#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1cfy s ALA 7 N 0.00 3.79 -0.30 2.33 0.00 -0.60 -4.93 121.76 122.04 1cfy s ALA 7 Ca 0.00 -0.52 -0.15 0.00 0.00 0.00 0.00 51.96 51.29 1cfy s ALA 7 Cb 0.00 -2.15 -0.03 0.00 0.00 0.00 0.00 23.12 20.94 1cfy s ALA 7 CO 0.00 0.64 0.38 0.08 0.00 0.00 0.00 175.76 176.86 1cfy s VAL 8 N -1.52 5.16 0.59 0.00 1.01 -1.26 -0.96 120.40 123.42 1cfy s VAL 8 Ca 0.36 0.36 -0.20 0.00 0.00 0.00 0.00 61.98 62.50 1cfy s VAL 8 Cb -0.13 -3.76 -0.04 0.00 0.00 0.00 0.00 36.38 32.45 1cfy s VAL 8 CO 0.21 0.04 1.26 0.00 0.00 0.00 0.00 175.10 176.61 1cfy n ALA 9 N 5.39 1.16 -0.32 5.51 0.00 -0.30 -4.88 120.51 127.06 1cfy n ALA 9 Ca -0.08 0.07 -0.04 0.00 0.00 0.00 0.00 53.44 53.38 1cfy n ALA 9 Cb 0.50 -2.30 0.08 0.00 0.00 0.00 0.00 19.45 17.74 1cfy n ALA 9 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.50 177.72 1cfy h ASP 10 N 0.96 1.08 -0.50 0.00 3.58 -1.97 -2.08 116.42 117.50 1cfy h ASP 10 Ca -0.50 -0.10 0.08 0.00 0.42 0.00 0.00 57.03 56.93 1cfy h ASP 10 Cb 1.33 -0.28 -0.03 0.00 1.72 0.00 0.00 39.33 42.07 1cfy h ASP 10 CO 0.55 0.87 0.34 1.05 -2.88 0.00 0.00 179.24 179.16 1cfy h GLU 11 N 1.21 0.35 -0.31 0.28 4.11 -1.93 -1.84 114.58 116.46 1cfy h GLU 11 Ca 0.31 -0.02 -0.16 0.00 0.07 0.00 0.00 59.36 59.55 1cfy h GLU 11 Cb 0.02 -0.08 -0.00 0.00 0.50 0.00 0.00 28.75 29.19 1cfy h GLU 11 CO -0.05 0.23 -0.46 0.77 0.07 0.00 0.00 179.01 179.57 1cfy h SER 12 N 0.36 0.88 -0.17 3.06 0.02 -1.65 -2.27 113.55 113.77 1cfy h SER 12 Ca 0.23 -0.43 -0.06 0.00 -0.84 0.00 0.00 61.79 60.69 1cfy h SER 12 Cb 0.43 -0.25 -0.00 0.00 0.14 0.00 0.00 62.40 62.72 1cfy h SER 12 CO -0.06 1.20 -0.13 -0.07 -1.14 0.00 0.00 176.83 176.64 1cfy h LEU 13 N 0.64 0.40 -1.04 5.07 -0.00 -1.30 -2.21 115.31 116.87 1cfy h LEU 13 Ca 0.04 -0.45 0.09 0.00 -0.00 0.00 0.00 57.88 57.56 1cfy h LEU 13 Cb 1.04 -0.11 -0.07 0.00 -0.00 0.00 0.00 40.66 41.51 1cfy h LEU 13 CO 0.10 0.77 0.63 0.74 -0.00 0.00 0.00 178.44 180.68 1cfy h THR 14 N 0.04 1.01 -0.41 0.22 2.02 -1.38 0.08 112.91 114.49 1cfy h THR 14 Ca 0.03 -0.36 -0.10 0.00 0.77 0.00 0.00 66.41 66.74 1cfy h THR 14 Cb 0.64 -0.15 -0.01 0.00 -1.74 0.00 0.00 68.15 66.89 1cfy h THR 14 CO 0.03 0.19 -0.15 0.00 0.37 0.00 0.00 175.52 175.97 1cfy h ALA 15 N 1.50 0.58 -0.40 6.16 0.00 -1.36 -1.18 119.26 124.56 1cfy h ALA 15 Ca 0.45 -0.35 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 1cfy h ALA 15 Cb 0.32 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 1cfy h ALA 15 CO -0.21 0.50 0.22 0.35 0.00 0.00 0.00 179.25 180.11 1cfy h PHE 16 N 0.65 0.56 -0.61 0.00 3.57 -0.63 -2.29 116.94 118.18 1cfy h PHE 16 Ca 0.10 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.55 1cfy h PHE 16 Cb 0.69 -0.18 -0.03 0.00 2.79 0.00 0.00 35.95 39.23 1cfy h PHE 16 CO 0.05 0.43 0.24 -0.91 -2.23 0.00 0.00 178.31 175.89 1cfy h ASN 17 N 0.52 0.82 -0.29 0.41 2.35 -0.85 0.15 115.58 118.69 1cfy h ASN 17 Ca 0.14 -0.11 -0.07 0.00 -0.55 0.00 0.00 56.30 55.71 1cfy h ASN 17 Cb 0.06 -0.21 -0.02 0.00 0.05 0.00 0.00 38.32 38.20 1cfy h ASN 17 CO -0.02 0.74 -0.05 0.44 -1.65 0.00 0.00 177.43 176.88 1cfy h ASP 18 N 0.88 0.64 -0.09 5.81 3.32 -1.04 0.20 116.42 126.14 1cfy h ASP 18 Ca 0.21 -0.16 -0.14 0.00 0.02 0.00 0.00 57.03 56.96 1cfy h ASP 18 Cb 0.18 -0.17 0.01 0.00 0.22 0.00 0.00 39.33 39.57 1cfy h ASP 18 CO -0.02 0.74 -0.48 0.25 -1.72 0.00 0.00 179.24 178.02 1cfy h LEU 19 N 0.62 0.57 0.62 1.55 6.46 -0.86 0.07 115.31 124.34 1cfy h LEU 19 Ca 0.12 -0.65 -0.03 0.00 -0.12 0.00 0.00 57.88 57.20 1cfy h LEU 19 Cb 0.46 -0.17 0.01 0.00 -0.73 0.00 0.00 40.66 40.23 1cfy h LEU 19 CO 0.02 1.13 -0.30 0.50 -0.62 0.00 0.00 178.44 179.18 1cfy h LYS 20 N 0.05 -0.80 0.00 1.25 3.64 -0.81 -0.31 116.57 119.60 1cfy h LYS 20 Ca -0.03 0.05 -0.16 0.00 -1.27 0.00 0.00 60.65 59.24 1cfy h LYS 20 Cb 1.13 0.18 -0.03 0.00 -0.41 0.00 0.00 32.23 33.10 1cfy h LYS 20 CO 0.10 -0.49 -1.17 -0.07 -2.27 0.00 0.00 179.45 175.55 1cfy h LEU 21 N -1.10 0.00 -1.31 5.20 3.38 -0.76 -3.38 115.31 117.34 1cfy h LEU 21 Ca -0.08 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.89 1cfy h LEU 21 Cb 0.68 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.43 1cfy h LEU 21 CO 0.14 0.61 -0.08 0.61 0.09 0.00 0.00 178.44 179.81 1cfy n GLY 22 N 1.36 -0.08 2.34 0.83 0.00 -0.08 -4.97 105.19 104.58 1cfy n GLY 22 Ca -0.06 -0.39 -0.15 0.00 0.00 0.00 0.00 46.02 45.42 1cfy n GLY 22 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1cfy n LYS 23 N 0.47 -1.83 -0.09 1.61 4.01 -0.13 -4.83 118.16 117.37 1cfy n LYS 23 Ca 0.07 0.77 -0.02 0.00 -0.51 0.00 0.00 58.31 58.62 1cfy n LYS 23 Cb 0.32 -5.28 0.23 0.00 -0.51 0.00 0.00 35.03 29.80 1cfy n LYS 23 CO 0.00 0.00 0.00 -0.22 -1.11 0.00 0.00 177.40 176.07 1cfy h LYS 24 N 0.00 0.73 -5.18 1.97 3.64 -1.50 -3.44 116.57 112.79 1cfy h LYS 24 Ca -0.34 -0.14 -0.36 0.00 -1.27 0.00 0.00 60.65 58.54 1cfy h LYS 24 Cb 1.17 -0.11 -0.17 0.00 -0.41 0.00 0.00 32.23 32.70 1cfy h LYS 24 CO 0.42 0.67 -0.74 0.71 -2.27 0.00 0.00 179.45 178.25 1cfy s TYR 25 N -5.17 1.26 -0.03 1.91 2.02 -1.26 -4.81 117.35 111.27 1cfy s TYR 25 Ca -0.09 -0.64 -0.04 0.00 -0.37 0.00 0.00 57.07 55.93 1cfy s TYR 25 Cb 0.16 -0.66 -0.28 0.00 -0.40 0.00 0.00 41.96 40.78 1cfy s TYR 25 CO 0.79 0.09 0.73 -0.22 -1.57 0.00 0.00 175.55 175.37 1cfy h LYS 26 N 3.31 0.26 -3.30 -0.62 1.63 -0.42 -3.45 116.57 113.99 1cfy h LYS 26 Ca -0.38 -0.45 -0.06 0.00 -0.85 0.00 0.00 60.65 58.90 1cfy h LYS 26 Cb 1.19 0.17 -0.14 0.00 -0.60 0.00 0.00 32.23 32.85 1cfy h LYS 26 CO 0.55 1.12 -0.11 -0.59 -3.45 0.00 0.00 179.45 176.97 1cfy s PHE 27 N -2.60 -0.19 -0.02 1.91 -0.12 -1.14 -0.58 117.98 115.24 1cfy s PHE 27 Ca -0.12 -0.03 0.01 0.00 -0.05 0.00 0.00 56.93 56.73 1cfy s PHE 27 Cb 0.07 0.22 0.01 0.00 -0.63 0.00 0.00 43.02 42.69 1cfy s PHE 27 CO 0.84 -0.64 -0.02 0.42 -0.05 0.00 0.00 175.22 175.77 1cfy s ILE 28 N -3.33 0.27 -0.19 -4.49 1.01 -0.28 -1.86 121.20 112.33 1cfy s ILE 28 Ca 0.00 -0.05 -0.06 0.00 0.00 0.00 0.00 60.65 60.55 1cfy s ILE 28 Cb 0.01 -0.29 -0.03 0.00 0.01 0.00 0.00 42.46 42.16 1cfy s ILE 28 CO -0.09 0.12 0.02 -0.76 0.00 0.00 0.00 174.94 174.23 1cfy s LEU 29 N 0.50 3.44 0.20 2.97 1.43 0.03 -1.15 118.68 126.11 1cfy s LEU 29 Ca -0.05 -0.10 0.11 0.00 -1.03 0.00 0.00 54.13 53.06 1cfy s LEU 29 Cb -0.08 -1.86 -0.04 0.00 0.03 0.00 0.00 46.19 44.23 1cfy s LEU 29 CO -0.01 0.12 -0.18 -0.36 0.23 0.00 0.00 176.35 176.15 1cfy s PHE 30 N 0.68 2.42 0.32 0.29 0.40 0.30 -0.05 117.98 122.34 1cfy s PHE 30 Ca 0.01 -0.31 -0.18 0.00 -0.60 0.00 0.00 56.93 55.84 1cfy s PHE 30 Cb -0.14 -1.17 0.03 0.00 0.51 0.00 0.00 43.02 42.26 1cfy s PHE 30 CO 0.02 0.53 0.74 0.20 0.70 0.00 0.00 175.22 177.41 1cfy s GLY 31 N -2.86 0.14 0.32 4.36 0.00 -0.55 -1.48 107.32 107.26 1cfy s GLY 31 Ca 0.23 -0.52 -0.16 0.00 0.00 0.00 0.00 44.72 44.27 1cfy s GLY 31 CO 0.12 -0.21 0.76 1.08 0.00 0.00 0.00 173.10 174.85 1cfy s LEU 32 N -2.99 4.09 0.99 0.66 1.43 -1.26 -0.56 118.68 121.04 1cfy s LEU 32 Ca 0.13 1.35 -0.15 0.00 -1.03 0.00 0.00 54.13 54.43 1cfy s LEU 32 Cb -0.05 -4.05 0.18 0.00 0.03 0.00 0.00 46.19 42.30 1cfy s LEU 32 CO 0.09 -0.18 1.18 0.54 0.23 0.00 0.00 176.35 178.20 1cfy s ASN 33 N -2.17 2.86 0.21 2.29 2.20 0.04 -4.85 114.94 115.53 1cfy s ASN 33 Ca 0.53 0.71 -0.09 0.00 -0.94 0.00 0.00 52.86 53.07 1cfy s ASN 33 Cb -0.11 -1.08 0.24 0.00 -2.00 0.00 0.00 41.25 38.30 1cfy s ASN 33 CO 0.18 -2.93 1.81 0.44 -2.94 0.00 0.00 177.10 173.65 1cfy h ASP 34 N -1.77 0.54 0.08 3.54 3.32 -1.98 -0.10 116.42 120.06 1cfy h ASP 34 Ca -0.48 0.03 0.00 0.00 0.02 0.00 0.00 57.03 56.61 1cfy h ASP 34 Cb 1.30 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 40.78 1cfy h ASP 34 CO 0.50 0.35 0.00 0.00 -1.72 0.00 0.00 179.24 178.37 1cfy n ALA 35 N -2.36 2.00 -2.19 3.45 0.00 -1.26 -4.82 120.51 115.34 1cfy n ALA 35 Ca 0.08 -0.09 -0.11 0.00 0.00 0.00 0.00 53.44 53.32 1cfy n ALA 35 Cb 0.18 -1.25 -0.02 0.00 0.00 0.00 0.00 19.45 18.36 1cfy n ALA 35 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1cfy n LYS 36 N -1.08 -2.04 -0.01 0.00 4.76 -0.05 -4.80 118.16 114.94 1cfy n LYS 36 Ca 0.10 0.58 0.07 0.00 -2.87 0.00 0.00 58.31 56.19 1cfy n LYS 36 Cb 0.07 -5.08 -0.14 0.00 -1.84 0.00 0.00 35.03 28.04 1cfy n LYS 36 CO 0.00 0.00 0.00 0.25 -1.37 0.00 0.00 177.40 176.28 1cfy n THR 37 N -2.96 0.39 -3.54 -0.18 -2.24 -1.26 -4.92 114.28 99.57 1cfy n THR 37 Ca -0.13 -0.58 -0.13 0.00 -2.27 0.00 0.00 64.05 60.94 1cfy n THR 37 Cb 0.55 -0.17 -0.04 0.00 -2.10 0.00 0.00 70.33 68.57 1cfy n THR 37 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 1cfy s GLU 38 N -3.29 1.11 -0.38 -0.78 -1.05 -1.26 -1.56 118.70 111.48 1cfy s GLU 38 Ca -0.07 -0.34 -0.23 0.00 -0.15 0.00 0.00 54.97 54.19 1cfy s GLU 38 Cb 0.12 0.50 0.01 0.00 -0.44 0.00 0.00 34.13 34.32 1cfy s GLU 38 CO 0.87 -0.43 0.75 0.42 0.95 0.00 0.00 175.26 177.83 1cfy s ILE 39 N -2.91 4.75 0.42 1.83 1.01 -0.13 -0.78 121.20 125.39 1cfy s ILE 39 Ca -0.03 0.70 0.07 0.00 0.00 0.00 0.00 60.65 61.39 1cfy s ILE 39 Cb -0.00 -4.21 -0.05 0.00 0.01 0.00 0.00 42.46 38.21 1cfy s ILE 39 CO -0.05 -0.48 0.16 0.68 0.00 0.00 0.00 174.94 175.25 1cfy s VAL 40 N 3.06 2.18 -0.08 2.92 -7.23 0.27 -1.15 120.40 120.36 1cfy s VAL 40 Ca 0.29 -1.74 -0.19 0.00 -1.81 0.00 0.00 61.98 58.54 1cfy s VAL 40 Cb -0.13 -2.92 -0.04 0.00 0.56 0.00 0.00 36.38 33.84 1cfy s VAL 40 CO 0.18 0.00 0.50 0.54 -0.31 0.00 0.00 175.10 176.01 1cfy s VAL 41 N -2.64 5.12 -0.19 1.32 0.11 -1.26 -1.48 120.40 121.38 1cfy s VAL 41 Ca 0.38 1.02 0.18 0.00 -2.93 0.00 0.00 61.98 60.63 1cfy s VAL 41 Cb 0.04 -3.84 -0.25 0.00 -1.53 0.00 0.00 36.38 30.80 1cfy s VAL 41 CO 0.21 0.36 0.10 0.29 -3.33 0.00 0.00 175.10 172.73 1cfy n LYS 42 N 3.34 0.69 -3.49 1.54 4.76 0.93 -4.92 118.16 121.01 1cfy n LYS 42 Ca -0.07 -0.00 -0.16 0.00 -2.87 0.00 0.00 58.31 55.21 1cfy n LYS 42 Cb 0.52 -1.53 -0.05 0.00 -1.84 0.00 0.00 35.03 32.13 1cfy n LYS 42 CO 0.00 0.00 0.00 -2.00 -1.37 0.00 0.00 177.40 174.03 1cfy s GLU 43 N -2.51 1.10 0.07 1.97 2.56 -1.11 -4.99 118.70 115.80 1cfy s GLU 43 Ca -0.10 0.01 0.00 0.00 0.00 0.00 0.00 54.97 54.89 1cfy s GLU 43 Cb 0.06 0.52 -0.04 0.00 2.00 0.00 0.00 34.13 36.67 1cfy s GLU 43 CO 0.83 -0.40 -0.05 0.95 -0.56 0.00 0.00 175.26 176.04 1cfy s THR 44 N -2.03 0.41 -0.00 -1.70 -4.23 -1.26 -0.79 115.64 106.04 1cfy s THR 44 Ca -0.06 -1.80 -0.28 0.00 -1.18 0.00 0.00 61.69 58.36 1cfy s THR 44 Cb -0.00 -1.51 0.08 0.00 1.34 0.00 0.00 72.50 72.41 1cfy s THR 44 CO 0.02 -0.91 0.73 -0.55 -0.54 0.00 0.00 174.62 173.36 1cfy s SER 45 N -2.87 -0.56 0.00 3.99 0.15 -0.77 -4.98 113.70 108.65 1cfy s SER 45 Ca 0.07 0.41 0.05 0.00 0.70 0.00 0.00 55.95 57.18 1cfy s SER 45 Cb 0.06 0.51 0.08 0.00 -1.71 0.00 0.00 66.02 64.95 1cfy s SER 45 CO -0.07 -0.67 0.84 0.35 1.20 0.00 0.00 173.24 174.89 1cfy n THR 46 N 0.42 0.40 -2.05 6.45 -2.24 -1.26 0.31 114.28 116.31 1cfy n THR 46 Ca -0.16 -0.70 -0.43 0.00 -2.27 0.00 0.00 64.05 60.49 1cfy n THR 46 Cb 0.60 0.86 -0.03 0.00 -2.10 0.00 0.00 70.33 69.67 1cfy n THR 46 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1cfy s ASP 47 N -0.65 6.27 0.26 3.42 -1.08 -1.26 -4.67 116.67 118.96 1cfy s ASP 47 Ca 0.08 1.65 0.26 0.00 -0.52 0.00 0.00 52.55 54.01 1cfy s ASP 47 Cb 0.05 -2.53 0.86 0.00 -1.46 0.00 0.00 42.92 39.83 1cfy s ASP 47 CO 0.07 -1.34 1.75 1.55 0.52 0.00 0.00 175.17 177.72 1cfy h PRO 48 N 11.24 0.00 -6.60 4.34 0.13 -1.99 -3.46 132.00 135.66 1cfy h PRO 48 Ca -0.35 0.00 -0.53 0.00 -0.87 0.00 0.00 66.00 64.25 1cfy h PRO 48 Cb 1.16 0.00 0.03 0.00 0.13 0.00 0.00 31.00 32.33 1cfy h PRO 48 CO 1.00 0.00 0.77 0.45 -0.23 0.00 0.00 178.00 179.99 1cfy s SER 49 N -4.66 6.74 0.36 1.44 0.15 -1.26 -4.91 113.70 111.56 1cfy s SER 49 Ca 0.08 2.46 0.17 0.00 0.70 0.00 0.00 55.95 59.36 1cfy s SER 49 Cb 0.11 -2.59 0.63 0.00 -1.71 0.00 0.00 66.02 62.45 1cfy s SER 49 CO 0.54 -0.70 1.72 0.22 1.20 0.00 0.00 173.24 176.22 1cfy h TYR 50 N 6.48 0.00 0.00 3.44 3.20 -2.02 -2.93 116.97 125.14 1cfy h TYR 50 Ca -0.43 0.00 -0.06 0.00 3.14 0.00 0.00 58.73 61.38 1cfy h TYR 50 Cb 1.21 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 39.47 1cfy h TYR 50 CO 0.65 0.41 -0.29 -0.44 -1.64 0.00 0.00 178.16 176.85 1cfy h ASP 51 N 0.00 0.00 1.44 -2.11 3.32 -1.97 -2.01 116.42 115.09 1cfy h ASP 51 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1cfy h ASP 51 Cb 0.92 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.47 1cfy h ASP 51 CO 0.05 0.29 0.00 0.00 -1.72 0.00 0.00 179.24 177.86 1cfy h ALA 52 N 1.71 1.00 0.10 3.45 0.00 -1.89 -1.69 119.26 121.94 1cfy h ALA 52 Ca -0.00 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 1cfy h ALA 52 Cb 0.63 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.43 1cfy h ALA 52 CO 0.04 0.00 -0.05 0.35 0.00 0.00 0.00 179.25 179.59 1cfy h PHE 53 N 0.00 -0.13 -0.92 0.00 3.57 -1.45 -3.32 116.94 114.69 1cfy h PHE 53 Ca 0.00 -0.00 0.11 0.00 3.53 0.00 0.00 57.97 61.61 1cfy h PHE 53 Cb 0.72 0.04 -0.07 0.00 2.79 0.00 0.00 35.95 39.43 1cfy h PHE 53 CO 0.00 0.16 0.59 -0.07 -2.23 0.00 0.00 178.31 176.76 1cfy h LEU 54 N -1.00 0.81 -1.91 0.59 3.38 -1.46 0.04 115.31 115.76 1cfy h LEU 54 Ca -0.01 0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.99 1cfy h LEU 54 Cb 0.35 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 40.97 1cfy h LEU 54 CO 0.02 0.46 0.00 1.05 0.09 0.00 0.00 178.44 180.06 1cfy h GLU 55 N 0.88 0.00 -0.35 1.13 4.11 -1.42 -2.15 114.58 116.79 1cfy h GLU 55 Ca 0.44 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.87 1cfy h GLU 55 Cb 0.48 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.73 1cfy h GLU 55 CO -0.20 0.00 0.00 1.63 0.07 0.00 0.00 179.01 180.51 1cfy n LYS 56 N -2.64 2.24 -3.01 1.06 5.02 -0.00 -4.87 118.16 115.96 1cfy n LYS 56 Ca -0.01 -1.88 -0.42 0.00 -2.02 0.00 0.00 58.31 53.98 1cfy n LYS 56 Cb 0.10 -1.46 -0.06 0.00 -0.02 0.00 0.00 35.03 33.59 1cfy n LYS 56 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1cfy s LEU 57 N -1.43 4.18 -0.05 -0.35 1.43 -0.81 -4.98 118.68 116.65 1cfy s LEU 57 Ca 0.36 0.28 -0.32 0.00 -1.03 0.00 0.00 54.13 53.42 1cfy s LEU 57 Cb 0.21 -2.95 -0.10 0.00 0.03 0.00 0.00 46.19 43.38 1cfy s LEU 57 CO 0.29 -0.69 1.95 -0.81 0.23 0.00 0.00 176.35 177.32 1cfy n PRO 58 N 6.30 2.42 -0.17 1.29 -0.04 -1.26 -4.87 135.00 138.66 1cfy n PRO 58 Ca 0.02 0.87 0.13 0.00 -0.04 0.00 0.00 63.50 64.48 1cfy n PRO 58 Cb 0.48 -2.82 0.46 0.00 -0.04 0.00 0.00 33.50 31.58 1cfy n PRO 58 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 1cfy h GLU 59 N 10.16 0.50 0.00 0.54 4.81 -1.97 -2.93 114.58 125.70 1cfy h GLU 59 Ca -0.48 -0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 58.71 1cfy h GLU 59 Cb 1.26 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 30.51 1cfy h GLU 59 CO 0.95 0.33 -0.28 0.09 -0.73 0.00 0.00 179.01 179.37 1cfy n ASN 60 N -4.49 1.95 -4.05 1.04 5.03 -1.26 -4.68 115.26 108.79 1cfy n ASN 60 Ca 0.14 -3.41 -0.10 0.00 0.87 0.00 0.00 54.58 52.08 1cfy n ASN 60 Cb 0.45 -0.47 -0.08 0.00 -1.02 0.00 0.00 39.78 38.66 1cfy n ASN 60 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 1cfy s ASP 61 N -2.97 0.14 0.28 6.41 2.15 -1.11 -4.23 116.67 117.34 1cfy s ASP 61 Ca 0.34 -1.03 0.06 0.00 0.43 0.00 0.00 52.55 52.35 1cfy s ASP 61 Cb 0.32 0.39 -0.03 0.00 -0.30 0.00 0.00 42.92 43.30 1cfy s ASP 61 CO -0.02 -0.84 0.34 0.00 -0.17 0.00 0.00 175.17 174.48 1cfy s LEU 63 N -4.00 -0.11 0.07 0.00 0.05 -0.83 -4.98 118.68 108.88 1cfy s LEU 63 Ca 0.38 -0.23 0.05 0.00 0.05 0.00 0.00 54.13 54.38 1cfy s LEU 63 Cb -0.08 1.69 -0.04 0.00 -2.05 0.00 0.00 46.19 45.71 1cfy s LEU 63 CO 0.28 -0.53 -0.06 -0.31 -0.55 0.00 0.00 176.35 175.17 1cfy s TYR 64 N -2.77 2.85 -0.01 3.48 2.02 -0.55 -0.78 117.35 121.59 1cfy s TYR 64 Ca 0.13 -0.09 -0.07 0.00 -0.37 0.00 0.00 57.07 56.67 1cfy s TYR 64 Cb 0.02 -1.51 0.00 0.00 -0.40 0.00 0.00 41.96 40.08 1cfy s TYR 64 CO -0.02 0.43 0.14 0.00 -1.57 0.00 0.00 175.55 174.53 1cfy s ALA 65 N -1.18 -0.33 -0.11 3.71 0.00 -0.45 -0.54 121.76 122.86 1cfy s ALA 65 Ca 0.21 -0.01 0.02 0.00 0.00 0.00 0.00 51.96 52.19 1cfy s ALA 65 Cb -0.11 0.02 0.01 0.00 0.00 0.00 0.00 23.12 23.04 1cfy s ALA 65 CO 0.13 -0.17 -0.18 0.42 0.00 0.00 0.00 175.76 175.96 1cfy s ILE 66 N -1.03 1.67 -0.03 0.00 -1.09 -0.30 -0.05 121.20 120.38 1cfy s ILE 66 Ca -0.11 -0.75 0.03 0.00 -2.23 0.00 0.00 60.65 57.59 1cfy s ILE 66 Cb -0.06 -1.50 -0.00 0.00 -1.58 0.00 0.00 42.46 39.32 1cfy s ILE 66 CO 0.01 0.47 -0.12 -0.47 -1.23 0.00 0.00 174.94 173.61 1cfy s TYR 67 N 0.84 1.18 -0.73 3.97 6.14 -0.66 -1.13 117.35 126.97 1cfy s TYR 67 Ca -0.09 -0.29 -0.17 0.00 0.64 0.00 0.00 57.07 57.16 1cfy s TYR 67 Cb -0.15 -0.81 0.15 0.00 0.42 0.00 0.00 41.96 41.56 1cfy s TYR 67 CO 0.00 -0.10 0.79 0.34 0.64 0.00 0.00 175.55 177.22 1cfy s ASP 68 N 0.04 6.46 -0.34 4.32 2.15 0.25 -1.18 116.67 128.38 1cfy s ASP 68 Ca -0.01 -2.00 -0.24 0.00 0.43 0.00 0.00 52.55 50.73 1cfy s ASP 68 Cb -0.08 -2.28 0.01 0.00 -0.30 0.00 0.00 42.92 40.26 1cfy s ASP 68 CO 0.01 -0.91 0.80 0.12 -0.17 0.00 0.00 175.17 175.02 1cfy s PHE 69 N 1.77 3.15 -0.15 -5.34 2.19 -0.53 -4.90 117.98 114.16 1cfy s PHE 69 Ca 0.17 0.69 -0.05 0.00 0.33 0.00 0.00 56.93 58.07 1cfy s PHE 69 Cb -0.16 -3.35 -0.03 0.00 -1.31 0.00 0.00 43.02 38.16 1cfy s PHE 69 CO -0.02 -0.67 0.01 -2.00 1.83 0.00 0.00 175.22 174.37 1cfy s GLU 70 N 3.08 3.66 0.14 10.12 2.12 -1.26 -0.28 118.70 136.28 1cfy s GLU 70 Ca 0.33 -0.42 -0.06 0.00 0.36 0.00 0.00 54.97 55.18 1cfy s GLU 70 Cb -0.13 -3.01 -0.02 0.00 0.26 0.00 0.00 34.13 31.22 1cfy s GLU 70 CO 0.15 0.35 0.18 1.52 -0.54 0.00 0.00 175.26 176.92 1cfy s TYR 71 N 0.10 0.53 -0.35 5.30 1.13 -0.05 -4.97 117.35 119.04 1cfy s TYR 71 Ca 0.02 -0.92 -0.25 0.00 -1.41 0.00 0.00 57.07 54.52 1cfy s TYR 71 Cb -0.13 -0.22 0.01 0.00 -1.10 0.00 0.00 41.96 40.52 1cfy s TYR 71 CO 0.02 -0.61 0.85 -1.21 -2.51 0.00 0.00 175.55 172.09 1cfy s GLU 72 N -3.98 3.86 -0.31 -3.49 2.02 -1.26 -0.79 118.70 114.74 1cfy s GLU 72 Ca 0.17 0.53 -0.24 0.00 0.02 0.00 0.00 54.97 55.45 1cfy s GLU 72 Cb 0.05 -3.78 0.00 0.00 0.10 0.00 0.00 34.13 30.51 1cfy s GLU 72 CO -0.01 -0.84 0.83 -1.50 0.02 0.00 0.00 175.26 173.76 1cfy s ILE 73 N 3.22 4.74 0.74 -1.63 1.10 -1.00 -4.94 121.20 123.43 1cfy s ILE 73 Ca 0.35 1.24 0.00 0.00 -0.51 0.00 0.00 60.65 61.73 1cfy s ILE 73 Cb -0.13 -4.20 0.14 0.00 0.15 0.00 0.00 42.46 38.43 1cfy s ILE 73 CO 0.16 -0.30 1.02 0.21 -2.11 0.00 0.00 174.94 173.91 1cfy s ASN 74 N 1.65 4.22 0.00 4.50 3.84 -1.26 -4.13 114.94 123.75 1cfy s ASN 74 Ca 0.34 -0.52 0.00 0.00 0.21 0.00 0.00 52.86 52.89 1cfy s ASN 74 Cb -0.14 0.24 0.00 0.00 -0.55 0.00 0.00 41.25 40.81 1cfy s ASN 74 CO 0.13 -1.97 0.00 0.61 -2.79 0.00 0.00 177.10 173.09 1cfy n GLY 75 N -2.87 0.97 1.67 1.21 0.00 -1.26 -4.45 105.19 100.46 1cfy n GLY 75 Ca 0.17 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.10 1cfy n GLY 75 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1cfy n ASN 76 N 0.00 -2.25 -4.83 1.61 0.23 -1.26 -4.88 115.26 103.89 1cfy n ASN 76 Ca 0.00 0.21 -0.35 0.00 -0.53 0.00 0.00 54.58 53.90 1cfy n ASN 76 Cb 0.00 -2.26 -0.06 0.00 -2.08 0.00 0.00 39.78 35.38 1cfy n ASN 76 CO 0.00 0.00 0.00 -0.70 -0.93 0.00 0.00 177.26 175.63 1cfy s GLU 77 N -2.68 4.12 0.00 -3.83 2.56 -1.26 -5.06 118.70 112.55 1cfy s GLU 77 Ca 0.00 0.70 0.00 0.00 0.00 0.00 0.00 54.97 55.67 1cfy s GLU 77 Cb 0.00 -2.85 0.00 0.00 2.00 0.00 0.00 34.13 33.28 1cfy s GLU 77 CO 0.00 0.40 0.00 0.41 -0.56 0.00 0.00 175.26 175.51 1cfy n GLY 78 N 0.62 -2.62 4.00 -1.50 0.00 -1.26 -4.48 105.19 99.94 1cfy n GLY 78 Ca -0.03 -0.74 -0.20 0.00 0.00 0.00 0.00 46.02 45.05 1cfy n GLY 78 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1cfy s LYS 79 N 0.00 2.47 0.08 1.61 1.02 -1.26 -2.39 119.74 121.27 1cfy s LYS 79 Ca 0.00 -1.14 0.02 0.00 0.02 0.00 0.00 55.97 54.87 1cfy s LYS 79 Cb 0.00 -2.59 -0.04 0.00 -0.52 0.00 0.00 37.83 34.69 1cfy s LYS 79 CO 0.00 -0.70 -0.07 1.03 -0.92 0.00 0.00 175.35 174.69 1cfy s ARG 80 N -4.66 0.72 -0.01 1.68 1.81 0.03 -4.75 118.95 113.76 1cfy s ARG 80 Ca 0.59 -1.11 0.01 0.00 -1.72 0.00 0.00 55.73 53.49 1cfy s ARG 80 Cb -0.09 -0.23 0.00 0.00 -0.45 0.00 0.00 34.95 34.18 1cfy s ARG 80 CO 0.38 0.01 -0.04 -1.54 -0.68 0.00 0.00 175.30 173.42 1cfy s SER 81 N -2.49 0.57 0.01 0.23 1.04 -1.26 -0.87 113.70 110.93 1cfy s SER 81 Ca 0.03 -0.08 0.03 0.00 0.48 0.00 0.00 55.95 56.42 1cfy s SER 81 Cb -0.00 -0.14 -0.01 0.00 0.10 0.00 0.00 66.02 65.97 1cfy s SER 81 CO -0.03 0.02 -0.10 -0.54 0.98 0.00 0.00 173.24 173.56 1cfy s LYS 82 N 0.21 0.78 -0.31 4.02 1.02 0.61 -4.98 119.74 121.08 1cfy s LYS 82 Ca -0.02 -0.49 -0.23 0.00 0.02 0.00 0.00 55.97 55.25 1cfy s LYS 82 Cb -0.05 -0.74 -0.00 0.00 -0.52 0.00 0.00 37.83 36.52 1cfy s LYS 82 CO -0.00 0.19 0.75 0.42 -0.92 0.00 0.00 175.35 175.79 1cfy s ILE 83 N -0.52 4.82 -0.17 2.17 1.01 -1.26 -1.46 121.20 125.79 1cfy s ILE 83 Ca 0.02 1.08 -0.08 0.00 0.00 0.00 0.00 60.65 61.66 1cfy s ILE 83 Cb -0.05 -4.12 -0.04 0.00 0.01 0.00 0.00 42.46 38.25 1cfy s ILE 83 CO 0.00 -0.24 0.10 -0.69 0.00 0.00 0.00 174.94 174.11 1cfy s VAL 84 N 2.89 5.18 -0.26 2.92 1.01 -0.32 -0.86 120.40 130.96 1cfy s VAL 84 Ca 0.31 0.10 -0.11 0.00 0.00 0.00 0.00 61.98 62.28 1cfy s VAL 84 Cb -0.14 -3.32 -0.05 0.00 0.00 0.00 0.00 36.38 32.86 1cfy s VAL 84 CO 0.13 0.49 0.18 0.12 0.00 0.00 0.00 175.10 176.01 1cfy s PHE 85 N 0.03 3.25 -0.09 5.22 2.19 0.14 -1.65 117.98 127.07 1cfy s PHE 85 Ca 0.08 0.15 -0.01 0.00 0.33 0.00 0.00 56.93 57.48 1cfy s PHE 85 Cb -0.12 -2.34 -0.03 0.00 -1.31 0.00 0.00 43.02 39.23 1cfy s PHE 85 CO -0.00 -0.08 -0.03 -0.06 1.83 0.00 0.00 175.22 176.88 1cfy s PHE 86 N 1.50 3.05 -0.25 10.12 0.40 0.93 -0.61 117.98 133.12 1cfy s PHE 86 Ca 0.07 0.03 -0.04 0.00 -0.60 0.00 0.00 56.93 56.38 1cfy s PHE 86 Cb -0.15 -1.80 0.00 0.00 0.51 0.00 0.00 43.02 41.58 1cfy s PHE 86 CO 0.09 0.31 -0.00 0.99 0.70 0.00 0.00 175.22 177.30 1cfy s THR 87 N -0.58 3.50 -0.31 0.64 2.01 0.13 -1.34 115.64 119.69 1cfy s THR 87 Ca 0.09 -0.66 -0.06 0.00 0.31 0.00 0.00 61.69 61.38 1cfy s THR 87 Cb -0.12 -2.71 0.03 0.00 0.01 0.00 0.00 72.50 69.71 1cfy s THR 87 CO 0.02 0.26 0.07 0.86 -0.69 0.00 0.00 174.62 175.14 1cfy s TRP 88 N 1.46 3.19 -0.40 4.92 -0.11 0.04 0.73 118.94 128.77 1cfy s TRP 88 Ca 0.04 -1.30 0.03 0.00 1.22 0.00 0.00 56.10 56.09 1cfy s TRP 88 Cb -0.16 -2.23 0.16 0.00 -1.50 0.00 0.00 33.47 29.75 1cfy s TRP 88 CO -0.01 -0.67 0.31 -1.12 -4.62 0.00 0.00 176.95 170.83 1cfy s SER 89 N 1.42 1.78 0.54 5.86 0.01 0.46 -1.96 113.70 121.80 1cfy s SER 89 Ca -0.00 -2.84 -0.22 0.00 1.31 0.00 0.00 55.95 54.20 1cfy s SER 89 Cb -0.18 -0.41 -0.05 0.00 0.21 0.00 0.00 66.02 65.58 1cfy s SER 89 CO 0.02 -0.20 1.33 -2.16 0.41 0.00 0.00 173.24 172.63 1cfy s PRO 90 N 0.32 3.22 0.41 12.44 0.04 -1.26 -4.08 135.00 146.09 1cfy s PRO 90 Ca 0.29 2.16 0.17 0.00 0.04 0.00 0.00 61.00 63.66 1cfy s PRO 90 Cb -0.03 -2.27 1.05 0.00 0.04 0.00 0.00 34.50 33.30 1cfy s PRO 90 CO -0.15 -1.10 1.84 -0.44 0.04 0.00 0.00 177.00 177.19 1cfy h ASP 91 N 1.52 0.45 -0.06 6.66 3.32 -1.51 0.02 116.42 126.81 1cfy h ASP 91 Ca -0.51 0.05 0.00 0.00 0.02 0.00 0.00 57.03 56.59 1cfy h ASP 91 Cb 1.29 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 40.81 1cfy h ASP 91 CO 0.58 0.17 0.00 0.35 -1.72 0.00 0.00 179.24 178.61 1cfy n THR 92 N -4.54 0.08 -3.07 0.35 -2.24 -1.26 -4.89 114.28 98.70 1cfy n THR 92 Ca 0.20 -0.09 -0.33 0.00 -2.27 0.00 0.00 64.05 61.57 1cfy n THR 92 Cb 0.70 -0.02 -0.06 0.00 -2.10 0.00 0.00 70.33 68.85 1cfy n THR 92 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1cfy s ALA 93 N -1.92 3.27 0.35 6.98 0.00 -0.01 -4.78 121.76 125.66 1cfy s ALA 93 Ca 0.13 0.12 -0.27 0.00 0.00 0.00 0.00 51.96 51.93 1cfy s ALA 93 Cb 0.06 -2.84 -0.12 0.00 0.00 0.00 0.00 23.12 20.22 1cfy s ALA 93 CO 0.10 0.29 1.24 -0.35 0.00 0.00 0.00 175.76 177.04 1cfy n PRO 94 N -0.36 1.96 0.15 0.00 -0.04 -1.26 -4.79 135.00 130.67 1cfy n PRO 94 Ca 0.04 0.69 0.14 0.00 -0.04 0.00 0.00 63.50 64.33 1cfy n PRO 94 Cb 0.53 -2.26 0.70 0.00 -0.04 0.00 0.00 33.50 32.43 1cfy n PRO 94 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1cfy h VAL 95 N 2.34 0.79 -0.24 0.52 2.07 -1.96 0.14 116.25 119.92 1cfy h VAL 95 Ca -0.46 0.00 -0.11 0.00 0.82 0.00 0.00 66.70 66.95 1cfy h VAL 95 Cb 1.29 0.87 -0.01 0.00 -1.52 0.00 0.00 31.29 31.92 1cfy h VAL 95 CO 0.61 0.00 -0.33 0.03 0.02 0.00 0.00 177.57 177.90 1cfy h ARG 96 N 0.00 0.50 0.03 1.57 2.47 -2.00 -1.78 114.38 115.17 1cfy h ARG 96 Ca 0.11 -0.22 -0.00 0.00 -1.26 0.00 0.00 59.98 58.61 1cfy h ARG 96 Cb 0.47 -0.01 0.00 0.00 -1.65 0.00 0.00 29.97 28.77 1cfy h ARG 96 CO -0.00 0.77 -0.02 0.77 0.56 0.00 0.00 179.97 182.05 1cfy h SER 97 N 0.42 -0.04 -0.82 7.04 0.02 -1.11 -3.05 113.55 116.02 1cfy h SER 97 Ca 0.05 -0.53 0.11 0.00 -0.84 0.00 0.00 61.79 60.58 1cfy h SER 97 Cb 0.79 0.01 -0.06 0.00 0.14 0.00 0.00 62.40 63.28 1cfy h SER 97 CO 0.06 0.53 0.53 0.11 -1.14 0.00 0.00 176.83 176.92 1cfy h LYS 98 N -0.62 0.67 0.48 3.45 1.57 -1.27 -0.30 116.57 120.54 1cfy h LYS 98 Ca -0.00 -0.04 -0.02 0.00 -1.87 0.00 0.00 60.65 58.71 1cfy h LYS 98 Cb 0.57 -0.15 0.00 0.00 0.08 0.00 0.00 32.23 32.73 1cfy h LYS 98 CO 0.01 0.44 -0.23 1.98 -0.57 0.00 0.00 179.45 181.08 1cfy h MET 99 N 0.69 -0.62 -0.54 3.15 4.05 -1.37 -1.36 114.93 118.93 1cfy h MET 99 Ca 0.39 0.04 -0.08 0.00 -0.28 0.00 0.00 59.70 59.77 1cfy h MET 99 Cb 0.56 0.14 -0.02 0.00 -0.80 0.00 0.00 31.60 31.48 1cfy h MET 99 CO -0.16 -0.32 0.03 -0.24 0.23 0.00 0.00 176.91 176.45 1cfy h VAL 100 N -0.86 1.25 -0.18 -5.77 3.04 -1.36 -2.45 116.25 109.92 1cfy h VAL 100 Ca -0.07 -1.03 -0.14 0.00 -1.01 0.00 0.00 66.70 64.45 1cfy h VAL 100 Cb 0.58 0.81 -0.01 0.00 -2.01 0.00 0.00 31.29 30.66 1cfy h VAL 100 CO 0.11 0.37 -0.48 1.88 -1.01 0.00 0.00 177.57 178.44 1cfy h TYR 101 N 0.84 0.58 -0.73 3.17 -1.99 -1.09 -2.00 116.97 115.74 1cfy h TYR 101 Ca 0.16 -0.18 -0.03 0.00 2.00 0.00 0.00 58.73 60.68 1cfy h TYR 101 Cb 0.46 -0.12 -0.03 0.00 2.00 0.00 0.00 36.73 39.04 1cfy h TYR 101 CO 0.03 0.86 0.33 0.00 -0.00 0.00 0.00 178.16 179.38 1cfy h ALA 102 N 1.11 1.20 0.00 3.88 0.00 -1.00 -1.65 119.26 122.79 1cfy h ALA 102 Ca 0.02 -0.16 -0.25 0.00 0.00 0.00 0.00 54.91 54.52 1cfy h ALA 102 Cb 0.98 -0.29 -0.04 0.00 0.00 0.00 0.00 17.79 18.43 1cfy h ALA 102 CO 0.09 0.60 -1.38 0.66 0.00 0.00 0.00 179.25 179.21 1cfy h SER 103 N 1.05 0.00 1.72 0.00 4.64 -1.38 -3.35 113.55 116.23 1cfy h SER 103 Ca 0.25 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.54 1cfy h SER 103 Cb 0.14 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.23 1cfy h SER 103 CO -0.03 0.98 -0.28 0.28 -0.87 0.00 0.00 176.83 176.91 1cfy h SER 104 N 0.00 0.00 -0.50 4.97 0.02 -1.28 -3.39 113.55 113.37 1cfy h SER 104 Ca -0.16 0.00 0.04 0.00 -0.84 0.00 0.00 61.79 60.83 1cfy h SER 104 Cb 1.89 0.00 -0.06 0.00 0.14 0.00 0.00 62.40 64.37 1cfy h SER 104 CO 0.10 0.12 -0.29 1.17 -1.14 0.00 0.00 176.83 176.79 1cfy n LYS 105 N -3.06 -0.22 -0.22 3.45 4.81 -0.63 -1.17 118.16 121.11 1cfy n LYS 105 Ca 0.03 1.25 0.24 0.00 -0.87 0.00 0.00 58.31 58.95 1cfy n LYS 105 Cb 0.59 -1.85 0.61 0.00 0.02 0.00 0.00 35.03 34.40 1cfy n LYS 105 CO 0.00 0.00 0.00 -0.44 1.17 0.00 0.00 177.40 178.13 1cfy h ASP 106 N 0.00 0.23 -0.53 3.14 3.32 -1.83 0.34 116.42 121.09 1cfy h ASP 106 Ca 0.08 0.03 0.08 0.00 0.02 0.00 0.00 57.03 57.24 1cfy h ASP 106 Cb 0.20 -0.01 -0.07 0.00 0.22 0.00 0.00 39.33 39.67 1cfy h ASP 106 CO -0.47 0.08 0.16 0.00 -1.72 0.00 0.00 179.24 177.29 1cfy h ALA 107 N 1.59 0.64 0.07 3.45 0.00 -1.40 0.26 119.26 123.86 1cfy h ALA 107 Ca 0.46 0.09 -0.00 0.00 0.00 0.00 0.00 54.91 55.46 1cfy h ALA 107 Cb 1.44 0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.32 1cfy h ALA 107 CO -0.11 -0.25 -0.03 1.25 0.00 0.00 0.00 179.25 180.10 1cfy h LEU 108 N 0.32 -0.08 -1.35 0.00 6.46 -1.04 -3.28 115.31 116.33 1cfy h LEU 108 Ca 0.26 -0.53 0.14 0.00 -0.12 0.00 0.00 57.88 57.63 1cfy h LEU 108 Cb 0.33 0.02 -0.07 0.00 -0.73 0.00 0.00 40.66 40.21 1cfy h LEU 108 CO -0.30 0.59 0.56 -0.09 -0.62 0.00 0.00 178.44 178.58 1cfy h ARG 109 N -0.86 0.62 0.00 1.25 9.65 -0.89 -1.63 114.38 122.52 1cfy h ARG 109 Ca -0.01 -0.04 -0.10 0.00 -1.10 0.00 0.00 59.98 58.73 1cfy h ARG 109 Cb 0.61 -0.14 -0.01 0.00 -1.39 0.00 0.00 29.97 29.03 1cfy h ARG 109 CO 0.02 0.41 -0.49 -0.09 2.80 0.00 0.00 179.97 182.62 1cfy h ARG 110 N 0.64 0.00 0.00 0.20 2.43 -1.07 -3.18 114.38 113.40 1cfy h ARG 110 Ca 0.43 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.60 1cfy h ARG 110 Cb 0.73 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.28 1cfy h ARG 110 CO -0.18 0.49 -0.22 0.00 -1.51 0.00 0.00 179.97 178.55 1cfy n ALA 111 N -2.35 2.81 -3.47 2.80 0.00 -0.63 -4.67 120.51 115.00 1cfy n ALA 111 Ca -0.01 -0.20 -0.43 0.00 0.00 0.00 0.00 53.44 52.81 1cfy n ALA 111 Cb 0.57 -1.33 -0.06 0.00 0.00 0.00 0.00 19.45 18.63 1cfy n ALA 111 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1cfy s LEU 112 N -3.14 6.02 -0.07 0.00 1.43 -1.11 -5.05 118.68 116.76 1cfy s LEU 112 Ca 0.12 -2.26 -0.30 0.00 -1.03 0.00 0.00 54.13 50.67 1cfy s LEU 112 Cb 0.18 -2.08 -0.02 0.00 0.03 0.00 0.00 46.19 44.29 1cfy s LEU 112 CO 0.61 -0.64 1.12 0.21 0.23 0.00 0.00 176.35 177.87 1cfy s ASN 113 N 2.40 7.14 0.00 2.29 3.84 -1.26 -3.92 114.94 125.42 1cfy s ASN 113 Ca 0.10 1.70 0.00 0.00 0.21 0.00 0.00 52.86 54.88 1cfy s ASN 113 Cb -0.22 -2.56 0.00 0.00 -0.55 0.00 0.00 41.25 37.93 1cfy s ASN 113 CO -0.03 -0.52 0.00 0.61 -2.79 0.00 0.00 177.10 174.37 1cfy n GLY 114 N 3.24 1.05 3.73 1.21 0.00 -1.26 -5.08 105.19 108.08 1cfy n GLY 114 Ca 0.10 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.71 1cfy n GLY 114 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1cfy s VAL 115 N -2.00 4.19 -0.13 1.61 1.01 -1.25 -4.55 120.40 119.28 1cfy s VAL 115 Ca 0.00 1.77 -0.08 0.00 0.00 0.00 0.00 61.98 63.67 1cfy s VAL 115 Cb 0.00 -4.13 -0.03 0.00 0.00 0.00 0.00 36.38 32.22 1cfy s VAL 115 CO 0.00 0.25 -0.16 0.28 0.00 0.00 0.00 175.10 175.47 1cfy h SER 116 N 5.73 0.00 -2.56 3.32 0.02 -1.36 -3.48 113.55 115.22 1cfy h SER 116 Ca -0.43 0.00 -0.59 0.00 -0.84 0.00 0.00 61.79 59.93 1cfy h SER 116 Cb 1.21 0.00 -0.12 0.00 0.14 0.00 0.00 62.40 63.64 1cfy h SER 116 CO 0.74 0.70 -0.69 0.28 -1.14 0.00 0.00 176.83 176.72 1cfy s THR 117 N -2.13 3.28 -0.09 -2.27 -1.32 -1.17 -5.04 115.64 106.91 1cfy s THR 117 Ca -0.13 -1.83 0.03 0.00 -1.21 0.00 0.00 61.69 58.55 1cfy s THR 117 Cb 0.02 -2.69 0.01 0.00 -1.51 0.00 0.00 72.50 68.32 1cfy s THR 117 CO 0.19 -0.26 -0.19 -1.81 -2.21 0.00 0.00 174.62 170.35 1cfy s ASP 118 N -3.28 2.54 -0.10 8.08 1.11 -1.26 -0.69 116.67 123.07 1cfy s ASP 118 Ca 0.28 -0.45 0.02 0.00 0.18 0.00 0.00 52.55 52.59 1cfy s ASP 118 Cb -0.07 -1.16 0.01 0.00 1.07 0.00 0.00 42.92 42.76 1cfy s ASP 118 CO 0.18 0.10 -0.17 -0.69 1.18 0.00 0.00 175.17 175.76 1cfy s VAL 119 N 0.55 1.56 -0.31 -1.27 1.01 0.22 -4.96 120.40 117.20 1cfy s VAL 119 Ca -0.16 -0.70 -0.13 0.00 0.00 0.00 0.00 61.98 61.00 1cfy s VAL 119 Cb -0.17 -1.40 -0.03 0.00 0.00 0.00 0.00 36.38 34.78 1cfy s VAL 119 CO 0.06 0.45 0.26 -1.58 0.00 0.00 0.00 175.10 174.28 1cfy s GLN 120 N 0.79 3.72 -0.16 2.72 2.00 -1.26 -0.69 119.66 126.77 1cfy s GLN 120 Ca -0.11 -0.42 -0.01 0.00 -2.00 0.00 0.00 55.36 52.82 1cfy s GLN 120 Cb -0.16 -3.74 -0.01 0.00 0.80 0.00 0.00 33.01 29.90 1cfy s GLN 120 CO 0.02 -0.35 -0.11 0.20 -0.50 0.00 0.00 175.29 174.55 1cfy s GLY 121 N 1.73 1.56 -0.00 2.59 0.00 0.22 -4.94 107.32 108.49 1cfy s GLY 121 Ca 0.08 -0.97 0.03 0.00 0.00 0.00 0.00 44.72 43.86 1cfy s GLY 121 CO 0.11 -0.00 0.10 -1.30 0.00 0.00 0.00 173.10 172.00 1cfy n THR 122 N 3.89 0.00 -3.89 0.90 -2.24 -1.26 -0.40 114.28 111.28 1cfy n THR 122 Ca -0.18 -0.26 -0.09 0.00 -2.27 0.00 0.00 64.05 61.24 1cfy n THR 122 Cb 0.52 0.74 -0.06 0.00 -2.10 0.00 0.00 70.33 69.43 1cfy n THR 122 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 1cfy s ASP 123 N -1.78 -0.06 0.44 3.42 1.47 -1.26 -1.23 116.67 117.67 1cfy s ASP 123 Ca 0.00 -0.75 0.19 0.00 1.18 0.00 0.00 52.55 53.17 1cfy s ASP 123 Cb 0.02 0.49 1.04 0.00 -0.34 0.00 0.00 42.92 44.13 1cfy s ASP 123 CO 0.13 -0.96 1.94 -0.26 0.68 0.00 0.00 175.17 176.70 1cfy h PHE 124 N 2.42 0.00 0.00 2.11 0.04 -1.98 -2.58 116.94 116.95 1cfy h PHE 124 Ca -0.30 0.00 -0.10 0.00 2.80 0.00 0.00 57.97 60.36 1cfy h PHE 124 Cb 1.24 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 39.37 1cfy h PHE 124 CO 0.38 0.24 -0.49 0.66 -0.60 0.00 0.00 178.31 178.50 1cfy h SER 125 N 0.00 0.00 0.51 2.17 4.64 -1.99 -2.60 113.55 116.28 1cfy h SER 125 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1cfy h SER 125 Cb 0.50 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.59 1cfy h SER 125 CO 0.03 0.49 0.00 -0.62 -0.87 0.00 0.00 176.83 175.86 1cfy n GLU 126 N -3.56 0.09 -0.16 4.77 1.02 -0.97 -2.80 120.64 119.02 1cfy n GLU 126 Ca -0.00 0.17 0.07 0.00 -0.02 0.00 0.00 57.16 57.37 1cfy n GLU 126 Cb 0.59 -1.50 0.09 0.00 -0.02 0.00 0.00 31.44 30.60 1cfy n GLU 126 CO 0.00 0.00 0.00 1.33 1.18 0.00 0.00 177.13 179.64 1cfy n VAL 127 N -1.42 1.32 -1.10 2.62 0.24 -1.00 -4.76 118.33 114.23 1cfy n VAL 127 Ca 0.06 -1.57 -0.31 0.00 -2.04 0.00 0.00 64.34 60.48 1cfy n VAL 127 Cb 0.18 0.03 0.12 0.00 -1.47 0.00 0.00 33.84 32.70 1cfy n VAL 127 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 1cfy s SER 128 N -2.21 3.78 0.20 -1.34 1.04 -1.11 -4.80 113.70 109.25 1cfy s SER 128 Ca 0.21 1.80 -0.10 0.00 0.48 0.00 0.00 55.95 58.34 1cfy s SER 128 Cb 0.18 -2.43 0.25 0.00 0.10 0.00 0.00 66.02 64.12 1cfy s SER 128 CO 0.02 -2.49 1.76 0.22 0.98 0.00 0.00 173.24 173.73 1cfy h TYR 129 N -1.45 0.47 -0.65 5.02 3.20 -1.92 -1.90 116.97 119.74 1cfy h TYR 129 Ca -0.46 0.03 -0.07 0.00 3.14 0.00 0.00 58.73 61.36 1cfy h TYR 129 Cb 1.26 -0.12 -0.03 0.00 1.54 0.00 0.00 36.73 39.38 1cfy h TYR 129 CO 0.51 0.17 0.11 -0.44 -1.64 0.00 0.00 178.16 176.87 1cfy h ASP 130 N 0.48 1.02 -0.45 -2.11 3.32 -1.96 0.16 116.42 116.88 1cfy h ASP 130 Ca 0.29 -0.26 -0.10 0.00 0.02 0.00 0.00 57.03 56.98 1cfy h ASP 130 Cb 0.30 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.56 1cfy h ASP 130 CO -0.25 1.02 -0.11 0.28 -1.72 0.00 0.00 179.24 178.46 1cfy h SER 131 N 0.98 0.87 -0.36 6.45 0.02 -1.76 -1.93 113.55 117.82 1cfy h SER 131 Ca 0.20 -0.36 -0.16 0.00 -0.84 0.00 0.00 61.79 60.63 1cfy h SER 131 Cb 0.43 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 62.72 1cfy h SER 131 CO 0.01 1.03 -0.37 0.58 -1.14 0.00 0.00 176.83 176.94 1cfy h VAL 132 N 0.70 1.27 0.02 2.27 2.07 -1.27 -2.43 116.25 118.88 1cfy h VAL 132 Ca 0.11 -1.54 0.01 0.00 0.82 0.00 0.00 66.70 66.10 1cfy h VAL 132 Cb 0.65 1.37 -0.02 0.00 -1.52 0.00 0.00 31.29 31.77 1cfy h VAL 132 CO 0.04 0.52 -0.10 0.25 0.02 0.00 0.00 177.57 178.30 1cfy h LEU 133 N 0.75 -0.28 -0.92 2.57 5.85 -0.52 -1.14 115.31 121.62 1cfy h LEU 133 Ca 0.06 0.04 0.13 0.00 0.84 0.00 0.00 57.88 58.95 1cfy h LEU 133 Cb 0.96 0.12 -0.09 0.00 0.37 0.00 0.00 40.66 42.02 1cfy h LEU 133 CO 0.09 -0.15 0.54 -0.08 -0.34 0.00 0.00 178.44 178.51 1cfy h GLU 134 N -0.18 0.81 0.00 1.25 4.22 -1.33 0.23 114.58 119.58 1cfy h GLU 134 Ca 0.03 -0.05 -0.09 0.00 0.08 0.00 0.00 59.36 59.33 1cfy h GLU 134 Cb 0.22 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.27 1cfy h GLU 134 CO -0.08 0.53 -0.44 -0.09 -2.18 0.00 0.00 179.01 176.75 1cfy h ARG 135 N 0.83 0.00 0.00 1.92 2.43 -0.85 -0.57 114.38 118.14 1cfy h ARG 135 Ca 0.47 0.00 -0.31 0.00 -0.81 0.00 0.00 59.98 59.33 1cfy h ARG 135 Cb 0.53 0.00 -0.05 0.00 -0.42 0.00 0.00 29.97 30.03 1cfy h ARG 135 CO -0.29 0.44 -1.85 1.33 -1.51 0.00 0.00 179.97 178.09 1cfy n VAL 136 N -3.78 1.55 0.14 0.20 0.24 -0.50 -4.46 118.33 111.72 1cfy n VAL 136 Ca -0.01 -0.81 -0.06 0.00 -2.04 0.00 0.00 64.34 61.42 1cfy n VAL 136 Cb 0.50 -0.91 -0.03 0.00 -1.47 0.00 0.00 33.84 31.93 1cfy n VAL 136 CO 0.00 0.00 0.00 0.28 -2.14 0.00 0.00 176.83 174.97 1cfy h SER 137 N 0.00 -0.33 -0.01 -1.34 0.02 -0.56 -3.51 113.55 107.81 1cfy h SER 137 Ca -0.34 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.62 1cfy h SER 137 Cb 2.05 0.09 0.00 0.00 0.14 0.00 0.00 62.40 64.68 1cfy h SER 137 CO 0.07 -0.05 0.00 0.54 -1.14 0.00 0.00 176.83 176.25