#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 -4.65 116.55 105.82 1cfc n ASP 2 Ca 0.00 -0.47 -0.38 0.00 -1.51 0.00 0.00 54.79 52.43 1cfc n ASP 2 Cb 0.00 0.00 0.06 0.00 2.34 0.00 0.00 41.12 43.52 1cfc n ASP 2 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1cfc n GLN 3 N 0.00 1.38 -2.52 -0.67 6.02 -1.26 -4.90 117.38 115.43 1cfc n GLN 3 Ca 0.00 0.52 -0.42 0.00 -0.01 0.00 0.00 57.00 57.09 1cfc n GLN 3 Cb 0.24 -2.56 -0.03 0.00 1.02 0.00 0.00 30.24 28.91 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 -3.97 4.39 0.84 1.08 1.43 -1.26 -5.01 118.68 116.18 1cfc s LEU 4 Ca 0.78 1.93 -0.11 0.00 -1.03 0.00 0.00 54.13 55.69 1cfc s LEU 4 Cb -0.40 -3.58 0.09 0.00 0.03 0.00 0.00 46.19 42.34 1cfc s LEU 4 CO 0.44 -0.37 1.09 0.42 0.23 0.00 0.00 176.35 178.17 1cfc s THR 5 N 0.82 2.98 0.26 5.49 -4.23 -1.26 -4.83 115.64 114.87 1cfc s THR 5 Ca 0.55 0.32 -0.05 0.00 -1.18 0.00 0.00 61.69 61.33 1cfc s THR 5 Cb -0.27 -2.82 0.22 0.00 1.34 0.00 0.00 72.50 70.97 1cfc s THR 5 CO 0.30 -0.42 1.88 -0.33 -0.54 0.00 0.00 174.62 175.52 1cfc h GLU 6 N -1.34 1.17 -0.28 3.99 4.39 -1.99 -2.01 114.58 118.52 1cfc h GLU 6 Ca -0.47 -0.13 -0.04 0.00 0.34 0.00 0.00 59.36 59.07 1cfc h GLU 6 Cb 1.26 -0.24 -0.01 0.00 -0.10 0.00 0.00 28.75 29.66 1cfc h GLU 6 CO 0.53 0.85 0.04 0.93 -1.16 0.00 0.00 179.01 180.20 1cfc h GLU 7 N 1.18 0.46 -0.86 2.33 4.39 -1.99 -1.81 114.58 118.28 1cfc h GLU 7 Ca 0.30 -0.13 0.04 0.00 0.34 0.00 0.00 59.36 59.91 1cfc h GLU 7 Cb 0.01 -0.05 -0.05 0.00 -0.10 0.00 0.00 28.75 28.56 1cfc h GLU 7 CO -0.05 0.59 0.57 1.96 -1.16 0.00 0.00 179.01 180.91 1cfc h GLN 8 N 0.27 1.04 -0.14 2.33 4.20 -1.84 0.17 115.11 121.14 1cfc h GLN 8 Ca 0.08 -0.06 -0.10 0.00 0.06 0.00 0.00 58.65 58.63 1cfc h GLN 8 Cb 0.35 -0.23 -0.01 0.00 0.30 0.00 0.00 27.48 27.89 1cfc h GLN 8 CO 0.01 0.69 -0.35 0.82 -0.67 0.00 0.00 178.83 179.32 1cfc h ILE 9 N 1.07 1.29 -0.03 2.54 2.04 -1.10 -2.72 117.51 120.60 1cfc h ILE 9 Ca 0.34 -1.39 -0.09 0.00 1.00 0.00 0.00 64.86 64.72 1cfc h ILE 9 Cb 0.03 1.58 0.01 0.00 -0.74 0.00 0.00 36.82 37.69 1cfc h ILE 9 CO -0.10 0.42 -0.32 0.00 0.00 0.00 0.00 178.15 178.15 1cfc h ALA 10 N 1.39 0.07 -0.78 1.87 0.00 -0.25 -2.12 119.26 119.46 1cfc h ALA 10 Ca 0.03 -0.46 0.15 0.00 0.00 0.00 0.00 54.91 54.62 1cfc h ALA 10 Cb 0.74 0.01 -0.10 0.00 0.00 0.00 0.00 17.79 18.44 1cfc h ALA 10 CO 0.06 0.15 0.31 1.49 0.00 0.00 0.00 179.25 181.26 1cfc h GLU 11 N -0.32 0.43 -0.19 0.00 4.81 -0.66 0.33 114.58 118.98 1cfc h GLU 11 Ca -0.03 -0.03 -0.12 0.00 -0.13 0.00 0.00 59.36 59.05 1cfc h GLU 11 Cb 1.02 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 30.29 1cfc h GLU 11 CO 0.06 0.29 -0.40 0.74 -0.73 0.00 0.00 179.01 178.97 1cfc h PHE 12 N 0.45 0.51 -0.55 0.92 0.04 -1.50 -2.27 116.94 114.54 1cfc h PHE 12 Ca 0.43 -0.14 -0.03 0.00 2.80 0.00 0.00 57.97 61.03 1cfc h PHE 12 Cb 0.68 -0.11 -0.02 0.00 2.20 0.00 0.00 35.95 38.69 1cfc h PHE 12 CO -0.16 0.77 0.24 -0.22 -0.60 0.00 0.00 178.31 178.33 1cfc h LYS 13 N 0.36 0.81 -0.25 1.51 3.64 0.28 0.40 116.57 123.32 1cfc h LYS 13 Ca 0.03 -0.14 -0.03 0.00 -1.27 0.00 0.00 60.65 59.24 1cfc h LYS 13 Cb 0.86 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 32.53 1cfc h LYS 13 CO 0.07 0.69 0.02 0.93 -2.27 0.00 0.00 179.45 178.89 1cfc h GLU 14 N 0.74 0.43 0.00 1.90 5.08 -0.92 0.02 114.58 121.83 1cfc h GLU 14 Ca 0.18 -0.12 -0.04 0.00 -1.00 0.00 0.00 59.36 58.38 1cfc h GLU 14 Cb 0.17 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.37 1cfc h GLU 14 CO -0.02 0.58 -0.21 0.00 -1.00 0.00 0.00 179.01 178.36 1cfc h ALA 15 N 0.83 1.52 0.04 3.43 0.00 -1.16 -1.56 119.26 122.36 1cfc h ALA 15 Ca 0.07 -0.19 -0.15 0.00 0.00 0.00 0.00 54.91 54.64 1cfc h ALA 15 Cb 0.37 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 18.14 1cfc h ALA 15 CO 0.01 0.26 -0.62 0.35 0.00 0.00 0.00 179.25 179.25 1cfc h PHE 16 N 0.00 0.54 0.00 0.00 3.57 0.23 -3.25 116.94 118.03 1cfc h PHE 16 Ca -0.00 -0.32 -0.03 0.00 3.53 0.00 0.00 57.97 61.14 1cfc h PHE 16 Cb 0.40 -0.05 -0.00 0.00 2.79 0.00 0.00 35.95 39.09 1cfc h PHE 16 CO 0.00 1.17 -0.14 0.77 -2.23 0.00 0.00 178.31 177.88 1cfc h SER 17 N -0.24 0.00 -0.01 0.41 0.02 -0.82 -2.75 113.55 110.17 1cfc h SER 17 Ca -0.09 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.86 1cfc h SER 17 Cb 1.37 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.91 1cfc h SER 17 CO 0.12 0.14 0.15 -0.07 -1.14 0.00 0.00 176.83 176.03 1cfc h LEU 18 N 0.00 0.00 -2.90 5.07 3.38 -1.32 -0.91 115.31 118.63 1cfc h LEU 18 Ca -0.00 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 1cfc h LEU 18 Cb 0.62 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.37 1cfc h LEU 18 CO 0.02 0.00 -0.06 0.49 0.09 0.00 0.00 178.44 178.97 1cfc n PHE 19 N -3.02 0.00 -2.98 1.13 3.01 -1.04 -4.85 117.46 109.71 1cfc n PHE 19 Ca -0.02 -0.91 -0.43 0.00 1.01 0.00 0.00 57.45 57.09 1cfc n PHE 19 Cb 0.21 -0.14 0.01 0.00 -0.01 0.00 0.00 39.48 39.55 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 -1.29 6.50 0.00 4.37 2.03 -0.35 -4.72 116.55 123.10 1cfc n ASP 20 Ca 0.14 -3.44 0.08 0.00 0.52 0.00 0.00 54.79 52.10 1cfc n ASP 20 Cb 0.65 -1.26 0.43 0.00 -0.72 0.00 0.00 41.12 40.22 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 1.22 0.30 -0.04 -0.67 4.76 -1.26 -2.09 118.16 120.38 1cfc n LYS 21 Ca 0.27 0.10 0.12 0.00 -2.87 0.00 0.00 58.31 55.93 1cfc n LYS 21 Cb 0.33 -1.50 0.13 0.00 -1.84 0.00 0.00 35.03 32.15 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 -1.22 3.06 -1.68 4.39 8.00 -1.26 -4.92 116.55 122.93 1cfc n ASP 22 Ca 0.09 -1.99 -0.09 0.00 0.71 0.00 0.00 54.79 53.51 1cfc n ASP 22 Cb 0.11 -0.05 -0.03 0.00 -0.02 0.00 0.00 41.12 41.14 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 1.38 0.42 0.67 0.44 0.00 -0.89 -4.71 105.19 102.49 1cfc n GLY 23 Ca 0.15 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.29 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 -0.63 2.39 -0.07 1.61 2.03 -1.26 -4.95 116.55 115.67 1cfc n ASP 24 Ca -0.10 -1.69 -0.01 0.00 0.52 0.00 0.00 54.79 53.51 1cfc n ASP 24 Cb 0.40 0.29 -0.00 0.00 -0.72 0.00 0.00 41.12 41.09 1cfc n ASP 24 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1cfc n GLY 25 N 1.39 0.37 3.16 0.27 0.00 -1.26 -5.04 105.19 104.08 1cfc n GLY 25 Ca 0.11 -0.93 -0.10 0.00 0.00 0.00 0.00 46.02 45.10 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 -2.03 0.09 0.14 2.61 -4.23 -1.26 -3.35 115.64 107.61 1cfc s THR 26 Ca 0.00 -1.92 -0.01 0.00 -1.18 0.00 0.00 61.69 58.58 1cfc s THR 26 Cb 0.00 -2.11 -0.04 0.00 1.34 0.00 0.00 72.50 71.69 1cfc s THR 26 CO 0.00 -0.39 0.07 0.27 -0.54 0.00 0.00 174.62 174.03 1cfc s ILE 27 N -4.06 0.08 0.53 2.99 -4.36 -0.39 -4.44 121.20 111.54 1cfc s ILE 27 Ca 0.26 -1.92 -0.01 0.00 -0.26 0.00 0.00 60.65 58.72 1cfc s ILE 27 Cb 0.07 -2.13 0.02 0.00 1.25 0.00 0.00 42.46 41.67 1cfc s ILE 27 CO 0.03 -0.38 0.78 0.42 0.24 0.00 0.00 174.94 176.03 1cfc s THR 28 N -4.07 3.38 0.28 8.37 -4.23 -1.26 -0.93 115.64 117.18 1cfc s THR 28 Ca 0.27 -0.43 0.09 0.00 -1.18 0.00 0.00 61.69 60.43 1cfc s THR 28 Cb 0.07 -3.29 -0.01 0.00 1.34 0.00 0.00 72.50 70.62 1cfc s THR 28 CO 0.04 -0.23 1.64 0.71 -0.54 0.00 0.00 174.62 176.24 1cfc h THR 29 N 0.10 1.39 0.00 3.99 1.35 -1.87 -2.79 112.91 115.08 1cfc h THR 29 Ca -0.45 -1.89 -0.01 0.00 -0.55 0.00 0.00 66.41 63.51 1cfc h THR 29 Cb 1.27 1.98 -0.00 0.00 -1.73 0.00 0.00 68.15 69.68 1cfc h THR 29 CO 0.57 0.55 -0.06 0.11 -0.25 0.00 0.00 175.52 176.43 1cfc h LYS 30 N 0.07 0.00 -0.27 4.72 1.57 -1.94 -1.38 116.57 119.35 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 1.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.31 1cfc h LYS 30 CO 0.08 0.06 0.00 0.39 -0.57 0.00 0.00 179.45 179.41 1cfc n GLU 31 N -3.85 2.46 0.07 3.15 1.02 -1.06 -4.46 120.64 117.96 1cfc n GLU 31 Ca -0.03 -2.18 -0.13 0.00 -0.02 0.00 0.00 57.16 54.80 1cfc n GLU 31 Cb 0.15 -1.50 -0.08 0.00 -0.02 0.00 0.00 31.44 29.99 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 4.60 -0.12 -1.87 -4.62 5.85 -1.15 -1.03 115.31 116.98 1cfc h LEU 32 Ca 0.00 -0.18 0.01 0.00 0.84 0.00 0.00 57.88 58.56 1cfc h LEU 32 Cb 1.00 0.03 -0.01 0.00 0.37 0.00 0.00 40.66 42.05 1cfc h LEU 32 CO 0.00 0.11 0.11 1.23 -0.34 0.00 0.00 178.44 179.55 1cfc h GLY 33 N -0.34 0.19 1.19 3.75 0.00 -1.78 -0.59 103.07 105.49 1cfc h GLY 33 Ca -0.01 -0.07 -0.17 0.00 0.00 0.00 0.00 47.33 47.08 1cfc h GLY 33 CO 0.02 0.07 -0.46 -0.84 0.00 0.00 0.00 176.54 175.33 1cfc h THR 34 N 0.18 1.28 0.01 4.70 2.02 -1.70 -0.91 112.91 118.48 1cfc h THR 34 Ca 0.07 -1.64 -0.00 0.00 0.77 0.00 0.00 66.41 65.61 1cfc h THR 34 Cb 0.04 1.50 0.00 0.00 -1.74 0.00 0.00 68.15 67.96 1cfc h THR 34 CO -0.01 0.54 -0.01 0.58 0.37 0.00 0.00 175.52 176.99 1cfc h VAL 35 N 0.69 1.24 -0.89 3.16 2.07 -0.10 -2.30 116.25 120.12 1cfc h VAL 35 Ca 0.04 -0.75 0.12 0.00 0.82 0.00 0.00 66.70 66.94 1cfc h VAL 35 Cb 1.05 1.74 -0.07 0.00 -1.52 0.00 0.00 31.29 32.49 1cfc h VAL 35 CO 0.11 0.19 0.57 0.24 0.02 0.00 0.00 177.57 178.70 1cfc h MET 36 N -0.34 0.75 -0.63 1.57 2.86 -1.13 0.12 114.93 118.14 1cfc h MET 36 Ca -0.00 -0.05 -0.01 0.00 -2.06 0.00 0.00 59.70 57.58 1cfc h MET 36 Cb 0.33 -0.17 -0.03 0.00 0.06 0.00 0.00 31.60 31.79 1cfc h MET 36 CO 0.00 0.50 0.34 0.00 1.06 0.00 0.00 176.91 178.81 1cfc h ARG 37 N 0.77 0.87 -0.85 1.72 2.47 -0.76 -0.72 114.38 117.88 1cfc h ARG 37 Ca 0.43 -0.09 0.05 0.00 -1.26 0.00 0.00 59.98 59.11 1cfc h ARG 37 Cb 0.58 -0.18 -0.06 0.00 -1.65 0.00 0.00 29.97 28.67 1cfc h ARG 37 CO -0.20 0.64 0.54 0.66 0.56 0.00 0.00 179.97 182.18 1cfc h SER 38 N 0.88 0.87 0.00 7.04 4.64 -0.21 0.28 113.55 127.04 1cfc h SER 38 Ca 0.22 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.55 1cfc h SER 38 Cb 0.03 -0.18 0.00 0.00 -0.31 0.00 0.00 62.40 61.94 1cfc h SER 38 CO -0.04 0.58 0.00 0.18 -0.87 0.00 0.00 176.83 176.68 1cfc n LEU 39 N -4.59 0.00 0.00 5.97 4.77 -0.74 -4.82 117.00 117.59 1cfc n LEU 39 Ca 0.11 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.09 1cfc n LEU 39 Cb 0.13 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.22 1cfc n LEU 39 CO 0.32 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 176.99 1cfc n GLY 40 N 0.48 0.60 3.89 -0.72 0.00 0.97 -5.06 105.19 105.35 1cfc n GLY 40 Ca 0.18 -0.60 -0.36 0.00 0.00 0.00 0.00 46.02 45.23 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 -1.16 3.44 -0.46 1.61 -1.52 -0.35 -4.97 119.66 116.25 1cfc s GLN 41 Ca 0.00 -0.17 0.06 0.00 -1.95 0.00 0.00 55.36 53.30 1cfc s GLN 41 Cb 0.00 -3.17 0.22 0.00 -0.22 0.00 0.00 33.01 29.84 1cfc s GLN 41 CO 0.00 0.76 0.49 -1.71 -0.25 0.00 0.00 175.29 174.58 1cfc n ASN 42 N 1.76 0.71 -4.79 5.90 2.85 -1.26 -3.14 115.26 117.29 1cfc n ASN 42 Ca -0.18 -2.74 -0.34 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 -1.00 3.53 1.04 1.20 0.04 -1.26 -5.02 135.00 133.53 1cfc s PRO 43 Ca 0.34 1.45 -0.14 0.00 0.04 0.00 0.00 61.00 62.69 1cfc s PRO 43 Cb 0.11 -2.05 0.21 0.00 0.04 0.00 0.00 34.50 32.81 1cfc s PRO 43 CO -0.13 -0.67 1.11 0.95 0.04 0.00 0.00 177.00 178.29 1cfc s THR 44 N -1.96 1.92 0.17 1.26 -4.23 -1.26 -4.80 115.64 106.73 1cfc s THR 44 Ca 0.69 0.00 -0.12 0.00 -1.18 0.00 0.00 61.69 61.08 1cfc s THR 44 Cb -0.19 -2.53 0.06 0.00 1.34 0.00 0.00 72.50 71.18 1cfc s THR 44 CO 0.25 0.00 1.70 -0.33 -0.54 0.00 0.00 174.62 175.70 1cfc h GLU 45 N -2.01 0.88 -0.64 3.99 5.08 -1.99 -2.03 114.58 117.86 1cfc h GLU 45 Ca -0.52 -0.19 -0.05 0.00 -1.00 0.00 0.00 59.36 57.60 1cfc h GLU 45 Cb 1.32 -0.13 -0.03 0.00 0.50 0.00 0.00 28.75 30.42 1cfc h GLU 45 CO 0.53 0.79 0.21 0.00 -1.00 0.00 0.00 179.01 179.55 1cfc h ALA 46 N 1.05 1.17 -0.52 3.43 0.00 -1.98 0.20 119.26 122.60 1cfc h ALA 46 Ca 0.18 -0.19 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 1cfc h ALA 46 Cb 0.28 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 1cfc h ALA 46 CO -0.01 0.58 0.16 0.93 0.00 0.00 0.00 179.25 180.92 1cfc h GLU 47 N 0.93 0.78 -0.08 0.00 5.08 -1.82 -1.08 114.58 118.38 1cfc h GLU 47 Ca 0.21 -0.13 -0.11 0.00 -1.00 0.00 0.00 59.36 58.33 1cfc h GLU 47 Cb 0.25 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.37 1cfc h GLU 47 CO -0.01 0.67 -0.37 -0.07 -1.00 0.00 0.00 179.01 178.23 1cfc h LEU 48 N 0.76 0.47 -1.90 1.33 3.38 -0.57 -3.03 115.31 115.74 1cfc h LEU 48 Ca 0.18 -0.64 -0.01 0.00 0.09 0.00 0.00 57.88 57.49 1cfc h LEU 48 Cb 0.22 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 40.83 1cfc h LEU 48 CO -0.01 1.03 -0.06 1.56 0.09 0.00 0.00 178.44 181.05 1cfc h GLN 49 N -0.07 0.00 0.00 1.13 1.08 -0.39 -1.78 115.11 115.08 1cfc h GLN 49 Ca -0.02 0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.17 1cfc h GLN 49 Cb 1.02 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.45 1cfc h GLN 49 CO 0.08 0.06 -0.04 0.22 -0.95 0.00 0.00 178.83 178.20 1cfc h ASP 50 N 0.00 0.04 0.43 1.46 3.58 -1.17 -2.53 116.42 118.23 1cfc h ASP 50 Ca -0.00 -0.81 -0.05 0.00 0.42 0.00 0.00 57.03 56.59 1cfc h ASP 50 Cb 0.37 -0.01 -0.01 0.00 1.72 0.00 0.00 39.33 41.40 1cfc h ASP 50 CO 0.01 0.84 -0.25 0.24 -2.88 0.00 0.00 179.24 177.21 1cfc h MET 51 N -0.77 0.00 -0.43 0.28 2.86 -1.41 -2.44 114.93 113.02 1cfc h MET 51 Ca -0.01 0.00 -0.15 0.00 -2.06 0.00 0.00 59.70 57.49 1cfc h MET 51 Cb 0.85 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.50 1cfc h MET 51 CO 0.01 0.25 -0.32 0.82 1.06 0.00 0.00 176.91 178.73 1cfc h ILE 52 N 0.00 1.27 -0.57 -1.22 2.04 -1.33 0.17 117.51 117.87 1cfc h ILE 52 Ca -0.00 -1.49 0.01 0.00 1.00 0.00 0.00 64.86 64.38 1cfc h ILE 52 Cb 0.53 1.27 -0.03 0.00 -0.74 0.00 0.00 36.82 37.85 1cfc h ILE 52 CO 0.03 0.50 0.38 -1.13 0.00 0.00 0.00 178.15 177.94 1cfc h ASN 53 N 0.81 0.64 0.04 1.72 -1.24 -0.98 1.19 115.58 117.76 1cfc h ASN 53 Ca 0.08 -0.01 -0.07 0.00 0.71 0.00 0.00 56.30 57.01 1cfc h ASN 53 Cb 0.91 -0.16 0.00 0.00 0.73 0.00 0.00 38.32 39.80 1cfc h ASN 53 CO 0.08 0.46 -0.31 -0.33 -1.29 0.00 0.00 177.43 176.04 1cfc h GLU 54 N 0.75 0.09 0.00 6.67 5.08 -1.45 -3.30 114.58 122.43 1cfc h GLU 54 Ca 0.22 -0.16 -0.05 0.00 -1.00 0.00 0.00 59.36 58.37 1cfc h GLU 54 Cb -0.05 0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.25 1cfc h GLU 54 CO -0.05 1.08 -0.22 0.28 -1.00 0.00 0.00 179.01 179.10 1cfc h VAL 55 N -0.80 0.90 0.00 3.13 2.07 -0.71 -2.52 116.25 118.32 1cfc h VAL 55 Ca -0.06 -0.82 0.00 0.00 0.82 0.00 0.00 66.70 66.64 1cfc h VAL 55 Cb 1.21 1.47 0.00 0.00 -1.52 0.00 0.00 31.29 32.46 1cfc h VAL 55 CO 0.04 0.21 0.00 -0.67 0.02 0.00 0.00 177.57 177.17 1cfc n ASP 56 N -3.91 4.82 0.20 0.57 2.03 0.41 -3.93 116.55 116.74 1cfc n ASP 56 Ca -0.02 -2.31 0.10 0.00 0.52 0.00 0.00 54.79 53.08 1cfc n ASP 56 Cb 0.30 -0.99 0.14 0.00 -0.72 0.00 0.00 41.12 39.86 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 1.23 0.94 0.00 -1.67 0.00 -1.62 -3.04 119.26 115.09 1cfc h ALA 57 Ca 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.83 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 0.10 0.00 0.22 0.00 0.00 0.00 179.25 179.57 1cfc h ASP 58 N 0.00 0.00 -0.60 0.00 1.82 -1.87 -3.47 116.42 112.30 1cfc h ASP 58 Ca -0.00 0.00 -0.14 0.00 -0.39 0.00 0.00 57.03 56.50 1cfc h ASP 58 Cb 1.06 0.00 -0.03 0.00 0.68 0.00 0.00 39.33 41.04 1cfc h ASP 58 CO 0.01 0.00 -0.15 0.61 -1.61 0.00 0.00 179.24 178.10 1cfc n GLY 59 N 1.12 0.55 0.67 -0.78 0.00 -1.15 -4.90 105.19 100.70 1cfc n GLY 59 Ca 0.04 -0.68 0.06 0.00 0.00 0.00 0.00 46.02 45.44 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 0.82 2.92 -2.70 1.61 4.05 -1.26 -4.96 115.26 115.74 1cfc n ASN 60 Ca -0.07 -1.97 -0.09 0.00 0.45 0.00 0.00 54.58 52.90 1cfc n ASN 60 Cb 0.37 -0.23 -0.01 0.00 1.23 0.00 0.00 39.78 41.14 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 0.59 -0.49 3.25 8.20 0.00 -1.26 -4.88 105.19 110.60 1cfc n GLY 61 Ca 0.12 0.01 -0.15 0.00 0.00 0.00 0.00 46.02 46.00 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 -2.38 0.13 -0.01 2.61 -4.23 -1.26 -3.05 115.64 107.46 1cfc s THR 62 Ca 0.09 -2.00 -0.00 0.00 -1.18 0.00 0.00 61.69 58.60 1cfc s THR 62 Cb -0.05 -2.52 0.01 0.00 1.34 0.00 0.00 72.50 71.28 1cfc s THR 62 CO 0.11 0.00 0.02 -0.63 -0.54 0.00 0.00 174.62 173.59 1cfc s ILE 63 N -3.89 -0.02 0.36 2.99 1.01 -0.10 -4.85 121.20 116.70 1cfc s ILE 63 Ca 0.39 0.06 0.07 0.00 0.00 0.00 0.00 60.65 61.16 1cfc s ILE 63 Cb 0.06 -0.05 -0.01 0.00 0.01 0.00 0.00 42.46 42.48 1cfc s ILE 63 CO 0.16 0.02 0.48 1.51 0.00 0.00 0.00 174.94 177.11 1cfc s ASP 64 N 0.30 5.84 0.17 3.58 1.47 -1.26 -1.27 116.67 125.51 1cfc s ASP 64 Ca -0.02 -0.27 -0.12 0.00 1.18 0.00 0.00 52.55 53.31 1cfc s ASP 64 Cb -0.04 -1.06 0.07 0.00 -0.34 0.00 0.00 42.92 41.55 1cfc s ASP 64 CO -0.01 -0.51 1.73 0.15 0.68 0.00 0.00 175.17 177.21 1cfc h PHE 65 N 0.85 0.87 -0.28 2.11 3.57 -1.96 -0.85 116.94 121.25 1cfc h PHE 65 Ca -0.44 -0.06 0.05 0.00 3.53 0.00 0.00 57.97 61.04 1cfc h PHE 65 Cb 1.26 -0.26 -0.04 0.00 2.79 0.00 0.00 35.95 39.70 1cfc h PHE 65 CO 0.43 0.69 0.02 -1.35 -2.23 0.00 0.00 178.31 175.87 1cfc h PRO 66 N 0.79 0.11 -0.11 6.41 0.11 -1.96 -0.23 132.00 137.12 1cfc h PRO 66 Ca 0.19 -0.01 -0.07 0.00 0.11 0.00 0.00 66.00 66.23 1cfc h PRO 66 Cb 0.18 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 31.26 1cfc h PRO 66 CO -0.02 0.07 -0.25 0.93 -0.21 0.00 0.00 178.00 178.52 1cfc h GLU 67 N 0.11 0.20 -0.43 1.05 5.08 -1.94 -1.90 114.58 116.75 1cfc h GLU 67 Ca 0.13 -0.06 -0.03 0.00 -1.00 0.00 0.00 59.36 58.40 1cfc h GLU 67 Cb 0.17 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.38 1cfc h GLU 67 CO -0.21 0.44 0.13 0.35 -1.00 0.00 0.00 179.01 178.72 1cfc h PHE 68 N 0.18 0.63 0.00 4.33 3.57 0.39 -0.90 116.94 125.13 1cfc h PHE 68 Ca 0.03 -0.04 -0.07 0.00 3.53 0.00 0.00 57.97 61.43 1cfc h PHE 68 Cb 0.54 -0.19 -0.01 0.00 2.79 0.00 0.00 35.95 39.08 1cfc h PHE 68 CO 0.01 0.52 -0.31 -0.07 -2.23 0.00 0.00 178.31 176.23 1cfc h LEU 69 N 0.61 0.00 -0.03 0.59 3.38 -0.34 -2.77 115.31 116.75 1cfc h LEU 69 Ca 0.15 0.00 -0.26 0.00 0.09 0.00 0.00 57.88 57.85 1cfc h LEU 69 Cb 0.19 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.96 1cfc h LEU 69 CO -0.01 0.31 -1.07 0.74 0.09 0.00 0.00 178.44 178.51 1cfc h THR 70 N 0.00 1.34 -0.03 0.22 2.02 -0.90 -2.37 112.91 113.18 1cfc h THR 70 Ca -0.00 -2.43 -0.13 0.00 0.77 0.00 0.00 66.41 64.62 1cfc h THR 70 Cb 0.81 2.51 -0.01 0.00 -1.74 0.00 0.00 68.15 69.71 1cfc h THR 70 CO 0.04 0.74 -0.56 0.00 0.37 0.00 0.00 175.52 176.11 1cfc h MET 71 N 0.28 0.10 -0.22 6.66 -0.00 -1.35 -2.40 114.93 118.01 1cfc h MET 71 Ca -0.13 -0.07 -0.17 0.00 -0.00 0.00 0.00 59.70 59.34 1cfc h MET 71 Cb 1.73 0.01 0.00 0.00 -0.00 0.00 0.00 31.60 33.34 1cfc h MET 71 CO 0.20 0.63 -0.54 0.52 -0.00 0.00 0.00 176.91 177.72 1cfc h MET 72 N 0.08 0.76 -0.05 -0.10 2.07 -1.50 -2.94 114.93 113.25 1cfc h MET 72 Ca -0.00 -0.52 -0.05 0.00 -2.07 0.00 0.00 59.70 57.06 1cfc h MET 72 Cb 1.01 0.08 -0.01 0.00 -1.87 0.00 0.00 31.60 30.80 1cfc h MET 72 CO 0.08 1.14 -0.21 0.00 1.07 0.00 0.00 176.91 178.99 1cfc h ALA 73 N 0.62 1.57 -0.49 6.32 0.00 -1.31 -0.50 119.26 125.46 1cfc h ALA 73 Ca -0.00 -0.22 -0.06 0.00 0.00 0.00 0.00 54.91 54.62 1cfc h ALA 73 Cb 1.15 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.87 1cfc h ALA 73 CO 0.12 0.32 0.04 0.00 0.00 0.00 0.00 179.25 179.73 1cfc h ARG 74 N 0.07 0.79 0.06 0.00 2.47 -1.26 0.53 114.38 117.04 1cfc h ARG 74 Ca 0.01 -0.19 -0.15 0.00 -1.26 0.00 0.00 59.98 58.39 1cfc h ARG 74 Cb 0.42 -0.10 0.02 0.00 -1.65 0.00 0.00 29.97 28.65 1cfc h ARG 74 CO 0.03 0.77 -0.63 0.87 0.56 0.00 0.00 179.97 181.57 1cfc h LYS 75 N 0.74 0.32 0.02 0.04 1.57 -1.21 -3.38 116.57 114.68 1cfc h LYS 75 Ca 0.15 -0.43 -0.24 0.00 -1.87 0.00 0.00 60.65 58.27 1cfc h LYS 75 Cb 0.40 0.14 -0.03 0.00 0.08 0.00 0.00 32.23 32.82 1cfc h LYS 75 CO 0.01 1.14 -1.17 0.52 -0.57 0.00 0.00 179.45 179.38 1cfc h MET 76 N -0.31 0.05 -0.50 3.15 2.86 -0.99 -3.40 114.93 115.80 1cfc h MET 76 Ca -0.10 -0.09 -0.02 0.00 -2.06 0.00 0.00 59.70 57.44 1cfc h MET 76 Cb 1.41 0.03 -0.02 0.00 0.06 0.00 0.00 31.60 33.08 1cfc h MET 76 CO 0.12 0.96 0.23 1.57 1.06 0.00 0.00 176.91 180.86 1cfc h LYS 77 N 0.01 0.72 -0.16 1.72 2.10 -0.10 -3.30 116.57 117.57 1cfc h LYS 77 Ca -0.08 -0.11 0.02 0.00 -2.00 0.00 0.00 60.65 58.48 1cfc h LYS 77 Cb 1.85 -0.13 -0.03 0.00 -0.90 0.00 0.00 32.23 33.02 1cfc h LYS 77 CO 0.13 0.61 -0.21 0.22 -2.00 0.00 0.00 179.45 178.20 1cfc h ASP 78 N 0.66 -0.70 0.00 7.07 1.82 -1.77 0.12 116.42 123.63 1cfc h ASP 78 Ca 0.17 0.09 0.00 0.00 -0.39 0.00 0.00 57.03 56.90 1cfc h ASP 78 Cb 0.13 0.29 0.00 0.00 0.68 0.00 0.00 39.33 40.43 1cfc h ASP 78 CO -0.02 -0.15 0.00 1.07 -1.61 0.00 0.00 179.24 178.53 1cfc n THR 79 N -3.71 1.57 -0.91 2.25 5.66 -1.24 -4.91 114.28 112.99 1cfc n THR 79 Ca -0.01 -0.36 -0.37 0.00 -3.05 0.00 0.00 64.05 60.26 1cfc n THR 79 Cb 0.13 -1.35 0.07 0.00 -1.55 0.00 0.00 70.33 67.62 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 1.44 -3.28 0.22 1.09 5.68 0.42 -4.80 116.55 117.32 1cfc n ASP 80 Ca 0.00 0.02 0.13 0.00 -0.50 0.00 0.00 54.79 54.43 1cfc n ASP 80 Cb 0.42 -0.68 0.24 0.00 -1.14 0.00 0.00 41.12 39.95 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 -1.28 0.00 -0.91 -1.12 0.87 -1.87 -3.15 113.55 106.10 1cfc h SER 81 Ca -0.43 0.00 0.09 0.00 -1.23 0.00 0.00 61.79 60.21 1cfc h SER 81 Cb 1.37 0.00 -0.06 0.00 -0.44 0.00 0.00 62.40 63.26 1cfc h SER 81 CO 0.26 0.00 0.59 -0.33 -0.53 0.00 0.00 176.83 176.82 1cfc h GLU 82 N 0.00 0.92 0.00 2.24 5.08 -1.87 0.19 114.58 121.15 1cfc h GLU 82 Ca 0.00 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 1cfc h GLU 82 Cb 0.93 -0.21 0.00 0.00 0.50 0.00 0.00 28.75 29.97 1cfc h GLU 82 CO 0.00 0.61 0.00 0.93 -1.00 0.00 0.00 179.01 179.55 1cfc h GLU 83 N 0.95 0.00 0.00 2.33 5.08 -1.87 0.46 114.58 121.53 1cfc h GLU 83 Ca 0.41 0.00 -0.10 0.00 -1.00 0.00 0.00 59.36 58.68 1cfc h GLU 83 Cb 0.34 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.57 1cfc h GLU 83 CO -0.17 0.00 -0.54 0.93 -1.00 0.00 0.00 179.01 178.23 1cfc h GLU 84 N 0.00 0.00 -0.33 2.33 4.39 -0.81 -2.79 114.58 117.37 1cfc h GLU 84 Ca 0.00 0.00 -0.14 0.00 0.34 0.00 0.00 59.36 59.56 1cfc h GLU 84 Cb 0.43 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.07 1cfc h GLU 84 CO 0.00 0.95 -0.34 0.82 -1.16 0.00 0.00 179.01 179.28 1cfc h ILE 85 N -1.00 1.29 -0.03 3.13 2.04 -1.30 -2.86 117.51 118.78 1cfc h ILE 85 Ca -0.15 -1.51 -0.07 0.00 1.00 0.00 0.00 64.86 64.14 1cfc h ILE 85 Cb 1.08 1.49 -0.01 0.00 -0.74 0.00 0.00 36.82 38.65 1cfc h ILE 85 CO -0.09 0.49 -0.30 -0.09 0.00 0.00 0.00 178.15 178.17 1cfc h ARG 86 N 0.60 0.06 0.00 2.37 2.43 -1.06 -1.43 114.38 117.35 1cfc h ARG 86 Ca 0.05 -0.02 -0.08 0.00 -0.81 0.00 0.00 59.98 59.13 1cfc h ARG 86 Cb 0.92 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 30.46 1cfc h ARG 86 CO 0.08 0.36 -0.36 0.93 -1.51 0.00 0.00 179.97 179.47 1cfc h GLU 87 N 0.05 0.00 0.21 0.20 4.39 -1.28 0.41 114.58 118.56 1cfc h GLU 87 Ca 0.01 0.00 -0.27 0.00 0.34 0.00 0.00 59.36 59.44 1cfc h GLU 87 Cb 0.56 0.00 0.03 0.00 -0.10 0.00 0.00 28.75 29.24 1cfc h GLU 87 CO 0.04 0.36 -1.18 0.00 -1.16 0.00 0.00 179.01 177.07 1cfc h ALA 88 N 1.64 -0.13 -0.26 3.43 0.00 -1.18 -3.00 119.26 119.75 1cfc h ALA 88 Ca -0.00 -0.79 -0.03 0.00 0.00 0.00 0.00 54.91 54.09 1cfc h ALA 88 Cb 0.77 0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.69 1cfc h ALA 88 CO 0.05 0.55 0.03 0.74 0.00 0.00 0.00 179.25 180.62 1cfc h PHE 89 N -0.09 0.37 -0.19 0.00 0.04 -1.04 -1.78 116.94 114.26 1cfc h PHE 89 Ca -0.21 -0.02 0.04 0.00 2.80 0.00 0.00 57.97 60.59 1cfc h PHE 89 Cb 1.93 -0.11 -0.04 0.00 2.20 0.00 0.00 35.95 39.93 1cfc h PHE 89 CO 0.16 0.36 -0.09 -0.09 -0.60 0.00 0.00 178.31 178.06 1cfc h ARG 90 N 0.37 -0.06 -0.43 1.51 2.43 -0.10 1.08 114.38 119.18 1cfc h ARG 90 Ca 0.09 0.00 0.12 0.00 -0.81 0.00 0.00 59.98 59.38 1cfc h ARG 90 Cb 0.20 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.75 1cfc h ARG 90 CO 0.00 -0.04 0.46 0.28 -1.51 0.00 0.00 179.97 179.17 1cfc h VAL 91 N -0.06 0.36 -0.00 0.20 2.07 -1.20 0.22 116.25 117.84 1cfc h VAL 91 Ca 0.10 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.62 1cfc h VAL 91 Cb 0.21 0.63 0.00 0.00 -1.52 0.00 0.00 31.29 30.61 1cfc h VAL 91 CO -0.23 0.00 -0.93 0.49 0.02 0.00 0.00 177.57 176.92 1cfc n PHE 92 N -3.70 0.00 -1.91 1.57 3.72 0.27 -4.48 117.46 112.93 1cfc n PHE 92 Ca 0.08 0.00 -0.40 0.00 -0.05 0.00 0.00 57.45 57.08 1cfc n PHE 92 Cb 0.64 -0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 39.18 1cfc n PHE 92 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 1cfc n ASP 93 N -1.29 8.13 0.32 4.37 2.03 0.30 -4.68 116.55 125.73 1cfc n ASP 93 Ca 0.05 -3.08 0.20 0.00 0.52 0.00 0.00 54.79 52.47 1cfc n ASP 93 Cb 0.35 -1.38 1.06 0.00 -0.72 0.00 0.00 41.12 40.43 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 4.63 0.00 -0.71 -0.67 1.57 -1.78 0.73 116.57 120.34 1cfc h LYS 94 Ca 0.72 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.50 1cfc h LYS 94 Cb 0.30 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.61 1cfc h LYS 94 CO 1.51 0.00 0.00 -3.47 -0.57 0.00 0.00 179.45 176.92 1cfc n ASP 95 N -2.96 4.03 -0.32 0.86 2.03 -1.26 -4.90 116.55 114.04 1cfc n ASP 95 Ca -0.03 -2.10 -0.02 0.00 0.52 0.00 0.00 54.79 53.17 1cfc n ASP 95 Cb 0.16 -0.50 -0.01 0.00 -0.72 0.00 0.00 41.12 40.05 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 1.53 0.21 0.01 0.27 0.00 0.25 -4.63 105.19 102.82 1cfc n GLY 96 Ca 0.24 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.37 1cfc n GLY 96 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1cfc n ASN 97 N 1.02 0.66 0.00 1.61 4.05 -1.26 -4.96 115.26 116.38 1cfc n ASN 97 Ca -0.02 -0.62 0.00 0.00 0.45 0.00 0.00 54.58 54.39 1cfc n ASN 97 Cb 0.22 1.27 0.00 0.00 1.23 0.00 0.00 39.78 42.51 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 1.42 1.57 3.76 8.20 0.00 -1.26 -5.02 105.19 113.86 1cfc n GLY 98 Ca 0.01 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.68 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 -3.05 3.45 0.17 1.61 1.51 -1.26 -3.69 117.35 116.09 1cfc s TYR 99 Ca 0.00 0.38 -0.02 0.00 -1.01 0.00 0.00 57.07 56.42 1cfc s TYR 99 Cb 0.00 -2.13 -0.04 0.00 -0.11 0.00 0.00 41.96 39.68 1cfc s TYR 99 CO 0.00 0.37 0.12 0.96 -1.11 0.00 0.00 175.55 175.89 1cfc s ILE 100 N 0.11 0.05 0.27 2.71 -4.36 -1.20 -4.82 121.20 113.96 1cfc s ILE 100 Ca 0.10 -1.91 -0.29 0.00 -0.26 0.00 0.00 60.65 58.29 1cfc s ILE 100 Cb -0.11 -2.27 -0.09 0.00 1.25 0.00 0.00 42.46 41.24 1cfc s ILE 100 CO -0.01 -0.21 0.98 -0.94 0.24 0.00 0.00 174.94 175.01 1cfc s SER 101 N -3.10 7.48 0.49 4.36 1.04 -1.26 -2.82 113.70 119.89 1cfc s SER 101 Ca 0.31 2.01 0.38 0.00 0.48 0.00 0.00 55.95 59.13 1cfc s SER 101 Cb 0.07 -2.61 1.55 0.00 0.10 0.00 0.00 66.02 65.13 1cfc s SER 101 CO 0.07 0.03 1.62 0.00 0.98 0.00 0.00 173.24 175.94 1cfc h ALA 102 N 3.86 3.17 0.80 5.32 0.00 -1.93 0.13 119.26 130.60 1cfc h ALA 102 Ca -0.46 0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.45 1cfc h ALA 102 Cb 1.20 0.18 0.01 0.00 0.00 0.00 0.00 17.79 19.18 1cfc h ALA 102 CO 0.67 -1.76 -0.38 0.00 0.00 0.00 0.00 179.25 177.78 1cfc h ALA 103 N 1.38 -1.23 -0.96 0.00 0.00 -1.93 0.49 119.26 117.01 1cfc h ALA 103 Ca 0.84 -0.23 0.23 0.00 0.00 0.00 0.00 54.91 55.75 1cfc h ALA 103 Cb 2.98 0.41 -0.07 0.00 0.00 0.00 0.00 17.79 21.11 1cfc h ALA 103 CO -0.24 -1.15 0.63 0.93 0.00 0.00 0.00 179.25 179.42 1cfc h GLU 104 N -1.12 0.38 -0.05 0.00 5.08 -1.16 0.51 114.58 118.22 1cfc h GLU 104 Ca -0.11 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.21 1cfc h GLU 104 Cb 0.82 -0.08 -0.00 0.00 0.50 0.00 0.00 28.75 29.98 1cfc h GLU 104 CO 0.18 0.25 -0.03 1.25 -1.00 0.00 0.00 179.01 179.66 1cfc h LEU 105 N 0.39 0.11 -1.18 1.33 5.85 -0.54 0.39 115.31 121.66 1cfc h LEU 105 Ca 0.51 -0.42 -0.01 0.00 0.84 0.00 0.00 57.88 58.80 1cfc h LEU 105 Cb 1.32 -0.03 -0.03 0.00 0.37 0.00 0.00 40.66 42.28 1cfc h LEU 105 CO -0.21 0.51 0.37 0.03 -0.34 0.00 0.00 178.44 178.81 1cfc h ARG 106 N -0.29 0.94 -0.43 1.25 3.08 0.21 -1.48 114.38 117.65 1cfc h ARG 106 Ca 0.01 -0.10 -0.07 0.00 0.07 0.00 0.00 59.98 59.90 1cfc h ARG 106 Cb 0.47 -0.19 -0.02 0.00 0.08 0.00 0.00 29.97 30.31 1cfc h ARG 106 CO 0.01 0.69 0.02 1.25 -1.07 0.00 0.00 179.97 180.87 1cfc h HIS 107 N 0.95 0.82 -0.84 3.04 2.76 0.18 -1.38 115.15 120.69 1cfc h HIS 107 Ca 0.24 -0.14 0.03 0.00 -2.20 0.00 0.00 60.37 58.31 1cfc h HIS 107 Cb 0.02 -0.22 -0.05 0.00 1.55 0.00 0.00 27.41 28.72 1cfc h HIS 107 CO 0.01 0.80 0.55 0.28 -1.30 0.00 0.00 177.93 178.27 1cfc h VAL 108 N 0.60 1.15 0.00 5.26 2.07 0.62 0.88 116.25 126.83 1cfc h VAL 108 Ca 0.13 -0.36 -0.12 0.00 0.82 0.00 0.00 66.70 67.16 1cfc h VAL 108 Cb 0.47 0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 30.22 1cfc h VAL 108 CO 0.02 0.19 -0.58 0.24 0.02 0.00 0.00 177.57 177.46 1cfc h MET 109 N 1.05 0.00 0.12 1.57 2.07 -0.86 -2.91 114.93 115.97 1cfc h MET 109 Ca 0.33 0.00 -0.27 0.00 -2.07 0.00 0.00 59.70 57.69 1cfc h MET 109 Cb 0.01 0.00 0.00 0.00 -1.87 0.00 0.00 31.60 29.74 1cfc h MET 109 CO -0.09 0.58 -1.37 1.15 1.07 0.00 0.00 176.91 178.25 1cfc h THR 110 N 0.00 1.08 0.00 2.22 2.02 -0.33 -3.34 112.91 114.56 1cfc h THR 110 Ca -0.01 -2.42 -0.04 0.00 0.77 0.00 0.00 66.41 64.72 1cfc h THR 110 Cb 1.16 2.77 -0.01 0.00 -1.74 0.00 0.00 68.15 70.34 1cfc h THR 110 CO 0.08 0.71 -0.17 0.78 0.37 0.00 0.00 175.52 177.29 1cfc h ASN 111 N -0.29 0.00 -0.00 4.18 -0.26 -0.96 -2.03 115.58 116.21 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 1.77 0.00 -0.00 0.00 -1.06 0.00 0.00 38.32 39.03 1cfc h ASN 111 CO 0.07 0.17 0.00 -0.07 -1.06 0.00 0.00 177.43 176.55 1cfc h LEU 112 N 0.00 0.00 -0.00 1.61 3.38 -1.63 -3.46 115.31 115.21 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 0.02 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.16 1cfc n GLY 113 N -1.43 0.95 3.76 0.83 0.00 -0.76 -5.05 105.19 103.48 1cfc n GLY 113 Ca -0.03 -0.57 -0.39 0.00 0.00 0.00 0.00 46.02 45.03 1cfc n GLY 113 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1cfc s GLU 114 N -2.93 4.71 0.00 1.61 2.02 -1.26 -4.90 118.70 117.95 1cfc s GLU 114 Ca 0.00 1.43 0.00 0.00 0.02 0.00 0.00 54.97 56.42 1cfc s GLU 114 Cb 0.00 -3.04 0.00 0.00 0.10 0.00 0.00 34.13 31.19 1cfc s GLU 114 CO 0.00 0.38 1.81 1.63 0.02 0.00 0.00 175.26 179.10 1cfc n LYS 115 N 1.02 0.99 -3.12 1.61 4.01 -1.26 -4.85 118.16 116.57 1cfc n LYS 115 Ca -0.00 0.00 -0.39 0.00 -0.51 0.00 0.00 58.31 57.41 1cfc n LYS 115 Cb 0.48 -1.00 -0.05 0.00 -0.51 0.00 0.00 35.03 33.95 1cfc n LYS 115 CO 0.00 0.00 0.00 -0.51 -1.11 0.00 0.00 177.40 175.78 1cfc s LEU 116 N 0.00 4.44 0.34 -0.35 1.43 -1.26 -5.05 118.68 118.23 1cfc s LEU 116 Ca 0.00 1.29 -0.19 0.00 -1.03 0.00 0.00 54.13 54.20 1cfc s LEU 116 Cb 0.00 -3.04 -0.10 0.00 0.03 0.00 0.00 46.19 43.08 1cfc s LEU 116 CO 0.00 0.09 0.83 0.42 0.23 0.00 0.00 176.35 177.92 1cfc s THR 117 N -0.26 4.50 0.56 5.49 -4.23 -1.26 -4.92 115.64 115.51 1cfc s THR 117 Ca 0.34 1.32 0.30 0.00 -1.18 0.00 0.00 61.69 62.47 1cfc s THR 117 Cb -0.19 -3.72 0.45 0.00 1.34 0.00 0.00 72.50 70.38 1cfc s THR 117 CO 0.20 -0.10 1.88 0.44 -0.54 0.00 0.00 174.62 176.50 1cfc h ASP 118 N 2.52 0.00 0.00 3.99 3.32 -2.00 -0.17 116.42 124.09 1cfc h ASP 118 Ca -0.48 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 56.57 1cfc h ASP 118 Cb 1.18 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.73 1cfc h ASP 118 CO 0.64 0.00 -0.00 -0.33 -1.72 0.00 0.00 179.24 177.83 1cfc h GLU 119 N 0.00 -0.00 -0.90 3.56 3.07 -2.00 -1.74 114.58 116.57 1cfc h GLU 119 Ca 0.36 0.00 0.21 0.00 -0.50 0.00 0.00 59.36 59.43 1cfc h GLU 119 Cb 1.56 0.00 -0.06 0.00 -0.84 0.00 0.00 28.75 29.41 1cfc h GLU 119 CO -0.00 0.34 0.60 0.93 -1.40 0.00 0.00 179.01 179.48 1cfc h GLU 120 N -0.35 0.33 -0.08 2.33 5.08 -1.40 0.34 114.58 120.83 1cfc h GLU 120 Ca -0.00 -0.02 -0.19 0.00 -1.00 0.00 0.00 59.36 58.15 1cfc h GLU 120 Cb 0.35 -0.07 -0.00 0.00 0.50 0.00 0.00 28.75 29.52 1cfc h GLU 120 CO 0.00 0.22 -0.75 0.28 -1.00 0.00 0.00 179.01 177.76 1cfc h VAL 121 N 0.34 1.37 -0.44 3.13 2.07 -1.30 -2.73 116.25 118.69 1cfc h VAL 121 Ca 0.47 -2.15 0.02 0.00 0.82 0.00 0.00 66.70 65.86 1cfc h VAL 121 Cb 1.26 2.12 -0.02 0.00 -1.52 0.00 0.00 31.29 33.13 1cfc h VAL 121 CO -0.16 0.65 0.29 0.44 0.02 0.00 0.00 177.57 178.81 1cfc h ASP 122 N 0.30 0.44 0.05 0.57 3.32 0.58 0.27 116.42 121.95 1cfc h ASP 122 Ca -0.04 -0.01 -0.22 0.00 0.02 0.00 0.00 57.03 56.78 1cfc h ASP 122 Cb 1.34 -0.10 0.01 0.00 0.22 0.00 0.00 39.33 40.79 1cfc h ASP 122 CO 0.13 0.31 -0.85 -0.08 -1.72 0.00 0.00 179.24 177.03 1cfc h GLU 123 N 0.51 0.63 0.00 3.56 4.81 -1.31 -2.06 114.58 120.72 1cfc h GLU 123 Ca 0.17 -0.57 -0.05 0.00 -0.13 0.00 0.00 59.36 58.78 1cfc h GLU 123 Cb 0.06 0.14 -0.01 0.00 0.63 0.00 0.00 28.75 29.57 1cfc h GLU 123 CO -0.04 1.19 -0.25 0.52 -0.73 0.00 0.00 179.01 179.70 1cfc h MET 124 N 0.40 0.00 0.00 1.92 2.86 -0.81 -2.05 114.93 117.26 1cfc h MET 124 Ca -0.07 0.00 -0.15 0.00 -2.06 0.00 0.00 59.70 57.42 1cfc h MET 124 Cb 1.48 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 33.11 1cfc h MET 124 CO 0.16 0.25 -0.74 0.82 1.06 0.00 0.00 176.91 178.46 1cfc h ILE 125 N 0.00 1.33 0.12 -1.22 2.04 -0.32 -2.90 117.51 116.56 1cfc h ILE 125 Ca -0.00 -2.72 -0.01 0.00 1.00 0.00 0.00 64.86 63.14 1cfc h ILE 125 Cb 0.44 2.55 0.00 0.00 -0.74 0.00 0.00 36.82 39.08 1cfc h ILE 125 CO 0.03 0.72 -0.06 0.03 0.00 0.00 0.00 178.15 178.88 1cfc h ARG 126 N 0.00 -0.15 0.00 2.37 3.08 -0.64 -2.86 114.38 116.18 1cfc h ARG 126 Ca -0.01 0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1cfc h ARG 126 Cb 1.49 0.03 0.00 0.00 0.08 0.00 0.00 29.97 31.58 1cfc h ARG 126 CO 0.10 -0.07 0.00 0.93 -1.07 0.00 0.00 179.97 179.86 1cfc h GLU 127 N -0.20 0.00 -4.30 0.04 5.08 -1.65 -3.36 114.58 110.19 1cfc h GLU 127 Ca -0.02 0.00 -0.75 0.00 -1.00 0.00 0.00 59.36 57.59 1cfc h GLU 127 Cb 0.15 0.00 -0.18 0.00 0.50 0.00 0.00 28.75 29.22 1cfc h GLU 127 CO 0.03 0.00 1.41 0.00 -1.00 0.00 0.00 179.01 179.44 1cfc n ALA 128 N -2.07 4.29 -1.09 3.43 0.00 -1.08 -4.91 120.51 119.08 1cfc n ALA 128 Ca 0.04 -4.32 -0.06 0.00 0.00 0.00 0.00 53.44 49.10 1cfc n ALA 128 Cb 0.51 -2.96 -0.06 0.00 0.00 0.00 0.00 19.45 16.94 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 4.82 -1.80 -0.13 0.00 8.00 -1.26 -4.58 116.55 121.60 1cfc n ASP 129 Ca 0.36 -1.15 0.13 0.00 0.71 0.00 0.00 54.79 54.84 1cfc n ASP 129 Cb 0.41 -0.56 0.68 0.00 -0.02 0.00 0.00 41.12 41.62 1cfc n ASP 129 CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43 1cfc n ILE 130 N 4.60 0.03 -2.62 0.53 5.41 -1.26 -4.78 119.36 121.26 1cfc n ILE 130 Ca 0.17 -0.07 0.00 0.00 1.00 0.00 0.00 62.75 63.85 1cfc n ILE 130 Cb 0.39 -0.19 0.00 0.00 -0.71 0.00 0.00 39.64 39.14 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 -0.61 1.32 0.00 4.38 2.03 -1.26 -4.27 116.55 118.14 1cfc n ASP 131 Ca 0.19 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.50 1cfc n ASP 131 Cb 0.15 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.55 1cfc n ASP 131 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1cfc n GLY 132 N 5.00 1.12 0.00 0.27 0.00 -1.26 -4.33 105.19 105.99 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 0.24 0.00 0.00 1.61 8.00 -1.26 -5.09 116.55 120.05 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 2.63 1.05 3.51 0.44 0.00 -1.26 -5.13 105.19 106.44 1cfc n GLY 134 Ca 0.00 -0.04 -0.25 0.00 0.00 0.00 0.00 46.02 45.74 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 1.75 0.02 1.61 -0.21 -1.26 -4.22 119.66 117.34 1cfc s GLN 135 Ca 0.00 -1.90 -0.07 0.00 0.02 0.00 0.00 55.36 53.41 1cfc s GLN 135 Cb 0.00 -1.55 -0.00 0.00 1.00 0.00 0.00 33.01 32.46 1cfc s GLN 135 CO 0.00 0.11 0.14 0.08 -2.12 0.00 0.00 175.29 173.50 1cfc s VAL 136 N -2.72 0.10 -0.77 1.09 1.01 -1.13 -4.95 120.40 113.03 1cfc s VAL 136 Ca 0.32 -0.80 -0.22 0.00 0.00 0.00 0.00 61.98 61.28 1cfc s VAL 136 Cb 0.03 -0.60 0.09 0.00 0.00 0.00 0.00 36.38 35.89 1cfc s VAL 136 CO 0.15 -0.44 1.06 0.21 0.00 0.00 0.00 175.10 176.08 1cfc s ASN 137 N -1.65 6.33 0.58 3.32 3.04 -1.26 -3.23 114.94 122.06 1cfc s ASN 137 Ca -0.11 -1.32 0.00 0.00 0.04 0.00 0.00 52.86 51.46 1cfc s ASN 137 Cb -0.05 -2.43 0.00 0.00 -1.54 0.00 0.00 41.25 37.23 1cfc s ASN 137 CO -0.00 -1.35 0.90 0.00 -3.04 0.00 0.00 177.10 173.61 1cfc n TYR 138 N 7.51 0.00 -0.30 0.43 4.11 -1.24 -2.07 117.16 125.59 1cfc n TYR 138 Ca 0.07 0.00 0.14 0.00 -0.00 0.00 0.00 57.90 58.11 1cfc n TYR 138 Cb 0.47 0.00 0.30 0.00 -0.00 0.00 0.00 39.34 40.11 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 0.18 -0.28 -3.48 5.08 -1.89 0.94 114.58 115.13 1cfc h GLU 139 Ca 0.00 -0.01 -0.15 0.00 -1.00 0.00 0.00 59.36 58.20 1cfc h GLU 139 Cb 1.80 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 31.00 1cfc h GLU 139 CO 0.00 0.12 -0.43 0.93 -1.00 0.00 0.00 179.01 178.63 1cfc h GLU 140 N 0.19 0.71 0.00 2.33 4.39 -1.84 -2.60 114.58 117.76 1cfc h GLU 140 Ca 0.57 -0.39 -0.07 0.00 0.34 0.00 0.00 59.36 59.82 1cfc h GLU 140 Cb 1.16 0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 29.82 1cfc h GLU 140 CO -0.68 1.00 -0.31 0.74 -1.16 0.00 0.00 179.01 178.60 1cfc h PHE 141 N 0.57 0.00 0.02 4.33 0.04 -0.23 -2.34 116.94 119.33 1cfc h PHE 141 Ca 0.04 0.00 -0.09 0.00 2.80 0.00 0.00 57.97 60.72 1cfc h PHE 141 Cb 0.98 0.00 0.01 0.00 2.20 0.00 0.00 35.95 39.14 1cfc h PHE 141 CO 0.05 0.31 -0.37 0.28 -0.60 0.00 0.00 178.31 177.98 1cfc h VAL 142 N 0.00 1.55 0.00 -0.55 2.07 0.79 -3.00 116.25 117.11 1cfc h VAL 142 Ca -0.00 -2.11 -0.00 0.00 0.82 0.00 0.00 66.70 65.41 1cfc h VAL 142 Cb 1.03 2.88 -0.00 0.00 -1.52 0.00 0.00 31.29 33.68 1cfc h VAL 142 CO 0.04 0.58 -0.00 1.56 0.02 0.00 0.00 177.57 179.77 1cfc h GLN 143 N -0.47 0.00 -0.02 1.57 4.20 -1.53 -3.14 115.11 115.72 1cfc h GLN 143 Ca -0.05 0.00 -0.23 0.00 0.06 0.00 0.00 58.65 58.43 1cfc h GLN 143 Cb 1.16 0.00 0.01 0.00 0.30 0.00 0.00 27.48 28.94 1cfc h GLN 143 CO 0.07 0.00 -0.92 0.52 -0.67 0.00 0.00 178.83 177.84 1cfc h MET 144 N 0.00 0.48 0.00 1.46 2.86 -1.45 -2.81 114.93 115.47 1cfc h MET 144 Ca -0.00 -0.49 -0.02 0.00 -2.06 0.00 0.00 59.70 57.12 1cfc h MET 144 Cb 0.74 0.13 -0.00 0.00 0.06 0.00 0.00 31.60 32.53 1cfc h MET 144 CO 0.00 1.14 -0.11 0.52 1.06 0.00 0.00 176.91 179.52 1cfc h MET 145 N 0.29 0.00 0.00 1.72 2.86 -1.47 -3.30 114.93 115.02 1cfc h MET 145 Ca -0.08 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.56 1cfc h MET 145 Cb 1.55 0.00 0.00 0.00 0.06 0.00 0.00 31.60 33.21 1cfc h MET 145 CO 0.16 0.11 -0.01 1.79 1.06 0.00 0.00 176.91 180.03 1cfc h THR 146 N 0.00 0.00 0.00 2.22 1.35 -1.58 -3.49 112.91 111.41 1cfc h THR 146 Ca -0.00 -0.39 0.00 0.00 -0.55 0.00 0.00 66.41 65.47 1cfc h THR 146 Cb 0.55 0.00 0.00 0.00 -1.73 0.00 0.00 68.15 66.97 1cfc h THR 146 CO 0.01 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 175.28 1cfc n ALA 147 N -2.32 0.00 0.00 6.62 0.00 -1.07 -4.69 120.51 119.06 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