#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 3.88 3.35 0.23 0.00 -1.26 -4.87 105.19 106.51 3mef n GLY 3 Ca 0.00 -1.00 -0.18 0.00 0.00 0.00 0.00 46.02 44.84 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 -1.50 1.33 -0.01 1.61 3.01 -1.26 -4.89 119.74 118.04 3mef s LYS 4 Ca 0.29 -1.61 0.01 0.00 -1.01 0.00 0.00 55.97 53.65 3mef s LYS 4 Cb 0.22 -1.05 0.00 0.00 -1.01 0.00 0.00 37.83 35.99 3mef s LYS 4 CO -0.02 0.14 -0.03 0.00 0.51 0.00 0.00 175.35 175.95 3mef s MET 5 N -3.68 0.27 0.31 1.68 0.23 -0.94 -5.04 119.30 112.13 3mef s MET 5 Ca 0.23 -0.09 -0.01 0.00 -1.03 0.00 0.00 55.69 54.79 3mef s MET 5 Cb 0.01 -0.28 -0.04 0.00 -1.53 0.00 0.00 34.83 32.99 3mef s MET 5 CO 0.07 0.04 0.53 0.95 -2.03 0.00 0.00 175.02 174.58 3mef s THR 6 N 0.07 5.10 0.00 3.16 -4.23 -1.26 -1.35 115.64 117.13 3mef s THR 6 Ca -0.00 -0.32 0.00 0.00 -1.18 0.00 0.00 61.69 60.18 3mef s THR 6 Cb -0.03 -3.81 0.00 0.00 1.34 0.00 0.00 72.50 70.00 3mef s THR 6 CO -0.00 -0.45 0.00 0.61 -0.54 0.00 0.00 174.62 174.23 3mef n GLY 7 N -1.43 1.65 3.17 3.99 0.00 0.89 -3.87 105.19 109.58 3mef n GLY 7 Ca -0.04 -0.64 -0.13 0.00 0.00 0.00 0.00 46.02 45.21 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 -2.32 -0.01 0.07 -0.61 -4.36 -0.65 -0.13 121.20 113.19 3mef s ILE 8 Ca 0.00 0.02 -0.25 0.00 -0.26 0.00 0.00 60.65 60.17 3mef s ILE 8 Cb 0.00 -0.42 -0.06 0.00 1.25 0.00 0.00 42.46 43.23 3mef s ILE 8 CO 0.00 0.01 0.76 0.54 0.24 0.00 0.00 174.94 176.49 3mef s VAL 9 N 0.36 4.66 -0.16 8.37 0.11 0.91 0.22 120.40 134.87 3mef s VAL 9 Ca -0.02 1.63 -0.16 0.00 -2.93 0.00 0.00 61.98 60.51 3mef s VAL 9 Cb -0.03 -4.11 -0.05 0.00 -1.53 0.00 0.00 36.38 30.65 3mef s VAL 9 CO -0.01 0.40 -0.30 0.29 -3.33 0.00 0.00 175.10 172.15 3mef n LYS 10 N 2.53 0.47 -4.33 1.54 5.02 -1.11 -0.37 118.16 121.90 3mef n LYS 10 Ca -0.03 0.21 -0.20 0.00 -2.02 0.00 0.00 58.31 56.26 3mef n LYS 10 Cb 0.50 -1.35 -0.11 0.00 -0.02 0.00 0.00 35.03 34.05 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 -2.67 1.76 -0.29 2.13 0.52 -1.08 -3.61 118.94 115.70 3mef s TRP 11 Ca -0.25 -0.51 -0.16 0.00 0.02 0.00 0.00 56.10 55.21 3mef s TRP 11 Cb 0.03 -0.86 0.14 0.00 -1.15 0.00 0.00 33.47 31.64 3mef s TRP 11 CO 0.37 0.34 0.95 0.12 0.02 0.00 0.00 176.95 178.74 3mef s PHE 12 N -2.38 -0.65 -0.12 -1.98 2.19 -1.26 -0.42 117.98 113.37 3mef s PHE 12 Ca 0.18 1.25 -0.02 0.00 0.33 0.00 0.00 56.93 58.68 3mef s PHE 12 Cb -0.04 0.39 -0.03 0.00 -1.31 0.00 0.00 43.02 42.03 3mef s PHE 12 CO 0.07 -0.32 -0.05 -0.80 1.83 0.00 0.00 175.22 175.95 3mef s ASN 13 N 1.61 4.75 -0.01 6.13 0.02 0.21 -4.94 114.94 122.72 3mef s ASN 13 Ca -0.08 -0.07 0.18 0.00 -1.02 0.00 0.00 52.86 51.87 3mef s ASN 13 Cb -0.04 -1.52 -0.22 0.00 0.02 0.00 0.00 41.25 39.48 3mef s ASN 13 CO -0.16 0.26 0.63 0.00 0.02 0.00 0.00 177.10 177.85 3mef n ALA 14 N 2.91 3.75 0.01 0.60 0.00 -1.26 -1.51 120.51 125.01 3mef n ALA 14 Ca -0.18 -0.47 -0.13 0.00 0.00 0.00 0.00 53.44 52.66 3mef n ALA 14 Cb 0.53 -0.63 -0.01 0.00 0.00 0.00 0.00 19.45 19.33 3mef n ALA 14 CO 0.00 0.00 0.00 0.38 0.00 0.00 0.00 177.50 177.88 3mef h ASP 15 N 0.00 0.72 0.10 0.00 2.03 -1.94 -3.32 116.42 114.01 3mef h ASP 15 Ca 0.00 -0.46 -0.37 0.00 -0.73 0.00 0.00 57.03 55.47 3mef h ASP 15 Cb 0.55 -0.21 -0.04 0.00 -0.83 0.00 0.00 39.33 38.80 3mef h ASP 15 CO 0.00 1.22 -2.18 2.29 -1.03 0.00 0.00 179.24 179.54 3mef n LYS 16 N -3.90 0.70 0.00 4.15 2.85 -1.26 -5.04 118.16 115.67 3mef n LYS 16 Ca -0.06 0.20 0.00 0.00 -1.05 0.00 0.00 58.31 57.41 3mef n LYS 16 Cb 0.71 -1.63 0.00 0.00 -0.65 0.00 0.00 35.03 33.46 3mef n LYS 16 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 3mef n GLY 17 N 2.04 0.53 3.49 2.58 0.00 -1.17 -5.12 105.19 107.54 3mef n GLY 17 Ca -0.36 -0.05 -0.10 0.00 0.00 0.00 0.00 46.02 45.51 3mef n GLY 17 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3mef s PHE 18 N -1.05 -0.40 0.35 1.61 0.08 -0.57 -4.46 117.98 113.55 3mef s PHE 18 Ca 0.00 0.28 -0.12 0.00 0.12 0.00 0.00 56.93 57.20 3mef s PHE 18 Cb 0.00 0.54 0.05 0.00 -0.57 0.00 0.00 43.02 43.04 3mef s PHE 18 CO 0.00 -0.61 0.69 0.41 -0.10 0.00 0.00 175.22 175.62 3mef n GLY 19 N -0.20 1.16 2.87 4.36 0.00 0.12 0.65 105.19 114.15 3mef n GLY 19 Ca -0.11 -1.26 -0.22 0.00 0.00 0.00 0.00 46.02 44.43 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 -2.87 0.88 0.33 1.61 0.40 0.44 -0.07 117.98 118.70 3mef s PHE 20 Ca 0.15 -0.29 0.07 0.00 -0.60 0.00 0.00 56.93 56.26 3mef s PHE 20 Cb -0.04 -0.80 -0.02 0.00 0.51 0.00 0.00 43.02 42.66 3mef s PHE 20 CO 0.11 -0.27 0.36 0.42 0.70 0.00 0.00 175.22 176.54 3mef s ILE 21 N 1.27 3.80 -0.33 0.64 1.01 0.72 -2.63 121.20 125.68 3mef s ILE 21 Ca -0.05 -1.22 -0.01 0.00 0.00 0.00 0.00 60.65 59.37 3mef s ILE 21 Cb -0.14 -3.29 0.11 0.00 0.01 0.00 0.00 42.46 39.15 3mef s ILE 21 CO -0.02 -0.18 0.13 -0.89 0.00 0.00 0.00 174.94 173.99 3mef s THR 22 N -2.24 0.79 0.14 2.92 2.01 0.13 -2.57 115.64 116.82 3mef s THR 22 Ca 0.42 -1.53 -0.30 0.00 0.31 0.00 0.00 61.69 60.59 3mef s THR 22 Cb -0.07 -1.59 -0.07 0.00 0.01 0.00 0.00 72.50 70.77 3mef s THR 22 CO 0.28 -0.74 1.13 -2.16 -0.69 0.00 0.00 174.62 172.44 3mef s PRO 23 N 1.44 4.53 0.00 4.92 0.04 -1.22 -1.64 135.00 143.08 3mef s PRO 23 Ca 0.12 1.74 0.00 0.00 0.04 0.00 0.00 61.00 62.89 3mef s PRO 23 Cb -0.19 -3.30 0.00 0.00 0.04 0.00 0.00 34.50 31.05 3mef s PRO 23 CO -0.21 -0.04 1.00 -0.40 0.04 0.00 0.00 177.00 177.39 3mef n ASP 24 N 2.89 0.00 -0.07 6.66 5.68 -1.25 -1.80 116.55 128.66 3mef n ASP 24 Ca 0.05 1.00 0.08 0.00 -0.50 0.00 0.00 54.79 55.42 3mef n ASP 24 Cb 0.46 -0.50 0.45 0.00 -1.14 0.00 0.00 41.12 40.40 3mef n ASP 24 CO 0.00 0.00 0.00 0.44 -1.33 0.00 0.00 177.20 176.31 3mef h ASP 25 N 0.00 0.45 -1.74 -1.12 3.32 -1.94 -3.04 116.42 112.34 3mef h ASP 25 Ca 0.00 0.00 -0.77 0.00 0.02 0.00 0.00 57.03 56.28 3mef h ASP 25 Cb 0.00 -0.10 -0.18 0.00 0.22 0.00 0.00 39.33 39.27 3mef h ASP 25 CO 0.00 0.29 1.74 0.61 -1.72 0.00 0.00 179.24 180.17 3mef n GLY 26 N -1.49 4.94 0.60 2.75 0.00 -0.74 -4.81 105.19 106.44 3mef n GLY 26 Ca 0.08 -2.24 0.47 0.00 0.00 0.00 0.00 46.02 44.32 3mef n GLY 26 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 3mef h SER 27 N 5.54 0.09 -1.61 1.61 0.87 -1.38 -3.23 113.55 115.45 3mef h SER 27 Ca 0.37 0.07 -0.13 0.00 -1.23 0.00 0.00 61.79 60.87 3mef h SER 27 Cb 0.59 0.07 0.08 0.00 -0.44 0.00 0.00 62.40 62.70 3mef h SER 27 CO 1.54 -0.11 -0.06 0.29 -0.53 0.00 0.00 176.83 177.96 3mef n LYS 28 N -4.29 -2.60 -4.39 2.24 5.02 -1.26 -4.82 118.16 108.06 3mef n LYS 28 Ca 0.42 -0.51 -0.21 0.00 -2.02 0.00 0.00 58.31 55.98 3mef n LYS 28 Cb 1.78 -0.71 -0.16 0.00 -0.02 0.00 0.00 35.03 35.92 3mef n LYS 28 CO 0.00 0.00 0.00 0.16 -0.52 0.00 0.00 177.40 177.04 3mef s ASP 29 N -2.28 1.30 0.22 4.39 1.47 -1.26 -4.20 116.67 116.30 3mef s ASP 29 Ca 0.24 -0.20 0.11 0.00 1.18 0.00 0.00 52.55 53.87 3mef s ASP 29 Cb -0.04 -0.50 -0.05 0.00 -0.34 0.00 0.00 42.92 41.99 3mef s ASP 29 CO 0.20 0.02 -0.18 0.68 0.68 0.00 0.00 175.17 176.57 3mef s VAL 30 N 0.52 2.65 0.34 2.11 -7.23 -1.06 -4.97 120.40 112.77 3mef s VAL 30 Ca -0.09 -2.03 -0.06 0.00 -1.81 0.00 0.00 61.98 57.99 3mef s VAL 30 Cb -0.12 -2.32 -0.05 0.00 0.56 0.00 0.00 36.38 34.44 3mef s VAL 30 CO 0.01 -0.20 0.64 0.72 -0.31 0.00 0.00 175.10 175.96 3mef s PHE 31 N -1.93 3.48 0.08 2.82 -0.12 -1.26 -0.20 117.98 120.85 3mef s PHE 31 Ca 0.25 0.77 -0.02 0.00 -0.05 0.00 0.00 56.93 57.88 3mef s PHE 31 Cb -0.07 -2.22 -0.04 0.00 -0.63 0.00 0.00 43.02 40.06 3mef s PHE 31 CO 0.13 0.05 0.02 0.54 -0.05 0.00 0.00 175.22 175.91 3mef s VAL 32 N -2.23 0.17 0.25 -2.49 0.11 0.90 -0.41 120.40 116.70 3mef s VAL 32 Ca 0.46 -1.80 0.03 0.00 -2.93 0.00 0.00 61.98 57.74 3mef s VAL 32 Cb -0.10 -1.71 -0.05 0.00 -1.53 0.00 0.00 36.38 32.98 3mef s VAL 32 CO 0.32 -0.77 0.03 -1.38 -3.33 0.00 0.00 175.10 169.97 3mef s HIS 33 N -3.97 1.57 -0.65 1.54 -3.43 -1.26 0.13 115.29 109.23 3mef s HIS 33 Ca 0.13 -1.01 -0.02 0.00 -0.80 0.00 0.00 55.06 53.36 3mef s HIS 33 Cb 0.08 -0.93 0.41 0.00 -1.43 0.00 0.00 32.58 30.71 3mef s HIS 33 CO -0.05 -0.14 2.05 1.97 -2.00 0.00 0.00 174.74 176.57 3mef n PHE 34 N -0.45 3.03 -1.25 0.38 -1.74 -1.26 -4.23 117.46 111.95 3mef n PHE 34 Ca -0.03 -2.85 0.08 0.00 -0.56 0.00 0.00 57.45 54.09 3mef n PHE 34 Cb 0.65 -1.38 0.12 0.00 1.52 0.00 0.00 39.48 40.38 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 -0.74 1.93 -1.73 5.98 2.88 -1.26 -4.71 113.62 115.97 3mef n SER 35 Ca 0.59 -2.92 -0.02 0.00 -1.33 0.00 0.00 58.87 55.20 3mef n SER 35 Cb 0.61 -0.39 0.04 0.00 -0.75 0.00 0.00 64.21 63.71 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 -1.18 0.51 -2.36 -1.46 0.00 -1.26 -5.10 120.51 109.66 3mef n ALA 36 Ca 0.13 -0.44 -0.21 0.00 0.00 0.00 0.00 53.44 52.92 3mef n ALA 36 Cb 0.65 -0.56 0.14 0.00 0.00 0.00 0.00 19.45 19.68 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 -0.56 0.00 -3.31 0.00 3.06 -1.26 -2.03 119.36 115.27 3mef n ILE 37 Ca -0.10 -1.30 -0.26 0.00 -2.50 0.00 0.00 62.75 58.59 3mef n ILE 37 Cb 0.63 -1.12 -0.09 0.00 0.54 0.00 0.00 39.64 39.60 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 -3.02 0.44 -2.75 9.51 3.00 0.45 -4.75 117.38 120.26 3mef n GLN 38 Ca 0.16 -3.21 -0.03 0.00 -0.01 0.00 0.00 57.00 53.90 3mef n GLN 38 Cb 0.55 -1.48 0.07 0.00 0.00 0.00 0.00 30.24 29.38 3mef n GLN 38 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.06 177.33 3mef n ASN 39 N 2.19 0.51 0.00 1.08 2.04 -1.26 -4.25 115.26 115.57 3mef n ASN 39 Ca 0.26 -2.24 0.00 0.00 -0.44 0.00 0.00 54.58 52.16 3mef n ASN 39 Cb 0.50 -0.07 0.00 0.00 -2.53 0.00 0.00 39.78 37.68 3mef n ASN 39 CO 0.00 0.00 0.00 0.47 -0.44 0.00 0.00 177.26 177.29 3mef n ASP 40 N -0.72 0.00 0.00 0.53 8.00 -1.26 -4.60 116.55 118.50 3mef n ASP 40 Ca 0.01 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.51 3mef n ASP 40 Cb 0.83 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.93 3mef n ASP 40 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3mef n GLY 41 N 0.00 5.44 3.01 0.44 0.00 -1.26 -5.00 105.19 107.81 3mef n GLY 41 Ca 0.00 -0.86 -0.16 0.00 0.00 0.00 0.00 46.02 45.00 3mef n GLY 41 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 3mef n TYR 42 N 0.00 -1.23 -1.70 1.61 9.36 -1.26 -4.56 117.16 119.38 3mef n TYR 42 Ca 0.00 0.51 -0.54 0.00 3.32 0.00 0.00 57.90 61.19 3mef n TYR 42 Cb 0.00 -1.38 -0.06 0.00 -0.63 0.00 0.00 39.34 37.27 3mef n TYR 42 CO 0.00 0.00 0.00 1.63 0.22 0.00 0.00 176.86 178.71 3mef n LYS 43 N -1.26 1.47 -3.64 2.98 4.76 -1.26 -4.93 118.16 116.28 3mef n LYS 43 Ca -0.15 0.54 -0.04 0.00 -2.87 0.00 0.00 58.31 55.79 3mef n LYS 43 Cb 0.39 -2.27 -0.07 0.00 -1.84 0.00 0.00 35.03 31.24 3mef n LYS 43 CO 0.00 0.00 0.00 -1.12 -1.37 0.00 0.00 177.40 174.91 3mef s SER 44 N 3.50 -0.44 0.08 4.39 0.01 -1.26 -5.12 113.70 114.86 3mef s SER 44 Ca 0.96 0.75 0.01 0.00 1.31 0.00 0.00 55.95 58.97 3mef s SER 44 Cb -0.95 1.02 -0.04 0.00 0.21 0.00 0.00 66.02 66.27 3mef s SER 44 CO 0.60 -0.12 -0.05 -0.76 0.41 0.00 0.00 173.24 173.32 3mef s LEU 45 N 0.90 2.48 0.27 2.44 1.43 -1.26 -5.04 118.68 119.90 3mef s LEU 45 Ca -0.04 -0.96 0.04 0.00 -1.03 0.00 0.00 54.13 52.14 3mef s LEU 45 Cb -0.04 0.02 -0.03 0.00 0.03 0.00 0.00 46.19 46.17 3mef s LEU 45 CO -0.12 -0.49 0.41 -1.81 0.23 0.00 0.00 176.35 174.57 3mef s ASP 46 N -2.85 6.26 -0.25 2.29 1.01 -1.26 -5.08 116.67 116.78 3mef s ASP 46 Ca 0.08 0.10 -0.18 0.00 0.71 0.00 0.00 52.55 53.26 3mef s ASP 46 Cb 0.05 -1.80 -0.03 0.00 1.01 0.00 0.00 42.92 42.15 3mef s ASP 46 CO -0.06 -0.17 0.51 -1.83 0.21 0.00 0.00 175.17 173.84 3mef s GLU 47 N -4.07 4.09 0.00 8.23 -1.05 -1.26 -4.02 118.70 120.62 3mef s GLU 47 Ca 0.37 0.34 0.00 0.00 -0.15 0.00 0.00 54.97 55.53 3mef s GLU 47 Cb -0.09 -3.63 0.00 0.00 -0.44 0.00 0.00 34.13 29.97 3mef s GLU 47 CO 0.31 -0.31 0.00 0.41 0.95 0.00 0.00 175.26 176.62 3mef n GLY 48 N 4.29 0.91 3.75 -3.83 0.00 0.50 -5.01 105.19 105.80 3mef n GLY 48 Ca -0.04 -0.59 -0.31 0.00 0.00 0.00 0.00 46.02 45.08 3mef n GLY 48 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3mef s GLN 49 N -4.37 2.84 -0.24 1.61 0.74 -0.99 -4.90 119.66 114.36 3mef s GLN 49 Ca 0.00 -0.67 -0.29 0.00 0.05 0.00 0.00 55.36 54.45 3mef s GLN 49 Cb 0.00 -2.71 0.01 0.00 1.10 0.00 0.00 33.01 31.41 3mef s GLN 49 CO 0.00 0.59 1.07 0.21 -0.55 0.00 0.00 175.29 176.60 3mef s LYS 50 N -2.13 4.22 0.06 1.67 2.20 -1.26 -0.06 119.74 124.44 3mef s LYS 50 Ca 0.26 1.34 -0.00 0.00 -0.36 0.00 0.00 55.97 57.20 3mef s LYS 50 Cb -0.12 -3.67 -0.04 0.00 -1.51 0.00 0.00 37.83 32.49 3mef s LYS 50 CO 0.18 -0.69 -0.04 0.14 -0.36 0.00 0.00 175.35 174.59 3mef s VAL 51 N 3.31 0.30 0.44 4.02 -7.23 0.81 -1.07 120.40 120.98 3mef s VAL 51 Ca 0.45 -1.75 0.07 0.00 -1.81 0.00 0.00 61.98 58.94 3mef s VAL 51 Cb -0.15 -1.43 -0.03 0.00 0.56 0.00 0.00 36.38 35.32 3mef s VAL 51 CO 0.08 -0.93 0.21 -0.94 -0.31 0.00 0.00 175.10 173.22 3mef s SER 52 N -2.80 4.47 0.00 4.85 1.04 0.37 -0.08 113.70 121.55 3mef s SER 52 Ca 0.06 -1.13 0.00 0.00 0.48 0.00 0.00 55.95 55.36 3mef s SER 52 Cb 0.06 -0.27 0.00 0.00 0.10 0.00 0.00 66.02 65.91 3mef s SER 52 CO -0.08 -0.66 0.00 2.22 0.98 0.00 0.00 173.24 175.70 3mef n PHE 53 N -1.34 -0.07 -2.14 5.02 -1.74 -0.46 -2.40 117.46 114.33 3mef n PHE 53 Ca -0.02 0.00 -0.04 0.00 -0.56 0.00 0.00 57.45 56.83 3mef n PHE 53 Cb 0.65 0.00 -0.04 0.00 1.52 0.00 0.00 39.48 41.60 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 0.00 0.00 -2.69 1.97 5.66 0.21 -2.21 114.28 117.21 3mef n THR 54 Ca 0.00 -0.28 -0.20 0.00 -3.05 0.00 0.00 64.05 60.53 3mef n THR 54 Cb 0.00 0.62 0.02 0.00 -1.55 0.00 0.00 70.33 69.42 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 0.14 -2.34 -1.93 1.09 2.08 -1.06 -4.87 119.36 112.47 3mef n ILE 55 Ca -0.17 0.15 -0.30 0.00 0.56 0.00 0.00 62.75 62.98 3mef n ILE 55 Cb 0.82 -2.40 0.02 0.00 -0.75 0.00 0.00 39.64 37.33 3mef n ILE 55 CO 0.00 0.00 0.00 -1.61 0.56 0.00 0.00 176.55 175.50 3mef s GLU 56 N -1.43 3.31 -0.03 0.38 2.02 0.29 -4.67 118.70 118.56 3mef s GLU 56 Ca 0.19 0.59 0.07 0.00 0.02 0.00 0.00 54.97 55.85 3mef s GLU 56 Cb -0.02 -2.08 -0.02 0.00 0.10 0.00 0.00 34.13 32.11 3mef s GLU 56 CO 0.44 -0.72 -0.24 0.45 0.02 0.00 0.00 175.26 175.20 3mef s SER 57 N -4.24 3.22 0.00 -0.19 0.15 -1.23 0.28 113.70 111.69 3mef s SER 57 Ca 0.56 -0.43 0.00 0.00 0.70 0.00 0.00 55.95 56.78 3mef s SER 57 Cb -0.11 -0.49 0.00 0.00 -1.71 0.00 0.00 66.02 63.71 3mef s SER 57 CO 0.52 0.31 0.00 0.61 1.20 0.00 0.00 173.24 175.89 3mef n GLY 58 N 2.49 0.26 0.11 9.45 0.00 -1.26 -5.02 105.19 111.22 3mef n GLY 58 Ca -0.16 -0.14 0.00 0.00 0.00 0.00 0.00 46.02 45.71 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 -1.32 0.95 -1.66 4.61 0.00 -1.26 -5.05 120.51 116.77 3mef n ALA 59 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.40 3mef n ALA 59 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 3mef n ALA 59 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3mef n LYS 60 N -1.60 0.00 0.00 0.00 4.01 -1.26 -5.09 118.16 114.22 3mef n LYS 60 Ca 0.00 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.80 3mef n LYS 60 Cb 0.00 0.00 0.00 0.00 -0.51 0.00 0.00 35.03 34.52 3mef n LYS 60 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 3mef n GLY 61 N 2.92 -0.02 3.78 0.72 0.00 -1.26 -5.01 105.19 106.31 3mef n GLY 61 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 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 -0.63 4.16 0.00 1.61 0.04 -1.26 -3.48 135.00 135.45 3mef s PRO 62 Ca 0.00 1.53 0.00 0.00 0.04 0.00 0.00 61.00 62.57 3mef s PRO 62 Cb 0.00 -2.56 0.00 0.00 0.04 0.00 0.00 34.50 31.98 3mef s PRO 62 CO 0.00 -0.15 0.00 0.00 0.04 0.00 0.00 177.00 176.89 3mef n ALA 63 N -0.04 0.00 0.00 8.56 0.00 0.14 -4.63 120.51 124.54 3mef n ALA 63 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.49 3mef n ALA 63 Cb 0.49 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.94 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 0.00 0.00 0.00 0.00 0.45 -1.61 120.51 119.35 3mef n ALA 64 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 3mef n ALA 64 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 3mef n ALA 64 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3mef n GLY 65 N 0.00 1.15 3.29 0.00 0.00 -1.26 0.10 105.19 108.48 3mef n GLY 65 Ca 0.00 -0.58 -0.13 0.00 0.00 0.00 0.00 46.02 45.31 3mef n GLY 65 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3mef n ASN 66 N 0.00 -6.72 -4.56 1.61 3.02 -1.23 0.64 115.26 108.02 3mef n ASN 66 Ca 0.00 -0.56 -0.42 0.00 -0.03 0.00 0.00 54.58 53.57 3mef n ASN 66 Cb 0.00 -4.70 -0.03 0.00 -0.61 0.00 0.00 39.78 34.44 3mef n ASN 66 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 3mef s VAL 67 N -3.24 4.04 0.09 2.41 1.01 -0.86 -3.69 120.40 120.16 3mef s VAL 67 Ca 0.27 0.61 0.10 0.00 0.00 0.00 0.00 61.98 62.96 3mef s VAL 67 Cb -0.05 -4.73 -0.03 0.00 0.00 0.00 0.00 36.38 31.56 3mef s VAL 67 CO 0.78 -1.42 -0.25 0.28 0.00 0.00 0.00 175.10 174.49 3mef s THR 68 N 4.89 2.06 0.17 3.92 -1.32 -1.01 -0.41 115.64 123.93 3mef s THR 68 Ca 0.38 -1.56 -0.22 0.00 -1.21 0.00 0.00 61.69 59.08 3mef s THR 68 Cb -0.09 -1.81 -0.08 0.00 -1.51 0.00 0.00 72.50 69.01 3mef s THR 68 CO 0.21 0.14 0.71 -0.94 -2.21 0.00 0.00 174.62 172.53 3mef s SER 69 N -1.73 7.18 0.00 8.08 1.04 -1.26 -0.47 113.70 126.53 3mef s SER 69 Ca 0.11 1.47 0.32 0.00 0.48 0.00 0.00 55.95 58.32 3mef s SER 69 Cb -0.10 -2.43 1.82 0.00 0.10 0.00 0.00 66.02 65.41 3mef s SER 69 CO 0.04 0.15 2.18 0.18 0.98 0.00 0.00 173.24 176.77