#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 1.10 -4.78 0.00 9.92 -1.26 -4.86 116.55 116.66 1cfc n ASP 2 Ca 0.00 -2.05 -0.36 0.00 -0.53 0.00 0.00 54.79 51.85 1cfc n ASP 2 Cb 0.00 -0.40 -0.03 0.00 -0.64 0.00 0.00 41.12 40.05 1cfc n ASP 2 CO 0.00 0.00 0.00 -1.10 0.13 0.00 0.00 177.20 176.23 1cfc s GLN 3 N -1.32 3.89 -0.02 -1.24 -0.21 -1.26 -4.85 119.66 114.65 1cfc s GLN 3 Ca 0.04 1.51 -0.30 0.00 0.02 0.00 0.00 55.36 56.63 1cfc s GLN 3 Cb 0.03 -2.31 -0.06 0.00 1.00 0.00 0.00 33.01 31.68 1cfc s GLN 3 CO 0.02 -0.38 1.51 -0.51 -2.12 0.00 0.00 175.29 173.80 1cfc s LEU 4 N -3.12 4.31 0.70 2.90 1.43 -1.26 -4.99 118.68 118.65 1cfc s LEU 4 Ca 0.64 2.18 -0.11 0.00 -1.03 0.00 0.00 54.13 55.81 1cfc s LEU 4 Cb -0.21 -3.55 0.01 0.00 0.03 0.00 0.00 46.19 42.47 1cfc s LEU 4 CO 0.26 -0.82 1.06 0.42 0.23 0.00 0.00 176.35 177.50 1cfc s THR 5 N 3.03 4.03 0.53 5.49 -4.23 -1.26 -4.86 115.64 118.37 1cfc s THR 5 Ca 0.68 0.66 0.21 0.00 -1.18 0.00 0.00 61.69 62.06 1cfc s THR 5 Cb -0.33 -3.41 0.33 0.00 1.34 0.00 0.00 72.50 70.43 1cfc s THR 5 CO 0.27 -0.86 2.10 -0.33 -0.54 0.00 0.00 174.62 175.26 1cfc h GLU 6 N -0.71 0.00 0.11 3.99 5.08 -1.96 -2.12 114.58 118.96 1cfc h GLU 6 Ca -0.44 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 57.92 1cfc h GLU 6 Cb 1.21 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.46 1cfc h GLU 6 CO 0.57 0.00 -0.05 0.93 -1.00 0.00 0.00 179.01 179.46 1cfc h GLU 7 N 0.00 -0.14 -0.98 2.33 4.39 -1.90 -2.64 114.58 115.63 1cfc h GLU 7 Ca 0.09 0.01 0.22 0.00 0.34 0.00 0.00 59.36 60.03 1cfc h GLU 7 Cb 0.39 0.03 -0.09 0.00 -0.10 0.00 0.00 28.75 28.98 1cfc h GLU 7 CO -0.00 0.35 0.63 1.96 -1.16 0.00 0.00 179.01 180.79 1cfc h GLN 8 N -0.80 0.48 -0.31 2.33 4.20 -1.80 0.66 115.11 119.88 1cfc h GLN 8 Ca -0.02 -0.03 -0.10 0.00 0.06 0.00 0.00 58.65 58.57 1cfc h GLN 8 Cb 0.56 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 28.22 1cfc h GLN 8 CO 0.02 0.32 -0.23 0.82 -0.67 0.00 0.00 178.83 179.10 1cfc h ILE 9 N 0.50 1.27 -0.05 2.54 2.04 -1.36 -2.59 117.51 119.86 1cfc h ILE 9 Ca 0.55 -1.27 -0.07 0.00 1.00 0.00 0.00 64.86 65.07 1cfc h ILE 9 Cb 1.23 1.28 0.00 0.00 -0.74 0.00 0.00 36.82 38.59 1cfc h ILE 9 CO -0.28 0.41 -0.25 0.00 0.00 0.00 0.00 178.15 178.03 1cfc h ALA 10 N 1.23 0.10 -0.64 1.87 0.00 0.55 -2.03 119.26 120.33 1cfc h ALA 10 Ca 0.08 -0.42 0.13 0.00 0.00 0.00 0.00 54.91 54.70 1cfc h ALA 10 Cb 0.67 -0.00 -0.10 0.00 0.00 0.00 0.00 17.79 18.36 1cfc h ALA 10 CO 0.05 0.11 0.08 1.49 0.00 0.00 0.00 179.25 180.97 1cfc h GLU 11 N -0.28 0.18 0.00 0.00 4.81 -0.57 0.50 114.58 119.21 1cfc h GLU 11 Ca -0.02 -0.01 -0.09 0.00 -0.13 0.00 0.00 59.36 59.11 1cfc h GLU 11 Cb 0.91 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 30.24 1cfc h GLU 11 CO 0.05 0.12 -0.42 0.74 -0.73 0.00 0.00 179.01 178.78 1cfc h PHE 12 N 0.19 0.00 -0.46 0.92 0.04 -1.48 -2.71 116.94 113.44 1cfc h PHE 12 Ca 0.35 0.00 -0.11 0.00 2.80 0.00 0.00 57.97 61.00 1cfc h PHE 12 Cb 0.56 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.70 1cfc h PHE 12 CO -0.31 0.42 -0.16 -0.22 -0.60 0.00 0.00 178.31 177.43 1cfc h LYS 13 N 0.00 0.92 -0.34 1.51 3.64 0.66 0.82 116.57 123.78 1cfc h LYS 13 Ca -0.00 -0.38 -0.03 0.00 -1.27 0.00 0.00 60.65 58.97 1cfc h LYS 13 Cb 0.79 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.55 1cfc h LYS 13 CO 0.05 1.03 0.11 0.93 -2.27 0.00 0.00 179.45 179.30 1cfc h GLU 14 N 0.75 0.53 -0.03 1.90 5.08 -0.76 -0.86 114.58 121.20 1cfc h GLU 14 Ca 0.11 -0.12 -0.07 0.00 -1.00 0.00 0.00 59.36 58.28 1cfc h GLU 14 Cb 0.73 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.89 1cfc h GLU 14 CO 0.06 0.56 -0.30 0.00 -1.00 0.00 0.00 179.01 178.33 1cfc h ALA 15 N 0.95 1.44 -0.09 3.43 0.00 -1.36 -2.44 119.26 121.19 1cfc h ALA 15 Ca 0.11 -0.29 -0.19 0.00 0.00 0.00 0.00 54.91 54.54 1cfc h ALA 15 Cb 0.25 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 17.98 1cfc h ALA 15 CO -0.00 0.41 -0.74 0.35 0.00 0.00 0.00 179.25 179.26 1cfc h PHE 16 N 0.05 0.63 -0.06 0.00 3.04 -0.33 -3.20 116.94 117.07 1cfc h PHE 16 Ca 0.01 -0.28 -0.16 0.00 3.98 0.00 0.00 57.97 61.52 1cfc h PHE 16 Cb 0.56 -0.10 -0.01 0.00 2.56 0.00 0.00 35.95 38.96 1cfc h PHE 16 CO 0.00 1.05 -0.65 0.66 -2.02 0.00 0.00 178.31 177.35 1cfc h SER 17 N 0.32 0.27 -0.68 0.41 4.64 -0.88 -3.08 113.55 114.54 1cfc h SER 17 Ca -0.04 -0.16 0.20 0.00 -0.47 0.00 0.00 61.79 61.32 1cfc h SER 17 Cb 1.33 -0.08 -0.03 0.00 -0.31 0.00 0.00 62.40 63.32 1cfc h SER 17 CO 0.13 0.85 0.70 -0.07 -0.87 0.00 0.00 176.83 177.57 1cfc h LEU 18 N 0.16 0.00 -3.01 5.97 3.38 -1.44 0.14 115.31 120.52 1cfc h LEU 18 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1cfc h LEU 18 Cb 1.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.93 1cfc h LEU 18 CO 0.10 0.00 0.00 0.49 0.09 0.00 0.00 178.44 179.12 1cfc n PHE 19 N -3.66 0.03 -2.97 1.13 3.01 -1.17 -4.83 117.46 109.01 1cfc n PHE 19 Ca 0.14 -0.99 -0.43 0.00 1.01 0.00 0.00 57.45 57.18 1cfc n PHE 19 Cb 0.94 -0.16 0.01 0.00 -0.01 0.00 0.00 39.48 40.27 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 -1.40 6.47 -0.01 4.37 -0.08 0.50 -4.71 116.55 121.69 1cfc n ASP 20 Ca 0.16 -3.43 0.15 0.00 -1.51 0.00 0.00 54.79 50.16 1cfc n ASP 20 Cb 0.65 -1.27 0.86 0.00 2.34 0.00 0.00 41.12 43.70 1cfc n ASP 20 CO 0.00 0.00 0.00 0.29 0.12 0.00 0.00 177.20 177.61 1cfc n LYS 21 N 1.29 1.01 -0.14 -0.67 4.76 -1.26 -3.08 118.16 120.06 1cfc n LYS 21 Ca 0.27 -0.01 0.12 0.00 -2.87 0.00 0.00 58.31 55.82 1cfc n LYS 21 Cb 0.33 -1.46 0.20 0.00 -1.84 0.00 0.00 35.03 32.26 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 -0.94 3.31 -1.07 4.39 9.92 -1.26 -4.91 116.55 125.99 1cfc n ASP 22 Ca 0.22 -1.99 -0.08 0.00 -0.53 0.00 0.00 54.79 52.41 1cfc n ASP 22 Cb 0.10 -0.19 -0.03 0.00 -0.64 0.00 0.00 41.12 40.36 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 1.47 0.77 1.00 0.44 0.00 -1.18 -4.68 105.19 103.01 1cfc n GLY 23 Ca 0.18 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.32 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 0.11 3.10 -0.96 1.61 2.03 -1.26 -4.94 116.55 116.23 1cfc n ASP 24 Ca -0.08 -2.00 -0.10 0.00 0.52 0.00 0.00 54.79 53.14 1cfc n ASP 24 Cb 0.30 -0.06 -0.02 0.00 -0.72 0.00 0.00 41.12 40.63 1cfc n ASP 24 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1cfc n GLY 25 N 1.39 0.40 3.22 0.27 0.00 -1.26 -5.01 105.19 104.19 1cfc n GLY 25 Ca 0.15 -0.53 -0.12 0.00 0.00 0.00 0.00 46.02 45.52 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 -2.43 0.28 0.10 2.61 -4.23 -1.26 -3.50 115.64 107.20 1cfc s THR 26 Ca 0.00 -1.97 -0.01 0.00 -1.18 0.00 0.00 61.69 58.53 1cfc s THR 26 Cb 0.00 -2.31 -0.04 0.00 1.34 0.00 0.00 72.50 71.49 1cfc s THR 26 CO 0.00 -0.24 0.02 0.27 -0.54 0.00 0.00 174.62 174.13 1cfc s ILE 27 N -3.94 0.15 0.64 2.99 -4.36 -0.46 -4.49 121.20 111.73 1cfc s ILE 27 Ca 0.31 -1.86 -0.06 0.00 -0.26 0.00 0.00 60.65 58.78 1cfc s ILE 27 Cb 0.07 -1.82 0.03 0.00 1.25 0.00 0.00 42.46 41.99 1cfc s ILE 27 CO 0.07 -0.68 0.94 0.42 0.24 0.00 0.00 174.94 175.94 1cfc s THR 28 N -3.99 3.04 0.33 8.37 -4.23 -1.26 -0.85 115.64 117.04 1cfc s THR 28 Ca 0.17 -0.14 0.12 0.00 -1.18 0.00 0.00 61.69 60.66 1cfc s THR 28 Cb 0.08 -3.25 0.04 0.00 1.34 0.00 0.00 72.50 70.71 1cfc s THR 28 CO -0.03 -0.25 1.73 0.71 -0.54 0.00 0.00 174.62 176.24 1cfc h THR 29 N -0.34 1.34 0.00 3.99 1.35 -1.79 -2.58 112.91 114.88 1cfc h THR 29 Ca -0.45 -1.65 -0.02 0.00 -0.55 0.00 0.00 66.41 63.74 1cfc h THR 29 Cb 1.28 1.89 -0.00 0.00 -1.73 0.00 0.00 68.15 69.59 1cfc h THR 29 CO 0.60 0.47 -0.09 0.11 -0.25 0.00 0.00 175.52 176.36 1cfc h LYS 30 N 0.00 0.00 -0.70 4.72 1.57 -1.93 -1.30 116.57 118.93 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 0.85 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.16 1cfc h LYS 30 CO 0.06 0.09 0.00 0.39 -0.57 0.00 0.00 179.45 179.42 1cfc n GLU 31 N -3.68 3.37 -0.00 3.15 1.02 -0.98 -4.44 120.64 119.08 1cfc n GLU 31 Ca -0.02 -2.82 -0.12 0.00 -0.02 0.00 0.00 57.16 54.18 1cfc n GLU 31 Cb 0.20 -1.78 -0.10 0.00 -0.02 0.00 0.00 31.44 29.74 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 4.25 -0.06 -1.90 -4.62 5.85 -1.21 -2.42 115.31 115.19 1cfc h LEU 32 Ca 0.00 -0.55 -0.03 0.00 0.84 0.00 0.00 57.88 58.14 1cfc h LEU 32 Cb 1.29 0.02 -0.00 0.00 0.37 0.00 0.00 40.66 42.33 1cfc h LEU 32 CO 0.15 0.56 -0.12 1.23 -0.34 0.00 0.00 178.44 179.92 1cfc h GLY 33 N -0.74 0.00 1.07 3.75 0.00 -1.78 -1.92 103.07 103.45 1cfc h GLY 33 Ca -0.01 0.00 -0.18 0.00 0.00 0.00 0.00 47.33 47.14 1cfc h GLY 33 CO 0.01 0.00 -0.61 -0.84 0.00 0.00 0.00 176.54 175.11 1cfc h THR 34 N 0.00 1.30 -0.32 4.70 2.02 -1.78 -0.99 112.91 117.83 1cfc h THR 34 Ca -0.00 -1.83 -0.08 0.00 0.77 0.00 0.00 66.41 65.27 1cfc h THR 34 Cb 0.33 1.92 -0.01 0.00 -1.74 0.00 0.00 68.15 68.65 1cfc h THR 34 CO 0.02 0.58 -0.10 0.58 0.37 0.00 0.00 175.52 176.96 1cfc h VAL 35 N 0.45 1.28 -0.74 3.16 2.07 -0.98 -1.87 116.25 119.62 1cfc h VAL 35 Ca -0.02 -1.17 -0.02 0.00 0.82 0.00 0.00 66.70 66.31 1cfc h VAL 35 Cb 1.23 1.37 -0.04 0.00 -1.52 0.00 0.00 31.29 32.34 1cfc h VAL 35 CO 0.13 0.38 0.38 0.24 0.02 0.00 0.00 177.57 178.72 1cfc h MET 36 N 0.41 1.04 0.00 1.57 2.86 -1.36 -1.13 114.93 118.32 1cfc h MET 36 Ca 0.08 -0.13 -0.06 0.00 -2.06 0.00 0.00 59.70 57.53 1cfc h MET 36 Cb 0.61 -0.20 -0.01 0.00 0.06 0.00 0.00 31.60 32.06 1cfc h MET 36 CO 0.04 0.79 -0.28 0.00 1.06 0.00 0.00 176.91 178.51 1cfc h ARG 37 N 1.04 0.00 -0.22 1.72 3.08 -0.91 -1.12 114.38 117.98 1cfc h ARG 37 Ca 0.26 0.00 -0.07 0.00 0.07 0.00 0.00 59.98 60.24 1cfc h ARG 37 Cb 0.07 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.10 1cfc h ARG 37 CO -0.04 0.28 -0.18 0.66 -1.07 0.00 0.00 179.97 179.62 1cfc h SER 38 N 0.00 0.37 -0.01 7.04 4.64 -0.37 -1.21 113.55 124.01 1cfc h SER 38 Ca -0.00 -0.10 0.00 0.00 -0.47 0.00 0.00 61.79 61.22 1cfc h SER 38 Cb 0.60 -0.10 0.00 0.00 -0.31 0.00 0.00 62.40 62.59 1cfc h SER 38 CO 0.04 0.57 0.00 0.18 -0.87 0.00 0.00 176.83 176.75 1cfc n LEU 39 N -4.19 0.41 0.00 5.97 4.77 -0.85 -4.86 117.00 118.25 1cfc n LEU 39 Ca -0.00 -0.14 0.00 0.00 -0.03 0.00 0.00 56.01 55.83 1cfc n LEU 39 Cb 0.34 -0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.42 1cfc n LEU 39 CO 0.40 0.07 0.00 0.61 -1.33 0.00 0.00 177.39 177.14 1cfc n GLY 40 N 1.02 0.67 3.89 -0.72 0.00 -0.46 -5.06 105.19 104.53 1cfc n GLY 40 Ca 0.21 -0.46 -0.35 0.00 0.00 0.00 0.00 46.02 45.42 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 -0.95 3.45 -0.48 1.61 -1.52 -0.48 -4.99 119.66 116.31 1cfc s GLN 41 Ca 0.00 -0.20 0.06 0.00 -1.95 0.00 0.00 55.36 53.28 1cfc s GLN 41 Cb 0.00 -3.15 0.22 0.00 -0.22 0.00 0.00 33.01 29.86 1cfc s GLN 41 CO 0.00 0.73 0.51 -1.71 -0.25 0.00 0.00 175.29 174.57 1cfc n ASN 42 N 1.54 0.96 -4.78 5.90 4.05 -1.26 -3.32 115.26 118.34 1cfc n ASN 42 Ca -0.16 -2.80 -0.35 0.00 0.45 0.00 0.00 54.58 51.72 1cfc n ASN 42 Cb 0.54 -0.63 -0.03 0.00 1.23 0.00 0.00 39.78 40.89 1cfc n ASN 42 CO 0.00 0.00 0.00 -2.16 -3.05 0.00 0.00 177.26 172.05 1cfc s PRO 43 N -1.09 3.83 1.00 1.20 0.04 -1.26 -5.02 135.00 133.70 1cfc s PRO 43 Ca 0.34 1.52 -0.12 0.00 0.04 0.00 0.00 61.00 62.78 1cfc s PRO 43 Cb 0.10 -2.26 0.19 0.00 0.04 0.00 0.00 34.50 32.57 1cfc s PRO 43 CO -0.13 -0.44 1.09 0.95 0.04 0.00 0.00 177.00 178.52 1cfc s THR 44 N -1.78 2.04 0.24 1.26 -4.23 -1.26 -4.81 115.64 107.11 1cfc s THR 44 Ca 0.65 0.01 -0.04 0.00 -1.18 0.00 0.00 61.69 61.13 1cfc s THR 44 Cb -0.21 -2.51 0.12 0.00 1.34 0.00 0.00 72.50 71.24 1cfc s THR 44 CO 0.26 -0.02 1.76 -0.33 -0.54 0.00 0.00 174.62 175.75 1cfc h GLU 45 N -1.91 0.93 -0.53 3.99 5.08 -1.99 -2.05 114.58 118.10 1cfc h GLU 45 Ca -0.55 -0.23 -0.12 0.00 -1.00 0.00 0.00 59.36 57.47 1cfc h GLU 45 Cb 1.33 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 30.44 1cfc h GLU 45 CO 0.58 0.87 -0.13 0.00 -1.00 0.00 0.00 179.01 179.33 1cfc h ALA 46 N 1.21 0.78 -0.92 3.43 0.00 -1.98 0.20 119.26 121.98 1cfc h ALA 46 Ca 0.18 -0.36 0.01 0.00 0.00 0.00 0.00 54.91 54.74 1cfc h ALA 46 Cb 0.39 -0.19 -0.05 0.00 0.00 0.00 0.00 17.79 17.95 1cfc h ALA 46 CO 0.01 0.67 0.61 0.93 0.00 0.00 0.00 179.25 181.47 1cfc h GLU 47 N 0.89 1.21 -0.09 0.00 5.08 -1.82 0.59 114.58 120.45 1cfc h GLU 47 Ca 0.14 -0.07 -0.05 0.00 -1.00 0.00 0.00 59.36 58.37 1cfc h GLU 47 Cb 0.69 -0.27 -0.00 0.00 0.50 0.00 0.00 28.75 29.67 1cfc h GLU 47 CO 0.05 0.80 -0.13 -0.07 -1.00 0.00 0.00 179.01 178.66 1cfc h LEU 48 N 1.25 0.27 -2.22 1.33 3.38 -0.86 -2.98 115.31 115.48 1cfc h LEU 48 Ca 0.34 -0.53 -0.01 0.00 0.09 0.00 0.00 57.88 57.77 1cfc h LEU 48 Cb -0.15 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 40.53 1cfc h LEU 48 CO -0.07 0.74 -0.05 1.56 0.09 0.00 0.00 178.44 180.71 1cfc h GLN 49 N -0.20 0.00 -0.02 1.13 4.20 -0.17 -1.24 115.11 118.81 1cfc h GLN 49 Ca 0.01 0.00 -0.04 0.00 0.06 0.00 0.00 58.65 58.68 1cfc h GLN 49 Cb 0.68 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.47 1cfc h GLN 49 CO 0.03 0.05 -0.14 -0.44 -0.67 0.00 0.00 178.83 177.66 1cfc h ASP 50 N 0.00 0.16 0.05 1.46 3.32 -0.79 -2.08 116.42 118.53 1cfc h ASP 50 Ca -0.00 -0.70 -0.09 0.00 0.02 0.00 0.00 57.03 56.26 1cfc h ASP 50 Cb 0.22 -0.05 -0.01 0.00 0.22 0.00 0.00 39.33 39.71 1cfc h ASP 50 CO 0.01 0.83 -0.27 0.24 -1.72 0.00 0.00 179.24 178.33 1cfc h MET 51 N -0.51 0.36 -0.53 3.56 2.86 -1.35 -2.71 114.93 116.61 1cfc h MET 51 Ca -0.01 -0.13 -0.05 0.00 -2.06 0.00 0.00 59.70 57.44 1cfc h MET 51 Cb 0.84 -0.02 -0.02 0.00 0.06 0.00 0.00 31.60 32.46 1cfc h MET 51 CO 0.03 0.61 0.13 0.82 1.06 0.00 0.00 176.91 179.56 1cfc h ILE 52 N 0.32 1.24 -0.58 -1.22 2.04 -1.23 -0.24 117.51 117.84 1cfc h ILE 52 Ca 0.05 -0.86 0.08 0.00 1.00 0.00 0.00 64.86 65.12 1cfc h ILE 52 Cb 0.65 0.78 -0.03 0.00 -0.74 0.00 0.00 36.82 37.48 1cfc h ILE 52 CO 0.05 0.31 0.39 -1.13 0.00 0.00 0.00 178.15 177.77 1cfc h ASN 53 N 0.75 0.43 0.17 1.72 -0.73 -1.04 1.27 115.58 118.15 1cfc h ASN 53 Ca 0.17 0.00 -0.24 0.00 1.87 0.00 0.00 56.30 58.10 1cfc h ASN 53 Cb 0.33 -0.09 0.02 0.00 0.27 0.00 0.00 38.32 38.86 1cfc h ASN 53 CO 0.00 0.27 -1.08 -0.33 -0.37 0.00 0.00 177.43 175.92 1cfc h GLU 54 N 0.48 0.37 0.00 6.67 5.08 -1.35 -3.32 114.58 122.51 1cfc h GLU 54 Ca 0.26 -0.63 -0.09 0.00 -1.00 0.00 0.00 59.36 57.90 1cfc h GLU 54 Cb 0.39 0.23 -0.01 0.00 0.50 0.00 0.00 28.75 29.86 1cfc h GLU 54 CO -0.07 1.30 -0.44 0.28 -1.00 0.00 0.00 179.01 179.07 1cfc h VAL 55 N -0.21 0.86 0.00 3.13 2.07 -0.53 -3.12 116.25 118.46 1cfc h VAL 55 Ca -0.19 -1.89 0.00 0.00 0.82 0.00 0.00 66.70 65.44 1cfc h VAL 55 Cb 1.82 2.19 0.00 0.00 -1.52 0.00 0.00 31.29 33.77 1cfc h VAL 55 CO 0.18 0.43 0.00 -0.67 0.02 0.00 0.00 177.57 177.53 1cfc n ASP 56 N -3.36 3.76 0.13 0.57 2.03 0.43 -3.78 116.55 116.33 1cfc n ASP 56 Ca 0.01 -2.12 0.02 0.00 0.52 0.00 0.00 54.79 53.21 1cfc n ASP 56 Cb 0.63 -0.71 0.01 0.00 -0.72 0.00 0.00 41.12 40.33 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 1.67 0.64 0.00 -1.67 0.00 -1.71 -3.06 119.26 115.14 1cfc h ALA 57 Ca 0.00 -0.50 0.00 0.00 0.00 0.00 0.00 54.91 54.41 1cfc h ALA 57 Cb 0.99 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.70 1cfc h ALA 57 CO 0.00 0.69 0.00 0.22 0.00 0.00 0.00 179.25 180.16 1cfc h ASP 58 N 0.00 0.00 -0.25 0.00 1.82 -1.88 -3.47 116.42 112.64 1cfc h ASP 58 Ca -0.01 0.00 -0.09 0.00 -0.39 0.00 0.00 57.03 56.55 1cfc h ASP 58 Cb 1.42 0.00 -0.03 0.00 0.68 0.00 0.00 39.33 41.40 1cfc h ASP 58 CO 0.07 0.00 -0.08 0.61 -1.61 0.00 0.00 179.24 178.23 1cfc n GLY 59 N 1.13 0.65 1.01 -0.78 0.00 -1.16 -4.90 105.19 101.15 1cfc n GLY 59 Ca 0.04 -0.86 0.12 0.00 0.00 0.00 0.00 46.02 45.33 1cfc n GLY 59 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1cfc n ASN 60 N 1.29 3.12 -2.38 1.61 2.04 -1.26 -4.94 115.26 114.74 1cfc n ASN 60 Ca -0.04 -1.99 -0.04 0.00 -0.44 0.00 0.00 54.58 52.07 1cfc n ASN 60 Cb 0.18 -0.08 -0.00 0.00 -2.53 0.00 0.00 39.78 37.36 1cfc n ASN 60 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 1cfc n GLY 61 N 1.40 -0.44 3.33 4.83 0.00 -1.26 -4.88 105.19 108.17 1cfc n GLY 61 Ca 0.16 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 46.01 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 -2.14 0.63 -0.01 2.61 -4.23 -1.26 -2.31 115.64 108.94 1cfc s THR 62 Ca 0.00 -2.00 -0.00 0.00 -1.18 0.00 0.00 61.69 58.51 1cfc s THR 62 Cb 0.00 -2.63 0.01 0.00 1.34 0.00 0.00 72.50 71.23 1cfc s THR 62 CO 0.00 -0.03 0.02 -0.63 -0.54 0.00 0.00 174.62 173.44 1cfc s ILE 63 N -3.70 -0.02 0.35 2.99 1.01 -0.03 -4.85 121.20 116.95 1cfc s ILE 63 Ca 0.37 0.08 0.07 0.00 0.00 0.00 0.00 60.65 61.17 1cfc s ILE 63 Cb 0.08 -0.05 -0.00 0.00 0.01 0.00 0.00 42.46 42.50 1cfc s ILE 63 CO 0.13 0.03 0.49 1.51 0.00 0.00 0.00 174.94 177.11 1cfc s ASP 64 N 0.40 5.90 0.19 3.58 1.47 -1.26 -1.35 116.67 125.60 1cfc s ASP 64 Ca -0.03 -0.23 -0.12 0.00 1.18 0.00 0.00 52.55 53.34 1cfc s ASP 64 Cb -0.05 -1.11 0.10 0.00 -0.34 0.00 0.00 42.92 41.53 1cfc s ASP 64 CO -0.01 -0.51 1.83 0.15 0.68 0.00 0.00 175.17 177.31 1cfc h PHE 65 N 0.83 0.82 -0.04 2.11 3.57 -1.97 -1.21 116.94 121.06 1cfc h PHE 65 Ca -0.44 0.00 0.03 0.00 3.53 0.00 0.00 57.97 61.09 1cfc h PHE 65 Cb 1.26 -0.27 -0.04 0.00 2.79 0.00 0.00 35.95 39.69 1cfc h PHE 65 CO 0.42 0.55 -0.20 -1.35 -2.23 0.00 0.00 178.31 175.50 1cfc h PRO 66 N 0.85 -0.29 -0.14 6.41 0.11 -1.96 0.16 132.00 137.16 1cfc h PRO 66 Ca 0.23 0.02 -0.00 0.00 0.11 0.00 0.00 66.00 66.36 1cfc h PRO 66 Cb -0.04 0.07 -0.01 0.00 0.11 0.00 0.00 31.00 31.13 1cfc h PRO 66 CO -0.04 -0.19 0.08 0.93 -0.21 0.00 0.00 178.00 178.56 1cfc h GLU 67 N -0.30 0.18 -0.46 1.05 5.08 -1.93 0.25 114.58 118.45 1cfc h GLU 67 Ca 0.07 -0.01 -0.08 0.00 -1.00 0.00 0.00 59.36 58.34 1cfc h GLU 67 Cb 0.39 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.58 1cfc h GLU 67 CO -0.21 0.13 -0.04 0.35 -1.00 0.00 0.00 179.01 178.24 1cfc h PHE 68 N 0.19 0.84 0.00 4.33 3.57 0.42 -1.00 116.94 125.28 1cfc h PHE 68 Ca 0.05 -0.13 -0.03 0.00 3.53 0.00 0.00 57.97 61.39 1cfc h PHE 68 Cb 0.00 -0.22 -0.00 0.00 2.79 0.00 0.00 35.95 38.51 1cfc h PHE 68 CO 0.00 0.80 -0.14 -0.07 -2.23 0.00 0.00 178.31 176.66 1cfc h LEU 69 N 0.72 0.00 -0.17 0.59 3.38 0.13 -1.48 115.31 118.49 1cfc h LEU 69 Ca 0.13 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.08 1cfc h LEU 69 Cb 0.50 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.25 1cfc h LEU 69 CO 0.03 0.14 -0.13 0.74 0.09 0.00 0.00 178.44 179.31 1cfc h THR 70 N 0.00 0.23 0.04 0.22 2.02 -0.66 -2.65 112.91 112.11 1cfc h THR 70 Ca -0.00 -1.26 -0.12 0.00 0.77 0.00 0.00 66.41 65.80 1cfc h THR 70 Cb 0.44 2.05 0.01 0.00 -1.74 0.00 0.00 68.15 68.92 1cfc h THR 70 CO 0.02 0.13 -0.48 0.24 0.37 0.00 0.00 175.52 175.79 1cfc h MET 71 N 0.00 0.25 -0.15 6.66 2.86 -0.77 -2.86 114.93 120.93 1cfc h MET 71 Ca -0.00 -0.33 -0.09 0.00 -2.06 0.00 0.00 59.70 57.22 1cfc h MET 71 Cb 1.04 0.11 -0.01 0.00 0.06 0.00 0.00 31.60 32.80 1cfc h MET 71 CO 0.02 1.08 -0.31 0.52 1.06 0.00 0.00 176.91 179.28 1cfc h MET 72 N -0.42 0.29 -0.11 1.72 2.07 -1.56 -2.55 114.93 114.38 1cfc h MET 72 Ca -0.07 -0.11 -0.10 0.00 -2.07 0.00 0.00 59.70 57.34 1cfc h MET 72 Cb 1.28 -0.02 -0.01 0.00 -1.87 0.00 0.00 31.60 30.98 1cfc h MET 72 CO 0.09 0.58 -0.38 0.00 1.07 0.00 0.00 176.91 178.27 1cfc h ALA 73 N 1.43 1.16 -0.32 6.32 0.00 -1.53 0.90 119.26 127.22 1cfc h ALA 73 Ca 0.04 -0.39 -0.09 0.00 0.00 0.00 0.00 54.91 54.47 1cfc h ALA 73 Cb 0.67 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 1cfc h ALA 73 CO 0.05 0.56 -0.17 0.00 0.00 0.00 0.00 179.25 179.69 1cfc h ARG 74 N 0.20 0.58 0.07 0.00 2.47 -1.21 -2.34 114.38 114.14 1cfc h ARG 74 Ca 0.02 -0.19 -0.00 0.00 -1.26 0.00 0.00 59.98 58.54 1cfc h ARG 74 Cb 0.76 -0.05 0.00 0.00 -1.65 0.00 0.00 29.97 29.03 1cfc h ARG 74 CO 0.06 0.72 -0.03 0.87 0.56 0.00 0.00 179.97 182.15 1cfc h LYS 75 N 0.52 -0.09 -1.22 0.04 1.57 -1.30 -3.38 116.57 112.71 1cfc h LYS 75 Ca 0.09 0.01 -0.37 0.00 -1.87 0.00 0.00 60.65 58.50 1cfc h LYS 75 Cb 0.59 0.02 -0.18 0.00 0.08 0.00 0.00 32.23 32.74 1cfc h LYS 75 CO 0.04 0.35 0.48 -1.33 -0.57 0.00 0.00 179.45 178.42 1cfc n MET 76 N -4.79 1.92 0.00 3.15 2.81 0.27 -4.55 117.12 115.93 1cfc n MET 76 Ca -0.06 -1.94 0.00 0.00 -1.81 0.00 0.00 57.70 53.89 1cfc n MET 76 Cb 0.23 -1.76 0.00 0.00 -0.71 0.00 0.00 33.22 30.98 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 -0.22 0.00 0.00 0.03 5.02 -0.88 -3.92 118.16 118.19 1cfc n LYS 77 Ca 0.38 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.67 1cfc n LYS 77 Cb 0.87 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.88 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 -2.46 4.39 2.03 -1.26 -0.92 116.55 118.33 1cfc n ASP 78 Ca 0.00 0.20 -0.19 0.00 0.52 0.00 0.00 54.79 55.32 1cfc n ASP 78 Cb 0.00 -0.20 0.02 0.00 -0.72 0.00 0.00 41.12 40.21 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 -1.14 1.97 -0.87 5.18 5.66 -1.26 -5.09 114.28 118.73 1cfc n THR 79 Ca 0.00 -4.12 -0.36 0.00 -3.05 0.00 0.00 64.05 56.52 1cfc n THR 79 Cb 0.13 -0.51 0.09 0.00 -1.55 0.00 0.00 70.33 68.49 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 -0.45 -3.15 0.19 1.09 -0.08 -0.10 -4.72 116.55 109.32 1cfc n ASP 80 Ca 0.30 0.01 0.12 0.00 -1.51 0.00 0.00 54.79 53.71 1cfc n ASP 80 Cb 0.78 -0.75 0.15 0.00 2.34 0.00 0.00 41.12 43.64 1cfc n ASP 80 CO 0.00 0.00 0.00 -1.28 0.12 0.00 0.00 177.20 176.04 1cfc h SER 81 N -1.40 0.00 -0.38 1.67 0.87 -1.91 -3.17 113.55 109.24 1cfc h SER 81 Ca -0.45 -0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.11 1cfc h SER 81 Cb 1.36 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 63.30 1cfc h SER 81 CO 0.28 0.00 0.25 1.05 -0.53 0.00 0.00 176.83 177.88 1cfc h GLU 82 N 0.00 0.49 0.00 2.24 4.11 -1.95 0.24 114.58 119.71 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 0.98 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 30.12 1cfc h GLU 82 CO 0.00 0.32 0.00 0.93 0.07 0.00 0.00 179.01 180.33 1cfc h GLU 83 N 0.51 0.00 0.16 1.06 5.08 -1.88 -0.70 114.58 118.80 1cfc h GLU 83 Ca 0.14 0.00 -0.26 0.00 -1.00 0.00 0.00 59.36 58.23 1cfc h GLU 83 Cb -0.05 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.21 1cfc h GLU 83 CO -0.03 0.00 -1.26 0.93 -1.00 0.00 0.00 179.01 177.65 1cfc h GLU 84 N 0.00 0.33 -0.12 2.33 4.39 -1.12 -2.83 114.58 117.56 1cfc h GLU 84 Ca 0.00 -0.57 -0.18 0.00 0.34 0.00 0.00 59.36 58.95 1cfc h GLU 84 Cb 0.46 0.21 0.01 0.00 -0.10 0.00 0.00 28.75 29.34 1cfc h GLU 84 CO 0.00 1.27 -0.63 0.82 -1.16 0.00 0.00 179.01 179.31 1cfc h ILE 85 N -0.20 1.33 -0.71 3.13 2.04 -1.33 -2.57 117.51 119.19 1cfc h ILE 85 Ca -0.25 -1.90 -0.04 0.00 1.00 0.00 0.00 64.86 63.67 1cfc h ILE 85 Cb 1.83 2.11 -0.03 0.00 -0.74 0.00 0.00 36.82 39.99 1cfc h ILE 85 CO 0.14 0.59 0.28 -0.09 0.00 0.00 0.00 178.15 179.07 1cfc h ARG 86 N 0.31 1.07 0.00 2.37 2.43 -1.27 0.11 114.38 119.40 1cfc h ARG 86 Ca -0.04 -0.20 -0.02 0.00 -0.81 0.00 0.00 59.98 58.91 1cfc h ARG 86 Cb 1.27 -0.17 -0.00 0.00 -0.42 0.00 0.00 29.97 30.65 1cfc h ARG 86 CO 0.13 0.88 -0.09 0.93 -1.51 0.00 0.00 179.97 180.32 1cfc h GLU 87 N 1.02 0.00 0.09 0.20 4.39 -1.50 0.27 114.58 119.06 1cfc h GLU 87 Ca 0.24 0.00 -0.13 0.00 0.34 0.00 0.00 59.36 59.81 1cfc h GLU 87 Cb 0.22 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 28.88 1cfc h GLU 87 CO -0.02 0.09 -0.57 0.00 -1.16 0.00 0.00 179.01 177.35 1cfc h ALA 88 N 1.91 -0.05 -0.03 3.43 0.00 -0.78 -2.62 119.26 121.12 1cfc h ALA 88 Ca -0.00 -0.62 0.01 0.00 0.00 0.00 0.00 54.91 54.29 1cfc h ALA 88 Cb 0.45 0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.30 1cfc h ALA 88 CO 0.01 0.27 0.04 0.74 0.00 0.00 0.00 179.25 180.31 1cfc h PHE 89 N -0.50 0.00 -0.18 0.00 0.04 -0.37 0.98 116.94 116.91 1cfc h PHE 89 Ca -0.10 0.00 -0.04 0.00 2.80 0.00 0.00 57.97 60.63 1cfc h PHE 89 Cb 1.43 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 39.57 1cfc h PHE 89 CO 0.21 0.00 -0.05 -0.09 -0.60 0.00 0.00 178.31 177.78 1cfc h ARG 90 N 0.00 0.35 -0.04 1.51 2.43 -0.77 -1.17 114.38 116.70 1cfc h ARG 90 Ca 0.02 -0.14 0.01 0.00 -0.81 0.00 0.00 59.98 59.06 1cfc h ARG 90 Cb 0.10 -0.02 -0.00 0.00 -0.42 0.00 0.00 29.97 29.63 1cfc h ARG 90 CO -0.00 0.63 0.33 0.28 -1.51 0.00 0.00 179.97 179.70 1cfc h VAL 91 N 0.06 0.05 -0.00 0.20 2.07 -0.44 0.30 116.25 118.48 1cfc h VAL 91 Ca 0.04 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.56 1cfc h VAL 91 Cb 0.50 0.68 0.00 0.00 -1.52 0.00 0.00 31.29 30.95 1cfc h VAL 91 CO 0.02 0.00 -0.83 0.49 0.02 0.00 0.00 177.57 177.27 1cfc n PHE 92 N -2.99 0.00 -2.30 1.57 3.01 -0.54 -4.57 117.46 111.65 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 0.39 -0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.86 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 -1.03 5.75 0.33 4.37 -0.08 0.10 -4.74 116.55 121.25 1cfc n ASP 93 Ca 0.06 -3.14 0.22 0.00 -1.51 0.00 0.00 54.79 50.42 1cfc n ASP 93 Cb 0.37 -1.44 1.13 0.00 2.34 0.00 0.00 41.12 43.53 1cfc n ASP 93 CO 0.00 0.00 0.00 0.11 0.12 0.00 0.00 177.20 177.43 1cfc h LYS 94 N 5.49 0.00 -0.48 -0.67 1.57 -1.80 -0.87 116.57 119.80 1cfc h LYS 94 Ca 0.44 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.22 1cfc h LYS 94 Cb 0.56 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.87 1cfc h LYS 94 CO 1.58 0.00 0.00 -0.25 -0.57 0.00 0.00 179.45 180.21 1cfc n ASP 95 N -3.05 3.55 -2.34 0.86 9.92 -1.26 -4.92 116.55 119.30 1cfc n ASP 95 Ca -0.02 -1.99 -0.07 0.00 -0.53 0.00 0.00 54.79 52.17 1cfc n ASP 95 Cb 0.10 -0.32 -0.01 0.00 -0.64 0.00 0.00 41.12 40.26 1cfc n ASP 95 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1cfc n GLY 96 N 1.55 -0.38 0.01 0.44 0.00 -0.33 -4.76 105.19 101.71 1cfc n GLY 96 Ca 0.21 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.33 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 -1.50 0.48 0.00 1.61 4.05 -1.26 -4.97 115.26 113.66 1cfc n ASN 97 Ca -0.09 -0.43 0.00 0.00 0.45 0.00 0.00 54.58 54.51 1cfc n ASN 97 Cb 0.54 1.46 0.00 0.00 1.23 0.00 0.00 39.78 43.00 1cfc n ASN 97 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1cfc n GLY 98 N 1.37 0.75 2.96 8.20 0.00 -1.26 -5.05 105.19 112.16 1cfc n GLY 98 Ca -0.00 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.88 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 -2.30 0.39 0.13 1.61 1.51 -1.26 -4.37 117.35 113.06 1cfc s TYR 99 Ca 0.00 -0.19 -0.01 0.00 -1.01 0.00 0.00 57.07 55.86 1cfc s TYR 99 Cb 0.00 -0.25 -0.04 0.00 -0.11 0.00 0.00 41.96 41.57 1cfc s TYR 99 CO 0.00 -0.04 0.07 0.96 -1.11 0.00 0.00 175.55 175.43 1cfc s ILE 100 N -0.46 0.10 0.28 2.71 -4.36 -1.17 -4.89 121.20 113.41 1cfc s ILE 100 Ca -0.02 -1.89 -0.29 0.00 -0.26 0.00 0.00 60.65 58.18 1cfc s ILE 100 Cb -0.04 -2.04 -0.10 0.00 1.25 0.00 0.00 42.46 41.54 1cfc s ILE 100 CO -0.00 -0.45 1.12 -0.94 0.24 0.00 0.00 174.94 174.90 1cfc s SER 101 N -3.05 7.23 0.48 4.36 1.04 -1.26 -2.16 113.70 120.33 1cfc s SER 101 Ca 0.24 2.30 0.37 0.00 0.48 0.00 0.00 55.95 59.34 1cfc s SER 101 Cb 0.07 -2.63 1.55 0.00 0.10 0.00 0.00 66.02 65.11 1cfc s SER 101 CO 0.02 -0.18 1.60 0.00 0.98 0.00 0.00 173.24 175.66 1cfc h ALA 102 N 3.82 3.12 0.44 5.32 0.00 -1.90 0.39 119.26 130.45 1cfc h ALA 102 Ca -0.47 0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.48 1cfc h ALA 102 Cb 1.21 0.20 0.00 0.00 0.00 0.00 0.00 17.79 19.21 1cfc h ALA 102 CO 0.67 -1.74 -0.21 0.00 0.00 0.00 0.00 179.25 177.96 1cfc h ALA 103 N 1.42 -0.60 -0.11 0.00 0.00 -1.92 0.26 119.26 118.31 1cfc h ALA 103 Ca 0.87 -0.17 0.03 0.00 0.00 0.00 0.00 54.91 55.64 1cfc h ALA 103 Cb 3.01 0.23 -0.00 0.00 0.00 0.00 0.00 17.79 21.02 1cfc h ALA 103 CO -0.30 -0.75 0.15 0.93 0.00 0.00 0.00 179.25 179.28 1cfc h GLU 104 N -0.76 0.00 0.00 0.00 5.08 -0.63 0.24 114.58 118.51 1cfc h GLU 104 Ca -0.06 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.29 1cfc h GLU 104 Cb 0.54 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.79 1cfc h GLU 104 CO 0.10 0.00 -0.03 1.25 -1.00 0.00 0.00 179.01 179.33 1cfc h LEU 105 N 0.00 0.02 -1.57 1.33 5.85 -0.32 -0.92 115.31 119.70 1cfc h LEU 105 Ca 0.05 -0.92 -0.03 0.00 0.84 0.00 0.00 57.88 57.82 1cfc h LEU 105 Cb 0.36 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.37 1cfc h LEU 105 CO -0.00 0.94 -0.00 -0.09 -0.34 0.00 0.00 178.44 178.95 1cfc h ARG 106 N -0.90 0.26 -0.26 1.25 2.43 0.33 -1.79 114.38 115.71 1cfc h ARG 106 Ca -0.00 -0.04 -0.09 0.00 -0.81 0.00 0.00 59.98 59.03 1cfc h ARG 106 Cb 0.95 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.44 1cfc h ARG 106 CO 0.01 0.29 -0.20 1.25 -1.51 0.00 0.00 179.97 179.81 1cfc h HIS 107 N 0.26 0.70 -0.94 2.20 2.76 -0.56 -2.03 115.15 117.54 1cfc h HIS 107 Ca 0.06 -0.20 0.16 0.00 -2.20 0.00 0.00 60.37 58.20 1cfc h HIS 107 Cb 0.19 -0.15 -0.08 0.00 1.55 0.00 0.00 27.41 28.91 1cfc h HIS 107 CO 0.00 0.88 0.60 0.28 -1.30 0.00 0.00 177.93 178.40 1cfc h VAL 108 N 0.32 0.79 -0.00 5.26 2.07 -0.30 0.21 116.25 124.61 1cfc h VAL 108 Ca 0.05 -0.25 -0.17 0.00 0.82 0.00 0.00 66.70 67.15 1cfc h VAL 108 Cb 0.74 0.01 -0.02 0.00 -1.52 0.00 0.00 31.29 30.49 1cfc h VAL 108 CO 0.05 0.13 -0.79 0.24 0.02 0.00 0.00 177.57 177.22 1cfc h MET 109 N 0.72 0.02 0.11 1.57 2.86 -1.14 -3.07 114.93 116.00 1cfc h MET 109 Ca 0.50 -0.02 -0.26 0.00 -2.06 0.00 0.00 59.70 57.85 1cfc h MET 109 Cb 0.80 0.01 -0.00 0.00 0.06 0.00 0.00 31.60 32.46 1cfc h MET 109 CO -0.26 0.80 -1.30 1.15 1.06 0.00 0.00 176.91 178.36 1cfc h THR 110 N 0.01 1.10 0.00 2.22 2.02 -0.33 -3.34 112.91 114.59 1cfc h THR 110 Ca -0.01 -2.41 -0.02 0.00 0.77 0.00 0.00 66.41 64.74 1cfc h THR 110 Cb 1.39 2.77 -0.00 0.00 -1.74 0.00 0.00 68.15 70.57 1cfc h THR 110 CO 0.10 0.69 -0.09 -1.13 0.37 0.00 0.00 175.52 175.46 1cfc h ASN 111 N -0.36 0.00 -0.00 4.18 -0.73 -0.80 -1.65 115.58 116.23 1cfc h ASN 111 Ca -0.28 0.00 0.00 0.00 1.87 0.00 0.00 56.30 57.89 1cfc h ASN 111 Cb 1.71 0.00 -0.00 0.00 0.27 0.00 0.00 38.32 40.30 1cfc h ASN 111 CO 0.06 0.09 0.00 -0.07 -0.37 0.00 0.00 177.43 177.14 1cfc h LEU 112 N 0.00 0.00 -0.04 0.34 3.38 -1.65 -3.45 115.31 113.88 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 0.19 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.94 1cfc h LEU 112 CO 0.01 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.15 1cfc n GLY 113 N -1.39 1.03 3.83 0.83 0.00 -0.62 -5.06 105.19 103.81 1cfc n GLY 113 Ca -0.03 -0.52 -0.33 0.00 0.00 0.00 0.00 46.02 45.15 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 -2.79 4.13 0.00 1.61 0.41 -1.26 -4.90 118.70 115.91 1cfc s GLU 114 Ca 0.00 1.08 -0.02 0.00 -0.41 0.00 0.00 54.97 55.62 1cfc s GLU 114 Cb 0.00 -2.16 -0.08 0.00 -1.78 0.00 0.00 34.13 30.11 1cfc s GLU 114 CO 0.00 -0.11 2.41 1.63 -0.49 0.00 0.00 175.26 178.70 1cfc n LYS 115 N -0.93 1.26 -2.87 1.61 5.02 -1.26 -4.86 118.16 116.12 1cfc n LYS 115 Ca 0.07 -0.28 -0.38 0.00 -2.02 0.00 0.00 58.31 55.70 1cfc n LYS 115 Cb 0.54 -1.29 -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 4.43 0.02 -0.35 0.05 -1.26 -5.06 118.68 116.50 1cfc s LEU 116 Ca 0.19 1.74 0.01 0.00 0.05 0.00 0.00 54.13 56.12 1cfc s LEU 116 Cb 0.09 -3.75 -0.04 0.00 -2.05 0.00 0.00 46.19 40.44 1cfc s LEU 116 CO 0.00 0.03 0.04 0.42 -0.55 0.00 0.00 176.35 176.29 1cfc s THR 117 N -1.46 4.42 0.58 5.48 -4.23 -1.26 -4.99 115.64 114.19 1cfc s THR 117 Ca 0.45 -0.58 0.28 0.00 -1.18 0.00 0.00 61.69 60.66 1cfc s THR 117 Cb -0.20 -3.02 0.37 0.00 1.34 0.00 0.00 72.50 70.99 1cfc s THR 117 CO 0.25 0.31 2.02 0.44 -0.54 0.00 0.00 174.62 177.10 1cfc h ASP 118 N 4.04 0.00 -0.17 3.99 5.19 -2.00 -0.92 116.42 126.55 1cfc h ASP 118 Ca -0.49 0.00 -0.20 0.00 -0.62 0.00 0.00 57.03 55.72 1cfc h ASP 118 Cb 1.18 0.00 0.01 0.00 0.18 0.00 0.00 39.33 40.69 1cfc h ASP 118 CO 0.61 0.00 -0.68 -0.33 -3.12 0.00 0.00 179.24 175.71 1cfc h GLU 119 N 0.00 0.76 -0.64 3.56 3.07 -2.00 -2.64 114.58 116.69 1cfc h GLU 119 Ca 0.14 -0.59 -0.02 0.00 -0.50 0.00 0.00 59.36 58.39 1cfc h GLU 119 Cb 0.76 0.11 -0.03 0.00 -0.84 0.00 0.00 28.75 28.76 1cfc h GLU 119 CO -0.00 1.21 0.33 0.93 -1.40 0.00 0.00 179.01 180.08 1cfc h GLU 120 N 0.48 0.91 -0.67 2.33 5.08 -1.57 -2.34 114.58 118.80 1cfc h GLU 120 Ca -0.04 -0.12 -0.06 0.00 -1.00 0.00 0.00 59.36 58.14 1cfc h GLU 120 Cb 1.31 -0.17 -0.03 0.00 0.50 0.00 0.00 28.75 30.36 1cfc h GLU 120 CO 0.14 0.70 0.16 0.28 -1.00 0.00 0.00 179.01 179.30 1cfc h VAL 121 N 0.88 1.26 -0.43 3.13 2.07 -1.53 -1.52 116.25 120.11 1cfc h VAL 121 Ca 0.22 -0.94 0.09 0.00 0.82 0.00 0.00 66.70 66.89 1cfc h VAL 121 Cb 0.08 0.56 -0.02 0.00 -1.52 0.00 0.00 31.29 30.39 1cfc h VAL 121 CO -0.03 0.36 0.30 0.44 0.02 0.00 0.00 177.57 178.65 1cfc h ASP 122 N 1.01 0.17 0.03 0.57 3.32 -1.05 0.34 116.42 120.81 1cfc h ASP 122 Ca 0.21 0.00 -0.25 0.00 0.02 0.00 0.00 57.03 57.01 1cfc h ASP 122 Cb 0.35 -0.03 0.02 0.00 0.22 0.00 0.00 39.33 39.89 1cfc h ASP 122 CO 0.00 0.11 -1.01 -0.33 -1.72 0.00 0.00 179.24 176.29 1cfc h GLU 123 N 0.19 0.63 0.00 3.56 4.39 -0.96 -2.77 114.58 119.63 1cfc h GLU 123 Ca 0.20 -0.72 -0.04 0.00 0.34 0.00 0.00 59.36 59.14 1cfc h GLU 123 Cb 0.54 0.21 -0.01 0.00 -0.10 0.00 0.00 28.75 29.39 1cfc h GLU 123 CO -0.03 1.30 -0.17 0.52 -1.16 0.00 0.00 179.01 179.47 1cfc h MET 124 N 0.27 0.00 0.00 2.33 2.86 -0.32 -2.41 114.93 117.66 1cfc h MET 124 Ca -0.13 0.00 -0.17 0.00 -2.06 0.00 0.00 59.70 57.33 1cfc h MET 124 Cb 1.68 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 33.32 1cfc h MET 124 CO 0.20 0.17 -0.81 0.82 1.06 0.00 0.00 176.91 178.34 1cfc h ILE 125 N 0.00 1.45 0.14 -1.22 2.04 -0.33 -2.82 117.51 116.78 1cfc h ILE 125 Ca -0.00 -2.91 -0.01 0.00 1.00 0.00 0.00 64.86 62.94 1cfc h ILE 125 Cb 0.50 2.63 0.00 0.00 -0.74 0.00 0.00 36.82 39.21 1cfc h ILE 125 CO 0.02 0.80 -0.07 0.03 0.00 0.00 0.00 178.15 178.93 1cfc h ARG 126 N 0.00 -0.18 0.00 2.37 3.08 -1.14 -2.91 114.38 115.59 1cfc h ARG 126 Ca -0.01 0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1cfc h ARG 126 Cb 1.56 0.04 0.00 0.00 0.08 0.00 0.00 29.97 31.65 1cfc h ARG 126 CO 0.11 -0.04 0.00 0.93 -1.07 0.00 0.00 179.97 179.90 1cfc h GLU 127 N -0.29 0.00 -4.54 0.04 5.08 -1.66 -3.36 114.58 109.84 1cfc h GLU 127 Ca -0.02 0.00 -0.75 0.00 -1.00 0.00 0.00 59.36 57.60 1cfc h GLU 127 Cb 0.23 0.00 -0.18 0.00 0.50 0.00 0.00 28.75 29.29 1cfc h GLU 127 CO 0.03 0.00 1.33 0.00 -1.00 0.00 0.00 179.01 179.37 1cfc n ALA 128 N -1.99 4.03 -1.01 3.43 0.00 -1.06 -4.90 120.51 119.02 1cfc n ALA 128 Ca 0.04 -4.29 -0.02 0.00 0.00 0.00 0.00 53.44 49.17 1cfc n ALA 128 Cb 0.48 -2.99 -0.03 0.00 0.00 0.00 0.00 19.45 16.91 1cfc n ALA 128 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1cfc n ASP 129 N 5.21 -1.84 -0.06 0.00 8.00 -1.26 -4.56 116.55 122.04 1cfc n ASP 129 Ca 0.36 -1.24 0.12 0.00 0.71 0.00 0.00 54.79 54.73 1cfc n ASP 129 Cb 0.42 -0.56 0.66 0.00 -0.02 0.00 0.00 41.12 41.61 1cfc n ASP 129 CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43 1cfc n ILE 130 N 4.39 0.01 -2.23 0.53 5.41 -1.26 -4.75 119.36 121.46 1cfc n ILE 130 Ca 0.08 -0.03 0.00 0.00 1.00 0.00 0.00 62.75 63.79 1cfc n ILE 130 Cb 0.44 -0.28 0.00 0.00 -0.71 0.00 0.00 39.64 39.09 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 0.75 0.00 4.38 2.03 -1.26 -4.23 116.55 117.48 1cfc n ASP 131 Ca 0.17 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.48 1cfc n ASP 131 Cb 0.11 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.51 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 1.19 0.00 0.27 0.00 -1.26 -4.28 105.19 106.11 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 0.29 0.00 0.00 1.61 8.00 -1.26 -5.08 116.55 120.11 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 1.93 0.78 3.31 0.44 0.00 -1.26 -5.13 105.19 105.27 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 1.20 0.03 1.61 -0.21 -1.26 -4.03 119.66 117.00 1cfc s GLN 135 Ca 0.00 -1.24 0.01 0.00 0.02 0.00 0.00 55.36 54.15 1cfc s GLN 135 Cb 0.00 -1.49 -0.02 0.00 1.00 0.00 0.00 33.01 32.50 1cfc s GLN 135 CO 0.00 0.34 -0.04 0.08 -2.12 0.00 0.00 175.29 173.55 1cfc s VAL 136 N -1.28 0.22 0.81 1.09 1.01 -0.92 -4.94 120.40 116.40 1cfc s VAL 136 Ca 0.09 -0.95 -0.12 0.00 0.00 0.00 0.00 61.98 61.00 1cfc s VAL 136 Cb -0.09 -0.35 0.08 0.00 0.00 0.00 0.00 36.38 36.02 1cfc s VAL 136 CO 0.05 -0.47 1.18 0.21 0.00 0.00 0.00 175.10 176.07 1cfc s ASN 137 N -1.48 4.46 -0.17 3.32 3.84 -1.26 -3.02 114.94 120.63 1cfc s ASN 137 Ca -0.14 0.78 0.16 0.00 0.21 0.00 0.00 52.86 53.87 1cfc s ASN 137 Cb -0.10 -1.27 -0.22 0.00 -0.55 0.00 0.00 41.25 39.11 1cfc s ASN 137 CO -0.01 -1.94 0.08 0.00 -2.79 0.00 0.00 177.10 172.44 1cfc n TYR 138 N -3.34 0.00 -0.35 0.43 4.11 -1.26 -4.51 117.16 112.24 1cfc n TYR 138 Ca 0.08 0.00 0.34 0.00 -0.00 0.00 0.00 57.90 58.32 1cfc n TYR 138 Cb 0.61 -0.84 0.61 0.00 -0.00 0.00 0.00 39.34 39.71 1cfc n TYR 138 CO 0.00 0.00 0.00 -1.91 -0.00 0.00 0.00 176.86 174.95 1cfc n GLU 139 N -2.63 -0.05 -0.04 -3.48 2.13 -1.26 0.13 120.64 115.44 1cfc n GLU 139 Ca -0.27 1.34 -0.15 0.00 0.66 0.00 0.00 57.16 58.73 1cfc n GLU 139 Cb 1.04 -2.46 -0.08 0.00 0.27 0.00 0.00 31.44 30.22 1cfc n GLU 139 CO 0.00 0.00 0.00 0.93 -0.41 0.00 0.00 177.13 177.65 1cfc h GLU 140 N 0.00 0.53 0.00 5.31 4.39 -2.01 -2.96 114.58 119.84 1cfc h GLU 140 Ca 0.85 -0.38 -0.03 0.00 0.34 0.00 0.00 59.36 60.13 1cfc h GLU 140 Cb 2.37 0.07 -0.00 0.00 -0.10 0.00 0.00 28.75 31.08 1cfc h GLU 140 CO -0.69 1.00 -0.15 0.74 -1.16 0.00 0.00 179.01 178.75 1cfc h PHE 141 N 0.15 0.00 -0.02 4.33 0.04 0.86 -2.94 116.94 119.35 1cfc h PHE 141 Ca -0.01 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.75 1cfc h PHE 141 Cb 1.04 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 39.19 1cfc h PHE 141 CO 0.10 0.15 -0.02 0.28 -0.60 0.00 0.00 178.31 178.23 1cfc h VAL 142 N 0.00 1.40 0.00 -0.55 2.07 0.61 -2.43 116.25 117.35 1cfc h VAL 142 Ca -0.00 -1.21 -0.02 0.00 0.82 0.00 0.00 66.70 66.30 1cfc h VAL 142 Cb 0.71 2.17 -0.00 0.00 -1.52 0.00 0.00 31.29 32.66 1cfc h VAL 142 CO 0.02 0.32 -0.08 1.56 0.02 0.00 0.00 177.57 179.41 1cfc h GLN 143 N -0.45 0.00 -0.13 1.57 4.20 -1.49 -2.36 115.11 116.46 1cfc h GLN 143 Ca 0.00 0.00 -0.22 0.00 0.06 0.00 0.00 58.65 58.50 1cfc h GLN 143 Cb 0.53 0.00 0.01 0.00 0.30 0.00 0.00 27.48 28.32 1cfc h GLN 143 CO 0.00 0.08 -0.76 0.52 -0.67 0.00 0.00 178.83 178.00 1cfc h MET 144 N 0.00 0.75 0.00 1.46 2.86 -1.37 -2.55 114.93 116.08 1cfc h MET 144 Ca -0.00 -0.63 -0.04 0.00 -2.06 0.00 0.00 59.70 56.97 1cfc h MET 144 Cb 0.16 0.14 -0.01 0.00 0.06 0.00 0.00 31.60 31.95 1cfc h MET 144 CO 0.01 1.24 -0.19 0.52 1.06 0.00 0.00 176.91 179.54 1cfc h MET 145 N 0.46 0.00 0.17 1.72 2.86 -0.93 -3.24 114.93 115.97 1cfc h MET 145 Ca -0.06 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.57 1cfc h MET 145 Cb 1.40 0.00 0.00 0.00 0.06 0.00 0.00 31.60 33.06 1cfc h MET 145 CO 0.16 0.19 -0.08 1.79 1.06 0.00 0.00 176.91 180.02 1cfc h THR 146 N 0.00 0.00 -0.03 2.22 1.35 -1.38 -3.48 112.91 111.59 1cfc h THR 146 Ca -0.00 -0.79 0.28 0.00 -0.55 0.00 0.00 66.41 65.35 1cfc h THR 146 Cb 0.59 0.00 -0.25 0.00 -1.73 0.00 0.00 68.15 66.76 1cfc h THR 146 CO 0.02 0.00 0.47 0.00 -0.25 0.00 0.00 175.52 175.76 1cfc s ALA 147 N -3.15 -3.61 -1.48 6.62 0.00 -0.97 -5.01 121.76 114.16 1cfc s ALA 147 Ca -0.03 1.55 0.00 0.00 0.00 0.00 0.00 51.96 53.47 1cfc s ALA 147 Cb 0.00 -2.46 0.00 0.00 0.00 0.00 0.00 23.12 20.67 1cfc s ALA 147 CO 0.10 -1.20 0.37 1.63 0.00 0.00 0.00 175.76 176.66