#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3mef n GLY 3 N 0.00 2.80 3.68 0.46 0.00 -1.26 -5.14 105.19 105.73 3mef n GLY 3 Ca 0.00 -0.37 -0.31 0.00 0.00 0.00 0.00 46.02 45.34 3mef n GLY 3 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3mef s LYS 4 N 0.00 1.11 -0.02 1.61 3.01 -1.26 -5.04 119.74 119.15 3mef s LYS 4 Ca 0.00 1.40 0.08 0.00 -1.01 0.00 0.00 55.97 56.44 3mef s LYS 4 Cb 0.00 -1.75 -0.02 0.00 -1.01 0.00 0.00 37.83 35.05 3mef s LYS 4 CO 0.00 -2.52 -0.25 0.00 0.51 0.00 0.00 175.35 173.09 3mef s MET 5 N -4.69 2.06 0.91 1.68 0.23 -1.09 -5.04 119.30 113.36 3mef s MET 5 Ca 0.66 -0.91 -0.12 0.00 -1.03 0.00 0.00 55.69 54.29 3mef s MET 5 Cb -0.22 -1.99 0.14 0.00 -1.53 0.00 0.00 34.83 31.23 3mef s MET 5 CO 0.58 0.55 1.10 0.95 -2.03 0.00 0.00 175.02 176.17 3mef s THR 6 N -0.60 2.44 0.00 3.16 -4.23 -1.26 -1.13 115.64 114.01 3mef s THR 6 Ca 0.10 0.14 0.00 0.00 -1.18 0.00 0.00 61.69 60.75 3mef s THR 6 Cb -0.10 -2.73 0.00 0.00 1.34 0.00 0.00 72.50 71.01 3mef s THR 6 CO -0.01 -0.18 0.00 0.61 -0.54 0.00 0.00 174.62 174.50 3mef n GLY 7 N -1.53 -0.54 3.82 3.99 0.00 0.24 -4.59 105.19 106.58 3mef n GLY 7 Ca 0.06 0.84 -0.37 0.00 0.00 0.00 0.00 46.02 46.55 3mef n GLY 7 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3mef s ILE 8 N 0.00 4.70 -0.16 -0.61 -5.25 -0.75 -0.63 121.20 118.51 3mef s ILE 8 Ca 0.00 1.18 -0.21 0.00 -0.99 0.00 0.00 60.65 60.63 3mef s ILE 8 Cb 0.00 -3.87 -0.03 0.00 2.95 0.00 0.00 42.46 41.51 3mef s ILE 8 CO 0.00 0.41 0.61 0.54 -1.79 0.00 0.00 174.94 174.71 3mef s VAL 9 N -1.28 5.06 -0.26 8.37 0.11 0.16 -0.15 120.40 132.42 3mef s VAL 9 Ca 0.34 1.18 -0.01 0.00 -2.93 0.00 0.00 61.98 60.57 3mef s VAL 9 Cb -0.18 -3.93 -0.16 0.00 -1.53 0.00 0.00 36.38 30.57 3mef s VAL 9 CO 0.20 0.18 -0.25 0.29 -3.33 0.00 0.00 175.10 172.19 3mef n LYS 10 N 4.54 0.64 -4.24 1.54 5.02 -1.18 -1.80 118.16 122.67 3mef n LYS 10 Ca -0.03 0.17 -0.14 0.00 -2.02 0.00 0.00 58.31 56.29 3mef n LYS 10 Cb 0.50 -1.51 -0.10 0.00 -0.02 0.00 0.00 35.03 33.90 3mef n LYS 10 CO 0.00 0.00 0.00 -1.58 -0.52 0.00 0.00 177.40 175.30 3mef s TRP 11 N -2.51 1.26 -0.30 2.13 0.52 -1.12 -4.33 118.94 114.59 3mef s TRP 11 Ca -0.35 -0.74 -0.17 0.00 0.02 0.00 0.00 56.10 54.86 3mef s TRP 11 Cb 0.10 -0.64 0.18 0.00 -1.15 0.00 0.00 33.47 31.95 3mef s TRP 11 CO 0.58 0.08 1.11 0.12 0.02 0.00 0.00 176.95 178.86 3mef s PHE 12 N -3.20 -0.43 -0.17 -1.98 5.36 -1.26 -0.94 117.98 115.36 3mef s PHE 12 Ca 0.15 0.73 -0.19 0.00 -0.96 0.00 0.00 56.93 56.66 3mef s PHE 12 Cb 0.02 0.25 -0.03 0.00 -0.34 0.00 0.00 43.02 42.92 3mef s PHE 12 CO 0.01 -0.21 0.55 1.21 -1.46 0.00 0.00 175.22 175.31 3mef s ASN 13 N 2.30 6.65 -0.36 6.13 2.47 -0.73 -4.95 114.94 126.45 3mef s ASN 13 Ca -0.01 0.78 0.07 0.00 0.42 0.00 0.00 52.86 54.12 3mef s ASN 13 Cb -0.04 -2.31 0.62 0.00 -1.45 0.00 0.00 41.25 38.06 3mef s ASN 13 CO -0.17 -0.16 1.71 0.00 -3.72 0.00 0.00 177.10 174.77 3mef n ALA 14 N 4.53 4.85 -0.12 1.71 0.00 -1.26 -1.66 120.51 128.55 3mef n ALA 14 Ca -0.04 -2.87 -0.24 0.00 0.00 0.00 0.00 53.44 50.28 3mef n ALA 14 Cb 0.51 -1.12 -0.09 0.00 0.00 0.00 0.00 19.45 18.74 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 -0.95 1.86 -0.03 0.00 8.00 -1.26 -4.65 116.55 119.52 3mef n ASP 15 Ca 0.45 0.20 0.03 0.00 0.71 0.00 0.00 54.79 56.18 3mef n ASP 15 Cb 1.36 -0.65 -0.15 0.00 -0.02 0.00 0.00 41.12 41.66 3mef n ASP 15 CO 0.00 0.00 0.00 2.29 -0.39 0.00 0.00 177.20 179.10 3mef n LYS 16 N -3.90 0.66 0.00 -1.24 -0.00 -1.26 -5.00 118.16 107.42 3mef n LYS 16 Ca -0.48 -0.08 0.00 0.00 -0.00 0.00 0.00 58.31 57.75 3mef n LYS 16 Cb 0.87 -1.56 0.00 0.00 -0.00 0.00 0.00 35.03 34.34 3mef n LYS 16 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 3mef n GLY 17 N 1.44 0.84 3.51 2.58 0.00 -1.24 -5.09 105.19 107.23 3mef n GLY 17 Ca -0.15 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.64 3mef n GLY 17 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3mef s PHE 18 N -1.55 2.39 -0.06 1.61 2.19 -0.66 -3.99 117.98 117.90 3mef s PHE 18 Ca 0.00 -0.31 -0.07 0.00 0.33 0.00 0.00 56.93 56.88 3mef s PHE 18 Cb 0.00 -1.05 0.02 0.00 -1.31 0.00 0.00 43.02 40.68 3mef s PHE 18 CO 0.00 0.69 0.19 0.20 1.83 0.00 0.00 175.22 178.14 3mef s GLY 19 N -3.55 -0.12 -0.28 13.12 0.00 0.14 -1.77 107.32 114.85 3mef s GLY 19 Ca 0.30 0.47 0.01 0.00 0.00 0.00 0.00 44.72 45.50 3mef s GLY 19 CO 0.16 0.38 -0.05 -0.12 0.00 0.00 0.00 173.10 173.47 3mef s PHE 20 N -0.11 3.28 0.08 1.90 2.19 -0.12 0.31 117.98 125.52 3mef s PHE 20 Ca -0.02 -2.14 0.02 0.00 0.33 0.00 0.00 56.93 55.11 3mef s PHE 20 Cb -0.02 -2.05 -0.04 0.00 -1.31 0.00 0.00 43.02 39.60 3mef s PHE 20 CO 0.01 -0.85 0.15 0.42 1.83 0.00 0.00 175.22 176.78 3mef s ILE 21 N 1.16 4.97 -0.04 3.12 1.01 -0.02 -2.79 121.20 128.62 3mef s ILE 21 Ca -0.07 -0.59 0.04 0.00 0.00 0.00 0.00 60.65 60.03 3mef s ILE 21 Cb -0.20 -3.42 -0.03 0.00 0.01 0.00 0.00 42.46 38.82 3mef s ILE 21 CO -0.03 0.12 -0.15 -0.89 0.00 0.00 0.00 174.94 173.98 3mef s THR 22 N -1.47 2.98 0.00 2.92 2.01 0.79 -2.61 115.64 120.27 3mef s THR 22 Ca 0.32 -0.80 0.00 0.00 0.31 0.00 0.00 61.69 61.52 3mef s THR 22 Cb -0.12 -2.17 0.00 0.00 0.01 0.00 0.00 72.50 70.21 3mef s THR 22 CO 0.25 0.56 0.00 -0.81 -0.69 0.00 0.00 174.62 173.93 3mef n PRO 23 N 2.21 0.24 0.00 4.92 -0.04 -1.26 -1.80 135.00 139.27 3mef n PRO 23 Ca -0.17 0.00 0.05 0.00 -0.04 0.00 0.00 63.50 63.35 3mef n PRO 23 Cb 0.52 0.00 0.33 0.00 -0.04 0.00 0.00 33.50 34.31 3mef n PRO 23 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 3mef n ASP 24 N -1.52 0.00 0.00 3.54 5.68 -1.26 -4.62 116.55 118.36 3mef n ASP 24 Ca 0.00 -0.38 0.00 0.00 -0.50 0.00 0.00 54.79 53.91 3mef n ASP 24 Cb 0.00 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 39.98 3mef n ASP 24 CO 0.00 0.00 0.00 -0.67 -1.33 0.00 0.00 177.20 175.20 3mef n ASP 25 N -0.97 0.00 0.24 -1.12 2.03 -1.26 -4.98 116.55 110.49 3mef n ASP 25 Ca 0.08 0.00 0.07 0.00 0.52 0.00 0.00 54.79 55.47 3mef n ASP 25 Cb 0.04 0.00 0.40 0.00 -0.72 0.00 0.00 41.12 40.83 3mef n ASP 25 CO 0.00 0.00 0.00 1.23 -1.92 0.00 0.00 177.20 176.51 3mef h GLY 26 N 0.00 0.00 0.00 0.27 0.00 -1.99 -3.44 103.07 97.92 3mef h GLY 26 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3mef h GLY 26 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 176.54 175.28 3mef n SER 27 N -2.32 0.00 -4.43 0.19 2.88 -1.26 -5.04 113.62 103.63 3mef n SER 27 Ca -0.01 0.00 -0.37 0.00 -1.33 0.00 0.00 58.87 57.16 3mef n SER 27 Cb 0.49 0.00 0.05 0.00 -0.75 0.00 0.00 64.21 64.00 3mef n SER 27 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 3mef n LYS 28 N 0.00 0.36 -4.00 -1.46 4.76 -1.26 -4.95 118.16 111.61 3mef n LYS 28 Ca 0.00 0.15 -0.30 0.00 -2.87 0.00 0.00 58.31 55.29 3mef n LYS 28 Cb 0.00 -1.67 -0.16 0.00 -1.84 0.00 0.00 35.03 31.36 3mef n LYS 28 CO 0.00 0.00 0.00 0.16 -1.37 0.00 0.00 177.40 176.19 3mef s ASP 29 N -1.28 3.21 -0.17 4.39 1.47 -1.26 -4.10 116.67 118.93 3mef s ASP 29 Ca 0.65 -0.79 -0.08 0.00 1.18 0.00 0.00 52.55 53.52 3mef s ASP 29 Cb -0.40 -1.22 -0.04 0.00 -0.34 0.00 0.00 42.92 40.92 3mef s ASP 29 CO 0.58 -0.12 0.10 0.68 0.68 0.00 0.00 175.17 177.08 3mef s VAL 30 N 1.42 5.11 0.49 2.11 -7.23 -1.07 -4.72 120.40 116.51 3mef s VAL 30 Ca 0.00 0.07 -0.02 0.00 -1.81 0.00 0.00 61.98 60.22 3mef s VAL 30 Cb -0.15 -3.29 -0.01 0.00 0.56 0.00 0.00 36.38 33.49 3mef s VAL 30 CO -0.09 0.50 0.75 0.72 -0.31 0.00 0.00 175.10 176.67 3mef s PHE 31 N -0.01 3.31 0.11 2.82 -0.12 -1.26 -0.84 117.98 121.99 3mef s PHE 31 Ca 0.08 0.46 -0.11 0.00 -0.05 0.00 0.00 56.93 57.31 3mef s PHE 31 Cb -0.12 -2.41 0.01 0.00 -0.63 0.00 0.00 43.02 39.87 3mef s PHE 31 CO 0.00 -0.45 0.26 0.14 -0.05 0.00 0.00 175.22 175.12 3mef s VAL 32 N -2.70 0.11 0.02 -2.49 -7.23 0.15 -2.65 120.40 105.60 3mef s VAL 32 Ca 0.49 -1.08 0.02 0.00 -1.81 0.00 0.00 61.98 59.61 3mef s VAL 32 Cb -0.10 -1.40 -0.02 0.00 0.56 0.00 0.00 36.38 35.42 3mef s VAL 32 CO 0.41 -0.50 -0.08 -1.00 -0.31 0.00 0.00 175.10 173.63 3mef s HIS 33 N -3.87 0.69 0.56 2.82 3.76 -1.26 0.26 115.29 118.25 3mef s HIS 33 Ca 0.07 -0.30 0.42 0.00 -0.15 0.00 0.00 55.06 55.10 3mef s HIS 33 Cb 0.04 -0.42 1.55 0.00 1.11 0.00 0.00 32.58 34.86 3mef s HIS 33 CO -0.09 -0.03 1.61 0.74 -0.85 0.00 0.00 174.74 176.12 3mef h PHE 34 N 5.22 0.00 0.00 1.40 -1.00 -1.91 -0.88 116.94 119.77 3mef h PHE 34 Ca -0.33 0.00 -0.06 0.00 2.81 0.00 0.00 57.97 60.40 3mef h PHE 34 Cb 1.19 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 40.73 3mef h PHE 34 CO 0.52 0.00 -0.02 0.45 -1.61 0.00 0.00 178.31 177.65 3mef n SER 35 N -3.88 3.27 0.00 2.17 2.88 -1.26 -3.69 113.62 113.11 3mef n SER 35 Ca 0.34 -1.98 0.00 0.00 -1.33 0.00 0.00 58.87 55.90 3mef n SER 35 Cb 1.67 -0.78 0.00 0.00 -0.75 0.00 0.00 64.21 64.34 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 2.17 0.00 -2.72 -1.46 0.00 -0.33 -5.02 120.51 113.16 3mef n ALA 36 Ca 0.13 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.52 3mef n ALA 36 Cb 0.43 0.00 0.08 0.00 0.00 0.00 0.00 19.45 19.97 3mef n ALA 36 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 177.50 179.01 3mef n ILE 37 N 0.00 0.56 -3.67 0.00 3.06 -1.24 -4.01 119.36 114.06 3mef n ILE 37 Ca 0.00 -2.13 -0.28 0.00 -2.50 0.00 0.00 62.75 57.85 3mef n ILE 37 Cb 0.00 0.99 -0.05 0.00 0.54 0.00 0.00 39.64 41.11 3mef n ILE 37 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 3mef n GLN 38 N -0.68 -1.30 0.00 9.51 1.13 -1.26 -4.47 117.38 120.31 3mef n GLN 38 Ca -0.01 0.09 0.00 0.00 -1.94 0.00 0.00 57.00 55.14 3mef n GLN 38 Cb 0.84 -4.13 0.00 0.00 0.11 0.00 0.00 30.24 27.06 3mef n GLN 38 CO 0.00 0.00 0.00 -1.71 -1.44 0.00 0.00 177.06 173.91 3mef n ASN 39 N -1.88 -1.30 0.00 1.08 4.05 -1.26 -4.98 115.26 110.97 3mef n ASN 39 Ca 0.08 0.00 0.00 0.00 0.45 0.00 0.00 54.58 55.11 3mef n ASN 39 Cb 0.41 0.00 0.00 0.00 1.23 0.00 0.00 39.78 41.42 3mef n ASN 39 CO 0.00 0.00 0.00 -0.67 -3.05 0.00 0.00 177.26 173.54 3mef n ASP 40 N -3.68 0.00 0.00 1.20 2.03 -1.26 -5.01 116.55 109.83 3mef n ASP 40 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 3mef n ASP 40 Cb 0.00 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 3mef n ASP 40 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3mef n GLY 41 N 0.00 2.93 3.42 0.27 0.00 -1.26 -5.02 105.19 105.53 3mef n GLY 41 Ca 0.00 -0.85 -0.44 0.00 0.00 0.00 0.00 46.02 44.73 3mef n GLY 41 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3mef s TYR 42 N 0.00 3.12 -0.56 1.61 1.13 -1.26 -5.01 117.35 116.39 3mef s TYR 42 Ca 0.00 -0.73 -0.27 0.00 -1.41 0.00 0.00 57.07 54.67 3mef s TYR 42 Cb 0.00 -3.43 -0.03 0.00 -1.10 0.00 0.00 41.96 37.39 3mef s TYR 42 CO 0.00 -0.96 1.99 0.15 -2.51 0.00 0.00 175.55 174.22 3mef s LYS 43 N 2.24 2.56 -0.28 -3.49 -0.14 -1.26 -4.90 119.74 114.47 3mef s LYS 43 Ca 0.10 0.86 -0.22 0.00 -1.36 0.00 0.00 55.97 55.36 3mef s LYS 43 Cb -0.22 -4.42 0.08 0.00 -1.68 0.00 0.00 37.83 31.60 3mef s LYS 43 CO 0.09 -2.80 0.76 -1.12 -0.76 0.00 0.00 175.35 171.53 3mef s SER 44 N 8.92 -0.76 0.15 2.83 0.01 -1.26 -5.18 113.70 118.41 3mef s SER 44 Ca 0.75 1.36 -0.07 0.00 1.31 0.00 0.00 55.95 59.31 3mef s SER 44 Cb -0.14 1.36 -0.02 0.00 0.21 0.00 0.00 66.02 67.43 3mef s SER 44 CO 0.23 -0.23 0.21 -0.76 0.41 0.00 0.00 173.24 173.10 3mef s LEU 45 N 0.76 1.22 0.12 2.44 1.02 -1.26 -5.17 118.68 117.80 3mef s LEU 45 Ca -0.03 -0.97 0.08 0.00 0.02 0.00 0.00 54.13 53.23 3mef s LEU 45 Cb -0.05 0.92 -0.04 0.00 0.02 0.00 0.00 46.19 47.04 3mef s LEU 45 CO -0.07 -0.84 -0.13 -1.81 0.02 0.00 0.00 176.35 173.52 3mef s ASP 46 N -2.99 4.17 -1.37 2.29 1.11 -1.26 -5.04 116.67 113.57 3mef s ASP 46 Ca 0.19 -0.48 -0.16 0.00 0.18 0.00 0.00 52.55 52.29 3mef s ASP 46 Cb 0.05 -0.70 0.04 0.00 1.07 0.00 0.00 42.92 43.37 3mef s ASP 46 CO 0.00 0.17 2.05 -1.84 1.18 0.00 0.00 175.17 176.73 3mef n GLU 47 N 0.68 2.89 0.00 8.23 0.28 -1.26 -3.94 120.64 127.52 3mef n GLU 47 Ca -0.14 -2.80 0.00 0.00 -0.16 0.00 0.00 57.16 54.06 3mef n GLU 47 Cb 0.53 -3.35 0.00 0.00 1.43 0.00 0.00 31.44 30.04 3mef n GLU 47 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 3mef n GLY 48 N 4.59 -1.19 3.13 -1.84 0.00 -0.74 -4.85 105.19 104.29 3mef n GLY 48 Ca 0.51 0.32 -0.14 0.00 0.00 0.00 0.00 46.02 46.70 3mef n GLY 48 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3mef s GLN 49 N 0.00 0.72 -0.22 1.61 -0.21 -1.08 -4.98 119.66 115.50 3mef s GLN 49 Ca 0.00 -0.98 -0.14 0.00 0.02 0.00 0.00 55.36 54.25 3mef s GLN 49 Cb 0.00 -0.48 -0.04 0.00 1.00 0.00 0.00 33.01 33.49 3mef s GLN 49 CO 0.00 0.08 0.34 0.21 -2.12 0.00 0.00 175.29 173.80 3mef s LYS 50 N -2.20 4.12 0.21 2.91 2.20 -1.26 0.39 119.74 126.10 3mef s LYS 50 Ca -0.01 0.06 0.05 0.00 -0.36 0.00 0.00 55.97 55.71 3mef s LYS 50 Cb -0.06 -3.56 -0.05 0.00 -1.51 0.00 0.00 37.83 32.65 3mef s LYS 50 CO 0.00 -0.06 -0.07 0.14 -0.36 0.00 0.00 175.35 175.00 3mef s VAL 51 N 1.40 1.36 -0.14 4.02 -7.23 0.20 -1.35 120.40 118.64 3mef s VAL 51 Ca 0.15 -2.10 0.01 0.00 -1.81 0.00 0.00 61.98 58.23 3mef s VAL 51 Cb -0.15 -2.17 -0.00 0.00 0.56 0.00 0.00 36.38 34.62 3mef s VAL 51 CO 0.08 -0.49 -0.17 -0.55 -0.31 0.00 0.00 175.10 173.66 3mef s SER 52 N -3.30 3.56 0.31 4.85 0.15 -0.37 0.82 113.70 119.72 3mef s SER 52 Ca 0.24 -0.48 0.01 0.00 0.70 0.00 0.00 55.95 56.42 3mef s SER 52 Cb 0.03 -1.54 0.01 0.00 -1.71 0.00 0.00 66.02 62.81 3mef s SER 52 CO 0.07 0.10 0.09 2.22 1.20 0.00 0.00 173.24 176.92 3mef n PHE 53 N 3.95 0.10 -2.26 3.44 1.16 -0.29 -1.21 117.46 122.35 3mef n PHE 53 Ca -0.19 -1.45 0.04 0.00 -1.87 0.00 0.00 57.45 53.98 3mef n PHE 53 Cb 0.52 -0.22 0.06 0.00 -1.61 0.00 0.00 39.48 38.23 3mef n PHE 53 CO 0.00 0.00 0.00 -2.37 -1.87 0.00 0.00 176.76 172.52 3mef n THR 54 N -0.94 0.51 -3.31 1.97 5.66 -0.37 -2.66 114.28 115.14 3mef n THR 54 Ca -0.09 -1.48 -0.15 0.00 -3.05 0.00 0.00 64.05 59.29 3mef n THR 54 Cb 0.38 0.69 0.01 0.00 -1.55 0.00 0.00 70.33 69.86 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 0.10 -2.70 -3.51 1.09 5.41 -1.26 -4.70 119.36 113.78 3mef n ILE 55 Ca 0.09 0.35 -0.19 0.00 1.00 0.00 0.00 62.75 63.99 3mef n ILE 55 Cb 1.02 -3.20 -0.01 0.00 -0.71 0.00 0.00 39.64 36.74 3mef n ILE 55 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 176.55 174.94 3mef s GLU 56 N -1.54 2.92 -0.10 0.38 2.02 -0.36 -4.81 118.70 117.21 3mef s GLU 56 Ca 0.14 -1.17 -0.04 0.00 0.02 0.00 0.00 54.97 53.93 3mef s GLU 56 Cb -0.01 -2.68 -0.04 0.00 0.10 0.00 0.00 34.13 31.50 3mef s GLU 56 CO 0.33 0.01 0.05 0.45 0.02 0.00 0.00 175.26 176.11 3mef s SER 57 N -4.14 5.59 0.00 -0.19 0.15 -1.25 -1.32 113.70 112.54 3mef s SER 57 Ca 0.45 0.23 0.00 0.00 0.70 0.00 0.00 55.95 57.34 3mef s SER 57 Cb -0.08 -1.68 0.00 0.00 -1.71 0.00 0.00 66.02 62.55 3mef s SER 57 CO 0.30 0.37 0.00 0.61 1.20 0.00 0.00 173.24 175.72 3mef n GLY 58 N 2.19 1.62 1.50 9.45 0.00 -1.19 -4.85 105.19 113.90 3mef n GLY 58 Ca -0.19 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 45.78 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 -3.00 2.99 -0.32 4.61 0.00 -1.26 -4.84 120.51 118.69 3mef n ALA 59 Ca 0.00 0.00 0.20 0.00 0.00 0.00 0.00 53.44 53.64 3mef n ALA 59 Cb 0.00 0.00 0.41 0.00 0.00 0.00 0.00 19.45 19.86 3mef n ALA 59 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 3mef h LYS 60 N 0.00 0.20 0.00 0.00 6.56 -2.04 -3.46 116.57 117.84 3mef h LYS 60 Ca 0.00 -0.01 0.00 0.00 -1.06 0.00 0.00 60.65 59.58 3mef h LYS 60 Cb 0.00 -0.04 0.00 0.00 -0.57 0.00 0.00 32.23 31.62 3mef h LYS 60 CO 0.00 0.13 0.00 0.41 -2.06 0.00 0.00 179.45 177.93 3mef n GLY 61 N -1.34 -1.70 3.78 3.86 0.00 -1.26 -5.16 105.19 103.38 3mef n GLY 61 Ca 0.28 0.67 -0.29 0.00 0.00 0.00 0.00 46.02 46.68 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 0.00 0.89 0.00 1.61 0.04 -1.26 -3.18 135.00 133.09 3mef s PRO 62 Ca 0.00 0.19 0.00 0.00 0.04 0.00 0.00 61.00 61.23 3mef s PRO 62 Cb 0.00 -1.82 0.00 0.00 0.04 0.00 0.00 34.50 32.72 3mef s PRO 62 CO 0.00 -2.35 0.00 0.00 0.04 0.00 0.00 177.00 174.69 3mef n ALA 63 N -3.85 0.00 -1.61 8.56 0.00 -0.44 -4.12 120.51 119.05 3mef n ALA 63 Ca 0.08 0.00 -0.50 0.00 0.00 0.00 0.00 53.44 53.02 3mef n ALA 63 Cb 0.59 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.99 3mef n ALA 63 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3mef n ALA 64 N 0.00 -0.33 -2.61 0.00 0.00 -1.08 -1.22 120.51 115.26 3mef n ALA 64 Ca 0.00 0.48 -0.28 0.00 0.00 0.00 0.00 53.44 53.65 3mef n ALA 64 Cb 0.00 -2.13 -0.09 0.00 0.00 0.00 0.00 19.45 17.23 3mef n ALA 64 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3mef s GLY 65 N 0.42 1.76 -1.03 0.00 0.00 -1.26 -4.68 107.32 102.52 3mef s GLY 65 Ca 0.79 -1.36 -0.16 0.00 0.00 0.00 0.00 44.72 44.00 3mef s GLY 65 CO 0.47 -1.36 0.74 0.70 0.00 0.00 0.00 173.10 173.64 3mef n ASN 66 N 0.17 -5.50 -4.50 1.64 3.02 -1.26 -1.24 115.26 107.58 3mef n ASN 66 Ca -0.11 -0.90 -0.43 0.00 -0.03 0.00 0.00 54.58 53.11 3mef n ASN 66 Cb 0.54 -3.20 -0.04 0.00 -0.61 0.00 0.00 39.78 36.48 3mef n ASN 66 CO 0.00 0.00 0.00 0.68 -2.62 0.00 0.00 177.26 175.32 3mef s VAL 67 N -3.32 4.34 -0.18 2.41 -7.23 -1.25 -4.16 120.40 111.02 3mef s VAL 67 Ca 0.33 0.06 -0.18 0.00 -1.81 0.00 0.00 61.98 60.38 3mef s VAL 67 Cb -0.12 -4.60 -0.04 0.00 0.56 0.00 0.00 36.38 32.18 3mef s VAL 67 CO 0.86 -1.26 0.50 0.28 -0.31 0.00 0.00 175.10 175.17 3mef s THR 68 N 4.05 5.13 -0.13 5.32 -1.32 -0.35 -4.01 115.64 124.33 3mef s THR 68 Ca 0.28 0.93 -0.24 0.00 -1.21 0.00 0.00 61.69 61.45 3mef s THR 68 Cb -0.14 -3.83 -0.03 0.00 -1.51 0.00 0.00 72.50 67.00 3mef s THR 68 CO 0.16 0.22 0.73 -0.94 -2.21 0.00 0.00 174.62 172.58 3mef s SER 69 N 1.01 6.92 0.00 8.08 1.04 -1.26 -1.23 113.70 128.25 3mef s SER 69 Ca 0.24 1.11 0.28 0.00 0.48 0.00 0.00 55.95 58.07 3mef s SER 69 Cb -0.15 -2.41 1.07 0.00 0.10 0.00 0.00 66.02 64.62 3mef s SER 69 CO 0.10 -0.24 1.76 0.18 0.98 0.00 0.00 173.24 176.01