#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 0.04 -4.74 0.00 8.00 -1.26 -5.09 116.55 113.51 1cfc n ASP 2 Ca 0.00 -1.74 -0.38 0.00 0.71 0.00 0.00 54.79 53.38 1cfc n ASP 2 Cb 0.00 -0.14 0.05 0.00 -0.02 0.00 0.00 41.12 41.01 1cfc n ASP 2 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1cfc n GLN 3 N 0.03 1.47 -1.44 -1.24 6.02 -1.26 -4.91 117.38 116.05 1cfc n GLN 3 Ca -0.00 0.55 -0.37 0.00 -0.01 0.00 0.00 57.00 57.17 1cfc n GLN 3 Cb 0.68 -2.55 0.06 0.00 1.02 0.00 0.00 30.24 29.45 1cfc n GLN 3 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 1cfc n LEU 4 N -1.32 2.32 -4.90 1.08 4.77 -1.26 -4.97 117.00 112.72 1cfc n LEU 4 Ca 0.12 0.70 -0.28 0.00 -0.03 0.00 0.00 56.01 56.53 1cfc n LEU 4 Cb 0.46 -1.30 -0.02 0.00 -2.33 0.00 0.00 43.42 40.23 1cfc n LEU 4 CO 0.51 -2.48 0.39 0.42 -1.33 0.00 0.00 177.39 174.90 1cfc s THR 5 N -1.72 4.90 0.42 -5.08 -4.23 -1.26 -4.96 115.64 103.71 1cfc s THR 5 Ca 0.71 0.28 0.10 0.00 -1.18 0.00 0.00 61.69 61.60 1cfc s THR 5 Cb -0.39 -3.80 0.22 0.00 1.34 0.00 0.00 72.50 69.87 1cfc s THR 5 CO 0.52 -0.65 2.01 -0.33 -0.54 0.00 0.00 174.62 175.64 1cfc h GLU 6 N 0.82 0.30 0.31 3.99 5.08 -1.97 -2.07 114.58 121.04 1cfc h GLU 6 Ca -0.47 -0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 57.83 1cfc h GLU 6 Cb 1.20 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 30.39 1cfc h GLU 6 CO 0.63 0.30 -0.15 0.93 -1.00 0.00 0.00 179.01 179.72 1cfc h GLU 7 N 0.30 -0.40 -0.95 2.33 5.08 -1.97 0.47 114.58 119.45 1cfc h GLU 7 Ca 0.07 0.03 0.15 0.00 -1.00 0.00 0.00 59.36 58.61 1cfc h GLU 7 Cb 0.14 0.09 -0.08 0.00 0.50 0.00 0.00 28.75 29.40 1cfc h GLU 7 CO -0.00 -0.08 0.60 1.96 -1.00 0.00 0.00 179.01 180.49 1cfc h GLN 8 N -0.80 0.75 -0.34 2.33 4.20 -1.91 0.27 115.11 119.61 1cfc h GLN 8 Ca -0.04 -0.05 -0.15 0.00 0.06 0.00 0.00 58.65 58.47 1cfc h GLN 8 Cb 0.51 -0.17 -0.01 0.00 0.30 0.00 0.00 27.48 28.12 1cfc h GLN 8 CO 0.07 0.50 -0.40 0.82 -0.67 0.00 0.00 178.83 179.15 1cfc h ILE 9 N 0.78 1.28 0.00 2.54 2.04 -1.25 -1.99 117.51 120.91 1cfc h ILE 9 Ca 0.49 -1.57 -0.06 0.00 1.00 0.00 0.00 64.86 64.71 1cfc h ILE 9 Cb 0.71 1.44 -0.01 0.00 -0.74 0.00 0.00 36.82 38.22 1cfc h ILE 9 CO -0.25 0.52 -0.30 0.00 0.00 0.00 0.00 178.15 178.12 1cfc h ALA 10 N 0.87 1.09 0.05 1.87 0.00 0.15 -0.37 119.26 122.92 1cfc h ALA 10 Ca 0.05 -0.27 -0.18 0.00 0.00 0.00 0.00 54.91 54.51 1cfc h ALA 10 Cb 0.97 -0.05 0.02 0.00 0.00 0.00 0.00 17.79 18.73 1cfc h ALA 10 CO 0.09 0.37 -0.73 1.49 0.00 0.00 0.00 179.25 180.48 1cfc h GLU 11 N 0.00 0.41 -0.22 0.00 4.81 -0.32 -2.83 114.58 116.44 1cfc h GLU 11 Ca -0.00 -0.51 -0.12 0.00 -0.13 0.00 0.00 59.36 58.60 1cfc h GLU 11 Cb 0.74 0.16 -0.01 0.00 0.63 0.00 0.00 28.75 30.27 1cfc h GLU 11 CO 0.04 1.17 -0.37 0.74 -0.73 0.00 0.00 179.01 179.87 1cfc h PHE 12 N -0.12 0.56 -0.51 0.92 0.04 -1.24 -2.57 116.94 114.02 1cfc h PHE 12 Ca -0.10 -0.15 -0.01 0.00 2.80 0.00 0.00 57.97 60.51 1cfc h PHE 12 Cb 1.47 -0.13 -0.02 0.00 2.20 0.00 0.00 35.95 39.47 1cfc h PHE 12 CO 0.15 0.78 0.28 -0.22 -0.60 0.00 0.00 178.31 178.71 1cfc h LYS 13 N 0.40 0.72 0.07 1.51 3.64 -1.09 0.28 116.57 122.09 1cfc h LYS 13 Ca 0.04 -0.08 -0.00 0.00 -1.27 0.00 0.00 60.65 59.34 1cfc h LYS 13 Cb 0.83 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 32.51 1cfc h LYS 13 CO 0.07 0.56 -0.03 0.93 -2.27 0.00 0.00 179.45 178.70 1cfc h GLU 14 N 0.69 -0.09 -0.11 1.90 4.39 -1.35 0.12 114.58 120.12 1cfc h GLU 14 Ca 0.18 0.01 -0.00 0.00 0.34 0.00 0.00 59.36 59.89 1cfc h GLU 14 Cb 0.05 0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 28.71 1cfc h GLU 14 CO -0.03 -0.00 0.06 0.00 -1.16 0.00 0.00 179.01 177.88 1cfc h ALA 15 N 0.78 1.90 -0.00 3.43 0.00 -1.16 -1.47 119.26 122.73 1cfc h ALA 15 Ca -0.01 -0.02 -0.21 0.00 0.00 0.00 0.00 54.91 54.67 1cfc h ALA 15 Cb 0.12 -0.05 0.02 0.00 0.00 0.00 0.00 17.79 17.88 1cfc h ALA 15 CO 0.01 0.09 -0.81 0.35 0.00 0.00 0.00 179.25 178.90 1cfc h PHE 16 N 0.15 0.82 -0.20 0.00 3.57 0.30 -3.26 116.94 118.32 1cfc h PHE 16 Ca 0.04 -0.45 -0.09 0.00 3.53 0.00 0.00 57.97 61.01 1cfc h PHE 16 Cb 0.01 -0.09 -0.01 0.00 2.79 0.00 0.00 35.95 38.64 1cfc h PHE 16 CO 0.00 1.27 -0.25 0.66 -2.23 0.00 0.00 178.31 177.76 1cfc h SER 17 N 0.14 0.36 -0.59 0.41 4.64 -0.31 -2.79 113.55 115.41 1cfc h SER 17 Ca -0.10 -0.12 0.17 0.00 -0.47 0.00 0.00 61.79 61.27 1cfc h SER 17 Cb 1.49 -0.10 -0.02 0.00 -0.31 0.00 0.00 62.40 63.46 1cfc h SER 17 CO 0.16 0.62 0.77 -0.07 -0.87 0.00 0.00 176.83 177.43 1cfc h LEU 18 N 0.33 0.00 -2.92 5.97 3.38 -1.32 0.15 115.31 120.90 1cfc h LEU 18 Ca 0.05 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.99 1cfc h LEU 18 Cb 0.62 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.32 1cfc h LEU 18 CO 0.04 0.00 -0.44 0.49 0.09 0.00 0.00 178.44 178.62 1cfc n PHE 19 N -3.37 0.00 -3.01 1.13 3.01 -1.06 -4.88 117.46 109.28 1cfc n PHE 19 Ca 0.12 -1.10 -0.43 0.00 1.01 0.00 0.00 57.45 57.05 1cfc n PHE 19 Cb 0.97 -0.19 0.01 0.00 -0.01 0.00 0.00 39.48 40.26 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 -0.89 6.42 0.00 4.37 -0.08 0.53 -4.67 116.55 122.24 1cfc n ASP 20 Ca 0.15 -3.41 0.13 0.00 -1.51 0.00 0.00 54.79 50.15 1cfc n ASP 20 Cb 0.74 -1.27 0.74 0.00 2.34 0.00 0.00 41.12 43.67 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 1.35 0.75 -0.07 -0.67 4.76 -1.26 -2.71 118.16 120.31 1cfc n LYS 21 Ca 0.26 0.01 0.12 0.00 -2.87 0.00 0.00 58.31 55.83 1cfc n LYS 21 Cb 0.33 -1.50 0.16 0.00 -1.84 0.00 0.00 35.03 32.18 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 -1.03 3.11 -0.69 4.39 8.00 -1.26 -4.91 116.55 124.16 1cfc n ASP 22 Ca 0.18 -1.98 -0.05 0.00 0.71 0.00 0.00 54.79 53.65 1cfc n ASP 22 Cb 0.10 -0.09 -0.02 0.00 -0.02 0.00 0.00 41.12 41.08 1cfc n ASP 22 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1cfc n GLY 23 N 1.40 0.46 1.03 0.44 0.00 -1.10 -4.65 105.19 102.77 1cfc n GLY 23 Ca 0.16 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.30 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 0.60 3.15 -0.47 1.61 2.03 -1.26 -4.94 116.55 117.27 1cfc n ASP 24 Ca -0.05 -1.99 -0.04 0.00 0.52 0.00 0.00 54.79 53.23 1cfc n ASP 24 Cb 0.25 -0.09 -0.00 0.00 -0.72 0.00 0.00 41.12 40.56 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 1.41 0.24 3.17 0.27 0.00 -1.26 -5.03 105.19 103.99 1cfc n GLY 25 Ca 0.16 -0.72 -0.11 0.00 0.00 0.00 0.00 46.02 45.35 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 -2.21 0.11 0.13 2.61 -4.23 -1.26 -3.26 115.64 107.52 1cfc s THR 26 Ca 0.00 -1.94 -0.01 0.00 -1.18 0.00 0.00 61.69 58.55 1cfc s THR 26 Cb 0.00 -2.20 -0.04 0.00 1.34 0.00 0.00 72.50 71.60 1cfc s THR 26 CO 0.00 -0.31 0.06 0.27 -0.54 0.00 0.00 174.62 174.10 1cfc s ILE 27 N -4.06 0.11 0.60 2.99 -4.36 -0.36 -4.45 121.20 111.67 1cfc s ILE 27 Ca 0.29 -1.89 -0.03 0.00 -0.26 0.00 0.00 60.65 58.76 1cfc s ILE 27 Cb 0.07 -2.00 0.03 0.00 1.25 0.00 0.00 42.46 41.81 1cfc s ILE 27 CO 0.05 -0.49 0.88 0.42 0.24 0.00 0.00 174.94 176.04 1cfc s THR 28 N -4.04 2.94 0.33 8.37 -4.23 -1.26 -0.86 115.64 116.90 1cfc s THR 28 Ca 0.23 -0.34 0.12 0.00 -1.18 0.00 0.00 61.69 60.52 1cfc s THR 28 Cb 0.07 -3.17 0.05 0.00 1.34 0.00 0.00 72.50 70.79 1cfc s THR 28 CO 0.01 -0.16 1.75 0.71 -0.54 0.00 0.00 174.62 176.39 1cfc h THR 29 N -0.18 1.31 0.00 3.99 1.35 -1.87 -2.59 112.91 114.92 1cfc h THR 29 Ca -0.44 -1.58 -0.02 0.00 -0.55 0.00 0.00 66.41 63.81 1cfc h THR 29 Cb 1.29 1.86 -0.00 0.00 -1.73 0.00 0.00 68.15 69.56 1cfc h THR 29 CO 0.58 0.45 -0.09 0.11 -0.25 0.00 0.00 175.52 176.32 1cfc h LYS 30 N 0.00 0.00 -0.71 4.72 1.79 -1.93 -1.12 116.57 119.31 1cfc h LYS 30 Ca -0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1cfc h LYS 30 Cb 0.82 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.47 1cfc h LYS 30 CO 0.06 0.09 0.00 0.39 -1.08 0.00 0.00 179.45 178.91 1cfc n GLU 31 N -3.92 3.19 -0.02 3.15 1.02 -0.98 -4.44 120.64 118.64 1cfc n GLU 31 Ca -0.02 -2.79 -0.13 0.00 -0.02 0.00 0.00 57.16 54.19 1cfc n GLU 31 Cb 0.18 -1.72 -0.10 0.00 -0.02 0.00 0.00 31.44 29.77 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 4.30 -0.01 -2.01 -4.62 5.85 -1.15 -2.58 115.31 115.09 1cfc h LEU 32 Ca 0.00 -0.55 -0.01 0.00 0.84 0.00 0.00 57.88 58.16 1cfc h LEU 32 Cb 1.21 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.24 1cfc h LEU 32 CO 0.10 0.54 -0.07 1.23 -0.34 0.00 0.00 178.44 179.91 1cfc h GLY 33 N -0.56 0.00 1.05 3.75 0.00 -1.78 -2.50 103.07 103.04 1cfc h GLY 33 Ca -0.00 0.00 -0.19 0.00 0.00 0.00 0.00 47.33 47.14 1cfc h GLY 33 CO 0.00 0.00 -0.65 -0.84 0.00 0.00 0.00 176.54 175.05 1cfc h THR 34 N 0.00 1.31 -0.03 4.70 2.02 -1.77 -1.32 112.91 117.82 1cfc h THR 34 Ca -0.00 -1.89 -0.01 0.00 0.77 0.00 0.00 66.41 65.28 1cfc h THR 34 Cb 0.32 2.04 -0.00 0.00 -1.74 0.00 0.00 68.15 68.77 1cfc h THR 34 CO 0.01 0.59 -0.00 0.58 0.37 0.00 0.00 175.52 177.06 1cfc h VAL 35 N 0.38 1.27 -0.62 3.16 2.07 -1.06 -2.10 116.25 119.35 1cfc h VAL 35 Ca -0.04 -0.83 0.05 0.00 0.82 0.00 0.00 66.70 66.70 1cfc h VAL 35 Cb 1.28 1.77 -0.04 0.00 -1.52 0.00 0.00 31.29 32.79 1cfc h VAL 35 CO 0.14 0.22 0.41 0.24 0.02 0.00 0.00 177.57 178.60 1cfc h MET 36 N -0.27 0.66 0.00 1.57 2.86 -1.51 0.14 114.93 118.37 1cfc h MET 36 Ca 0.01 -0.04 -0.05 0.00 -2.06 0.00 0.00 59.70 57.56 1cfc h MET 36 Cb 0.36 -0.15 -0.01 0.00 0.06 0.00 0.00 31.60 31.86 1cfc h MET 36 CO 0.00 0.43 -0.22 0.00 1.06 0.00 0.00 176.91 178.18 1cfc h ARG 37 N 0.68 0.00 -0.15 1.72 3.08 -0.92 -1.08 114.38 117.71 1cfc h ARG 37 Ca 0.26 0.00 -0.11 0.00 0.07 0.00 0.00 59.98 60.20 1cfc h ARG 37 Cb 0.17 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.20 1cfc h ARG 37 CO -0.07 0.22 -0.37 0.66 -1.07 0.00 0.00 179.97 179.33 1cfc h SER 38 N 0.00 0.33 -0.03 7.04 4.64 -0.04 -2.05 113.55 123.45 1cfc h SER 38 Ca -0.00 -0.13 0.00 0.00 -0.47 0.00 0.00 61.79 61.19 1cfc h SER 38 Cb 0.51 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 62.51 1cfc h SER 38 CO 0.03 0.68 0.00 0.18 -0.87 0.00 0.00 176.83 176.85 1cfc n LEU 39 N -4.05 0.47 0.00 5.97 4.77 -0.82 -4.86 117.00 118.48 1cfc n LEU 39 Ca -0.01 -0.18 0.00 0.00 -0.03 0.00 0.00 56.01 55.79 1cfc n LEU 39 Cb 0.46 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.54 1cfc n LEU 39 CO 0.42 0.09 0.00 0.61 -1.33 0.00 0.00 177.39 177.18 1cfc n GLY 40 N 0.98 0.76 3.79 -0.72 0.00 -0.77 -5.07 105.19 104.16 1cfc n GLY 40 Ca 0.19 -0.54 -0.36 0.00 0.00 0.00 0.00 46.02 45.31 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 -1.24 3.24 -0.46 1.61 -1.52 -0.47 -4.99 119.66 115.82 1cfc s GLN 41 Ca 0.00 -0.26 0.06 0.00 -1.95 0.00 0.00 55.36 53.21 1cfc s GLN 41 Cb 0.00 -3.01 0.22 0.00 -0.22 0.00 0.00 33.01 30.00 1cfc s GLN 41 CO 0.00 0.74 0.49 -1.71 -0.25 0.00 0.00 175.29 174.56 1cfc n ASN 42 N 2.07 0.74 -4.79 5.90 4.05 -1.26 -3.43 115.26 118.54 1cfc n ASN 42 Ca -0.19 -2.74 -0.34 0.00 0.45 0.00 0.00 54.58 51.75 1cfc n ASN 42 Cb 0.54 -0.63 -0.00 0.00 1.23 0.00 0.00 39.78 40.92 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 -0.99 3.45 1.17 1.20 0.04 -1.26 -5.03 135.00 133.58 1cfc s PRO 43 Ca 0.34 1.43 -0.18 0.00 0.04 0.00 0.00 61.00 62.63 1cfc s PRO 43 Cb 0.10 -2.04 0.27 0.00 0.04 0.00 0.00 34.50 32.88 1cfc s PRO 43 CO -0.13 -0.74 1.11 0.95 0.04 0.00 0.00 177.00 178.23 1cfc s THR 44 N -2.03 1.66 0.12 1.26 -4.23 -1.26 -4.80 115.64 106.37 1cfc s THR 44 Ca 0.69 0.00 -0.14 0.00 -1.18 0.00 0.00 61.69 61.06 1cfc s THR 44 Cb -0.19 -2.50 -0.03 0.00 1.34 0.00 0.00 72.50 71.11 1cfc s THR 44 CO 0.28 0.00 1.52 -0.33 -0.54 0.00 0.00 174.62 175.54 1cfc h GLU 45 N -2.48 0.77 -0.62 3.99 5.08 -1.99 -2.43 114.58 116.91 1cfc h GLU 45 Ca -0.46 -0.31 -0.05 0.00 -1.00 0.00 0.00 59.36 57.53 1cfc h GLU 45 Cb 1.30 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 30.49 1cfc h GLU 45 CO 0.38 0.93 0.17 0.00 -1.00 0.00 0.00 179.01 179.48 1cfc h ALA 46 N 0.82 1.13 -0.77 3.43 0.00 -1.98 0.18 119.26 122.07 1cfc h ALA 46 Ca 0.09 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 1cfc h ALA 46 Cb 0.66 -0.24 -0.04 0.00 0.00 0.00 0.00 17.79 18.17 1cfc h ALA 46 CO 0.05 0.59 0.43 0.93 0.00 0.00 0.00 179.25 181.25 1cfc h GLU 47 N 0.91 1.06 -0.09 0.00 5.08 -1.87 0.06 114.58 119.74 1cfc h GLU 47 Ca 0.20 -0.11 -0.14 0.00 -1.00 0.00 0.00 59.36 58.31 1cfc h GLU 47 Cb 0.30 -0.22 0.01 0.00 0.50 0.00 0.00 28.75 29.34 1cfc h GLU 47 CO -0.00 0.77 -0.47 -0.07 -1.00 0.00 0.00 179.01 178.23 1cfc h LEU 48 N 1.07 0.57 -1.75 1.33 3.38 -0.84 -3.10 115.31 115.98 1cfc h LEU 48 Ca 0.27 -0.65 -0.01 0.00 0.09 0.00 0.00 57.88 57.58 1cfc h LEU 48 Cb 0.01 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 40.58 1cfc h LEU 48 CO -0.05 1.13 -0.07 1.56 0.09 0.00 0.00 178.44 181.10 1cfc h GLN 49 N 0.05 0.00 -0.01 1.13 4.20 -0.32 -2.25 115.11 117.91 1cfc h GLN 49 Ca -0.03 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.65 1cfc h GLN 49 Cb 1.12 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.90 1cfc h GLN 49 CO 0.10 0.07 -0.10 -0.44 -0.67 0.00 0.00 178.83 177.79 1cfc h ASP 50 N 0.00 0.10 0.48 1.46 3.32 -0.95 -2.47 116.42 118.36 1cfc h ASP 50 Ca -0.00 -0.72 -0.05 0.00 0.02 0.00 0.00 57.03 56.29 1cfc h ASP 50 Cb 0.43 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 39.94 1cfc h ASP 50 CO 0.01 0.80 -0.23 0.24 -1.72 0.00 0.00 179.24 178.34 1cfc h MET 51 N -0.59 0.00 -0.31 3.56 2.86 -1.46 -2.62 114.93 116.37 1cfc h MET 51 Ca -0.01 0.00 -0.11 0.00 -2.06 0.00 0.00 59.70 57.52 1cfc h MET 51 Cb 0.81 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.46 1cfc h MET 51 CO 0.02 0.23 -0.25 0.82 1.06 0.00 0.00 176.91 178.80 1cfc h ILE 52 N 0.00 1.30 -0.84 -1.22 2.04 -1.37 0.18 117.51 117.59 1cfc h ILE 52 Ca -0.00 -1.40 0.09 0.00 1.00 0.00 0.00 64.86 64.55 1cfc h ILE 52 Cb 0.54 1.52 -0.06 0.00 -0.74 0.00 0.00 36.82 38.07 1cfc h ILE 52 CO 0.03 0.45 0.54 -1.13 0.00 0.00 0.00 178.15 178.04 1cfc h ASN 53 N 0.46 0.73 0.00 1.72 -1.24 -1.05 1.04 115.58 117.24 1cfc h ASN 53 Ca 0.06 0.02 -0.01 0.00 0.71 0.00 0.00 56.30 57.08 1cfc h ASN 53 Cb 0.80 -0.13 -0.00 0.00 0.73 0.00 0.00 38.32 39.72 1cfc h ASN 53 CO 0.06 0.44 -0.05 -0.33 -1.29 0.00 0.00 177.43 176.26 1cfc h GLU 54 N 0.81 0.00 -0.08 6.67 5.08 -1.45 -3.30 114.58 122.31 1cfc h GLU 54 Ca 0.38 0.00 0.02 0.00 -1.00 0.00 0.00 59.36 58.77 1cfc h GLU 54 Cb 0.41 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.66 1cfc h GLU 54 CO -0.15 0.56 0.08 0.28 -1.00 0.00 0.00 179.01 178.78 1cfc h VAL 55 N -1.00 0.59 0.00 3.13 2.07 -0.43 -1.23 116.25 119.38 1cfc h VAL 55 Ca -0.01 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.51 1cfc h VAL 55 Cb 0.58 0.94 0.00 0.00 -1.52 0.00 0.00 31.29 31.29 1cfc h VAL 55 CO -0.01 0.00 0.00 -0.67 0.02 0.00 0.00 177.57 176.91 1cfc n ASP 56 N -3.96 4.37 0.17 0.57 2.03 0.36 -3.86 116.55 116.23 1cfc n ASP 56 Ca -0.01 -2.23 0.07 0.00 0.52 0.00 0.00 54.79 53.14 1cfc n ASP 56 Cb 0.18 -0.87 0.09 0.00 -0.72 0.00 0.00 41.12 39.80 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 1.42 0.81 0.00 -1.67 0.00 -1.40 -3.06 119.26 115.36 1cfc h ALA 57 Ca 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.65 1cfc h ALA 57 Cb 0.99 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.73 1cfc h ALA 57 CO 0.00 0.35 0.00 0.22 0.00 0.00 0.00 179.25 179.82 1cfc h ASP 58 N 0.00 0.00 -0.06 0.00 1.82 -1.85 -3.47 116.42 112.86 1cfc h ASP 58 Ca -0.00 0.00 -0.03 0.00 -0.39 0.00 0.00 57.03 56.61 1cfc h ASP 58 Cb 1.22 0.00 -0.01 0.00 0.68 0.00 0.00 39.33 41.22 1cfc h ASP 58 CO 0.04 0.00 -0.02 0.61 -1.61 0.00 0.00 179.24 178.25 1cfc n GLY 59 N 1.12 0.45 1.10 -0.78 0.00 -1.16 -4.86 105.19 101.06 1cfc n GLY 59 Ca 0.04 -0.15 0.12 0.00 0.00 0.00 0.00 46.02 46.03 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 -0.05 3.33 -3.47 1.61 5.03 -1.26 -4.95 115.26 115.50 1cfc n ASN 60 Ca -0.01 -2.00 -0.24 0.00 0.87 0.00 0.00 54.58 53.20 1cfc n ASN 60 Cb 0.16 -0.17 -0.01 0.00 -1.02 0.00 0.00 39.78 38.75 1cfc n ASN 60 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1cfc n GLY 61 N 1.46 -0.48 3.23 7.41 0.00 -1.26 -4.92 105.19 110.63 1cfc n GLY 61 Ca 0.18 0.09 -0.13 0.00 0.00 0.00 0.00 46.02 46.15 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 -2.93 0.13 -0.01 2.61 -4.23 -1.26 -3.11 115.64 106.83 1cfc s THR 62 Ca 0.44 -2.00 -0.00 0.00 -1.18 0.00 0.00 61.69 58.95 1cfc s THR 62 Cb -0.23 -2.53 0.02 0.00 1.34 0.00 0.00 72.50 71.09 1cfc s THR 62 CO 0.54 0.00 0.02 -0.63 -0.54 0.00 0.00 174.62 174.01 1cfc s ILE 63 N -4.04 -0.03 0.33 2.99 1.01 -0.03 -4.85 121.20 116.58 1cfc s ILE 63 Ca 0.39 0.11 0.07 0.00 0.00 0.00 0.00 60.65 61.22 1cfc s ILE 63 Cb 0.07 -0.05 -0.01 0.00 0.01 0.00 0.00 42.46 42.48 1cfc s ILE 63 CO 0.13 0.05 0.46 1.51 0.00 0.00 0.00 174.94 177.09 1cfc s ASP 64 N 0.57 5.94 0.18 3.58 1.47 -1.26 -1.23 116.67 125.91 1cfc s ASP 64 Ca -0.05 -0.20 -0.14 0.00 1.18 0.00 0.00 52.55 53.34 1cfc s ASP 64 Cb -0.07 -1.22 0.07 0.00 -0.34 0.00 0.00 42.92 41.37 1cfc s ASP 64 CO -0.02 -0.43 1.84 0.15 0.68 0.00 0.00 175.17 177.39 1cfc h PHE 65 N 0.91 0.68 -0.04 2.11 3.57 -1.95 -1.10 116.94 121.13 1cfc h PHE 65 Ca -0.46 0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.10 1cfc h PHE 65 Cb 1.26 -0.23 -0.05 0.00 2.79 0.00 0.00 35.95 39.71 1cfc h PHE 65 CO 0.43 0.43 -0.31 -1.35 -2.23 0.00 0.00 178.31 175.28 1cfc h PRO 66 N 0.73 -0.43 -0.37 6.41 0.11 -1.96 0.35 132.00 136.85 1cfc h PRO 66 Ca 0.20 0.03 0.02 0.00 0.11 0.00 0.00 66.00 66.36 1cfc h PRO 66 Cb -0.08 0.10 -0.02 0.00 0.11 0.00 0.00 31.00 31.11 1cfc h PRO 66 CO -0.04 -0.28 0.25 0.93 -0.21 0.00 0.00 178.00 178.64 1cfc h GLU 67 N -0.44 0.40 -0.39 1.05 5.08 -1.93 0.74 114.58 119.08 1cfc h GLU 67 Ca 0.07 -0.02 -0.08 0.00 -1.00 0.00 0.00 59.36 58.33 1cfc h GLU 67 Cb 0.55 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.69 1cfc h GLU 67 CO -0.29 0.26 -0.09 0.35 -1.00 0.00 0.00 179.01 178.24 1cfc h PHE 68 N 0.41 0.73 0.00 4.33 3.57 0.54 -1.24 116.94 125.28 1cfc h PHE 68 Ca 0.15 -0.12 -0.05 0.00 3.53 0.00 0.00 57.97 61.48 1cfc h PHE 68 Cb 0.09 -0.19 -0.01 0.00 2.79 0.00 0.00 35.95 38.63 1cfc h PHE 68 CO -0.00 0.74 -0.25 -0.07 -2.23 0.00 0.00 178.31 176.50 1cfc h LEU 69 N 0.62 0.00 -0.66 0.59 3.38 0.19 -1.96 115.31 117.48 1cfc h LEU 69 Ca 0.11 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.94 1cfc h LEU 69 Cb 0.52 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.26 1cfc h LEU 69 CO 0.03 0.25 -0.60 0.74 0.09 0.00 0.00 178.44 178.96 1cfc h THR 70 N 0.00 1.38 -0.41 0.22 2.02 -0.52 0.26 112.91 115.86 1cfc h THR 70 Ca -0.00 -1.96 -0.08 0.00 0.77 0.00 0.00 66.41 65.14 1cfc h THR 70 Cb 0.54 1.98 -0.01 0.00 -1.74 0.00 0.00 68.15 68.92 1cfc h THR 70 CO 0.03 0.58 -0.06 0.24 0.37 0.00 0.00 175.52 176.68 1cfc h MET 71 N 0.19 0.77 -0.20 6.66 2.86 -0.86 0.33 114.93 124.68 1cfc h MET 71 Ca -0.00 -0.27 -0.20 0.00 -2.06 0.00 0.00 59.70 57.16 1cfc h MET 71 Cb 1.10 -0.05 0.00 0.00 0.06 0.00 0.00 31.60 32.71 1cfc h MET 71 CO 0.09 0.88 -0.67 0.52 1.06 0.00 0.00 176.91 178.79 1cfc h MET 72 N 0.59 0.76 -0.41 1.72 2.07 -1.38 -2.06 114.93 116.23 1cfc h MET 72 Ca 0.11 -0.55 -0.15 0.00 -2.07 0.00 0.00 59.70 57.04 1cfc h MET 72 Cb 0.57 0.09 -0.01 0.00 -1.87 0.00 0.00 31.60 30.38 1cfc h MET 72 CO 0.03 1.17 -0.32 0.00 1.07 0.00 0.00 176.91 178.86 1cfc h ALA 73 N 0.69 0.59 0.00 6.32 0.00 -0.80 0.99 119.26 127.04 1cfc h ALA 73 Ca -0.02 -0.43 -0.06 0.00 0.00 0.00 0.00 54.91 54.40 1cfc h ALA 73 Cb 1.27 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.93 1cfc h ALA 73 CO 0.14 0.65 -0.28 0.07 0.00 0.00 0.00 179.25 179.83 1cfc h ARG 74 N 0.76 0.00 0.07 0.00 -0.00 -0.33 -3.23 114.38 111.65 1cfc h ARG 74 Ca 0.07 0.00 -0.00 0.00 -0.00 0.00 0.00 59.98 60.05 1cfc h ARG 74 Cb 0.91 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 30.88 1cfc h ARG 74 CO 0.08 0.28 -0.03 0.87 -0.00 0.00 0.00 179.97 181.17 1cfc h LYS 75 N 0.00 -0.09 -5.07 0.08 1.57 -1.01 -3.43 116.57 108.62 1cfc h LYS 75 Ca -0.00 0.01 -0.25 0.00 -1.87 0.00 0.00 60.65 58.53 1cfc h LYS 75 Cb 0.57 0.02 -0.08 0.00 0.08 0.00 0.00 32.23 32.82 1cfc h LYS 75 CO 0.04 -0.06 1.51 -1.33 -0.57 0.00 0.00 179.45 179.04 1cfc n MET 76 N -3.95 0.12 0.00 3.15 2.81 0.31 -4.28 117.12 115.29 1cfc n MET 76 Ca -0.01 -0.21 0.00 0.00 -1.81 0.00 0.00 57.70 55.67 1cfc n MET 76 Cb 0.04 -1.62 0.00 0.00 -0.71 0.00 0.00 33.22 30.93 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 6.17 0.00 0.00 0.03 5.02 -1.26 -4.89 118.16 123.23 1cfc n LYS 77 Ca 0.59 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.88 1cfc n LYS 77 Cb 0.23 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.24 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 -2.38 4.39 -0.08 -1.26 -1.42 116.55 115.80 1cfc n ASP 78 Ca 0.00 0.39 -0.23 0.00 -1.51 0.00 0.00 54.79 53.44 1cfc n ASP 78 Cb 0.00 -0.39 0.01 0.00 2.34 0.00 0.00 41.12 43.08 1cfc n ASP 78 CO 0.00 0.00 0.00 1.07 0.12 0.00 0.00 177.20 178.39 1cfc n THR 79 N -1.38 2.22 -0.94 5.18 5.66 -1.26 -5.07 114.28 118.69 1cfc n THR 79 Ca 0.00 -4.42 -0.37 0.00 -3.05 0.00 0.00 64.05 56.21 1cfc n THR 79 Cb 0.03 -0.90 0.06 0.00 -1.55 0.00 0.00 70.33 67.97 1cfc n THR 79 CO 0.00 0.00 0.00 -0.90 -3.05 0.00 0.00 175.07 171.12 1cfc n ASP 80 N -0.52 -3.50 0.22 1.09 5.68 -0.51 -4.79 116.55 114.22 1cfc n ASP 80 Ca 0.36 0.03 0.13 0.00 -0.50 0.00 0.00 54.79 54.81 1cfc n ASP 80 Cb 0.78 -0.66 0.28 0.00 -1.14 0.00 0.00 41.12 40.38 1cfc n ASP 80 CO 0.00 0.00 0.00 -1.28 -1.33 0.00 0.00 177.20 174.59 1cfc h SER 81 N -1.19 0.00 -0.19 -1.12 0.87 -1.97 -3.20 113.55 106.75 1cfc h SER 81 Ca -0.43 0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.13 1cfc h SER 81 Cb 1.37 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 63.32 1cfc h SER 81 CO 0.25 0.00 0.12 -0.33 -0.53 0.00 0.00 176.83 176.33 1cfc h GLU 82 N 0.00 0.25 0.00 2.24 5.08 -1.95 0.06 114.58 120.26 1cfc h GLU 82 Ca 0.00 -0.02 -0.06 0.00 -1.00 0.00 0.00 59.36 58.28 1cfc h GLU 82 Cb 0.88 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 30.07 1cfc h GLU 82 CO 0.00 0.20 -0.30 0.93 -1.00 0.00 0.00 179.01 178.84 1cfc h GLU 83 N 0.23 0.00 -0.01 2.33 5.08 -1.88 -1.42 114.58 118.90 1cfc h GLU 83 Ca 0.07 0.00 -0.22 0.00 -1.00 0.00 0.00 59.36 58.21 1cfc h GLU 83 Cb 0.01 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.26 1cfc h GLU 83 CO -0.01 0.30 -0.91 0.93 -1.00 0.00 0.00 179.01 178.31 1cfc h GLU 84 N 0.00 0.41 0.03 2.33 5.08 -1.44 -1.84 114.58 119.15 1cfc h GLU 84 Ca -0.00 -0.43 -0.14 0.00 -1.00 0.00 0.00 59.36 57.79 1cfc h GLU 84 Cb 0.61 0.12 0.01 0.00 0.50 0.00 0.00 28.75 29.99 1cfc h GLU 84 CO 0.04 1.09 -0.58 0.82 -1.00 0.00 0.00 179.01 179.37 1cfc h ILE 85 N 0.24 1.47 -0.40 3.13 2.04 -0.71 -2.65 117.51 120.65 1cfc h ILE 85 Ca -0.07 -2.17 -0.05 0.00 1.00 0.00 0.00 64.86 63.57 1cfc h ILE 85 Cb 1.54 2.77 -0.02 0.00 -0.74 0.00 0.00 36.82 40.37 1cfc h ILE 85 CO 0.16 0.62 0.05 -0.09 0.00 0.00 0.00 178.15 178.88 1cfc h ARG 86 N -0.24 0.67 0.00 2.37 2.43 -1.35 0.12 114.38 118.38 1cfc h ARG 86 Ca -0.08 -0.19 -0.01 0.00 -0.81 0.00 0.00 59.98 58.89 1cfc h ARG 86 Cb 1.33 -0.07 -0.00 0.00 -0.42 0.00 0.00 29.97 30.81 1cfc h ARG 86 CO 0.11 0.73 -0.05 0.93 -1.51 0.00 0.00 179.97 180.18 1cfc h GLU 87 N 0.51 0.00 0.11 0.20 5.08 -1.41 0.33 114.58 119.39 1cfc h GLU 87 Ca 0.12 0.00 -0.14 0.00 -1.00 0.00 0.00 59.36 58.34 1cfc h GLU 87 Cb 0.40 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.66 1cfc h GLU 87 CO 0.01 0.05 -0.62 0.00 -1.00 0.00 0.00 179.01 177.45 1cfc h ALA 88 N 1.95 -0.07 0.00 3.43 0.00 -0.94 -2.61 119.26 121.03 1cfc h ALA 88 Ca -0.00 -0.65 -0.00 0.00 0.00 0.00 0.00 54.91 54.25 1cfc h ALA 88 Cb 0.17 0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.04 1cfc h ALA 88 CO 0.01 0.29 -0.01 0.74 0.00 0.00 0.00 179.25 180.28 1cfc h PHE 89 N -0.53 0.00 -0.20 0.00 0.04 0.28 0.79 116.94 117.32 1cfc h PHE 89 Ca -0.11 0.00 -0.08 0.00 2.80 0.00 0.00 57.97 60.58 1cfc h PHE 89 Cb 1.49 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 39.63 1cfc h PHE 89 CO 0.22 0.01 -0.18 -0.09 -0.60 0.00 0.00 178.31 177.66 1cfc h ARG 90 N 0.00 0.48 0.00 1.51 2.43 -0.25 -1.32 114.38 117.24 1cfc h ARG 90 Ca -0.00 -0.25 0.00 0.00 -0.81 0.00 0.00 59.98 58.92 1cfc h ARG 90 Cb 0.03 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.59 1cfc h ARG 90 CO 0.00 0.82 0.25 0.28 -1.51 0.00 0.00 179.97 179.81 1cfc h VAL 91 N 0.16 0.00 0.00 0.20 2.07 -0.46 0.17 116.25 118.39 1cfc h VAL 91 Ca 0.03 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.55 1cfc h VAL 91 Cb 0.72 0.66 0.00 0.00 -1.52 0.00 0.00 31.29 31.15 1cfc h VAL 91 CO 0.05 0.00 -1.39 0.49 0.02 0.00 0.00 177.57 176.74 1cfc n PHE 92 N -2.76 0.01 -2.05 1.57 3.01 -0.60 -4.48 117.46 112.17 1cfc n PHE 92 Ca -0.02 0.00 -0.40 0.00 1.01 0.00 0.00 57.45 58.04 1cfc n PHE 92 Cb 0.30 -0.22 -0.00 0.00 -0.01 0.00 0.00 39.48 39.54 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 -1.82 7.80 0.33 4.37 -0.08 0.60 -4.68 116.55 123.07 1cfc n ASP 93 Ca 0.01 -3.16 0.22 0.00 -1.51 0.00 0.00 54.79 50.35 1cfc n ASP 93 Cb 0.43 -1.36 1.16 0.00 2.34 0.00 0.00 41.12 43.69 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 4.67 0.00 -0.54 -0.67 1.57 -1.79 -0.06 116.57 119.75 1cfc h LYS 94 Ca 0.67 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.45 1cfc h LYS 94 Cb 0.33 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.64 1cfc h LYS 94 CO 1.48 0.00 0.00 -3.47 -0.57 0.00 0.00 179.45 176.89 1cfc n ASP 95 N -3.06 3.65 -3.48 0.86 2.03 -1.26 -4.93 116.55 110.35 1cfc n ASP 95 Ca -0.03 -1.99 -0.24 0.00 0.52 0.00 0.00 54.79 53.05 1cfc n ASP 95 Cb 0.09 -0.35 -0.01 0.00 -0.72 0.00 0.00 41.12 40.12 1cfc n ASP 95 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1cfc n GLY 96 N 1.58 -0.47 1.08 0.27 0.00 -0.04 -4.78 105.19 102.83 1cfc n GLY 96 Ca 0.22 0.08 0.12 0.00 0.00 0.00 0.00 46.02 46.44 1cfc n GLY 96 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1cfc n ASN 97 N -2.27 3.27 0.00 1.61 0.23 -1.26 -4.92 115.26 111.93 1cfc n ASN 97 Ca 0.01 -1.98 0.00 0.00 -0.53 0.00 0.00 54.58 52.08 1cfc n ASN 97 Cb 0.52 -0.18 0.00 0.00 -2.08 0.00 0.00 39.78 38.04 1cfc n ASN 97 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1cfc n GLY 98 N 1.46 0.70 3.24 4.83 0.00 -1.26 -4.91 105.19 109.25 1cfc n GLY 98 Ca 0.18 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.97 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 -1.72 1.62 0.27 1.61 1.51 -1.26 -4.39 117.35 115.00 1cfc s TYR 99 Ca 0.00 -0.41 0.04 0.00 -1.01 0.00 0.00 57.07 55.69 1cfc s TYR 99 Cb 0.00 -0.92 -0.03 0.00 -0.11 0.00 0.00 41.96 40.90 1cfc s TYR 99 CO 0.00 0.13 0.22 0.96 -1.11 0.00 0.00 175.55 175.75 1cfc s ILE 100 N -1.07 0.00 0.23 2.71 -4.36 -1.00 -4.91 121.20 112.80 1cfc s ILE 100 Ca 0.05 -2.00 -0.29 0.00 -0.26 0.00 0.00 60.65 58.15 1cfc s ILE 100 Cb -0.09 -2.50 -0.09 0.00 1.25 0.00 0.00 42.46 41.03 1cfc s ILE 100 CO 0.03 0.00 0.91 -0.94 0.24 0.00 0.00 174.94 175.18 1cfc s SER 101 N -3.28 7.56 0.42 4.36 1.04 -1.26 -1.20 113.70 121.34 1cfc s SER 101 Ca 0.40 1.88 0.24 0.00 0.48 0.00 0.00 55.95 58.95 1cfc s SER 101 Cb 0.04 -2.58 1.28 0.00 0.10 0.00 0.00 66.02 64.85 1cfc s SER 101 CO 0.21 0.14 1.69 0.00 0.98 0.00 0.00 173.24 176.26 1cfc h ALA 102 N 4.07 2.48 0.09 5.32 0.00 -1.90 0.27 119.26 129.59 1cfc h ALA 102 Ca -0.46 0.10 -0.00 0.00 0.00 0.00 0.00 54.91 54.55 1cfc h ALA 102 Cb 1.20 0.13 0.00 0.00 0.00 0.00 0.00 17.79 19.12 1cfc h ALA 102 CO 0.67 -1.02 -0.04 0.00 0.00 0.00 0.00 179.25 178.86 1cfc h ALA 103 N 1.62 -0.70 -0.44 0.00 0.00 -1.91 0.39 119.26 118.22 1cfc h ALA 103 Ca 0.72 -0.03 0.13 0.00 0.00 0.00 0.00 54.91 55.73 1cfc h ALA 103 Cb 2.08 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 19.90 1cfc h ALA 103 CO -0.38 -0.69 0.58 1.05 0.00 0.00 0.00 179.25 179.81 1cfc h GLU 104 N -0.16 0.00 0.02 0.00 4.11 -1.77 0.61 114.58 117.39 1cfc h GLU 104 Ca -0.01 0.00 -0.00 0.00 0.07 0.00 0.00 59.36 59.42 1cfc h GLU 104 Cb 0.09 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.34 1cfc h GLU 104 CO 0.02 0.00 -0.01 1.25 0.07 0.00 0.00 179.01 180.34 1cfc h LEU 105 N 0.00 -0.02 -2.18 3.06 6.46 -0.26 -0.53 115.31 121.83 1cfc h LEU 105 Ca 0.21 -0.70 0.02 0.00 -0.12 0.00 0.00 57.88 57.30 1cfc h LEU 105 Cb 1.36 0.01 -0.00 0.00 -0.73 0.00 0.00 40.66 41.29 1cfc h LEU 105 CO -0.00 0.72 0.07 0.03 -0.62 0.00 0.00 178.44 178.64 1cfc h ARG 106 N -0.79 0.00 -0.09 1.25 3.08 0.39 -0.43 114.38 117.78 1cfc h ARG 106 Ca -0.00 0.00 -0.17 0.00 0.07 0.00 0.00 59.98 59.87 1cfc h ARG 106 Cb 0.72 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.78 1cfc h ARG 106 CO 0.00 0.00 -0.62 1.25 -1.07 0.00 0.00 179.97 179.54 1cfc h HIS 107 N 0.00 0.80 -1.01 3.04 2.76 0.14 -2.65 115.15 118.24 1cfc h HIS 107 Ca 0.04 -0.37 0.23 0.00 -2.20 0.00 0.00 60.37 58.07 1cfc h HIS 107 Cb 0.19 -0.12 -0.10 0.00 1.55 0.00 0.00 27.41 28.92 1cfc h HIS 107 CO 0.00 1.17 0.62 0.28 -1.30 0.00 0.00 177.93 178.70 1cfc h VAL 108 N 0.21 0.61 0.00 5.26 2.07 0.61 0.33 116.25 125.34 1cfc h VAL 108 Ca -0.05 -0.20 -0.18 0.00 0.82 0.00 0.00 66.70 67.10 1cfc h VAL 108 Cb 1.27 -0.02 -0.02 0.00 -1.52 0.00 0.00 31.29 31.00 1cfc h VAL 108 CO 0.13 0.11 -0.82 0.24 0.02 0.00 0.00 177.57 177.24 1cfc h MET 109 N 0.58 0.06 0.09 1.57 2.07 -1.34 -3.06 114.93 114.90 1cfc h MET 109 Ca 0.59 -0.06 -0.23 0.00 -2.07 0.00 0.00 59.70 57.93 1cfc h MET 109 Cb 1.18 0.02 -0.00 0.00 -1.87 0.00 0.00 31.60 30.92 1cfc h MET 109 CO -0.36 0.84 -1.19 1.79 1.07 0.00 0.00 176.91 179.05 1cfc h THR 110 N 0.03 1.14 0.00 2.22 1.35 -0.38 -3.34 112.91 113.93 1cfc h THR 110 Ca -0.02 -2.38 -0.02 0.00 -0.55 0.00 0.00 66.41 63.45 1cfc h THR 110 Cb 1.44 2.76 -0.00 0.00 -1.73 0.00 0.00 68.15 70.62 1cfc h THR 110 CO 0.11 0.64 -0.07 0.78 -0.25 0.00 0.00 175.52 176.73 1cfc h ASN 111 N -0.47 0.00 -0.00 5.36 4.21 -0.62 -1.68 115.58 122.37 1cfc h ASN 111 Ca -0.26 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.25 1cfc h ASN 111 Cb 1.61 0.00 -0.00 0.00 -1.12 0.00 0.00 38.32 38.81 1cfc h ASN 111 CO 0.03 0.07 0.00 -0.07 -1.29 0.00 0.00 177.43 176.17 1cfc h LEU 112 N 0.00 0.00 0.00 1.61 3.38 -1.65 -3.45 115.31 115.19 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 0.16 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.91 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 -1.41 1.15 3.82 0.83 0.00 -0.63 -5.06 105.19 103.88 1cfc n GLY 113 Ca -0.03 -0.46 -0.33 0.00 0.00 0.00 0.00 46.02 45.20 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 -2.44 4.20 0.00 1.61 0.41 -1.26 -4.89 118.70 116.33 1cfc s GLU 114 Ca 0.00 1.12 -0.02 0.00 -0.41 0.00 0.00 54.97 55.66 1cfc s GLU 114 Cb 0.00 -2.17 -0.10 0.00 -1.78 0.00 0.00 34.13 30.07 1cfc s GLU 114 CO 0.00 -0.06 2.58 1.63 -0.49 0.00 0.00 175.26 178.93 1cfc n LYS 115 N -0.70 1.36 -2.76 1.61 4.01 -1.26 -4.86 118.16 115.56 1cfc n LYS 115 Ca 0.07 -0.38 -0.39 0.00 -0.51 0.00 0.00 58.31 57.10 1cfc n LYS 115 Cb 0.54 -1.39 -0.06 0.00 -0.51 0.00 0.00 35.03 33.61 1cfc n LYS 115 CO 0.00 0.00 0.00 -0.48 -1.11 0.00 0.00 177.40 175.81 1cfc s LEU 116 N 0.00 4.54 0.00 -0.35 0.05 -1.26 -5.06 118.68 116.60 1cfc s LEU 116 Ca 0.25 1.91 0.01 0.00 0.05 0.00 0.00 54.13 56.35 1cfc s LEU 116 Cb 0.12 -3.75 -0.04 0.00 -2.05 0.00 0.00 46.19 40.47 1cfc s LEU 116 CO 0.00 0.08 0.05 0.42 -0.55 0.00 0.00 176.35 176.35 1cfc s THR 117 N -1.34 4.50 0.59 5.48 -4.23 -1.26 -4.98 115.64 114.40 1cfc s THR 117 Ca 0.44 -0.51 0.29 0.00 -1.18 0.00 0.00 61.69 60.73 1cfc s THR 117 Cb -0.23 -3.05 0.36 0.00 1.34 0.00 0.00 72.50 70.92 1cfc s THR 117 CO 0.29 0.34 2.08 0.44 -0.54 0.00 0.00 174.62 177.22 1cfc h ASP 118 N 4.11 0.00 -0.02 3.99 3.32 -2.01 -1.89 116.42 123.92 1cfc h ASP 118 Ca -0.49 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 56.51 1cfc h ASP 118 Cb 1.18 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.73 1cfc h ASP 118 CO 0.61 0.00 -0.17 -0.33 -1.72 0.00 0.00 179.24 177.63 1cfc h GLU 119 N 0.00 0.16 -0.84 3.56 3.07 -2.00 -2.83 114.58 115.69 1cfc h GLU 119 Ca 0.10 -0.14 0.12 0.00 -0.50 0.00 0.00 59.36 58.94 1cfc h GLU 119 Cb 0.57 0.03 -0.08 0.00 -0.84 0.00 0.00 28.75 28.42 1cfc h GLU 119 CO -0.00 0.81 0.46 0.93 -1.40 0.00 0.00 179.01 179.81 1cfc h GLU 120 N -0.45 0.70 -0.69 2.33 5.08 -1.75 -0.70 114.58 119.09 1cfc h GLU 120 Ca -0.01 -0.04 -0.06 0.00 -1.00 0.00 0.00 59.36 58.24 1cfc h GLU 120 Cb 0.85 -0.16 -0.03 0.00 0.50 0.00 0.00 28.75 29.92 1cfc h GLU 120 CO 0.03 0.46 0.18 0.28 -1.00 0.00 0.00 179.01 178.97 1cfc h VAL 121 N 0.72 1.26 -0.84 3.13 2.07 -1.54 -1.97 116.25 119.08 1cfc h VAL 121 Ca 0.43 -0.94 0.21 0.00 0.82 0.00 0.00 66.70 67.22 1cfc h VAL 121 Cb 0.50 0.55 -0.05 0.00 -1.52 0.00 0.00 31.29 30.78 1cfc h VAL 121 CO -0.30 0.36 0.58 0.44 0.02 0.00 0.00 177.57 178.67 1cfc h ASP 122 N 1.03 0.21 -0.01 0.57 5.19 -0.87 0.40 116.42 122.94 1cfc h ASP 122 Ca 0.22 0.02 -0.12 0.00 -0.62 0.00 0.00 57.03 56.53 1cfc h ASP 122 Cb 0.35 -0.02 0.01 0.00 0.18 0.00 0.00 39.33 39.85 1cfc h ASP 122 CO -0.00 0.08 -0.46 -0.08 -3.12 0.00 0.00 179.24 175.67 1cfc h GLU 123 N 0.21 0.33 -0.02 3.56 4.81 -1.17 -2.53 114.58 119.78 1cfc h GLU 123 Ca 0.42 -0.34 0.01 0.00 -0.13 0.00 0.00 59.36 59.31 1cfc h GLU 123 Cb 1.32 0.09 -0.00 0.00 0.63 0.00 0.00 28.75 30.79 1cfc h GLU 123 CO -0.09 1.02 0.02 0.52 -0.73 0.00 0.00 179.01 179.75 1cfc h MET 124 N -0.22 0.00 0.00 1.92 2.86 -0.33 -0.46 114.93 118.69 1cfc h MET 124 Ca -0.05 0.00 -0.15 0.00 -2.06 0.00 0.00 59.70 57.44 1cfc h MET 124 Cb 1.17 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.81 1cfc h MET 124 CO 0.09 0.00 -0.69 0.82 1.06 0.00 0.00 176.91 178.19 1cfc h ILE 125 N 0.00 1.19 0.29 -1.22 2.04 -0.22 -3.13 117.51 116.46 1cfc h ILE 125 Ca 0.01 -2.68 0.00 0.00 1.00 0.00 0.00 64.86 63.19 1cfc h ILE 125 Cb 0.05 2.59 -0.02 0.00 -0.74 0.00 0.00 36.82 38.69 1cfc h ILE 125 CO -0.00 0.68 -0.28 0.03 0.00 0.00 0.00 178.15 178.58 1cfc h ARG 126 N 0.00 -0.58 0.00 2.37 3.08 -0.63 -2.73 114.38 115.88 1cfc h ARG 126 Ca -0.01 0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.08 1cfc h ARG 126 Cb 1.53 0.13 0.00 0.00 0.08 0.00 0.00 29.97 31.71 1cfc h ARG 126 CO 0.09 -0.39 0.00 0.93 -1.07 0.00 0.00 179.97 179.53 1cfc h GLU 127 N -0.60 0.00 -4.20 0.04 5.08 -1.69 -3.36 114.58 109.84 1cfc h GLU 127 Ca -0.01 0.00 -0.75 0.00 -1.00 0.00 0.00 59.36 57.60 1cfc h GLU 127 Cb 0.55 0.00 -0.18 0.00 0.50 0.00 0.00 28.75 29.62 1cfc h GLU 127 CO -0.05 0.00 1.51 0.00 -1.00 0.00 0.00 179.01 179.47 1cfc n ALA 128 N -1.96 4.44 -1.10 3.43 0.00 -1.03 -4.90 120.51 119.38 1cfc n ALA 128 Ca 0.05 -4.31 -0.06 0.00 0.00 0.00 0.00 53.44 49.11 1cfc n ALA 128 Cb 0.48 -2.97 -0.07 0.00 0.00 0.00 0.00 19.45 16.89 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 4.72 -1.76 -0.00 0.00 2.03 -1.26 -4.57 116.55 115.71 1cfc n ASP 129 Ca 0.37 -1.10 0.14 0.00 0.52 0.00 0.00 54.79 54.71 1cfc n ASP 129 Cb 0.40 -0.55 0.80 0.00 -0.72 0.00 0.00 41.12 41.05 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 4.59 0.00 -2.26 5.18 5.41 -1.26 -4.75 119.36 126.27 1cfc n ILE 130 Ca 0.20 -0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.95 1cfc n ILE 130 Cb 0.37 -0.42 0.00 0.00 -0.71 0.00 0.00 39.64 38.88 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 -0.92 0.74 0.00 4.38 -0.08 -1.26 -4.30 116.55 115.11 1cfc n ASP 131 Ca 0.20 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.48 1cfc n ASP 131 Cb 0.09 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.55 1cfc n ASP 131 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1cfc n GLY 132 N 5.00 1.42 0.00 0.27 0.00 -1.26 -4.30 105.19 106.32 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 1.34 0.00 0.00 0.00 173.32 174.66 1cfc n ASP 133 N 0.55 0.00 0.00 1.61 -0.08 -1.26 -5.09 116.55 112.27 1cfc n ASP 133 Ca 0.00 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.28 1cfc n ASP 133 Cb 0.00 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.46 1cfc n ASP 133 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1cfc n GLY 134 N 1.92 0.67 3.43 0.27 0.00 -1.26 -5.13 105.19 105.09 1cfc n GLY 134 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 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 1.54 0.03 1.61 -0.21 -1.26 -3.77 119.66 117.60 1cfc s GLN 135 Ca 0.00 -1.32 0.01 0.00 0.02 0.00 0.00 55.36 54.07 1cfc s GLN 135 Cb 0.00 -1.96 -0.02 0.00 1.00 0.00 0.00 33.01 32.03 1cfc s GLN 135 CO 0.00 0.45 -0.05 0.08 -2.12 0.00 0.00 175.29 173.66 1cfc s VAL 136 N -1.17 0.25 0.93 1.09 1.01 -0.34 -4.91 120.40 117.26 1cfc s VAL 136 Ca 0.16 -0.96 -0.14 0.00 0.00 0.00 0.00 61.98 61.05 1cfc s VAL 136 Cb -0.10 -0.38 0.19 0.00 0.00 0.00 0.00 36.38 36.09 1cfc s VAL 136 CO 0.08 -0.46 1.28 0.21 0.00 0.00 0.00 175.10 176.21 1cfc s ASN 137 N -1.49 3.31 -0.08 3.32 2.47 -1.26 -2.38 114.94 118.83 1cfc s ASN 137 Ca -0.14 0.18 0.08 0.00 0.42 0.00 0.00 52.86 53.40 1cfc s ASN 137 Cb -0.10 -0.28 -0.11 0.00 -1.45 0.00 0.00 41.25 39.31 1cfc s ASN 137 CO -0.01 -2.60 0.04 0.00 -3.72 0.00 0.00 177.10 170.81 1cfc n TYR 138 N -3.63 0.00 -0.33 0.43 4.11 -1.26 -4.57 117.16 111.91 1cfc n TYR 138 Ca 0.15 0.00 0.24 0.00 -0.00 0.00 0.00 57.90 58.29 1cfc n TYR 138 Cb 0.60 -0.42 0.45 0.00 -0.00 0.00 0.00 39.34 39.97 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 -2.29 -0.07 -0.06 -3.48 4.71 -1.26 0.12 120.64 118.30 1cfc n GLU 139 Ca -0.13 1.43 -0.15 0.00 -0.01 0.00 0.00 57.16 58.29 1cfc n GLU 139 Cb 0.75 -2.42 -0.06 0.00 -1.01 0.00 0.00 31.44 28.71 1cfc n GLU 139 CO 0.00 0.00 0.00 0.93 0.09 0.00 0.00 177.13 178.15 1cfc h GLU 140 N 0.00 0.65 0.00 3.49 5.08 -2.01 -2.94 114.58 118.85 1cfc h GLU 140 Ca 0.73 -0.43 -0.00 0.00 -1.00 0.00 0.00 59.36 58.67 1cfc h GLU 140 Cb 1.77 0.05 -0.00 0.00 0.50 0.00 0.00 28.75 31.08 1cfc h GLU 140 CO -0.84 1.04 -0.00 0.74 -1.00 0.00 0.00 179.01 178.95 1cfc h PHE 141 N 0.35 0.00 -0.01 4.33 0.04 0.58 -2.92 116.94 119.31 1cfc h PHE 141 Ca 0.01 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.77 1cfc h PHE 141 Cb 1.03 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.18 1cfc h PHE 141 CO 0.09 0.00 -0.02 0.28 -0.60 0.00 0.00 178.31 178.06 1cfc h VAL 142 N 0.00 1.44 0.00 -0.55 2.07 0.11 -2.95 116.25 116.37 1cfc h VAL 142 Ca -0.00 -1.33 -0.01 0.00 0.82 0.00 0.00 66.70 66.18 1cfc h VAL 142 Cb 0.57 2.31 -0.00 0.00 -1.52 0.00 0.00 31.29 32.65 1cfc h VAL 142 CO 0.00 0.35 -0.04 1.56 0.02 0.00 0.00 177.57 179.46 1cfc h GLN 143 N -0.51 0.00 -0.12 1.57 4.20 -1.49 -2.86 115.11 115.89 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 0.58 0.00 0.01 0.00 0.30 0.00 0.00 27.48 28.37 1cfc h GLN 143 CO 0.00 0.04 -0.79 0.52 -0.67 0.00 0.00 178.83 177.94 1cfc h MET 144 N 0.00 0.67 0.00 1.46 2.86 -1.42 -3.13 114.93 115.37 1cfc h MET 144 Ca -0.00 -0.56 -0.03 0.00 -2.06 0.00 0.00 59.70 57.05 1cfc h MET 144 Cb 0.41 0.12 -0.00 0.00 0.06 0.00 0.00 31.60 32.19 1cfc h MET 144 CO 0.01 1.18 -0.12 0.52 1.06 0.00 0.00 176.91 179.55 1cfc h MET 145 N 0.45 0.00 0.25 1.72 2.86 -1.34 -3.06 114.93 115.81 1cfc h MET 145 Ca -0.05 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.58 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 0.15 0.12 -0.12 1.79 1.06 0.00 0.00 176.91 179.91 1cfc h THR 146 N 0.00 0.72 0.00 2.22 1.35 -1.52 -2.89 112.91 112.79 1cfc h THR 146 Ca -0.00 -0.85 0.00 0.00 -0.55 0.00 0.00 66.41 65.01 1cfc h THR 146 Cb 0.65 1.13 0.00 0.00 -1.73 0.00 0.00 68.15 68.20 1cfc h THR 146 CO 0.02 0.16 0.00 0.00 -0.25 0.00 0.00 175.52 175.44 1cfc n ALA 147 N -2.54 2.26 -1.39 6.62 0.00 -1.22 -4.96 120.51 119.28 1cfc n ALA 147 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.36 1cfc n ALA 147 Cb 0.26 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.71 1cfc n ALA 147 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13