#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fmc s THR 2 N 0.00 5.29 -0.20 0.00 2.01 -0.26 -4.86 115.64 117.62 2fmc s THR 2 Ca 0.00 -0.15 -0.29 0.00 0.31 0.00 0.00 61.69 61.56 2fmc s THR 2 Cb 0.00 -3.69 0.01 0.00 0.01 0.00 0.00 72.50 68.83 2fmc s THR 2 CO 0.00 0.03 1.03 -0.89 -0.69 0.00 0.00 174.62 174.10 2fmc s THR 3 N 1.73 4.70 -0.09 -0.82 2.01 -1.26 -0.15 115.64 121.76 2fmc s THR 3 Ca 0.06 2.03 -0.29 0.00 0.31 0.00 0.00 61.69 63.80 2fmc s THR 3 Cb -0.17 -4.31 -0.02 0.00 0.01 0.00 0.00 72.50 68.01 2fmc s THR 3 CO 0.11 -0.14 0.99 -0.63 -0.69 0.00 0.00 174.62 174.25 2fmc s ILE 4 N 2.94 4.81 0.41 1.82 1.01 0.04 -4.95 121.20 127.28 2fmc s ILE 4 Ca 0.45 2.02 0.08 0.00 0.00 0.00 0.00 60.65 63.19 2fmc s ILE 4 Cb -0.16 -4.30 -0.03 0.00 0.01 0.00 0.00 42.46 37.99 2fmc s ILE 4 CO 0.09 0.04 0.34 -0.83 0.00 0.00 0.00 174.94 174.57 2fmc s GLY 5 N 1.08 2.15 0.23 6.18 0.00 -1.26 -0.84 107.32 114.85 2fmc s GLY 5 Ca 0.48 -1.91 -0.07 0.00 0.00 0.00 0.00 44.72 43.22 2fmc s GLY 5 CO 0.19 -1.73 1.85 -2.55 0.00 0.00 0.00 173.10 170.86 2fmc h PRO 6 N 1.10 1.22 -2.24 2.90 0.11 -1.96 -3.15 132.00 129.98 2fmc h PRO 6 Ca -0.42 -0.15 -0.61 0.00 0.11 0.00 0.00 66.00 64.94 2fmc h PRO 6 Cb 1.26 -0.24 -0.41 0.00 0.11 0.00 0.00 31.00 31.72 2fmc h PRO 6 CO 0.59 0.90 -0.55 0.27 -0.21 0.00 0.00 178.00 179.00 2fmc n ASN 7 N -4.35 4.09 -0.15 -2.05 0.23 -1.26 -4.89 115.26 106.88 2fmc n ASN 7 Ca 0.09 -3.52 -0.08 0.00 -0.53 0.00 0.00 54.58 50.54 2fmc n ASN 7 Cb 0.10 -0.66 0.00 0.00 -2.08 0.00 0.00 39.78 37.14 2fmc n ASN 7 CO 0.00 0.00 0.00 0.74 -0.93 0.00 0.00 177.26 177.07 2fmc h THR 8 N 3.12 1.17 -3.59 5.53 2.02 -1.96 -3.41 112.91 115.78 2fmc h THR 8 Ca 0.18 -0.47 -0.68 0.00 0.77 0.00 0.00 66.41 66.21 2fmc h THR 8 Cb 0.61 0.69 -0.32 0.00 -1.74 0.00 0.00 68.15 67.39 2fmc h THR 8 CO 0.85 0.19 -0.87 0.00 0.37 0.00 0.00 175.52 176.06 2fmc n SER 10 N 3.29 3.98 -2.15 0.00 7.64 -1.26 -4.86 113.62 120.25 2fmc n SER 10 Ca -0.18 -2.85 -0.06 0.00 1.01 0.00 0.00 58.87 56.79 2fmc n SER 10 Cb 0.53 -1.66 -0.02 0.00 -1.01 0.00 0.00 64.21 62.05 2fmc n SER 10 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65 2fmc n ILE 11 N 5.32 0.00 0.00 0.44 5.41 -1.26 -5.17 119.36 124.10 2fmc n ILE 11 Ca 0.51 -0.55 0.00 0.00 1.00 0.00 0.00 62.75 63.71 2fmc n ILE 11 Cb 0.40 0.18 0.00 0.00 -0.71 0.00 0.00 39.64 39.51 2fmc n ILE 11 CO 0.00 0.00 0.00 -0.90 0.00 0.00 0.00 176.55 175.65 2fmc n ASP 12 N -1.75 0.00 -4.55 4.38 5.75 -1.26 -4.82 116.55 114.30 2fmc n ASP 12 Ca -0.02 0.00 -0.38 0.00 -0.01 0.00 0.00 54.79 54.38 2fmc n ASP 12 Cb 0.14 0.00 -0.03 0.00 -1.03 0.00 0.00 41.12 40.20 2fmc n ASP 12 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 2fmc s ASP 13 N -1.00 5.13 0.00 -1.12 2.15 -1.26 -4.91 116.67 115.67 2fmc s ASP 13 Ca 0.00 0.61 -0.10 0.00 0.43 0.00 0.00 52.55 53.49 2fmc s ASP 13 Cb 0.00 -2.52 0.01 0.00 -0.30 0.00 0.00 42.92 40.11 2fmc s ASP 13 CO 0.00 -2.43 0.20 -0.31 -0.17 0.00 0.00 175.17 172.46 2fmc s TYR 14 N 9.60 -0.03 -0.07 -5.34 2.02 -1.26 -4.70 117.35 117.56 2fmc s TYR 14 Ca 0.76 -0.03 0.03 0.00 -0.37 0.00 0.00 57.07 57.46 2fmc s TYR 14 Cb -0.15 0.00 -0.02 0.00 -0.40 0.00 0.00 41.96 41.40 2fmc s TYR 14 CO 0.23 -0.34 -0.18 0.15 -1.57 0.00 0.00 175.55 173.84 2fmc s LYS 15 N -1.53 2.77 0.05 -0.62 -0.14 -1.02 -4.95 119.74 114.30 2fmc s LYS 15 Ca -0.13 -0.77 -0.31 0.00 -1.36 0.00 0.00 55.97 53.40 2fmc s LYS 15 Cb -0.06 -2.37 -0.06 0.00 -1.68 0.00 0.00 37.83 33.66 2fmc s LYS 15 CO 0.02 0.42 1.24 -2.14 -0.76 0.00 0.00 175.35 174.13 2fmc s PRO 16 N -0.22 4.39 0.07 -1.68 0.02 -1.26 -1.96 135.00 134.35 2fmc s PRO 16 Ca -0.00 1.81 0.08 0.00 0.02 0.00 0.00 61.00 62.91 2fmc s PRO 16 Cb -0.13 -3.39 -0.03 0.00 0.02 0.00 0.00 34.50 30.97 2fmc s PRO 16 CO 0.03 -0.33 -0.22 0.71 -0.33 0.00 0.00 177.00 176.86 2fmc s TYR 17 N 1.35 1.91 -0.38 6.54 2.02 0.12 -0.35 117.35 128.57 2fmc s TYR 17 Ca 0.59 -0.39 -0.16 0.00 -0.37 0.00 0.00 57.07 56.74 2fmc s TYR 17 Cb -0.30 -1.11 0.00 0.00 -0.40 0.00 0.00 41.96 40.16 2fmc s TYR 17 CO 0.28 0.14 0.41 0.00 -1.57 0.00 0.00 175.55 174.82 2fmc s GLN 20 N -2.17 4.71 0.14 0.00 1.11 -1.26 -0.03 119.66 122.15 2fmc s GLN 20 Ca 0.10 1.37 0.02 0.00 0.01 0.00 0.00 55.36 56.86 2fmc s GLN 20 Cb -0.09 -3.12 -0.04 0.00 -1.01 0.00 0.00 33.01 28.76 2fmc s GLN 20 CO 0.05 0.45 0.27 -1.12 0.01 0.00 0.00 175.29 174.95 2fmc s SER 21 N -1.33 6.33 -0.65 5.90 0.01 -1.26 -4.80 113.70 117.90 2fmc s SER 21 Ca 0.43 0.18 0.01 0.00 1.31 0.00 0.00 55.95 57.88 2fmc s SER 21 Cb -0.23 -1.91 0.40 0.00 0.21 0.00 0.00 66.02 64.49 2fmc s SER 21 CO 0.28 0.07 1.72 0.80 0.41 0.00 0.00 173.24 176.52 2fmc n MET 22 N -0.42 3.00 -2.00 12.44 1.56 -1.26 -4.92 117.12 125.52 2fmc n MET 22 Ca -0.07 -3.78 -0.42 0.00 -0.27 0.00 0.00 57.70 53.16 2fmc n MET 22 Cb 0.54 -2.27 -0.00 0.00 2.15 0.00 0.00 33.22 33.63 2fmc n MET 22 CO 0.00 0.00 0.00 -1.13 -0.73 0.00 0.00 175.97 174.11 2fmc n SER 23 N -0.62 4.20 0.00 6.12 3.41 -1.26 -4.82 113.62 120.64 2fmc n SER 23 Ca 0.51 -2.86 0.00 0.00 -0.26 0.00 0.00 58.87 56.26 2fmc n SER 23 Cb 0.50 -1.69 0.00 0.00 -0.26 0.00 0.00 64.21 62.76 2fmc n SER 23 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2fmc n GLY 24 N 4.52 0.69 3.57 5.00 0.00 -1.26 -4.85 105.19 112.86 2fmc n GLY 24 Ca 0.51 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 46.19 2fmc n GLY 24 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2fmc s PRO 25 N 1.49 3.12 0.48 1.61 0.02 -1.26 -4.97 135.00 135.49 2fmc s PRO 25 Ca 0.00 -1.29 -0.20 0.00 0.02 0.00 0.00 61.00 59.53 2fmc s PRO 25 Cb 0.00 -5.32 -0.08 0.00 0.02 0.00 0.00 34.50 29.11 2fmc s PRO 25 CO 0.00 -3.12 1.05 0.00 -0.33 0.00 0.00 177.00 174.60 2fmc s ALA 26 N 7.97 2.87 0.00 -1.55 0.00 -1.26 -3.82 121.76 125.96 2fmc s ALA 26 Ca 0.61 0.64 0.00 0.00 0.00 0.00 0.00 51.96 53.21 2fmc s ALA 26 Cb -0.00 -3.27 0.00 0.00 0.00 0.00 0.00 23.12 19.85 2fmc s ALA 26 CO 0.06 -0.35 0.00 0.41 0.00 0.00 0.00 175.76 175.88 2fmc n GLY 27 N -0.16 0.69 3.62 0.00 0.00 -1.26 -5.03 105.19 103.06 2fmc n GLY 27 Ca 0.09 -0.55 -0.43 0.00 0.00 0.00 0.00 46.02 45.13 2fmc n GLY 27 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2fmc s SER 28 N -2.50 6.60 0.00 1.61 1.04 -1.25 -4.89 113.70 114.30 2fmc s SER 28 Ca 0.00 1.12 0.07 0.00 0.48 0.00 0.00 55.95 57.62 2fmc s SER 28 Cb 0.00 -2.54 0.26 0.00 0.10 0.00 0.00 66.02 63.85 2fmc s SER 28 CO 0.00 -1.16 1.20 -0.81 0.98 0.00 0.00 173.24 173.45 2fmc n PRO 29 N 7.49 1.34 -2.60 4.02 -0.04 -1.26 -4.12 135.00 139.84 2fmc n PRO 29 Ca 0.15 -0.53 -0.30 0.00 -0.04 0.00 0.00 63.50 62.78 2fmc n PRO 29 Cb 0.47 -1.15 -0.01 0.00 -0.04 0.00 0.00 33.50 32.77 2fmc n PRO 29 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2fmc n GLY 30 N 0.77 5.82 0.13 0.55 0.00 -1.26 -4.68 105.19 106.52 2fmc n GLY 30 Ca 0.07 -2.72 -0.23 0.00 0.00 0.00 0.00 46.02 43.14 2fmc n GLY 30 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2fmc n LEU 31 N -0.35 2.58 0.00 0.99 4.77 -1.26 -5.09 117.00 118.64 2fmc n LEU 31 Ca 0.39 0.05 0.00 0.00 -0.03 0.00 0.00 56.01 56.42 2fmc n LEU 31 Cb 0.46 -0.88 0.00 0.00 -2.33 0.00 0.00 43.42 40.67 2fmc n LEU 31 CO 0.38 0.80 0.00 0.18 -1.33 0.00 0.00 177.39 177.42 2fmc n LEU 32 N -3.65 0.00 -2.74 2.23 4.32 -1.26 -4.73 117.00 111.17 2fmc n LEU 32 Ca -0.49 0.00 -0.09 0.00 -0.02 0.00 0.00 56.01 55.41 2fmc n LEU 32 Cb 0.95 0.00 0.08 0.00 -1.62 0.00 0.00 43.42 42.83 2fmc n LEU 32 CO 0.17 -0.63 0.30 -0.46 -1.22 0.00 0.00 177.39 175.55 2fmc n ASN 33 N -3.05 -2.40 0.17 -1.43 6.94 -1.26 -5.02 115.26 109.21 2fmc n ASN 33 Ca 0.00 -3.60 -0.08 0.00 -0.02 0.00 0.00 54.58 50.88 2fmc n ASN 33 Cb 0.00 1.86 -0.04 0.00 -2.36 0.00 0.00 39.78 39.24 2fmc n ASN 33 CO 0.00 0.00 0.00 0.25 -1.03 0.00 0.00 177.26 176.48 2fmc h LEU 34 N 3.23 -0.43 -7.94 -4.53 5.85 -2.05 -3.44 115.31 105.99 2fmc h LEU 34 Ca -0.11 0.01 -0.55 0.00 0.84 0.00 0.00 57.88 58.08 2fmc h LEU 34 Cb 1.08 0.11 -0.35 0.00 0.37 0.00 0.00 40.66 41.88 2fmc h LEU 34 CO 0.18 -0.04 -0.82 -0.63 -0.34 0.00 0.00 178.44 176.79 2fmc s ILE 35 N -3.23 1.29 0.07 4.05 1.01 -1.26 -5.11 121.20 118.03 2fmc s ILE 35 Ca -0.07 -0.52 -0.32 0.00 0.00 0.00 0.00 60.65 59.73 2fmc s ILE 35 Cb 0.01 -1.20 -0.11 0.00 0.01 0.00 0.00 42.46 41.17 2fmc s ILE 35 CO 0.22 0.40 1.84 -0.81 0.00 0.00 0.00 174.94 176.59 2fmc n PRO 36 N 4.21 2.62 -3.61 2.79 -0.04 -1.26 -4.96 135.00 134.75 2fmc n PRO 36 Ca -0.19 0.95 -0.40 0.00 -0.04 0.00 0.00 63.50 63.83 2fmc n PRO 36 Cb 0.51 -2.84 -0.09 0.00 -0.04 0.00 0.00 33.50 31.04 2fmc n PRO 36 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2fmc s VAL 37 N 3.07 3.99 -0.06 0.52 1.01 -1.26 -5.07 120.40 122.61 2fmc s VAL 37 Ca 0.85 -1.95 -0.03 0.00 0.00 0.00 0.00 61.98 60.85 2fmc s VAL 37 Cb -0.54 -3.65 -0.04 0.00 0.00 0.00 0.00 36.38 32.16 2fmc s VAL 37 CO 0.41 -0.77 0.11 -0.62 0.00 0.00 0.00 175.10 174.23 2fmc s ASP 38 N 2.33 6.00 -0.14 3.32 2.15 -1.26 -4.99 116.67 124.08 2fmc s ASP 38 Ca 0.07 0.30 0.23 0.00 0.43 0.00 0.00 52.55 53.58 2fmc s ASP 38 Cb -0.25 -1.83 0.46 0.00 -0.30 0.00 0.00 42.92 41.00 2fmc s ASP 38 CO -0.02 0.33 1.15 0.18 -0.17 0.00 0.00 175.17 176.64 2fmc n LEU 39 N 1.56 1.54 -0.05 -1.34 4.32 -1.26 -4.85 117.00 116.92 2fmc n LEU 39 Ca -0.16 -2.68 0.09 0.00 -0.02 0.00 0.00 56.01 53.24 2fmc n LEU 39 Cb 0.54 0.15 -0.09 0.00 -1.62 0.00 0.00 43.42 42.39 2fmc n LEU 39 CO 0.35 0.86 -0.01 -1.20 -1.22 0.00 0.00 177.39 176.18 2fmc n SER 40 N -0.12 0.98 -1.36 -1.43 7.64 -1.26 -4.19 113.62 113.89 2fmc n SER 40 Ca 0.09 -0.99 0.11 0.00 1.01 0.00 0.00 58.87 59.09 2fmc n SER 40 Cb 0.97 0.94 0.32 0.00 -1.01 0.00 0.00 64.21 65.43 2fmc n SER 40 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2fmc n ALA 41 N -1.27 2.54 -3.54 -0.43 0.00 -1.26 -4.72 120.51 111.82 2fmc n ALA 41 Ca 0.04 -1.30 -0.24 0.00 0.00 0.00 0.00 53.44 51.95 2fmc n ALA 41 Cb 0.30 -0.96 -0.15 0.00 0.00 0.00 0.00 19.45 18.64 2fmc n ALA 41 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2fmc s SER 42 N -0.97 2.22 -0.10 0.00 0.01 -1.26 -4.55 113.70 109.05 2fmc s SER 42 Ca 0.48 -0.63 0.01 0.00 1.31 0.00 0.00 55.95 57.12 2fmc s SER 42 Cb 0.26 -0.01 0.02 0.00 0.21 0.00 0.00 66.02 66.50 2fmc s SER 42 CO 0.30 -0.36 -0.11 -0.76 0.41 0.00 0.00 173.24 172.72 2fmc s LEU 43 N 2.21 1.45 -0.69 2.44 2.01 -1.21 -5.01 118.68 119.88 2fmc s LEU 43 Ca 0.05 -0.33 0.02 0.00 0.01 0.00 0.00 54.13 53.89 2fmc s LEU 43 Cb -0.16 -0.88 0.17 0.00 0.01 0.00 0.00 46.19 45.33 2fmc s LEU 43 CO -0.17 -0.04 0.49 -0.83 1.01 0.00 0.00 176.35 176.81 2fmc s GLY 44 N 1.22 2.80 0.37 -3.19 0.00 -1.26 -2.43 107.32 104.83 2fmc s GLY 44 Ca -0.04 -3.64 0.04 0.00 0.00 0.00 0.00 44.72 41.08 2fmc s GLY 44 CO -0.03 1.09 0.07 0.00 0.00 0.00 0.00 173.10 174.23 2fmc s VAL 46 N -3.19 2.60 0.15 0.00 -7.23 -1.22 -4.67 120.40 106.84 2fmc s VAL 46 Ca 0.30 -2.26 -0.31 0.00 -1.81 0.00 0.00 61.98 57.89 2fmc s VAL 46 Cb 0.06 -2.35 -0.10 0.00 0.56 0.00 0.00 36.38 34.56 2fmc s VAL 46 CO 0.14 -0.34 1.60 -0.69 -0.31 0.00 0.00 175.10 175.50 2fmc s VAL 47 N -2.32 2.64 0.13 1.32 1.01 -1.26 -0.96 120.40 120.97 2fmc s VAL 47 Ca 0.28 0.41 -0.30 0.00 0.00 0.00 0.00 61.98 62.37 2fmc s VAL 47 Cb -0.06 -3.26 -0.07 0.00 0.00 0.00 0.00 36.38 32.99 2fmc s VAL 47 CO 0.15 0.03 1.20 -0.83 0.00 0.00 0.00 175.10 175.64 2fmc s GLY 48 N 1.40 2.55 -0.36 4.51 0.00 0.53 -4.70 107.32 111.25 2fmc s GLY 48 Ca 0.71 0.90 -0.23 0.00 0.00 0.00 0.00 44.72 46.11 2fmc s GLY 48 CO 0.32 1.93 0.76 0.14 0.00 0.00 0.00 173.10 176.25 2fmc s VAL 49 N 0.42 4.76 -0.07 1.40 1.01 -1.26 -4.89 120.40 121.77 2fmc s VAL 49 Ca 0.55 0.84 -0.29 0.00 0.00 0.00 0.00 61.98 63.08 2fmc s VAL 49 Cb -0.31 -4.19 -0.06 0.00 0.00 0.00 0.00 36.38 31.82 2fmc s VAL 49 CO 0.33 -0.41 1.81 -0.63 0.00 0.00 0.00 175.10 176.20 2fmc s ILE 50 N 3.04 3.35 0.00 2.22 1.09 -1.26 -1.20 121.20 128.45 2fmc s ILE 50 Ca 0.30 0.42 0.00 0.00 -1.10 0.00 0.00 60.65 60.27 2fmc s ILE 50 Cb -0.13 -3.30 0.00 0.00 -1.06 0.00 0.00 42.46 37.96 2fmc s ILE 50 CO 0.16 -0.07 0.00 0.61 -0.10 0.00 0.00 174.94 175.54 2fmc n GLY 51 N 4.53 1.77 3.92 6.18 0.00 -0.02 -5.01 105.19 116.56 2fmc n GLY 51 Ca 0.20 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.02 2fmc n GLY 51 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2fmc s SER 52 N -1.72 5.70 0.08 1.61 0.01 -0.34 -4.89 113.70 114.14 2fmc s SER 52 Ca 0.00 -0.30 0.04 0.00 1.31 0.00 0.00 55.95 57.01 2fmc s SER 52 Cb 0.00 -1.19 -0.04 0.00 0.21 0.00 0.00 66.02 65.00 2fmc s SER 52 CO 0.00 -0.35 -0.01 0.00 0.41 0.00 0.00 173.24 173.29 2fmc s GLN 53 N -4.07 2.56 -0.16 12.44 -2.07 -1.26 -0.78 119.66 126.32 2fmc s GLN 53 Ca 0.42 -0.81 0.01 0.00 -1.82 0.00 0.00 55.36 53.15 2fmc s GLN 53 Cb -0.08 -2.55 0.02 0.00 -1.09 0.00 0.00 33.01 29.32 2fmc s GLN 53 CO 0.29 0.55 -0.18 0.00 -1.32 0.00 0.00 175.29 174.63 2fmc n GLY 55 N 4.60 3.00 0.00 0.00 0.00 -1.26 -1.10 105.19 110.43 2fmc n GLY 55 Ca -0.19 -1.06 0.00 0.00 0.00 0.00 0.00 46.02 44.77 2fmc n GLY 55 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fmc n ALA 56 N 2.25 0.00 -2.52 4.61 0.00 -1.26 -4.90 120.51 118.69 2fmc n ALA 56 Ca 0.37 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 53.50 2fmc n ALA 56 Cb 0.84 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 20.17 2fmc n ALA 56 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2fmc s SER 57 N 1.91 4.15 -0.39 0.00 0.01 0.95 -4.72 113.70 115.61 2fmc s SER 57 Ca 0.00 -0.32 -0.12 0.00 1.31 0.00 0.00 55.95 56.82 2fmc s SER 57 Cb 0.00 -0.80 0.03 0.00 0.21 0.00 0.00 66.02 65.46 2fmc s SER 57 CO 0.00 0.26 0.25 -0.69 0.41 0.00 0.00 173.24 173.47 2fmc s VAL 58 N -0.98 4.81 0.19 3.43 1.01 -1.26 -1.39 120.40 126.20 2fmc s VAL 58 Ca 0.16 -0.84 0.05 0.00 0.00 0.00 0.00 61.98 61.35 2fmc s VAL 58 Cb -0.11 -3.71 -0.04 0.00 0.00 0.00 0.00 36.38 32.53 2fmc s VAL 58 CO 0.07 -0.30 0.18 -0.75 0.00 0.00 0.00 175.10 174.30 2fmc s LYS 59 N 1.59 3.00 -0.33 2.72 2.20 0.71 -4.89 119.74 124.73 2fmc s LYS 59 Ca 0.03 -0.88 -0.00 0.00 -0.36 0.00 0.00 55.97 54.76 2fmc s LYS 59 Cb -0.20 -2.67 0.08 0.00 -1.51 0.00 0.00 37.83 33.53 2fmc s LYS 59 CO 0.07 0.46 0.05 0.00 -0.36 0.00 0.00 175.35 175.58 2fmc s LYS 62 N -0.27 3.05 -0.28 0.00 2.47 0.25 -2.44 119.74 122.53 2fmc s LYS 62 Ca 0.03 -0.83 -0.34 0.00 -1.56 0.00 0.00 55.97 53.27 2fmc s LYS 62 Cb -0.10 -2.52 0.17 0.00 -1.46 0.00 0.00 37.83 33.93 2fmc s LYS 62 CO 0.01 -0.07 1.35 0.34 0.16 0.00 0.00 175.35 177.14 2fmc s ASP 63 N 0.96 -0.04 -0.89 1.43 2.15 -1.26 -2.30 116.67 116.72 2fmc s ASP 63 Ca -0.03 0.02 -0.24 0.00 0.43 0.00 0.00 52.55 52.72 2fmc s ASP 63 Cb -0.15 0.04 0.05 0.00 -0.30 0.00 0.00 42.92 42.56 2fmc s ASP 63 CO -0.05 -0.05 1.35 -1.81 -0.17 0.00 0.00 175.17 174.44 2fmc s ASP 64 N -1.61 6.36 0.02 -0.34 1.11 -1.26 -4.96 116.67 115.99 2fmc s ASP 64 Ca 0.10 -1.06 -0.36 0.00 0.18 0.00 0.00 52.55 51.42 2fmc s ASP 64 Cb -0.01 -2.55 -0.15 0.00 1.07 0.00 0.00 42.92 41.28 2fmc s ASP 64 CO -0.05 -1.62 1.60 1.33 1.18 0.00 0.00 175.17 177.61 2fmc n VAL 65 N 6.59 0.17 -4.42 -1.27 0.24 -1.26 -4.87 118.33 113.51 2fmc n VAL 65 Ca 0.19 -0.03 -0.34 0.00 -2.04 0.00 0.00 64.34 62.12 2fmc n VAL 65 Cb 0.50 -1.35 -0.10 0.00 -1.47 0.00 0.00 33.84 31.42 2fmc n VAL 65 CO 0.00 0.00 0.00 -0.89 -2.14 0.00 0.00 176.83 173.80 2fmc s THR 66 N 1.83 4.11 -0.11 3.34 2.01 -1.10 -4.93 115.64 120.80 2fmc s THR 66 Ca 0.86 -0.31 0.16 0.00 0.31 0.00 0.00 61.69 62.71 2fmc s THR 66 Cb -0.82 -2.74 -0.19 0.00 0.01 0.00 0.00 72.50 68.76 2fmc s THR 66 CO 0.48 0.57 0.63 -3.20 -0.69 0.00 0.00 174.62 172.41 2fmc n ASN 67 N 2.50 0.65 -4.57 3.53 5.15 -1.26 -2.68 115.26 118.60 2fmc n ASN 67 Ca -0.18 0.30 -0.41 0.00 -0.60 0.00 0.00 54.58 53.69 2fmc n ASN 67 Cb 0.53 0.38 -0.02 0.00 -0.53 0.00 0.00 39.78 40.14 2fmc n ASN 67 CO 0.00 0.00 0.00 0.42 1.40 0.00 0.00 177.26 179.08 2fmc s THR 68 N -2.82 3.95 0.00 -0.44 -4.23 -1.26 -3.56 115.64 107.28 2fmc s THR 68 Ca -0.05 -1.13 0.00 0.00 -1.18 0.00 0.00 61.69 59.34 2fmc s THR 68 Cb 0.08 -5.04 0.00 0.00 1.34 0.00 0.00 72.50 68.88 2fmc s THR 68 CO 0.82 -1.90 0.00 0.61 -0.54 0.00 0.00 174.62 173.62 2fmc n GLY 69 N 6.37 1.08 3.30 3.99 0.00 -1.26 -5.12 105.19 113.55 2fmc n GLY 69 Ca 0.39 -0.05 -0.16 0.00 0.00 0.00 0.00 46.02 46.20 2fmc n GLY 69 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2fmc s ASN 70 N 0.00 1.11 0.51 1.61 3.84 -1.23 -5.03 114.94 115.74 2fmc s ASN 70 Ca 0.00 -1.37 0.32 0.00 0.21 0.00 0.00 52.86 52.03 2fmc s ASN 70 Cb 0.00 0.18 1.32 0.00 -0.55 0.00 0.00 41.25 42.20 2fmc s ASN 70 CO 0.00 -0.73 1.95 0.28 -2.79 0.00 0.00 177.10 175.81 2fmc h SER 71 N 2.43 0.00 -2.53 -4.21 0.02 -1.97 -3.44 113.55 103.84 2fmc h SER 71 Ca -0.38 0.00 -0.54 0.00 -0.84 0.00 0.00 61.79 60.03 2fmc h SER 71 Cb 1.24 0.00 -0.13 0.00 0.14 0.00 0.00 62.40 63.65 2fmc h SER 71 CO 0.60 0.00 -0.62 0.72 -1.14 0.00 0.00 176.83 176.40 2fmc s PHE 72 N -3.62 2.20 -0.41 3.45 -0.71 -1.26 -5.07 117.98 112.55 2fmc s PHE 72 Ca 0.02 -0.79 -0.27 0.00 -1.04 0.00 0.00 56.93 54.84 2fmc s PHE 72 Cb 0.09 -1.46 -0.03 0.00 -1.21 0.00 0.00 43.02 40.41 2fmc s PHE 72 CO 0.52 0.24 2.00 -0.48 -1.34 0.00 0.00 175.22 176.17 2fmc s LEU 73 N -3.57 3.42 0.13 -1.99 0.05 -1.26 -4.81 118.68 110.65 2fmc s LEU 73 Ca 0.35 1.11 -0.22 0.00 0.05 0.00 0.00 54.13 55.42 2fmc s LEU 73 Cb 0.08 -3.07 -0.07 0.00 -2.05 0.00 0.00 46.19 41.08 2fmc s LEU 73 CO 0.16 -2.15 0.68 -0.51 -0.55 0.00 0.00 176.35 173.98 2fmc s ILE 74 N 8.71 4.55 -0.16 1.48 1.10 -1.09 -4.45 121.20 131.34 2fmc s ILE 74 Ca 0.83 1.44 -0.05 0.00 -0.51 0.00 0.00 60.65 62.37 2fmc s ILE 74 Cb -0.21 -4.00 -0.03 0.00 0.15 0.00 0.00 42.46 38.37 2fmc s ILE 74 CO 0.29 0.50 -0.00 0.27 -2.11 0.00 0.00 174.94 173.89 2fmc s ILE 75 N -1.18 4.19 -0.67 2.00 -0.00 -1.02 -2.70 121.20 121.83 2fmc s ILE 75 Ca 0.34 -0.25 0.22 0.00 -0.00 0.00 0.00 60.65 60.95 2fmc s ILE 75 Cb -0.21 -2.85 0.22 0.00 -0.00 0.00 0.00 42.46 39.62 2fmc s ILE 75 CO 0.23 0.49 1.67 0.59 -0.00 0.00 0.00 174.94 177.91 2fmc n ASN 76 N 3.45 0.48 -2.31 4.36 3.02 -1.26 -3.34 115.26 119.66 2fmc n ASN 76 Ca -0.17 0.60 -0.20 0.00 -0.03 0.00 0.00 54.58 54.78 2fmc n ASN 76 Cb 0.52 -0.71 -0.02 0.00 -0.61 0.00 0.00 39.78 38.97 2fmc n ASN 76 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2fmc n ALA 77 N -1.69 -0.59 -0.15 5.41 0.00 -1.26 -4.46 120.51 117.77 2fmc n ALA 77 Ca 0.03 0.19 -0.01 0.00 0.00 0.00 0.00 53.44 53.65 2fmc n ALA 77 Cb 0.24 -2.15 0.24 0.00 0.00 0.00 0.00 19.45 17.78 2fmc n ALA 77 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2fmc h ALA 78 N 0.89 1.36 -3.04 0.00 0.00 -1.88 -3.29 119.26 113.30 2fmc h ALA 78 Ca -0.48 -0.13 -0.62 0.00 0.00 0.00 0.00 54.91 53.68 2fmc h ALA 78 Cb 1.36 -0.24 -0.41 0.00 0.00 0.00 0.00 17.79 18.49 2fmc h ALA 78 CO 0.58 0.50 -0.65 -0.80 0.00 0.00 0.00 179.25 178.87 2fmc s ASN 79 N -6.51 4.16 -0.07 0.00 0.01 -0.97 -5.04 114.94 106.52 2fmc s ASN 79 Ca -0.10 -3.45 0.03 0.00 -0.71 0.00 0.00 52.86 48.64 2fmc s ASN 79 Cb 0.17 -1.41 0.01 0.00 0.41 0.00 0.00 41.25 40.42 2fmc s ASN 79 CO 0.79 -0.15 -0.16 0.00 -1.51 0.00 0.00 177.10 176.07 2fmc s VAL 81 N 0.42 0.52 0.00 0.00 -7.23 -0.24 -5.01 120.40 108.85 2fmc s VAL 81 Ca -0.13 -0.94 0.00 0.00 -1.81 0.00 0.00 61.98 59.10 2fmc s VAL 81 Cb -0.15 -0.57 0.00 0.00 0.56 0.00 0.00 36.38 36.22 2fmc s VAL 81 CO 0.05 -0.30 0.00 0.00 -0.31 0.00 0.00 175.10 174.53