#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1cfc n ASP 2 N 0.00 0.00 -4.74 0.00 -0.08 -1.26 -4.48 116.55 105.99 1cfc n ASP 2 Ca 0.00 -1.15 -0.37 0.00 -1.51 0.00 0.00 54.79 51.75 1cfc n ASP 2 Cb 0.00 -0.03 0.06 0.00 2.34 0.00 0.00 41.12 43.49 1cfc n ASP 2 CO 0.00 0.00 0.00 -1.10 0.12 0.00 0.00 177.20 176.22 1cfc s GLN 3 N 0.00 2.69 -0.35 -0.67 -0.21 -1.26 -4.85 119.66 115.00 1cfc s GLN 3 Ca 0.00 2.10 -0.28 0.00 0.02 0.00 0.00 55.36 57.20 1cfc s GLN 3 Cb 0.00 -1.94 -0.03 0.00 1.00 0.00 0.00 33.01 32.05 1cfc s GLN 3 CO 0.00 -1.50 1.90 -0.51 -2.12 0.00 0.00 175.29 173.06 1cfc s LEU 4 N -4.17 3.46 0.79 2.90 1.43 -1.26 -4.96 118.68 116.86 1cfc s LEU 4 Ca 0.80 1.26 -0.11 0.00 -1.03 0.00 0.00 54.13 55.06 1cfc s LEU 4 Cb -0.38 -3.34 0.06 0.00 0.03 0.00 0.00 46.19 42.56 1cfc s LEU 4 CO 0.41 -1.89 1.08 0.42 0.23 0.00 0.00 176.35 176.61 1cfc s THR 5 N 7.66 3.30 0.52 5.49 -4.23 -1.26 -4.81 115.64 122.31 1cfc s THR 5 Ca 0.82 0.42 0.18 0.00 -1.18 0.00 0.00 61.69 61.94 1cfc s THR 5 Cb -0.23 -3.03 0.31 0.00 1.34 0.00 0.00 72.50 70.90 1cfc s THR 5 CO 0.32 -0.55 2.10 -0.33 -0.54 0.00 0.00 174.62 175.62 1cfc h GLU 6 N -1.11 0.03 -0.01 3.99 5.08 -2.00 -1.69 114.58 118.87 1cfc h GLU 6 Ca -0.46 -0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 57.89 1cfc h GLU 6 Cb 1.24 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.49 1cfc h GLU 6 CO 0.55 0.02 -0.06 0.93 -1.00 0.00 0.00 179.01 179.45 1cfc h GLU 7 N 0.03 0.06 -0.88 2.33 5.08 -1.99 -2.28 114.58 116.93 1cfc h GLU 7 Ca 0.08 -0.05 0.11 0.00 -1.00 0.00 0.00 59.36 58.51 1cfc h GLU 7 Cb 0.30 0.01 -0.07 0.00 0.50 0.00 0.00 28.75 29.49 1cfc h GLU 7 CO -0.00 0.72 0.57 1.96 -1.00 0.00 0.00 179.01 181.26 1cfc h GLN 8 N -0.59 0.78 -0.34 2.33 4.20 -1.76 0.25 115.11 119.98 1cfc h GLN 8 Ca -0.00 -0.05 -0.13 0.00 0.06 0.00 0.00 58.65 58.53 1cfc h GLN 8 Cb 0.73 -0.18 -0.01 0.00 0.30 0.00 0.00 27.48 28.33 1cfc h GLN 8 CO 0.01 0.52 -0.33 0.82 -0.67 0.00 0.00 178.83 179.18 1cfc h ILE 9 N 0.81 1.28 -0.12 2.54 2.04 -1.31 -2.48 117.51 120.27 1cfc h ILE 9 Ca 0.42 -1.47 -0.15 0.00 1.00 0.00 0.00 64.86 64.66 1cfc h ILE 9 Cb 0.51 1.37 -0.01 0.00 -0.74 0.00 0.00 36.82 37.95 1cfc h ILE 9 CO -0.18 0.48 -0.57 0.00 0.00 0.00 0.00 178.15 177.88 1cfc h ALA 10 N 1.01 0.81 0.04 1.87 0.00 -0.36 -1.83 119.26 120.80 1cfc h ALA 10 Ca 0.07 -0.52 -0.00 0.00 0.00 0.00 0.00 54.91 54.45 1cfc h ALA 10 Cb 0.85 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.56 1cfc h ALA 10 CO 0.07 0.70 -0.02 1.49 0.00 0.00 0.00 179.25 181.50 1cfc h GLU 11 N 0.28 -0.05 0.00 0.00 4.81 -0.43 -1.57 114.58 117.62 1cfc h GLU 11 Ca 0.00 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.21 1cfc h GLU 11 Cb 1.08 0.01 -0.00 0.00 0.63 0.00 0.00 28.75 30.47 1cfc h GLU 11 CO 0.10 0.16 -0.10 0.74 -0.73 0.00 0.00 179.01 179.18 1cfc h PHE 12 N -0.24 0.00 -0.02 0.92 0.04 -1.41 -2.42 116.94 113.80 1cfc h PHE 12 Ca -0.00 0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.76 1cfc h PHE 12 Cb 0.23 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.37 1cfc h PHE 12 CO -0.01 0.10 0.00 -0.22 -0.60 0.00 0.00 178.31 177.58 1cfc h LYS 13 N 0.00 0.03 -0.67 1.51 3.64 -0.61 0.23 116.57 120.71 1cfc h LYS 13 Ca -0.00 -0.01 0.06 0.00 -1.27 0.00 0.00 60.65 59.43 1cfc h LYS 13 Cb 0.18 -0.00 -0.06 0.00 -0.41 0.00 0.00 32.23 31.94 1cfc h LYS 13 CO 0.01 0.29 0.37 0.93 -2.27 0.00 0.00 179.45 178.78 1cfc h GLU 14 N -0.23 0.65 -0.15 1.90 5.08 -0.85 0.18 114.58 121.16 1cfc h GLU 14 Ca 0.01 -0.04 -0.08 0.00 -1.00 0.00 0.00 59.36 58.24 1cfc h GLU 14 Cb 0.27 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.36 1cfc h GLU 14 CO 0.00 0.43 -0.28 0.00 -1.00 0.00 0.00 179.01 178.16 1cfc h ALA 15 N 1.35 1.24 -0.04 3.43 0.00 -1.25 -2.49 119.26 121.51 1cfc h ALA 15 Ca 0.30 -0.33 -0.18 0.00 0.00 0.00 0.00 54.91 54.70 1cfc h ALA 15 Cb 0.20 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 1cfc h ALA 15 CO -0.19 0.51 -0.77 0.35 0.00 0.00 0.00 179.25 179.15 1cfc h PHE 16 N 0.25 0.40 -0.06 0.00 3.57 0.10 -3.20 116.94 118.01 1cfc h PHE 16 Ca 0.04 -0.19 -0.15 0.00 3.53 0.00 0.00 57.97 61.20 1cfc h PHE 16 Cb 0.64 -0.06 -0.01 0.00 2.79 0.00 0.00 35.95 39.31 1cfc h PHE 16 CO 0.01 0.95 -0.63 0.66 -2.23 0.00 0.00 178.31 177.07 1cfc h SER 17 N 0.19 0.24 -0.53 0.41 4.64 -0.47 -3.05 113.55 114.98 1cfc h SER 17 Ca -0.03 -0.14 0.15 0.00 -0.47 0.00 0.00 61.79 61.30 1cfc h SER 17 Cb 1.35 -0.07 -0.02 0.00 -0.31 0.00 0.00 62.40 63.35 1cfc h SER 17 CO 0.12 0.81 0.63 -0.07 -0.87 0.00 0.00 176.83 177.45 1cfc h LEU 18 N 0.15 0.00 -3.02 5.97 3.38 -1.44 0.17 115.31 120.52 1cfc h LEU 18 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1cfc h LEU 18 Cb 1.14 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.89 1cfc h LEU 18 CO 0.10 0.00 0.00 0.49 0.09 0.00 0.00 178.44 179.12 1cfc n PHE 19 N -3.51 0.07 -2.98 1.13 3.01 -1.16 -4.83 117.46 109.18 1cfc n PHE 19 Ca 0.10 -0.94 -0.43 0.00 1.01 0.00 0.00 57.45 57.20 1cfc n PHE 19 Cb 0.83 -0.15 0.01 0.00 -0.01 0.00 0.00 39.48 40.16 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 -1.27 6.50 0.00 4.37 2.03 0.58 -4.69 116.55 124.07 1cfc n ASP 20 Ca 0.15 -3.43 0.08 0.00 0.52 0.00 0.00 54.79 52.11 1cfc n ASP 20 Cb 0.62 -1.26 0.50 0.00 -0.72 0.00 0.00 41.12 40.25 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 1.23 0.99 -0.18 -0.67 4.76 -1.26 -3.07 118.16 119.96 1cfc n LYS 21 Ca 0.27 0.00 0.12 0.00 -2.87 0.00 0.00 58.31 55.83 1cfc n LYS 21 Cb 0.33 -1.27 0.21 0.00 -1.84 0.00 0.00 35.03 32.46 1cfc n LYS 21 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 1cfc n ASP 22 N -0.77 3.43 -0.40 4.39 8.00 -1.26 -4.90 116.55 125.03 1cfc n ASP 22 Ca 0.13 -1.99 -0.03 0.00 0.71 0.00 0.00 54.79 53.60 1cfc n ASP 22 Cb 0.06 -0.23 -0.01 0.00 -0.02 0.00 0.00 41.12 40.91 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 1.50 0.30 0.51 0.44 0.00 -1.17 -4.65 105.19 102.12 1cfc n GLY 23 Ca 0.19 0.00 0.11 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 0.68 2.04 -0.41 1.61 2.03 -1.26 -4.96 116.55 116.28 1cfc n ASP 24 Ca -0.03 -1.52 -0.03 0.00 0.52 0.00 0.00 54.79 53.73 1cfc n ASP 24 Cb 0.27 0.46 0.00 0.00 -0.72 0.00 0.00 41.12 41.13 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 1.42 0.35 3.17 0.27 0.00 -1.26 -5.04 105.19 104.10 1cfc n GLY 25 Ca 0.09 -0.74 -0.11 0.00 0.00 0.00 0.00 46.02 45.27 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 0.09 0.13 2.61 -4.23 -1.26 -3.44 115.64 107.25 1cfc s THR 26 Ca 0.01 -1.94 -0.01 0.00 -1.18 0.00 0.00 61.69 58.57 1cfc s THR 26 Cb -0.01 -2.19 -0.04 0.00 1.34 0.00 0.00 72.50 71.61 1cfc s THR 26 CO 0.02 -0.32 0.06 0.27 -0.54 0.00 0.00 174.62 174.10 1cfc s ILE 27 N -4.07 0.11 0.60 2.99 -4.36 -0.28 -4.43 121.20 111.76 1cfc s ILE 27 Ca 0.29 -1.89 -0.04 0.00 -0.26 0.00 0.00 60.65 58.74 1cfc s ILE 27 Cb 0.07 -2.02 0.02 0.00 1.25 0.00 0.00 42.46 41.79 1cfc s ILE 27 CO 0.05 -0.48 0.88 0.42 0.24 0.00 0.00 174.94 176.05 1cfc s THR 28 N -4.04 3.20 0.32 8.37 -4.23 -1.26 -0.75 115.64 117.24 1cfc s THR 28 Ca 0.23 -0.23 0.11 0.00 -1.18 0.00 0.00 61.69 60.63 1cfc s THR 28 Cb 0.07 -3.27 0.03 0.00 1.34 0.00 0.00 72.50 70.67 1cfc s THR 28 CO 0.01 -0.26 1.72 0.71 -0.54 0.00 0.00 174.62 176.26 1cfc h THR 29 N -0.18 1.35 0.00 3.99 1.35 -1.84 -2.70 112.91 114.89 1cfc h THR 29 Ca -0.45 -1.69 -0.02 0.00 -0.55 0.00 0.00 66.41 63.70 1cfc h THR 29 Cb 1.28 1.90 -0.00 0.00 -1.73 0.00 0.00 68.15 69.60 1cfc h THR 29 CO 0.59 0.48 -0.10 0.11 -0.25 0.00 0.00 175.52 176.35 1cfc h LYS 30 N 0.01 0.00 -0.69 4.72 1.79 -1.93 -1.45 116.57 119.02 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 0.88 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.53 1cfc h LYS 30 CO 0.06 0.10 0.00 0.39 -1.08 0.00 0.00 179.45 178.93 1cfc n GLU 31 N -3.71 3.50 -0.03 3.15 1.02 -1.02 -4.44 120.64 119.11 1cfc n GLU 31 Ca -0.02 -2.85 -0.13 0.00 -0.02 0.00 0.00 57.16 54.13 1cfc n GLU 31 Cb 0.21 -1.82 -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 4.22 0.03 -1.79 -4.62 5.85 -1.24 -2.41 115.31 115.34 1cfc h LEU 32 Ca 0.00 -0.59 -0.03 0.00 0.84 0.00 0.00 57.88 58.10 1cfc h LEU 32 Cb 1.35 -0.01 -0.00 0.00 0.37 0.00 0.00 40.66 42.36 1cfc h LEU 32 CO 0.17 0.62 -0.13 1.23 -0.34 0.00 0.00 178.44 179.99 1cfc h GLY 33 N -0.55 0.00 1.01 3.75 0.00 -1.78 -2.23 103.07 103.27 1cfc h GLY 33 Ca -0.00 0.00 -0.16 0.00 0.00 0.00 0.00 47.33 47.17 1cfc h GLY 33 CO 0.00 0.00 -0.53 -0.84 0.00 0.00 0.00 176.54 175.18 1cfc h THR 34 N 0.00 1.32 -0.21 4.70 2.02 -1.78 -1.65 112.91 117.31 1cfc h THR 34 Ca -0.00 -1.76 -0.03 0.00 0.77 0.00 0.00 66.41 65.38 1cfc h THR 34 Cb 0.40 1.92 -0.01 0.00 -1.74 0.00 0.00 68.15 68.73 1cfc h THR 34 CO 0.02 0.55 0.00 0.58 0.37 0.00 0.00 175.52 177.04 1cfc h VAL 35 N 0.38 1.25 -0.91 3.16 2.07 -1.06 -2.42 116.25 118.72 1cfc h VAL 35 Ca -0.01 -0.86 0.08 0.00 0.82 0.00 0.00 66.70 66.72 1cfc h VAL 35 Cb 1.15 1.41 -0.06 0.00 -1.52 0.00 0.00 31.29 32.27 1cfc h VAL 35 CO 0.11 0.27 0.59 0.24 0.02 0.00 0.00 177.57 178.80 1cfc h MET 36 N 0.13 0.95 0.00 1.57 2.86 -1.42 0.13 114.93 119.15 1cfc h MET 36 Ca 0.06 -0.06 -0.03 0.00 -2.06 0.00 0.00 59.70 57.61 1cfc h MET 36 Cb 0.39 -0.21 -0.00 0.00 0.06 0.00 0.00 31.60 31.83 1cfc h MET 36 CO 0.01 0.63 -0.16 0.00 1.06 0.00 0.00 176.91 178.45 1cfc h ARG 37 N 0.98 0.00 -0.22 1.72 2.47 -0.89 -1.29 114.38 117.15 1cfc h ARG 37 Ca 0.41 0.00 -0.07 0.00 -1.26 0.00 0.00 59.98 59.06 1cfc h ARG 37 Cb 0.29 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.60 1cfc h ARG 37 CO -0.17 0.16 -0.17 0.66 0.56 0.00 0.00 179.97 181.01 1cfc h SER 38 N 0.00 0.37 -0.04 7.04 4.64 -0.26 -1.39 113.55 123.91 1cfc h SER 38 Ca -0.00 -0.10 0.00 0.00 -0.47 0.00 0.00 61.79 61.22 1cfc h SER 38 Cb 0.28 -0.10 0.00 0.00 -0.31 0.00 0.00 62.40 62.27 1cfc h SER 38 CO 0.02 0.57 0.00 0.18 -0.87 0.00 0.00 176.83 176.73 1cfc n LEU 39 N -4.20 0.58 0.00 5.97 4.77 -0.62 -4.86 117.00 118.65 1cfc n LEU 39 Ca -0.00 -0.23 0.00 0.00 -0.03 0.00 0.00 56.01 55.75 1cfc n LEU 39 Cb 0.33 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.40 1cfc n LEU 39 CO 0.40 0.11 0.00 0.61 -1.33 0.00 0.00 177.39 177.18 1cfc n GLY 40 N 0.97 0.60 3.81 -0.72 0.00 -0.52 -5.05 105.19 104.28 1cfc n GLY 40 Ca 0.17 -0.43 -0.35 0.00 0.00 0.00 0.00 46.02 45.41 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 3.23 -0.44 1.61 -0.21 -0.58 -4.99 119.66 117.35 1cfc s GLN 41 Ca 0.00 -0.33 0.06 0.00 0.02 0.00 0.00 55.36 55.10 1cfc s GLN 41 Cb 0.00 -2.99 0.21 0.00 1.00 0.00 0.00 33.01 31.23 1cfc s GLN 41 CO 0.00 0.70 0.45 -1.71 -2.12 0.00 0.00 175.29 172.61 1cfc n ASN 42 N 1.57 0.33 -4.77 5.90 2.85 -1.26 -3.04 115.26 116.84 1cfc n ASN 42 Ca -0.16 -2.63 -0.36 0.00 -0.11 0.00 0.00 54.58 51.32 1cfc n ASN 42 Cb 0.54 -0.61 0.01 0.00 1.24 0.00 0.00 39.78 40.95 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 -0.70 3.37 1.08 1.20 0.04 -1.26 -5.01 135.00 133.71 1cfc s PRO 43 Ca 0.34 1.68 -0.15 0.00 0.04 0.00 0.00 61.00 62.91 1cfc s PRO 43 Cb 0.09 -2.07 0.23 0.00 0.04 0.00 0.00 34.50 32.78 1cfc s PRO 43 CO -0.15 -0.85 1.10 0.95 0.04 0.00 0.00 177.00 178.09 1cfc s THR 44 N -1.69 1.86 0.36 1.26 -4.23 -1.26 -4.80 115.64 107.14 1cfc s THR 44 Ca 0.72 0.00 0.06 0.00 -1.18 0.00 0.00 61.69 61.28 1cfc s THR 44 Cb -0.26 -2.50 0.19 0.00 1.34 0.00 0.00 72.50 71.27 1cfc s THR 44 CO 0.30 0.00 1.93 -0.33 -0.54 0.00 0.00 174.62 175.98 1cfc h GLU 45 N -2.15 0.50 -0.41 3.99 5.08 -1.99 -2.22 114.58 117.37 1cfc h GLU 45 Ca -0.51 -0.08 -0.15 0.00 -1.00 0.00 0.00 59.36 57.61 1cfc h GLU 45 Cb 1.32 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 30.48 1cfc h GLU 45 CO 0.50 0.48 -0.34 0.00 -1.00 0.00 0.00 179.01 178.65 1cfc h ALA 46 N 1.58 0.61 -0.66 3.43 0.00 -1.98 0.13 119.26 122.39 1cfc h ALA 46 Ca 0.11 -0.44 0.01 0.00 0.00 0.00 0.00 54.91 54.60 1cfc h ALA 46 Cb 0.23 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.85 1cfc h ALA 46 CO -0.00 0.68 0.44 0.93 0.00 0.00 0.00 179.25 181.29 1cfc h GLU 47 N 0.79 0.85 -0.02 0.00 3.07 -1.76 0.11 114.58 117.62 1cfc h GLU 47 Ca 0.08 -0.05 -0.03 0.00 -0.50 0.00 0.00 59.36 58.85 1cfc h GLU 47 Cb 0.93 -0.19 0.00 0.00 -0.84 0.00 0.00 28.75 28.65 1cfc h GLU 47 CO 0.09 0.56 -0.12 -0.07 -1.40 0.00 0.00 179.01 178.07 1cfc h LEU 48 N 0.87 0.13 -1.92 1.33 3.38 -0.96 -3.06 115.31 115.08 1cfc h LEU 48 Ca 0.24 -0.70 -0.01 0.00 0.09 0.00 0.00 57.88 57.51 1cfc h LEU 48 Cb -0.07 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 40.64 1cfc h LEU 48 CO -0.06 0.81 -0.05 1.56 0.09 0.00 0.00 178.44 180.79 1cfc h GLN 49 N -0.54 0.00 -0.03 1.13 4.20 -0.40 -1.84 115.11 117.63 1cfc h GLN 49 Ca -0.01 0.00 -0.09 0.00 0.06 0.00 0.00 58.65 58.61 1cfc h GLN 49 Cb 0.81 0.00 0.01 0.00 0.30 0.00 0.00 27.48 28.59 1cfc h GLN 49 CO 0.02 0.05 -0.32 0.22 -0.67 0.00 0.00 178.83 178.13 1cfc h ASP 50 N 0.00 0.33 0.51 1.46 1.82 -0.80 -2.89 116.42 116.85 1cfc h ASP 50 Ca -0.00 -0.71 -0.11 0.00 -0.39 0.00 0.00 57.03 55.82 1cfc h ASP 50 Cb 0.36 -0.10 -0.02 0.00 0.68 0.00 0.00 39.33 40.26 1cfc h ASP 50 CO 0.01 1.00 -0.51 0.24 -1.61 0.00 0.00 179.24 178.36 1cfc h MET 51 N -0.30 0.00 -0.62 0.28 2.86 -1.41 -2.64 114.93 113.10 1cfc h MET 51 Ca -0.03 -0.00 -0.03 0.00 -2.06 0.00 0.00 59.70 57.58 1cfc h MET 51 Cb 1.02 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.65 1cfc h MET 51 CO 0.06 0.51 0.28 0.82 1.06 0.00 0.00 176.91 179.65 1cfc h ILE 52 N 0.00 1.21 0.41 -1.22 2.04 -1.33 0.54 117.51 119.15 1cfc h ILE 52 Ca -0.00 -0.61 -0.01 0.00 1.00 0.00 0.00 64.86 65.24 1cfc h ILE 52 Cb 0.90 0.43 -0.02 0.00 -0.74 0.00 0.00 36.82 37.39 1cfc h ILE 52 CO 0.07 0.25 -0.37 -0.55 0.00 0.00 0.00 178.15 177.55 1cfc h ASN 53 N 0.89 -0.98 0.71 1.72 7.08 -1.25 0.96 115.58 124.72 1cfc h ASN 53 Ca 0.22 0.08 -0.18 0.00 -3.08 0.00 0.00 56.30 53.34 1cfc h ASN 53 Cb 0.12 0.32 -0.02 0.00 -2.08 0.00 0.00 38.32 36.66 1cfc h ASN 53 CO -0.03 -0.52 -0.83 -0.33 -2.08 0.00 0.00 177.43 173.65 1cfc h GLU 54 N -0.78 0.08 0.00 4.14 4.39 -1.54 -3.19 114.58 117.67 1cfc h GLU 54 Ca -0.04 -0.08 -0.14 0.00 0.34 0.00 0.00 59.36 59.44 1cfc h GLU 54 Cb 0.69 0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 29.34 1cfc h GLU 54 CO -0.04 0.86 -0.69 0.28 -1.16 0.00 0.00 179.01 178.26 1cfc h VAL 55 N 0.04 1.28 0.00 3.13 2.07 0.26 -3.16 116.25 119.86 1cfc h VAL 55 Ca -0.02 -2.56 0.00 0.00 0.82 0.00 0.00 66.70 64.94 1cfc h VAL 55 Cb 1.45 2.47 0.00 0.00 -1.52 0.00 0.00 31.29 33.69 1cfc h VAL 55 CO 0.12 0.68 0.00 -0.67 0.02 0.00 0.00 177.57 177.71 1cfc n ASP 56 N -3.40 5.04 0.22 0.57 2.03 0.33 -3.94 116.55 117.40 1cfc n ASP 56 Ca 0.00 -2.35 0.12 0.00 0.52 0.00 0.00 54.79 53.08 1cfc n ASP 56 Cb 0.76 -1.05 0.17 0.00 -0.72 0.00 0.00 41.12 40.28 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 1.14 1.00 0.00 -1.67 0.00 -1.72 -3.03 119.26 114.98 1cfc h ALA 57 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1cfc h ALA 57 Cb 0.99 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.78 1cfc h ALA 57 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 179.25 179.47 1cfc h ASP 58 N 0.00 0.00 0.00 0.00 3.58 -1.89 -3.47 116.42 114.64 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 1.00 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.05 1cfc h ASP 58 CO 0.00 0.00 0.00 0.61 -2.88 0.00 0.00 179.24 176.97 1cfc n GLY 59 N 1.13 0.62 1.05 -0.78 0.00 -1.15 -4.84 105.19 101.22 1cfc n GLY 59 Ca 0.04 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.18 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 -0.08 3.22 -3.23 1.61 4.13 -1.26 -4.95 115.26 114.69 1cfc n ASN 60 Ca 0.00 -2.00 -0.22 0.00 1.68 0.00 0.00 54.58 54.04 1cfc n ASN 60 Cb 0.04 -0.11 0.01 0.00 -1.54 0.00 0.00 39.78 38.17 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 1.42 -0.50 3.39 7.41 0.00 -1.26 -4.95 105.19 110.70 1cfc n GLY 61 Ca 0.16 0.10 -0.19 0.00 0.00 0.00 0.00 46.02 46.09 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 -2.98 0.82 -0.01 2.61 -4.23 -1.26 -2.77 115.64 107.81 1cfc s THR 62 Ca 0.35 -2.00 -0.00 0.00 -1.18 0.00 0.00 61.69 58.86 1cfc s THR 62 Cb -0.18 -2.68 0.02 0.00 1.34 0.00 0.00 72.50 71.00 1cfc s THR 62 CO 0.44 0.00 0.02 -0.63 -0.54 0.00 0.00 174.62 173.91 1cfc s ILE 63 N -3.52 -0.03 0.35 2.99 1.01 0.07 -4.84 121.20 117.23 1cfc s ILE 63 Ca 0.36 0.11 0.07 0.00 0.00 0.00 0.00 60.65 61.20 1cfc s ILE 63 Cb 0.08 -0.06 -0.01 0.00 0.01 0.00 0.00 42.46 42.48 1cfc s ILE 63 CO 0.15 0.05 0.46 1.51 0.00 0.00 0.00 174.94 177.10 1cfc s ASP 64 N 0.58 5.77 0.18 3.58 1.47 -1.26 -1.12 116.67 125.87 1cfc s ASP 64 Ca -0.05 -0.30 -0.13 0.00 1.18 0.00 0.00 52.55 53.25 1cfc s ASP 64 Cb -0.07 -1.06 0.11 0.00 -0.34 0.00 0.00 42.92 41.56 1cfc s ASP 64 CO -0.02 -0.49 1.81 0.15 0.68 0.00 0.00 175.17 177.31 1cfc h PHE 65 N 0.91 0.56 -0.19 2.11 3.57 -1.96 -1.37 116.94 120.57 1cfc h PHE 65 Ca -0.44 0.02 0.05 0.00 3.53 0.00 0.00 57.97 61.13 1cfc h PHE 65 Cb 1.26 -0.18 -0.07 0.00 2.79 0.00 0.00 35.95 39.76 1cfc h PHE 65 CO 0.44 0.31 -0.29 -1.35 -2.23 0.00 0.00 178.31 175.19 1cfc h PRO 66 N 0.60 -0.32 -0.26 6.41 0.11 -1.96 0.16 132.00 136.74 1cfc h PRO 66 Ca 0.22 0.02 -0.01 0.00 0.11 0.00 0.00 66.00 66.34 1cfc h PRO 66 Cb 0.05 0.07 -0.01 0.00 0.11 0.00 0.00 31.00 31.22 1cfc h PRO 66 CO -0.11 -0.22 0.12 0.93 -0.21 0.00 0.00 178.00 178.51 1cfc h GLU 67 N -0.34 0.35 -0.43 1.05 5.08 -1.92 -0.51 114.58 117.87 1cfc h GLU 67 Ca 0.11 -0.03 -0.06 0.00 -1.00 0.00 0.00 59.36 58.38 1cfc h GLU 67 Cb 0.51 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.67 1cfc h GLU 67 CO -0.37 0.29 0.01 0.35 -1.00 0.00 0.00 179.01 178.29 1cfc h PHE 68 N 0.36 0.72 0.00 4.33 3.57 0.35 -0.67 116.94 125.59 1cfc h PHE 68 Ca 0.09 -0.09 -0.05 0.00 3.53 0.00 0.00 57.97 61.46 1cfc h PHE 68 Cb 0.06 -0.20 -0.01 0.00 2.79 0.00 0.00 35.95 38.59 1cfc h PHE 68 CO 0.00 0.67 -0.22 -0.07 -2.23 0.00 0.00 178.31 176.46 1cfc h LEU 69 N 0.65 0.00 -0.59 0.59 3.38 0.80 -1.53 115.31 118.61 1cfc h LEU 69 Ca 0.13 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.08 1cfc h LEU 69 Cb 0.39 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.13 1cfc h LEU 69 CO 0.01 0.22 -0.12 0.74 0.09 0.00 0.00 178.44 179.38 1cfc h THR 70 N 0.00 0.24 0.04 0.22 2.02 -0.69 -2.10 112.91 112.65 1cfc h THR 70 Ca -0.00 -1.09 -0.08 0.00 0.77 0.00 0.00 66.41 66.01 1cfc h THR 70 Cb 0.53 1.90 0.01 0.00 -1.74 0.00 0.00 68.15 68.84 1cfc h THR 70 CO 0.03 0.12 -0.35 0.24 0.37 0.00 0.00 175.52 175.93 1cfc h MET 71 N 0.00 0.16 -0.04 6.66 2.86 -0.83 -2.86 114.93 120.87 1cfc h MET 71 Ca -0.00 -0.23 -0.06 0.00 -2.06 0.00 0.00 59.70 57.34 1cfc h MET 71 Cb 0.89 0.08 -0.01 0.00 0.06 0.00 0.00 31.60 32.62 1cfc h MET 71 CO 0.02 1.05 -0.28 0.52 1.06 0.00 0.00 176.91 179.28 1cfc h MET 72 N -0.62 0.07 -0.17 1.72 2.07 -1.49 -2.41 114.93 114.09 1cfc h MET 72 Ca -0.06 -0.02 -0.13 0.00 -2.07 0.00 0.00 59.70 57.43 1cfc h MET 72 Cb 1.21 -0.01 -0.01 0.00 -1.87 0.00 0.00 31.60 30.92 1cfc h MET 72 CO 0.07 0.35 -0.44 0.00 1.07 0.00 0.00 176.91 177.95 1cfc h ALA 73 N 1.66 0.93 -0.02 6.32 0.00 -1.43 0.32 119.26 127.04 1cfc h ALA 73 Ca 0.01 -0.45 -0.08 0.00 0.00 0.00 0.00 54.91 54.40 1cfc h ALA 73 Cb 0.53 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 1cfc h ALA 73 CO 0.04 0.64 -0.35 0.00 0.00 0.00 0.00 179.25 179.58 1cfc h ARG 74 N 0.34 0.04 0.18 0.00 2.47 -1.19 -2.90 114.38 113.30 1cfc h ARG 74 Ca 0.03 -0.01 -0.32 0.00 -1.26 0.00 0.00 59.98 58.41 1cfc h ARG 74 Cb 0.91 -0.00 0.01 0.00 -1.65 0.00 0.00 29.97 29.24 1cfc h ARG 74 CO 0.08 0.38 -1.52 0.87 0.56 0.00 0.00 179.97 180.34 1cfc h LYS 75 N 0.03 0.37 -4.27 0.04 1.57 -1.28 -3.42 116.57 109.62 1cfc h LYS 75 Ca 0.00 -0.64 -0.73 0.00 -1.87 0.00 0.00 60.65 57.41 1cfc h LYS 75 Cb 0.63 0.24 -0.28 0.00 0.08 0.00 0.00 32.23 32.89 1cfc h LYS 75 CO 0.05 1.28 -0.37 -1.64 -0.57 0.00 0.00 179.45 178.20 1cfc s MET 76 N -2.61 2.57 0.00 3.15 -1.94 0.07 -4.76 119.30 115.78 1cfc s MET 76 Ca -0.10 -1.74 0.00 0.00 -1.71 0.00 0.00 55.69 52.15 1cfc s MET 76 Cb 0.06 -3.98 0.00 0.00 2.01 0.00 0.00 34.83 32.92 1cfc s MET 76 CO 0.89 -1.20 0.00 1.63 -0.01 0.00 0.00 175.02 176.33 1cfc n LYS 77 N 4.96 0.00 0.04 2.03 5.02 -1.25 -4.66 118.16 124.31 1cfc n LYS 77 Ca -0.09 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.20 1cfc n LYS 77 Cb 0.41 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.42 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 -2.19 4.39 2.03 -1.26 0.11 116.55 119.63 1cfc n ASP 78 Ca 0.00 0.06 -0.28 0.00 0.52 0.00 0.00 54.79 55.10 1cfc n ASP 78 Cb 0.00 0.00 0.03 0.00 -0.72 0.00 0.00 41.12 40.43 1cfc n ASP 78 CO 0.00 0.00 0.00 1.07 -1.92 0.00 0.00 177.20 176.35 1cfc n THR 79 N -1.15 2.84 -0.85 5.18 5.66 -1.26 -5.03 114.28 119.67 1cfc n THR 79 Ca 0.00 -3.97 -0.36 0.00 -3.05 0.00 0.00 64.05 56.67 1cfc n THR 79 Cb 0.54 -1.16 0.10 0.00 -1.55 0.00 0.00 70.33 68.25 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 -0.73 -2.80 0.20 1.09 -0.08 0.31 -4.81 116.55 109.71 1cfc n ASP 80 Ca 0.49 -0.05 0.12 0.00 -1.51 0.00 0.00 54.79 53.84 1cfc n ASP 80 Cb 0.82 -0.72 0.16 0.00 2.34 0.00 0.00 41.12 43.72 1cfc n ASP 80 CO 0.00 0.00 0.00 -1.28 0.12 0.00 0.00 177.20 176.04 1cfc h SER 81 N -1.49 0.00 -0.55 1.67 0.87 -1.89 -3.09 113.55 109.07 1cfc h SER 81 Ca -0.46 -0.00 0.12 0.00 -1.23 0.00 0.00 61.79 60.22 1cfc h SER 81 Cb 1.38 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 63.31 1cfc h SER 81 CO 0.29 0.00 0.38 -0.33 -0.53 0.00 0.00 176.83 176.64 1cfc h GLU 82 N 0.00 0.22 0.00 2.24 5.08 -1.87 0.41 114.58 120.66 1cfc h GLU 82 Ca 0.00 -0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.33 1cfc h GLU 82 Cb 0.98 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 30.18 1cfc h GLU 82 CO 0.00 0.15 -0.06 1.05 -1.00 0.00 0.00 179.01 179.15 1cfc h GLU 83 N 0.23 0.00 0.07 2.33 4.11 -1.86 -1.56 114.58 117.90 1cfc h GLU 83 Ca 0.26 0.00 -0.29 0.00 0.07 0.00 0.00 59.36 59.40 1cfc h GLU 83 Cb 0.71 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.94 1cfc h GLU 83 CO -0.05 0.06 -1.49 0.93 0.07 0.00 0.00 179.01 178.53 1cfc h GLU 84 N 0.00 0.15 0.02 1.06 5.08 -0.37 -3.02 114.58 117.50 1cfc h GLU 84 Ca -0.00 -0.26 -0.05 0.00 -1.00 0.00 0.00 59.36 58.05 1cfc h GLU 84 Cb 0.29 0.10 0.01 0.00 0.50 0.00 0.00 28.75 29.64 1cfc h GLU 84 CO 0.01 0.96 -0.21 0.82 -1.00 0.00 0.00 179.01 179.60 1cfc h ILE 85 N 0.04 1.66 -0.81 3.13 2.04 -1.19 -2.49 117.51 119.90 1cfc h ILE 85 Ca -0.21 -2.20 -0.04 0.00 1.00 0.00 0.00 64.86 63.40 1cfc h ILE 85 Cb 1.97 3.12 -0.04 0.00 -0.74 0.00 0.00 36.82 41.14 1cfc h ILE 85 CO 0.14 0.59 0.33 0.08 0.00 0.00 0.00 178.15 179.29 1cfc h ARG 86 N -0.73 1.20 0.00 2.37 0.11 -1.47 0.18 114.38 116.04 1cfc h ARG 86 Ca -0.03 -0.21 -0.02 0.00 0.10 0.00 0.00 59.98 59.82 1cfc h ARG 86 Cb 1.08 -0.20 -0.00 0.00 1.11 0.00 0.00 29.97 31.96 1cfc h ARG 86 CO 0.04 0.96 -0.10 0.93 0.10 0.00 0.00 179.97 181.90 1cfc h GLU 87 N 1.17 0.00 0.07 0.08 4.39 -1.61 0.14 114.58 118.81 1cfc h GLU 87 Ca 0.27 0.00 -0.09 0.00 0.34 0.00 0.00 59.36 59.88 1cfc h GLU 87 Cb 0.20 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 28.86 1cfc h GLU 87 CO -0.02 0.10 -0.41 0.00 -1.16 0.00 0.00 179.01 177.51 1cfc h ALA 88 N 1.90 -0.05 -0.01 3.43 0.00 -0.60 -2.46 119.26 121.47 1cfc h ALA 88 Ca -0.00 -0.60 0.00 0.00 0.00 0.00 0.00 54.91 54.31 1cfc h ALA 88 Cb 0.41 0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.25 1cfc h ALA 88 CO 0.01 0.19 0.01 0.74 0.00 0.00 0.00 179.25 180.21 1cfc h PHE 89 N -0.67 0.00 -0.18 0.00 0.04 -0.24 0.83 116.94 116.72 1cfc h PHE 89 Ca -0.07 0.00 -0.09 0.00 2.80 0.00 0.00 57.97 60.61 1cfc h PHE 89 Cb 1.32 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 39.47 1cfc h PHE 89 CO 0.24 0.00 -0.25 -0.09 -0.60 0.00 0.00 178.31 177.61 1cfc h ARG 90 N 0.00 0.48 0.00 1.51 2.43 -0.61 -1.79 114.38 116.41 1cfc h ARG 90 Ca 0.00 -0.28 0.00 0.00 -0.81 0.00 0.00 59.98 58.90 1cfc h ARG 90 Cb 0.03 0.02 0.00 0.00 -0.42 0.00 0.00 29.97 29.60 1cfc h ARG 90 CO -0.00 0.87 0.30 0.28 -1.51 0.00 0.00 179.97 179.91 1cfc h VAL 91 N 0.13 0.00 0.00 0.20 2.07 -0.36 0.23 116.25 118.52 1cfc h VAL 91 Ca 0.02 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.54 1cfc h VAL 91 Cb 0.81 0.62 0.00 0.00 -1.52 0.00 0.00 31.29 31.20 1cfc h VAL 91 CO 0.06 0.00 -1.01 0.49 0.02 0.00 0.00 177.57 177.12 1cfc n PHE 92 N -2.74 0.00 -2.33 1.57 3.01 -0.72 -4.58 117.46 111.67 1cfc n PHE 92 Ca -0.02 0.00 -0.42 0.00 1.01 0.00 0.00 57.45 58.02 1cfc n PHE 92 Cb 0.34 -0.02 0.00 0.00 -0.01 0.00 0.00 39.48 39.79 1cfc n PHE 92 CO 0.00 0.00 0.00 -3.47 1.01 0.00 0.00 176.76 174.30 1cfc n ASP 93 N -1.52 5.47 0.32 4.37 2.03 0.80 -4.74 116.55 123.28 1cfc n ASP 93 Ca 0.04 -3.13 0.21 0.00 0.52 0.00 0.00 54.79 52.43 1cfc n ASP 93 Cb 0.34 -1.45 1.12 0.00 -0.72 0.00 0.00 41.12 40.40 1cfc n ASP 93 CO 0.00 0.00 0.00 0.11 -1.92 0.00 0.00 177.20 175.39 1cfc h LYS 94 N 5.59 0.00 -0.61 -0.67 1.57 -1.81 -0.53 116.57 120.12 1cfc h LYS 94 Ca 0.42 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.20 1cfc h LYS 94 Cb 0.59 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.90 1cfc h LYS 94 CO 1.60 0.00 0.00 -0.25 -0.57 0.00 0.00 179.45 180.23 1cfc n ASP 95 N -3.00 3.69 -3.98 0.86 9.92 -1.26 -4.93 116.55 117.84 1cfc n ASP 95 Ca -0.02 -1.99 -0.32 0.00 -0.53 0.00 0.00 54.79 51.92 1cfc n ASP 95 Cb 0.09 -0.40 -0.02 0.00 -0.64 0.00 0.00 41.12 40.15 1cfc n ASP 95 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1cfc n GLY 96 N 1.59 -0.46 0.13 0.44 0.00 -0.21 -4.82 105.19 101.87 1cfc n GLY 96 Ca 0.22 0.11 -0.19 0.00 0.00 0.00 0.00 46.02 46.17 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 -2.50 1.99 0.00 1.61 4.05 -1.26 -5.01 115.26 114.13 1cfc n ASN 97 Ca 0.06 -0.09 0.00 0.00 0.45 0.00 0.00 54.58 55.00 1cfc n ASN 97 Cb 0.50 -0.46 0.00 0.00 1.23 0.00 0.00 39.78 41.05 1cfc n ASN 97 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1cfc n GLY 98 N 2.18 0.84 3.07 8.20 0.00 -1.26 -5.10 105.19 113.12 1cfc n GLY 98 Ca -0.46 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.42 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 0.76 0.15 1.61 1.51 -1.26 -4.38 117.35 113.74 1cfc s TYR 99 Ca 0.00 -0.42 -0.01 0.00 -1.01 0.00 0.00 57.07 55.62 1cfc s TYR 99 Cb 0.00 -0.45 -0.04 0.00 -0.11 0.00 0.00 41.96 41.36 1cfc s TYR 99 CO 0.00 -0.04 0.09 0.96 -1.11 0.00 0.00 175.55 175.44 1cfc s ILE 100 N -1.14 0.08 0.26 2.71 -4.36 -1.19 -4.91 121.20 112.66 1cfc s ILE 100 Ca -0.06 -1.90 -0.30 0.00 -0.26 0.00 0.00 60.65 58.13 1cfc s ILE 100 Cb -0.09 -2.13 -0.09 0.00 1.25 0.00 0.00 42.46 41.40 1cfc s ILE 100 CO 0.01 -0.35 1.03 -0.94 0.24 0.00 0.00 174.94 174.92 1cfc s SER 101 N -3.07 7.44 0.46 4.36 1.04 -1.26 -2.54 113.70 120.13 1cfc s SER 101 Ca 0.27 2.12 0.35 0.00 0.48 0.00 0.00 55.95 59.17 1cfc s SER 101 Cb 0.07 -2.62 1.53 0.00 0.10 0.00 0.00 66.02 65.10 1cfc s SER 101 CO 0.04 -0.01 1.58 0.00 0.98 0.00 0.00 173.24 175.84 1cfc h ALA 102 N 3.99 2.99 0.39 5.32 0.00 -1.91 0.60 119.26 130.64 1cfc h ALA 102 Ca -0.46 0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.53 1cfc h ALA 102 Cb 1.21 0.23 0.00 0.00 0.00 0.00 0.00 17.79 19.23 1cfc h ALA 102 CO 0.67 -1.66 -0.19 0.00 0.00 0.00 0.00 179.25 178.07 1cfc h ALA 103 N 1.51 -0.53 -0.44 0.00 0.00 -1.93 0.33 119.26 118.20 1cfc h ALA 103 Ca 0.89 -0.12 0.06 0.00 0.00 0.00 0.00 54.91 55.73 1cfc h ALA 103 Cb 2.97 0.20 -0.02 0.00 0.00 0.00 0.00 17.79 20.94 1cfc h ALA 103 CO -0.39 -0.79 0.29 0.93 0.00 0.00 0.00 179.25 179.29 1cfc h GLU 104 N -0.55 0.34 -0.10 0.00 5.08 -0.20 0.48 114.58 119.63 1cfc h GLU 104 Ca -0.05 -0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.26 1cfc h GLU 104 Cb 0.42 -0.08 -0.00 0.00 0.50 0.00 0.00 28.75 29.59 1cfc h GLU 104 CO 0.09 0.23 -0.03 1.25 -1.00 0.00 0.00 179.01 179.54 1cfc h LEU 105 N 0.35 0.20 -1.32 1.33 5.85 -0.03 0.19 115.31 121.89 1cfc h LEU 105 Ca 0.19 -0.39 -0.02 0.00 0.84 0.00 0.00 57.88 58.50 1cfc h LEU 105 Cb 0.30 -0.06 -0.02 0.00 0.37 0.00 0.00 40.66 41.25 1cfc h LEU 105 CO -0.04 0.54 0.22 0.03 -0.34 0.00 0.00 178.44 178.85 1cfc h ARG 106 N -0.14 0.69 -0.42 1.25 3.08 0.50 -1.88 114.38 117.46 1cfc h ARG 106 Ca 0.02 -0.09 -0.13 0.00 0.07 0.00 0.00 59.98 59.86 1cfc h ARG 106 Cb 0.46 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.36 1cfc h ARG 106 CO 0.01 0.55 -0.24 1.25 -1.07 0.00 0.00 179.97 180.47 1cfc h HIS 107 N 0.69 1.04 -0.93 3.04 2.76 -0.63 -1.93 115.15 119.20 1cfc h HIS 107 Ca 0.17 -0.27 0.03 0.00 -2.20 0.00 0.00 60.37 58.11 1cfc h HIS 107 Cb 0.09 -0.24 -0.05 0.00 1.55 0.00 0.00 27.41 28.77 1cfc h HIS 107 CO 0.01 1.06 0.61 0.28 -1.30 0.00 0.00 177.93 178.59 1cfc h VAL 108 N 0.72 1.17 -0.01 5.26 2.07 0.15 0.18 116.25 125.78 1cfc h VAL 108 Ca 0.09 -0.40 -0.15 0.00 0.82 0.00 0.00 66.70 67.06 1cfc h VAL 108 Cb 0.81 -0.11 -0.02 0.00 -1.52 0.00 0.00 31.29 30.45 1cfc h VAL 108 CO 0.07 0.21 -0.67 0.24 0.02 0.00 0.00 177.57 177.44 1cfc h MET 109 N 1.18 0.06 0.13 1.57 2.07 -1.13 -2.95 114.93 115.86 1cfc h MET 109 Ca 0.37 -0.05 -0.27 0.00 -2.07 0.00 0.00 59.70 57.68 1cfc h MET 109 Cb 0.00 0.01 0.00 0.00 -1.87 0.00 0.00 31.60 29.74 1cfc h MET 109 CO -0.11 0.71 -1.37 1.15 1.07 0.00 0.00 176.91 178.36 1cfc h THR 110 N 0.04 1.08 0.00 2.22 2.02 -0.65 -3.33 112.91 114.29 1cfc h THR 110 Ca -0.01 -2.43 -0.01 0.00 0.77 0.00 0.00 66.41 64.73 1cfc h THR 110 Cb 1.20 2.78 -0.00 0.00 -1.74 0.00 0.00 68.15 70.38 1cfc h THR 110 CO 0.09 0.72 -0.06 -1.13 0.37 0.00 0.00 175.52 175.51 1cfc h ASN 111 N -0.27 0.00 0.00 4.18 -0.73 -0.76 -1.51 115.58 116.49 1cfc h ASN 111 Ca -0.29 0.00 -0.00 0.00 1.87 0.00 0.00 56.30 57.88 1cfc h ASN 111 Cb 1.78 0.00 -0.00 0.00 0.27 0.00 0.00 38.32 40.37 1cfc h ASN 111 CO 0.08 0.06 -0.00 -0.07 -0.37 0.00 0.00 177.43 177.13 1cfc h LEU 112 N 0.00 0.00 0.00 0.34 3.38 -1.63 -3.45 115.31 113.95 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 0.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.88 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 -1.44 1.18 3.81 0.83 0.00 -0.57 -5.06 105.19 103.93 1cfc n GLY 113 Ca -0.03 -0.41 -0.34 0.00 0.00 0.00 0.00 46.02 45.24 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 -2.09 4.31 0.00 1.61 0.41 -1.26 -4.89 118.70 116.79 1cfc s GLU 114 Ca 0.00 1.19 -0.02 0.00 -0.41 0.00 0.00 54.97 55.73 1cfc s GLU 114 Cb 0.00 -2.36 -0.10 0.00 -1.78 0.00 0.00 34.13 29.89 1cfc s GLU 114 CO 0.00 0.04 2.59 1.63 -0.49 0.00 0.00 175.26 179.03 1cfc n LYS 115 N -0.31 1.37 -3.08 1.61 5.02 -1.26 -4.86 118.16 116.65 1cfc n LYS 115 Ca 0.06 -0.39 -0.37 0.00 -2.02 0.00 0.00 58.31 55.59 1cfc n LYS 115 Cb 0.53 -1.40 -0.06 0.00 -0.02 0.00 0.00 35.03 34.08 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 4.37 0.02 -0.35 0.05 -1.26 -5.07 118.68 116.44 1cfc s LEU 116 Ca 0.26 1.45 0.02 0.00 0.05 0.00 0.00 54.13 55.91 1cfc s LEU 116 Cb 0.12 -3.55 -0.04 0.00 -2.05 0.00 0.00 46.19 40.68 1cfc s LEU 116 CO 0.00 0.05 0.03 0.42 -0.55 0.00 0.00 176.35 176.31 1cfc s THR 117 N -1.47 4.33 0.54 5.48 -4.23 -1.26 -4.99 115.64 114.03 1cfc s THR 117 Ca 0.42 -0.64 0.25 0.00 -1.18 0.00 0.00 61.69 60.54 1cfc s THR 117 Cb -0.17 -2.99 0.38 0.00 1.34 0.00 0.00 72.50 71.06 1cfc s THR 117 CO 0.22 0.29 2.01 0.44 -0.54 0.00 0.00 174.62 177.04 1cfc h ASP 118 N 3.98 0.00 -0.27 3.99 3.32 -2.00 -1.29 116.42 124.15 1cfc h ASP 118 Ca -0.48 0.00 -0.13 0.00 0.02 0.00 0.00 57.03 56.44 1cfc h ASP 118 Cb 1.17 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.72 1cfc h ASP 118 CO 0.60 0.00 -0.33 -0.33 -1.72 0.00 0.00 179.24 177.47 1cfc h GLU 119 N 0.00 0.71 -0.65 3.56 3.07 -1.99 -1.87 114.58 117.39 1cfc h GLU 119 Ca 0.22 -0.39 0.00 0.00 -0.50 0.00 0.00 59.36 58.69 1cfc h GLU 119 Cb 0.90 0.02 -0.03 0.00 -0.84 0.00 0.00 28.75 28.80 1cfc h GLU 119 CO -0.00 1.01 0.43 0.93 -1.40 0.00 0.00 179.01 179.97 1cfc h GLU 120 N 0.44 0.87 -0.41 2.33 5.08 -1.64 -2.19 114.58 119.06 1cfc h GLU 120 Ca 0.04 -0.06 -0.11 0.00 -1.00 0.00 0.00 59.36 58.23 1cfc h GLU 120 Cb 0.91 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 29.95 1cfc h GLU 120 CO 0.08 0.58 -0.17 0.28 -1.00 0.00 0.00 179.01 178.78 1cfc h VAL 121 N 0.89 1.26 -1.00 3.13 2.07 -1.47 -2.66 116.25 118.46 1cfc h VAL 121 Ca 0.24 -1.26 0.23 0.00 0.82 0.00 0.00 66.70 66.73 1cfc h VAL 121 Cb -0.09 1.14 -0.10 0.00 -1.52 0.00 0.00 31.29 30.72 1cfc h VAL 121 CO -0.05 0.42 0.63 0.44 0.02 0.00 0.00 177.57 179.04 1cfc h ASP 122 N 0.68 0.57 0.06 0.57 3.32 -0.68 0.49 116.42 121.42 1cfc h ASP 122 Ca 0.10 0.09 -0.22 0.00 0.02 0.00 0.00 57.03 57.03 1cfc h ASP 122 Cb 0.67 -0.01 0.01 0.00 0.22 0.00 0.00 39.33 40.22 1cfc h ASP 122 CO 0.05 0.15 -0.81 -0.33 -1.72 0.00 0.00 179.24 176.58 1cfc h GLU 123 N 0.52 0.61 0.00 3.56 4.39 -1.36 -2.68 114.58 119.63 1cfc h GLU 123 Ca 0.58 -0.53 -0.01 0.00 0.34 0.00 0.00 59.36 59.73 1cfc h GLU 123 Cb 1.25 0.12 -0.00 0.00 -0.10 0.00 0.00 28.75 30.02 1cfc h GLU 123 CO -0.33 1.15 -0.06 0.52 -1.16 0.00 0.00 179.01 179.13 1cfc h MET 124 N 0.41 0.00 0.00 2.33 2.86 -0.01 -1.03 114.93 119.48 1cfc h MET 124 Ca -0.06 0.00 -0.14 0.00 -2.06 0.00 0.00 59.70 57.45 1cfc h MET 124 Cb 1.42 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 33.06 1cfc h MET 124 CO 0.15 0.06 -0.65 0.82 1.06 0.00 0.00 176.91 178.36 1cfc h ILE 125 N 0.00 1.14 0.29 -1.22 2.04 -0.45 -2.99 117.51 116.33 1cfc h ILE 125 Ca -0.00 -2.54 -0.01 0.00 1.00 0.00 0.00 64.86 63.31 1cfc h ILE 125 Cb 0.13 2.51 0.00 0.00 -0.74 0.00 0.00 36.82 38.72 1cfc h ILE 125 CO 0.01 0.64 -0.16 0.03 0.00 0.00 0.00 178.15 178.67 1cfc h ARG 126 N 0.00 -0.40 0.00 2.37 2.47 -0.86 -2.86 114.38 115.10 1cfc h ARG 126 Ca -0.01 0.03 0.00 0.00 -1.26 0.00 0.00 59.98 58.74 1cfc h ARG 126 Cb 1.46 0.09 0.00 0.00 -1.65 0.00 0.00 29.97 29.87 1cfc h ARG 126 CO 0.08 -0.27 0.00 0.93 0.56 0.00 0.00 179.97 181.28 1cfc h GLU 127 N -0.42 0.00 -3.98 0.04 5.08 -1.67 -3.35 114.58 110.28 1cfc h GLU 127 Ca -0.04 0.00 -0.75 0.00 -1.00 0.00 0.00 59.36 57.57 1cfc h GLU 127 Cb 0.33 0.00 -0.17 0.00 0.50 0.00 0.00 28.75 29.41 1cfc h GLU 127 CO 0.05 0.00 1.63 0.00 -1.00 0.00 0.00 179.01 179.69 1cfc n ALA 128 N -2.07 4.71 -1.04 3.43 0.00 -1.08 -4.90 120.51 119.57 1cfc n ALA 128 Ca 0.04 -4.33 -0.03 0.00 0.00 0.00 0.00 53.44 49.12 1cfc n ALA 128 Cb 0.51 -2.96 -0.03 0.00 0.00 0.00 0.00 19.45 16.97 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 4.40 -1.85 0.00 0.00 9.92 -1.26 -4.56 116.55 123.20 1cfc n ASP 129 Ca 0.37 -1.23 0.12 0.00 -0.53 0.00 0.00 54.79 53.53 1cfc n ASP 129 Cb 0.39 -0.57 0.72 0.00 -0.64 0.00 0.00 41.12 41.02 1cfc n ASP 129 CO 0.00 0.00 0.00 -0.38 0.13 0.00 0.00 177.20 176.95 1cfc n ILE 130 N 4.48 0.00 -2.42 0.53 5.41 -1.26 -4.74 119.36 121.36 1cfc n ILE 130 Ca 0.10 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.85 1cfc n ILE 130 Cb 0.43 -0.38 0.00 0.00 -0.71 0.00 0.00 39.64 38.98 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 -0.88 0.99 0.00 4.38 2.03 -1.26 -4.18 116.55 117.64 1cfc n ASP 131 Ca 0.18 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.49 1cfc n ASP 131 Cb 0.08 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.48 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 1.12 0.00 0.27 0.00 -1.26 -4.32 105.19 106.00 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 0.21 0.00 0.00 1.61 2.03 -1.26 -5.09 116.55 114.05 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 2.35 1.10 3.30 0.27 0.00 -1.26 -5.13 105.19 105.81 1cfc n GLY 134 Ca 0.00 -0.04 -0.22 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 1.16 0.01 1.61 -0.21 -1.26 -4.21 119.66 116.77 1cfc s GLN 135 Ca 0.00 -1.26 -0.02 0.00 0.02 0.00 0.00 55.36 54.10 1cfc s GLN 135 Cb 0.00 -1.31 -0.01 0.00 1.00 0.00 0.00 33.01 32.69 1cfc s GLN 135 CO 0.00 0.29 0.01 0.08 -2.12 0.00 0.00 175.29 173.55 1cfc s VAL 136 N -1.59 0.10 0.54 1.09 1.01 -1.05 -4.95 120.40 115.54 1cfc s VAL 136 Ca 0.10 -0.83 -0.15 0.00 0.00 0.00 0.00 61.98 61.10 1cfc s VAL 136 Cb -0.08 -0.29 -0.07 0.00 0.00 0.00 0.00 36.38 35.94 1cfc s VAL 136 CO 0.05 -0.45 1.00 0.54 0.00 0.00 0.00 175.10 176.23 1cfc s ASN 137 N -1.39 6.53 0.08 3.32 2.20 -1.26 -3.13 114.94 121.28 1cfc s ASN 137 Ca -0.15 1.53 0.18 0.00 -0.94 0.00 0.00 52.86 53.48 1cfc s ASN 137 Cb -0.09 -2.50 -0.12 0.00 -2.00 0.00 0.00 41.25 36.54 1cfc s ASN 137 CO -0.00 -0.66 0.84 0.00 -2.94 0.00 0.00 177.10 174.34 1cfc n TYR 138 N -1.87 0.94 -0.33 1.54 4.11 -1.26 -4.29 117.16 116.00 1cfc n TYR 138 Ca 0.06 0.31 0.24 0.00 -0.00 0.00 0.00 57.90 58.51 1cfc n TYR 138 Cb 0.54 -1.05 0.45 0.00 -0.00 0.00 0.00 39.34 39.28 1cfc n TYR 138 CO 0.00 0.00 0.00 0.93 -0.00 0.00 0.00 176.86 177.79 1cfc h GLU 139 N 0.00 0.00 -0.16 -3.48 3.07 -1.93 1.16 114.58 113.24 1cfc h GLU 139 Ca -0.14 -0.00 -0.14 0.00 -0.50 0.00 0.00 59.36 58.58 1cfc h GLU 139 Cb 1.47 -0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.39 1cfc h GLU 139 CO 0.04 0.00 -0.46 0.93 -1.40 0.00 0.00 179.01 178.11 1cfc h GLU 140 N 0.00 0.60 0.00 2.33 4.39 -2.01 -2.95 114.58 116.95 1cfc h GLU 140 Ca 0.73 -0.43 -0.00 0.00 0.34 0.00 0.00 59.36 60.00 1cfc h GLU 140 Cb 1.76 0.07 -0.00 0.00 -0.10 0.00 0.00 28.75 30.48 1cfc h GLU 140 CO -0.85 1.05 -0.00 0.74 -1.16 0.00 0.00 179.01 178.78 1cfc h PHE 141 N 0.26 0.00 -0.09 4.33 0.04 0.43 -2.94 116.94 118.96 1cfc h PHE 141 Ca -0.01 0.00 -0.04 0.00 2.80 0.00 0.00 57.97 60.72 1cfc h PHE 141 Cb 1.08 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 39.23 1cfc h PHE 141 CO 0.10 0.00 -0.09 0.28 -0.60 0.00 0.00 178.31 178.00 1cfc h VAL 142 N 0.00 1.36 0.00 -0.55 2.07 0.11 -2.87 116.25 116.37 1cfc h VAL 142 Ca -0.00 -1.24 -0.03 0.00 0.82 0.00 0.00 66.70 66.25 1cfc h VAL 142 Cb 0.51 1.98 -0.00 0.00 -1.52 0.00 0.00 31.29 32.25 1cfc h VAL 142 CO 0.00 0.35 -0.13 1.56 0.02 0.00 0.00 177.57 179.38 1cfc h GLN 143 N -0.19 0.00 -0.15 1.57 1.08 -1.47 -2.77 115.11 113.19 1cfc h GLN 143 Ca 0.01 0.00 -0.18 0.00 -1.45 0.00 0.00 58.65 57.03 1cfc h GLN 143 Cb 0.61 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 28.03 1cfc h GLN 143 CO 0.02 0.13 -0.66 0.52 -0.95 0.00 0.00 178.83 177.88 1cfc h MET 144 N 0.00 0.57 0.00 1.46 2.86 -1.34 -3.04 114.93 115.44 1cfc h MET 144 Ca -0.00 -0.42 -0.04 0.00 -2.06 0.00 0.00 59.70 57.17 1cfc h MET 144 Cb 0.43 0.07 -0.01 0.00 0.06 0.00 0.00 31.60 32.15 1cfc h MET 144 CO 0.02 1.04 -0.21 0.52 1.06 0.00 0.00 176.91 179.34 1cfc h MET 145 N 0.41 0.00 0.10 1.72 2.86 -1.28 -3.21 114.93 115.53 1cfc h MET 145 Ca -0.02 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.62 1cfc h MET 145 Cb 1.24 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.90 1cfc h MET 145 CO 0.12 0.21 -0.05 1.79 1.06 0.00 0.00 176.91 180.04 1cfc h THR 146 N 0.00 1.04 0.00 2.22 1.35 -1.47 -3.13 112.91 112.91 1cfc h THR 146 Ca -0.00 -1.33 0.00 0.00 -0.55 0.00 0.00 66.41 64.53 1cfc h THR 146 Cb 0.81 1.78 0.00 0.00 -1.73 0.00 0.00 68.15 69.01 1cfc h THR 146 CO 0.03 0.28 0.00 0.00 -0.25 0.00 0.00 175.52 175.58 1cfc n ALA 147 N -2.55 2.00 -1.46 6.62 0.00 -1.16 -4.73 120.51 119.23 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 0.28 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.73 1cfc n ALA 147 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13