.00 -0.91 0.00 0.00 33.84 33.93 3mef n VAL 67 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 3mef s THR 68 N -0.52 2.21 0.87 2.52 -1.32 -1.26 -4.75 115.64 113.38 3mef s THR 68 Ca 0.00 0.07 -0.10 0.00 -1.21 0.00 0.00 61.69 60.44 3mef s THR 68 Cb 0.00 -2.42 0.12 0.00 -1.51 0.00 0.00 72.50 68.68 3mef s THR 68 CO 0.00 -0.09 1.14 -0.94 -2.21 0.00 0.00 174.62 172.52 3mef s SER 69 N -3.17 3.35 0.00 8.08 1.04 -1.26 0.47 113.70 122.21 3mef s SER 69 Ca 0.66 2.12 0.00 0.00 0.48 0.00 0.00 55.95 59.21 3mef s SER 69 Cb -0.20 -2.56 0.00 0.00 0.10 0.00 0.00 66.02 63.36 3mef s SER 69 CO 0.59 -2.82 0.12 0.00 0.98 0.00 0.00 173.24 172.12