#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 1.07 -4.76 0.00 2.03 -1.26 -4.26 116.55 109.37 1cfc n ASP 2 Ca 0.00 -2.06 -0.39 0.00 0.52 0.00 0.00 54.79 52.86 1cfc n ASP 2 Cb 0.00 -0.29 0.02 0.00 -0.72 0.00 0.00 41.12 40.13 1cfc n ASP 2 CO 0.00 0.00 0.00 -1.10 -1.92 0.00 0.00 177.20 174.18 1cfc s GLN 3 N -1.57 3.60 -0.24 -0.67 -0.21 -1.26 -4.93 119.66 114.38 1cfc s GLN 3 Ca 0.07 2.30 -0.29 0.00 0.02 0.00 0.00 55.36 57.47 1cfc s GLN 3 Cb 0.05 -2.56 0.01 0.00 1.00 0.00 0.00 33.01 31.50 1cfc s GLN 3 CO 0.03 -0.85 1.04 -0.51 -2.12 0.00 0.00 175.29 172.89 1cfc s LEU 4 N -2.89 4.08 0.59 2.90 1.43 -1.26 -5.02 118.68 118.51 1cfc s LEU 4 Ca 0.63 1.32 -0.16 0.00 -1.03 0.00 0.00 54.13 54.89 1cfc s LEU 4 Cb -0.41 -3.53 -0.04 0.00 0.03 0.00 0.00 46.19 42.24 1cfc s LEU 4 CO 0.52 -0.69 1.07 0.42 0.23 0.00 0.00 176.35 177.89 1cfc s THR 5 N 3.25 3.69 0.44 5.49 -4.23 -1.26 -4.82 115.64 118.19 1cfc s THR 5 Ca 0.44 0.83 0.19 0.00 -1.18 0.00 0.00 61.69 61.97 1cfc s THR 5 Cb -0.15 -3.34 0.39 0.00 1.34 0.00 0.00 72.50 70.75 1cfc s THR 5 CO 0.07 -0.44 1.87 -0.33 -0.54 0.00 0.00 174.62 175.24 1cfc h GLU 6 N 0.50 0.34 0.16 3.99 5.08 -1.99 -0.87 114.58 121.79 1cfc h GLU 6 Ca -0.47 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 57.86 1cfc h GLU 6 Cb 1.23 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 30.40 1cfc h GLU 6 CO 0.57 0.22 -0.08 0.93 -1.00 0.00 0.00 179.01 179.66 1cfc h GLU 7 N 0.35 -0.20 -0.89 2.33 4.39 -1.98 -0.41 114.58 118.16 1cfc h GLU 7 Ca 0.45 0.01 0.16 0.00 0.34 0.00 0.00 59.36 60.32 1cfc h GLU 7 Cb 1.21 0.05 -0.07 0.00 -0.10 0.00 0.00 28.75 29.84 1cfc h GLU 7 CO -0.15 0.15 0.58 1.96 -1.16 0.00 0.00 179.01 180.38 1cfc h GLN 8 N -0.59 0.62 -0.20 2.33 4.20 -1.56 0.18 115.11 120.09 1cfc h GLN 8 Ca -0.02 -0.04 -0.17 0.00 0.06 0.00 0.00 58.65 58.48 1cfc h GLN 8 Cb 0.45 -0.14 -0.00 0.00 0.30 0.00 0.00 27.48 28.09 1cfc h GLN 8 CO 0.04 0.41 -0.58 0.82 -0.67 0.00 0.00 178.83 178.84 1cfc h ILE 9 N 0.64 1.31 0.00 2.54 2.04 -1.06 -2.80 117.51 120.18 1cfc h ILE 9 Ca 0.46 -1.83 0.00 0.00 1.00 0.00 0.00 64.86 64.49 1cfc h ILE 9 Cb 0.81 1.79 0.00 0.00 -0.74 0.00 0.00 36.82 38.67 1cfc h ILE 9 CO -0.21 0.57 0.00 0.00 0.00 0.00 0.00 178.15 178.51 1cfc h ALA 10 N 0.88 1.00 0.04 1.87 0.00 0.98 -1.47 119.26 122.56 1cfc h ALA 10 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 1cfc h ALA 10 Cb 1.15 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.94 1cfc h ALA 10 CO 0.11 0.00 -0.02 1.49 0.00 0.00 0.00 179.25 180.83 1cfc h GLU 11 N 0.00 -0.05 -0.43 0.00 4.81 -0.66 -2.94 114.58 115.32 1cfc h GLU 11 Ca 0.00 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.22 1cfc h GLU 11 Cb 0.60 0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.97 1cfc h GLU 11 CO 0.00 0.55 0.20 0.74 -0.73 0.00 0.00 179.01 179.77 1cfc h PHE 12 N -0.94 0.58 -0.35 0.92 0.04 -1.49 -1.61 116.94 114.10 1cfc h PHE 12 Ca -0.01 -0.01 0.03 0.00 2.80 0.00 0.00 57.97 60.79 1cfc h PHE 12 Cb 0.63 -0.19 -0.03 0.00 2.20 0.00 0.00 35.95 38.56 1cfc h PHE 12 CO 0.16 0.44 0.14 -0.22 -0.60 0.00 0.00 178.31 178.23 1cfc h LYS 13 N 0.60 0.29 0.59 1.51 3.64 -1.31 0.58 116.57 122.46 1cfc h LYS 13 Ca 0.15 -0.02 -0.03 0.00 -1.27 0.00 0.00 60.65 59.48 1cfc h LYS 13 Cb 0.08 -0.07 0.01 0.00 -0.41 0.00 0.00 32.23 31.84 1cfc h LYS 13 CO -0.02 0.19 -0.28 0.93 -2.27 0.00 0.00 179.45 178.00 1cfc h GLU 14 N 0.30 -0.76 -0.83 1.90 4.39 -1.21 0.15 114.58 118.52 1cfc h GLU 14 Ca 0.15 0.05 0.22 0.00 0.34 0.00 0.00 59.36 60.12 1cfc h GLU 14 Cb 0.10 0.17 -0.04 0.00 -0.10 0.00 0.00 28.75 28.88 1cfc h GLU 14 CO -0.14 -0.46 0.58 0.00 -1.16 0.00 0.00 179.01 177.83 1cfc h ALA 15 N -0.64 2.53 0.02 3.43 0.00 -1.05 0.12 119.26 123.67 1cfc h ALA 15 Ca -0.08 -0.01 -0.21 0.00 0.00 0.00 0.00 54.91 54.61 1cfc h ALA 15 Cb 0.66 0.02 0.02 0.00 0.00 0.00 0.00 17.79 18.49 1cfc h ALA 15 CO 0.13 -0.78 -0.83 0.35 0.00 0.00 0.00 179.25 178.12 1cfc h PHE 16 N 0.16 0.81 -0.09 0.00 3.57 0.71 -3.25 116.94 118.84 1cfc h PHE 16 Ca 0.41 -0.45 -0.09 0.00 3.53 0.00 0.00 57.97 61.37 1cfc h PHE 16 Cb 1.36 -0.09 -0.01 0.00 2.79 0.00 0.00 35.95 40.00 1cfc h PHE 16 CO -0.00 1.28 -0.36 0.66 -2.23 0.00 0.00 178.31 177.66 1cfc h SER 17 N 0.11 0.19 0.00 0.41 4.64 0.13 -2.63 113.55 116.40 1cfc h SER 17 Ca -0.11 -0.07 0.00 0.00 -0.47 0.00 0.00 61.79 61.14 1cfc h SER 17 Cb 1.52 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 63.56 1cfc h SER 17 CO 0.16 0.54 0.39 -0.07 -0.87 0.00 0.00 176.83 176.98 1cfc h LEU 18 N 0.16 0.00 -2.81 5.97 3.38 -0.89 0.54 115.31 121.66 1cfc h LEU 18 Ca 0.02 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 1cfc h LEU 18 Cb 0.71 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.44 1cfc h LEU 18 CO 0.05 0.00 -0.24 0.49 0.09 0.00 0.00 178.44 178.83 1cfc n PHE 19 N -2.81 0.00 -2.95 1.13 3.01 -1.00 -4.86 117.46 109.98 1cfc n PHE 19 Ca -0.02 -0.88 -0.43 0.00 1.01 0.00 0.00 57.45 57.14 1cfc n PHE 19 Cb 0.43 -0.15 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 -1.00 6.54 0.00 4.37 2.03 0.18 -4.66 116.55 124.00 1cfc n ASP 20 Ca 0.13 -3.45 0.11 0.00 0.52 0.00 0.00 54.79 52.10 1cfc n ASP 20 Cb 0.69 -1.26 0.60 0.00 -0.72 0.00 0.00 41.12 40.43 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 1.18 0.55 -0.11 -0.67 4.76 -1.26 -2.42 118.16 120.19 1cfc n LYS 21 Ca 0.29 0.03 0.12 0.00 -2.87 0.00 0.00 58.31 55.88 1cfc n LYS 21 Cb 0.32 -1.50 0.17 0.00 -1.84 0.00 0.00 35.03 32.19 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 -1.10 3.22 -1.02 4.39 8.00 -1.26 -4.91 116.55 123.87 1cfc n ASP 22 Ca 0.14 -1.99 -0.07 0.00 0.71 0.00 0.00 54.79 53.58 1cfc n ASP 22 Cb 0.11 -0.14 -0.03 0.00 -0.02 0.00 0.00 41.12 41.04 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 1.44 0.68 1.00 0.44 0.00 -1.01 -4.67 105.19 103.06 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 0.25 3.10 -0.65 1.61 2.03 -1.26 -4.94 116.55 116.68 1cfc n ASP 24 Ca -0.07 -1.99 -0.06 0.00 0.52 0.00 0.00 54.79 53.19 1cfc n ASP 24 Cb 0.27 -0.06 -0.00 0.00 -0.72 0.00 0.00 41.12 40.61 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 0.17 3.18 0.27 0.00 -1.26 -5.03 105.19 103.92 1cfc n GLY 25 Ca 0.15 -0.65 -0.11 0.00 0.00 0.00 0.00 46.02 45.41 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 -2.29 0.04 0.14 2.61 -4.23 -1.26 -3.53 115.64 107.12 1cfc s THR 26 Ca 0.00 -1.96 -0.01 0.00 -1.18 0.00 0.00 61.69 58.54 1cfc s THR 26 Cb 0.00 -2.33 -0.04 0.00 1.34 0.00 0.00 72.50 71.47 1cfc s THR 26 CO 0.00 -0.17 0.06 0.27 -0.54 0.00 0.00 174.62 174.25 1cfc s ILE 27 N -4.12 0.09 0.46 2.99 -4.36 -0.19 -4.39 121.20 111.68 1cfc s ILE 27 Ca 0.33 -1.92 -0.00 0.00 -0.26 0.00 0.00 60.65 58.80 1cfc s ILE 27 Cb 0.07 -2.10 -0.01 0.00 1.25 0.00 0.00 42.46 41.68 1cfc s ILE 27 CO 0.08 -0.41 0.69 0.42 0.24 0.00 0.00 174.94 175.96 1cfc s THR 28 N -4.06 4.09 0.35 8.37 -4.23 -1.26 -0.83 115.64 118.07 1cfc s THR 28 Ca 0.26 -0.41 0.15 0.00 -1.18 0.00 0.00 61.69 60.50 1cfc s THR 28 Cb 0.07 -3.52 0.11 0.00 1.34 0.00 0.00 72.50 70.50 1cfc s THR 28 CO 0.03 -0.39 1.84 0.71 -0.54 0.00 0.00 174.62 176.27 1cfc h THR 29 N 0.36 1.16 0.00 3.99 1.35 -1.83 -2.35 112.91 115.59 1cfc h THR 29 Ca -0.46 -1.24 -0.02 0.00 -0.55 0.00 0.00 66.41 64.14 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 0.34 -0.08 0.11 -0.25 0.00 0.00 175.52 176.22 1cfc h LYS 30 N 0.00 0.00 -0.67 4.72 1.57 -1.93 -1.22 116.57 119.04 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 0.66 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.97 1cfc h LYS 30 CO 0.05 0.08 0.00 0.39 -0.57 0.00 0.00 179.45 179.40 1cfc n GLU 31 N -4.00 3.40 -0.01 3.15 1.02 -0.89 -4.48 120.64 118.82 1cfc n GLU 31 Ca -0.03 -2.81 -0.13 0.00 -0.02 0.00 0.00 57.16 54.18 1cfc n GLU 31 Cb 0.17 -1.78 -0.10 0.00 -0.02 0.00 0.00 31.44 29.71 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 4.09 -0.01 -1.84 -4.62 5.85 -1.15 -2.29 115.31 115.34 1cfc h LEU 32 Ca 0.00 -0.50 -0.02 0.00 0.84 0.00 0.00 57.88 58.19 1cfc h LEU 32 Cb 1.29 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.32 1cfc h LEU 32 CO 0.15 0.50 -0.10 1.23 -0.34 0.00 0.00 178.44 179.88 1cfc h GLY 33 N -0.53 0.00 1.17 3.75 0.00 -1.79 -2.55 103.07 103.12 1cfc h GLY 33 Ca -0.00 0.00 -0.24 0.00 0.00 0.00 0.00 47.33 47.09 1cfc h GLY 33 CO 0.00 0.00 -0.87 -0.84 0.00 0.00 0.00 176.54 174.83 1cfc h THR 34 N 0.00 1.28 -0.07 4.70 2.02 -1.78 -2.14 112.91 116.92 1cfc h THR 34 Ca -0.00 -2.07 -0.01 0.00 0.77 0.00 0.00 66.41 65.09 1cfc h THR 34 Cb 0.39 2.15 -0.00 0.00 -1.74 0.00 0.00 68.15 68.95 1cfc h THR 34 CO 0.01 0.65 -0.01 0.58 0.37 0.00 0.00 175.52 177.13 1cfc h VAL 35 N 0.46 1.26 -0.59 3.16 2.07 -1.07 -2.47 116.25 119.08 1cfc h VAL 35 Ca -0.08 -0.83 0.07 0.00 0.82 0.00 0.00 66.70 66.68 1cfc h VAL 35 Cb 1.51 1.68 -0.04 0.00 -1.52 0.00 0.00 31.29 32.93 1cfc h VAL 35 CO 0.18 0.23 0.39 0.24 0.02 0.00 0.00 177.57 178.63 1cfc h MET 36 N -0.17 0.49 -0.47 1.57 2.86 -1.52 0.16 114.93 117.84 1cfc h MET 36 Ca 0.02 -0.03 -0.05 0.00 -2.06 0.00 0.00 59.70 57.58 1cfc h MET 36 Cb 0.37 -0.11 -0.02 0.00 0.06 0.00 0.00 31.60 31.89 1cfc h MET 36 CO 0.00 0.32 0.08 0.00 1.06 0.00 0.00 176.91 178.37 1cfc h ARG 37 N 0.50 0.72 -0.55 1.72 2.47 -0.98 -1.07 114.38 117.19 1cfc h ARG 37 Ca 0.26 -0.15 -0.00 0.00 -1.26 0.00 0.00 59.98 58.83 1cfc h ARG 37 Cb 0.38 -0.11 -0.03 0.00 -1.65 0.00 0.00 29.97 28.56 1cfc h ARG 37 CO -0.07 0.68 0.34 0.66 0.56 0.00 0.00 179.97 182.13 1cfc h SER 38 N 0.69 0.64 0.07 7.04 4.64 -0.53 0.17 113.55 126.28 1cfc h SER 38 Ca 0.15 -0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.44 1cfc h SER 38 Cb 0.31 -0.16 0.00 0.00 -0.31 0.00 0.00 62.40 62.24 1cfc h SER 38 CO 0.00 0.49 0.00 0.18 -0.87 0.00 0.00 176.83 176.63 1cfc n LEU 39 N -4.43 0.00 0.00 5.97 4.77 -0.74 -4.84 117.00 117.73 1cfc n LEU 39 Ca 0.05 0.04 0.00 0.00 -0.03 0.00 0.00 56.01 56.07 1cfc n LEU 39 Cb 0.07 -0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.12 1cfc n LEU 39 CO 0.36 -0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.03 1cfc n GLY 40 N 0.85 0.67 3.88 -0.72 0.00 0.58 -5.06 105.19 105.39 1cfc n GLY 40 Ca 0.21 -0.44 -0.37 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 -0.92 3.46 -0.46 1.61 -1.52 -0.48 -4.98 119.66 116.35 1cfc s GLN 41 Ca 0.00 -0.13 0.06 0.00 -1.95 0.00 0.00 55.36 53.34 1cfc s GLN 41 Cb 0.00 -3.19 0.21 0.00 -0.22 0.00 0.00 33.01 29.81 1cfc s GLN 41 CO 0.00 0.77 0.49 -1.71 -0.25 0.00 0.00 175.29 174.58 1cfc n ASN 42 N 2.02 0.73 -4.78 5.90 2.85 -1.26 -3.35 115.26 117.36 1cfc n ASN 42 Ca -0.20 -2.74 -0.34 0.00 -0.11 0.00 0.00 54.58 51.20 1cfc n ASN 42 Cb 0.55 -0.63 0.02 0.00 1.24 0.00 0.00 39.78 40.96 1cfc n ASN 42 CO 0.00 0.00 0.00 -2.16 -2.11 0.00 0.00 177.26 172.99 1cfc s PRO 43 N -0.97 3.20 1.07 1.20 0.04 -1.26 -5.02 135.00 133.27 1cfc s PRO 43 Ca 0.34 1.40 -0.15 0.00 0.04 0.00 0.00 61.00 62.63 1cfc s PRO 43 Cb 0.10 -2.00 0.23 0.00 0.04 0.00 0.00 34.50 32.86 1cfc s PRO 43 CO -0.13 -0.93 1.10 0.95 0.04 0.00 0.00 177.00 178.02 1cfc s THR 44 N -2.17 1.87 0.09 1.26 -4.23 -1.26 -4.83 115.64 106.37 1cfc s THR 44 Ca 0.68 0.00 -0.20 0.00 -1.18 0.00 0.00 61.69 60.99 1cfc s THR 44 Cb -0.20 -2.49 -0.09 0.00 1.34 0.00 0.00 72.50 71.07 1cfc s THR 44 CO 0.34 0.00 1.59 -0.33 -0.54 0.00 0.00 174.62 175.68 1cfc h GLU 45 N -2.15 0.33 -0.68 3.99 5.08 -2.00 -2.55 114.58 116.60 1cfc h GLU 45 Ca -0.52 -0.07 0.01 0.00 -1.00 0.00 0.00 59.36 57.77 1cfc h GLU 45 Cb 1.32 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 30.49 1cfc h GLU 45 CO 0.50 0.43 0.45 0.00 -1.00 0.00 0.00 179.01 179.40 1cfc h ALA 46 N 0.88 1.52 -0.98 3.43 0.00 -1.98 0.13 119.26 122.26 1cfc h ALA 46 Ca 0.07 -0.05 0.04 0.00 0.00 0.00 0.00 54.91 54.97 1cfc h ALA 46 Cb 0.24 -0.27 -0.06 0.00 0.00 0.00 0.00 17.79 17.70 1cfc h ALA 46 CO -0.00 0.45 0.64 0.93 0.00 0.00 0.00 179.25 181.26 1cfc h GLU 47 N 0.92 1.20 0.15 0.00 5.08 -1.82 0.40 114.58 120.51 1cfc h GLU 47 Ca 0.25 -0.07 -0.01 0.00 -1.00 0.00 0.00 59.36 58.53 1cfc h GLU 47 Cb -0.10 -0.27 0.00 0.00 0.50 0.00 0.00 28.75 28.88 1cfc h GLU 47 CO -0.06 0.79 -0.07 -0.07 -1.00 0.00 0.00 179.01 178.61 1cfc h LEU 48 N 1.23 -0.17 -2.44 1.33 3.38 -0.69 -2.99 115.31 114.97 1cfc h LEU 48 Ca 0.39 -0.37 0.01 0.00 0.09 0.00 0.00 57.88 58.00 1cfc h LEU 48 Cb 0.01 0.04 -0.00 0.00 0.09 0.00 0.00 40.66 40.80 1cfc h LEU 48 CO -0.13 0.36 0.18 1.56 0.09 0.00 0.00 178.44 180.50 1cfc h GLN 49 N -0.79 0.00 0.00 1.13 7.50 -0.57 -1.01 115.11 121.38 1cfc h GLN 49 Ca -0.02 0.00 -0.01 0.00 0.50 0.00 0.00 58.65 59.12 1cfc h GLN 49 Cb 0.53 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.06 1cfc h GLN 49 CO 0.03 0.00 -0.05 0.22 -1.50 0.00 0.00 178.83 177.53 1cfc h ASP 50 N 0.00 0.04 -0.10 1.46 1.82 -0.82 -2.69 116.42 116.13 1cfc h ASP 50 Ca 0.02 -0.81 -0.06 0.00 -0.39 0.00 0.00 57.03 55.78 1cfc h ASP 50 Cb 0.37 -0.01 -0.01 0.00 0.68 0.00 0.00 39.33 40.36 1cfc h ASP 50 CO -0.00 0.85 -0.12 0.24 -1.61 0.00 0.00 179.24 178.60 1cfc h MET 51 N -0.75 0.43 -0.52 0.28 0.00 -1.20 -2.49 114.93 110.67 1cfc h MET 51 Ca -0.01 -0.11 0.00 0.00 0.00 0.00 0.00 59.70 59.58 1cfc h MET 51 Cb 0.85 -0.05 -0.03 0.00 0.00 0.00 0.00 31.60 32.38 1cfc h MET 51 CO 0.01 0.55 0.33 0.82 0.00 0.00 0.00 176.91 178.62 1cfc h ILE 52 N 0.40 1.15 -0.79 -1.22 2.04 -1.25 -1.37 117.51 116.48 1cfc h ILE 52 Ca 0.08 -0.31 0.21 0.00 1.00 0.00 0.00 64.86 65.84 1cfc h ILE 52 Cb 0.45 0.41 -0.04 0.00 -0.74 0.00 0.00 36.82 36.90 1cfc h ILE 52 CO 0.03 0.15 0.56 -1.13 0.00 0.00 0.00 178.15 177.75 1cfc h ASN 53 N 0.70 0.10 0.00 1.72 -1.24 -1.09 0.86 115.58 116.63 1cfc h ASN 53 Ca 0.19 0.01 -0.00 0.00 0.71 0.00 0.00 56.30 57.21 1cfc h ASN 53 Cb -0.04 -0.01 -0.00 0.00 0.73 0.00 0.00 38.32 39.00 1cfc h ASN 53 CO -0.04 0.04 -0.04 -0.33 -1.29 0.00 0.00 177.43 175.78 1cfc h GLU 54 N 0.10 0.00 0.00 6.67 5.08 -1.28 -3.33 114.58 121.81 1cfc h GLU 54 Ca 0.38 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.72 1cfc h GLU 54 Cb 1.37 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.62 1cfc h GLU 54 CO -0.04 0.28 -0.13 0.28 -1.00 0.00 0.00 179.01 178.40 1cfc h VAL 55 N -1.00 0.62 0.00 3.13 2.07 -1.01 -2.32 116.25 117.74 1cfc h VAL 55 Ca -0.01 -0.57 0.00 0.00 0.82 0.00 0.00 66.70 66.95 1cfc h VAL 55 Cb 0.31 1.36 0.00 0.00 -1.52 0.00 0.00 31.29 31.44 1cfc h VAL 55 CO -0.00 0.13 0.00 -0.67 0.02 0.00 0.00 177.57 177.04 1cfc n ASP 56 N -3.69 4.37 0.19 0.57 2.03 0.29 -3.89 116.55 116.43 1cfc n ASP 56 Ca -0.02 -2.23 0.09 0.00 0.52 0.00 0.00 54.79 53.16 1cfc n ASP 56 Cb 0.25 -0.87 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 1.42 0.89 0.00 -1.67 0.00 -1.58 -3.08 119.26 115.24 1cfc h ALA 57 Ca 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.77 1cfc h ALA 57 Cb 0.99 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.76 1cfc h ALA 57 CO 0.00 0.19 0.00 0.22 0.00 0.00 0.00 179.25 179.66 1cfc h ASP 58 N 0.00 0.00 -0.99 0.00 3.58 -1.86 -3.47 116.42 113.68 1cfc h ASP 58 Ca -0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 1cfc h ASP 58 Cb 1.11 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.16 1cfc h ASP 58 CO 0.02 0.00 0.00 0.61 -2.88 0.00 0.00 179.24 176.99 1cfc n GLY 59 N 1.11 0.91 0.00 -0.78 0.00 -1.16 -5.01 105.19 100.26 1cfc n GLY 59 Ca 0.04 -0.59 0.00 0.00 0.00 0.00 0.00 46.02 45.48 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 1.09 0.00 0.00 1.61 3.02 -1.26 -5.12 115.26 114.60 1cfc n ASN 60 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.55 1cfc n ASN 60 Cb 0.45 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.62 1cfc n ASN 60 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1cfc n GLY 61 N 1.88 -0.15 3.11 7.41 0.00 -1.26 -5.08 105.19 111.09 1cfc n GLY 61 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.95 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 0.00 0.19 -0.01 2.61 -4.23 -1.26 -2.68 115.64 110.26 1cfc s THR 62 Ca 0.00 -1.82 -0.00 0.00 -1.18 0.00 0.00 61.69 58.69 1cfc s THR 62 Cb 0.00 -1.63 0.01 0.00 1.34 0.00 0.00 72.50 72.23 1cfc s THR 62 CO 0.00 -0.88 0.02 -0.63 -0.54 0.00 0.00 174.62 172.59 1cfc s ILE 63 N -3.95 -0.02 0.35 2.99 1.01 -0.01 -4.84 121.20 116.73 1cfc s ILE 63 Ca 0.11 0.07 0.07 0.00 0.00 0.00 0.00 60.65 60.90 1cfc s ILE 63 Cb 0.08 -0.05 -0.01 0.00 0.01 0.00 0.00 42.46 42.49 1cfc s ILE 63 CO -0.08 0.03 0.43 1.51 0.00 0.00 0.00 174.94 176.83 1cfc s ASP 64 N 0.38 5.68 0.18 3.58 1.47 -1.26 -1.02 116.67 125.67 1cfc s ASP 64 Ca -0.03 -0.34 -0.14 0.00 1.18 0.00 0.00 52.55 53.22 1cfc s ASP 64 Cb -0.04 -1.04 0.07 0.00 -0.34 0.00 0.00 42.92 41.57 1cfc s ASP 64 CO -0.01 -0.47 1.84 0.15 0.68 0.00 0.00 175.17 177.35 1cfc h PHE 65 N 0.96 0.70 -0.27 2.11 3.57 -1.97 -1.04 116.94 121.01 1cfc h PHE 65 Ca -0.44 0.01 0.06 0.00 3.53 0.00 0.00 57.97 61.13 1cfc h PHE 65 Cb 1.26 -0.24 -0.06 0.00 2.79 0.00 0.00 35.95 39.70 1cfc h PHE 65 CO 0.46 0.45 -0.13 -1.35 -2.23 0.00 0.00 178.31 175.51 1cfc h PRO 66 N 0.75 -0.09 -0.13 6.41 0.11 -1.96 0.88 132.00 137.98 1cfc h PRO 66 Ca 0.20 0.01 -0.05 0.00 0.11 0.00 0.00 66.00 66.27 1cfc h PRO 66 Cb -0.08 0.02 -0.01 0.00 0.11 0.00 0.00 31.00 31.04 1cfc h PRO 66 CO -0.04 -0.06 -0.15 0.93 -0.21 0.00 0.00 178.00 178.47 1cfc h GLU 67 N -0.09 0.20 -0.48 1.05 5.08 -1.92 -1.60 114.58 116.82 1cfc h GLU 67 Ca 0.14 -0.05 -0.06 0.00 -1.00 0.00 0.00 59.36 58.40 1cfc h GLU 67 Cb 0.30 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.50 1cfc h GLU 67 CO -0.33 0.36 0.06 0.35 -1.00 0.00 0.00 179.01 178.45 1cfc h PHE 68 N 0.19 0.79 0.00 4.33 3.57 0.44 -0.68 116.94 125.58 1cfc h PHE 68 Ca 0.04 -0.09 -0.04 0.00 3.53 0.00 0.00 57.97 61.41 1cfc h PHE 68 Cb 0.39 -0.23 -0.01 0.00 2.79 0.00 0.00 35.95 38.90 1cfc h PHE 68 CO 0.01 0.70 -0.20 -0.07 -2.23 0.00 0.00 178.31 176.52 1cfc h LEU 69 N 0.72 0.00 -0.59 0.59 3.38 0.04 -1.74 115.31 117.71 1cfc h LEU 69 Ca 0.15 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 58.06 1cfc h LEU 69 Cb 0.35 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.10 1cfc h LEU 69 CO 0.01 0.20 -0.30 0.74 0.09 0.00 0.00 178.44 179.17 1cfc h THR 70 N 0.00 0.61 0.02 0.22 2.02 -0.78 -1.91 112.91 113.09 1cfc h THR 70 Ca -0.00 -1.51 -0.09 0.00 0.77 0.00 0.00 66.41 65.57 1cfc h THR 70 Cb 0.52 2.03 0.01 0.00 -1.74 0.00 0.00 68.15 68.97 1cfc h THR 70 CO 0.03 0.30 -0.37 0.24 0.37 0.00 0.00 175.52 176.08 1cfc h MET 71 N 0.00 0.22 -0.22 6.66 2.86 -0.86 -2.68 114.93 120.91 1cfc h MET 71 Ca -0.00 -0.26 -0.09 0.00 -2.06 0.00 0.00 59.70 57.29 1cfc h MET 71 Cb 1.01 0.08 -0.01 0.00 0.06 0.00 0.00 31.60 32.73 1cfc h MET 71 CO 0.04 1.01 -0.23 0.52 1.06 0.00 0.00 176.91 179.30 1cfc h MET 72 N -0.45 0.41 -0.09 1.72 2.07 -1.50 -2.52 114.93 114.56 1cfc h MET 72 Ca -0.05 -0.14 -0.11 0.00 -2.07 0.00 0.00 59.70 57.33 1cfc h MET 72 Cb 1.15 -0.03 -0.01 0.00 -1.87 0.00 0.00 31.60 30.84 1cfc h MET 72 CO 0.07 0.62 -0.42 0.00 1.07 0.00 0.00 176.91 178.26 1cfc h ALA 73 N 1.39 1.13 -0.35 6.32 0.00 -1.39 -0.79 119.26 125.56 1cfc h ALA 73 Ca 0.06 -0.41 -0.06 0.00 0.00 0.00 0.00 54.91 54.50 1cfc h ALA 73 Cb 0.62 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.30 1cfc h ALA 73 CO 0.04 0.59 -0.03 0.00 0.00 0.00 0.00 179.25 179.85 1cfc h ARG 74 N 0.18 0.56 0.07 0.00 2.47 -1.09 -3.18 114.38 113.39 1cfc h ARG 74 Ca 0.02 -0.13 -0.00 0.00 -1.26 0.00 0.00 59.98 58.60 1cfc h ARG 74 Cb 0.81 -0.07 0.00 0.00 -1.65 0.00 0.00 29.97 29.06 1cfc h ARG 74 CO 0.06 0.61 -0.03 0.87 0.56 0.00 0.00 179.97 182.04 1cfc h LYS 75 N 0.53 -0.09 -5.51 0.04 1.79 -1.32 -3.43 116.57 108.59 1cfc h LYS 75 Ca 0.11 0.01 -0.45 0.00 -2.18 0.00 0.00 60.65 58.13 1cfc h LYS 75 Cb 0.38 0.02 -0.01 0.00 -1.58 0.00 0.00 32.23 31.05 1cfc h LYS 75 CO 0.02 0.31 1.61 -1.33 -1.08 0.00 0.00 179.45 178.97 1cfc n MET 76 N -4.79 0.86 0.00 3.15 2.81 -0.34 -4.47 117.12 114.35 1cfc n MET 76 Ca -0.05 -0.03 0.00 0.00 -1.81 0.00 0.00 57.70 55.80 1cfc n MET 76 Cb 0.21 -3.16 0.00 0.00 -0.71 0.00 0.00 33.22 29.56 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 8.91 0.00 0.00 0.03 5.02 -1.26 -4.87 118.16 125.99 1cfc n LYS 77 Ca 0.42 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.71 1cfc n LYS 77 Cb 0.47 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.48 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 -2.27 4.39 2.03 -1.26 0.79 116.55 120.23 1cfc n ASP 78 Ca 0.00 0.03 -0.23 0.00 0.52 0.00 0.00 54.79 55.11 1cfc n ASP 78 Cb 0.00 -0.03 0.01 0.00 -0.72 0.00 0.00 41.12 40.38 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 -0.99 2.32 -0.76 5.18 5.66 -1.26 -5.04 114.28 119.39 1cfc n THR 79 Ca 0.00 -4.36 -0.34 0.00 -3.05 0.00 0.00 64.05 56.30 1cfc n THR 79 Cb 0.42 -0.96 0.14 0.00 -1.55 0.00 0.00 70.33 68.38 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 -0.59 -2.59 0.17 1.09 2.03 0.24 -4.84 116.55 112.07 1cfc n ASP 80 Ca 0.38 -0.03 0.12 0.00 0.52 0.00 0.00 54.79 55.78 1cfc n ASP 80 Cb 0.84 -0.90 0.13 0.00 -0.72 0.00 0.00 41.12 40.46 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 -1.79 0.00 -0.36 1.67 0.87 -1.90 -3.24 113.55 108.81 1cfc h SER 81 Ca -0.50 -0.01 -0.04 0.00 -1.23 0.00 0.00 61.79 60.01 1cfc h SER 81 Cb 1.35 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 63.30 1cfc h SER 81 CO 0.34 0.00 0.05 -0.33 -0.53 0.00 0.00 176.83 176.37 1cfc h GLU 82 N 0.00 0.60 0.00 2.24 5.08 -1.88 -2.19 114.58 118.43 1cfc h GLU 82 Ca 0.00 -0.16 0.00 0.00 -1.00 0.00 0.00 59.36 58.20 1cfc h GLU 82 Cb 0.98 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.16 1cfc h GLU 82 CO 0.00 0.67 0.00 0.93 -1.00 0.00 0.00 179.01 179.61 1cfc h GLU 83 N 0.43 0.00 0.08 2.33 4.39 -1.90 -1.56 114.58 118.36 1cfc h GLU 83 Ca 0.11 0.00 -0.27 0.00 0.34 0.00 0.00 59.36 59.53 1cfc h GLU 83 Cb 0.37 0.00 0.03 0.00 -0.10 0.00 0.00 28.75 29.04 1cfc h GLU 83 CO 0.01 0.00 -1.12 0.93 -1.16 0.00 0.00 179.01 177.67 1cfc h GLU 84 N 0.00 0.61 -0.04 2.33 5.08 -1.48 -2.23 114.58 118.86 1cfc h GLU 84 Ca 0.00 -0.77 -0.17 0.00 -1.00 0.00 0.00 59.36 57.42 1cfc h GLU 84 Cb 0.39 0.25 0.01 0.00 0.50 0.00 0.00 28.75 29.89 1cfc h GLU 84 CO 0.00 1.34 -0.63 0.82 -1.00 0.00 0.00 179.01 179.54 1cfc h ILE 85 N 0.24 1.39 -0.80 3.13 2.04 -1.13 -2.46 117.51 119.91 1cfc h ILE 85 Ca -0.16 -2.02 -0.04 0.00 1.00 0.00 0.00 64.86 63.64 1cfc h ILE 85 Cb 1.80 2.43 -0.04 0.00 -0.74 0.00 0.00 36.82 40.27 1cfc h ILE 85 CO 0.22 0.60 0.36 -0.09 0.00 0.00 0.00 178.15 179.23 1cfc h ARG 86 N 0.04 1.17 0.00 2.37 2.43 -1.39 0.70 114.38 119.70 1cfc h ARG 86 Ca -0.07 -0.19 -0.01 0.00 -0.81 0.00 0.00 59.98 58.90 1cfc h ARG 86 Cb 1.31 -0.20 -0.00 0.00 -0.42 0.00 0.00 29.97 30.65 1cfc h ARG 86 CO 0.13 0.92 -0.07 0.93 -1.51 0.00 0.00 179.97 180.37 1cfc h GLU 87 N 1.15 0.00 0.05 0.20 5.08 -1.42 -0.12 114.58 119.52 1cfc h GLU 87 Ca 0.27 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.56 1cfc h GLU 87 Cb 0.16 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.42 1cfc h GLU 87 CO -0.03 0.07 -0.31 0.00 -1.00 0.00 0.00 179.01 177.74 1cfc h ALA 88 N 1.93 -0.03 -0.05 3.43 0.00 -0.71 -2.46 119.26 121.37 1cfc h ALA 88 Ca -0.00 -0.57 0.02 0.00 0.00 0.00 0.00 54.91 54.36 1cfc h ALA 88 Cb 0.52 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.35 1cfc h ALA 88 CO 0.01 0.14 0.09 0.74 0.00 0.00 0.00 179.25 180.23 1cfc h PHE 89 N -0.73 0.00 -0.15 0.00 0.04 -0.62 0.13 116.94 115.61 1cfc h PHE 89 Ca -0.05 0.00 -0.10 0.00 2.80 0.00 0.00 57.97 60.62 1cfc h PHE 89 Cb 1.23 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.38 1cfc h PHE 89 CO 0.24 0.00 -0.28 -0.09 -0.60 0.00 0.00 178.31 177.58 1cfc h ARG 90 N 0.00 0.46 0.00 1.51 2.43 -0.83 -1.81 114.38 116.14 1cfc h ARG 90 Ca 0.02 -0.29 0.00 0.00 -0.81 0.00 0.00 59.98 58.90 1cfc h ARG 90 Cb 0.21 0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.79 1cfc h ARG 90 CO -0.00 0.89 0.32 0.28 -1.51 0.00 0.00 179.97 179.95 1cfc h VAL 91 N 0.08 0.00 -0.01 0.20 2.07 -0.26 0.42 116.25 118.75 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 0.87 0.58 0.00 0.00 -1.52 0.00 0.00 31.29 31.22 1cfc h VAL 91 CO 0.06 0.00 -0.72 0.49 0.02 0.00 0.00 177.57 177.42 1cfc n PHE 92 N -2.69 0.00 -2.75 1.57 3.72 -0.73 -4.66 117.46 111.93 1cfc n PHE 92 Ca -0.02 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 56.95 1cfc n PHE 92 Cb 0.36 -0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.89 1cfc n PHE 92 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 1cfc n ASP 93 N -0.73 5.19 0.30 4.37 2.03 0.15 -4.78 116.55 123.07 1cfc n ASP 93 Ca 0.07 -3.02 0.20 0.00 0.52 0.00 0.00 54.79 52.55 1cfc n ASP 93 Cb 0.40 -1.54 0.97 0.00 -0.72 0.00 0.00 41.12 40.23 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 6.67 0.00 -0.65 -0.67 1.79 -1.83 -1.86 116.57 120.03 1cfc h LYS 94 Ca 0.34 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.81 1cfc h LYS 94 Cb 0.79 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.44 1cfc h LYS 94 CO 1.37 0.00 0.00 -3.47 -1.08 0.00 0.00 179.45 176.27 1cfc n ASP 95 N -2.98 3.75 -2.23 0.86 2.03 -1.26 -4.92 116.55 111.80 1cfc n ASP 95 Ca -0.02 -2.00 -0.11 0.00 0.52 0.00 0.00 54.79 53.19 1cfc n ASP 95 Cb 0.15 -0.43 -0.01 0.00 -0.72 0.00 0.00 41.12 40.10 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 1.61 -0.21 0.14 0.27 0.00 -0.70 -4.79 105.19 101.52 1cfc n GLY 96 Ca 0.23 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.96 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 -1.48 1.96 0.00 1.61 5.15 -1.26 -5.03 115.26 116.21 1cfc n ASN 97 Ca -0.13 0.34 0.00 0.00 -0.60 0.00 0.00 54.58 54.19 1cfc n ASN 97 Cb 0.55 -0.82 0.00 0.00 -0.53 0.00 0.00 39.78 38.98 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 1.27 0.80 3.40 8.20 0.00 -1.26 -5.12 105.19 112.48 1cfc n GLY 98 Ca -0.54 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.17 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 -1.59 2.48 0.15 1.61 1.51 -1.26 -4.21 117.35 116.03 1cfc s TYR 99 Ca 0.00 -0.32 -0.01 0.00 -1.01 0.00 0.00 57.07 55.73 1cfc s TYR 99 Cb 0.00 -1.49 -0.04 0.00 -0.11 0.00 0.00 41.96 40.33 1cfc s TYR 99 CO 0.00 0.14 0.08 0.96 -1.11 0.00 0.00 175.55 175.62 1cfc s ILE 100 N -0.79 0.08 0.24 2.71 -4.36 -1.20 -4.90 121.20 112.98 1cfc s ILE 100 Ca 0.12 -1.92 -0.30 0.00 -0.26 0.00 0.00 60.65 58.29 1cfc s ILE 100 Cb -0.10 -2.14 -0.09 0.00 1.25 0.00 0.00 42.46 41.37 1cfc s ILE 100 CO 0.02 -0.36 0.94 -0.94 0.24 0.00 0.00 174.94 174.85 1cfc s SER 101 N -3.07 7.64 0.49 4.36 1.04 -1.26 -2.41 113.70 120.49 1cfc s SER 101 Ca 0.27 1.95 0.40 0.00 0.48 0.00 0.00 55.95 59.06 1cfc s SER 101 Cb 0.07 -2.61 1.60 0.00 0.10 0.00 0.00 66.02 65.18 1cfc s SER 101 CO 0.04 0.15 1.57 0.00 0.98 0.00 0.00 173.24 175.98 1cfc n ALA 102 N 1.49 1.59 0.30 5.32 0.00 -1.26 0.51 120.51 128.46 1cfc n ALA 102 Ca -0.02 0.78 -0.17 0.00 0.00 0.00 0.00 53.44 54.04 1cfc n ALA 102 Cb 0.47 -1.10 -0.08 0.00 0.00 0.00 0.00 19.45 18.74 1cfc n ALA 102 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1cfc h ALA 103 N 1.35 -0.79 -0.65 0.00 0.00 -1.93 0.35 119.26 117.59 1cfc h ALA 103 Ca 0.91 -0.16 0.08 0.00 0.00 0.00 0.00 54.91 55.75 1cfc h ALA 103 Cb 3.24 0.37 -0.04 0.00 0.00 0.00 0.00 17.79 21.37 1cfc h ALA 103 CO -0.28 -0.96 0.43 0.93 0.00 0.00 0.00 179.25 179.38 1cfc h GLU 104 N -0.78 0.53 -0.19 0.00 5.08 -0.30 0.79 114.58 119.71 1cfc h GLU 104 Ca -0.06 -0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.25 1cfc h GLU 104 Cb 0.63 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.76 1cfc h GLU 104 CO 0.07 0.35 0.05 1.25 -1.00 0.00 0.00 179.01 179.74 1cfc h LEU 105 N 0.55 0.29 -1.31 1.33 5.85 -0.26 0.39 115.31 122.15 1cfc h LEU 105 Ca 0.29 -0.22 -0.03 0.00 0.84 0.00 0.00 57.88 58.76 1cfc h LEU 105 Cb 0.43 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.36 1cfc h LEU 105 CO -0.09 0.43 0.09 0.03 -0.34 0.00 0.00 178.44 178.56 1cfc h ARG 106 N 0.13 0.56 -0.22 1.25 3.08 0.96 -1.88 114.38 118.26 1cfc h ARG 106 Ca 0.06 -0.09 -0.18 0.00 0.07 0.00 0.00 59.98 59.84 1cfc h ARG 106 Cb 0.25 -0.09 -0.00 0.00 0.08 0.00 0.00 29.97 30.20 1cfc h ARG 106 CO -0.00 0.52 -0.59 1.25 -1.07 0.00 0.00 179.97 180.08 1cfc h HIS 107 N 0.55 0.90 -0.86 3.04 2.76 -0.28 -2.36 115.15 118.90 1cfc h HIS 107 Ca 0.13 -0.33 -0.01 0.00 -2.20 0.00 0.00 60.37 57.95 1cfc h HIS 107 Cb 0.22 -0.16 -0.04 0.00 1.55 0.00 0.00 27.41 28.97 1cfc h HIS 107 CO 0.01 1.12 0.48 0.28 -1.30 0.00 0.00 177.93 178.52 1cfc h VAL 108 N 0.53 1.25 0.00 5.26 2.07 0.41 0.20 116.25 125.96 1cfc h VAL 108 Ca 0.00 -0.60 -0.07 0.00 0.82 0.00 0.00 66.70 66.85 1cfc h VAL 108 Cb 1.17 0.08 -0.01 0.00 -1.52 0.00 0.00 31.29 31.01 1cfc h VAL 108 CO 0.12 0.27 -0.34 0.24 0.02 0.00 0.00 177.57 177.89 1cfc h MET 109 N 1.20 0.00 0.08 1.57 2.07 -1.21 -2.59 114.93 116.04 1cfc h MET 109 Ca 0.30 0.00 -0.21 0.00 -2.07 0.00 0.00 59.70 57.72 1cfc h MET 109 Cb 0.01 0.00 -0.01 0.00 -1.87 0.00 0.00 31.60 29.74 1cfc h MET 109 CO -0.05 0.34 -1.10 1.79 1.07 0.00 0.00 176.91 178.96 1cfc h THR 110 N 0.00 1.18 0.00 2.22 1.35 -0.82 -3.33 112.91 113.51 1cfc h THR 110 Ca -0.00 -2.36 -0.03 0.00 -0.55 0.00 0.00 66.41 63.47 1cfc h THR 110 Cb 0.75 2.78 -0.00 0.00 -1.73 0.00 0.00 68.15 69.94 1cfc h THR 110 CO 0.04 0.62 -0.13 -1.13 -0.25 0.00 0.00 175.52 174.67 1cfc h ASN 111 N -0.55 0.00 -0.01 5.36 -1.24 -1.02 -1.54 115.58 116.57 1cfc h ASN 111 Ca -0.25 0.00 0.00 0.00 0.71 0.00 0.00 56.30 56.76 1cfc h ASN 111 Cb 1.54 0.00 -0.00 0.00 0.73 0.00 0.00 38.32 40.59 1cfc h ASN 111 CO 0.01 0.13 0.01 -0.07 -1.29 0.00 0.00 177.43 176.21 1cfc h LEU 112 N 0.00 0.00 -0.14 0.34 3.38 -1.58 -3.46 115.31 113.86 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 0.25 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.00 1cfc h LEU 112 CO 0.02 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.16 1cfc n GLY 113 N -1.44 0.91 3.76 0.83 0.00 -0.58 -5.05 105.19 103.63 1cfc n GLY 113 Ca -0.03 -0.58 -0.39 0.00 0.00 0.00 0.00 46.02 45.03 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 -3.11 4.76 -0.03 1.61 0.41 -1.25 -4.91 118.70 116.18 1cfc s GLU 114 Ca 0.00 1.45 -0.00 0.00 -0.41 0.00 0.00 54.97 56.01 1cfc s GLU 114 Cb 0.00 -3.12 0.02 0.00 -1.78 0.00 0.00 34.13 29.25 1cfc s GLU 114 CO 0.00 0.42 1.88 1.63 -0.49 0.00 0.00 175.26 178.70 1cfc n LYS 115 N 1.17 1.07 -3.39 1.61 5.02 -1.26 -4.84 118.16 117.54 1cfc n LYS 115 Ca -0.01 -0.14 -0.38 0.00 -2.02 0.00 0.00 58.31 55.77 1cfc n LYS 115 Cb 0.48 -1.06 -0.06 0.00 -0.02 0.00 0.00 35.03 34.37 1cfc n LYS 115 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1cfc s LEU 116 N -0.16 4.33 0.36 -0.35 1.43 -1.26 -5.06 118.68 117.97 1cfc s LEU 116 Ca 0.03 0.83 -0.21 0.00 -1.03 0.00 0.00 54.13 53.74 1cfc s LEU 116 Cb 0.02 -2.63 -0.10 0.00 0.03 0.00 0.00 46.19 43.51 1cfc s LEU 116 CO 0.00 0.11 0.90 0.42 0.23 0.00 0.00 176.35 178.01 1cfc s THR 117 N 0.09 4.40 0.66 5.49 -4.23 -1.26 -4.89 115.64 115.89 1cfc s THR 117 Ca 0.24 1.49 0.28 0.00 -1.18 0.00 0.00 61.69 62.52 1cfc s THR 117 Cb -0.15 -3.75 0.28 0.00 1.34 0.00 0.00 72.50 70.22 1cfc s THR 117 CO 0.10 -0.11 1.86 0.44 -0.54 0.00 0.00 174.62 176.37 1cfc h ASP 118 N 2.48 0.00 -0.01 3.99 5.19 -1.99 0.18 116.42 126.25 1cfc h ASP 118 Ca -0.48 0.00 -0.04 0.00 -0.62 0.00 0.00 57.03 55.89 1cfc h ASP 118 Cb 1.18 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.70 1cfc h ASP 118 CO 0.63 0.00 -0.15 -0.33 -3.12 0.00 0.00 179.24 176.27 1cfc h GLU 119 N 0.00 0.13 -0.80 3.56 5.08 -2.00 -2.80 114.58 117.75 1cfc h GLU 119 Ca 0.00 -0.12 0.21 0.00 -1.00 0.00 0.00 59.36 58.45 1cfc h GLU 119 Cb 0.75 0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.99 1cfc h GLU 119 CO 0.00 0.83 0.56 0.93 -1.00 0.00 0.00 179.01 180.32 1cfc h GLU 120 N -0.52 0.14 -0.07 2.33 5.08 -1.32 0.24 114.58 120.45 1cfc h GLU 120 Ca -0.02 -0.01 -0.20 0.00 -1.00 0.00 0.00 59.36 58.14 1cfc h GLU 120 Cb 0.87 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 30.09 1cfc h GLU 120 CO 0.03 0.09 -0.79 0.28 -1.00 0.00 0.00 179.01 177.62 1cfc h VAL 121 N 0.14 1.37 -0.47 3.13 2.07 -1.46 -3.02 116.25 118.02 1cfc h VAL 121 Ca 0.39 -2.20 0.07 0.00 0.82 0.00 0.00 66.70 65.78 1cfc h VAL 121 Cb 1.32 2.18 -0.03 0.00 -1.52 0.00 0.00 31.29 33.24 1cfc h VAL 121 CO -0.06 0.66 0.32 0.44 0.02 0.00 0.00 177.57 178.95 1cfc h ASP 122 N 0.30 0.29 0.06 0.57 3.32 -0.25 0.27 116.42 120.98 1cfc h ASP 122 Ca -0.05 0.00 -0.21 0.00 0.02 0.00 0.00 57.03 56.79 1cfc h ASP 122 Cb 1.39 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 40.88 1cfc h ASP 122 CO 0.14 0.19 -0.79 -0.33 -1.72 0.00 0.00 179.24 176.72 1cfc h GLU 123 N 0.33 0.60 -0.04 3.56 4.39 -1.40 -2.51 114.58 119.52 1cfc h GLU 123 Ca 0.21 -0.51 -0.10 0.00 0.34 0.00 0.00 59.36 59.29 1cfc h GLU 123 Cb 0.40 0.11 -0.01 0.00 -0.10 0.00 0.00 28.75 29.15 1cfc h GLU 123 CO -0.05 1.14 -0.45 0.52 -1.16 0.00 0.00 179.01 179.01 1cfc h MET 124 N 0.40 0.09 0.00 2.33 2.86 -0.85 -2.55 114.93 117.20 1cfc h MET 124 Ca -0.05 -0.04 -0.09 0.00 -2.06 0.00 0.00 59.70 57.46 1cfc h MET 124 Cb 1.40 -0.00 -0.01 0.00 0.06 0.00 0.00 31.60 33.05 1cfc h MET 124 CO 0.15 0.52 -0.42 0.82 1.06 0.00 0.00 176.91 179.04 1cfc h ILE 125 N 0.07 0.89 0.14 -1.22 2.04 -0.45 -2.23 117.51 116.76 1cfc h ILE 125 Ca 0.00 -1.73 -0.01 0.00 1.00 0.00 0.00 64.86 64.13 1cfc h ILE 125 Cb 0.82 2.07 0.00 0.00 -0.74 0.00 0.00 36.82 38.97 1cfc h ILE 125 CO 0.06 0.41 -0.07 0.03 0.00 0.00 0.00 178.15 178.59 1cfc h ARG 126 N 0.00 -0.18 0.00 2.37 2.47 -1.01 -3.10 114.38 114.92 1cfc h ARG 126 Ca -0.00 0.01 0.00 0.00 -1.26 0.00 0.00 59.98 58.73 1cfc h ARG 126 Cb 1.03 0.04 0.00 0.00 -1.65 0.00 0.00 29.97 29.39 1cfc h ARG 126 CO 0.05 0.12 0.00 0.93 0.56 0.00 0.00 179.97 181.63 1cfc h GLU 127 N -0.49 0.00 -4.46 0.04 3.07 -1.60 -3.37 114.58 107.77 1cfc h GLU 127 Ca -0.02 0.00 -0.75 0.00 -0.50 0.00 0.00 59.36 58.09 1cfc h GLU 127 Cb 0.38 0.00 -0.19 0.00 -0.84 0.00 0.00 28.75 28.11 1cfc h GLU 127 CO 0.03 0.00 1.35 0.00 -1.40 0.00 0.00 179.01 178.99 1cfc n ALA 128 N -2.00 4.11 -1.06 3.43 0.00 -0.84 -4.91 120.51 119.25 1cfc n ALA 128 Ca 0.04 -4.30 -0.04 0.00 0.00 0.00 0.00 53.44 49.14 1cfc n ALA 128 Cb 0.48 -2.98 -0.04 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 5.08 -1.82 -0.07 0.00 8.00 -1.26 -4.58 116.55 121.91 1cfc n ASP 129 Ca 0.36 -1.19 0.14 0.00 0.71 0.00 0.00 54.79 54.81 1cfc n ASP 129 Cb 0.41 -0.56 0.80 0.00 -0.02 0.00 0.00 41.12 41.75 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 4.51 0.01 -2.47 0.53 5.41 -1.26 -4.76 119.36 121.33 1cfc n ILE 130 Ca 0.13 -0.04 0.00 0.00 1.00 0.00 0.00 62.75 63.84 1cfc n ILE 130 Cb 0.41 -0.32 0.00 0.00 -0.71 0.00 0.00 39.64 39.02 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 -0.79 1.05 0.00 4.38 2.03 -1.26 -4.16 116.55 117.79 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 0.13 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.53 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 1.16 0.00 0.27 0.00 -1.26 -4.33 105.19 106.03 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 0.27 0.00 0.00 1.61 2.03 -1.26 -5.08 116.55 114.12 1cfc n ASP 133 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 1cfc n ASP 133 Cb 0.00 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 1cfc n ASP 133 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1cfc n GLY 134 N 2.79 1.23 3.27 0.27 0.00 -1.26 -5.12 105.19 106.36 1cfc n GLY 134 Ca 0.00 -0.04 -0.19 0.00 0.00 0.00 0.00 46.02 45.80 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 1.10 0.04 1.61 -0.21 -1.26 -4.19 119.66 116.75 1cfc s GLN 135 Ca 0.00 -1.32 0.02 0.00 0.02 0.00 0.00 55.36 54.08 1cfc s GLN 135 Cb 0.00 -1.00 -0.02 0.00 1.00 0.00 0.00 33.01 32.99 1cfc s GLN 135 CO 0.00 0.19 -0.06 0.08 -2.12 0.00 0.00 175.29 173.38 1cfc s VAL 136 N -2.26 0.41 -0.64 1.09 1.01 -1.01 -4.94 120.40 114.06 1cfc s VAL 136 Ca 0.12 -1.03 -0.25 0.00 0.00 0.00 0.00 61.98 60.82 1cfc s VAL 136 Cb -0.04 -0.50 0.04 0.00 0.00 0.00 0.00 36.38 35.88 1cfc s VAL 136 CO 0.04 -0.41 1.09 0.54 0.00 0.00 0.00 175.10 176.35 1cfc s ASN 137 N -1.54 6.26 0.65 3.32 2.20 -1.26 -3.22 114.94 121.35 1cfc s ASN 137 Ca -0.12 -0.49 0.04 0.00 -0.94 0.00 0.00 52.86 51.35 1cfc s ASN 137 Cb -0.10 -2.49 0.14 0.00 -2.00 0.00 0.00 41.25 36.80 1cfc s ASN 137 CO -0.00 -1.51 1.04 0.00 -2.94 0.00 0.00 177.10 173.69 1cfc n TYR 138 N 8.25 0.00 -0.22 1.54 0.18 -1.26 -1.90 117.16 123.75 1cfc n TYR 138 Ca 0.02 0.00 -0.05 0.00 1.88 0.00 0.00 57.90 59.74 1cfc n TYR 138 Cb 0.48 -0.04 0.01 0.00 -0.38 0.00 0.00 39.34 39.40 1cfc n TYR 138 CO 0.00 0.00 0.00 1.49 -2.08 0.00 0.00 176.86 176.27 1cfc h GLU 139 N 0.00 -0.15 -0.65 -3.48 4.81 -1.88 0.45 114.58 113.67 1cfc h GLU 139 Ca 0.07 0.01 -0.08 0.00 -0.13 0.00 0.00 59.36 59.24 1cfc h GLU 139 Cb 2.13 0.03 -0.03 0.00 0.63 0.00 0.00 28.75 31.52 1cfc h GLU 139 CO -0.00 -0.10 0.09 1.49 -0.73 0.00 0.00 179.01 179.76 1cfc h GLU 140 N -0.16 1.08 0.00 1.92 4.81 -1.80 -2.38 114.58 118.05 1cfc h GLU 140 Ca 0.24 -0.29 -0.03 0.00 -0.13 0.00 0.00 59.36 59.15 1cfc h GLU 140 Cb 0.56 -0.12 -0.00 0.00 0.63 0.00 0.00 28.75 29.81 1cfc h GLU 140 CO -0.70 1.00 -0.14 0.74 -0.73 0.00 0.00 179.01 179.17 1cfc h PHE 141 N 1.01 0.00 0.17 0.92 0.04 -0.94 -3.01 116.94 115.13 1cfc h PHE 141 Ca 0.20 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.96 1cfc h PHE 141 Cb 0.45 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.60 1cfc h PHE 141 CO 0.03 0.14 -0.08 0.28 -0.60 0.00 0.00 178.31 178.08 1cfc h VAL 142 N 0.00 0.92 0.00 -0.55 2.07 0.30 -2.49 116.25 116.50 1cfc h VAL 142 Ca -0.00 -0.42 -0.00 0.00 0.82 0.00 0.00 66.70 67.10 1cfc h VAL 142 Cb 0.40 1.17 -0.00 0.00 -1.52 0.00 0.00 31.29 31.34 1cfc h VAL 142 CO 0.02 0.10 -0.01 1.56 0.02 0.00 0.00 177.57 179.26 1cfc h GLN 143 N -0.44 0.00 -0.58 1.57 4.20 -1.57 -1.94 115.11 116.35 1cfc h GLN 143 Ca -0.02 0.00 -0.10 0.00 0.06 0.00 0.00 58.65 58.59 1cfc h GLN 143 Cb 0.34 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.10 1cfc h GLN 143 CO 0.04 0.01 -0.02 0.52 -0.67 0.00 0.00 178.83 178.71 1cfc h MET 144 N 0.00 1.04 0.00 1.46 2.86 -1.33 -2.65 114.93 116.31 1cfc h MET 144 Ca -0.00 -0.34 -0.07 0.00 -2.06 0.00 0.00 59.70 57.23 1cfc h MET 144 Cb 0.01 -0.09 -0.01 0.00 0.06 0.00 0.00 31.60 31.58 1cfc h MET 144 CO 0.00 1.03 -0.31 0.52 1.06 0.00 0.00 176.91 179.21 1cfc h MET 145 N 0.93 0.00 -0.76 1.72 2.86 -1.04 -2.40 114.93 116.24 1cfc h MET 145 Ca 0.16 0.00 -0.08 0.00 -2.06 0.00 0.00 59.70 57.73 1cfc h MET 145 Cb 0.57 0.00 -0.04 0.00 0.06 0.00 0.00 31.60 32.19 1cfc h MET 145 CO 0.03 0.31 0.10 0.25 1.06 0.00 0.00 176.91 178.66 1cfc n THR 146 N -3.58 2.14 -0.02 2.22 -2.24 -1.02 -4.14 114.28 107.64 1cfc n THR 146 Ca -0.01 -1.10 0.04 0.00 -2.27 0.00 0.00 64.05 60.72 1cfc n THR 146 Cb 0.45 -0.40 0.23 0.00 -2.10 0.00 0.00 70.33 68.51 1cfc n THR 146 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1cfc n ALA 147 N 0.23 3.22 1.95 6.98 0.00 -0.90 -4.87 120.51 127.11 1cfc n ALA 147 Ca 0.25 -1.06 0.16 0.00 0.00 0.00 0.00 53.44 52.78 1cfc n ALA 147 Cb 1.03 -1.06 0.91 0.00 0.00 0.00 0.00 19.45 20.32 1cfc n ALA 147 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13