#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 -4.73 0.00 8.00 -1.26 -5.05 116.55 113.51 1cfc n ASP 2 Ca 0.00 -1.14 -0.37 0.00 0.71 0.00 0.00 54.79 53.99 1cfc n ASP 2 Cb 0.00 -0.03 0.07 0.00 -0.02 0.00 0.00 41.12 41.14 1cfc n ASP 2 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1cfc n GLN 3 N 0.00 1.15 -2.13 -1.24 6.02 -1.26 -4.87 117.38 115.05 1cfc n GLN 3 Ca 0.00 0.45 -0.43 0.00 -0.01 0.00 0.00 57.00 57.01 1cfc n GLN 3 Cb 0.53 -2.54 -0.02 0.00 1.02 0.00 0.00 30.24 29.22 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 -4.31 3.71 0.69 1.08 1.43 -1.26 -4.98 118.68 115.04 1cfc s LEU 4 Ca 0.82 1.36 -0.12 0.00 -1.03 0.00 0.00 54.13 55.16 1cfc s LEU 4 Cb -0.38 -3.53 0.01 0.00 0.03 0.00 0.00 46.19 42.31 1cfc s LEU 4 CO 0.41 -1.42 1.06 0.42 0.23 0.00 0.00 176.35 177.05 1cfc s THR 5 N 5.73 3.89 0.59 5.49 -4.23 -1.26 -4.79 115.64 121.06 1cfc s THR 5 Ca 0.72 0.67 0.29 0.00 -1.18 0.00 0.00 61.69 62.18 1cfc s THR 5 Cb -0.22 -3.33 0.38 0.00 1.34 0.00 0.00 72.50 70.67 1cfc s THR 5 CO 0.31 -0.75 1.92 1.05 -0.54 0.00 0.00 174.62 176.61 1cfc h GLU 6 N -0.54 0.00 0.22 3.99 4.11 -1.99 -1.24 114.58 119.13 1cfc h GLU 6 Ca -0.44 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 58.98 1cfc h GLU 6 Cb 1.21 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.47 1cfc h GLU 6 CO 0.56 0.00 -0.11 0.93 0.07 0.00 0.00 179.01 180.47 1cfc h GLU 7 N 0.00 -0.28 -0.90 1.06 5.08 -1.99 -2.05 114.58 115.49 1cfc h GLU 7 Ca 0.20 0.02 0.20 0.00 -1.00 0.00 0.00 59.36 58.78 1cfc h GLU 7 Cb 1.10 0.06 -0.07 0.00 0.50 0.00 0.00 28.75 30.35 1cfc h GLU 7 CO -0.00 -0.02 0.60 1.96 -1.00 0.00 0.00 179.01 180.55 1cfc h GLN 8 N -1.01 0.42 -0.28 2.33 4.20 -1.68 0.45 115.11 119.53 1cfc h GLN 8 Ca -0.03 -0.03 -0.13 0.00 0.06 0.00 0.00 58.65 58.52 1cfc h GLN 8 Cb 0.40 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 28.07 1cfc h GLN 8 CO 0.05 0.28 -0.37 0.82 -0.67 0.00 0.00 178.83 178.94 1cfc h ILE 9 N 0.43 1.29 -0.20 2.54 2.04 -1.27 -2.73 117.51 119.61 1cfc h ILE 9 Ca 0.47 -1.52 -0.10 0.00 1.00 0.00 0.00 64.86 64.71 1cfc h ILE 9 Cb 1.14 1.47 -0.00 0.00 -0.74 0.00 0.00 36.82 38.69 1cfc h ILE 9 CO -0.19 0.49 -0.28 0.00 0.00 0.00 0.00 178.15 178.17 1cfc h ALA 10 N 1.06 0.30 -0.63 1.87 0.00 0.52 -1.24 119.26 121.13 1cfc h ALA 10 Ca 0.05 -0.40 0.10 0.00 0.00 0.00 0.00 54.91 54.66 1cfc h ALA 10 Cb 0.88 -0.06 -0.07 0.00 0.00 0.00 0.00 17.79 18.54 1cfc h ALA 10 CO 0.08 0.31 0.25 1.49 0.00 0.00 0.00 179.25 181.38 1cfc h GLU 11 N 0.21 0.43 -0.13 0.00 4.81 -0.76 0.42 114.58 119.56 1cfc h GLU 11 Ca 0.02 -0.03 -0.13 0.00 -0.13 0.00 0.00 59.36 59.09 1cfc h GLU 11 Cb 0.86 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 30.13 1cfc h GLU 11 CO 0.07 0.29 -0.50 0.74 -0.73 0.00 0.00 179.01 178.87 1cfc h PHE 12 N 0.45 0.42 -0.85 0.92 0.04 -1.43 -2.31 116.94 114.18 1cfc h PHE 12 Ca 0.32 -0.14 -0.03 0.00 2.80 0.00 0.00 57.97 60.92 1cfc h PHE 12 Cb 0.39 -0.08 -0.04 0.00 2.20 0.00 0.00 35.95 38.41 1cfc h PHE 12 CO -0.16 0.78 0.40 -0.22 -0.60 0.00 0.00 178.31 178.51 1cfc h LYS 13 N 0.28 1.23 0.30 1.51 3.64 0.25 0.43 116.57 124.21 1cfc h LYS 13 Ca 0.01 -0.19 -0.01 0.00 -1.27 0.00 0.00 60.65 59.19 1cfc h LYS 13 Cb 0.98 -0.22 0.00 0.00 -0.41 0.00 0.00 32.23 32.58 1cfc h LYS 13 CO 0.08 0.95 -0.15 0.93 -2.27 0.00 0.00 179.45 178.99 1cfc h GLU 14 N 1.21 -0.39 -0.27 1.90 4.39 -0.85 0.59 114.58 121.15 1cfc h GLU 14 Ca 0.29 0.03 0.06 0.00 0.34 0.00 0.00 59.36 60.07 1cfc h GLU 14 Cb 0.13 0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 28.86 1cfc h GLU 14 CO -0.03 -0.08 0.19 0.00 -1.16 0.00 0.00 179.01 177.93 1cfc h ALA 15 N -0.17 2.12 0.03 3.43 0.00 -1.23 -0.68 119.26 122.76 1cfc h ALA 15 Ca -0.04 -0.01 -0.18 0.00 0.00 0.00 0.00 54.91 54.68 1cfc h ALA 15 Cb 0.49 -0.02 0.02 0.00 0.00 0.00 0.00 17.79 18.28 1cfc h ALA 15 CO 0.07 -0.18 -0.72 0.35 0.00 0.00 0.00 179.25 178.77 1cfc h PHE 16 N 0.11 0.67 0.00 0.00 3.57 0.11 -3.24 116.94 118.16 1cfc h PHE 16 Ca 0.12 -0.38 -0.01 0.00 3.53 0.00 0.00 57.97 61.23 1cfc h PHE 16 Cb 0.36 -0.07 -0.00 0.00 2.79 0.00 0.00 35.95 39.03 1cfc h PHE 16 CO -0.00 1.22 -0.07 0.77 -2.23 0.00 0.00 178.31 178.00 1cfc h SER 17 N -0.08 0.00 0.01 0.41 0.02 -0.27 -2.77 113.55 110.87 1cfc h SER 17 Ca -0.10 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 60.85 1cfc h SER 17 Cb 1.44 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.98 1cfc h SER 17 CO 0.14 0.07 -0.00 -0.07 -1.14 0.00 0.00 176.83 175.83 1cfc h LEU 18 N 0.00 0.00 -2.93 5.07 3.38 -1.16 -1.98 115.31 117.68 1cfc h LEU 18 Ca -0.00 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 1cfc h LEU 18 Cb 0.58 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.31 1cfc h LEU 18 CO 0.01 0.00 -0.26 0.49 0.09 0.00 0.00 178.44 178.77 1cfc n PHE 19 N -3.17 0.00 -2.92 1.13 3.01 -1.05 -4.85 117.46 109.61 1cfc n PHE 19 Ca -0.03 -1.08 -0.43 0.00 1.01 0.00 0.00 57.45 56.92 1cfc n PHE 19 Cb 0.07 -0.18 0.01 0.00 -0.01 0.00 0.00 39.48 39.38 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 6.64 0.00 4.37 2.03 -0.75 -4.66 116.55 123.04 1cfc n ASP 20 Ca 0.15 -3.48 0.08 0.00 0.52 0.00 0.00 54.79 52.07 1cfc n ASP 20 Cb 0.69 -1.25 0.48 0.00 -0.72 0.00 0.00 41.12 40.31 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 1.02 0.42 -0.07 -0.67 4.76 -1.26 -2.10 118.16 120.26 1cfc n LYS 21 Ca 0.30 0.05 0.12 0.00 -2.87 0.00 0.00 58.31 55.92 1cfc n LYS 21 Cb 0.32 -1.50 0.15 0.00 -1.84 0.00 0.00 35.03 32.16 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 -1.11 3.14 -1.10 4.39 8.00 -1.26 -4.91 116.55 123.70 1cfc n ASP 22 Ca 0.11 -1.99 -0.07 0.00 0.71 0.00 0.00 54.79 53.55 1cfc n ASP 22 Cb 0.09 -0.09 -0.03 0.00 -0.02 0.00 0.00 41.12 41.06 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 1.41 0.70 0.96 0.44 0.00 -0.89 -4.67 105.19 103.13 1cfc n GLY 23 Ca 0.16 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.30 1cfc n GLY 23 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1cfc n ASP 24 N 0.21 2.99 -0.36 1.61 2.03 -1.26 -4.94 116.55 116.83 1cfc n ASP 24 Ca -0.07 -1.99 -0.03 0.00 0.52 0.00 0.00 54.79 53.21 1cfc n ASP 24 Cb 0.26 -0.00 -0.00 0.00 -0.72 0.00 0.00 41.12 40.66 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 0.28 3.16 0.27 0.00 -1.26 -5.04 105.19 103.96 1cfc n GLY 25 Ca 0.14 -0.77 -0.10 0.00 0.00 0.00 0.00 46.02 45.29 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 -2.16 0.10 0.09 2.61 -4.23 -1.26 -3.39 115.64 107.39 1cfc s THR 26 Ca 0.00 -1.93 -0.01 0.00 -1.18 0.00 0.00 61.69 58.56 1cfc s THR 26 Cb 0.00 -2.16 -0.04 0.00 1.34 0.00 0.00 72.50 71.64 1cfc s THR 26 CO 0.00 -0.35 0.02 0.27 -0.54 0.00 0.00 174.62 174.01 1cfc s ILE 27 N -4.06 0.16 0.57 2.99 -4.36 -0.26 -4.39 121.20 111.86 1cfc s ILE 27 Ca 0.28 -1.84 -0.03 0.00 -0.26 0.00 0.00 60.65 58.80 1cfc s ILE 27 Cb 0.07 -1.75 0.03 0.00 1.25 0.00 0.00 42.46 42.06 1cfc s ILE 27 CO 0.04 -0.75 0.84 0.42 0.24 0.00 0.00 174.94 175.73 1cfc s THR 28 N -3.98 3.12 0.27 8.37 -4.23 -1.26 -0.74 115.64 117.19 1cfc s THR 28 Ca 0.15 -0.37 0.03 0.00 -1.18 0.00 0.00 61.69 60.32 1cfc s THR 28 Cb 0.08 -3.22 0.03 0.00 1.34 0.00 0.00 72.50 70.73 1cfc s THR 28 CO -0.05 -0.19 1.67 0.71 -0.54 0.00 0.00 174.62 176.22 1cfc h THR 29 N -0.07 1.30 -0.14 3.99 1.35 -1.88 -2.52 112.91 114.95 1cfc h THR 29 Ca -0.44 -1.48 0.04 0.00 -0.55 0.00 0.00 66.41 63.98 1cfc h THR 29 Cb 1.28 1.56 -0.01 0.00 -1.73 0.00 0.00 68.15 69.26 1cfc h THR 29 CO 0.57 0.45 0.12 0.11 -0.25 0.00 0.00 175.52 176.53 1cfc h LYS 30 N 0.34 0.00 -0.44 4.72 1.57 -1.94 0.11 116.57 120.93 1cfc h LYS 30 Ca 0.04 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.82 1cfc h LYS 30 Cb 0.81 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.12 1cfc h LYS 30 CO 0.07 0.00 0.00 0.39 -0.57 0.00 0.00 179.45 179.34 1cfc n GLU 31 N -4.07 2.56 -0.00 3.15 1.02 -0.96 -4.43 120.64 117.90 1cfc n GLU 31 Ca 0.00 -2.36 -0.13 0.00 -0.02 0.00 0.00 57.16 54.66 1cfc n GLU 31 Cb 0.24 -1.53 -0.09 0.00 -0.02 0.00 0.00 31.44 30.04 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 4.50 0.02 -2.01 -4.62 5.85 -0.60 -1.98 115.31 116.46 1cfc h LEU 32 Ca 0.00 -0.38 -0.02 0.00 0.84 0.00 0.00 57.88 58.32 1cfc h LEU 32 Cb 1.00 -0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.02 1cfc h LEU 32 CO 0.00 0.39 -0.10 1.23 -0.34 0.00 0.00 178.44 179.63 1cfc h GLY 33 N -0.36 0.00 0.95 3.75 0.00 -1.77 -2.24 103.07 103.40 1cfc h GLY 33 Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 47.33 47.16 1cfc h GLY 33 CO 0.00 0.00 -0.60 -0.84 0.00 0.00 0.00 176.54 175.10 1cfc h THR 34 N 0.00 1.35 -0.10 4.70 2.02 -1.73 -1.87 112.91 117.28 1cfc h THR 34 Ca -0.00 -1.91 -0.01 0.00 0.77 0.00 0.00 66.41 65.26 1cfc h THR 34 Cb 0.29 2.20 -0.00 0.00 -1.74 0.00 0.00 68.15 68.89 1cfc h THR 34 CO 0.01 0.58 0.02 0.58 0.37 0.00 0.00 175.52 177.09 1cfc h VAL 35 N 0.21 1.19 -0.78 3.16 2.07 -0.94 -1.62 116.25 119.54 1cfc h VAL 35 Ca -0.05 -0.59 0.07 0.00 0.82 0.00 0.00 66.70 66.95 1cfc h VAL 35 Cb 1.25 1.41 -0.05 0.00 -1.52 0.00 0.00 31.29 32.38 1cfc h VAL 35 CO 0.12 0.17 0.51 0.24 0.02 0.00 0.00 177.57 178.63 1cfc h MET 36 N -0.05 0.80 -0.07 1.57 2.86 -1.47 -0.10 114.93 118.48 1cfc h MET 36 Ca 0.03 -0.05 -0.09 0.00 -2.06 0.00 0.00 59.70 57.53 1cfc h MET 36 Cb 0.25 -0.18 -0.01 0.00 0.06 0.00 0.00 31.60 31.71 1cfc h MET 36 CO 0.00 0.53 -0.37 0.00 1.06 0.00 0.00 176.91 178.13 1cfc h ARG 37 N 0.82 0.13 0.00 1.72 3.08 -0.89 -2.18 114.38 117.06 1cfc h ARG 37 Ca 0.34 -0.06 -0.03 0.00 0.07 0.00 0.00 59.98 60.30 1cfc h ARG 37 Cb 0.26 -0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.30 1cfc h ARG 37 CO -0.12 0.49 -0.16 0.66 -1.07 0.00 0.00 179.97 179.78 1cfc h SER 38 N 0.11 0.00 -0.01 7.04 4.64 -0.04 -0.09 113.55 125.20 1cfc h SER 38 Ca 0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.33 1cfc h SER 38 Cb 0.72 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.81 1cfc h SER 38 CO 0.05 0.16 0.00 0.18 -0.87 0.00 0.00 176.83 176.35 1cfc n LEU 39 N -4.35 0.55 0.00 5.97 4.77 -0.89 -4.87 117.00 118.18 1cfc n LEU 39 Ca -0.03 -0.19 0.00 0.00 -0.03 0.00 0.00 56.01 55.77 1cfc n LEU 39 Cb 0.22 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.31 1cfc n LEU 39 CO 0.36 0.09 0.00 0.61 -1.33 0.00 0.00 177.39 177.12 1cfc n GLY 40 N 1.04 0.70 3.91 -0.72 0.00 -0.05 -5.07 105.19 105.01 1cfc n GLY 40 Ca 0.21 -0.37 -0.32 0.00 0.00 0.00 0.00 46.02 45.54 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 -0.85 3.44 -0.46 1.61 -0.21 -0.87 -5.01 119.66 117.32 1cfc s GLN 41 Ca 0.00 -0.39 0.07 0.00 0.02 0.00 0.00 55.36 55.05 1cfc s GLN 41 Cb 0.00 -3.06 0.23 0.00 1.00 0.00 0.00 33.01 31.18 1cfc s GLN 41 CO 0.00 0.63 0.51 -1.71 -2.12 0.00 0.00 175.29 172.61 1cfc n ASN 42 N 0.53 0.78 -4.78 5.90 2.85 -1.26 -3.72 115.26 115.55 1cfc n ASN 42 Ca -0.07 -2.77 -0.37 0.00 -0.11 0.00 0.00 54.58 51.26 1cfc n ASN 42 Cb 0.52 -0.63 -0.03 0.00 1.24 0.00 0.00 39.78 40.87 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 -1.12 4.10 1.07 1.20 0.04 -1.26 -5.03 135.00 134.00 1cfc s PRO 43 Ca 0.35 1.58 -0.15 0.00 0.04 0.00 0.00 61.00 62.81 1cfc s PRO 43 Cb 0.12 -2.53 0.22 0.00 0.04 0.00 0.00 34.50 32.35 1cfc s PRO 43 CO -0.12 -0.21 1.12 0.95 0.04 0.00 0.00 177.00 178.78 1cfc s THR 44 N -1.62 1.85 0.38 1.26 -4.23 -1.26 -4.81 115.64 107.20 1cfc s THR 44 Ca 0.59 0.00 0.09 0.00 -1.18 0.00 0.00 61.69 61.18 1cfc s THR 44 Cb -0.24 -2.56 0.15 0.00 1.34 0.00 0.00 72.50 71.19 1cfc s THR 44 CO 0.29 0.00 1.90 -0.33 -0.54 0.00 0.00 174.62 175.94 1cfc h GLU 45 N -2.10 0.26 -0.22 3.99 5.08 -1.99 -2.40 114.58 117.20 1cfc h GLU 45 Ca -0.50 -0.06 -0.18 0.00 -1.00 0.00 0.00 59.36 57.62 1cfc h GLU 45 Cb 1.31 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 30.53 1cfc h GLU 45 CO 0.48 0.40 -0.57 0.00 -1.00 0.00 0.00 179.01 178.32 1cfc h ALA 46 N 1.62 0.58 -0.78 3.43 0.00 -1.97 0.16 119.26 122.29 1cfc h ALA 46 Ca 0.05 -0.52 -0.01 0.00 0.00 0.00 0.00 54.91 54.43 1cfc h ALA 46 Cb 0.39 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.07 1cfc h ALA 46 CO 0.02 0.69 0.46 0.93 0.00 0.00 0.00 179.25 181.35 1cfc h GLU 47 N 0.53 1.05 -0.02 0.00 3.07 -1.79 0.57 114.58 118.00 1cfc h GLU 47 Ca 0.01 -0.10 -0.03 0.00 -0.50 0.00 0.00 59.36 58.74 1cfc h GLU 47 Cb 1.15 -0.22 0.00 0.00 -0.84 0.00 0.00 28.75 28.84 1cfc h GLU 47 CO 0.12 0.74 -0.10 -0.07 -1.40 0.00 0.00 179.01 178.30 1cfc h LEU 48 N 1.07 0.12 -2.24 1.33 3.38 -1.16 -3.08 115.31 114.74 1cfc h LEU 48 Ca 0.28 -0.67 -0.01 0.00 0.09 0.00 0.00 57.88 57.56 1cfc h LEU 48 Cb -0.03 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 40.68 1cfc h LEU 48 CO -0.05 0.78 -0.05 1.56 0.09 0.00 0.00 178.44 180.77 1cfc h GLN 49 N -0.52 0.00 -0.02 1.13 1.08 -0.41 -1.46 115.11 114.91 1cfc h GLN 49 Ca -0.01 0.00 -0.07 0.00 -1.45 0.00 0.00 58.65 57.13 1cfc h GLN 49 Cb 0.78 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.21 1cfc h GLN 49 CO 0.02 0.05 -0.25 0.22 -0.95 0.00 0.00 178.83 177.92 1cfc h ASP 50 N 0.00 0.25 0.04 1.46 3.58 -0.88 -2.24 116.42 118.63 1cfc h ASP 50 Ca -0.00 -0.72 -0.10 0.00 0.42 0.00 0.00 57.03 56.63 1cfc h ASP 50 Cb 0.22 -0.08 -0.01 0.00 1.72 0.00 0.00 39.33 41.18 1cfc h ASP 50 CO 0.01 0.94 -0.30 0.24 -2.88 0.00 0.00 179.24 177.25 1cfc h MET 51 N -0.41 0.39 -0.44 0.28 2.86 -1.40 -2.80 114.93 113.41 1cfc h MET 51 Ca -0.03 -0.16 -0.02 0.00 -2.06 0.00 0.00 59.70 57.44 1cfc h MET 51 Cb 0.96 -0.02 -0.02 0.00 0.06 0.00 0.00 31.60 32.58 1cfc h MET 51 CO 0.05 0.66 0.19 0.82 1.06 0.00 0.00 176.91 179.69 1cfc h ILE 52 N 0.34 1.19 -0.70 -1.22 2.04 -1.28 -1.52 117.51 116.37 1cfc h ILE 52 Ca 0.05 -0.57 0.20 0.00 1.00 0.00 0.00 64.86 65.53 1cfc h ILE 52 Cb 0.71 0.76 -0.03 0.00 -0.74 0.00 0.00 36.82 37.51 1cfc h ILE 52 CO 0.05 0.22 0.50 -1.13 0.00 0.00 0.00 178.15 177.79 1cfc h ASN 53 N 0.57 0.04 0.00 1.72 -0.00 -1.12 0.75 115.58 117.54 1cfc h ASN 53 Ca 0.15 0.00 -0.00 0.00 -0.00 0.00 0.00 56.30 56.45 1cfc h ASN 53 Cb 0.16 -0.00 -0.00 0.00 -0.00 0.00 0.00 38.32 38.47 1cfc h ASN 53 CO -0.02 0.02 -0.02 -0.33 -0.00 0.00 0.00 177.43 177.08 1cfc h GLU 54 N 0.04 0.00 0.00 6.67 5.08 -1.30 -3.34 114.58 121.73 1cfc h GLU 54 Ca 0.33 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.68 1cfc h GLU 54 Cb 1.27 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.52 1cfc h GLU 54 CO -0.02 0.08 -0.05 0.28 -1.00 0.00 0.00 179.01 178.30 1cfc h VAL 55 N -1.00 0.90 0.00 3.13 2.07 -0.95 -1.94 116.25 118.46 1cfc h VAL 55 Ca -0.00 -0.18 0.00 0.00 0.82 0.00 0.00 66.70 67.34 1cfc h VAL 55 Cb 0.10 1.10 0.00 0.00 -1.52 0.00 0.00 31.29 30.97 1cfc h VAL 55 CO -0.00 0.05 0.00 -0.67 0.02 0.00 0.00 177.57 176.97 1cfc n ASP 56 N -4.28 5.05 0.21 0.57 2.03 0.26 -3.95 116.55 116.43 1cfc n ASP 56 Ca -0.03 -2.35 0.11 0.00 0.52 0.00 0.00 54.79 53.04 1cfc n ASP 56 Cb 0.13 -1.05 0.15 0.00 -0.72 0.00 0.00 41.12 39.64 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 1.13 0.96 0.00 -1.67 0.00 -1.52 -3.04 119.26 115.13 1cfc h ALA 57 Ca 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1cfc h ALA 57 Cb 0.99 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.77 1cfc h ALA 57 CO 0.00 0.06 0.00 0.22 0.00 0.00 0.00 179.25 179.53 1cfc h ASP 58 N 0.00 0.00 -0.92 0.00 1.82 -1.86 -3.47 116.42 111.99 1cfc h ASP 58 Ca -0.00 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.64 1cfc h ASP 58 Cb 1.04 0.00 0.00 0.00 0.68 0.00 0.00 39.33 41.05 1cfc h ASP 58 CO 0.01 0.00 0.00 0.61 -1.61 0.00 0.00 179.24 178.25 1cfc n GLY 59 N 1.15 0.87 0.00 -0.78 0.00 -1.15 -5.02 105.19 100.26 1cfc n GLY 59 Ca 0.04 -0.50 0.00 0.00 0.00 0.00 0.00 46.02 45.57 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 0.80 0.00 0.00 1.61 4.13 -1.26 -5.12 115.26 115.42 1cfc n ASN 60 Ca 0.00 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.26 1cfc n ASN 60 Cb 0.39 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.63 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 2.06 -0.14 3.12 7.41 0.00 -1.26 -5.08 105.19 111.31 1cfc n GLY 61 Ca 0.00 0.01 -0.08 0.00 0.00 0.00 0.00 46.02 45.94 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 0.17 -0.01 2.61 -4.23 -1.26 -3.00 115.64 109.92 1cfc s THR 62 Ca 0.00 -1.82 -0.00 0.00 -1.18 0.00 0.00 61.69 58.69 1cfc s THR 62 Cb 0.00 -1.72 0.01 0.00 1.34 0.00 0.00 72.50 72.14 1cfc s THR 62 CO 0.00 -0.78 0.02 -0.63 -0.54 0.00 0.00 174.62 172.69 1cfc s ILE 63 N -3.97 -0.02 0.34 2.99 1.01 0.08 -4.88 121.20 116.74 1cfc s ILE 63 Ca 0.14 0.09 0.07 0.00 0.00 0.00 0.00 60.65 60.94 1cfc s ILE 63 Cb 0.08 -0.05 -0.01 0.00 0.01 0.00 0.00 42.46 42.49 1cfc s ILE 63 CO -0.05 0.04 0.46 1.51 0.00 0.00 0.00 174.94 176.89 1cfc s ASP 64 N 0.44 5.90 0.17 3.58 1.47 -1.26 -1.10 116.67 125.88 1cfc s ASP 64 Ca -0.04 -0.23 -0.14 0.00 1.18 0.00 0.00 52.55 53.33 1cfc s ASP 64 Cb -0.05 -1.18 0.07 0.00 -0.34 0.00 0.00 42.92 41.42 1cfc s ASP 64 CO -0.01 -0.44 1.82 0.15 0.68 0.00 0.00 175.17 177.36 1cfc h PHE 65 N 0.91 0.70 -0.38 2.11 3.57 -1.96 -1.09 116.94 120.80 1cfc h PHE 65 Ca -0.45 0.01 0.07 0.00 3.53 0.00 0.00 57.97 61.13 1cfc h PHE 65 Cb 1.26 -0.23 -0.07 0.00 2.79 0.00 0.00 35.95 39.70 1cfc h PHE 65 CO 0.43 0.47 -0.04 -1.35 -2.23 0.00 0.00 178.31 175.59 1cfc h PRO 66 N 0.74 0.05 -0.15 6.41 0.11 -1.96 0.14 132.00 137.33 1cfc h PRO 66 Ca 0.20 -0.00 -0.06 0.00 0.11 0.00 0.00 66.00 66.24 1cfc h PRO 66 Cb -0.04 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 31.04 1cfc h PRO 66 CO -0.04 0.03 -0.19 0.93 -0.21 0.00 0.00 178.00 178.53 1cfc h GLU 67 N 0.05 0.26 -0.54 1.05 5.08 -1.92 -1.86 114.58 116.70 1cfc h GLU 67 Ca 0.19 -0.07 -0.05 0.00 -1.00 0.00 0.00 59.36 58.43 1cfc h GLU 67 Cb 0.27 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.47 1cfc h GLU 67 CO -0.35 0.44 0.13 0.35 -1.00 0.00 0.00 179.01 178.58 1cfc h PHE 68 N 0.24 0.85 0.00 4.33 3.57 0.50 -0.57 116.94 125.85 1cfc h PHE 68 Ca 0.04 -0.08 -0.05 0.00 3.53 0.00 0.00 57.97 61.42 1cfc h PHE 68 Cb 0.47 -0.25 -0.01 0.00 2.79 0.00 0.00 35.95 38.96 1cfc h PHE 68 CO 0.01 0.71 -0.23 -0.07 -2.23 0.00 0.00 178.31 176.50 1cfc h LEU 69 N 0.79 0.00 -0.52 0.59 3.38 -0.13 -1.93 115.31 117.49 1cfc h LEU 69 Ca 0.17 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.11 1cfc h LEU 69 Cb 0.29 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.04 1cfc h LEU 69 CO -0.00 0.23 -0.15 0.74 0.09 0.00 0.00 178.44 179.34 1cfc h THR 70 N 0.00 0.30 0.00 0.22 2.02 -0.72 -2.10 112.91 112.63 1cfc h THR 70 Ca -0.00 -1.19 -0.01 0.00 0.77 0.00 0.00 66.41 65.98 1cfc h THR 70 Cb 0.59 1.95 0.00 0.00 -1.74 0.00 0.00 68.15 68.94 1cfc h THR 70 CO 0.03 0.15 -0.04 0.24 0.37 0.00 0.00 175.52 176.27 1cfc h MET 71 N 0.00 0.02 -0.21 6.66 2.86 -0.80 -2.86 114.93 120.60 1cfc h MET 71 Ca -0.00 -0.02 -0.06 0.00 -2.06 0.00 0.00 59.70 57.56 1cfc h MET 71 Cb 0.93 0.01 -0.01 0.00 0.06 0.00 0.00 31.60 32.59 1cfc h MET 71 CO 0.02 0.92 -0.12 0.52 1.06 0.00 0.00 176.91 179.31 1cfc h MET 72 N -0.87 0.34 -0.11 1.72 2.07 -1.53 -2.25 114.93 114.31 1cfc h MET 72 Ca -0.01 -0.08 -0.11 0.00 -2.07 0.00 0.00 59.70 57.43 1cfc h MET 72 Cb 0.93 -0.04 -0.01 0.00 -1.87 0.00 0.00 31.60 30.60 1cfc h MET 72 CO 0.01 0.47 -0.41 0.00 1.07 0.00 0.00 176.91 178.04 1cfc h ALA 73 N 1.56 1.12 0.00 6.32 0.00 -1.44 0.46 119.26 127.28 1cfc h ALA 73 Ca 0.06 -0.41 -0.08 0.00 0.00 0.00 0.00 54.91 54.49 1cfc h ALA 73 Cb 0.41 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 1cfc h ALA 73 CO 0.02 0.59 -0.37 0.00 0.00 0.00 0.00 179.25 179.48 1cfc h ARG 74 N 0.20 0.00 0.00 0.00 2.47 -1.16 -3.26 114.38 112.63 1cfc h ARG 74 Ca 0.02 0.00 -0.05 0.00 -1.26 0.00 0.00 59.98 58.68 1cfc h ARG 74 Cb 0.81 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 29.12 1cfc h ARG 74 CO 0.06 0.37 -0.41 0.87 0.56 0.00 0.00 179.97 181.43 1cfc h LYS 75 N 0.00 0.00 -4.71 0.04 1.79 -1.23 -3.42 116.57 109.04 1cfc h LYS 75 Ca -0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1cfc h LYS 75 Cb 0.68 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.33 1cfc h LYS 75 CO 0.05 0.49 0.50 -1.33 -1.08 0.00 0.00 179.45 178.07 1cfc n MET 76 N -4.62 0.00 0.00 3.15 2.81 0.11 -3.09 117.12 115.48 1cfc n MET 76 Ca -0.12 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.77 1cfc n MET 76 Cb 0.34 -0.94 0.00 0.00 -0.71 0.00 0.00 33.22 31.91 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 3.35 0.00 0.16 0.03 5.02 -1.26 -4.81 118.16 120.66 1cfc n LYS 77 Ca 0.00 0.00 0.03 0.00 -2.02 0.00 0.00 58.31 56.32 1cfc n LYS 77 Cb 0.25 0.00 0.18 0.00 -0.02 0.00 0.00 35.03 35.44 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 0.17 -2.45 4.39 2.03 -1.18 0.38 116.55 119.89 1cfc n ASP 78 Ca 0.00 0.40 -0.20 0.00 0.52 0.00 0.00 54.79 55.52 1cfc n ASP 78 Cb 0.00 -0.25 0.02 0.00 -0.72 0.00 0.00 41.12 40.16 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 -1.90 2.01 -0.80 5.18 5.66 -1.26 -5.07 114.28 118.10 1cfc n THR 79 Ca -0.00 -4.17 -0.34 0.00 -3.05 0.00 0.00 64.05 56.48 1cfc n THR 79 Cb 0.53 -0.57 0.12 0.00 -1.55 0.00 0.00 70.33 68.86 1cfc n THR 79 CO 0.00 0.00 0.00 0.47 -3.05 0.00 0.00 175.07 172.49 1cfc n ASP 80 N -0.46 -2.78 0.18 1.09 9.92 0.16 -4.83 116.55 119.83 1cfc n ASP 80 Ca 0.31 -0.01 0.12 0.00 -0.53 0.00 0.00 54.79 54.67 1cfc n ASP 80 Cb 0.78 -0.85 0.13 0.00 -0.64 0.00 0.00 41.12 40.54 1cfc n ASP 80 CO 0.00 0.00 0.00 -1.28 0.13 0.00 0.00 177.20 176.05 1cfc h SER 81 N -1.65 0.00 -0.26 -2.24 0.87 -1.95 -3.24 113.55 105.08 1cfc h SER 81 Ca -0.48 -0.00 -0.05 0.00 -1.23 0.00 0.00 61.79 60.02 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 -0.05 -0.33 -0.53 0.00 0.00 176.83 176.24 1cfc h GLU 82 N 0.00 0.49 0.00 2.24 5.08 -1.98 -2.44 114.58 117.97 1cfc h GLU 82 Ca 0.00 -0.18 0.00 0.00 -1.00 0.00 0.00 59.36 58.18 1cfc h GLU 82 Cb 0.99 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.21 1cfc h GLU 82 CO 0.00 0.70 0.00 0.93 -1.00 0.00 0.00 179.01 179.64 1cfc h GLU 83 N 0.24 0.00 -0.03 2.33 5.08 -1.90 -2.08 114.58 118.22 1cfc h GLU 83 Ca 0.07 0.00 -0.13 0.00 -1.00 0.00 0.00 59.36 58.30 1cfc h GLU 83 Cb 0.51 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.77 1cfc h GLU 83 CO 0.02 0.00 -0.48 0.93 -1.00 0.00 0.00 179.01 178.48 1cfc h GLU 84 N 0.00 0.39 -0.32 2.33 5.08 -1.50 -1.06 114.58 119.50 1cfc h GLU 84 Ca 0.00 -0.37 -0.17 0.00 -1.00 0.00 0.00 59.36 57.81 1cfc h GLU 84 Cb 0.32 0.09 -0.00 0.00 0.50 0.00 0.00 28.75 29.66 1cfc h GLU 84 CO 0.00 1.03 -0.49 0.82 -1.00 0.00 0.00 179.01 179.38 1cfc h ILE 85 N -0.12 1.27 0.10 3.13 2.04 -1.24 -2.75 117.51 119.95 1cfc h ILE 85 Ca -0.05 -1.67 -0.01 0.00 1.00 0.00 0.00 64.86 64.14 1cfc h ILE 85 Cb 1.17 1.54 0.00 0.00 -0.74 0.00 0.00 36.82 38.79 1cfc h ILE 85 CO 0.10 0.55 -0.05 -0.09 0.00 0.00 0.00 178.15 178.66 1cfc h ARG 86 N 0.69 -0.13 -0.17 2.37 2.43 -1.44 -0.64 114.38 117.49 1cfc h ARG 86 Ca 0.03 0.01 0.05 0.00 -0.81 0.00 0.00 59.98 59.26 1cfc h ARG 86 Cb 1.08 0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.66 1cfc h ARG 86 CO 0.11 0.19 0.24 0.93 -1.51 0.00 0.00 179.97 179.93 1cfc h GLU 87 N -0.46 0.00 0.05 0.20 5.08 -1.22 0.46 114.58 118.69 1cfc h GLU 87 Ca -0.01 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.26 1cfc h GLU 87 Cb 0.38 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.64 1cfc h GLU 87 CO 0.02 0.00 -0.36 0.00 -1.00 0.00 0.00 179.01 177.67 1cfc h ALA 88 N 1.67 -0.02 -0.06 3.43 0.00 -1.13 -2.43 119.26 120.72 1cfc h ALA 88 Ca 0.08 -0.56 0.02 0.00 0.00 0.00 0.00 54.91 54.44 1cfc h ALA 88 Cb 0.57 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.40 1cfc h ALA 88 CO -0.00 0.16 0.07 0.74 0.00 0.00 0.00 179.25 180.22 1cfc h PHE 89 N -0.64 0.00 -0.17 0.00 0.04 0.68 0.96 116.94 117.81 1cfc h PHE 89 Ca -0.06 0.00 -0.06 0.00 2.80 0.00 0.00 57.97 60.66 1cfc h PHE 89 Cb 1.24 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 39.39 1cfc h PHE 89 CO 0.23 0.00 -0.11 -0.09 -0.60 0.00 0.00 178.31 177.73 1cfc h ARG 90 N 0.00 0.37 0.00 1.51 2.43 -0.01 -1.43 114.38 117.25 1cfc h ARG 90 Ca 0.03 -0.18 0.00 0.00 -0.81 0.00 0.00 59.98 59.02 1cfc h ARG 90 Cb 0.17 -0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.71 1cfc h ARG 90 CO -0.00 0.71 0.34 0.28 -1.51 0.00 0.00 179.97 179.78 1cfc h VAL 91 N 0.04 0.00 0.00 0.20 2.07 -0.32 0.33 116.25 118.56 1cfc h VAL 91 Ca 0.03 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.55 1cfc h VAL 91 Cb 0.61 0.59 0.00 0.00 -1.52 0.00 0.00 31.29 30.97 1cfc h VAL 91 CO 0.03 0.00 -1.08 0.49 0.02 0.00 0.00 177.57 177.03 1cfc n PHE 92 N -2.73 0.00 -2.25 1.57 3.01 -0.60 -4.55 117.46 111.90 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 0.38 -0.05 0.00 0.00 -0.01 0.00 0.00 39.48 39.80 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 -1.57 5.86 0.32 4.37 2.03 0.11 -4.74 116.55 122.93 1cfc n ASP 93 Ca 0.03 -3.12 0.18 0.00 0.52 0.00 0.00 54.79 52.40 1cfc n ASP 93 Cb 0.35 -1.45 0.97 0.00 -0.72 0.00 0.00 41.12 40.27 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 5.45 0.00 -0.65 -0.67 1.57 -1.80 0.13 116.57 120.59 1cfc h LYS 94 Ca 0.47 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.25 1cfc h LYS 94 Cb 0.55 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.86 1cfc h LYS 94 CO 1.59 0.00 0.00 -0.25 -0.57 0.00 0.00 179.45 180.22 1cfc n ASP 95 N -2.90 3.78 -3.13 0.86 8.00 -1.26 -4.92 116.55 116.97 1cfc n ASP 95 Ca -0.02 -2.00 -0.19 0.00 0.71 0.00 0.00 54.79 53.29 1cfc n ASP 95 Cb 0.23 -0.43 -0.01 0.00 -0.02 0.00 0.00 41.12 40.88 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 1.62 -0.48 0.13 0.44 0.00 0.45 -4.80 105.19 102.55 1cfc n GLY 96 Ca 0.23 0.06 -0.23 0.00 0.00 0.00 0.00 46.02 46.08 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 -2.09 1.97 0.00 1.61 5.15 -1.26 -5.02 115.26 115.63 1cfc n ASN 97 Ca -0.03 0.07 0.00 0.00 -0.60 0.00 0.00 54.58 54.02 1cfc n ASN 97 Cb 0.54 -0.59 0.00 0.00 -0.53 0.00 0.00 39.78 39.20 1cfc n ASN 97 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1cfc n GLY 98 N 1.85 0.96 3.13 8.20 0.00 -1.26 -5.11 105.19 112.97 1cfc n GLY 98 Ca -0.49 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.32 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 1.25 0.14 1.61 1.51 -1.26 -4.30 117.35 114.30 1cfc s TYR 99 Ca 0.00 -0.31 -0.01 0.00 -1.01 0.00 0.00 57.07 55.74 1cfc s TYR 99 Cb 0.00 -0.77 -0.04 0.00 -0.11 0.00 0.00 41.96 41.05 1cfc s TYR 99 CO 0.00 0.02 0.08 0.96 -1.11 0.00 0.00 175.55 175.50 1cfc s ILE 100 N -0.65 0.08 0.25 2.71 -4.36 -1.19 -4.90 121.20 113.15 1cfc s ILE 100 Ca 0.03 -1.90 -0.30 0.00 -0.26 0.00 0.00 60.65 58.23 1cfc s ILE 100 Cb -0.07 -2.11 -0.09 0.00 1.25 0.00 0.00 42.46 41.44 1cfc s ILE 100 CO 0.01 -0.38 1.02 -0.94 0.24 0.00 0.00 174.94 174.89 1cfc s SER 101 N -3.06 7.46 0.56 4.36 1.04 -1.26 -2.17 113.70 120.62 1cfc s SER 101 Ca 0.26 2.10 0.50 0.00 0.48 0.00 0.00 55.95 59.29 1cfc s SER 101 Cb 0.07 -2.62 1.72 0.00 0.10 0.00 0.00 66.02 65.30 1cfc s SER 101 CO 0.03 0.00 1.56 0.00 0.98 0.00 0.00 173.24 175.81 1cfc n ALA 102 N 1.42 1.89 0.35 5.32 0.00 -1.26 0.13 120.51 128.36 1cfc n ALA 102 Ca -0.01 0.65 -0.16 0.00 0.00 0.00 0.00 53.44 53.92 1cfc n ALA 102 Cb 0.46 -1.13 -0.08 0.00 0.00 0.00 0.00 19.45 18.70 1cfc n ALA 102 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1cfc h ALA 103 N 0.98 -0.90 -0.31 0.00 0.00 -1.93 0.16 119.26 117.26 1cfc h ALA 103 Ca 0.94 -0.22 0.09 0.00 0.00 0.00 0.00 54.91 55.72 1cfc h ALA 103 Cb 3.79 0.35 -0.01 0.00 0.00 0.00 0.00 17.79 21.91 1cfc h ALA 103 CO -0.01 -0.91 0.29 0.93 0.00 0.00 0.00 179.25 179.55 1cfc h GLU 104 N -1.09 0.00 0.04 0.00 5.08 -0.67 0.17 114.58 118.10 1cfc h GLU 104 Ca -0.09 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.27 1cfc h GLU 104 Cb 0.73 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.98 1cfc h GLU 104 CO 0.15 0.00 -0.02 1.25 -1.00 0.00 0.00 179.01 179.39 1cfc h LEU 105 N 0.00 -0.05 -1.44 1.33 5.85 -0.54 0.11 115.31 120.57 1cfc h LEU 105 Ca 0.15 -0.57 -0.02 0.00 0.84 0.00 0.00 57.88 58.28 1cfc h LEU 105 Cb 0.73 0.01 -0.02 0.00 0.37 0.00 0.00 40.66 41.75 1cfc h LEU 105 CO -0.00 0.57 0.18 -0.09 -0.34 0.00 0.00 178.44 178.77 1cfc h ARG 106 N -0.70 0.56 -0.40 1.25 2.43 0.40 -1.54 114.38 116.38 1cfc h ARG 106 Ca -0.01 -0.06 -0.07 0.00 -0.81 0.00 0.00 59.98 59.03 1cfc h ARG 106 Cb 0.61 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 30.04 1cfc h ARG 106 CO 0.01 0.44 -0.03 1.25 -1.51 0.00 0.00 179.97 180.13 1cfc h HIS 107 N 0.56 0.81 -0.99 2.20 2.76 -0.62 -1.83 115.15 118.05 1cfc h HIS 107 Ca 0.14 -0.15 0.07 0.00 -2.20 0.00 0.00 60.37 58.23 1cfc h HIS 107 Cb 0.08 -0.21 -0.07 0.00 1.55 0.00 0.00 27.41 28.76 1cfc h HIS 107 CO 0.00 0.83 0.64 0.28 -1.30 0.00 0.00 177.93 178.38 1cfc h VAL 108 N 0.56 1.06 0.00 5.26 2.07 0.21 0.13 116.25 125.53 1cfc h VAL 108 Ca 0.11 -0.38 -0.10 0.00 0.82 0.00 0.00 66.70 67.14 1cfc h VAL 108 Cb 0.53 -0.16 -0.01 0.00 -1.52 0.00 0.00 31.29 30.12 1cfc h VAL 108 CO 0.03 0.20 -0.48 0.24 0.02 0.00 0.00 177.57 177.58 1cfc h MET 109 N 1.12 0.00 0.14 1.57 2.86 -1.00 -2.64 114.93 116.98 1cfc h MET 109 Ca 0.43 0.00 -0.28 0.00 -2.06 0.00 0.00 59.70 57.79 1cfc h MET 109 Cb 0.22 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.89 1cfc h MET 109 CO -0.18 0.48 -1.41 1.15 1.06 0.00 0.00 176.91 178.01 1cfc h THR 110 N 0.00 1.08 0.00 2.22 2.02 -0.36 -3.33 112.91 114.53 1cfc h THR 110 Ca -0.00 -2.45 -0.04 0.00 0.77 0.00 0.00 66.41 64.68 1cfc h THR 110 Cb 0.94 2.79 -0.01 0.00 -1.74 0.00 0.00 68.15 70.13 1cfc h THR 110 CO 0.06 0.74 -0.20 0.78 0.37 0.00 0.00 175.52 177.28 1cfc h ASN 111 N -0.21 0.00 -0.00 4.18 -0.26 -0.86 -2.05 115.58 116.38 1cfc h ASN 111 Ca -0.29 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.45 1cfc h ASN 111 Cb 1.83 0.00 -0.00 0.00 -1.06 0.00 0.00 38.32 39.09 1cfc h ASN 111 CO 0.10 0.20 0.00 -0.07 -1.06 0.00 0.00 177.43 176.60 1cfc h LEU 112 N 0.00 0.00 -0.07 1.61 3.38 -1.58 -3.46 115.31 115.19 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 0.38 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.13 1cfc h LEU 112 CO 0.03 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.17 1cfc n GLY 113 N -1.42 0.96 3.76 0.83 0.00 -0.77 -5.05 105.19 103.50 1cfc n GLY 113 Ca -0.03 -0.56 -0.39 0.00 0.00 0.00 0.00 46.02 45.05 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 -2.95 4.75 -0.03 1.61 0.41 -1.25 -4.91 118.70 116.33 1cfc s GLU 114 Ca 0.00 1.43 -0.00 0.00 -0.41 0.00 0.00 54.97 55.99 1cfc s GLU 114 Cb 0.00 -3.09 0.02 0.00 -1.78 0.00 0.00 34.13 29.28 1cfc s GLU 114 CO 0.00 0.42 1.85 1.63 -0.49 0.00 0.00 175.26 178.67 1cfc n LYS 115 N 1.12 1.07 -3.09 1.61 5.02 -1.26 -4.85 118.16 117.78 1cfc n LYS 115 Ca -0.00 -0.14 -0.39 0.00 -2.02 0.00 0.00 58.31 55.75 1cfc n LYS 115 Cb 0.48 -1.05 -0.05 0.00 -0.02 0.00 0.00 35.03 34.38 1cfc n LYS 115 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1cfc s LEU 116 N -0.16 4.43 0.31 -0.35 1.43 -1.26 -5.05 118.68 118.04 1cfc s LEU 116 Ca 0.03 1.31 -0.20 0.00 -1.03 0.00 0.00 54.13 54.24 1cfc s LEU 116 Cb 0.02 -3.08 -0.09 0.00 0.03 0.00 0.00 46.19 43.06 1cfc s LEU 116 CO 0.00 0.06 0.82 0.42 0.23 0.00 0.00 176.35 177.88 1cfc s THR 117 N -0.12 4.48 0.60 5.49 -4.23 -1.26 -4.90 115.64 115.70 1cfc s THR 117 Ca 0.35 1.36 0.28 0.00 -1.18 0.00 0.00 61.69 62.50 1cfc s THR 117 Cb -0.19 -3.77 0.37 0.00 1.34 0.00 0.00 72.50 70.24 1cfc s THR 117 CO 0.20 -0.02 1.76 0.44 -0.54 0.00 0.00 174.62 176.46 1cfc h ASP 118 N 2.74 0.00 0.05 3.99 5.19 -2.00 0.12 116.42 126.52 1cfc h ASP 118 Ca -0.48 0.00 -0.00 0.00 -0.62 0.00 0.00 57.03 55.93 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 0.64 0.00 -0.03 -0.33 -3.12 0.00 0.00 179.24 176.41 1cfc h GLU 119 N 0.00 -0.07 -0.88 3.56 5.08 -2.00 -1.72 114.58 118.56 1cfc h GLU 119 Ca 0.24 0.00 0.23 0.00 -1.00 0.00 0.00 59.36 58.84 1cfc h GLU 119 Cb 1.50 0.02 -0.05 0.00 0.50 0.00 0.00 28.75 30.71 1cfc h GLU 119 CO -0.00 0.39 0.61 0.93 -1.00 0.00 0.00 179.01 179.94 1cfc h GLU 120 N -0.56 0.17 -0.17 2.33 5.08 -1.12 0.25 114.58 120.56 1cfc h GLU 120 Ca -0.01 -0.01 -0.21 0.00 -1.00 0.00 0.00 59.36 58.13 1cfc h GLU 120 Cb 0.50 -0.04 0.01 0.00 0.50 0.00 0.00 28.75 29.72 1cfc h GLU 120 CO 0.01 0.11 -0.72 0.28 -1.00 0.00 0.00 179.01 177.69 1cfc h VAL 121 N 0.18 1.28 -0.20 3.13 2.07 -1.23 -2.61 116.25 118.87 1cfc h VAL 121 Ca 0.44 -1.92 0.03 0.00 0.82 0.00 0.00 66.70 66.06 1cfc h VAL 121 Cb 1.44 1.96 -0.01 0.00 -1.52 0.00 0.00 31.29 33.16 1cfc h VAL 121 CO -0.09 0.61 0.14 0.44 0.02 0.00 0.00 177.57 178.69 1cfc h ASP 122 N 0.52 0.12 -0.05 0.57 3.32 0.41 0.33 116.42 121.63 1cfc h ASP 122 Ca -0.04 -0.00 -0.22 0.00 0.02 0.00 0.00 57.03 56.78 1cfc h ASP 122 Cb 1.35 -0.03 0.02 0.00 0.22 0.00 0.00 39.33 40.89 1cfc h ASP 122 CO 0.15 0.08 -0.83 -0.08 -1.72 0.00 0.00 179.24 176.84 1cfc h GLU 123 N 0.14 0.66 0.00 3.56 4.81 -1.26 -2.11 114.58 120.37 1cfc h GLU 123 Ca 0.08 -0.64 -0.06 0.00 -0.13 0.00 0.00 59.36 58.62 1cfc h GLU 123 Cb 0.17 0.16 -0.01 0.00 0.63 0.00 0.00 28.75 29.70 1cfc h GLU 123 CO -0.01 1.24 -0.30 0.52 -0.73 0.00 0.00 179.01 179.73 1cfc h MET 124 N 0.31 0.00 0.00 1.92 2.86 -0.78 -2.16 114.93 117.08 1cfc h MET 124 Ca -0.09 0.00 -0.14 0.00 -2.06 0.00 0.00 59.70 57.41 1cfc h MET 124 Cb 1.49 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 33.13 1cfc h MET 124 CO 0.17 0.30 -0.67 0.82 1.06 0.00 0.00 176.91 178.58 1cfc h ILE 125 N 0.00 1.30 0.01 -1.22 2.04 -0.31 -2.61 117.51 116.73 1cfc h ILE 125 Ca -0.00 -2.45 -0.00 0.00 1.00 0.00 0.00 64.86 63.41 1cfc h ILE 125 Cb 0.54 2.39 0.00 0.00 -0.74 0.00 0.00 36.82 39.01 1cfc h ILE 125 CO 0.04 0.66 -0.01 0.03 0.00 0.00 0.00 178.15 178.87 1cfc h ARG 126 N 0.00 -0.02 0.00 2.37 3.08 -0.70 -2.97 114.38 116.14 1cfc h ARG 126 Ca -0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.04 1cfc h ARG 126 Cb 1.34 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.39 1cfc h ARG 126 CO 0.09 0.19 0.00 0.93 -1.07 0.00 0.00 179.97 180.11 1cfc h GLU 127 N -0.23 0.00 -4.84 0.04 5.08 -1.62 -3.38 114.58 109.64 1cfc h GLU 127 Ca -0.00 0.00 -0.71 0.00 -1.00 0.00 0.00 59.36 57.65 1cfc h GLU 127 Cb 0.22 0.00 -0.19 0.00 0.50 0.00 0.00 28.75 29.28 1cfc h GLU 127 CO 0.00 0.00 0.82 0.00 -1.00 0.00 0.00 179.01 178.83 1cfc s ALA 128 N -3.16 3.55 -0.87 3.43 0.00 -0.98 -4.92 121.76 118.81 1cfc s ALA 128 Ca 0.09 -2.93 -0.08 0.00 0.00 0.00 0.00 51.96 49.04 1cfc s ALA 128 Cb 0.09 -4.00 -0.29 0.00 0.00 0.00 0.00 23.12 18.92 1cfc s ALA 128 CO 0.62 -2.87 1.96 -0.25 0.00 0.00 0.00 175.76 175.23 1cfc n ASP 129 N 6.08 -1.49 -4.11 0.00 8.00 -1.26 -4.80 116.55 118.97 1cfc n ASP 129 Ca 0.25 -0.62 -0.28 0.00 0.71 0.00 0.00 54.79 54.85 1cfc n ASP 129 Cb 0.48 -0.52 -0.17 0.00 -0.02 0.00 0.00 41.12 40.89 1cfc n ASP 129 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1cfc s ILE 130 N 0.00 1.54 0.00 0.53 1.01 -1.26 -5.02 121.20 117.99 1cfc s ILE 130 Ca 1.14 -0.72 0.00 0.00 0.00 0.00 0.00 60.65 61.08 1cfc s ILE 130 Cb -0.74 -1.36 0.00 0.00 0.01 0.00 0.00 42.46 40.38 1cfc s ILE 130 CO 0.49 0.44 0.00 -0.67 0.00 0.00 0.00 174.94 175.21 1cfc n ASP 131 N 3.66 0.00 -0.17 3.58 2.03 -1.26 -5.01 116.55 119.39 1cfc n ASP 131 Ca -0.21 0.00 0.02 0.00 0.52 0.00 0.00 54.79 55.12 1cfc n ASP 131 Cb 0.52 0.00 0.02 0.00 -0.72 0.00 0.00 41.12 40.95 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 -0.24 2.58 0.27 0.00 -1.26 -4.71 105.19 106.83 1cfc n GLY 132 Ca 0.00 -0.11 -0.11 0.00 0.00 0.00 0.00 46.02 45.80 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 0.13 1.23 -3.79 1.61 2.03 -1.26 -5.11 116.55 111.39 1cfc n ASP 133 Ca 0.03 -2.76 -0.10 0.00 0.52 0.00 0.00 54.79 52.48 1cfc n ASP 133 Cb 0.14 -0.49 -0.04 0.00 -0.72 0.00 0.00 41.12 40.01 1cfc n ASP 133 CO 0.00 0.00 0.00 -0.83 -1.92 0.00 0.00 177.20 174.45 1cfc s GLY 134 N -2.94 0.61 0.16 0.27 0.00 -1.26 -5.18 107.32 98.98 1cfc s GLY 134 Ca 0.29 -0.91 0.09 0.00 0.00 0.00 0.00 44.72 44.18 1cfc s GLY 134 CO 0.02 -0.61 -0.19 1.20 0.00 0.00 0.00 173.10 173.52 1cfc s GLN 135 N -3.72 1.26 0.02 2.90 -0.21 -1.26 -4.19 119.66 114.46 1cfc s GLN 135 Ca 0.22 -1.37 -0.02 0.00 0.02 0.00 0.00 55.36 54.21 1cfc s GLN 135 Cb -0.01 -1.36 -0.02 0.00 1.00 0.00 0.00 33.01 32.62 1cfc s GLN 135 CO 0.11 0.28 0.00 0.08 -2.12 0.00 0.00 175.29 173.64 1cfc s VAL 136 N -1.90 0.11 0.61 1.09 1.01 -0.92 -4.93 120.40 115.47 1cfc s VAL 136 Ca 0.14 -0.91 -0.13 0.00 0.00 0.00 0.00 61.98 61.08 1cfc s VAL 136 Cb -0.06 -0.36 -0.04 0.00 0.00 0.00 0.00 36.38 35.92 1cfc s VAL 136 CO 0.06 -0.50 1.03 0.54 0.00 0.00 0.00 175.10 176.23 1cfc s ASN 137 N -1.53 6.06 0.17 3.32 4.22 -1.26 -3.16 114.94 122.75 1cfc s ASN 137 Ca -0.15 1.54 0.21 0.00 -2.14 0.00 0.00 52.86 52.33 1cfc s ASN 137 Cb -0.09 -2.49 -0.04 0.00 1.28 0.00 0.00 41.25 39.92 1cfc s ASN 137 CO -0.01 -0.98 0.99 0.00 -2.04 0.00 0.00 177.10 175.05 1cfc n TYR 138 N -2.51 0.95 -0.34 1.54 4.11 -1.26 -4.33 117.16 115.32 1cfc n TYR 138 Ca 0.07 0.28 0.10 0.00 -0.00 0.00 0.00 57.90 58.36 1cfc n TYR 138 Cb 0.54 -0.98 0.22 0.00 -0.00 0.00 0.00 39.34 39.12 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 0.01 -0.39 -3.48 5.08 -1.93 1.16 114.58 115.02 1cfc h GLU 139 Ca -0.03 -0.00 -0.16 0.00 -1.00 0.00 0.00 59.36 58.17 1cfc h GLU 139 Cb 1.11 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.35 1cfc h GLU 139 CO 0.01 0.01 -0.36 0.93 -1.00 0.00 0.00 179.01 178.59 1cfc h GLU 140 N 0.01 0.94 0.00 2.33 4.39 -2.01 -2.86 114.58 117.39 1cfc h GLU 140 Ca 0.54 -0.48 -0.01 0.00 0.34 0.00 0.00 59.36 59.74 1cfc h GLU 140 Cb 1.00 0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 29.66 1cfc h GLU 140 CO -0.94 1.14 -0.07 0.74 -1.16 0.00 0.00 179.01 178.72 1cfc h PHE 141 N 0.76 0.00 -0.02 4.33 0.04 0.21 -2.96 116.94 119.30 1cfc h PHE 141 Ca 0.07 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.83 1cfc h PHE 141 Cb 0.96 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 39.10 1cfc h PHE 141 CO 0.06 0.07 -0.01 0.28 -0.60 0.00 0.00 178.31 178.11 1cfc h VAL 142 N 0.00 1.35 0.00 -0.55 2.07 0.12 -2.65 116.25 116.59 1cfc h VAL 142 Ca -0.00 -1.06 -0.04 0.00 0.82 0.00 0.00 66.70 66.42 1cfc h VAL 142 Cb 0.64 2.02 -0.01 0.00 -1.52 0.00 0.00 31.29 32.43 1cfc h VAL 142 CO 0.01 0.28 -0.18 1.56 0.02 0.00 0.00 177.57 179.26 1cfc h GLN 143 N -0.38 0.00 -0.21 1.57 4.20 -1.53 -2.92 115.11 115.84 1cfc h GLN 143 Ca 0.00 0.00 -0.17 0.00 0.06 0.00 0.00 58.65 58.54 1cfc h GLN 143 Cb 0.46 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.25 1cfc h GLN 143 CO 0.00 0.18 -0.55 0.52 -0.67 0.00 0.00 178.83 178.32 1cfc h MET 144 N 0.00 0.75 0.00 1.46 2.86 -1.39 -2.23 114.93 116.38 1cfc h MET 144 Ca -0.00 -0.52 -0.00 0.00 -2.06 0.00 0.00 59.70 57.12 1cfc h MET 144 Cb 0.51 0.08 -0.00 0.00 0.06 0.00 0.00 31.60 32.25 1cfc h MET 144 CO 0.02 1.14 -0.00 0.52 1.06 0.00 0.00 176.91 179.65 1cfc h MET 145 N 0.47 0.00 0.00 1.72 2.86 -1.27 -3.27 114.93 115.44 1cfc h MET 145 Ca -0.01 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.63 1cfc h MET 145 Cb 1.17 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.83 1cfc h MET 145 CO 0.12 0.00 0.00 0.25 1.06 0.00 0.00 176.91 178.34 1cfc n THR 146 N -3.37 0.00 0.00 2.22 -2.24 -1.05 -5.05 114.28 104.78 1cfc n THR 146 Ca -0.03 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.75 1cfc n THR 146 Cb 0.08 -0.27 0.00 0.00 -2.10 0.00 0.00 70.33 68.05 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 -0.77 0.00 0.00 6.98 0.00 -0.86 -5.08 120.51 120.78 1cfc n ALA 147 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1cfc n ALA 147 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1cfc n ALA 147 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13