#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 2.66 -4.77 0.00 8.00 -1.26 -4.91 116.55 116.27 1cfc n ASP 2 Ca 0.00 -2.28 -0.36 0.00 0.71 0.00 0.00 54.79 52.85 1cfc n ASP 2 Cb 0.00 -0.47 -0.00 0.00 -0.02 0.00 0.00 41.12 40.62 1cfc n ASP 2 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 1cfc s GLN 3 N -1.71 3.58 -0.03 -1.24 -0.21 -1.26 -4.96 119.66 113.84 1cfc s GLN 3 Ca 0.23 1.70 -0.30 0.00 0.02 0.00 0.00 55.36 57.01 1cfc s GLN 3 Cb 0.16 -2.23 -0.04 0.00 1.00 0.00 0.00 33.01 31.90 1cfc s GLN 3 CO 0.09 -0.68 1.26 -0.51 -2.12 0.00 0.00 175.29 173.33 1cfc s LEU 4 N -3.36 4.30 0.72 2.90 1.43 -1.26 -5.01 118.68 118.40 1cfc s LEU 4 Ca 0.68 1.92 -0.11 0.00 -1.03 0.00 0.00 54.13 55.59 1cfc s LEU 4 Cb -0.27 -3.56 0.03 0.00 0.03 0.00 0.00 46.19 42.42 1cfc s LEU 4 CO 0.31 -0.62 1.07 0.42 0.23 0.00 0.00 176.35 177.77 1cfc s THR 5 N 2.19 3.76 0.42 5.49 -4.23 -1.26 -4.84 115.64 117.17 1cfc s THR 5 Ca 0.59 0.57 0.09 0.00 -1.18 0.00 0.00 61.69 61.76 1cfc s THR 5 Cb -0.27 -3.22 0.27 0.00 1.34 0.00 0.00 72.50 70.63 1cfc s THR 5 CO 0.24 -0.74 2.06 -0.33 -0.54 0.00 0.00 174.62 175.30 1cfc h GLU 6 N -0.86 0.47 -0.07 3.99 4.39 -1.99 -1.74 114.58 118.76 1cfc h GLU 6 Ca -0.44 -0.03 -0.04 0.00 0.34 0.00 0.00 59.36 59.19 1cfc h GLU 6 Cb 1.22 -0.11 0.00 0.00 -0.10 0.00 0.00 28.75 29.76 1cfc h GLU 6 CO 0.55 0.31 -0.12 0.93 -1.16 0.00 0.00 179.01 179.52 1cfc h GLU 7 N 0.48 0.20 -0.91 2.33 5.08 -1.99 -2.28 114.58 117.49 1cfc h GLU 7 Ca 0.15 -0.12 0.08 0.00 -1.00 0.00 0.00 59.36 58.47 1cfc h GLU 7 Cb 0.02 0.01 -0.06 0.00 0.50 0.00 0.00 28.75 29.22 1cfc h GLU 7 CO -0.04 0.70 0.59 1.96 -1.00 0.00 0.00 179.01 181.22 1cfc h GLN 8 N -0.28 0.93 -0.25 2.33 4.20 -1.80 0.11 115.11 120.34 1cfc h GLN 8 Ca 0.00 -0.06 -0.10 0.00 0.06 0.00 0.00 58.65 58.56 1cfc h GLN 8 Cb 0.69 -0.21 -0.01 0.00 0.30 0.00 0.00 27.48 28.24 1cfc h GLN 8 CO 0.03 0.62 -0.25 0.82 -0.67 0.00 0.00 178.83 179.37 1cfc h ILE 9 N 0.96 1.27 -0.24 2.54 2.04 -1.27 -2.61 117.51 120.20 1cfc h ILE 9 Ca 0.41 -1.27 -0.15 0.00 1.00 0.00 0.00 64.86 64.86 1cfc h ILE 9 Cb 0.32 1.35 -0.01 0.00 -0.74 0.00 0.00 36.82 37.75 1cfc h ILE 9 CO -0.17 0.40 -0.45 0.00 0.00 0.00 0.00 178.15 177.93 1cfc h ALA 10 N 1.31 0.76 -0.17 1.87 0.00 -0.27 -0.87 119.26 121.88 1cfc h ALA 10 Ca 0.06 -0.47 -0.06 0.00 0.00 0.00 0.00 54.91 54.45 1cfc h ALA 10 Cb 0.67 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 1cfc h ALA 10 CO 0.05 0.66 -0.14 0.93 0.00 0.00 0.00 179.25 180.75 1cfc h GLU 11 N 0.49 0.28 0.21 0.00 5.08 -0.69 -1.12 114.58 118.83 1cfc h GLU 11 Ca 0.03 -0.07 -0.32 0.00 -1.00 0.00 0.00 59.36 58.01 1cfc h GLU 11 Cb 0.98 -0.04 0.03 0.00 0.50 0.00 0.00 28.75 30.22 1cfc h GLU 11 CO 0.09 0.43 -1.41 0.74 -1.00 0.00 0.00 179.01 177.86 1cfc h PHE 12 N 0.26 0.81 -0.33 4.33 0.04 -1.22 -2.34 116.94 118.49 1cfc h PHE 12 Ca 0.05 -0.59 -0.05 0.00 2.80 0.00 0.00 57.97 60.18 1cfc h PHE 12 Cb 0.42 -0.03 -0.02 0.00 2.20 0.00 0.00 35.95 38.52 1cfc h PHE 12 CO 0.01 1.47 -0.02 -0.22 -0.60 0.00 0.00 178.31 178.95 1cfc h LYS 13 N 0.12 0.51 0.05 1.51 3.64 -0.82 0.37 116.57 121.94 1cfc h LYS 13 Ca -0.22 -0.11 -0.00 0.00 -1.27 0.00 0.00 60.65 59.05 1cfc h LYS 13 Cb 2.10 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 33.85 1cfc h LYS 13 CO 0.25 0.55 -0.03 0.93 -2.27 0.00 0.00 179.45 178.88 1cfc h GLU 14 N 0.49 -0.07 0.00 1.90 4.39 -1.24 -1.72 114.58 118.33 1cfc h GLU 14 Ca 0.10 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.79 1cfc h GLU 14 Cb 0.34 0.02 -0.00 0.00 -0.10 0.00 0.00 28.75 29.00 1cfc h GLU 14 CO 0.01 0.48 -0.10 0.00 -1.16 0.00 0.00 179.01 178.24 1cfc h ALA 15 N 0.17 1.65 -0.00 3.43 0.00 -1.22 -2.39 119.26 120.92 1cfc h ALA 15 Ca -0.01 -0.09 -0.14 0.00 0.00 0.00 0.00 54.91 54.66 1cfc h ALA 15 Cb 0.59 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 18.37 1cfc h ALA 15 CO 0.01 0.13 -0.56 0.35 0.00 0.00 0.00 179.25 179.18 1cfc h PHE 16 N 0.00 0.57 0.00 0.00 3.04 -0.21 -3.18 116.94 117.15 1cfc h PHE 16 Ca -0.00 -0.31 0.00 0.00 3.98 0.00 0.00 57.97 61.64 1cfc h PHE 16 Cb 0.21 -0.06 0.00 0.00 2.56 0.00 0.00 35.95 38.65 1cfc h PHE 16 CO 0.00 1.12 0.00 0.77 -2.02 0.00 0.00 178.31 178.18 1cfc h SER 17 N -0.15 0.00 0.08 0.41 0.02 -1.01 -2.79 113.55 110.11 1cfc h SER 17 Ca -0.07 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.87 1cfc h SER 17 Cb 1.28 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.82 1cfc h SER 17 CO 0.11 0.00 -0.05 -0.07 -1.14 0.00 0.00 176.83 175.68 1cfc h LEU 18 N 0.00 0.00 -3.11 5.07 3.38 -1.42 -2.54 115.31 116.69 1cfc h LEU 18 Ca 0.00 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.93 1cfc h LEU 18 Cb 0.34 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.06 1cfc h LEU 18 CO 0.00 0.05 -0.23 0.49 0.09 0.00 0.00 178.44 178.85 1cfc n PHE 19 N -4.19 0.35 -2.96 1.13 3.01 -1.05 -4.83 117.46 108.92 1cfc n PHE 19 Ca -0.03 -1.34 -0.43 0.00 1.01 0.00 0.00 57.45 56.67 1cfc n PHE 19 Cb 0.14 -0.29 0.01 0.00 -0.01 0.00 0.00 39.48 39.33 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 -1.14 6.56 0.00 4.37 2.03 -0.96 -4.68 116.55 122.72 1cfc n ASP 20 Ca 0.22 -3.45 0.10 0.00 0.52 0.00 0.00 54.79 52.17 1cfc n ASP 20 Cb 0.78 -1.26 0.56 0.00 -0.72 0.00 0.00 41.12 40.48 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 1.14 0.52 -0.10 -0.67 4.76 -1.26 -2.33 118.16 120.21 1cfc n LYS 21 Ca 0.28 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 32.18 1cfc n LYS 21 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 1cfc n ASP 22 N -1.09 3.25 -1.08 4.39 8.00 -1.26 -4.91 116.55 123.85 1cfc n ASP 22 Ca 0.13 -2.00 -0.08 0.00 0.71 0.00 0.00 54.79 53.56 1cfc n ASP 22 Cb 0.09 -0.13 -0.03 0.00 -0.02 0.00 0.00 41.12 41.02 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 0.77 0.75 0.44 0.00 -0.98 -4.68 105.19 102.93 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 0.11 2.56 -0.31 1.61 2.03 -1.26 -4.95 116.55 116.34 1cfc n ASP 24 Ca -0.08 -1.78 -0.03 0.00 0.52 0.00 0.00 54.79 53.42 1cfc n ASP 24 Cb 0.30 0.21 -0.00 0.00 -0.72 0.00 0.00 41.12 40.90 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 1.38 0.30 3.18 0.27 0.00 -1.26 -5.03 105.19 104.03 1cfc n GLY 25 Ca 0.12 -0.80 -0.11 0.00 0.00 0.00 0.00 46.02 45.23 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 -2.14 0.14 0.10 2.61 -4.23 -1.26 -3.32 115.64 107.54 1cfc s THR 26 Ca 0.00 -1.95 -0.01 0.00 -1.18 0.00 0.00 61.69 58.55 1cfc s THR 26 Cb 0.00 -2.21 -0.04 0.00 1.34 0.00 0.00 72.50 71.59 1cfc s THR 26 CO 0.00 -0.31 0.04 0.27 -0.54 0.00 0.00 174.62 174.08 1cfc s ILE 27 N -4.04 0.14 0.59 2.99 -4.36 -0.30 -4.41 121.20 111.82 1cfc s ILE 27 Ca 0.29 -1.84 -0.04 0.00 -0.26 0.00 0.00 60.65 58.81 1cfc s ILE 27 Cb 0.07 -1.83 0.03 0.00 1.25 0.00 0.00 42.46 41.98 1cfc s ILE 27 CO 0.05 -0.66 0.87 0.42 0.24 0.00 0.00 174.94 175.87 1cfc s THR 28 N -3.99 3.14 0.35 8.37 -4.23 -1.26 -0.89 115.64 117.13 1cfc s THR 28 Ca 0.17 -0.28 0.12 0.00 -1.18 0.00 0.00 61.69 60.52 1cfc s THR 28 Cb 0.07 -3.25 0.07 0.00 1.34 0.00 0.00 72.50 70.73 1cfc s THR 28 CO -0.03 -0.23 1.78 0.71 -0.54 0.00 0.00 174.62 176.32 1cfc h THR 29 N -0.15 1.30 0.00 3.99 1.35 -1.86 -2.45 112.91 115.09 1cfc h THR 29 Ca -0.45 -1.44 -0.02 0.00 -0.55 0.00 0.00 66.41 63.96 1cfc h THR 29 Cb 1.28 1.77 -0.00 0.00 -1.73 0.00 0.00 68.15 69.47 1cfc h THR 29 CO 0.58 0.41 -0.08 0.11 -0.25 0.00 0.00 175.52 176.30 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 0.74 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.05 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 -4.06 3.07 -0.01 3.15 1.02 -0.93 -4.46 120.64 118.42 1cfc n GLU 31 Ca -0.03 -2.76 -0.13 0.00 -0.02 0.00 0.00 57.16 54.23 1cfc n GLU 31 Cb 0.16 -1.69 -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 4.31 0.02 -1.79 -4.62 5.85 -1.15 -2.33 115.31 115.60 1cfc h LEU 32 Ca 0.00 -0.42 -0.03 0.00 0.84 0.00 0.00 57.88 58.27 1cfc h LEU 32 Cb 1.15 -0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.17 1cfc h LEU 32 CO 0.08 0.43 -0.15 1.23 -0.34 0.00 0.00 178.44 179.69 1cfc h GLY 33 N -0.40 0.00 0.99 3.75 0.00 -1.78 -2.16 103.07 103.47 1cfc h GLY 33 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 47.33 47.20 1cfc h GLY 33 CO 0.00 0.00 -0.33 -0.84 0.00 0.00 0.00 176.54 175.37 1cfc h THR 34 N 0.00 1.30 -0.14 4.70 2.02 -1.76 0.78 112.91 119.81 1cfc h THR 34 Ca -0.00 -1.51 -0.03 0.00 0.77 0.00 0.00 66.41 65.64 1cfc h THR 34 Cb 0.38 1.62 -0.00 0.00 -1.74 0.00 0.00 68.15 68.40 1cfc h THR 34 CO 0.02 0.48 -0.01 0.58 0.37 0.00 0.00 175.52 176.96 1cfc h VAL 35 N 0.46 1.26 -0.98 3.16 2.07 -1.02 -1.24 116.25 119.96 1cfc h VAL 35 Ca 0.04 -0.88 0.04 0.00 0.82 0.00 0.00 66.70 66.72 1cfc h VAL 35 Cb 0.91 1.57 -0.06 0.00 -1.52 0.00 0.00 31.29 32.19 1cfc h VAL 35 CO 0.08 0.26 0.64 0.24 0.02 0.00 0.00 177.57 178.81 1cfc h MET 36 N -0.02 1.19 0.00 1.57 2.86 -1.38 0.13 114.93 119.28 1cfc h MET 36 Ca 0.04 -0.07 -0.02 0.00 -2.06 0.00 0.00 59.70 57.58 1cfc h MET 36 Cb 0.40 -0.27 -0.00 0.00 0.06 0.00 0.00 31.60 31.78 1cfc h MET 36 CO 0.01 0.79 -0.11 0.00 1.06 0.00 0.00 176.91 178.66 1cfc h ARG 37 N 1.23 0.00 -0.33 1.72 3.08 -0.53 -1.18 114.38 118.37 1cfc h ARG 37 Ca 0.39 0.00 -0.10 0.00 0.07 0.00 0.00 59.98 60.34 1cfc h ARG 37 Cb 0.02 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.05 1cfc h ARG 37 CO -0.13 0.11 -0.23 0.66 -1.07 0.00 0.00 179.97 179.31 1cfc h SER 38 N 0.00 0.65 -0.04 7.04 4.64 0.48 -1.88 113.55 124.43 1cfc h SER 38 Ca -0.00 -0.23 0.00 0.00 -0.47 0.00 0.00 61.79 61.09 1cfc h SER 38 Cb 0.42 -0.18 0.00 0.00 -0.31 0.00 0.00 62.40 62.33 1cfc h SER 38 CO 0.01 0.87 0.00 0.18 -0.87 0.00 0.00 176.83 177.02 1cfc n LEU 39 N -4.12 0.48 0.00 5.97 4.77 -0.83 -4.85 117.00 118.41 1cfc n LEU 39 Ca 0.00 -0.19 0.00 0.00 -0.03 0.00 0.00 56.01 55.79 1cfc n LEU 39 Cb 0.42 -0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.48 1cfc n LEU 39 CO 0.43 0.10 0.00 0.61 -1.33 0.00 0.00 177.39 177.20 1cfc n GLY 40 N 0.91 0.64 3.89 -0.72 0.00 -0.71 -5.06 105.19 104.15 1cfc n GLY 40 Ca 0.16 -0.71 -0.35 0.00 0.00 0.00 0.00 46.02 45.11 1cfc n GLY 40 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1cfc s GLN 41 N -1.62 3.44 -0.46 1.61 -0.21 -0.51 -4.98 119.66 116.92 1cfc s GLN 41 Ca 0.00 -0.21 0.06 0.00 0.02 0.00 0.00 55.36 55.23 1cfc s GLN 41 Cb 0.00 -3.15 0.22 0.00 1.00 0.00 0.00 33.01 31.08 1cfc s GLN 41 CO 0.00 0.73 0.49 -1.71 -2.12 0.00 0.00 175.29 172.69 1cfc n ASN 42 N 1.52 0.72 -4.78 5.90 2.85 -1.26 -3.40 115.26 116.82 1cfc n ASN 42 Ca -0.16 -2.74 -0.35 0.00 -0.11 0.00 0.00 54.58 51.21 1cfc n ASN 42 Cb 0.54 -0.63 -0.01 0.00 1.24 0.00 0.00 39.78 40.93 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 -1.01 3.50 1.11 1.20 0.04 -1.26 -5.02 135.00 133.56 1cfc s PRO 43 Ca 0.34 1.61 -0.16 0.00 0.04 0.00 0.00 61.00 62.83 1cfc s PRO 43 Cb 0.11 -2.10 0.24 0.00 0.04 0.00 0.00 34.50 32.79 1cfc s PRO 43 CO -0.13 -0.73 1.11 0.95 0.04 0.00 0.00 177.00 178.24 1cfc s THR 44 N -1.76 1.79 0.14 1.26 -4.23 -1.26 -4.78 115.64 106.81 1cfc s THR 44 Ca 0.70 0.00 -0.14 0.00 -1.18 0.00 0.00 61.69 61.07 1cfc s THR 44 Cb -0.24 -2.51 0.01 0.00 1.34 0.00 0.00 72.50 71.11 1cfc s THR 44 CO 0.27 0.00 1.66 -0.33 -0.54 0.00 0.00 174.62 175.68 1cfc h GLU 45 N -2.25 0.72 -0.79 3.99 3.07 -1.99 -1.91 114.58 115.42 1cfc h GLU 45 Ca -0.49 -0.16 -0.05 0.00 -0.50 0.00 0.00 59.36 58.16 1cfc h GLU 45 Cb 1.31 -0.10 -0.03 0.00 -0.84 0.00 0.00 28.75 29.09 1cfc h GLU 45 CO 0.45 0.70 0.30 0.00 -1.40 0.00 0.00 179.01 179.05 1cfc h ALA 46 N 0.99 1.03 -0.78 3.43 0.00 -1.98 0.24 119.26 122.19 1cfc h ALA 46 Ca 0.15 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1cfc h ALA 46 Cb 0.28 -0.31 -0.04 0.00 0.00 0.00 0.00 17.79 17.73 1cfc h ALA 46 CO -0.00 0.67 0.49 0.93 0.00 0.00 0.00 179.25 181.34 1cfc h GLU 47 N 1.16 1.04 -0.11 0.00 5.08 -1.84 0.21 114.58 120.12 1cfc h GLU 47 Ca 0.26 -0.08 -0.11 0.00 -1.00 0.00 0.00 59.36 58.43 1cfc h GLU 47 Cb 0.24 -0.23 0.00 0.00 0.50 0.00 0.00 28.75 29.27 1cfc h GLU 47 CO -0.02 0.71 -0.37 -0.07 -1.00 0.00 0.00 179.01 178.26 1cfc h LEU 48 N 1.06 0.52 -1.49 1.33 3.38 -0.51 -3.06 115.31 116.54 1cfc h LEU 48 Ca 0.28 -0.61 -0.03 0.00 0.09 0.00 0.00 57.88 57.61 1cfc h LEU 48 Cb -0.08 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 40.51 1cfc h LEU 48 CO -0.06 1.04 -0.14 1.56 0.09 0.00 0.00 178.44 180.93 1cfc h GLN 49 N 0.02 0.00 -0.26 1.13 1.08 -0.13 -2.40 115.11 114.55 1cfc h GLN 49 Ca -0.02 0.00 -0.13 0.00 -1.45 0.00 0.00 58.65 57.06 1cfc h GLN 49 Cb 1.00 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 28.43 1cfc h GLN 49 CO 0.08 0.14 -0.33 0.22 -0.95 0.00 0.00 178.83 177.98 1cfc h ASP 50 N 0.00 0.75 -0.38 1.46 1.82 -0.53 -1.24 116.42 118.30 1cfc h ASP 50 Ca -0.00 -0.50 -0.13 0.00 -0.39 0.00 0.00 57.03 56.01 1cfc h ASP 50 Cb 0.55 -0.21 -0.01 0.00 0.68 0.00 0.00 39.33 40.34 1cfc h ASP 50 CO 0.02 1.10 -0.25 0.24 -1.61 0.00 0.00 179.24 178.74 1cfc h MET 51 N 0.42 0.89 -0.27 0.28 2.86 -1.41 -2.97 114.93 114.74 1cfc h MET 51 Ca 0.03 -0.39 -0.00 0.00 -2.06 0.00 0.00 59.70 57.29 1cfc h MET 51 Cb 0.91 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 32.53 1cfc h MET 51 CO 0.08 1.04 0.16 0.82 1.06 0.00 0.00 176.91 180.07 1cfc h ILE 52 N 0.76 1.10 -0.45 -1.22 2.04 -1.32 -0.91 117.51 117.50 1cfc h ILE 52 Ca 0.10 -0.22 0.13 0.00 1.00 0.00 0.00 64.86 65.86 1cfc h ILE 52 Cb 0.80 0.76 -0.02 0.00 -0.74 0.00 0.00 36.82 37.63 1cfc h ILE 52 CO 0.07 0.09 0.39 -1.13 0.00 0.00 0.00 178.15 177.57 1cfc h ASN 53 N 0.34 0.00 0.00 1.72 -0.73 -1.07 0.76 115.58 116.60 1cfc h ASN 53 Ca 0.10 0.00 -0.01 0.00 1.87 0.00 0.00 56.30 58.26 1cfc h ASN 53 Cb 0.01 0.00 -0.00 0.00 0.27 0.00 0.00 38.32 38.60 1cfc h ASN 53 CO -0.02 0.00 -0.05 -0.33 -0.37 0.00 0.00 177.43 176.67 1cfc h GLU 54 N 0.00 0.00 0.00 6.67 5.08 -1.07 -3.35 114.58 121.90 1cfc h GLU 54 Ca 0.21 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.49 1cfc h GLU 54 Cb 0.99 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.22 1cfc h GLU 54 CO -0.00 0.77 -0.40 0.28 -1.00 0.00 0.00 179.01 178.66 1cfc h VAL 55 N -1.00 0.85 0.00 3.13 2.07 -0.72 -3.05 116.25 117.52 1cfc h VAL 55 Ca -0.01 -1.69 0.00 0.00 0.82 0.00 0.00 66.70 65.82 1cfc h VAL 55 Cb 0.79 2.06 0.00 0.00 -1.52 0.00 0.00 31.29 32.61 1cfc h VAL 55 CO -0.01 0.39 0.00 -0.67 0.02 0.00 0.00 177.57 177.31 1cfc n ASP 56 N -3.43 3.27 0.16 0.57 2.03 0.26 -3.71 116.55 115.71 1cfc n ASP 56 Ca 0.00 -2.05 0.05 0.00 0.52 0.00 0.00 54.79 53.32 1cfc n ASP 56 Cb 0.57 -0.57 0.06 0.00 -0.72 0.00 0.00 41.12 40.45 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 1.88 0.76 0.00 -1.67 0.00 -1.69 -3.10 119.26 115.43 1cfc h ALA 57 Ca 0.00 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.58 1cfc h ALA 57 Cb 1.00 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.74 1cfc h ALA 57 CO 0.00 0.45 0.00 0.22 0.00 0.00 0.00 179.25 179.92 1cfc h ASP 58 N 0.00 0.00 -1.03 0.00 3.58 -1.87 -3.47 116.42 113.63 1cfc h ASP 58 Ca -0.01 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.44 1cfc h ASP 58 Cb 1.28 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.33 1cfc h ASP 58 CO 0.05 0.00 0.00 0.61 -2.88 0.00 0.00 179.24 177.02 1cfc n GLY 59 N 1.13 0.71 0.00 -0.78 0.00 -1.17 -5.03 105.19 100.04 1cfc n GLY 59 Ca 0.04 -0.39 0.00 0.00 0.00 0.00 0.00 46.02 45.67 1cfc n GLY 59 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1cfc n ASN 60 N 0.14 0.00 0.00 1.61 4.05 -1.26 -5.12 115.26 114.68 1cfc n ASN 60 Ca 0.00 0.00 0.00 0.00 0.45 0.00 0.00 54.58 55.03 1cfc n ASN 60 Cb 0.34 0.00 0.00 0.00 1.23 0.00 0.00 39.78 41.35 1cfc n ASN 60 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1cfc n GLY 61 N 1.55 0.16 3.12 8.20 0.00 -1.26 -5.07 105.19 111.90 1cfc n GLY 61 Ca 0.00 -0.04 -0.08 0.00 0.00 0.00 0.00 46.02 45.90 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 0.16 -0.01 2.61 -4.23 -1.26 -2.85 115.64 110.05 1cfc s THR 62 Ca 0.00 -1.86 -0.00 0.00 -1.18 0.00 0.00 61.69 58.65 1cfc s THR 62 Cb 0.00 -1.79 0.02 0.00 1.34 0.00 0.00 72.50 72.07 1cfc s THR 62 CO 0.00 -0.73 0.03 -0.63 -0.54 0.00 0.00 174.62 172.75 1cfc s ILE 63 N -3.99 -0.04 0.35 2.99 1.01 -0.07 -4.86 121.20 116.60 1cfc s ILE 63 Ca 0.16 0.13 0.07 0.00 0.00 0.00 0.00 60.65 61.01 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 -0.04 0.05 0.46 1.51 0.00 0.00 0.00 174.94 176.93 1cfc s ASP 64 N 0.65 5.83 0.18 3.58 1.47 -1.26 -1.15 116.67 125.97 1cfc s ASP 64 Ca -0.05 -0.27 -0.13 0.00 1.18 0.00 0.00 52.55 53.28 1cfc s ASP 64 Cb -0.08 -1.10 0.08 0.00 -0.34 0.00 0.00 42.92 41.49 1cfc s ASP 64 CO -0.02 -0.48 1.81 0.15 0.68 0.00 0.00 175.17 177.31 1cfc h PHE 65 N 0.90 0.77 -0.12 2.11 3.57 -1.96 -1.09 116.94 121.12 1cfc h PHE 65 Ca -0.45 -0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.09 1cfc h PHE 65 Cb 1.26 -0.25 -0.05 0.00 2.79 0.00 0.00 35.95 39.70 1cfc h PHE 65 CO 0.43 0.54 -0.18 -1.35 -2.23 0.00 0.00 178.31 175.52 1cfc h PRO 66 N 0.79 -0.23 -0.17 6.41 0.11 -1.96 0.25 132.00 137.20 1cfc h PRO 66 Ca 0.21 0.02 -0.04 0.00 0.11 0.00 0.00 66.00 66.30 1cfc h PRO 66 Cb -0.00 0.05 -0.01 0.00 0.11 0.00 0.00 31.00 31.15 1cfc h PRO 66 CO -0.04 -0.15 -0.07 0.93 -0.21 0.00 0.00 178.00 178.46 1cfc h GLU 67 N -0.23 0.26 -0.65 1.05 5.08 -1.94 -1.51 114.58 116.63 1cfc h GLU 67 Ca 0.10 -0.05 -0.03 0.00 -1.00 0.00 0.00 59.36 58.38 1cfc h GLU 67 Cb 0.37 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.55 1cfc h GLU 67 CO -0.26 0.34 0.29 0.35 -1.00 0.00 0.00 179.01 178.73 1cfc h PHE 68 N 0.25 0.92 0.00 4.33 3.57 0.32 0.15 116.94 126.48 1cfc h PHE 68 Ca 0.05 -0.04 -0.04 0.00 3.53 0.00 0.00 57.97 61.47 1cfc h PHE 68 Cb 0.29 -0.29 -0.01 0.00 2.79 0.00 0.00 35.95 38.73 1cfc h PHE 68 CO 0.00 0.69 -0.19 -0.07 -2.23 0.00 0.00 178.31 176.51 1cfc h LEU 69 N 0.92 0.00 -0.65 0.59 3.38 -0.05 -1.90 115.31 117.60 1cfc h LEU 69 Ca 0.22 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 58.09 1cfc h LEU 69 Cb 0.13 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 1cfc h LEU 69 CO -0.03 0.19 -0.48 0.74 0.09 0.00 0.00 178.44 178.95 1cfc h THR 70 N 0.00 1.02 -0.05 0.22 2.02 -0.70 -2.09 112.91 113.33 1cfc h THR 70 Ca -0.00 -1.90 -0.09 0.00 0.77 0.00 0.00 66.41 65.19 1cfc h THR 70 Cb 0.50 2.13 0.01 0.00 -1.74 0.00 0.00 68.15 69.05 1cfc h THR 70 CO 0.03 0.47 -0.33 0.24 0.37 0.00 0.00 175.52 176.30 1cfc h MET 71 N 0.00 0.31 -0.46 6.66 2.86 -0.80 -2.59 114.93 120.91 1cfc h MET 71 Ca -0.00 -0.27 -0.06 0.00 -2.06 0.00 0.00 59.70 57.30 1cfc h MET 71 Cb 1.10 0.06 -0.02 0.00 0.06 0.00 0.00 31.60 32.80 1cfc h MET 71 CO 0.06 0.93 0.03 0.52 1.06 0.00 0.00 176.91 179.51 1cfc h MET 72 N -0.21 0.73 -0.11 1.72 2.07 -1.49 -2.24 114.93 115.41 1cfc h MET 72 Ca -0.03 -0.18 -0.08 0.00 -2.07 0.00 0.00 59.70 57.35 1cfc h MET 72 Cb 1.00 -0.10 -0.01 0.00 -1.87 0.00 0.00 31.60 30.63 1cfc h MET 72 CO 0.07 0.73 -0.29 0.00 1.07 0.00 0.00 176.91 178.49 1cfc h ALA 73 N 1.34 1.31 -0.26 6.32 0.00 -1.38 0.10 119.26 126.70 1cfc h ALA 73 Ca 0.14 -0.32 -0.07 0.00 0.00 0.00 0.00 54.91 54.67 1cfc h ALA 73 Cb 0.39 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 1cfc h ALA 73 CO 0.01 0.48 -0.14 0.00 0.00 0.00 0.00 179.25 179.60 1cfc h ARG 74 N 0.18 0.44 0.00 0.00 2.47 -0.99 -3.08 114.38 113.40 1cfc h ARG 74 Ca 0.03 -0.12 -0.02 0.00 -1.26 0.00 0.00 59.98 58.60 1cfc h ARG 74 Cb 0.61 -0.05 -0.00 0.00 -1.65 0.00 0.00 29.97 28.88 1cfc h ARG 74 CO 0.04 0.57 -0.16 0.87 0.56 0.00 0.00 179.97 181.86 1cfc h LYS 75 N 0.41 0.00 0.00 0.04 1.79 -1.23 -3.30 116.57 114.28 1cfc h LYS 75 Ca 0.08 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.55 1cfc h LYS 75 Cb 0.49 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.14 1cfc h LYS 75 CO 0.03 0.58 0.23 -1.33 -1.08 0.00 0.00 179.45 177.88 1cfc n MET 76 N -4.65 0.00 0.20 3.15 2.81 0.31 -1.15 117.12 117.78 1cfc n MET 76 Ca -0.09 0.23 0.18 0.00 -1.81 0.00 0.00 57.70 56.21 1cfc n MET 76 Cb 0.32 -1.73 0.82 0.00 -0.71 0.00 0.00 33.22 31.92 1cfc n MET 76 CO 0.00 0.00 0.00 1.57 1.51 0.00 0.00 175.97 179.05 1cfc h LYS 77 N 0.00 0.00 -0.98 0.03 2.10 -1.62 -2.11 116.57 114.00 1cfc h LYS 77 Ca 0.00 0.00 0.41 0.00 -2.00 0.00 0.00 60.65 59.06 1cfc h LYS 77 Cb 0.47 0.00 -0.18 0.00 -0.90 0.00 0.00 32.23 31.62 1cfc h LYS 77 CO 0.00 0.00 0.53 -3.47 -2.00 0.00 0.00 179.45 174.51 1cfc n ASP 78 N -3.58 0.34 -2.17 7.07 2.03 -0.30 0.22 116.55 120.16 1cfc n ASP 78 Ca 0.03 1.62 -0.28 0.00 0.52 0.00 0.00 54.79 56.68 1cfc n ASP 78 Cb 0.41 -0.79 0.09 0.00 -0.72 0.00 0.00 41.12 40.11 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 -5.21 3.27 -0.68 5.18 5.66 -0.79 -4.95 114.28 116.76 1cfc n THR 79 Ca 0.37 -2.34 -0.28 0.00 -3.05 0.00 0.00 64.05 58.75 1cfc n THR 79 Cb 1.26 -1.05 0.14 0.00 -1.55 0.00 0.00 70.33 69.13 1cfc n THR 79 CO 0.00 0.00 0.00 -0.90 -3.05 0.00 0.00 175.07 171.12 1cfc n ASP 80 N -0.65 -2.66 0.19 1.09 5.68 0.59 -4.68 116.55 116.12 1cfc n ASP 80 Ca 0.53 -0.19 0.12 0.00 -0.50 0.00 0.00 54.79 54.75 1cfc n ASP 80 Cb 0.85 -0.81 0.16 0.00 -1.14 0.00 0.00 41.12 40.18 1cfc n ASP 80 CO 0.00 0.00 0.00 -1.28 -1.33 0.00 0.00 177.20 174.59 1cfc h SER 81 N -2.09 0.00 -0.46 -1.12 0.87 -1.94 -3.09 113.55 105.72 1cfc h SER 81 Ca -0.42 -0.00 0.13 0.00 -1.23 0.00 0.00 61.79 60.27 1cfc h SER 81 Cb 1.16 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 63.10 1cfc h SER 81 CO 0.28 0.00 0.36 -0.33 -0.53 0.00 0.00 176.83 176.61 1cfc h GLU 82 N 0.00 0.00 0.00 2.24 5.08 -1.95 0.50 114.58 120.45 1cfc h GLU 82 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1cfc h GLU 82 Cb 0.98 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.23 1cfc h GLU 82 CO 0.00 0.00 0.00 1.05 -1.00 0.00 0.00 179.01 179.06 1cfc h GLU 83 N 0.00 0.00 0.21 2.33 4.11 -1.87 -2.58 114.58 116.78 1cfc h GLU 83 Ca 0.22 0.00 -0.32 0.00 0.07 0.00 0.00 59.36 59.33 1cfc h GLU 83 Cb 0.94 0.00 0.02 0.00 0.50 0.00 0.00 28.75 30.22 1cfc h GLU 83 CO -0.00 0.00 -1.47 0.93 0.07 0.00 0.00 179.01 178.54 1cfc h GLU 84 N 0.00 0.44 -0.37 1.06 5.08 -0.20 -2.62 114.58 117.96 1cfc h GLU 84 Ca 0.00 -0.76 -0.16 0.00 -1.00 0.00 0.00 59.36 57.45 1cfc h GLU 84 Cb 0.52 0.28 -0.01 0.00 0.50 0.00 0.00 28.75 30.04 1cfc h GLU 84 CO 0.00 1.36 -0.38 0.82 -1.00 0.00 0.00 179.01 179.81 1cfc h ILE 85 N 0.02 1.27 -0.08 3.13 2.04 -1.44 -2.17 117.51 120.29 1cfc h ILE 85 Ca -0.27 -1.55 -0.02 0.00 1.00 0.00 0.00 64.86 64.02 1cfc h ILE 85 Cb 2.04 1.41 -0.00 0.00 -0.74 0.00 0.00 36.82 39.53 1cfc h ILE 85 CO 0.21 0.52 -0.01 -0.09 0.00 0.00 0.00 178.15 178.78 1cfc h ARG 86 N 0.72 0.15 -0.00 2.37 2.43 -1.58 0.61 114.38 119.08 1cfc h ARG 86 Ca 0.06 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.18 1cfc h ARG 86 Cb 0.97 -0.01 -0.00 0.00 -0.42 0.00 0.00 29.97 30.51 1cfc h ARG 86 CO 0.09 0.45 0.01 0.93 -1.51 0.00 0.00 179.97 179.94 1cfc h GLU 87 N -0.17 0.00 0.06 0.20 5.08 -1.46 0.43 114.58 118.72 1cfc h GLU 87 Ca 0.02 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.30 1cfc h GLU 87 Cb 0.39 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.65 1cfc h GLU 87 CO 0.01 0.00 -0.34 0.00 -1.00 0.00 0.00 179.01 177.68 1cfc h ALA 88 N 1.99 -0.04 -0.02 3.43 0.00 -0.72 -1.85 119.26 122.04 1cfc h ALA 88 Ca 0.00 -0.58 0.01 0.00 0.00 0.00 0.00 54.91 54.33 1cfc h ALA 88 Cb 0.02 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 1cfc h ALA 88 CO -0.00 0.16 0.03 0.74 0.00 0.00 0.00 179.25 180.18 1cfc h PHE 89 N -0.74 0.00 -0.13 0.00 0.04 0.66 0.19 116.94 116.96 1cfc h PHE 89 Ca -0.06 0.00 -0.09 0.00 2.80 0.00 0.00 57.97 60.62 1cfc h PHE 89 Cb 1.27 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.42 1cfc h PHE 89 CO 0.25 0.00 -0.28 -0.09 -0.60 0.00 0.00 178.31 177.58 1cfc h ARG 90 N 0.00 0.41 0.00 1.51 2.43 -0.04 -1.80 114.38 116.90 1cfc h ARG 90 Ca 0.01 -0.28 0.00 0.00 -0.81 0.00 0.00 59.98 58.90 1cfc h ARG 90 Cb 0.07 0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.66 1cfc h ARG 90 CO -0.00 0.88 0.37 0.28 -1.51 0.00 0.00 179.97 179.99 1cfc h VAL 91 N 0.00 0.00 0.00 0.20 2.07 0.22 0.42 116.25 119.17 1cfc h VAL 91 Ca 0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 1cfc h VAL 91 Cb 0.88 0.58 0.00 0.00 -1.52 0.00 0.00 31.29 31.23 1cfc h VAL 91 CO 0.06 0.00 -1.33 0.49 0.02 0.00 0.00 177.57 176.82 1cfc n PHE 92 N -2.76 0.01 -1.94 1.57 3.01 -0.75 -4.48 117.46 112.11 1cfc n PHE 92 Ca -0.02 0.00 -0.39 0.00 1.01 0.00 0.00 57.45 58.05 1cfc n PHE 92 Cb 0.41 -0.18 -0.01 0.00 -0.01 0.00 0.00 39.48 39.70 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 -1.76 8.01 0.32 4.37 2.03 0.15 -4.68 116.55 125.00 1cfc n ASP 93 Ca 0.01 -3.12 0.20 0.00 0.52 0.00 0.00 54.79 52.40 1cfc n ASP 93 Cb 0.41 -1.36 1.09 0.00 -0.72 0.00 0.00 41.12 40.54 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 4.54 0.00 -0.71 -0.67 1.57 -1.78 0.15 116.57 119.66 1cfc h LYS 94 Ca 0.70 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.48 1cfc h LYS 94 Cb 0.32 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.63 1cfc h LYS 94 CO 1.46 0.00 0.00 -3.47 -0.57 0.00 0.00 179.45 176.87 1cfc n ASP 95 N -2.96 3.85 -3.52 0.86 2.03 -1.26 -4.93 116.55 110.61 1cfc n ASP 95 Ca -0.03 -2.00 -0.24 0.00 0.52 0.00 0.00 54.79 53.04 1cfc n ASP 95 Cb 0.13 -0.47 -0.02 0.00 -0.72 0.00 0.00 41.12 40.03 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 1.64 -0.47 0.79 0.27 0.00 0.52 -4.78 105.19 103.17 1cfc n GLY 96 Ca 0.24 0.07 0.12 0.00 0.00 0.00 0.00 46.02 46.45 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 -2.19 2.62 0.00 1.61 4.05 -1.26 -4.93 115.26 115.16 1cfc n ASN 97 Ca 0.02 -1.82 0.00 0.00 0.45 0.00 0.00 54.58 53.23 1cfc n ASN 97 Cb 0.51 0.14 0.00 0.00 1.23 0.00 0.00 39.78 41.66 1cfc n ASN 97 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1cfc n GLY 98 N 1.36 1.14 3.13 8.20 0.00 -1.26 -4.95 105.19 112.80 1cfc n GLY 98 Ca 0.13 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.99 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 -2.76 0.99 0.14 1.61 1.51 -1.26 -4.50 117.35 113.09 1cfc s TYR 99 Ca 0.00 -0.48 -0.01 0.00 -1.01 0.00 0.00 57.07 55.56 1cfc s TYR 99 Cb 0.00 -0.57 -0.04 0.00 -0.11 0.00 0.00 41.96 41.24 1cfc s TYR 99 CO 0.00 -0.00 0.08 0.96 -1.11 0.00 0.00 175.55 175.48 1cfc s ILE 100 N -1.35 0.09 0.28 2.71 -4.36 -1.18 -4.90 121.20 112.49 1cfc s ILE 100 Ca -0.05 -1.90 -0.29 0.00 -0.26 0.00 0.00 60.65 58.15 1cfc s ILE 100 Cb -0.10 -2.10 -0.09 0.00 1.25 0.00 0.00 42.46 41.42 1cfc s ILE 100 CO 0.01 -0.39 1.02 -0.94 0.24 0.00 0.00 174.94 174.89 1cfc s SER 101 N -3.06 7.38 0.50 4.36 1.04 -1.26 -2.49 113.70 120.16 1cfc s SER 101 Ca 0.26 2.10 0.40 0.00 0.48 0.00 0.00 55.95 59.19 1cfc s SER 101 Cb 0.07 -2.61 1.59 0.00 0.10 0.00 0.00 66.02 65.17 1cfc s SER 101 CO 0.03 -0.05 1.61 0.00 0.98 0.00 0.00 173.24 175.81 1cfc h ALA 102 N 3.79 3.29 0.49 5.32 0.00 -1.90 0.46 119.26 130.71 1cfc h ALA 102 Ca -0.46 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.45 1cfc h ALA 102 Cb 1.21 0.18 0.00 0.00 0.00 0.00 0.00 17.79 19.18 1cfc h ALA 102 CO 0.67 -1.88 -0.24 0.00 0.00 0.00 0.00 179.25 177.80 1cfc h ALA 103 N 1.33 -0.66 -0.20 0.00 0.00 -1.93 0.28 119.26 118.08 1cfc h ALA 103 Ca 0.87 -0.16 0.06 0.00 0.00 0.00 0.00 54.91 55.67 1cfc h ALA 103 Cb 3.13 0.26 -0.01 0.00 0.00 0.00 0.00 17.79 21.17 1cfc h ALA 103 CO -0.22 -0.83 0.15 0.93 0.00 0.00 0.00 179.25 179.28 1cfc h GLU 104 N -0.74 0.00 -0.09 0.00 5.08 -0.49 0.14 114.58 118.48 1cfc h GLU 104 Ca -0.07 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.24 1cfc h GLU 104 Cb 0.54 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.79 1cfc h GLU 104 CO 0.11 0.00 -0.16 1.25 -1.00 0.00 0.00 179.01 179.21 1cfc h LEU 105 N 0.00 0.30 -1.60 1.33 5.85 -0.23 0.14 115.31 121.10 1cfc h LEU 105 Ca 0.09 -0.55 -0.04 0.00 0.84 0.00 0.00 57.88 58.22 1cfc h LEU 105 Cb 0.40 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.33 1cfc h LEU 105 CO -0.00 0.79 -0.21 0.03 -0.34 0.00 0.00 178.44 178.72 1cfc h ARG 106 N -0.18 0.00 -0.12 1.25 3.08 0.69 -2.27 114.38 116.83 1cfc h ARG 106 Ca 0.01 0.00 -0.17 0.00 0.07 0.00 0.00 59.98 59.89 1cfc h ARG 106 Cb 0.74 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.80 1cfc h ARG 106 CO 0.04 0.21 -0.59 1.25 -1.07 0.00 0.00 179.97 179.80 1cfc h HIS 107 N 0.00 0.82 -0.96 3.04 2.76 -0.51 -2.61 115.15 117.68 1cfc h HIS 107 Ca -0.00 -0.36 0.10 0.00 -2.20 0.00 0.00 60.37 57.91 1cfc h HIS 107 Cb 0.37 -0.13 -0.07 0.00 1.55 0.00 0.00 27.41 29.13 1cfc h HIS 107 CO 0.00 1.16 0.61 0.28 -1.30 0.00 0.00 177.93 178.68 1cfc h VAL 108 N 0.24 0.97 0.00 5.26 2.07 -0.16 0.16 116.25 124.79 1cfc h VAL 108 Ca -0.04 -0.34 -0.13 0.00 0.82 0.00 0.00 66.70 67.01 1cfc h VAL 108 Cb 1.23 -0.09 -0.02 0.00 -1.52 0.00 0.00 31.29 30.89 1cfc h VAL 108 CO 0.12 0.18 -0.62 0.24 0.02 0.00 0.00 177.57 177.51 1cfc h MET 109 N 0.98 0.00 0.11 1.57 2.07 -1.37 -3.03 114.93 115.27 1cfc h MET 109 Ca 0.45 0.00 -0.26 0.00 -2.07 0.00 0.00 59.70 57.82 1cfc h MET 109 Cb 0.40 0.00 -0.00 0.00 -1.87 0.00 0.00 31.60 30.13 1cfc h MET 109 CO -0.21 0.62 -1.29 1.15 1.07 0.00 0.00 176.91 178.25 1cfc h THR 110 N 0.00 1.11 0.00 2.22 2.02 -0.80 -3.34 112.91 114.12 1cfc h THR 110 Ca -0.01 -2.41 -0.01 0.00 0.77 0.00 0.00 66.41 64.75 1cfc h THR 110 Cb 1.13 2.77 -0.00 0.00 -1.74 0.00 0.00 68.15 70.31 1cfc h THR 110 CO 0.08 0.69 -0.06 -1.13 0.37 0.00 0.00 175.52 175.47 1cfc h ASN 111 N -0.36 0.00 0.05 4.18 -0.73 -0.85 -1.38 115.58 116.49 1cfc h ASN 111 Ca -0.28 0.00 -0.01 0.00 1.87 0.00 0.00 56.30 57.89 1cfc h ASN 111 Cb 1.71 0.00 -0.00 0.00 0.27 0.00 0.00 38.32 40.30 1cfc h ASN 111 CO 0.06 0.06 -0.03 -0.07 -0.37 0.00 0.00 177.43 177.08 1cfc h LEU 112 N 0.00 0.00 0.00 0.34 3.38 -1.65 -3.45 115.31 113.93 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 0.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.86 1cfc h LEU 112 CO 0.01 0.03 0.00 0.61 0.09 0.00 0.00 178.44 179.17 1cfc n GLY 113 N -1.30 1.08 3.77 0.83 0.00 -0.52 -5.05 105.19 103.99 1cfc n GLY 113 Ca -0.03 -0.49 -0.38 0.00 0.00 0.00 0.00 46.02 45.12 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 -2.46 4.68 -0.02 1.61 0.41 -1.26 -4.91 118.70 116.76 1cfc s GLU 114 Ca 0.00 1.41 -0.00 0.00 -0.41 0.00 0.00 54.97 55.97 1cfc s GLU 114 Cb 0.00 -2.98 0.02 0.00 -1.78 0.00 0.00 34.13 29.38 1cfc s GLU 114 CO 0.00 0.36 1.89 1.63 -0.49 0.00 0.00 175.26 178.64 1cfc n LYS 115 N 0.91 1.05 -3.16 1.61 5.02 -1.26 -4.86 118.16 117.47 1cfc n LYS 115 Ca 0.00 -0.10 -0.39 0.00 -2.02 0.00 0.00 58.31 55.80 1cfc n LYS 115 Cb 0.49 -1.04 -0.06 0.00 -0.02 0.00 0.00 35.03 34.40 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 -0.12 4.47 0.20 -0.35 1.43 -1.26 -5.06 118.68 117.99 1cfc s LEU 116 Ca 0.02 1.28 -0.16 0.00 -1.03 0.00 0.00 54.13 54.24 1cfc s LEU 116 Cb 0.02 -3.01 -0.08 0.00 0.03 0.00 0.00 46.19 43.15 1cfc s LEU 116 CO 0.00 0.14 0.64 0.42 0.23 0.00 0.00 176.35 177.77 1cfc s THR 117 N -0.47 4.73 0.65 5.49 -4.23 -1.26 -4.92 115.64 115.63 1cfc s THR 117 Ca 0.32 0.98 0.30 0.00 -1.18 0.00 0.00 61.69 62.12 1cfc s THR 117 Cb -0.19 -3.76 0.30 0.00 1.34 0.00 0.00 72.50 70.19 1cfc s THR 117 CO 0.20 0.15 1.92 0.44 -0.54 0.00 0.00 174.62 176.79 1cfc h ASP 118 N 3.26 0.00 -0.01 3.99 5.19 -2.00 -0.18 116.42 126.68 1cfc h ASP 118 Ca -0.48 0.00 -0.06 0.00 -0.62 0.00 0.00 57.03 55.87 1cfc h ASP 118 Cb 1.19 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.70 1cfc h ASP 118 CO 0.66 0.00 -0.22 -0.08 -3.12 0.00 0.00 179.24 176.48 1cfc h GLU 119 N 0.00 0.16 -0.70 3.56 4.81 -2.00 -2.68 114.58 117.73 1cfc h GLU 119 Ca 0.00 -0.16 0.11 0.00 -0.13 0.00 0.00 59.36 59.18 1cfc h GLU 119 Cb 0.65 0.04 -0.05 0.00 0.63 0.00 0.00 28.75 30.03 1cfc h GLU 119 CO 0.00 0.89 0.47 0.93 -0.73 0.00 0.00 179.01 180.57 1cfc h GLU 120 N -0.51 0.51 -0.14 1.92 5.08 -1.41 -1.25 114.58 118.78 1cfc h GLU 120 Ca -0.03 -0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.28 1cfc h GLU 120 Cb 0.96 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 30.09 1cfc h GLU 120 CO 0.04 0.34 0.00 0.28 -1.00 0.00 0.00 179.01 178.67 1cfc h VAL 121 N 0.52 1.25 -1.11 3.13 2.07 -1.48 -2.51 116.25 118.13 1cfc h VAL 121 Ca 0.33 -0.82 0.31 0.00 0.82 0.00 0.00 66.70 67.33 1cfc h VAL 121 Cb 0.58 1.52 -0.07 0.00 -1.52 0.00 0.00 31.29 31.80 1cfc h VAL 121 CO -0.11 0.24 0.76 0.44 0.02 0.00 0.00 177.57 178.92 1cfc h ASP 122 N -0.01 0.22 -0.17 0.57 3.32 -0.87 0.86 116.42 120.34 1cfc h ASP 122 Ca 0.04 0.04 -0.18 0.00 0.02 0.00 0.00 57.03 56.96 1cfc h ASP 122 Cb 0.37 0.01 0.01 0.00 0.22 0.00 0.00 39.33 39.93 1cfc h ASP 122 CO 0.01 0.03 -0.60 -0.08 -1.72 0.00 0.00 179.24 176.88 1cfc h GLU 123 N 0.19 0.70 0.00 3.56 4.57 -1.25 -2.22 114.58 120.13 1cfc h GLU 123 Ca 0.58 -0.53 -0.06 0.00 -1.18 0.00 0.00 59.36 58.18 1cfc h GLU 123 Cb 1.89 0.10 -0.01 0.00 -0.16 0.00 0.00 28.75 30.57 1cfc h GLU 123 CO -0.16 1.15 -0.27 0.52 -1.18 0.00 0.00 179.01 179.07 1cfc h MET 124 N 0.39 0.00 0.00 1.92 2.86 0.88 -2.11 114.93 118.88 1cfc h MET 124 Ca -0.03 0.00 -0.13 0.00 -2.06 0.00 0.00 59.70 57.49 1cfc h MET 124 Cb 1.22 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.87 1cfc h MET 124 CO 0.13 0.27 -0.60 0.82 1.06 0.00 0.00 176.91 178.58 1cfc h ILE 125 N 0.00 1.16 0.20 -1.22 2.04 -0.11 -2.87 117.51 116.71 1cfc h ILE 125 Ca -0.00 -2.27 -0.01 0.00 1.00 0.00 0.00 64.86 63.57 1cfc h ILE 125 Cb 0.50 2.33 0.00 0.00 -0.74 0.00 0.00 36.82 38.91 1cfc h ILE 125 CO 0.03 0.59 -0.10 0.03 0.00 0.00 0.00 178.15 178.70 1cfc h ARG 126 N 0.00 -0.26 0.00 2.37 3.08 -0.75 -2.87 114.38 115.95 1cfc h ARG 126 Ca -0.01 0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.06 1cfc h ARG 126 Cb 1.28 0.06 0.00 0.00 0.08 0.00 0.00 29.97 31.39 1cfc h ARG 126 CO 0.08 -0.16 0.00 0.93 -1.07 0.00 0.00 179.97 179.75 1cfc h GLU 127 N -0.29 0.00 -4.27 0.04 5.08 -1.64 -3.36 114.58 110.14 1cfc h GLU 127 Ca -0.03 0.00 -0.75 0.00 -1.00 0.00 0.00 59.36 57.58 1cfc h GLU 127 Cb 0.22 0.00 -0.18 0.00 0.50 0.00 0.00 28.75 29.29 1cfc h GLU 127 CO 0.05 0.00 1.45 0.00 -1.00 0.00 0.00 179.01 179.51 1cfc n ALA 128 N -2.06 4.35 -1.06 3.43 0.00 -1.08 -4.90 120.51 119.19 1cfc n ALA 128 Ca 0.04 -4.32 -0.04 0.00 0.00 0.00 0.00 53.44 49.12 1cfc n ALA 128 Cb 0.50 -2.97 -0.05 0.00 0.00 0.00 0.00 19.45 16.94 1cfc n ALA 128 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1cfc n ASP 129 N 4.79 -1.82 -0.00 0.00 5.68 -1.26 -4.57 116.55 119.37 1cfc n ASP 129 Ca 0.36 -1.18 0.15 0.00 -0.50 0.00 0.00 54.79 53.61 1cfc n ASP 129 Cb 0.40 -0.56 0.86 0.00 -1.14 0.00 0.00 41.12 40.68 1cfc n ASP 129 CO 0.00 0.00 0.00 -0.38 -1.33 0.00 0.00 177.20 175.49 1cfc n ILE 130 N 4.52 0.00 -2.63 2.12 5.41 -1.26 -4.76 119.36 122.77 1cfc n ILE 130 Ca 0.14 -0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.88 1cfc n ILE 130 Cb 0.41 -0.45 0.00 0.00 -0.71 0.00 0.00 39.64 38.89 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 -0.95 1.29 0.00 4.38 2.03 -1.26 -4.18 116.55 117.86 1cfc n ASP 131 Ca 0.22 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.53 1cfc n ASP 131 Cb 0.10 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.50 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 1.11 0.00 0.27 0.00 -1.26 -4.33 105.19 105.98 1cfc n GLY 132 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1cfc n GLY 132 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1cfc n ASP 133 N 0.23 0.00 0.00 1.61 8.00 -1.26 -5.08 116.55 120.05 1cfc n ASP 133 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.50 1cfc n ASP 133 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.10 1cfc n ASP 133 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1cfc n GLY 134 N 2.95 0.97 3.30 0.44 0.00 -1.26 -5.13 105.19 106.46 1cfc n GLY 134 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 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 1.18 0.01 1.61 -0.21 -1.26 -4.21 119.66 116.78 1cfc s GLN 135 Ca 0.00 -1.26 -0.04 0.00 0.02 0.00 0.00 55.36 54.08 1cfc s GLN 135 Cb 0.00 -1.36 -0.01 0.00 1.00 0.00 0.00 33.01 32.65 1cfc s GLN 135 CO 0.00 0.30 0.06 0.08 -2.12 0.00 0.00 175.29 173.61 1cfc s VAL 136 N -1.52 0.09 0.79 1.09 1.01 -1.04 -4.97 120.40 115.84 1cfc s VAL 136 Ca 0.10 -0.72 -0.08 0.00 0.00 0.00 0.00 61.98 61.28 1cfc s VAL 136 Cb -0.08 -0.33 0.12 0.00 0.00 0.00 0.00 36.38 36.09 1cfc s VAL 136 CO 0.05 -0.39 1.11 0.21 0.00 0.00 0.00 175.10 176.08 1cfc s ASN 137 N -1.28 4.18 -0.11 3.32 3.04 -1.26 -3.07 114.94 119.75 1cfc s ASN 137 Ca -0.14 0.21 0.17 0.00 0.04 0.00 0.00 52.86 53.14 1cfc s ASN 137 Cb -0.08 -0.60 -0.24 0.00 -1.54 0.00 0.00 41.25 38.78 1cfc s ASN 137 CO 0.00 -2.02 0.20 0.00 -3.04 0.00 0.00 177.10 172.25 1cfc n TYR 138 N -3.17 0.00 -0.35 0.43 4.11 -1.26 -4.50 117.16 112.42 1cfc n TYR 138 Ca 0.12 0.00 0.10 0.00 -0.00 0.00 0.00 57.90 58.12 1cfc n TYR 138 Cb 0.60 -0.68 0.21 0.00 -0.00 0.00 0.00 39.34 39.47 1cfc n TYR 138 CO 0.00 0.00 0.00 -0.85 -0.00 0.00 0.00 176.86 176.01 1cfc n GLU 139 N -2.44 -0.08 -0.10 -3.48 0.28 -1.26 0.16 120.64 113.71 1cfc n GLU 139 Ca -0.18 1.51 -0.14 0.00 -0.16 0.00 0.00 57.16 58.20 1cfc n GLU 139 Cb 0.83 -2.33 -0.03 0.00 1.43 0.00 0.00 31.44 31.34 1cfc n GLU 139 CO 0.00 0.00 0.00 0.93 -0.16 0.00 0.00 177.13 177.90 1cfc h GLU 140 N 0.00 0.86 0.00 3.44 5.08 -2.02 -2.86 114.58 119.08 1cfc h GLU 140 Ca 0.53 -0.47 -0.00 0.00 -1.00 0.00 0.00 59.36 58.42 1cfc h GLU 140 Cb 0.97 0.03 -0.00 0.00 0.50 0.00 0.00 28.75 30.24 1cfc h GLU 140 CO -0.98 1.12 -0.00 0.74 -1.00 0.00 0.00 179.01 178.89 1cfc h PHE 141 N 0.65 0.00 -0.08 4.33 0.04 0.22 -3.01 116.94 119.10 1cfc h PHE 141 Ca 0.05 0.00 -0.03 0.00 2.80 0.00 0.00 57.97 60.79 1cfc h PHE 141 Cb 0.98 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 39.13 1cfc h PHE 141 CO 0.07 0.00 -0.07 0.28 -0.60 0.00 0.00 178.31 177.99 1cfc h VAL 142 N 0.00 1.36 0.00 -0.55 2.07 0.18 -2.93 116.25 116.39 1cfc h VAL 142 Ca -0.00 -1.20 -0.05 0.00 0.82 0.00 0.00 66.70 66.27 1cfc h VAL 142 Cb 0.61 1.99 -0.01 0.00 -1.52 0.00 0.00 31.29 32.36 1cfc h VAL 142 CO 0.00 0.33 -0.23 1.56 0.02 0.00 0.00 177.57 179.25 1cfc h GLN 143 N -0.24 0.00 -0.50 1.57 4.20 -1.51 -2.85 115.11 115.78 1cfc h GLN 143 Ca 0.01 0.00 -0.13 0.00 0.06 0.00 0.00 58.65 58.60 1cfc h GLN 143 Cb 0.57 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.34 1cfc h GLN 143 CO 0.02 0.23 -0.18 0.52 -0.67 0.00 0.00 178.83 178.75 1cfc h MET 144 N 0.00 1.01 0.00 1.46 2.86 -1.41 -2.67 114.93 116.17 1cfc h MET 144 Ca -0.00 -0.41 -0.03 0.00 -2.06 0.00 0.00 59.70 57.20 1cfc h MET 144 Cb 0.47 -0.04 -0.00 0.00 0.06 0.00 0.00 31.60 32.08 1cfc h MET 144 CO 0.03 1.09 -0.14 0.52 1.06 0.00 0.00 176.91 179.47 1cfc h MET 145 N 0.87 0.00 -0.64 1.72 2.86 -1.32 -1.74 114.93 116.68 1cfc h MET 145 Ca 0.12 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.76 1cfc h MET 145 Cb 0.75 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.41 1cfc h MET 145 CO 0.06 0.14 0.00 0.25 1.06 0.00 0.00 176.91 178.42 1cfc n THR 146 N -3.43 0.95 0.00 2.22 -2.24 -1.01 -4.71 114.28 106.06 1cfc n THR 146 Ca -0.01 -0.56 0.00 0.00 -2.27 0.00 0.00 64.05 61.21 1cfc n THR 146 Cb 0.32 -0.17 0.00 0.00 -2.10 0.00 0.00 70.33 68.37 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 0.35 0.00 0.09 6.98 0.00 -0.65 -5.07 120.51 122.21 1cfc n ALA 147 Ca 0.12 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.57 1cfc n ALA 147 Cb 0.53 0.00 0.04 0.00 0.00 0.00 0.00 19.45 20.03 1cfc n ALA 147 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13