#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1cfc n ASP 2 N 0.00 0.00 -4.74 0.00 -0.08 -1.26 -4.96 116.55 105.50 1cfc n ASP 2 Ca 0.00 -0.90 -0.38 0.00 -1.51 0.00 0.00 54.79 52.00 1cfc n ASP 2 Cb 0.00 0.00 0.05 0.00 2.34 0.00 0.00 41.12 43.51 1cfc n ASP 2 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1cfc n GLN 3 N 0.00 1.59 -1.75 -0.67 6.02 -1.26 -4.88 117.38 116.43 1cfc n GLN 3 Ca 0.00 0.59 -0.42 0.00 -0.01 0.00 0.00 57.00 57.16 1cfc n GLN 3 Cb 0.45 -2.58 -0.03 0.00 1.02 0.00 0.00 30.24 29.10 1cfc n GLN 3 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1cfc s LEU 4 N -3.70 4.37 0.68 1.08 1.43 -1.26 -4.92 118.68 116.36 1cfc s LEU 4 Ca 0.74 2.86 -0.14 0.00 -1.03 0.00 0.00 54.13 56.56 1cfc s LEU 4 Cb -0.41 -3.60 0.01 0.00 0.03 0.00 0.00 46.19 42.22 1cfc s LEU 4 CO 0.47 -0.95 1.10 0.42 0.23 0.00 0.00 176.35 177.61 1cfc s THR 5 N 1.05 3.37 0.43 5.49 -4.23 -1.26 -4.83 115.64 115.65 1cfc s THR 5 Ca 0.73 0.57 0.09 0.00 -1.18 0.00 0.00 61.69 61.90 1cfc s THR 5 Cb -0.49 -3.10 0.27 0.00 1.34 0.00 0.00 72.50 70.52 1cfc s THR 5 CO 0.34 -0.46 2.07 1.05 -0.54 0.00 0.00 174.62 177.08 1cfc h GLU 6 N -0.27 0.46 -0.10 3.99 4.11 -1.93 -1.37 114.58 119.47 1cfc h GLU 6 Ca -0.46 -0.03 -0.08 0.00 0.07 0.00 0.00 59.36 58.86 1cfc h GLU 6 Cb 1.24 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 30.39 1cfc h GLU 6 CO 0.54 0.30 -0.27 0.93 0.07 0.00 0.00 179.01 180.58 1cfc h GLU 7 N 0.47 0.36 -0.79 1.06 5.08 -1.96 -2.44 114.58 116.36 1cfc h GLU 7 Ca 0.13 -0.25 0.03 0.00 -1.00 0.00 0.00 59.36 58.28 1cfc h GLU 7 Cb -0.03 0.04 -0.04 0.00 0.50 0.00 0.00 28.75 29.21 1cfc h GLU 7 CO -0.03 0.87 0.52 1.96 -1.00 0.00 0.00 179.01 181.33 1cfc h GLN 8 N -0.08 0.95 -0.23 2.33 4.20 -1.78 0.58 115.11 121.06 1cfc h GLN 8 Ca -0.00 -0.06 -0.09 0.00 0.06 0.00 0.00 58.65 58.56 1cfc h GLN 8 Cb 0.88 -0.21 -0.01 0.00 0.30 0.00 0.00 27.48 28.43 1cfc h GLN 8 CO 0.06 0.63 -0.26 0.82 -0.67 0.00 0.00 178.83 179.41 1cfc h ILE 9 N 0.97 1.26 -0.04 2.54 2.04 -1.21 -2.60 117.51 120.49 1cfc h ILE 9 Ca 0.32 -1.26 -0.02 0.00 1.00 0.00 0.00 64.86 64.90 1cfc h ILE 9 Cb 0.05 1.37 -0.00 0.00 -0.74 0.00 0.00 36.82 37.50 1cfc h ILE 9 CO -0.09 0.40 -0.06 0.00 0.00 0.00 0.00 178.15 178.39 1cfc h ALA 10 N 1.34 0.06 -0.89 1.87 0.00 -0.58 -1.97 119.26 119.08 1cfc h ALA 10 Ca 0.06 -0.30 0.22 0.00 0.00 0.00 0.00 54.91 54.88 1cfc h ALA 10 Cb 0.66 -0.01 -0.06 0.00 0.00 0.00 0.00 17.79 18.38 1cfc h ALA 10 CO 0.05 -0.12 0.60 1.49 0.00 0.00 0.00 179.25 181.27 1cfc h GLU 11 N -0.40 0.29 -0.03 0.00 4.81 -0.85 0.38 114.58 118.77 1cfc h GLU 11 Ca 0.00 -0.02 -0.22 0.00 -0.13 0.00 0.00 59.36 58.99 1cfc h GLU 11 Cb 0.62 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.94 1cfc h GLU 11 CO 0.01 0.19 -0.90 0.74 -0.73 0.00 0.00 179.01 178.32 1cfc h PHE 12 N 0.29 0.70 -0.49 0.92 0.04 -1.30 -2.44 116.94 114.66 1cfc h PHE 12 Ca 0.45 -0.36 -0.05 0.00 2.80 0.00 0.00 57.97 60.82 1cfc h PHE 12 Cb 1.30 -0.09 -0.02 0.00 2.20 0.00 0.00 35.95 39.34 1cfc h PHE 12 CO -0.00 1.17 0.11 -0.22 -0.60 0.00 0.00 178.31 178.77 1cfc h LYS 13 N 0.29 0.78 -0.36 1.51 3.64 0.46 0.31 116.57 123.20 1cfc h LYS 13 Ca -0.07 -0.19 -0.03 0.00 -1.27 0.00 0.00 60.65 59.09 1cfc h LYS 13 Cb 1.53 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 33.23 1cfc h LYS 13 CO 0.16 0.77 0.12 0.93 -2.27 0.00 0.00 179.45 179.16 1cfc h GLU 14 N 0.66 0.56 0.00 1.90 5.08 -1.12 0.87 114.58 122.53 1cfc h GLU 14 Ca 0.15 -0.12 -0.05 0.00 -1.00 0.00 0.00 59.36 58.35 1cfc h GLU 14 Cb 0.34 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.50 1cfc h GLU 14 CO 0.00 0.58 -0.22 0.00 -1.00 0.00 0.00 179.01 178.37 1cfc h ALA 15 N 0.96 1.36 0.02 3.43 0.00 -1.19 -1.83 119.26 122.00 1cfc h ALA 15 Ca 0.12 -0.20 -0.08 0.00 0.00 0.00 0.00 54.91 54.74 1cfc h ALA 15 Cb 0.25 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 18.01 1cfc h ALA 15 CO -0.00 0.28 -0.34 0.35 0.00 0.00 0.00 179.25 179.53 1cfc h PHE 16 N 0.00 0.31 -0.10 0.00 3.57 0.37 -3.28 116.94 117.80 1cfc h PHE 16 Ca -0.00 -0.18 -0.05 0.00 3.53 0.00 0.00 57.97 61.27 1cfc h PHE 16 Cb 0.47 -0.03 -0.01 0.00 2.79 0.00 0.00 35.95 39.17 1cfc h PHE 16 CO 0.00 1.02 -0.17 0.66 -2.23 0.00 0.00 178.31 177.59 1cfc h SER 17 N -0.49 0.15 -0.04 0.41 4.64 -0.70 -2.31 113.55 115.21 1cfc h SER 17 Ca -0.05 -0.03 0.01 0.00 -0.47 0.00 0.00 61.79 61.25 1cfc h SER 17 Cb 1.13 -0.04 -0.00 0.00 -0.31 0.00 0.00 62.40 63.18 1cfc h SER 17 CO 0.07 0.34 0.38 -0.07 -0.87 0.00 0.00 176.83 176.68 1cfc h LEU 18 N 0.15 0.00 -2.82 5.97 3.38 -1.39 0.02 115.31 120.61 1cfc h LEU 18 Ca 0.03 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.98 1cfc h LEU 18 Cb 0.40 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.11 1cfc h LEU 18 CO 0.03 0.00 -0.33 0.49 0.09 0.00 0.00 178.44 178.72 1cfc n PHE 19 N -2.94 0.00 -2.97 1.13 3.01 -0.88 -4.88 117.46 109.94 1cfc n PHE 19 Ca -0.01 -0.90 -0.43 0.00 1.01 0.00 0.00 57.45 57.12 1cfc n PHE 19 Cb 0.44 -0.16 0.01 0.00 -0.01 0.00 0.00 39.48 39.76 1cfc n PHE 19 CO 0.00 0.00 0.00 -3.47 1.01 0.00 0.00 176.76 174.30 1cfc n ASP 20 N -0.90 6.47 0.00 4.37 2.03 -0.01 -4.65 116.55 123.87 1cfc n ASP 20 Ca 0.13 -3.43 0.10 0.00 0.52 0.00 0.00 54.79 52.11 1cfc n ASP 20 Cb 0.72 -1.27 0.60 0.00 -0.72 0.00 0.00 41.12 40.45 1cfc n ASP 20 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 1cfc n LYS 21 N 1.28 0.88 -0.09 -0.67 4.76 -1.26 -2.87 118.16 120.18 1cfc n LYS 21 Ca 0.27 0.00 0.12 0.00 -2.87 0.00 0.00 58.31 55.83 1cfc n LYS 21 Cb 0.33 -1.36 0.17 0.00 -1.84 0.00 0.00 35.03 32.32 1cfc n LYS 21 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 1cfc n ASP 22 N -0.86 3.20 -0.48 4.39 9.92 -1.26 -4.91 116.55 126.56 1cfc n ASP 22 Ca 0.15 -1.99 -0.04 0.00 -0.53 0.00 0.00 54.79 52.39 1cfc n ASP 22 Cb 0.07 -0.12 -0.02 0.00 -0.64 0.00 0.00 41.12 40.41 1cfc n ASP 22 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1cfc n GLY 23 N 1.43 0.36 0.89 0.44 0.00 -1.14 -4.65 105.19 102.51 1cfc n GLY 23 Ca 0.17 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.31 1cfc n GLY 23 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1cfc n ASP 24 N 0.61 2.85 -0.46 1.61 -0.08 -1.26 -4.95 116.55 114.86 1cfc n ASP 24 Ca -0.04 -1.92 -0.04 0.00 -1.51 0.00 0.00 54.79 51.28 1cfc n ASP 24 Cb 0.28 0.08 -0.00 0.00 2.34 0.00 0.00 41.12 43.81 1cfc n ASP 24 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1cfc n GLY 25 N 1.36 0.25 3.20 0.27 0.00 -1.26 -5.04 105.19 103.97 1cfc n GLY 25 Ca 0.13 -0.72 -0.12 0.00 0.00 0.00 0.00 46.02 45.31 1cfc n GLY 25 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1cfc s THR 26 N -2.25 0.07 0.18 2.61 -4.23 -1.26 -3.63 115.64 107.14 1cfc s THR 26 Ca 0.01 -1.98 -0.01 0.00 -1.18 0.00 0.00 61.69 58.53 1cfc s THR 26 Cb -0.00 -2.39 -0.04 0.00 1.34 0.00 0.00 72.50 71.40 1cfc s THR 26 CO 0.01 -0.12 0.11 0.27 -0.54 0.00 0.00 174.62 174.35 1cfc s ILE 27 N -4.10 0.03 0.44 2.99 -4.36 -0.20 -4.38 121.20 111.62 1cfc s ILE 27 Ca 0.35 -1.96 0.00 0.00 -0.26 0.00 0.00 60.65 58.78 1cfc s ILE 27 Cb 0.07 -2.34 -0.01 0.00 1.25 0.00 0.00 42.46 41.43 1cfc s ILE 27 CO 0.10 -0.16 0.66 0.42 0.24 0.00 0.00 174.94 176.19 1cfc s THR 28 N -4.12 4.14 0.29 8.37 -4.23 -1.26 -0.83 115.64 118.00 1cfc s THR 28 Ca 0.34 -0.49 0.20 0.00 -1.18 0.00 0.00 61.69 60.56 1cfc s THR 28 Cb 0.07 -3.53 0.17 0.00 1.34 0.00 0.00 72.50 70.56 1cfc s THR 28 CO 0.09 -0.37 1.86 0.71 -0.54 0.00 0.00 174.62 176.37 1cfc h THR 29 N 0.44 0.88 0.00 3.99 1.35 -1.85 -2.48 112.91 115.24 1cfc h THR 29 Ca -0.46 -1.15 -0.03 0.00 -0.55 0.00 0.00 66.41 64.21 1cfc h THR 29 Cb 1.25 1.69 -0.00 0.00 -1.73 0.00 0.00 68.15 69.35 1cfc h THR 29 CO 0.58 0.29 -0.16 0.11 -0.25 0.00 0.00 175.52 176.08 1cfc h LYS 30 N 0.00 0.00 -0.61 4.72 1.57 -1.93 -2.06 116.57 118.25 1cfc h LYS 30 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1cfc h LYS 30 Cb 0.67 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.98 1cfc h LYS 30 CO 0.04 0.16 0.00 0.39 -0.57 0.00 0.00 179.45 179.47 1cfc n GLU 31 N -3.75 3.85 -0.01 3.15 1.02 -0.94 -4.50 120.64 119.46 1cfc n GLU 31 Ca -0.02 -2.91 -0.13 0.00 -0.02 0.00 0.00 57.16 54.09 1cfc n GLU 31 Cb 0.27 -1.93 -0.10 0.00 -0.02 0.00 0.00 31.44 29.66 1cfc n GLU 31 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 1cfc h LEU 32 N 3.87 -0.02 -1.69 -4.62 5.85 -1.35 -2.39 115.31 114.96 1cfc h LEU 32 Ca 0.00 -0.54 -0.04 0.00 0.84 0.00 0.00 57.88 58.14 1cfc h LEU 32 Cb 1.51 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.54 1cfc h LEU 32 CO 0.26 0.54 -0.18 1.23 -0.34 0.00 0.00 178.44 179.95 1cfc h GLY 33 N -0.58 0.00 1.07 3.75 0.00 -1.79 -2.15 103.07 103.37 1cfc h GLY 33 Ca -0.00 0.00 -0.14 0.00 0.00 0.00 0.00 47.33 47.19 1cfc h GLY 33 CO 0.00 0.00 -0.29 -0.84 0.00 0.00 0.00 176.54 175.42 1cfc h THR 34 N 0.00 1.28 0.02 4.70 2.02 -1.79 -1.07 112.91 118.06 1cfc h THR 34 Ca -0.00 -1.45 -0.00 0.00 0.77 0.00 0.00 66.41 65.73 1cfc h THR 34 Cb 0.42 1.34 0.00 0.00 -1.74 0.00 0.00 68.15 68.17 1cfc h THR 34 CO 0.02 0.48 -0.01 0.58 0.37 0.00 0.00 175.52 176.97 1cfc h VAL 35 N 0.70 1.26 -0.43 3.16 2.07 -0.96 -2.28 116.25 119.76 1cfc h VAL 35 Ca 0.08 -0.84 0.12 0.00 0.82 0.00 0.00 66.70 66.87 1cfc h VAL 35 Cb 0.86 1.82 -0.02 0.00 -1.52 0.00 0.00 31.29 32.44 1cfc h VAL 35 CO 0.08 0.22 0.31 0.24 0.02 0.00 0.00 177.57 178.43 1cfc h MET 36 N -0.39 0.03 -0.13 1.57 2.86 -1.38 0.94 114.93 118.43 1cfc h MET 36 Ca -0.00 -0.00 -0.13 0.00 -2.06 0.00 0.00 59.70 57.51 1cfc h MET 36 Cb 0.37 -0.01 -0.01 0.00 0.06 0.00 0.00 31.60 32.01 1cfc h MET 36 CO 0.00 0.02 -0.48 0.00 1.06 0.00 0.00 176.91 177.51 1cfc h ARG 37 N 0.03 0.34 -0.02 1.72 2.47 -0.69 -1.10 114.38 117.13 1cfc h ARG 37 Ca 0.20 -0.19 -0.04 0.00 -1.26 0.00 0.00 59.98 58.70 1cfc h ARG 37 Cb 0.78 0.01 -0.01 0.00 -1.65 0.00 0.00 29.97 29.10 1cfc h ARG 37 CO -0.01 0.75 -0.15 0.66 0.56 0.00 0.00 179.97 181.78 1cfc h SER 38 N 0.27 0.03 0.04 7.04 4.64 -0.27 0.47 113.55 125.78 1cfc h SER 38 Ca 0.01 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.33 1cfc h SER 38 Cb 0.95 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 63.04 1cfc h SER 38 CO 0.08 0.19 -0.00 0.18 -0.87 0.00 0.00 176.83 176.41 1cfc n LEU 39 N -4.34 0.25 0.00 5.97 4.77 -1.02 -4.86 117.00 117.77 1cfc n LEU 39 Ca -0.02 -0.06 0.00 0.00 -0.03 0.00 0.00 56.01 55.90 1cfc n LEU 39 Cb 0.23 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.30 1cfc n LEU 39 CO 0.36 0.04 0.00 0.61 -1.33 0.00 0.00 177.39 177.08 1cfc n GLY 40 N 1.05 0.67 3.87 -0.72 0.00 0.15 -5.06 105.19 105.15 1cfc n GLY 40 Ca 0.22 -0.34 -0.36 0.00 0.00 0.00 0.00 46.02 45.55 1cfc n GLY 40 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1cfc s GLN 41 N -0.81 3.38 -0.46 1.61 -1.52 -0.45 -4.99 119.66 116.42 1cfc s GLN 41 Ca 0.00 -0.23 0.06 0.00 -1.95 0.00 0.00 55.36 53.24 1cfc s GLN 41 Cb 0.00 -3.11 0.21 0.00 -0.22 0.00 0.00 33.01 29.89 1cfc s GLN 41 CO 0.00 0.74 0.48 -1.71 -0.25 0.00 0.00 175.29 174.55 1cfc n ASN 42 N 1.65 0.61 -4.77 5.90 5.15 -1.26 -3.38 115.26 119.15 1cfc n ASN 42 Ca -0.17 -2.71 -0.34 0.00 -0.60 0.00 0.00 54.58 50.76 1cfc n ASN 42 Cb 0.54 -0.62 0.02 0.00 -0.53 0.00 0.00 39.78 39.19 1cfc n ASN 42 CO 0.00 0.00 0.00 -2.16 1.40 0.00 0.00 177.26 176.50 1cfc s PRO 43 N -0.91 3.17 1.12 1.20 0.04 -1.26 -5.02 135.00 133.34 1cfc s PRO 43 Ca 0.34 1.52 -0.16 0.00 0.04 0.00 0.00 61.00 62.73 1cfc s PRO 43 Cb 0.10 -1.99 0.25 0.00 0.04 0.00 0.00 34.50 32.90 1cfc s PRO 43 CO -0.14 -0.98 1.11 0.95 0.04 0.00 0.00 177.00 177.98 1cfc s THR 44 N -2.00 1.77 0.21 1.26 -4.23 -1.26 -4.79 115.64 106.61 1cfc s THR 44 Ca 0.70 0.00 -0.06 0.00 -1.18 0.00 0.00 61.69 61.15 1cfc s THR 44 Cb -0.22 -2.50 0.07 0.00 1.34 0.00 0.00 72.50 71.19 1cfc s THR 44 CO 0.32 0.00 1.67 -0.33 -0.54 0.00 0.00 174.62 175.74 1cfc h GLU 45 N -2.30 0.95 -0.53 3.99 4.39 -1.99 -2.01 114.58 117.07 1cfc h GLU 45 Ca -0.49 -0.30 -0.12 0.00 0.34 0.00 0.00 59.36 58.78 1cfc h GLU 45 Cb 1.31 -0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 29.86 1cfc h GLU 45 CO 0.44 0.96 -0.14 0.00 -1.16 0.00 0.00 179.01 179.12 1cfc h ALA 46 N 1.08 0.75 -0.63 3.43 0.00 -1.98 0.22 119.26 122.13 1cfc h ALA 46 Ca 0.15 -0.36 -0.01 0.00 0.00 0.00 0.00 54.91 54.69 1cfc h ALA 46 Cb 0.57 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.14 1cfc h ALA 46 CO 0.03 0.68 0.36 0.93 0.00 0.00 0.00 179.25 181.25 1cfc h GLU 47 N 0.91 0.85 -0.05 0.00 5.08 -1.85 0.14 114.58 119.65 1cfc h GLU 47 Ca 0.13 -0.08 -0.13 0.00 -1.00 0.00 0.00 59.36 58.29 1cfc h GLU 47 Cb 0.71 -0.18 0.01 0.00 0.50 0.00 0.00 28.75 29.79 1cfc h GLU 47 CO 0.05 0.61 -0.47 -0.07 -1.00 0.00 0.00 179.01 178.13 1cfc h LEU 48 N 0.86 0.50 -1.53 1.33 3.38 -0.81 -3.07 115.31 115.98 1cfc h LEU 48 Ca 0.22 -0.69 -0.01 0.00 0.09 0.00 0.00 57.88 57.49 1cfc h LEU 48 Cb -0.01 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 40.59 1cfc h LEU 48 CO -0.04 1.12 -0.07 1.56 0.09 0.00 0.00 178.44 181.10 1cfc h GLN 49 N -0.07 0.00 -0.07 1.13 4.20 -0.17 -2.23 115.11 117.90 1cfc h GLN 49 Ca -0.04 0.00 -0.09 0.00 0.06 0.00 0.00 58.65 58.57 1cfc h GLN 49 Cb 1.14 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.93 1cfc h GLN 49 CO 0.09 0.07 -0.33 -0.44 -0.67 0.00 0.00 178.83 177.56 1cfc h ASP 50 N 0.00 0.40 0.50 1.46 3.32 -0.71 -2.23 116.42 119.16 1cfc h ASP 50 Ca -0.00 -0.65 -0.10 0.00 0.02 0.00 0.00 57.03 56.30 1cfc h ASP 50 Cb 0.52 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 39.93 1cfc h ASP 50 CO 0.01 0.99 -0.46 0.24 -1.72 0.00 0.00 179.24 178.30 1cfc h MET 51 N -0.15 0.00 -0.50 3.56 2.86 -1.43 -2.82 114.93 116.45 1cfc h MET 51 Ca -0.02 0.00 -0.11 0.00 -2.06 0.00 0.00 59.70 57.50 1cfc h MET 51 Cb 0.98 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.62 1cfc h MET 51 CO 0.07 0.46 -0.14 0.82 1.06 0.00 0.00 176.91 179.18 1cfc h ILE 52 N 0.00 1.27 -0.55 -1.22 2.04 -1.35 -1.24 117.51 116.46 1cfc h ILE 52 Ca -0.00 -1.29 0.11 0.00 1.00 0.00 0.00 64.86 64.68 1cfc h ILE 52 Cb 0.83 1.06 -0.03 0.00 -0.74 0.00 0.00 36.82 37.94 1cfc h ILE 52 CO 0.06 0.45 0.38 -1.13 0.00 0.00 0.00 178.15 177.90 1cfc h ASN 53 N 0.83 0.24 0.00 1.72 -0.73 -1.13 1.23 115.58 117.74 1cfc h ASN 53 Ca 0.12 0.01 -0.01 0.00 1.87 0.00 0.00 56.30 58.29 1cfc h ASN 53 Cb 0.70 -0.04 -0.00 0.00 0.27 0.00 0.00 38.32 39.25 1cfc h ASN 53 CO 0.05 0.14 -0.08 -0.33 -0.37 0.00 0.00 177.43 176.85 1cfc h GLU 54 N 0.27 0.00 0.00 6.67 4.39 -1.46 -3.32 114.58 121.14 1cfc h GLU 54 Ca 0.26 -0.00 -0.04 0.00 0.34 0.00 0.00 59.36 59.91 1cfc h GLU 54 Cb 0.66 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.30 1cfc h GLU 54 CO -0.05 1.00 -0.21 0.28 -1.16 0.00 0.00 179.01 178.87 1cfc h VAL 55 N -0.99 0.70 0.00 3.13 2.07 -0.70 -2.67 116.25 117.79 1cfc h VAL 55 Ca -0.02 -0.89 0.00 0.00 0.82 0.00 0.00 66.70 66.61 1cfc h VAL 55 Cb 1.02 1.56 0.00 0.00 -1.52 0.00 0.00 31.29 32.35 1cfc h VAL 55 CO -0.01 0.21 0.00 -0.67 0.02 0.00 0.00 177.57 177.11 1cfc n ASP 56 N -3.64 3.80 0.06 0.57 2.03 0.42 -3.79 116.55 116.01 1cfc n ASP 56 Ca -0.01 -2.13 -0.08 0.00 0.52 0.00 0.00 54.79 53.09 1cfc n ASP 56 Cb 0.34 -0.72 -0.12 0.00 -0.72 0.00 0.00 41.12 39.90 1cfc n ASP 56 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1cfc h ALA 57 N 1.65 0.35 0.00 -1.67 0.00 -1.65 -3.12 119.26 114.83 1cfc h ALA 57 Ca 0.00 -0.93 0.00 0.00 0.00 0.00 0.00 54.91 53.98 1cfc h ALA 57 Cb 0.99 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.65 1cfc h ALA 57 CO 0.00 1.25 0.00 0.22 0.00 0.00 0.00 179.25 180.72 1cfc h ASP 58 N 0.00 0.00 -0.66 0.00 1.82 -1.86 -3.47 116.42 112.25 1cfc h ASP 58 Ca -0.03 0.00 -0.20 0.00 -0.39 0.00 0.00 57.03 56.41 1cfc h ASP 58 Cb 1.79 0.00 -0.06 0.00 0.68 0.00 0.00 39.33 41.73 1cfc h ASP 58 CO 0.13 0.00 -0.20 0.61 -1.61 0.00 0.00 179.24 178.17 1cfc n GLY 59 N 1.14 0.89 1.02 -0.78 0.00 -1.18 -4.88 105.19 101.40 1cfc n GLY 59 Ca 0.04 -0.56 0.12 0.00 0.00 0.00 0.00 46.02 45.62 1cfc n GLY 59 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1cfc n ASN 60 N 0.35 3.14 -3.04 1.61 4.13 -1.26 -4.95 115.26 115.25 1cfc n ASN 60 Ca -0.10 -1.99 -0.19 0.00 1.68 0.00 0.00 54.58 53.98 1cfc n ASN 60 Cb 0.38 -0.08 -0.00 0.00 -1.54 0.00 0.00 39.78 38.53 1cfc n ASN 60 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1cfc n GLY 61 N 1.40 -0.49 3.19 7.41 0.00 -1.26 -4.93 105.19 110.51 1cfc n GLY 61 Ca 0.16 0.06 -0.11 0.00 0.00 0.00 0.00 46.02 46.12 1cfc n GLY 61 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1cfc s THR 62 N -2.78 0.20 -0.01 2.61 -4.23 -1.26 -2.93 115.64 107.24 1cfc s THR 62 Ca 0.26 -1.95 -0.00 0.00 -1.18 0.00 0.00 61.69 58.82 1cfc s THR 62 Cb -0.13 -2.20 0.01 0.00 1.34 0.00 0.00 72.50 71.52 1cfc s THR 62 CO 0.31 -0.33 0.01 -0.63 -0.54 0.00 0.00 174.62 173.45 1cfc s ILE 63 N -3.99 -0.02 0.36 2.99 1.01 -0.01 -4.84 121.20 116.70 1cfc s ILE 63 Ca 0.28 0.07 0.07 0.00 0.00 0.00 0.00 60.65 61.07 1cfc s ILE 63 Cb 0.07 -0.04 -0.01 0.00 0.01 0.00 0.00 42.46 42.49 1cfc s ILE 63 CO 0.05 0.03 0.43 1.51 0.00 0.00 0.00 174.94 176.96 1cfc s ASP 64 N 0.35 5.66 0.17 3.58 1.47 -1.26 -1.03 116.67 125.60 1cfc s ASP 64 Ca -0.03 -0.36 -0.13 0.00 1.18 0.00 0.00 52.55 53.21 1cfc s ASP 64 Cb -0.04 -1.01 0.07 0.00 -0.34 0.00 0.00 42.92 41.60 1cfc s ASP 64 CO -0.01 -0.49 1.78 0.15 0.68 0.00 0.00 175.17 177.28 1cfc h PHE 65 N 0.95 0.79 -0.25 2.11 3.57 -1.97 -0.69 116.94 121.45 1cfc h PHE 65 Ca -0.44 -0.02 0.05 0.00 3.53 0.00 0.00 57.97 61.09 1cfc h PHE 65 Cb 1.26 -0.25 -0.05 0.00 2.79 0.00 0.00 35.95 39.70 1cfc h PHE 65 CO 0.46 0.58 -0.05 -1.35 -2.23 0.00 0.00 178.31 175.71 1cfc h PRO 66 N 0.77 0.01 -0.19 6.41 0.11 -1.96 -0.21 132.00 136.94 1cfc h PRO 66 Ca 0.20 -0.00 -0.06 0.00 0.11 0.00 0.00 66.00 66.25 1cfc h PRO 66 Cb 0.06 -0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.15 1cfc h PRO 66 CO -0.03 0.01 -0.15 0.93 -0.21 0.00 0.00 178.00 178.54 1cfc h GLU 67 N 0.01 0.31 -0.57 1.05 5.08 -1.93 -1.79 114.58 116.73 1cfc h GLU 67 Ca 0.12 -0.08 -0.01 0.00 -1.00 0.00 0.00 59.36 58.39 1cfc h GLU 67 Cb 0.18 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.36 1cfc h GLU 67 CO -0.25 0.47 0.32 0.35 -1.00 0.00 0.00 179.01 178.89 1cfc h PHE 68 N 0.29 0.77 0.00 4.33 3.57 0.49 -0.49 116.94 125.89 1cfc h PHE 68 Ca 0.06 -0.01 -0.07 0.00 3.53 0.00 0.00 57.97 61.47 1cfc h PHE 68 Cb 0.45 -0.25 -0.01 0.00 2.79 0.00 0.00 35.95 38.93 1cfc h PHE 68 CO 0.01 0.54 -0.36 -0.07 -2.23 0.00 0.00 178.31 176.20 1cfc h LEU 69 N 0.80 0.00 -0.23 0.59 3.38 -0.31 -2.85 115.31 116.69 1cfc h LEU 69 Ca 0.20 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.96 1cfc h LEU 69 Cb 0.02 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.77 1cfc h LEU 69 CO -0.03 0.36 -0.90 0.74 0.09 0.00 0.00 178.44 178.69 1cfc h THR 70 N 0.00 1.42 -0.22 0.22 2.02 -0.75 -1.91 112.91 113.70 1cfc h THR 70 Ca -0.00 -2.46 -0.19 0.00 0.77 0.00 0.00 66.41 64.53 1cfc h THR 70 Cb 0.90 2.40 0.00 0.00 -1.74 0.00 0.00 68.15 69.71 1cfc h THR 70 CO 0.05 0.73 -0.63 0.00 0.37 0.00 0.00 175.52 176.04 1cfc h MET 71 N 0.20 0.77 -0.43 6.66 -0.00 -1.31 -2.16 114.93 118.66 1cfc h MET 71 Ca -0.07 -0.54 -0.12 0.00 -0.00 0.00 0.00 59.70 58.98 1cfc h MET 71 Cb 1.53 0.08 -0.01 0.00 -0.00 0.00 0.00 31.60 33.20 1cfc h MET 71 CO 0.15 1.16 -0.22 0.52 -0.00 0.00 0.00 176.91 178.52 1cfc h MET 72 N 0.57 0.86 -0.07 -0.10 2.07 -1.53 -2.55 114.93 114.18 1cfc h MET 72 Ca -0.01 -0.35 -0.06 0.00 -2.07 0.00 0.00 59.70 57.20 1cfc h MET 72 Cb 1.23 -0.04 -0.01 0.00 -1.87 0.00 0.00 31.60 30.92 1cfc h MET 72 CO 0.13 0.99 -0.25 0.00 1.07 0.00 0.00 176.91 178.86 1cfc h ALA 73 N 1.00 1.45 -0.40 6.32 0.00 -1.26 -0.61 119.26 125.76 1cfc h ALA 73 Ca 0.10 -0.26 -0.04 0.00 0.00 0.00 0.00 54.91 54.71 1cfc h ALA 73 Cb 0.76 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.46 1cfc h ALA 73 CO 0.06 0.39 0.08 0.00 0.00 0.00 0.00 179.25 179.79 1cfc h ARG 74 N 0.11 0.60 0.13 0.00 2.47 -0.96 -3.21 114.38 113.52 1cfc h ARG 74 Ca 0.02 -0.11 -0.01 0.00 -1.26 0.00 0.00 59.98 58.62 1cfc h ARG 74 Cb 0.51 -0.10 0.00 0.00 -1.65 0.00 0.00 29.97 28.73 1cfc h ARG 74 CO 0.04 0.57 -0.06 0.87 0.56 0.00 0.00 179.97 181.94 1cfc h LYS 75 N 0.59 -0.16 -5.19 0.04 1.57 -1.18 -3.42 116.57 108.81 1cfc h LYS 75 Ca 0.13 0.01 -0.06 0.00 -1.87 0.00 0.00 60.65 58.87 1cfc h LYS 75 Cb 0.25 0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.57 1cfc h LYS 75 CO -0.00 -0.11 0.42 -1.33 -0.57 0.00 0.00 179.45 177.86 1cfc n MET 76 N -4.00 0.30 0.00 3.15 2.81 -0.32 -4.43 117.12 114.63 1cfc n MET 76 Ca -0.02 -0.86 0.00 0.00 -1.81 0.00 0.00 57.70 55.01 1cfc n MET 76 Cb 0.07 -3.10 0.00 0.00 -0.71 0.00 0.00 33.22 29.47 1cfc n MET 76 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 1cfc n LYS 77 N 7.74 0.00 0.00 0.03 5.02 -1.26 -4.82 118.16 124.87 1cfc n LYS 77 Ca 0.45 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.74 1cfc n LYS 77 Cb 0.40 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.41 1cfc n LYS 77 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 1cfc n ASP 78 N 0.00 0.00 -2.30 4.39 2.03 -1.26 -1.35 116.55 118.06 1cfc n ASP 78 Ca 0.00 0.29 -0.23 0.00 0.52 0.00 0.00 54.79 55.38 1cfc n ASP 78 Cb 0.00 -0.29 0.01 0.00 -0.72 0.00 0.00 41.12 40.12 1cfc n ASP 78 CO 0.00 0.00 0.00 1.07 -1.92 0.00 0.00 177.20 176.35 1cfc n THR 79 N -1.28 2.29 -0.72 5.18 5.66 -1.26 -5.06 114.28 119.09 1cfc n THR 79 Ca 0.00 -4.34 -0.24 0.00 -3.05 0.00 0.00 64.05 56.41 1cfc n THR 79 Cb 0.04 -0.91 0.10 0.00 -1.55 0.00 0.00 70.33 68.01 1cfc n THR 79 CO 0.00 0.00 0.00 -0.67 -3.05 0.00 0.00 175.07 171.35 1cfc n ASP 80 N -0.57 -2.69 0.20 1.09 2.03 -0.46 -4.81 116.55 111.34 1cfc n ASP 80 Ca 0.37 -0.16 0.12 0.00 0.52 0.00 0.00 54.79 55.64 1cfc n ASP 80 Cb 0.83 -0.70 0.18 0.00 -0.72 0.00 0.00 41.12 40.71 1cfc n ASP 80 CO 0.00 0.00 0.00 -1.28 -1.92 0.00 0.00 177.20 174.00 1cfc h SER 81 N -1.98 0.00 -0.85 1.67 0.87 -1.97 -3.17 113.55 108.12 1cfc h SER 81 Ca -0.32 -0.00 0.15 0.00 -1.23 0.00 0.00 61.79 60.39 1cfc h SER 81 Cb 0.96 0.00 -0.06 0.00 -0.44 0.00 0.00 62.40 62.86 1cfc h SER 81 CO 0.20 0.00 0.55 1.05 -0.53 0.00 0.00 176.83 178.11 1cfc h GLU 82 N 0.00 0.55 0.00 2.24 4.11 -1.96 0.45 114.58 119.97 1cfc h GLU 82 Ca 0.00 -0.03 -0.00 0.00 0.07 0.00 0.00 59.36 59.40 1cfc h GLU 82 Cb 0.97 -0.12 -0.00 0.00 0.50 0.00 0.00 28.75 30.09 1cfc h GLU 82 CO 0.00 0.37 -0.00 1.05 0.07 0.00 0.00 179.01 180.49 1cfc h GLU 83 N 0.57 0.00 0.00 1.06 4.11 -1.87 -1.01 114.58 117.44 1cfc h GLU 83 Ca 0.43 0.00 -0.19 0.00 0.07 0.00 0.00 59.36 59.66 1cfc h GLU 83 Cb 0.81 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.03 1cfc h GLU 83 CO -0.18 0.00 -1.10 0.93 0.07 0.00 0.00 179.01 178.74 1cfc h GLU 84 N 0.00 0.00 0.00 1.06 4.39 -0.31 -3.19 114.58 116.54 1cfc h GLU 84 Ca -0.00 0.00 -0.12 0.00 0.34 0.00 0.00 59.36 59.58 1cfc h GLU 84 Cb 0.21 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 28.87 1cfc h GLU 84 CO 0.00 0.64 -0.46 0.82 -1.16 0.00 0.00 179.01 178.86 1cfc h ILE 85 N 0.00 1.48 -0.21 3.13 2.04 -0.97 -2.75 117.51 120.23 1cfc h ILE 85 Ca -0.09 -2.04 -0.02 0.00 1.00 0.00 0.00 64.86 63.70 1cfc h ILE 85 Cb 1.69 2.69 -0.01 0.00 -0.74 0.00 0.00 36.82 40.46 1cfc h ILE 85 CO 0.09 0.58 0.05 0.08 0.00 0.00 0.00 178.15 178.95 1cfc h ARG 86 N -0.29 0.34 0.00 2.37 0.11 -1.57 0.61 114.38 115.95 1cfc h ARG 86 Ca -0.06 -0.08 0.00 0.00 0.10 0.00 0.00 59.98 59.94 1cfc h ARG 86 Cb 1.19 -0.04 0.00 0.00 1.11 0.00 0.00 29.97 32.23 1cfc h ARG 86 CO 0.09 0.47 0.00 1.05 0.10 0.00 0.00 179.97 181.68 1cfc h GLU 87 N 0.16 0.00 0.01 0.08 -0.00 -1.66 0.38 114.58 113.56 1cfc h GLU 87 Ca 0.07 0.00 -0.02 0.00 -0.00 0.00 0.00 59.36 59.40 1cfc h GLU 87 Cb 0.28 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 29.03 1cfc h GLU 87 CO 0.00 0.00 -0.10 0.00 -0.00 0.00 0.00 179.01 178.91 1cfc h ALA 88 N 2.01 -0.01 -0.10 1.06 0.00 -0.97 -2.15 119.26 119.10 1cfc h ALA 88 Ca 0.00 -0.50 0.03 0.00 0.00 0.00 0.00 54.91 54.44 1cfc h ALA 88 Cb 0.16 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.96 1cfc h ALA 88 CO 0.00 0.03 0.14 0.74 0.00 0.00 0.00 179.25 180.15 1cfc h PHE 89 N -0.86 0.00 -0.15 0.00 0.04 -0.14 0.20 116.94 116.03 1cfc h PHE 89 Ca -0.02 0.00 -0.08 0.00 2.80 0.00 0.00 57.97 60.67 1cfc h PHE 89 Cb 1.03 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 39.18 1cfc h PHE 89 CO 0.25 0.00 -0.24 -0.09 -0.60 0.00 0.00 178.31 177.63 1cfc h ARG 90 N 0.00 0.42 -0.01 1.51 2.43 -0.78 -1.62 114.38 116.33 1cfc h ARG 90 Ca 0.05 -0.26 0.00 0.00 -0.81 0.00 0.00 59.98 58.97 1cfc h ARG 90 Cb 0.32 0.03 -0.00 0.00 -0.42 0.00 0.00 29.97 29.90 1cfc h ARG 90 CO -0.00 0.85 0.41 0.28 -1.51 0.00 0.00 179.97 179.99 1cfc h VAL 91 N 0.03 0.01 0.00 0.20 2.07 0.05 0.48 116.25 119.10 1cfc h VAL 91 Ca 0.01 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.53 1cfc h VAL 91 Cb 0.81 0.60 0.00 0.00 -1.52 0.00 0.00 31.29 31.18 1cfc h VAL 91 CO 0.05 0.00 -1.23 0.49 0.02 0.00 0.00 177.57 176.91 1cfc n PHE 92 N -2.87 0.01 -2.26 1.57 3.01 -0.70 -4.56 117.46 111.64 1cfc n PHE 92 Ca -0.01 0.00 -0.42 0.00 1.01 0.00 0.00 57.45 58.03 1cfc n PHE 92 Cb 0.45 -0.13 0.00 0.00 -0.01 0.00 0.00 39.48 39.79 1cfc n PHE 92 CO 0.00 0.00 0.00 -3.47 1.01 0.00 0.00 176.76 174.30 1cfc n ASP 93 N -1.69 5.85 0.32 4.37 2.03 0.17 -4.73 116.55 122.87 1cfc n ASP 93 Ca 0.02 -3.13 0.21 0.00 0.52 0.00 0.00 54.79 52.42 1cfc n ASP 93 Cb 0.39 -1.44 1.11 0.00 -0.72 0.00 0.00 41.12 40.45 1cfc n ASP 93 CO 0.00 0.00 0.00 0.11 -1.92 0.00 0.00 177.20 175.39 1cfc h LYS 94 N 5.45 0.00 -0.58 -0.67 1.57 -1.80 -0.67 116.57 119.87 1cfc h LYS 94 Ca 0.47 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.25 1cfc h LYS 94 Cb 0.55 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.86 1cfc h LYS 94 CO 1.59 0.00 0.00 -3.47 -0.57 0.00 0.00 179.45 177.00 1cfc n ASP 95 N -3.02 3.67 -2.68 0.86 -0.08 -1.26 -4.93 116.55 109.11 1cfc n ASP 95 Ca -0.02 -1.99 -0.12 0.00 -1.51 0.00 0.00 54.79 51.15 1cfc n ASP 95 Cb 0.10 -0.38 -0.01 0.00 2.34 0.00 0.00 41.12 43.18 1cfc n ASP 95 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1cfc n GLY 96 N 1.59 -0.49 0.01 0.27 0.00 -0.26 -4.77 105.19 101.52 1cfc n GLY 96 Ca 0.22 0.02 0.10 0.00 0.00 0.00 0.00 46.02 46.36 1cfc n GLY 96 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1cfc n ASN 97 N -1.83 0.68 0.00 1.61 5.15 -1.26 -4.96 115.26 114.65 1cfc n ASN 97 Ca -0.08 -0.65 0.00 0.00 -0.60 0.00 0.00 54.58 53.26 1cfc n ASN 97 Cb 0.56 1.25 0.00 0.00 -0.53 0.00 0.00 39.78 41.07 1cfc n ASN 97 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1cfc n GLY 98 N 1.42 0.97 3.18 8.20 0.00 -1.26 -5.02 105.19 112.68 1cfc n GLY 98 Ca 0.02 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.80 1cfc n GLY 98 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1cfc s TYR 99 N -3.38 1.52 0.13 1.61 1.51 -1.26 -4.26 117.35 113.21 1cfc s TYR 99 Ca 0.00 -0.32 -0.01 0.00 -1.01 0.00 0.00 57.07 55.72 1cfc s TYR 99 Cb 0.00 -0.94 -0.04 0.00 -0.11 0.00 0.00 41.96 40.87 1cfc s TYR 99 CO 0.00 0.02 0.06 0.96 -1.11 0.00 0.00 175.55 175.49 1cfc s ILE 100 N -0.61 0.10 0.26 2.71 -4.36 -1.15 -4.90 121.20 113.25 1cfc s ILE 100 Ca 0.06 -1.88 -0.30 0.00 -0.26 0.00 0.00 60.65 58.27 1cfc s ILE 100 Cb -0.07 -2.02 -0.09 0.00 1.25 0.00 0.00 42.46 41.53 1cfc s ILE 100 CO 0.00 -0.47 1.06 -0.94 0.24 0.00 0.00 174.94 174.83 1cfc s SER 101 N -3.04 7.36 0.49 4.36 1.04 -1.26 -2.27 113.70 120.37 1cfc s SER 101 Ca 0.23 2.19 0.38 0.00 0.48 0.00 0.00 55.95 59.23 1cfc s SER 101 Cb 0.07 -2.62 1.56 0.00 0.10 0.00 0.00 66.02 65.13 1cfc s SER 101 CO 0.01 -0.08 1.62 0.00 0.98 0.00 0.00 173.24 175.77 1cfc h ALA 102 N 3.97 3.18 0.53 5.32 0.00 -1.90 0.54 119.26 130.90 1cfc h ALA 102 Ca -0.46 0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.46 1cfc h ALA 102 Cb 1.21 0.18 0.01 0.00 0.00 0.00 0.00 17.79 19.19 1cfc h ALA 102 CO 0.67 -1.77 -0.26 0.00 0.00 0.00 0.00 179.25 177.89 1cfc h ALA 103 N 1.38 -0.71 -0.65 0.00 0.00 -1.92 0.39 119.26 117.74 1cfc h ALA 103 Ca 0.85 -0.16 0.09 0.00 0.00 0.00 0.00 54.91 55.69 1cfc h ALA 103 Cb 3.01 0.28 -0.04 0.00 0.00 0.00 0.00 17.79 21.03 1cfc h ALA 103 CO -0.25 -0.89 0.43 0.93 0.00 0.00 0.00 179.25 179.47 1cfc h GLU 104 N -0.73 0.50 -0.13 0.00 5.08 -0.33 0.30 114.58 119.27 1cfc h GLU 104 Ca -0.07 -0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.24 1cfc h GLU 104 Cb 0.56 -0.11 -0.00 0.00 0.50 0.00 0.00 28.75 29.69 1cfc h GLU 104 CO 0.12 0.33 -0.00 1.25 -1.00 0.00 0.00 179.01 179.71 1cfc h LEU 105 N 0.51 0.23 -1.36 1.33 5.85 -0.19 0.42 115.31 122.09 1cfc h LEU 105 Ca 0.30 -0.31 -0.04 0.00 0.84 0.00 0.00 57.88 58.66 1cfc h LEU 105 Cb 0.48 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.44 1cfc h LEU 105 CO -0.09 0.48 -0.03 0.03 -0.34 0.00 0.00 178.44 178.49 1cfc h ARG 106 N -0.03 0.38 -0.27 1.25 3.08 0.10 -2.02 114.38 116.87 1cfc h ARG 106 Ca 0.04 -0.08 -0.17 0.00 0.07 0.00 0.00 59.98 59.84 1cfc h ARG 106 Cb 0.37 -0.06 -0.00 0.00 0.08 0.00 0.00 29.97 30.36 1cfc h ARG 106 CO 0.01 0.44 -0.53 1.25 -1.07 0.00 0.00 179.97 180.07 1cfc h HIS 107 N 0.37 0.98 -0.93 3.04 2.76 0.05 -2.47 115.15 118.95 1cfc h HIS 107 Ca 0.08 -0.34 -0.00 0.00 -2.20 0.00 0.00 60.37 57.91 1cfc h HIS 107 Cb 0.30 -0.19 -0.05 0.00 1.55 0.00 0.00 27.41 29.03 1cfc h HIS 107 CO 0.01 1.14 0.57 0.28 -1.30 0.00 0.00 177.93 178.63 1cfc h VAL 108 N 0.61 1.25 -0.02 5.26 2.07 0.51 0.14 116.25 126.07 1cfc h VAL 108 Ca 0.02 -0.54 -0.13 0.00 0.82 0.00 0.00 66.70 66.87 1cfc h VAL 108 Cb 1.11 -0.07 -0.02 0.00 -1.52 0.00 0.00 31.29 30.80 1cfc h VAL 108 CO 0.11 0.26 -0.58 0.24 0.02 0.00 0.00 177.57 177.62 1cfc h MET 109 N 1.28 0.06 0.17 1.57 2.07 -1.27 -2.72 114.93 116.09 1cfc h MET 109 Ca 0.34 -0.04 -0.32 0.00 -2.07 0.00 0.00 59.70 57.61 1cfc h MET 109 Cb -0.07 0.01 0.01 0.00 -1.87 0.00 0.00 31.60 29.67 1cfc h MET 109 CO -0.06 0.62 -1.59 1.15 1.07 0.00 0.00 176.91 178.10 1cfc h THR 110 N 0.04 1.01 0.00 2.22 2.02 -0.94 -3.33 112.91 113.93 1cfc h THR 110 Ca -0.01 -2.49 -0.04 0.00 0.77 0.00 0.00 66.41 64.65 1cfc h THR 110 Cb 1.04 2.79 -0.01 0.00 -1.74 0.00 0.00 68.15 70.23 1cfc h THR 110 CO 0.08 0.80 -0.19 -1.13 0.37 0.00 0.00 175.52 175.45 1cfc h ASN 111 N -0.04 0.00 -0.01 4.18 -0.00 -0.81 -2.27 115.58 116.64 1cfc h ASN 111 Ca -0.32 0.00 0.00 0.00 -0.00 0.00 0.00 56.30 55.98 1cfc h ASN 111 Cb 1.98 0.00 -0.00 0.00 -0.00 0.00 0.00 38.32 40.30 1cfc h ASN 111 CO 0.15 0.19 0.01 -0.07 -0.00 0.00 0.00 177.43 177.71 1cfc h LEU 112 N 0.00 0.00 0.00 0.34 3.38 -1.59 -3.46 115.31 113.99 1cfc h LEU 112 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1cfc h LEU 112 Cb 0.41 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.16 1cfc h LEU 112 CO 0.03 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.17 1cfc n GLY 113 N -1.47 1.26 3.80 0.83 0.00 -0.85 -5.07 105.19 103.69 1cfc n GLY 113 Ca -0.03 -0.39 -0.35 0.00 0.00 0.00 0.00 46.02 45.26 1cfc n GLY 113 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1cfc s GLU 114 N -2.16 4.37 0.00 1.61 2.02 -1.26 -4.89 118.70 118.38 1cfc s GLU 114 Ca 0.00 1.23 -0.02 0.00 0.02 0.00 0.00 54.97 56.21 1cfc s GLU 114 Cb 0.00 -2.46 -0.07 0.00 0.10 0.00 0.00 34.13 31.70 1cfc s GLU 114 CO 0.00 0.09 2.39 1.63 0.02 0.00 0.00 175.26 179.38 1cfc n LYS 115 N -0.11 1.24 -3.02 1.61 5.02 -1.26 -4.85 118.16 116.78 1cfc n LYS 115 Ca 0.05 -0.26 -0.35 0.00 -2.02 0.00 0.00 58.31 55.73 1cfc n LYS 115 Cb 0.52 -1.27 -0.06 0.00 -0.02 0.00 0.00 35.03 34.20 1cfc n LYS 115 CO 0.00 0.00 0.00 -0.48 -0.52 0.00 0.00 177.40 176.40 1cfc s LEU 116 N 0.00 4.26 0.04 -0.35 0.05 -1.26 -5.03 118.68 116.39 1cfc s LEU 116 Ca 0.17 1.50 0.03 0.00 0.05 0.00 0.00 54.13 55.88 1cfc s LEU 116 Cb 0.08 -3.84 -0.04 0.00 -2.05 0.00 0.00 46.19 40.35 1cfc s LEU 116 CO 0.00 -0.06 -0.00 0.42 -0.55 0.00 0.00 176.35 176.16 1cfc s THR 117 N -1.68 4.08 0.66 5.48 -4.23 -1.26 -4.97 115.64 113.71 1cfc s THR 117 Ca 0.48 -0.77 0.27 0.00 -1.18 0.00 0.00 61.69 60.49 1cfc s THR 117 Cb -0.15 -2.87 0.28 0.00 1.34 0.00 0.00 72.50 71.10 1cfc s THR 117 CO 0.20 0.27 1.84 0.44 -0.54 0.00 0.00 174.62 176.84 1cfc h ASP 118 N 3.97 0.00 -0.00 3.99 3.32 -2.00 -1.16 116.42 124.54 1cfc h ASP 118 Ca -0.48 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 56.57 1cfc h ASP 118 Cb 1.17 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.72 1cfc h ASP 118 CO 0.58 0.00 -0.01 -0.33 -1.72 0.00 0.00 179.24 177.77 1cfc h GLU 119 N 0.00 0.00 -0.94 3.56 3.07 -2.00 -2.79 114.58 115.48 1cfc h GLU 119 Ca 0.02 -0.00 0.16 0.00 -0.50 0.00 0.00 59.36 59.04 1cfc h GLU 119 Cb 0.82 0.00 -0.08 0.00 -0.84 0.00 0.00 28.75 28.65 1cfc h GLU 119 CO -0.00 0.79 0.60 0.93 -1.40 0.00 0.00 179.01 179.93 1cfc h GLU 120 N -0.78 0.68 -0.23 2.33 5.08 -1.61 -0.16 114.58 119.88 1cfc h GLU 120 Ca -0.00 -0.04 -0.16 0.00 -1.00 0.00 0.00 59.36 58.16 1cfc h GLU 120 Cb 0.79 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.88 1cfc h GLU 120 CO 0.00 0.45 -0.51 0.28 -1.00 0.00 0.00 179.01 178.23 1cfc h VAL 121 N 0.70 1.30 -0.88 3.13 2.07 -1.57 -2.89 116.25 118.11 1cfc h VAL 121 Ca 0.50 -1.73 0.19 0.00 0.82 0.00 0.00 66.70 66.48 1cfc h VAL 121 Cb 0.83 1.67 -0.07 0.00 -1.52 0.00 0.00 31.29 32.20 1cfc h VAL 121 CO -0.26 0.55 0.58 0.44 0.02 0.00 0.00 177.57 178.90 1cfc h ASP 122 N 0.51 0.45 -0.09 0.57 5.19 -0.73 0.28 116.42 122.60 1cfc h ASP 122 Ca 0.02 0.04 -0.09 0.00 -0.62 0.00 0.00 57.03 56.38 1cfc h ASP 122 Cb 1.07 -0.04 0.00 0.00 0.18 0.00 0.00 39.33 40.53 1cfc h ASP 122 CO 0.10 0.19 -0.29 -0.08 -3.12 0.00 0.00 179.24 176.04 1cfc h GLU 123 N 0.45 0.35 -0.09 3.56 4.81 -1.39 -2.44 114.58 119.84 1cfc h GLU 123 Ca 0.46 -0.26 0.02 0.00 -0.13 0.00 0.00 59.36 59.45 1cfc h GLU 123 Cb 1.06 0.05 -0.00 0.00 0.63 0.00 0.00 28.75 30.48 1cfc h GLU 123 CO -0.18 0.89 0.07 0.52 -0.73 0.00 0.00 179.01 179.58 1cfc h MET 124 N -0.11 0.00 0.00 1.92 2.86 -0.74 -0.44 114.93 118.42 1cfc h MET 124 Ca -0.01 0.00 -0.18 0.00 -2.06 0.00 0.00 59.70 57.45 1cfc h MET 124 Cb 0.92 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.56 1cfc h MET 124 CO 0.06 0.00 -0.85 0.82 1.06 0.00 0.00 176.91 178.00 1cfc h ILE 125 N 0.00 1.55 0.15 -1.22 2.04 -0.39 -2.86 117.51 116.78 1cfc h ILE 125 Ca 0.04 -2.99 -0.01 0.00 1.00 0.00 0.00 64.86 62.91 1cfc h ILE 125 Cb 0.18 2.64 0.00 0.00 -0.74 0.00 0.00 36.82 38.90 1cfc h ILE 125 CO -0.00 0.84 -0.07 0.03 0.00 0.00 0.00 178.15 178.95 1cfc h ARG 126 N 0.00 -0.19 0.00 2.37 2.47 -0.58 -2.80 114.38 115.65 1cfc h ARG 126 Ca -0.01 0.01 0.00 0.00 -1.26 0.00 0.00 59.98 58.72 1cfc h ARG 126 Cb 1.57 0.04 0.00 0.00 -1.65 0.00 0.00 29.97 29.93 1cfc h ARG 126 CO 0.11 -0.12 0.00 0.93 0.56 0.00 0.00 179.97 181.45 1cfc h GLU 127 N -0.21 0.00 -4.25 0.04 5.08 -1.65 -3.36 114.58 110.23 1cfc h GLU 127 Ca -0.02 0.00 -0.75 0.00 -1.00 0.00 0.00 59.36 57.59 1cfc h GLU 127 Cb 0.16 0.00 -0.18 0.00 0.50 0.00 0.00 28.75 29.23 1cfc h GLU 127 CO 0.03 0.00 1.46 0.00 -1.00 0.00 0.00 179.01 179.51 1cfc n ALA 128 N -2.03 4.37 -1.04 3.43 0.00 -1.06 -4.90 120.51 119.28 1cfc n ALA 128 Ca 0.04 -4.32 -0.04 0.00 0.00 0.00 0.00 53.44 49.13 1cfc n ALA 128 Cb 0.50 -2.97 -0.04 0.00 0.00 0.00 0.00 19.45 16.94 1cfc n ALA 128 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1cfc n ASP 129 N 4.77 -1.81 -0.09 0.00 2.03 -1.26 -4.57 116.55 115.63 1cfc n ASP 129 Ca 0.36 -1.19 0.14 0.00 0.52 0.00 0.00 54.79 54.63 1cfc n ASP 129 Cb 0.40 -0.56 0.78 0.00 -0.72 0.00 0.00 41.12 41.03 1cfc n ASP 129 CO 0.00 0.00 0.00 -0.38 -1.92 0.00 0.00 177.20 174.90 1cfc n ILE 130 N 4.45 0.01 -2.63 5.18 5.41 -1.26 -4.78 119.36 125.74 1cfc n ILE 130 Ca 0.12 -0.05 0.00 0.00 1.00 0.00 0.00 62.75 63.82 1cfc n ILE 130 Cb 0.41 -0.29 0.00 0.00 -0.71 0.00 0.00 39.64 39.05 1cfc n ILE 130 CO 0.00 0.00 0.00 -0.67 0.00 0.00 0.00 176.55 175.88 1cfc n ASP 131 N -0.74 1.28 0.00 4.38 2.03 -1.26 -4.19 116.55 118.04 1cfc n ASP 131 Ca 0.21 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.52 1cfc n ASP 131 Cb 0.14 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.54 1cfc n ASP 131 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1cfc n GLY 132 N 5.00 1.22 0.00 0.27 0.00 -1.26 -4.35 105.19 106.07 1cfc n GLY 132 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1cfc n GLY 132 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1cfc n ASP 133 N 0.45 0.00 0.00 1.61 8.00 -1.26 -5.09 116.55 120.27 1cfc n ASP 133 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.50 1cfc n ASP 133 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.10 1cfc n ASP 133 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1cfc n GLY 134 N 3.37 0.93 3.30 0.44 0.00 -1.26 -5.13 105.19 106.85 1cfc n GLY 134 Ca 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.77 1cfc n GLY 134 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1cfc s GLN 135 N 0.00 1.17 0.01 1.61 -0.21 -1.26 -4.02 119.66 116.96 1cfc s GLN 135 Ca 0.00 -1.20 -0.02 0.00 0.02 0.00 0.00 55.36 54.16 1cfc s GLN 135 Cb 0.00 -1.46 -0.01 0.00 1.00 0.00 0.00 33.01 32.53 1cfc s GLN 135 CO 0.00 0.34 0.02 0.08 -2.12 0.00 0.00 175.29 173.61 1cfc s VAL 136 N -1.17 0.10 0.88 1.09 1.01 -0.96 -4.95 120.40 116.40 1cfc s VAL 136 Ca 0.08 -0.83 -0.13 0.00 0.00 0.00 0.00 61.98 61.09 1cfc s VAL 136 Cb -0.10 -0.31 0.15 0.00 0.00 0.00 0.00 36.38 36.12 1cfc s VAL 136 CO 0.05 -0.46 1.24 0.21 0.00 0.00 0.00 175.10 176.13 1cfc s ASN 137 N -1.42 3.76 -0.13 3.32 3.84 -1.26 -2.93 114.94 120.12 1cfc s ASN 137 Ca -0.15 0.41 0.13 0.00 0.21 0.00 0.00 52.86 53.45 1cfc s ASN 137 Cb -0.09 -0.66 -0.18 0.00 -0.55 0.00 0.00 41.25 39.77 1cfc s ASN 137 CO -0.00 -2.33 0.06 0.00 -2.79 0.00 0.00 177.10 172.04 1cfc n TYR 138 N -3.51 0.00 -0.33 0.43 4.11 -1.26 -4.53 117.16 112.07 1cfc n TYR 138 Ca 0.12 0.00 0.23 0.00 -0.00 0.00 0.00 57.90 58.25 1cfc n TYR 138 Cb 0.60 -0.67 0.44 0.00 -0.00 0.00 0.00 39.34 39.71 1cfc n TYR 138 CO 0.00 0.00 0.00 0.39 -0.00 0.00 0.00 176.86 177.25 1cfc n GLU 139 N -2.49 -0.07 -0.10 -3.48 1.02 -1.26 0.15 120.64 114.41 1cfc n GLU 139 Ca -0.22 1.42 -0.13 0.00 -0.02 0.00 0.00 57.16 58.21 1cfc n GLU 139 Cb 0.92 -2.39 -0.04 0.00 -0.02 0.00 0.00 31.44 29.91 1cfc n GLU 139 CO 0.00 0.00 0.00 1.49 1.18 0.00 0.00 177.13 179.80 1cfc h GLU 140 N 0.00 0.75 0.00 3.49 4.81 -2.01 -2.85 114.58 118.76 1cfc h GLU 140 Ca 0.72 -0.40 -0.04 0.00 -0.13 0.00 0.00 59.36 59.51 1cfc h GLU 140 Cb 1.73 0.02 -0.01 0.00 0.63 0.00 0.00 28.75 31.12 1cfc h GLU 140 CO -0.84 1.03 -0.18 0.74 -0.73 0.00 0.00 179.01 179.03 1cfc h PHE 141 N 0.51 0.00 -0.21 0.92 0.04 0.11 -3.03 116.94 115.28 1cfc h PHE 141 Ca 0.05 0.00 -0.11 0.00 2.80 0.00 0.00 57.97 60.71 1cfc h PHE 141 Cb 0.90 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 39.04 1cfc h PHE 141 CO 0.07 0.18 -0.30 0.28 -0.60 0.00 0.00 178.31 177.94 1cfc h VAL 142 N 0.00 1.33 -0.34 -0.55 2.07 0.90 -2.59 116.25 117.07 1cfc h VAL 142 Ca -0.00 -1.50 -0.05 0.00 0.82 0.00 0.00 66.70 65.97 1cfc h VAL 142 Cb 0.73 1.79 -0.02 0.00 -1.52 0.00 0.00 31.29 32.28 1cfc h VAL 142 CO 0.02 0.46 0.01 1.56 0.02 0.00 0.00 177.57 179.64 1cfc h GLN 143 N 0.25 0.53 -0.29 1.57 1.08 -1.41 -2.75 115.11 114.10 1cfc h GLN 143 Ca 0.02 -0.11 -0.18 0.00 -1.45 0.00 0.00 58.65 56.94 1cfc h GLN 143 Cb 0.87 -0.08 0.00 0.00 -0.05 0.00 0.00 27.48 28.23 1cfc h GLN 143 CO 0.07 0.55 -0.51 0.52 -0.95 0.00 0.00 178.83 178.51 1cfc h MET 144 N 0.51 0.85 0.00 1.46 2.86 -1.47 -2.47 114.93 116.67 1cfc h MET 144 Ca 0.11 -0.53 -0.00 0.00 -2.06 0.00 0.00 59.70 57.22 1cfc h MET 144 Cb 0.32 0.06 -0.00 0.00 0.06 0.00 0.00 31.60 32.04 1cfc h MET 144 CO 0.01 1.16 -0.02 0.52 1.06 0.00 0.00 176.91 179.64 1cfc h MET 145 N 0.63 0.00 0.00 1.72 2.86 -1.19 -3.26 114.93 115.68 1cfc h MET 145 Ca 0.02 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.66 1cfc h MET 145 Cb 1.11 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.77 1cfc h MET 145 CO 0.11 0.02 0.00 0.25 1.06 0.00 0.00 176.91 178.35 1cfc n THR 146 N -3.20 0.00 -3.16 2.22 -2.24 -1.05 -5.02 114.28 101.83 1cfc n THR 146 Ca -0.02 0.43 0.05 0.00 -2.27 0.00 0.00 64.05 62.24 1cfc n THR 146 Cb 0.18 -1.31 -0.03 0.00 -2.10 0.00 0.00 70.33 67.06 1cfc n THR 146 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1cfc s ALA 147 N -3.15 -3.60 0.00 6.98 0.00 -0.96 -4.71 121.76 116.32 1cfc s ALA 147 Ca 0.00 1.55 0.00 0.00 0.00 0.00 0.00 51.96 53.51 1cfc s ALA 147 Cb 0.00 -2.45 0.00 0.00 0.00 0.00 0.00 23.12 20.67 1cfc s ALA 147 CO 0.00 -1.21 0.00 1.63 0.00 0.00 0.00 175.76 176.18