#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 0.40 -4.73 0.00 2.03 -1.24 2.18 116.55 115.18 1cfc n ASP 2 Ca 0.00 -1.81 -0.37 0.00 0.52 0.00 0.00 54.79 53.13 1cfc n ASP 2 Cb 0.00 -0.20 0.06 0.00 -0.72 0.00 0.00 41.12 40.27 1cfc n ASP 2 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1cfc n GLN 3 N -0.26 1.25 -2.27 -0.67 6.02 -1.26 0.79 117.38 120.98 1cfc n GLN 3 Ca 0.00 0.48 -0.43 0.00 -0.01 0.00 0.00 57.00 57.04 1cfc n GLN 3 Cb 0.10 -2.55 -0.02 0.00 1.02 0.00 0.00 30.24 28.78 1cfc n GLN 3 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1cfc s LEU 4 N -4.20 4.14 0.83 1.08 1.43 -1.26 -2.19 118.68 118.50 1cfc s LEU 4 Ca 0.81 1.76 -0.11 0.00 -1.03 0.00 0.00 54.13 55.55 1cfc s LEU 4 Cb -0.39 -3.54 0.09 0.00 0.03 0.00 0.00 46.19 42.38 1cfc s LEU 4 CO 0.42 -0.92 1.09 0.42 0.23 0.00 0.00 176.35 177.59 1cfc s THR 5 N 4.01 2.97 0.53 5.49 -4.23 -1.25 -3.85 115.64 119.31 1cfc s THR 5 Ca 0.62 0.31 0.20 0.00 -1.18 0.00 0.00 61.69 61.64 1cfc s THR 5 Cb -0.25 -2.95 0.32 0.00 1.34 0.00 0.00 72.50 70.96 1cfc s THR 5 CO 0.22 -0.41 2.10 -0.33 -0.54 0.00 0.00 174.62 175.65 1cfc h GLU 6 N -1.24 0.00 -0.01 3.99 4.39 3.82 -0.77 114.58 124.75 1cfc h GLU 6 Ca -0.48 0.00 -0.07 0.00 0.34 0.00 0.00 59.36 59.15 1cfc h GLU 6 Cb 1.27 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 29.92 1cfc h GLU 6 CO 0.57 0.00 -0.27 0.93 -1.16 0.00 0.00 179.01 179.08 1cfc h GLU 7 N 0.00 0.21 -0.64 2.33 4.39 -1.80 -2.35 114.58 116.73 1cfc h GLU 7 Ca 0.09 -0.21 -0.01 0.00 0.34 0.00 0.00 59.36 59.57 1cfc h GLU 7 Cb 0.37 0.05 -0.03 0.00 -0.10 0.00 0.00 28.75 29.04 1cfc h GLU 7 CO -0.00 0.91 0.34 1.96 -1.16 0.00 0.00 179.01 181.06 1cfc h GLN 8 N -0.41 0.88 -0.23 2.33 4.20 -1.74 -0.17 115.11 119.97 1cfc h GLN 8 Ca -0.03 -0.10 -0.10 0.00 0.06 0.00 0.00 58.65 58.48 1cfc h GLN 8 Cb 1.00 -0.18 -0.01 0.00 0.30 0.00 0.00 27.48 28.59 1cfc h GLN 8 CO 0.05 0.65 -0.29 0.82 -0.67 0.00 0.00 178.83 179.40 1cfc h ILE 9 N 0.89 1.27 -0.08 2.54 2.04 -1.18 -3.00 117.51 119.99 1cfc h ILE 9 Ca 0.23 -1.33 -0.05 0.00 1.00 0.00 0.00 64.86 64.71 1cfc h ILE 9 Cb 0.04 1.42 -0.00 0.00 -0.74 0.00 0.00 36.82 37.54 1cfc h ILE 9 CO -0.04 0.42 -0.13 0.00 0.00 0.00 0.00 178.15 178.40 1cfc h ALA 10 N 1.30 0.13 -0.82 1.87 0.00 -0.68 -2.20 119.26 118.86 1cfc h ALA 10 Ca 0.05 -0.33 0.19 0.00 0.00 0.00 0.00 54.91 54.82 1cfc h ALA 10 Cb 0.71 -0.02 -0.12 0.00 0.00 0.00 0.00 17.79 18.36 1cfc h ALA 10 CO 0.05 0.01 0.27 1.49 0.00 0.00 0.00 179.25 181.08 1cfc h GLU 11 N -0.22 0.32 -0.22 0.00 4.22 -0.99 0.48 114.58 118.17 1cfc h GLU 11 Ca 0.01 -0.02 -0.13 0.00 0.08 0.00 0.00 59.36 59.30 1cfc h GLU 11 Cb 0.69 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.86 1cfc h GLU 11 CO 0.03 0.21 -0.42 0.74 -2.18 0.00 0.00 179.01 177.40 1cfc h PHE 12 N 0.33 0.64 -0.61 0.92 0.04 -1.48 -1.71 116.94 115.06 1cfc h PHE 12 Ca 0.48 -0.19 -0.02 0.00 2.80 0.00 0.00 57.97 61.05 1cfc h PHE 12 Cb 0.87 -0.14 -0.03 0.00 2.20 0.00 0.00 35.95 38.86 1cfc h PHE 12 CO -0.21 0.87 0.31 -0.22 -0.60 0.00 0.00 178.31 178.45 1cfc h LYS 13 N 0.44 0.86 -0.22 1.51 3.64 0.53 0.66 116.57 123.99 1cfc h LYS 13 Ca 0.04 -0.12 -0.05 0.00 -1.27 0.00 0.00 60.65 59.25 1cfc h LYS 13 Cb 0.91 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 32.56 1cfc h LYS 13 CO 0.08 0.68 -0.07 0.93 -2.27 0.00 0.00 179.45 178.80 1cfc h GLU 14 N 0.83 0.44 0.00 1.90 4.39 -0.89 -0.48 114.58 120.77 1cfc h GLU 14 Ca 0.21 -0.18 -0.03 0.00 0.34 0.00 0.00 59.36 59.70 1cfc h GLU 14 Cb 0.08 -0.02 -0.00 0.00 -0.10 0.00 0.00 28.75 28.71 1cfc h GLU 14 CO -0.03 0.69 -0.16 0.00 -1.16 0.00 0.00 179.01 178.35 1cfc h ALA 15 N 0.73 1.38 0.02 3.43 0.00 -0.99 -0.94 119.26 122.89 1cfc h ALA 15 Ca 0.05 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 54.79 1cfc h ALA 15 Cb 0.54 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.31 1cfc h ALA 15 CO 0.03 0.20 -0.12 0.35 0.00 0.00 0.00 179.25 179.71 1cfc h PHE 16 N 0.00 0.09 0.00 0.00 3.04 0.71 -3.28 116.94 117.50 1cfc h PHE 16 Ca -0.00 -0.06 -0.02 0.00 3.98 0.00 0.00 57.97 61.87 1cfc h PHE 16 Cb 0.37 -0.01 -0.00 0.00 2.56 0.00 0.00 35.95 38.87 1cfc h PHE 16 CO 0.00 0.99 -0.08 0.77 -2.02 0.00 0.00 178.31 177.97 1cfc h SER 17 N -0.84 0.00 0.00 0.41 0.02 -0.95 -2.39 113.55 109.80 1cfc h SER 17 Ca -0.02 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.93 1cfc h SER 17 Cb 1.03 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.57 1cfc h SER 17 CO 0.02 0.08 0.05 -0.07 -1.14 0.00 0.00 176.83 175.78 1cfc h LEU 18 N 0.00 0.00 -2.86 5.07 3.38 -1.22 -1.25 115.31 118.43 1cfc h LEU 18 Ca -0.00 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 1cfc h LEU 18 Cb 0.42 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.17 1cfc h LEU 18 CO 0.01 0.00 -0.14 0.49 0.09 0.00 0.00 178.44 178.89 1cfc n PHE 19 N -2.84 0.00 -2.94 1.13 3.01 -0.90 -4.86 117.46 110.06 1cfc n PHE 19 Ca -0.02 -0.89 -0.43 0.00 1.01 0.00 0.00 57.45 57.11 1cfc n PHE 19 Cb 0.11 -0.14 0.01 0.00 -0.01 0.00 0.00 39.48 39.45 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 -1.17 6.54 0.00 4.37 2.03 -0.47 -4.73 116.55 123.12 1cfc n ASP 20 Ca 0.14 -3.45 0.11 0.00 0.52 0.00 0.00 54.79 52.11 1cfc n ASP 20 Cb 0.66 -1.26 0.63 0.00 -0.72 0.00 0.00 41.12 40.44 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 0.66 -0.13 -0.67 4.76 -1.26 -2.43 118.16 120.27 1cfc n LYS 21 Ca 0.29 0.00 0.12 0.00 -2.87 0.00 0.00 58.31 55.85 1cfc n LYS 21 Cb 0.32 -1.50 0.18 0.00 -1.84 0.00 0.00 35.03 32.20 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 -1.01 3.28 -1.24 4.39 8.00 -1.26 -4.91 116.55 123.80 1cfc n ASP 22 Ca 0.16 -1.99 -0.09 0.00 0.71 0.00 0.00 54.79 53.57 1cfc n ASP 22 Cb 0.08 -0.17 -0.04 0.00 -0.02 0.00 0.00 41.12 40.97 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 1.45 0.90 0.96 0.44 0.00 -1.02 -4.69 105.19 103.23 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 -0.07 3.00 -0.89 1.61 2.03 -1.26 -4.95 116.55 116.02 1cfc n ASP 24 Ca -0.09 -1.99 -0.08 0.00 0.52 0.00 0.00 54.79 53.14 1cfc n ASP 24 Cb 0.32 -0.00 -0.01 0.00 -0.72 0.00 0.00 41.12 40.71 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 1.35 0.21 3.16 0.27 0.00 -1.26 -5.02 105.19 103.90 1cfc n GLY 25 Ca 0.14 -0.56 -0.10 0.00 0.00 0.00 0.00 46.02 45.49 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 -2.39 0.09 0.12 2.61 -4.23 -1.26 -3.66 115.64 106.92 1cfc s THR 26 Ca 0.00 -1.94 -0.01 0.00 -1.18 0.00 0.00 61.69 58.56 1cfc s THR 26 Cb 0.00 -2.17 -0.04 0.00 1.34 0.00 0.00 72.50 71.63 1cfc s THR 26 CO 0.00 -0.34 0.05 0.27 -0.54 0.00 0.00 174.62 174.06 1cfc s ILE 27 N -4.07 0.11 0.55 2.99 -4.36 -0.34 -4.46 121.20 111.62 1cfc s ILE 27 Ca 0.28 -1.89 -0.03 0.00 -0.26 0.00 0.00 60.65 58.75 1cfc s ILE 27 Cb 0.07 -1.99 0.01 0.00 1.25 0.00 0.00 42.46 41.80 1cfc s ILE 27 CO 0.05 -0.51 0.83 0.42 0.24 0.00 0.00 174.94 175.96 1cfc s THR 28 N -4.04 3.47 0.35 8.37 -4.23 -1.26 -0.84 115.64 117.46 1cfc s THR 28 Ca 0.22 -0.27 0.12 0.00 -1.18 0.00 0.00 61.69 60.58 1cfc s THR 28 Cb 0.07 -3.35 0.07 0.00 1.34 0.00 0.00 72.50 70.64 1cfc s THR 28 CO 0.01 -0.31 1.78 0.71 -0.54 0.00 0.00 174.62 176.27 1cfc h THR 29 N -0.01 1.29 0.00 3.99 1.35 -1.88 -2.53 112.91 115.13 1cfc h THR 29 Ca -0.45 -1.45 -0.02 0.00 -0.55 0.00 0.00 66.41 63.95 1cfc h THR 29 Cb 1.27 1.78 -0.00 0.00 -1.73 0.00 0.00 68.15 69.47 1cfc h THR 29 CO 0.58 0.41 -0.09 0.11 -0.25 0.00 0.00 175.52 176.29 1cfc h LYS 30 N 0.00 0.00 -0.72 4.72 1.57 -1.93 -1.25 116.57 118.96 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 0.75 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.06 1cfc h LYS 30 CO 0.05 0.09 0.00 0.39 -0.57 0.00 0.00 179.45 179.41 1cfc n GLU 31 N -3.87 3.13 0.02 3.15 1.02 -0.96 -4.47 120.64 118.67 1cfc n GLU 31 Ca -0.02 -2.78 -0.13 0.00 -0.02 0.00 0.00 57.16 54.21 1cfc n GLU 31 Cb 0.18 -1.71 -0.09 0.00 -0.02 0.00 0.00 31.44 29.80 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 -0.07 -1.85 -4.62 5.85 -1.18 -2.19 115.31 115.56 1cfc h LEU 32 Ca 0.00 -0.37 -0.03 0.00 0.84 0.00 0.00 57.88 58.33 1cfc h LEU 32 Cb 1.18 0.02 -0.00 0.00 0.37 0.00 0.00 40.66 42.22 1cfc h LEU 32 CO 0.09 0.34 -0.14 1.23 -0.34 0.00 0.00 178.44 179.62 1cfc h GLY 33 N -0.49 0.00 1.08 3.75 0.00 -1.78 -2.06 103.07 103.56 1cfc h GLY 33 Ca -0.01 0.00 -0.16 0.00 0.00 0.00 0.00 47.33 47.16 1cfc h GLY 33 CO 0.01 0.00 -0.45 -0.84 0.00 0.00 0.00 176.54 175.26 1cfc h THR 34 N 0.00 1.29 0.01 4.70 2.02 -1.77 -0.38 112.91 118.78 1cfc h THR 34 Ca -0.00 -1.64 -0.00 0.00 0.77 0.00 0.00 66.41 65.54 1cfc h THR 34 Cb 0.34 1.63 0.00 0.00 -1.74 0.00 0.00 68.15 68.38 1cfc h THR 34 CO 0.02 0.53 -0.00 0.58 0.37 0.00 0.00 175.52 177.01 1cfc h VAL 35 N 0.58 1.26 -0.66 3.16 2.07 -0.90 -2.21 116.25 119.54 1cfc h VAL 35 Ca 0.02 -0.80 0.07 0.00 0.82 0.00 0.00 66.70 66.81 1cfc h VAL 35 Cb 1.06 1.80 -0.04 0.00 -1.52 0.00 0.00 31.29 32.58 1cfc h VAL 35 CO 0.10 0.21 0.44 0.24 0.02 0.00 0.00 177.57 178.58 1cfc h MET 36 N -0.36 0.62 -0.41 1.57 2.86 -1.40 0.72 114.93 118.53 1cfc h MET 36 Ca -0.00 -0.04 -0.03 0.00 -2.06 0.00 0.00 59.70 57.57 1cfc h MET 36 Cb 0.35 -0.14 -0.02 0.00 0.06 0.00 0.00 31.60 31.85 1cfc h MET 36 CO 0.00 0.41 0.11 0.00 1.06 0.00 0.00 176.91 178.49 1cfc h ARG 37 N 0.63 0.60 -0.23 1.72 2.47 -0.69 -1.19 114.38 117.69 1cfc h ARG 37 Ca 0.29 -0.10 -0.02 0.00 -1.26 0.00 0.00 59.98 58.89 1cfc h ARG 37 Cb 0.33 -0.10 -0.01 0.00 -1.65 0.00 0.00 29.97 28.53 1cfc h ARG 37 CO -0.09 0.54 0.05 0.66 0.56 0.00 0.00 179.97 181.69 1cfc h SER 38 N 0.59 0.30 0.11 7.04 4.64 -0.25 0.64 113.55 126.62 1cfc h SER 38 Ca 0.14 -0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.43 1cfc h SER 38 Cb 0.20 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 62.22 1cfc h SER 38 CO -0.01 0.32 -0.00 0.18 -0.87 0.00 0.00 176.83 176.45 1cfc n LEU 39 N -4.40 0.09 0.00 5.97 4.77 -0.52 -4.86 117.00 118.05 1cfc n LEU 39 Ca 0.00 0.03 0.00 0.00 -0.03 0.00 0.00 56.01 56.01 1cfc n LEU 39 Cb 0.16 -0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.19 1cfc n LEU 39 CO 0.36 0.01 0.00 0.61 -1.33 0.00 0.00 177.39 177.05 1cfc n GLY 40 N 1.07 0.74 3.88 -0.72 0.00 0.22 -5.06 105.19 105.32 1cfc n GLY 40 Ca 0.22 -0.14 -0.37 0.00 0.00 0.00 0.00 46.02 45.74 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 -0.63 3.44 -0.47 1.61 -0.21 -0.77 -4.99 119.66 117.63 1cfc s GLN 41 Ca 0.00 -0.16 0.06 0.00 0.02 0.00 0.00 55.36 55.29 1cfc s GLN 41 Cb 0.00 -3.18 0.22 0.00 1.00 0.00 0.00 33.01 31.05 1cfc s GLN 41 CO 0.00 0.77 0.51 -1.71 -2.12 0.00 0.00 175.29 172.74 1cfc n ASN 42 N 1.85 0.96 -4.78 5.90 4.05 -1.26 -3.29 115.26 118.69 1cfc n ASN 42 Ca -0.19 -2.80 -0.34 0.00 0.45 0.00 0.00 54.58 51.70 1cfc n ASN 42 Cb 0.55 -0.63 0.01 0.00 1.23 0.00 0.00 39.78 40.93 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 -1.13 3.26 0.91 1.20 0.04 -1.26 -5.01 135.00 133.00 1cfc s PRO 43 Ca 0.34 1.48 -0.12 0.00 0.04 0.00 0.00 61.00 62.74 1cfc s PRO 43 Cb 0.11 -2.00 0.14 0.00 0.04 0.00 0.00 34.50 32.78 1cfc s PRO 43 CO -0.12 -0.90 1.09 0.95 0.04 0.00 0.00 177.00 178.06 1cfc s THR 44 N -2.02 2.53 0.27 1.26 -4.23 -1.26 -4.80 115.64 107.39 1cfc s THR 44 Ca 0.70 0.17 -0.04 0.00 -1.18 0.00 0.00 61.69 61.34 1cfc s THR 44 Cb -0.21 -2.70 0.26 0.00 1.34 0.00 0.00 72.50 71.19 1cfc s THR 44 CO 0.31 -0.22 1.94 -0.33 -0.54 0.00 0.00 174.62 175.77 1cfc h GLU 45 N -1.58 1.22 -0.60 3.99 5.08 -1.99 -1.74 114.58 118.96 1cfc h GLU 45 Ca -0.50 -0.07 -0.08 0.00 -1.00 0.00 0.00 59.36 57.70 1cfc h GLU 45 Cb 1.30 -0.27 -0.02 0.00 0.50 0.00 0.00 28.75 30.25 1cfc h GLU 45 CO 0.56 0.80 0.05 0.00 -1.00 0.00 0.00 179.01 179.43 1cfc h ALA 46 N 1.42 0.80 -0.70 3.43 0.00 -1.98 0.18 119.26 122.41 1cfc h ALA 46 Ca 0.36 -0.28 0.02 0.00 0.00 0.00 0.00 54.91 55.01 1cfc h ALA 46 Cb -0.09 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 17.44 1cfc h ALA 46 CO -0.09 0.59 0.46 0.93 0.00 0.00 0.00 179.25 181.14 1cfc h GLU 47 N 0.92 0.85 -0.05 0.00 5.08 -1.71 -0.90 114.58 118.77 1cfc h GLU 47 Ca 0.18 -0.05 -0.07 0.00 -1.00 0.00 0.00 59.36 58.42 1cfc h GLU 47 Cb 0.49 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 29.55 1cfc h GLU 47 CO 0.02 0.56 -0.23 -0.07 -1.00 0.00 0.00 179.01 178.29 1cfc h LEU 48 N 0.88 0.30 -2.39 1.33 3.38 -0.61 -3.08 115.31 115.11 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 -0.00 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 40.66 1cfc h LEU 48 CO -0.07 0.90 -0.03 1.56 0.09 0.00 0.00 178.44 180.88 1cfc h GLN 49 N -0.28 0.00 0.01 1.13 4.20 -0.21 -1.50 115.11 118.46 1cfc h GLN 49 Ca -0.01 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.70 1cfc h GLN 49 Cb 0.88 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.66 1cfc h GLN 49 CO 0.05 0.03 -0.00 0.22 -0.67 0.00 0.00 178.83 178.46 1cfc h ASP 50 N 0.00 -0.01 0.28 1.46 3.58 -1.13 -2.84 116.42 117.75 1cfc h ASP 50 Ca -0.00 -0.70 -0.04 0.00 0.42 0.00 0.00 57.03 56.70 1cfc h ASP 50 Cb 0.12 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.17 1cfc h ASP 50 CO 0.00 0.71 -0.21 0.24 -2.88 0.00 0.00 179.24 177.10 1cfc h MET 51 N -0.74 0.00 -0.61 0.28 2.86 -1.40 -2.20 114.93 113.12 1cfc h MET 51 Ca -0.00 0.00 -0.08 0.00 -2.06 0.00 0.00 59.70 57.56 1cfc h MET 51 Cb 0.71 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.35 1cfc h MET 51 CO 0.00 0.21 0.07 0.82 1.06 0.00 0.00 176.91 179.07 1cfc h ILE 52 N 0.00 1.26 -1.01 -1.22 2.04 -1.26 0.40 117.51 117.72 1cfc h ILE 52 Ca -0.00 -1.03 0.07 0.00 1.00 0.00 0.00 64.86 64.90 1cfc h ILE 52 Cb 0.41 0.72 -0.07 0.00 -0.74 0.00 0.00 36.82 37.14 1cfc h ILE 52 CO 0.03 0.38 0.65 -1.13 0.00 0.00 0.00 178.15 178.08 1cfc h ASN 53 N 0.94 1.02 0.01 1.72 -1.24 -1.14 0.90 115.58 117.79 1cfc h ASN 53 Ca 0.18 0.02 -0.02 0.00 0.71 0.00 0.00 56.30 57.19 1cfc h ASN 53 Cb 0.45 -0.20 -0.00 0.00 0.73 0.00 0.00 38.32 39.30 1cfc h ASN 53 CO 0.02 0.64 -0.11 -0.33 -1.29 0.00 0.00 177.43 176.35 1cfc h GLU 54 N 1.15 0.02 -0.09 6.67 3.07 -1.51 -3.31 114.58 120.57 1cfc h GLU 54 Ca 0.44 -0.03 -0.01 0.00 -0.50 0.00 0.00 59.36 59.26 1cfc h GLU 54 Cb 0.22 0.01 -0.01 0.00 -0.84 0.00 0.00 28.75 28.14 1cfc h GLU 54 CO -0.19 1.01 -0.02 0.28 -1.40 0.00 0.00 179.01 178.70 1cfc h VAL 55 N -0.96 1.07 0.00 3.13 2.07 -0.73 -1.97 116.25 118.86 1cfc h VAL 55 Ca -0.03 -0.28 -0.04 0.00 0.82 0.00 0.00 66.70 67.17 1cfc h VAL 55 Cb 1.06 1.02 -0.02 0.00 -1.52 0.00 0.00 31.29 31.83 1cfc h VAL 55 CO -0.00 0.09 -0.09 -0.67 0.02 0.00 0.00 177.57 176.92 1cfc n ASP 56 N -4.44 5.27 0.17 0.57 2.03 0.31 -4.07 116.55 116.39 1cfc n ASP 56 Ca -0.02 -2.41 0.06 0.00 0.52 0.00 0.00 54.79 52.94 1cfc n ASP 56 Cb 0.14 -1.19 0.14 0.00 -0.72 0.00 0.00 41.12 39.50 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 1.49 0.81 0.00 -1.67 0.00 -1.54 -2.93 119.26 115.42 1cfc h ALA 57 Ca 0.04 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.65 1cfc h ALA 57 Cb 1.11 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.84 1cfc h ALA 57 CO 0.05 0.42 0.00 0.22 0.00 0.00 0.00 179.25 179.95 1cfc h ASP 58 N 0.00 0.00 -0.25 0.00 3.58 -1.86 -3.47 116.42 114.42 1cfc h ASP 58 Ca -0.00 0.00 -0.11 0.00 0.42 0.00 0.00 57.03 57.34 1cfc h ASP 58 Cb 1.18 0.00 -0.04 0.00 1.72 0.00 0.00 39.33 42.18 1cfc h ASP 58 CO 0.04 0.00 -0.10 0.61 -2.88 0.00 0.00 179.24 176.92 1cfc n GLY 59 N 1.12 0.77 0.88 -0.78 0.00 -1.11 -4.88 105.19 101.20 1cfc n GLY 59 Ca 0.04 -0.51 0.12 0.00 0.00 0.00 0.00 46.02 45.68 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 0.47 2.83 -2.71 1.61 4.13 -1.26 -4.96 115.26 115.37 1cfc n ASN 60 Ca -0.05 -1.92 -0.22 0.00 1.68 0.00 0.00 54.58 54.07 1cfc n ASN 60 Cb 0.23 0.07 0.01 0.00 -1.54 0.00 0.00 39.78 38.55 1cfc n ASN 60 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1cfc n GLY 61 N 1.36 -0.50 3.20 7.41 0.00 -1.26 -4.98 105.19 110.42 1cfc n GLY 61 Ca 0.13 0.06 -0.12 0.00 0.00 0.00 0.00 46.02 46.10 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 -3.12 0.01 -0.01 2.61 -4.23 -1.26 -3.22 115.64 106.43 1cfc s THR 62 Ca 0.16 -2.00 -0.00 0.00 -1.18 0.00 0.00 61.69 58.67 1cfc s THR 62 Cb -0.07 -2.49 0.01 0.00 1.34 0.00 0.00 72.50 71.29 1cfc s THR 62 CO 0.20 -0.01 0.01 -0.63 -0.54 0.00 0.00 174.62 173.65 1cfc s ILE 63 N -4.15 -0.01 0.35 2.99 1.01 -0.02 -4.85 121.20 116.52 1cfc s ILE 63 Ca 0.39 0.04 0.07 0.00 0.00 0.00 0.00 60.65 61.15 1cfc s ILE 63 Cb 0.07 -0.03 -0.02 0.00 0.01 0.00 0.00 42.46 42.49 1cfc s ILE 63 CO 0.12 0.02 0.37 1.51 0.00 0.00 0.00 174.94 176.95 1cfc s ASP 64 N 0.19 5.45 0.16 3.58 1.47 -1.26 -1.20 116.67 125.06 1cfc s ASP 64 Ca -0.02 -0.45 -0.14 0.00 1.18 0.00 0.00 52.55 53.13 1cfc s ASP 64 Cb -0.02 -0.96 0.05 0.00 -0.34 0.00 0.00 42.92 41.65 1cfc s ASP 64 CO -0.01 -0.45 1.78 0.15 0.68 0.00 0.00 175.17 177.32 1cfc h PHE 65 N 1.08 0.71 -0.13 2.11 3.57 -1.97 -0.66 116.94 121.64 1cfc h PHE 65 Ca -0.44 -0.02 0.04 0.00 3.53 0.00 0.00 57.97 61.09 1cfc h PHE 65 Cb 1.26 -0.23 -0.05 0.00 2.79 0.00 0.00 35.95 39.72 1cfc h PHE 65 CO 0.49 0.52 -0.18 -1.35 -2.23 0.00 0.00 178.31 175.57 1cfc h PRO 66 N 0.69 -0.22 -0.09 6.41 0.11 -1.96 0.47 132.00 137.42 1cfc h PRO 66 Ca 0.18 0.01 -0.05 0.00 0.11 0.00 0.00 66.00 66.26 1cfc h PRO 66 Cb 0.04 0.05 -0.01 0.00 0.11 0.00 0.00 31.00 31.19 1cfc h PRO 66 CO -0.03 -0.14 -0.16 0.93 -0.21 0.00 0.00 178.00 178.39 1cfc h GLU 67 N -0.22 0.14 -0.59 1.05 5.08 -1.95 -1.62 114.58 116.47 1cfc h GLU 67 Ca 0.10 -0.03 -0.03 0.00 -1.00 0.00 0.00 59.36 58.40 1cfc h GLU 67 Cb 0.37 -0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.57 1cfc h GLU 67 CO -0.27 0.30 0.25 0.35 -1.00 0.00 0.00 179.01 178.65 1cfc h PHE 68 N 0.13 0.85 0.00 4.33 3.57 0.63 -0.75 116.94 125.70 1cfc h PHE 68 Ca 0.03 -0.04 -0.06 0.00 3.53 0.00 0.00 57.97 61.43 1cfc h PHE 68 Cb 0.37 -0.26 -0.01 0.00 2.79 0.00 0.00 35.95 38.84 1cfc h PHE 68 CO 0.00 0.65 -0.27 -0.07 -2.23 0.00 0.00 178.31 176.39 1cfc h LEU 69 N 0.84 0.00 -0.13 0.59 3.38 -0.11 -2.77 115.31 117.11 1cfc h LEU 69 Ca 0.20 0.00 -0.23 0.00 0.09 0.00 0.00 57.88 57.94 1cfc h LEU 69 Cb 0.14 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.89 1cfc h LEU 69 CO -0.02 0.27 -0.99 0.74 0.09 0.00 0.00 178.44 178.53 1cfc h THR 70 N 0.00 1.42 -0.02 0.22 2.02 -0.91 -2.44 112.91 113.20 1cfc h THR 70 Ca -0.00 -2.54 -0.15 0.00 0.77 0.00 0.00 66.41 64.49 1cfc h THR 70 Cb 0.68 2.50 -0.02 0.00 -1.74 0.00 0.00 68.15 69.57 1cfc h THR 70 CO 0.03 0.76 -0.68 0.00 0.37 0.00 0.00 175.52 176.00 1cfc h MET 71 N 0.20 0.10 -0.14 6.66 -0.00 -1.26 -2.70 114.93 117.78 1cfc h MET 71 Ca -0.09 -0.08 -0.22 0.00 -0.00 0.00 0.00 59.70 59.31 1cfc h MET 71 Cb 1.64 0.02 0.01 0.00 -0.00 0.00 0.00 31.60 33.26 1cfc h MET 71 CO 0.17 0.74 -0.79 0.52 -0.00 0.00 0.00 176.91 177.55 1cfc h MET 72 N 0.07 0.77 -0.05 -0.10 2.07 -1.51 -2.98 114.93 113.20 1cfc h MET 72 Ca -0.01 -0.63 -0.06 0.00 -2.07 0.00 0.00 59.70 56.93 1cfc h MET 72 Cb 1.21 0.13 -0.01 0.00 -1.87 0.00 0.00 31.60 31.06 1cfc h MET 72 CO 0.10 1.24 -0.23 0.00 1.07 0.00 0.00 176.91 179.08 1cfc h ALA 73 N 0.58 1.52 -0.30 6.32 0.00 -1.40 0.10 119.26 126.08 1cfc h ALA 73 Ca -0.05 -0.24 -0.09 0.00 0.00 0.00 0.00 54.91 54.52 1cfc h ALA 73 Cb 1.42 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 19.13 1cfc h ALA 73 CO 0.16 0.35 -0.20 0.00 0.00 0.00 0.00 179.25 179.56 1cfc h ARG 74 N 0.07 0.55 -0.00 0.00 2.47 -1.36 -3.01 114.38 113.09 1cfc h ARG 74 Ca 0.01 -0.19 -0.14 0.00 -1.26 0.00 0.00 59.98 58.40 1cfc h ARG 74 Cb 0.46 -0.04 0.01 0.00 -1.65 0.00 0.00 29.97 28.75 1cfc h ARG 74 CO 0.03 0.72 -0.54 0.87 0.56 0.00 0.00 179.97 181.61 1cfc h LYS 75 N 0.49 0.37 -2.53 0.04 1.79 -1.20 -3.28 116.57 112.26 1cfc h LYS 75 Ca 0.08 -0.40 -0.47 0.00 -2.18 0.00 0.00 60.65 57.68 1cfc h LYS 75 Cb 0.62 0.11 -0.03 0.00 -1.58 0.00 0.00 32.23 31.35 1cfc h LYS 75 CO 0.04 1.07 1.92 -1.33 -1.08 0.00 0.00 179.45 180.08 1cfc n MET 76 N -4.26 3.02 0.00 3.15 2.81 -0.06 -4.74 117.12 117.04 1cfc n MET 76 Ca -0.10 -1.80 0.00 0.00 -1.81 0.00 0.00 57.70 53.99 1cfc n MET 76 Cb 0.64 -2.44 0.00 0.00 -0.71 0.00 0.00 33.22 30.71 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 2.92 0.00 0.00 0.03 5.02 -1.19 -3.04 118.16 121.90 1cfc n LYS 77 Ca 0.62 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.91 1cfc n LYS 77 Cb 0.52 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.53 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 -2.24 4.39 -0.08 -1.26 0.63 116.55 117.99 1cfc n ASP 78 Ca 0.00 0.03 -0.23 0.00 -1.51 0.00 0.00 54.79 53.08 1cfc n ASP 78 Cb 0.00 -0.03 0.01 0.00 2.34 0.00 0.00 41.12 43.44 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 -1.01 2.37 -0.81 5.18 5.66 -1.26 -5.04 114.28 119.37 1cfc n THR 79 Ca 0.00 -4.37 -0.35 0.00 -3.05 0.00 0.00 64.05 56.29 1cfc n THR 79 Cb 0.45 -1.01 0.11 0.00 -1.55 0.00 0.00 70.33 68.33 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 -0.61 -2.80 0.17 1.09 2.03 0.20 -4.83 116.55 111.80 1cfc n ASP 80 Ca 0.39 -0.02 0.12 0.00 0.52 0.00 0.00 54.79 55.80 1cfc n ASP 80 Cb 0.85 -0.83 0.09 0.00 -0.72 0.00 0.00 41.12 40.52 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 -1.61 0.00 -0.27 1.67 0.87 3.07 -3.27 113.55 114.01 1cfc h SER 81 Ca -0.48 -0.00 -0.06 0.00 -1.23 0.00 0.00 61.79 60.03 1cfc h SER 81 Cb 1.36 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 63.31 1cfc h SER 81 CO 0.32 0.00 -0.06 -0.33 -0.53 0.00 0.00 176.83 176.23 1cfc h GLU 82 N 0.00 0.52 0.00 2.24 4.39 36.72 -2.36 114.58 156.09 1cfc h GLU 82 Ca 0.00 -0.19 -0.00 0.00 0.34 0.00 0.00 59.36 59.51 1cfc h GLU 82 Cb 1.00 -0.03 -0.00 0.00 -0.10 0.00 0.00 28.75 29.62 1cfc h GLU 82 CO 0.00 0.72 -0.00 0.93 -1.16 0.00 0.00 179.01 179.50 1cfc h GLU 83 N 0.27 0.00 0.02 2.33 4.39 0.21 1.00 114.58 122.80 1cfc h GLU 83 Ca 0.07 0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.74 1cfc h GLU 83 Cb 0.52 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.18 1cfc h GLU 83 CO 0.02 0.00 -0.14 0.93 -1.16 0.00 0.00 179.01 178.66 1cfc h GLU 84 N 0.00 0.07 -0.26 2.33 4.39 -1.53 -1.78 114.58 117.80 1cfc h GLU 84 Ca -0.00 -0.10 -0.15 0.00 0.34 0.00 0.00 59.36 59.46 1cfc h GLU 84 Cb 0.30 0.03 -0.00 0.00 -0.10 0.00 0.00 28.75 28.98 1cfc h GLU 84 CO 0.00 0.96 -0.41 0.82 -1.16 0.00 0.00 179.01 179.22 1cfc h ILE 85 N -0.78 1.30 0.00 3.13 2.04 -1.21 -2.86 117.51 119.14 1cfc h ILE 85 Ca -0.02 -1.61 -0.05 0.00 1.00 0.00 0.00 64.86 64.17 1cfc h ILE 85 Cb 1.03 1.70 -0.01 0.00 -0.74 0.00 0.00 36.82 38.80 1cfc h ILE 85 CO 0.03 0.51 -0.24 -0.09 0.00 0.00 0.00 178.15 178.36 1cfc h ARG 86 N 0.47 0.00 0.00 2.37 2.43 -1.00 -1.19 114.38 117.46 1cfc h ARG 86 Ca 0.02 0.00 -0.10 0.00 -0.81 0.00 0.00 59.98 59.09 1cfc h ARG 86 Cb 1.01 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.55 1cfc h ARG 86 CO 0.09 0.24 -0.48 0.93 -1.51 0.00 0.00 179.97 179.24 1cfc h GLU 87 N 0.00 0.00 0.20 0.20 5.08 -1.12 0.21 114.58 119.14 1cfc h GLU 87 Ca -0.00 0.00 -0.31 0.00 -1.00 0.00 0.00 59.36 58.04 1cfc h GLU 87 Cb 0.44 0.00 0.03 0.00 0.50 0.00 0.00 28.75 29.73 1cfc h GLU 87 CO 0.03 0.48 -1.35 0.00 -1.00 0.00 0.00 179.01 177.18 1cfc h ALA 88 N 1.52 -0.11 -0.29 3.43 0.00 -1.15 -2.94 119.26 119.72 1cfc h ALA 88 Ca -0.00 -0.81 -0.04 0.00 0.00 0.00 0.00 54.91 54.05 1cfc h ALA 88 Cb 0.98 0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.90 1cfc h ALA 88 CO 0.06 0.66 0.01 0.74 0.00 0.00 0.00 179.25 180.72 1cfc h PHE 89 N 0.15 0.44 -0.18 0.00 0.04 -1.07 -1.87 116.94 114.44 1cfc h PHE 89 Ca -0.23 -0.03 0.04 0.00 2.80 0.00 0.00 57.97 60.55 1cfc h PHE 89 Cb 2.04 -0.13 -0.04 0.00 2.20 0.00 0.00 35.95 40.02 1cfc h PHE 89 CO 0.13 0.43 -0.08 -0.09 -0.60 0.00 0.00 178.31 178.10 1cfc h ARG 90 N 0.42 -0.06 -0.49 1.51 2.43 -0.46 1.09 114.38 118.82 1cfc h ARG 90 Ca 0.09 0.00 0.14 0.00 -0.81 0.00 0.00 59.98 59.41 1cfc h ARG 90 Cb 0.26 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.81 1cfc h ARG 90 CO 0.01 -0.04 0.52 0.28 -1.51 0.00 0.00 179.97 179.23 1cfc h VAL 91 N -0.06 0.35 -0.00 0.20 2.07 -1.17 0.35 116.25 117.99 1cfc h VAL 91 Ca 0.10 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.62 1cfc h VAL 91 Cb 0.20 0.59 0.00 0.00 -1.52 0.00 0.00 31.29 30.56 1cfc h VAL 91 CO -0.22 0.00 -0.91 0.49 0.02 0.00 0.00 177.57 176.95 1cfc n PHE 92 N -3.70 0.00 -2.01 1.57 3.72 0.27 -4.52 117.46 112.79 1cfc n PHE 92 Ca 0.09 0.00 -0.41 0.00 -0.05 0.00 0.00 57.45 57.09 1cfc n PHE 92 Cb 0.72 -0.00 -0.00 0.00 -0.94 0.00 0.00 39.48 39.25 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 -1.25 7.39 0.32 4.37 2.03 0.30 -4.69 116.55 125.02 1cfc n ASP 93 Ca 0.05 -3.09 0.21 0.00 0.52 0.00 0.00 54.79 52.48 1cfc n ASP 93 Cb 0.35 -1.41 1.13 0.00 -0.72 0.00 0.00 41.12 40.47 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 4.91 0.00 -0.50 -0.67 1.57 -1.79 -0.54 116.57 119.54 1cfc h LYS 94 Ca 0.65 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.43 1cfc h LYS 94 Cb 0.38 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.69 1cfc h LYS 94 CO 1.54 0.00 0.00 -0.25 -0.57 0.00 0.00 179.45 180.17 1cfc n ASP 95 N -2.99 3.53 -0.87 0.86 8.00 -1.26 -4.91 116.55 118.91 1cfc n ASP 95 Ca -0.03 -1.99 -0.03 0.00 0.71 0.00 0.00 54.79 53.45 1cfc n ASP 95 Cb 0.08 -0.33 -0.01 0.00 -0.02 0.00 0.00 41.12 40.84 1cfc n ASP 95 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1cfc n GLY 96 N 1.54 0.33 0.00 0.44 0.00 -0.21 -4.64 105.19 102.65 1cfc n GLY 96 Ca 0.21 0.00 0.10 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 0.87 0.72 0.00 1.61 2.85 -1.26 -4.97 115.26 115.08 1cfc n ASN 97 Ca -0.03 -0.69 0.00 0.00 -0.11 0.00 0.00 54.58 53.75 1cfc n ASN 97 Cb 0.14 1.20 0.00 0.00 1.24 0.00 0.00 39.78 42.36 1cfc n ASN 97 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1cfc n GLY 98 N 1.43 0.66 2.93 8.20 0.00 -1.26 -5.06 105.19 112.09 1cfc n GLY 98 Ca 0.02 -0.57 -0.18 0.00 0.00 0.00 0.00 46.02 45.29 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 -2.00 0.61 0.20 1.61 1.51 -1.26 -3.79 117.35 114.24 1cfc s TYR 99 Ca 0.00 -0.13 -0.02 0.00 -1.01 0.00 0.00 57.07 55.91 1cfc s TYR 99 Cb 0.00 -0.49 -0.04 0.00 -0.11 0.00 0.00 41.96 41.32 1cfc s TYR 99 CO 0.00 -0.09 0.15 0.96 -1.11 0.00 0.00 175.55 175.46 1cfc s ILE 100 N 0.39 0.00 0.26 2.71 -4.36 -1.22 -4.80 121.20 114.18 1cfc s ILE 100 Ca -0.05 -1.96 -0.30 0.00 -0.26 0.00 0.00 60.65 58.08 1cfc s ILE 100 Cb -0.09 -2.48 -0.09 0.00 1.25 0.00 0.00 42.46 41.05 1cfc s ILE 100 CO -0.00 0.00 1.02 -0.94 0.24 0.00 0.00 174.94 175.26 1cfc s SER 101 N -3.15 7.46 0.44 4.36 1.04 -1.26 -2.86 113.70 119.72 1cfc s SER 101 Ca 0.38 2.11 0.29 0.00 0.48 0.00 0.00 55.95 59.21 1cfc s SER 101 Cb 0.06 -2.62 1.39 0.00 0.10 0.00 0.00 66.02 64.95 1cfc s SER 101 CO 0.12 0.00 1.66 0.00 0.98 0.00 0.00 173.24 176.00 1cfc h ALA 102 N 4.01 2.72 0.51 5.32 0.00 -1.92 0.20 119.26 130.10 1cfc h ALA 102 Ca -0.46 0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.51 1cfc h ALA 102 Cb 1.21 0.16 0.01 0.00 0.00 0.00 0.00 17.79 19.16 1cfc h ALA 102 CO 0.68 -1.29 -0.25 0.00 0.00 0.00 0.00 179.25 178.39 1cfc h ALA 103 N 1.56 -0.69 -0.55 0.00 0.00 -1.93 0.46 119.26 118.12 1cfc h ALA 103 Ca 0.77 -0.17 0.09 0.00 0.00 0.00 0.00 54.91 55.60 1cfc h ALA 103 Cb 2.41 0.27 -0.03 0.00 0.00 0.00 0.00 17.79 20.43 1cfc h ALA 103 CO -0.35 -0.85 0.37 0.93 0.00 0.00 0.00 179.25 179.35 1cfc h GLU 104 N -0.76 0.34 0.03 0.00 5.08 -1.05 0.48 114.58 118.72 1cfc h GLU 104 Ca -0.07 -0.02 -0.00 0.00 -1.00 0.00 0.00 59.36 58.27 1cfc h GLU 104 Cb 0.56 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.73 1cfc h GLU 104 CO 0.12 0.23 -0.02 1.25 -1.00 0.00 0.00 179.01 179.59 1cfc h LEU 105 N 0.35 -0.04 -1.18 1.33 5.85 -0.12 0.43 115.31 121.94 1cfc h LEU 105 Ca 0.25 -0.42 0.00 0.00 0.84 0.00 0.00 57.88 58.55 1cfc h LEU 105 Cb 0.53 0.01 -0.04 0.00 0.37 0.00 0.00 40.66 41.53 1cfc h LEU 105 CO -0.06 0.41 0.49 0.03 -0.34 0.00 0.00 178.44 178.97 1cfc h ARG 106 N -0.49 1.05 -0.51 1.25 3.08 0.80 -1.53 114.38 118.03 1cfc h ARG 106 Ca -0.00 -0.08 -0.04 0.00 0.07 0.00 0.00 59.98 59.93 1cfc h ARG 106 Cb 0.46 -0.23 -0.02 0.00 0.08 0.00 0.00 29.97 30.26 1cfc h ARG 106 CO 0.01 0.72 0.16 1.25 -1.07 0.00 0.00 179.97 181.04 1cfc h HIS 107 N 1.07 0.81 -0.61 3.04 2.76 0.18 -0.20 115.15 122.21 1cfc h HIS 107 Ca 0.28 -0.08 0.03 0.00 -2.20 0.00 0.00 60.37 58.40 1cfc h HIS 107 Cb -0.08 -0.24 -0.03 0.00 1.55 0.00 0.00 27.41 28.61 1cfc h HIS 107 CO 0.00 0.70 0.40 0.28 -1.30 0.00 0.00 177.93 178.02 1cfc h VAL 108 N 0.69 1.10 0.00 5.26 2.07 0.82 0.16 116.25 126.35 1cfc h VAL 108 Ca 0.16 -0.26 -0.19 0.00 0.82 0.00 0.00 66.70 67.24 1cfc h VAL 108 Cb 0.27 0.29 -0.03 0.00 -1.52 0.00 0.00 31.29 30.30 1cfc h VAL 108 CO -0.01 0.14 -0.90 0.24 0.02 0.00 0.00 177.57 177.06 1cfc h MET 109 N 0.75 0.00 0.09 1.57 2.07 -0.63 -3.07 114.93 115.71 1cfc h MET 109 Ca 0.24 -0.00 -0.24 0.00 -2.07 0.00 0.00 59.70 57.63 1cfc h MET 109 Cb 0.03 0.00 -0.00 0.00 -1.87 0.00 0.00 31.60 29.76 1cfc h MET 109 CO -0.06 0.90 -1.22 1.79 1.07 0.00 0.00 176.91 179.39 1cfc h THR 110 N 0.00 1.13 0.00 2.22 1.35 -0.28 -3.34 112.91 113.99 1cfc h THR 110 Ca -0.01 -2.38 -0.02 0.00 -0.55 0.00 0.00 66.41 63.45 1cfc h THR 110 Cb 1.58 2.76 -0.00 0.00 -1.73 0.00 0.00 68.15 70.77 1cfc h THR 110 CO 0.12 0.65 -0.08 0.78 -0.25 0.00 0.00 175.52 176.73 1cfc h ASN 111 N -0.45 0.00 0.00 5.36 -0.26 -0.85 -1.70 115.58 117.69 1cfc h ASN 111 Ca -0.27 0.00 -0.00 0.00 -0.56 0.00 0.00 56.30 55.47 1cfc h ASN 111 Cb 1.63 0.00 -0.00 0.00 -1.06 0.00 0.00 38.32 38.89 1cfc h ASN 111 CO 0.03 0.08 -0.00 -0.07 -1.06 0.00 0.00 177.43 176.42 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 0.19 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 1.13 3.81 0.83 0.00 -0.64 -5.06 105.19 103.87 1cfc n GLY 113 Ca -0.03 -0.46 -0.34 0.00 0.00 0.00 0.00 46.02 45.19 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 -2.42 4.29 0.00 1.61 0.41 -1.26 -4.90 118.70 116.44 1cfc s GLU 114 Ca 0.00 1.18 -0.02 0.00 -0.41 0.00 0.00 54.97 55.72 1cfc s GLU 114 Cb 0.00 -2.32 -0.08 0.00 -1.78 0.00 0.00 34.13 29.95 1cfc s GLU 114 CO 0.00 0.02 2.45 1.63 -0.49 0.00 0.00 175.26 178.87 1cfc n LYS 115 N -0.38 1.28 -3.12 1.61 5.02 -1.26 -4.85 118.16 116.46 1cfc n LYS 115 Ca 0.06 -0.30 -0.39 0.00 -2.02 0.00 0.00 58.31 55.66 1cfc n LYS 115 Cb 0.53 -1.31 -0.06 0.00 -0.02 0.00 0.00 35.03 34.17 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 4.54 -0.02 -0.35 0.05 -1.26 -5.07 118.68 116.57 1cfc s LEU 116 Ca 0.20 1.43 -0.00 0.00 0.05 0.00 0.00 54.13 55.81 1cfc s LEU 116 Cb 0.10 -3.10 -0.04 0.00 -2.05 0.00 0.00 46.19 41.11 1cfc s LEU 116 CO 0.00 0.21 0.04 0.42 -0.55 0.00 0.00 176.35 176.47 1cfc s THR 117 N -0.97 4.45 0.64 5.48 -4.23 -1.26 -4.96 115.64 114.79 1cfc s THR 117 Ca 0.33 -0.43 0.19 0.00 -1.18 0.00 0.00 61.69 60.60 1cfc s THR 117 Cb -0.21 -2.98 0.19 0.00 1.34 0.00 0.00 72.50 70.84 1cfc s THR 117 CO 0.22 0.42 1.57 0.44 -0.54 0.00 0.00 174.62 176.73 1cfc h ASP 118 N 4.44 0.00 -0.03 3.99 3.32 -2.00 0.16 116.42 126.29 1cfc h ASP 118 Ca -0.50 0.00 -0.11 0.00 0.02 0.00 0.00 57.03 56.45 1cfc h ASP 118 Cb 1.18 0.00 0.01 0.00 0.22 0.00 0.00 39.33 40.74 1cfc h ASP 118 CO 0.59 0.00 -0.40 -0.33 -1.72 0.00 0.00 179.24 177.37 1cfc h GLU 119 N 0.00 0.33 -0.55 3.56 5.08 -1.99 -1.18 114.58 119.83 1cfc h GLU 119 Ca 0.00 -0.31 0.00 0.00 -1.00 0.00 0.00 59.36 58.05 1cfc h GLU 119 Cb 1.14 0.08 -0.03 0.00 0.50 0.00 0.00 28.75 30.44 1cfc h GLU 119 CO 0.00 0.98 0.35 0.93 -1.00 0.00 0.00 179.01 180.27 1cfc h GLU 120 N -0.20 0.74 -0.26 2.33 5.08 -1.08 -2.43 114.58 118.75 1cfc h GLU 120 Ca -0.04 -0.05 -0.15 0.00 -1.00 0.00 0.00 59.36 58.11 1cfc h GLU 120 Cb 1.10 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 30.18 1cfc h GLU 120 CO 0.08 0.51 -0.45 0.28 -1.00 0.00 0.00 179.01 178.43 1cfc h VAL 121 N 0.75 1.30 -1.01 3.13 2.07 -1.59 -2.84 116.25 118.05 1cfc h VAL 121 Ca 0.20 -1.64 0.25 0.00 0.82 0.00 0.00 66.70 66.33 1cfc h VAL 121 Cb -0.06 1.58 -0.08 0.00 -1.52 0.00 0.00 31.29 31.21 1cfc h VAL 121 CO -0.04 0.52 0.66 0.44 0.02 0.00 0.00 177.57 179.17 1cfc h ASP 122 N 0.54 0.43 -0.10 0.57 5.19 -0.71 0.36 116.42 122.69 1cfc h ASP 122 Ca 0.03 0.07 -0.11 0.00 -0.62 0.00 0.00 57.03 56.40 1cfc h ASP 122 Cb 0.99 -0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.51 1cfc h ASP 122 CO 0.09 0.11 -0.37 -0.08 -3.12 0.00 0.00 179.24 175.88 1cfc h GLU 123 N 0.39 0.43 -0.14 3.56 4.57 -1.32 -2.59 114.58 119.48 1cfc h GLU 123 Ca 0.56 -0.32 0.04 0.00 -1.18 0.00 0.00 59.36 58.45 1cfc h GLU 123 Cb 1.43 0.06 -0.01 0.00 -0.16 0.00 0.00 28.75 30.07 1cfc h GLU 123 CO -0.25 0.95 0.13 0.52 -1.18 0.00 0.00 179.01 179.17 1cfc h MET 124 N -0.01 0.00 0.00 1.92 2.86 -0.34 0.49 114.93 119.85 1cfc h MET 124 Ca -0.02 0.00 -0.13 0.00 -2.06 0.00 0.00 59.70 57.50 1cfc h MET 124 Cb 1.00 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.64 1cfc h MET 124 CO 0.08 0.00 -0.60 0.82 1.06 0.00 0.00 176.91 178.27 1cfc h ILE 125 N 0.00 1.04 0.72 -1.22 2.04 -0.35 -3.07 117.51 116.68 1cfc h ILE 125 Ca 0.07 -2.44 -0.04 0.00 1.00 0.00 0.00 64.86 63.45 1cfc h ILE 125 Cb 0.32 2.50 0.01 0.00 -0.74 0.00 0.00 36.82 38.90 1cfc h ILE 125 CO -0.00 0.59 -0.35 0.03 0.00 0.00 0.00 178.15 178.42 1cfc h ARG 126 N 0.00 -0.94 0.00 2.37 2.47 -0.51 -3.00 114.38 114.78 1cfc h ARG 126 Ca -0.01 0.06 0.00 0.00 -1.26 0.00 0.00 59.98 58.78 1cfc h ARG 126 Cb 1.45 0.21 0.00 0.00 -1.65 0.00 0.00 29.97 29.98 1cfc h ARG 126 CO 0.08 -0.62 0.00 0.39 0.56 0.00 0.00 179.97 180.38 1cfc n GLU 127 N -5.51 0.25 -2.98 0.04 1.02 -1.23 -4.23 120.64 108.01 1cfc n GLU 127 Ca -0.14 0.22 -0.44 0.00 -0.02 0.00 0.00 57.16 56.78 1cfc n GLU 127 Cb 0.39 -1.80 0.00 0.00 -0.02 0.00 0.00 31.44 30.01 1cfc n GLU 127 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1cfc n ALA 128 N -1.78 3.92 -1.01 0.62 0.00 -1.13 -4.90 120.51 116.23 1cfc n ALA 128 Ca 0.05 -4.28 -0.03 0.00 0.00 0.00 0.00 53.44 49.18 1cfc n ALA 128 Cb 0.42 -3.00 -0.03 0.00 0.00 0.00 0.00 19.45 16.83 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 5.37 -1.81 -0.09 0.00 2.03 -1.26 -4.57 116.55 116.23 1cfc n ASP 129 Ca 0.36 -1.21 0.15 0.00 0.52 0.00 0.00 54.79 54.62 1cfc n ASP 129 Cb 0.42 -0.55 0.86 0.00 -0.72 0.00 0.00 41.12 41.13 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 4.38 0.00 -2.62 5.18 5.41 -1.26 -4.79 119.36 125.66 1cfc n ILE 130 Ca 0.10 -0.04 0.00 0.00 1.00 0.00 0.00 62.75 63.80 1cfc n ILE 130 Cb 0.42 -0.32 0.00 0.00 -0.71 0.00 0.00 39.64 39.03 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 -0.78 1.20 0.00 4.38 2.03 -1.26 -4.31 116.55 117.80 1cfc n ASP 131 Ca 0.23 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.54 1cfc n ASP 131 Cb 0.15 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.55 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 4.87 1.31 0.00 0.27 0.00 -1.26 -4.26 105.19 106.11 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 1.34 0.00 0.00 0.00 173.32 174.66 1cfc n ASP 133 N 0.38 0.00 0.00 1.61 2.03 -1.26 -5.09 116.55 114.23 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 2.05 0.59 3.61 0.27 0.00 -1.26 -5.14 105.19 105.32 1cfc n GLY 134 Ca 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.76 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 1.97 0.01 1.61 -0.21 -1.26 -4.19 119.66 117.58 1cfc s GLN 135 Ca 0.00 -1.95 -0.06 0.00 0.02 0.00 0.00 55.36 53.36 1cfc s GLN 135 Cb 0.00 -1.76 -0.00 0.00 1.00 0.00 0.00 33.01 32.25 1cfc s GLN 135 CO 0.00 0.04 0.12 0.08 -2.12 0.00 0.00 175.29 173.40 1cfc s VAL 136 N -2.63 0.09 -1.23 1.09 1.01 -1.14 -4.89 120.40 112.70 1cfc s VAL 136 Ca 0.35 -0.72 -0.19 0.00 0.00 0.00 0.00 61.98 61.41 1cfc s VAL 136 Cb 0.05 -0.41 0.05 0.00 0.00 0.00 0.00 36.38 36.07 1cfc s VAL 136 CO 0.18 -0.40 1.69 0.54 0.00 0.00 0.00 175.10 177.12 1cfc s ASN 137 N -1.41 6.64 0.60 3.32 2.20 -1.26 -3.39 114.94 121.64 1cfc s ASN 137 Ca -0.15 -2.17 0.00 0.00 -0.94 0.00 0.00 52.86 49.60 1cfc s ASN 137 Cb -0.08 -2.58 0.00 0.00 -2.00 0.00 0.00 41.25 36.59 1cfc s ASN 137 CO 0.01 -1.38 0.93 0.00 -2.94 0.00 0.00 177.10 173.73 1cfc n TYR 138 N 8.94 0.00 -0.29 1.54 4.11 -1.25 -0.99 117.16 129.22 1cfc n TYR 138 Ca 0.45 0.00 0.02 0.00 -0.00 0.00 0.00 57.90 58.38 1cfc n TYR 138 Cb 0.47 0.00 0.16 0.00 -0.00 0.00 0.00 39.34 39.97 1cfc n TYR 138 CO 0.00 0.00 0.00 1.49 -0.00 0.00 0.00 176.86 178.35 1cfc h GLU 139 N 0.00 0.80 -0.33 -3.48 4.22 -1.87 0.30 114.58 114.21 1cfc h GLU 139 Ca 0.00 -0.05 -0.16 0.00 0.08 0.00 0.00 59.36 59.23 1cfc h GLU 139 Cb 1.87 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 30.93 1cfc h GLU 139 CO 0.00 0.53 -0.44 1.49 -2.18 0.00 0.00 179.01 178.41 1cfc h GLU 140 N 0.82 0.84 -0.33 1.92 4.81 -1.48 -2.94 114.58 118.23 1cfc h GLU 140 Ca 0.39 -0.46 -0.08 0.00 -0.13 0.00 0.00 59.36 59.07 1cfc h GLU 140 Cb 0.33 0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.72 1cfc h GLU 140 CO -0.23 1.10 -0.14 0.74 -0.73 0.00 0.00 179.01 179.75 1cfc h PHE 141 N 0.67 0.62 -0.66 0.92 0.04 -1.38 -2.50 116.94 114.66 1cfc h PHE 141 Ca 0.04 -0.11 -0.01 0.00 2.80 0.00 0.00 57.97 60.70 1cfc h PHE 141 Cb 1.02 -0.16 -0.03 0.00 2.20 0.00 0.00 35.95 38.97 1cfc h PHE 141 CO 0.06 0.69 0.39 0.28 -0.60 0.00 0.00 178.31 179.13 1cfc h VAL 142 N 0.52 1.19 0.00 -0.55 2.07 -0.29 -1.19 116.25 118.00 1cfc h VAL 142 Ca 0.09 -0.43 -0.00 0.00 0.82 0.00 0.00 66.70 67.17 1cfc h VAL 142 Cb 0.55 0.27 -0.00 0.00 -1.52 0.00 0.00 31.29 30.58 1cfc h VAL 142 CO 0.03 0.20 -0.02 1.56 0.02 0.00 0.00 177.57 179.37 1cfc h GLN 143 N 0.91 0.00 -0.01 1.57 4.20 -1.33 -3.23 115.11 117.22 1cfc h GLN 143 Ca 0.24 0.00 -0.25 0.00 0.06 0.00 0.00 58.65 58.70 1cfc h GLN 143 Cb -0.02 0.00 0.02 0.00 0.30 0.00 0.00 27.48 27.78 1cfc h GLN 143 CO -0.04 0.02 -0.96 0.52 -0.67 0.00 0.00 178.83 177.70 1cfc h MET 144 N 0.00 0.67 0.00 1.46 2.86 -0.88 -2.83 114.93 116.21 1cfc h MET 144 Ca -0.00 -0.71 -0.00 0.00 -2.06 0.00 0.00 59.70 56.93 1cfc h MET 144 Cb 0.81 0.20 -0.00 0.00 0.06 0.00 0.00 31.60 32.66 1cfc h MET 144 CO 0.00 1.29 -0.00 0.52 1.06 0.00 0.00 176.91 179.78 1cfc h MET 145 N 0.33 0.00 0.00 1.72 2.86 -1.50 -3.26 114.93 115.09 1cfc h MET 145 Ca -0.12 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.52 1cfc h MET 145 Cb 1.62 0.00 0.00 0.00 0.06 0.00 0.00 31.60 33.28 1cfc h MET 145 CO 0.19 0.00 0.00 0.25 1.06 0.00 0.00 176.91 178.41 1cfc n THR 146 N -3.11 0.00 -3.16 2.22 -2.24 -1.16 0.27 114.28 107.10 1cfc n THR 146 Ca -0.01 0.34 0.05 0.00 -2.27 0.00 0.00 64.05 62.15 1cfc n THR 146 Cb 0.18 -1.02 -0.03 0.00 -2.10 0.00 0.00 70.33 67.35 1cfc n THR 146 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1cfc s ALA 147 N -3.34 -3.67 0.00 6.98 0.00 -1.08 0.68 121.76 121.32 1cfc s ALA 147 Ca 0.00 1.49 0.00 0.00 0.00 0.00 0.00 51.96 53.45 1cfc s ALA 147 Cb 0.00 -2.49 0.00 0.00 0.00 0.00 0.00 23.12 20.63 1cfc s ALA 147 CO 0.00 -1.27 0.00 1.63 0.00 0.00 0.00 175.76 176.12