#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fcc s ARG 3 N 0.00 0.34 -0.17 -2.82 3.52 -1.26 -4.87 118.95 113.69 2fcc s ARG 3 Ca 0.00 0.12 -0.15 0.00 -0.13 0.00 0.00 55.73 55.57 2fcc s ARG 3 Cb 0.00 -0.62 -0.04 0.00 -1.56 0.00 0.00 34.95 32.72 2fcc s ARG 3 CO 0.00 -0.20 0.37 0.42 -0.81 0.00 0.00 175.30 175.08 2fcc s ILE 4 N 1.43 5.24 0.17 4.11 -1.09 -1.26 -4.70 121.20 125.09 2fcc s ILE 4 Ca -0.04 0.69 0.04 0.00 -2.23 0.00 0.00 60.65 59.10 2fcc s ILE 4 Cb -0.13 -3.71 -0.04 0.00 -1.58 0.00 0.00 42.46 37.01 2fcc s ILE 4 CO -0.03 0.32 0.23 0.20 -1.23 0.00 0.00 174.94 174.44 2fcc s ASN 5 N 0.74 6.01 0.00 3.58 0.01 -1.26 -5.02 114.94 119.01 2fcc s ASN 5 Ca 0.19 0.03 0.10 0.00 -0.71 0.00 0.00 52.86 52.48 2fcc s ASN 5 Cb -0.14 -1.72 0.11 0.00 0.41 0.00 0.00 41.25 39.91 2fcc s ASN 5 CO 0.07 0.04 0.88 0.18 -1.51 0.00 0.00 177.10 176.76 2fcc n LEU 6 N -0.59 1.99 -4.90 0.60 4.77 -1.26 -5.03 117.00 112.59 2fcc n LEU 6 Ca -0.08 -1.12 -0.29 0.00 -0.03 0.00 0.00 56.01 54.49 2fcc n LEU 6 Cb 0.55 -0.03 0.10 0.00 -2.33 0.00 0.00 43.42 41.71 2fcc n LEU 6 CO 0.46 0.40 0.79 0.42 -1.33 0.00 0.00 177.39 178.14 2fcc s THR 7 N -0.88 2.00 -0.15 -5.08 -4.23 -1.26 -4.91 115.64 101.12 2fcc s THR 7 Ca 0.13 0.00 -0.29 0.00 -1.18 0.00 0.00 61.69 60.36 2fcc s THR 7 Cb 0.09 -3.00 -0.05 0.00 1.34 0.00 0.00 72.50 70.88 2fcc s THR 7 CO 0.13 0.00 2.00 -0.76 -0.54 0.00 0.00 174.62 175.45 2fcc s LEU 8 N -5.60 3.82 0.35 4.79 1.02 -1.26 -4.86 118.68 116.94 2fcc s LEU 8 Ca 0.63 2.02 0.13 0.00 0.02 0.00 0.00 54.13 56.93 2fcc s LEU 8 Cb -0.11 -3.52 0.98 0.00 0.02 0.00 0.00 46.19 43.56 2fcc s LEU 8 CO 0.49 -1.55 1.75 0.58 0.02 0.00 0.00 176.35 177.64 2fcc h VAL 9 N 6.50 0.54 0.00 -1.59 2.07 -1.96 0.42 116.25 122.23 2fcc h VAL 9 Ca -0.42 -0.17 0.00 0.00 0.82 0.00 0.00 66.70 66.93 2fcc h VAL 9 Cb 1.22 -0.01 0.00 0.00 -1.52 0.00 0.00 31.29 30.97 2fcc h VAL 9 CO 0.97 0.09 0.00 -1.54 0.02 0.00 0.00 177.57 177.11 2fcc n SER 10 N -4.76 0.00 0.04 0.57 3.41 -1.26 -2.36 113.62 109.26 2fcc n SER 10 Ca 0.26 0.45 0.11 0.00 -0.26 0.00 0.00 58.87 59.43 2fcc n SER 10 Cb 0.80 -0.47 -0.10 0.00 -0.26 0.00 0.00 64.21 64.18 2fcc n SER 10 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2fcc n GLU 11 N -1.47 0.64 -1.62 4.33 -0.58 0.15 -4.98 120.64 117.10 2fcc n GLU 11 Ca 0.04 -0.05 -0.40 0.00 -0.42 0.00 0.00 57.16 56.33 2fcc n GLU 11 Cb 0.17 -1.66 0.03 0.00 -0.57 0.00 0.00 31.44 29.41 2fcc n GLU 11 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 2fcc n LEU 12 N -2.46 3.17 -4.81 -4.62 4.77 -0.99 -4.97 117.00 107.09 2fcc n LEU 12 Ca -0.03 0.95 -0.33 0.00 -0.03 0.00 0.00 56.01 56.57 2fcc n LEU 12 Cb 0.57 -1.38 -0.00 0.00 -2.33 0.00 0.00 43.42 40.28 2fcc n LEU 12 CO 0.43 -1.55 0.71 0.00 -1.33 0.00 0.00 177.39 175.65 2fcc s ALA 13 N -1.37 2.82 0.18 -1.18 0.00 -1.26 -4.78 121.76 116.17 2fcc s ALA 13 Ca 0.68 0.39 -0.21 0.00 0.00 0.00 0.00 51.96 52.82 2fcc s ALA 13 Cb -0.49 -3.22 0.11 0.00 0.00 0.00 0.00 23.12 19.53 2fcc s ALA 13 CO 0.53 -0.62 1.58 -0.44 0.00 0.00 0.00 175.76 176.81 2fcc h ASP 14 N 0.71 -1.19 0.09 0.00 3.32 -0.26 0.23 116.42 119.33 2fcc h ASP 14 Ca -0.47 0.23 -0.05 0.00 0.02 0.00 0.00 57.03 56.76 2fcc h ASP 14 Cb 1.21 0.58 -0.01 0.00 0.22 0.00 0.00 39.33 41.34 2fcc h ASP 14 CO 0.58 -0.31 -0.16 1.56 -1.72 0.00 0.00 179.24 179.19 2fcc h GLN 15 N -0.17 0.16 0.01 3.56 7.50 -1.93 -1.40 115.11 122.84 2fcc h GLN 15 Ca 0.23 -0.04 -0.19 0.00 0.50 0.00 0.00 58.65 59.15 2fcc h GLN 15 Cb 0.55 -0.02 -0.02 0.00 0.05 0.00 0.00 27.48 28.04 2fcc h GLN 15 CO -0.68 0.33 -0.89 0.45 -1.50 0.00 0.00 178.83 176.54 2fcc h HIS 16 N 0.15 0.12 -0.25 2.96 3.86 -1.57 -2.60 115.15 117.82 2fcc h HIS 16 Ca 0.03 -0.07 -0.03 0.00 -1.16 0.00 0.00 60.37 59.13 2fcc h HIS 16 Cb 0.39 -0.01 -0.01 0.00 1.06 0.00 0.00 27.41 28.84 2fcc h HIS 16 CO 0.00 0.93 0.03 1.25 0.86 0.00 0.00 177.93 181.00 2fcc h LEU 17 N 0.04 0.41 -0.61 2.43 5.85 0.12 -2.24 115.31 121.30 2fcc h LEU 17 Ca -0.03 -0.28 -0.05 0.00 0.84 0.00 0.00 57.88 58.36 2fcc h LEU 17 Cb 1.55 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 42.45 2fcc h LEU 17 CO 0.12 0.59 0.17 -0.03 -0.34 0.00 0.00 178.44 178.95 2fcc h MET 18 N 0.22 0.97 0.58 1.25 4.05 -1.31 -1.59 114.93 119.10 2fcc h MET 18 Ca 0.07 -0.22 -0.02 0.00 -0.28 0.00 0.00 59.70 59.25 2fcc h MET 18 Cb 0.36 -0.13 -0.01 0.00 -0.80 0.00 0.00 31.60 31.02 2fcc h MET 18 CO 0.01 0.87 -0.36 0.00 0.23 0.00 0.00 176.91 177.66 2fcc h ALA 19 N 1.05 -0.90 -0.53 0.39 0.00 -1.36 -2.25 119.26 115.67 2fcc h ALA 19 Ca 0.20 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 2fcc h ALA 19 Cb 0.32 0.44 -0.03 0.00 0.00 0.00 0.00 17.79 18.53 2fcc h ALA 19 CO -0.00 -1.02 0.26 1.49 0.00 0.00 0.00 179.25 179.97 2fcc h GLU 20 N -0.89 0.73 -0.92 0.00 4.81 -1.38 -0.69 114.58 116.24 2fcc h GLU 20 Ca -0.07 -0.08 0.04 0.00 -0.13 0.00 0.00 59.36 59.12 2fcc h GLU 20 Cb 0.72 -0.14 -0.06 0.00 0.63 0.00 0.00 28.75 29.90 2fcc h GLU 20 CO 0.07 0.56 0.59 -0.92 -0.73 0.00 0.00 179.01 178.58 2fcc h TYR 21 N 0.73 1.11 0.00 0.92 3.20 -0.97 -0.60 116.97 121.37 2fcc h TYR 21 Ca 0.18 0.03 -0.05 0.00 3.14 0.00 0.00 58.73 62.03 2fcc h TYR 21 Cb 0.07 -0.37 -0.01 0.00 1.54 0.00 0.00 36.73 37.96 2fcc h TYR 21 CO 0.01 0.62 -0.93 0.07 -1.64 0.00 0.00 178.16 176.29 2fcc h ARG 22 N 1.14 0.00 0.12 1.82 0.11 -0.94 -3.39 114.38 113.23 2fcc h ARG 22 Ca 0.37 0.00 -0.33 0.00 0.10 0.00 0.00 59.98 60.12 2fcc h ARG 22 Cb 0.04 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.11 2fcc h ARG 22 CO -0.13 0.11 -1.77 0.93 0.10 0.00 0.00 179.97 179.21 2fcc h GLU 23 N 0.00 0.25 -0.85 0.08 5.08 -0.83 -3.39 114.58 114.92 2fcc h GLU 23 Ca -0.04 -0.43 0.09 0.00 -1.00 0.00 0.00 59.36 57.99 2fcc h GLU 23 Cb 1.18 0.16 -0.07 0.00 0.50 0.00 0.00 28.75 30.51 2fcc h GLU 23 CO 0.02 1.10 0.50 1.25 -1.00 0.00 0.00 179.01 180.87 2fcc h LEU 24 N 0.07 0.72 -0.77 1.33 6.46 -1.31 -0.70 115.31 121.11 2fcc h LEU 24 Ca -0.34 0.05 0.00 0.00 -0.12 0.00 0.00 57.88 57.47 2fcc h LEU 24 Cb 2.04 -0.09 0.00 0.00 -0.73 0.00 0.00 40.66 41.88 2fcc h LEU 24 CO 0.13 0.41 0.00 -2.65 -0.62 0.00 0.00 178.44 175.71 2fcc n PRO 25 N -4.72 0.11 0.25 5.25 -0.02 -1.26 -1.86 135.00 132.75 2fcc n PRO 25 Ca 0.14 0.50 0.10 0.00 -2.02 0.00 0.00 63.50 62.22 2fcc n PRO 25 Cb 0.28 -1.79 0.66 0.00 -0.02 0.00 0.00 33.50 32.63 2fcc n PRO 25 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2fcc h ARG 26 N 0.00 0.00 -0.50 -0.52 3.08 -1.34 -2.48 114.38 112.61 2fcc h ARG 26 Ca 0.00 0.00 -0.10 0.00 0.07 0.00 0.00 59.98 59.95 2fcc h ARG 26 Cb 0.14 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.17 2fcc h ARG 26 CO 0.00 0.12 -0.09 0.28 -1.07 0.00 0.00 179.97 179.21 2fcc h VAL 27 N 0.00 1.26 -0.51 2.04 2.07 -1.53 -1.07 116.25 118.51 2fcc h VAL 27 Ca -0.00 -1.19 0.00 0.00 0.82 0.00 0.00 66.70 66.33 2fcc h VAL 27 Cb 0.24 0.96 -0.02 0.00 -1.52 0.00 0.00 31.29 30.95 2fcc h VAL 27 CO 0.02 0.42 0.32 -0.26 0.02 0.00 0.00 177.57 178.09 2fcc h PHE 28 N 0.82 0.66 -0.30 1.57 0.04 -1.62 -0.96 116.94 117.15 2fcc h PHE 28 Ca 0.14 0.01 -0.01 0.00 2.80 0.00 0.00 57.97 60.90 2fcc h PHE 28 Cb 0.61 -0.22 -0.01 0.00 2.20 0.00 0.00 35.95 38.53 2fcc h PHE 28 CO 0.04 0.43 0.14 0.78 -0.60 0.00 0.00 178.31 179.10 2fcc h GLY 29 N 0.69 0.46 0.78 -1.45 0.00 -1.46 -0.21 103.07 101.88 2fcc h GLY 29 Ca 0.19 -0.23 0.04 0.00 0.00 0.00 0.00 47.33 47.32 2fcc h GLY 29 CO -0.04 0.22 0.39 0.00 0.00 0.00 0.00 176.54 177.11 2fcc h ALA 30 N 0.99 0.87 -0.20 3.60 0.00 -0.84 -1.43 119.26 122.26 2fcc h ALA 30 Ca 0.10 -0.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.95 2fcc h ALA 30 Cb 0.13 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 2fcc h ALA 30 CO -0.01 0.11 -0.09 0.28 0.00 0.00 0.00 179.25 179.54 2fcc h VAL 31 N 0.74 1.30 -0.70 0.00 2.07 -0.97 -2.47 116.25 116.22 2fcc h VAL 31 Ca 0.28 -1.13 0.07 0.00 0.82 0.00 0.00 66.70 66.73 2fcc h VAL 31 Cb 0.10 1.63 -0.06 0.00 -1.52 0.00 0.00 31.29 31.44 2fcc h VAL 31 CO -0.14 0.34 0.38 -0.09 0.02 0.00 0.00 177.57 178.09 2fcc h ARG 32 N 0.11 0.68 -0.56 1.57 2.43 -0.76 0.16 114.38 118.01 2fcc h ARG 32 Ca 0.05 -0.04 -0.02 0.00 -0.81 0.00 0.00 59.98 59.16 2fcc h ARG 32 Cb 0.57 -0.15 -0.03 0.00 -0.42 0.00 0.00 29.97 29.94 2fcc h ARG 32 CO 0.03 0.45 0.27 -0.22 -1.51 0.00 0.00 179.97 178.99 2fcc h LYS 33 N 0.70 0.78 -0.37 0.20 3.64 -1.23 0.07 116.57 120.36 2fcc h LYS 33 Ca 0.32 -0.09 -0.13 0.00 -1.27 0.00 0.00 60.65 59.47 2fcc h LYS 33 Cb 0.23 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 31.89 2fcc h LYS 33 CO -0.20 0.60 -0.28 0.45 -2.27 0.00 0.00 179.45 177.76 2fcc h HIS 34 N 0.78 0.99 -0.07 1.91 3.86 -0.56 -2.43 115.15 119.64 2fcc h HIS 34 Ca 0.20 -0.28 -0.05 0.00 -1.16 0.00 0.00 60.37 59.08 2fcc h HIS 34 Cb 0.08 -0.22 -0.01 0.00 1.06 0.00 0.00 27.41 28.32 2fcc h HIS 34 CO 0.01 1.06 -0.19 0.28 0.86 0.00 0.00 177.93 179.95 2fcc h VAL 35 N 0.64 1.18 -0.86 2.45 2.07 -0.18 -0.06 116.25 121.48 2fcc h VAL 35 Ca 0.07 -0.81 -0.02 0.00 0.82 0.00 0.00 66.70 66.76 2fcc h VAL 35 Cb 0.85 1.33 -0.04 0.00 -1.52 0.00 0.00 31.29 31.92 2fcc h VAL 35 CO 0.07 0.24 0.46 0.00 0.02 0.00 0.00 177.57 178.37 2fcc h ALA 36 N 1.70 1.18 -0.19 1.67 0.00 -0.54 -1.35 119.26 121.73 2fcc h ALA 36 Ca 0.02 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.80 2fcc h ALA 36 Cb 0.40 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 17.85 2fcc h ALA 36 CO 0.03 0.65 0.00 0.09 0.00 0.00 0.00 179.25 180.02 2fcc n ASN 37 N -4.33 2.39 0.00 0.00 3.02 -0.62 -4.87 115.26 110.86 2fcc n ASN 37 Ca 0.09 -2.27 0.00 0.00 -0.03 0.00 0.00 54.58 52.37 2fcc n ASN 37 Cb 0.11 -0.52 0.00 0.00 -0.61 0.00 0.00 39.78 38.76 2fcc n ASN 37 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2fcc n GLY 38 N 0.27 0.52 3.74 7.41 0.00 -0.51 -4.99 105.19 111.63 2fcc n GLY 38 Ca 0.09 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.74 2fcc n GLY 38 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2fcc s LYS 39 N -0.44 2.81 0.32 1.61 -0.14 -0.13 -4.97 119.74 118.80 2fcc s LYS 39 Ca 0.00 2.03 0.08 0.00 -1.36 0.00 0.00 55.97 56.72 2fcc s LYS 39 Cb 0.00 -1.96 -0.06 0.00 -1.68 0.00 0.00 37.83 34.13 2fcc s LYS 39 CO 0.00 -1.39 -0.08 1.03 -0.76 0.00 0.00 175.35 174.16 2fcc s ARG 40 N -3.25 1.72 0.33 1.68 1.81 -1.26 -4.44 118.95 115.54 2fcc s ARG 40 Ca 0.79 -1.88 0.02 0.00 -1.72 0.00 0.00 55.73 52.93 2fcc s ARG 40 Cb -0.36 -1.48 0.59 0.00 -0.45 0.00 0.00 34.95 33.25 2fcc s ARG 40 CO 0.39 0.09 1.98 0.28 -0.68 0.00 0.00 175.30 177.37 2fcc h VAL 41 N 2.11 1.15 0.00 3.52 2.07 -1.96 -1.66 116.25 121.48 2fcc h VAL 41 Ca -0.41 -0.32 0.00 0.00 0.82 0.00 0.00 66.70 66.79 2fcc h VAL 41 Cb 1.24 0.14 0.00 0.00 -1.52 0.00 0.00 31.29 31.15 2fcc h VAL 41 CO 0.69 0.17 0.00 0.08 0.02 0.00 0.00 177.57 178.53 2fcc h ARG 42 N 0.93 0.00 -0.00 1.57 0.11 -1.98 -2.74 114.38 112.27 2fcc h ARG 42 Ca 0.28 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.36 2fcc h ARG 42 Cb -0.02 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.06 2fcc h ARG 42 CO -0.07 0.00 0.00 -0.25 0.10 0.00 0.00 179.97 179.75 2fcc n ASP 43 N -2.72 0.03 -4.51 0.08 8.00 -0.62 -4.83 116.55 111.98 2fcc n ASP 43 Ca 0.00 -1.37 -0.25 0.00 0.71 0.00 0.00 54.79 53.88 2fcc n ASP 43 Cb 0.20 -0.00 -0.10 0.00 -0.02 0.00 0.00 41.12 41.20 2fcc n ASP 43 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 2fcc s PHE 44 N -2.00 2.44 0.00 1.24 0.08 -1.04 -4.99 117.98 113.72 2fcc s PHE 44 Ca 0.31 -0.30 0.00 0.00 0.12 0.00 0.00 56.93 57.06 2fcc s PHE 44 Cb 0.14 -1.14 0.00 0.00 -0.57 0.00 0.00 43.02 41.45 2fcc s PHE 44 CO 0.24 0.59 0.23 1.17 -0.10 0.00 0.00 175.22 177.35 2fcc n LYS 45 N -0.25 0.00 -1.86 0.44 3.00 -1.26 -5.03 118.16 113.20 2fcc n LYS 45 Ca -0.09 0.00 -0.01 0.00 -0.00 0.00 0.00 58.31 58.22 2fcc n LYS 45 Cb 0.58 -0.69 -0.01 0.00 0.00 0.00 0.00 35.03 34.91 2fcc n LYS 45 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.40 176.51 2fcc n ILE 46 N -0.29 -5.43 -1.71 3.15 5.41 -1.26 -4.98 119.36 114.25 2fcc n ILE 46 Ca 0.00 0.68 -0.39 0.00 1.00 0.00 0.00 62.75 64.03 2fcc n ILE 46 Cb 0.00 -4.73 0.03 0.00 -0.71 0.00 0.00 39.64 34.23 2fcc n ILE 46 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 176.55 176.31 2fcc n SER 47 N 0.33 2.36 0.26 4.38 2.88 -1.26 -4.89 113.62 117.68 2fcc n SER 47 Ca -0.05 1.00 0.16 0.00 -1.33 0.00 0.00 58.87 58.65 2fcc n SER 47 Cb 0.08 -1.52 0.59 0.00 -0.75 0.00 0.00 64.21 62.60 2fcc n SER 47 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 2fcc h PRO 48 N 1.54 0.00 -5.55 -1.46 0.13 -2.00 -3.44 132.00 121.23 2fcc h PRO 48 Ca -0.49 0.00 -0.45 0.00 -0.87 0.00 0.00 66.00 64.19 2fcc h PRO 48 Cb 1.31 0.00 -0.21 0.00 0.13 0.00 0.00 31.00 32.23 2fcc h PRO 48 CO 0.57 0.02 -0.79 0.95 -0.23 0.00 0.00 178.00 178.52 2fcc s THR 49 N -3.59 1.30 0.28 1.56 -4.23 -1.26 -5.12 115.64 104.57 2fcc s THR 49 Ca 0.02 -1.45 -0.30 0.00 -1.18 0.00 0.00 61.69 58.78 2fcc s THR 49 Cb 0.08 -1.28 -0.12 0.00 1.34 0.00 0.00 72.50 72.52 2fcc s THR 49 CO 0.57 -0.23 1.48 0.33 -0.54 0.00 0.00 174.62 176.24 2fcc n PHE 50 N 1.07 2.51 -3.93 3.99 7.35 -1.26 -5.01 117.46 122.19 2fcc n PHE 50 Ca -0.20 0.37 -0.09 0.00 -0.76 0.00 0.00 57.45 56.77 2fcc n PHE 50 Cb 0.55 -2.52 -0.09 0.00 0.35 0.00 0.00 39.48 37.77 2fcc n PHE 50 CO 0.00 0.00 0.00 0.96 -0.76 0.00 0.00 176.76 176.96 2fcc s ILE 51 N -0.17 0.15 0.38 -2.13 -0.00 -1.26 -4.99 121.20 113.17 2fcc s ILE 51 Ca 0.65 -1.23 0.08 0.00 -0.00 0.00 0.00 60.65 60.14 2fcc s ILE 51 Cb -0.57 -1.14 -0.02 0.00 -0.00 0.00 0.00 42.46 40.73 2fcc s ILE 51 CO 0.51 -0.68 0.33 -0.76 -0.00 0.00 0.00 174.94 174.34 2fcc s LEU 52 N -2.48 3.49 0.00 0.37 1.43 -1.26 -4.18 118.68 116.05 2fcc s LEU 52 Ca 0.00 -0.62 0.00 0.00 -1.03 0.00 0.00 54.13 52.48 2fcc s LEU 52 Cb 0.02 -2.13 0.00 0.00 0.03 0.00 0.00 46.19 44.12 2fcc s LEU 52 CO -0.07 -0.50 0.00 0.61 0.23 0.00 0.00 176.35 176.62 2fcc n GLY 53 N -1.45 -0.59 3.64 -3.19 0.00 -1.26 -4.67 105.19 97.66 2fcc n GLY 53 Ca 0.01 -1.15 -0.48 0.00 0.00 0.00 0.00 46.02 44.40 2fcc n GLY 53 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fcc n ALA 54 N 4.47 0.54 0.00 4.61 0.00 -1.26 -1.18 120.51 127.69 2fcc n ALA 54 Ca 0.00 0.47 0.00 0.00 0.00 0.00 0.00 53.44 53.91 2fcc n ALA 54 Cb 0.00 -2.25 0.00 0.00 0.00 0.00 0.00 19.45 17.20 2fcc n ALA 54 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2fcc n GLY 55 N 3.02 1.52 0.26 0.00 0.00 -1.26 -4.96 105.19 103.77 2fcc n GLY 55 Ca 0.17 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.08 2fcc n GLY 55 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 2fcc h HIS 56 N 0.00 -0.61 -0.17 1.61 6.17 -1.31 -0.30 115.15 120.54 2fcc h HIS 56 Ca 0.00 0.02 -0.09 0.00 0.71 0.00 0.00 60.37 61.01 2fcc h HIS 56 Cb 0.00 0.27 -0.00 0.00 2.52 0.00 0.00 27.41 30.19 2fcc h HIS 56 CO 0.00 -0.32 -0.23 0.28 0.71 0.00 0.00 177.93 178.37 2fcc h VAL 57 N -0.37 1.34 -0.51 5.26 2.07 -1.89 -3.06 116.25 119.10 2fcc h VAL 57 Ca 0.05 -1.44 0.10 0.00 0.82 0.00 0.00 66.70 66.24 2fcc h VAL 57 Cb 0.44 1.87 -0.03 0.00 -1.52 0.00 0.00 31.29 32.05 2fcc h VAL 57 CO -0.19 0.43 0.35 0.74 0.02 0.00 0.00 177.57 178.92 2fcc h THR 58 N 0.11 0.86 -0.61 2.57 2.02 -1.95 -1.35 112.91 114.56 2fcc h THR 58 Ca 0.02 -0.09 0.18 0.00 0.77 0.00 0.00 66.41 67.29 2fcc h THR 58 Cb 0.80 0.59 -0.02 0.00 -1.74 0.00 0.00 68.15 67.78 2fcc h THR 58 CO 0.06 0.05 0.45 0.15 0.37 0.00 0.00 175.52 176.59 2fcc h PHE 59 N 0.25 0.00 -0.03 3.16 3.57 -0.93 0.37 116.94 123.33 2fcc h PHE 59 Ca 0.24 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.74 2fcc h PHE 59 Cb 0.61 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.35 2fcc h PHE 59 CO -0.00 0.00 -0.03 1.19 -2.23 0.00 0.00 178.31 177.24 2fcc n PHE 60 N -4.27 0.00 -0.02 0.41 3.01 -0.51 -4.36 117.46 111.71 2fcc n PHE 60 Ca 0.12 0.00 0.20 0.00 1.01 0.00 0.00 57.45 58.78 2fcc n PHE 60 Cb 0.70 -0.00 0.68 0.00 -0.01 0.00 0.00 39.48 40.84 2fcc n PHE 60 CO 0.00 0.00 0.00 1.88 1.01 0.00 0.00 176.76 179.65 2fcc h TYR 61 N 3.96 0.03 -0.42 1.38 -1.99 -0.96 0.20 116.97 119.18 2fcc h TYR 61 Ca 0.00 0.00 -0.02 0.00 2.00 0.00 0.00 58.73 60.71 2fcc h TYR 61 Cb 0.86 -0.01 -0.01 0.00 2.00 0.00 0.00 36.73 39.56 2fcc h TYR 61 CO 0.00 0.01 0.02 -0.40 -0.00 0.00 0.00 178.16 177.79 2fcc n ASP 62 N -4.38 4.61 -1.86 3.88 5.75 -1.26 -4.49 116.55 118.81 2fcc n ASP 62 Ca 0.10 -3.03 -0.07 0.00 -0.01 0.00 0.00 54.79 51.79 2fcc n ASP 62 Cb 0.61 -0.62 0.07 0.00 -1.03 0.00 0.00 41.12 40.16 2fcc n ASP 62 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 2fcc n LYS 63 N -0.09 2.08 0.26 0.11 5.02 0.71 -2.35 118.16 123.91 2fcc n LYS 63 Ca 0.26 -3.45 0.10 0.00 -2.02 0.00 0.00 58.31 53.19 2fcc n LYS 63 Cb 1.05 -1.58 0.71 0.00 -0.02 0.00 0.00 35.03 35.18 2fcc n LYS 63 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 2fcc h LEU 64 N 1.86 0.00 -0.93 -0.35 3.38 -1.44 -0.64 115.31 117.19 2fcc h LEU 64 Ca 0.05 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.91 2fcc h LEU 64 Cb 1.41 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.15 2fcc h LEU 64 CO 0.33 0.05 -0.49 -0.08 0.09 0.00 0.00 178.44 178.35 2fcc h GLU 65 N 0.00 0.11 -0.33 1.13 4.57 -1.69 0.40 114.58 118.77 2fcc h GLU 65 Ca -0.00 -0.06 -0.10 0.00 -1.18 0.00 0.00 59.36 58.02 2fcc h GLU 65 Cb 0.10 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.68 2fcc h GLU 65 CO 0.01 0.58 -0.17 0.35 -1.18 0.00 0.00 179.01 178.59 2fcc h PHE 66 N 0.09 0.82 -0.45 0.92 3.57 -0.99 -2.61 116.94 118.29 2fcc h PHE 66 Ca 0.00 -0.21 -0.11 0.00 3.53 0.00 0.00 57.97 61.18 2fcc h PHE 66 Cb 0.89 -0.19 -0.01 0.00 2.79 0.00 0.00 35.95 39.44 2fcc h PHE 66 CO 0.01 0.92 -0.16 -0.07 -2.23 0.00 0.00 178.31 176.78 2fcc h LEU 67 N 0.48 0.92 -0.48 0.59 3.38 -0.88 -1.81 115.31 117.51 2fcc h LEU 67 Ca 0.07 -0.38 0.04 0.00 0.09 0.00 0.00 57.88 57.70 2fcc h LEU 67 Cb 0.71 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 41.17 2fcc h LEU 67 CO 0.05 1.09 0.25 -0.09 0.09 0.00 0.00 178.44 179.83 2fcc h ARG 68 N 0.74 0.48 0.00 1.13 2.43 -0.19 0.32 114.38 119.29 2fcc h ARG 68 Ca 0.11 -0.03 -0.09 0.00 -0.81 0.00 0.00 59.98 59.16 2fcc h ARG 68 Cb 0.72 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 30.15 2fcc h ARG 68 CO 0.05 0.32 -0.41 0.87 -1.51 0.00 0.00 179.97 179.29 2fcc h LYS 69 N 0.49 0.00 0.03 0.20 1.57 -1.34 -2.72 116.57 114.80 2fcc h LYS 69 Ca 0.21 0.00 -0.23 0.00 -1.87 0.00 0.00 60.65 58.76 2fcc h LYS 69 Cb 0.10 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.41 2fcc h LYS 69 CO -0.14 0.41 -0.99 -0.09 -0.57 0.00 0.00 179.45 178.08 2fcc h ARG 70 N 0.00 0.33 -0.10 3.15 2.43 -0.55 -3.18 114.38 116.46 2fcc h ARG 70 Ca -0.00 -0.39 -0.06 0.00 -0.81 0.00 0.00 59.98 58.71 2fcc h ARG 70 Cb 0.78 0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 30.44 2fcc h ARG 70 CO 0.05 1.10 -0.20 0.37 -1.51 0.00 0.00 179.97 179.78 2fcc h GLN 71 N 0.17 0.16 -0.69 0.20 5.75 -0.72 0.01 115.11 119.98 2fcc h GLN 71 Ca -0.08 -0.04 -0.07 0.00 -0.15 0.00 0.00 58.65 58.31 2fcc h GLN 71 Cb 1.65 -0.02 -0.03 0.00 1.07 0.00 0.00 27.48 30.15 2fcc h GLN 71 CO 0.17 0.36 0.17 0.82 -2.65 0.00 0.00 178.83 177.70 2fcc h ILE 72 N 0.15 1.26 -0.24 2.39 2.04 -1.48 0.02 117.51 121.65 2fcc h ILE 72 Ca 0.03 -0.96 -0.18 0.00 1.00 0.00 0.00 64.86 64.75 2fcc h ILE 72 Cb 0.45 0.54 0.00 0.00 -0.74 0.00 0.00 36.82 37.07 2fcc h ILE 72 CO 0.03 0.37 -0.55 -0.33 0.00 0.00 0.00 178.15 177.67 2fcc h GLU 73 N 1.05 0.79 -0.71 2.37 5.08 -1.35 -2.04 114.58 119.77 2fcc h GLU 73 Ca 0.22 -0.53 -0.00 0.00 -1.00 0.00 0.00 59.36 58.04 2fcc h GLU 73 Cb 0.36 0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.65 2fcc h GLU 73 CO 0.00 1.16 0.44 -0.07 -1.00 0.00 0.00 179.01 179.54 2fcc h LEU 74 N 0.54 0.85 0.16 1.33 3.38 -0.76 -0.25 115.31 120.55 2fcc h LEU 74 Ca -0.00 -0.06 -0.01 0.00 0.09 0.00 0.00 57.88 57.91 2fcc h LEU 74 Cb 1.16 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.70 2fcc h LEU 74 CO 0.12 0.65 -0.08 0.40 0.09 0.00 0.00 178.44 179.63 2fcc h ILE 75 N 0.97 0.89 -0.93 1.22 2.04 -0.95 -0.26 117.51 120.49 2fcc h ILE 75 Ca 0.26 -0.23 0.05 0.00 1.00 0.00 0.00 64.86 65.94 2fcc h ILE 75 Cb -0.04 1.04 -0.06 0.00 -0.74 0.00 0.00 36.82 37.01 2fcc h ILE 75 CO -0.05 0.05 0.59 0.00 0.00 0.00 0.00 178.15 178.75 2fcc h ALA 76 N 0.49 1.25 -0.23 1.87 0.00 -1.11 -1.26 119.26 120.28 2fcc h ALA 76 Ca -0.02 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 2fcc h ALA 76 Cb 0.26 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 2fcc h ALA 76 CO 0.04 0.41 0.06 1.49 0.00 0.00 0.00 179.25 181.24 2fcc h GLU 77 N 1.11 0.37 -0.67 0.00 4.57 -0.88 -0.33 114.58 118.75 2fcc h GLU 77 Ca 0.39 -0.09 0.10 0.00 -1.18 0.00 0.00 59.36 58.58 2fcc h GLU 77 Cb 0.09 -0.05 -0.08 0.00 -0.16 0.00 0.00 28.75 28.56 2fcc h GLU 77 CO -0.15 0.48 0.28 0.00 -1.18 0.00 0.00 179.01 178.44 2fcc h LEU 79 N 0.48 0.58 -1.08 0.00 3.38 -1.03 -0.49 115.31 117.16 2fcc h LEU 79 Ca 0.34 -0.27 0.01 0.00 0.09 0.00 0.00 57.88 58.05 2fcc h LEU 79 Cb 0.42 -0.16 -0.05 0.00 0.09 0.00 0.00 40.66 40.96 2fcc h LEU 79 CO -0.31 0.94 0.62 0.11 0.09 0.00 0.00 178.44 179.89 2fcc h LYS 80 N 0.44 1.23 -0.00 1.13 1.57 -0.02 -1.93 116.57 118.99 2fcc h LYS 80 Ca 0.03 -0.08 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 2fcc h LYS 80 Cb 0.94 -0.28 0.00 0.00 0.08 0.00 0.00 32.23 32.97 2fcc h LYS 80 CO 0.08 0.82 -0.04 0.54 -0.57 0.00 0.00 179.45 180.28 2fcc n ARG 81 N -4.39 0.97 -0.41 3.15 1.74 -0.64 -4.91 116.66 112.16 2fcc n ARG 81 Ca 0.11 -0.28 0.00 0.00 -0.77 0.00 0.00 57.85 56.91 2fcc n ARG 81 Cb 0.02 -1.49 0.00 0.00 -1.02 0.00 0.00 32.46 29.96 2fcc n ARG 81 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2fcc n GLY 82 N 1.16 0.79 3.75 -0.13 0.00 -0.72 -4.96 105.19 105.08 2fcc n GLY 82 Ca 0.19 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.79 2fcc n GLY 82 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2fcc s PHE 83 N -2.03 2.94 -1.07 1.61 0.40 -0.21 -4.90 117.98 114.72 2fcc s PHE 83 Ca 0.00 1.05 -0.04 0.00 -0.60 0.00 0.00 56.93 57.33 2fcc s PHE 83 Cb 0.00 -3.86 0.15 0.00 0.51 0.00 0.00 43.02 39.81 2fcc s PHE 83 CO 0.00 -2.75 2.37 0.09 0.70 0.00 0.00 175.22 175.63 2fcc n ASN 84 N 1.95 7.59 -4.77 1.36 3.02 -1.26 -4.54 115.26 118.60 2fcc n ASN 84 Ca 0.06 -3.27 -0.35 0.00 -0.03 0.00 0.00 54.58 50.98 2fcc n ASN 84 Cb 0.40 -1.29 -0.00 0.00 -0.61 0.00 0.00 39.78 38.27 2fcc n ASN 84 CO 0.00 0.00 0.00 0.27 -2.62 0.00 0.00 177.26 174.91 2fcc s ILE 85 N -2.05 3.19 -0.18 2.41 -4.36 -1.26 -5.00 121.20 113.95 2fcc s ILE 85 Ca 0.53 0.77 -0.12 0.00 -0.26 0.00 0.00 60.65 61.57 2fcc s ILE 85 Cb 0.24 -3.33 -0.22 0.00 1.25 0.00 0.00 42.46 40.41 2fcc s ILE 85 CO -0.14 -0.13 0.19 0.29 0.24 0.00 0.00 174.94 175.39 2fcc n LYS 86 N -1.11 0.66 -2.83 0.37 4.76 -1.26 -4.74 118.16 114.02 2fcc n LYS 86 Ca 0.11 0.37 -0.43 0.00 -2.87 0.00 0.00 58.31 55.49 2fcc n LYS 86 Cb 0.50 -1.69 -0.04 0.00 -1.84 0.00 0.00 35.03 31.97 2fcc n LYS 86 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 2fcc s ASP 87 N -6.97 6.20 0.00 4.39 1.01 -1.26 -4.86 116.67 115.17 2fcc s ASP 87 Ca -0.27 -0.84 0.21 0.00 0.71 0.00 0.00 52.55 52.35 2fcc s ASP 87 Cb 0.07 -2.43 0.57 0.00 1.01 0.00 0.00 42.92 42.14 2fcc s ASP 87 CO 0.66 -1.45 1.48 0.35 0.21 0.00 0.00 175.17 176.43 2fcc n THR 88 N 6.01 0.82 -4.17 -1.27 -2.24 -1.26 -4.93 114.28 107.23 2fcc n THR 88 Ca -0.02 -0.86 -0.15 0.00 -2.27 0.00 0.00 64.05 60.75 2fcc n THR 88 Cb 0.46 0.52 -0.11 0.00 -2.10 0.00 0.00 70.33 69.11 2fcc n THR 88 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2fcc s THR 89 N -1.18 0.97 0.24 4.28 -4.23 -1.26 -4.96 115.64 109.49 2fcc s THR 89 Ca 0.44 -1.56 -0.19 0.00 -1.18 0.00 0.00 61.69 59.19 2fcc s THR 89 Cb 0.23 -1.28 -0.08 0.00 1.34 0.00 0.00 72.50 72.71 2fcc s THR 89 CO 0.31 -0.49 0.73 -0.69 -0.54 0.00 0.00 174.62 173.94 2fcc s VAL 90 N -2.17 4.57 0.72 2.29 1.01 -1.26 -5.03 120.40 120.53 2fcc s VAL 90 Ca 0.04 1.26 -0.15 0.00 0.00 0.00 0.00 61.98 63.13 2fcc s VAL 90 Cb -0.05 -3.84 0.03 0.00 0.00 0.00 0.00 36.38 32.53 2fcc s VAL 90 CO 0.01 0.16 1.18 0.00 0.00 0.00 0.00 175.10 176.45 2fcc s GLN 91 N -2.09 2.24 0.18 2.72 -2.07 -1.26 -4.94 119.66 114.44 2fcc s GLN 91 Ca 0.44 1.67 -0.30 0.00 -1.82 0.00 0.00 55.36 55.36 2fcc s GLN 91 Cb -0.16 -1.85 -0.08 0.00 -1.09 0.00 0.00 33.01 29.83 2fcc s GLN 91 CO 0.21 -1.74 1.16 0.34 -1.32 0.00 0.00 175.29 173.94 2fcc s ASP 92 N -2.17 7.15 0.00 12.60 2.15 -1.26 -4.91 116.67 130.23 2fcc s ASP 92 Ca 0.72 2.17 0.00 0.00 0.43 0.00 0.00 52.55 55.88 2fcc s ASP 92 Cb -0.27 -2.61 0.00 0.00 -0.30 0.00 0.00 42.92 39.74 2fcc s ASP 92 CO 0.45 -0.31 0.97 2.30 -0.17 0.00 0.00 175.17 178.40 2fcc n ILE 93 N 2.46 0.93 0.44 4.11 -5.35 -1.26 -4.69 119.36 116.00 2fcc n ILE 93 Ca 0.04 -0.95 0.05 0.00 -0.27 0.00 0.00 62.75 61.61 2fcc n ILE 93 Cb 0.45 0.53 0.23 0.00 -1.74 0.00 0.00 39.64 39.12 2fcc n ILE 93 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 2fcc n SER 94 N -0.47 0.00 0.08 7.28 3.41 -1.26 -1.46 113.62 121.20 2fcc n SER 94 Ca 0.00 0.16 0.12 0.00 -0.26 0.00 0.00 58.87 58.89 2fcc n SER 94 Cb 0.25 -0.29 0.17 0.00 -0.26 0.00 0.00 64.21 64.09 2fcc n SER 94 CO 0.00 0.00 0.00 -2.24 -0.16 0.00 0.00 175.04 172.64 2fcc h ASP 95 N 0.00 0.00 -3.43 4.04 2.03 -2.02 -3.46 116.42 113.58 2fcc h ASP 95 Ca 0.00 -0.15 -0.54 0.00 -0.73 0.00 0.00 57.03 55.61 2fcc h ASP 95 Cb 0.09 0.00 -0.04 0.00 -0.83 0.00 0.00 39.33 38.55 2fcc h ASP 95 CO 0.00 0.08 0.12 -0.63 -1.03 0.00 0.00 179.24 177.77 2fcc s ILE 96 N -3.19 4.53 0.17 4.15 1.01 -0.54 -5.01 121.20 122.33 2fcc s ILE 96 Ca 0.06 1.56 -0.33 0.00 0.00 0.00 0.00 60.65 61.94 2fcc s ILE 96 Cb 0.12 -4.07 -0.15 0.00 0.01 0.00 0.00 42.46 38.37 2fcc s ILE 96 CO 0.71 0.50 1.21 -2.65 0.00 0.00 0.00 174.94 174.72 2fcc n PRO 97 N 1.86 1.28 -0.25 2.79 -0.02 -1.26 -4.84 135.00 134.56 2fcc n PRO 97 Ca -0.06 0.46 0.32 0.00 -2.02 0.00 0.00 63.50 62.19 2fcc n PRO 97 Cb 0.49 -1.99 0.73 0.00 -0.02 0.00 0.00 33.50 32.72 2fcc n PRO 97 CO 0.00 0.00 0.00 0.37 1.98 0.00 0.00 175.50 177.85 2fcc h GLN 98 N 3.62 0.01 0.00 -0.52 -0.00 -1.94 -1.41 115.11 114.86 2fcc h GLN 98 Ca -0.44 -0.00 -0.02 0.00 -0.00 0.00 0.00 58.65 58.19 2fcc h GLN 98 Cb 1.33 -0.00 -0.00 0.00 0.00 0.00 0.00 27.48 28.81 2fcc h GLN 98 CO 0.72 0.01 -0.11 1.05 0.00 0.00 0.00 178.83 180.49 2fcc h GLU 99 N 0.01 0.00 0.00 1.69 4.11 -1.98 -1.34 114.58 117.07 2fcc h GLU 99 Ca 0.50 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.93 2fcc h GLU 99 Cb 1.98 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.23 2fcc h GLU 99 CO -0.01 0.11 -0.36 1.19 0.07 0.00 0.00 179.01 180.01 2fcc n PHE 100 N -4.31 0.69 -2.24 2.06 3.72 -0.53 -4.39 117.46 112.46 2fcc n PHE 100 Ca -0.03 0.20 -0.39 0.00 -0.05 0.00 0.00 57.45 57.18 2fcc n PHE 100 Cb 0.19 -0.76 0.02 0.00 -0.94 0.00 0.00 39.48 37.98 2fcc n PHE 100 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 2fcc n ARG 101 N -2.15 4.21 -3.23 -1.08 1.74 -0.50 -1.92 116.66 113.73 2fcc n ARG 101 Ca 0.04 -3.98 -0.26 0.00 -0.77 0.00 0.00 57.85 52.89 2fcc n ARG 101 Cb 0.43 -2.39 -0.02 0.00 -1.02 0.00 0.00 32.46 29.46 2fcc n ARG 101 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 2fcc s GLY 102 N -0.95 1.51 0.33 -0.13 0.00 -0.99 -4.25 107.32 102.84 2fcc s GLY 102 Ca 0.47 -0.74 -0.03 0.00 0.00 0.00 0.00 44.72 44.42 2fcc s GLY 102 CO -0.23 -0.65 0.45 1.34 0.00 0.00 0.00 173.10 174.01 2fcc n ASP 103 N -1.63 0.32 -3.64 1.64 -0.08 -1.26 -2.69 116.55 109.21 2fcc n ASP 103 Ca -0.03 -1.34 -0.09 0.00 -1.51 0.00 0.00 54.79 51.83 2fcc n ASP 103 Cb 0.55 -0.32 -0.07 0.00 2.34 0.00 0.00 41.12 43.63 2fcc n ASP 103 CO 0.00 0.00 0.00 -0.47 0.12 0.00 0.00 177.20 176.85 2fcc s TYR 104 N -1.53 -0.69 -0.34 -0.67 5.04 -1.26 -4.78 117.35 113.10 2fcc s TYR 104 Ca 0.28 1.56 0.01 0.00 -2.44 0.00 0.00 57.07 56.48 2fcc s TYR 104 Cb -0.01 0.39 0.11 0.00 0.35 0.00 0.00 41.96 42.79 2fcc s TYR 104 CO 0.19 -0.34 0.11 0.42 -1.34 0.00 0.00 175.55 174.59 2fcc s ILE 105 N 0.74 1.42 0.64 3.14 1.01 -1.26 -4.97 121.20 121.92 2fcc s ILE 105 Ca -0.02 -1.90 -0.17 0.00 0.00 0.00 0.00 60.65 58.55 2fcc s ILE 105 Cb -0.05 -2.05 -0.01 0.00 0.01 0.00 0.00 42.46 40.36 2fcc s ILE 105 CO -0.08 -0.69 1.21 -2.84 0.00 0.00 0.00 174.94 172.54 2fcc s PRO 106 N 1.17 2.71 0.46 2.79 0.02 -1.26 -5.03 135.00 135.86 2fcc s PRO 106 Ca 0.11 1.79 -0.04 0.00 0.02 0.00 0.00 61.00 62.89 2fcc s PRO 106 Cb -0.19 -1.90 -0.03 0.00 0.02 0.00 0.00 34.50 32.40 2fcc s PRO 106 CO -0.16 -1.40 0.74 -1.01 -0.33 0.00 0.00 177.00 174.84 2fcc s HIS 107 N -1.74 3.51 0.42 6.54 3.76 -1.26 -4.89 115.29 121.63 2fcc s HIS 107 Ca 0.76 0.68 0.19 0.00 -0.15 0.00 0.00 55.06 56.54 2fcc s HIS 107 Cb -0.30 -2.25 1.11 0.00 1.11 0.00 0.00 32.58 32.26 2fcc s HIS 107 CO 0.37 -0.24 1.84 0.93 -0.85 0.00 0.00 174.74 176.79 2fcc h GLU 108 N 0.31 0.37 -0.46 1.40 5.08 -1.99 -0.48 114.58 118.82 2fcc h GLU 108 Ca -0.47 -0.02 -0.05 0.00 -1.00 0.00 0.00 59.36 57.81 2fcc h GLU 108 Cb 1.21 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 30.36 2fcc h GLU 108 CO 0.61 0.24 0.09 0.00 -1.00 0.00 0.00 179.01 178.95 2fcc h ALA 109 N 1.60 0.61 -0.25 3.43 0.00 -1.98 -0.17 119.26 122.51 2fcc h ALA 109 Ca 0.50 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 55.18 2fcc h ALA 109 Cb 1.29 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.90 2fcc h ALA 109 CO -0.19 0.32 0.12 0.77 0.00 0.00 0.00 179.25 180.27 2fcc h SER 110 N 0.62 0.32 -0.60 0.00 0.02 -1.49 0.11 113.55 112.55 2fcc h SER 110 Ca 0.14 -0.12 0.00 0.00 -0.84 0.00 0.00 61.79 60.97 2fcc h SER 110 Cb 0.37 -0.08 -0.03 0.00 0.14 0.00 0.00 62.40 62.79 2fcc h SER 110 CO 0.01 0.36 0.39 0.40 -1.14 0.00 0.00 176.83 176.84 2fcc h ILE 111 N 0.27 1.16 -0.08 3.27 2.04 -1.23 -1.59 117.51 121.34 2fcc h ILE 111 Ca 0.08 -0.30 -0.17 0.00 1.00 0.00 0.00 64.86 65.48 2fcc h ILE 111 Cb 0.12 0.28 -0.01 0.00 -0.74 0.00 0.00 36.82 36.47 2fcc h ILE 111 CO -0.01 0.15 -0.67 0.00 0.00 0.00 0.00 178.15 177.63 2fcc h ALA 112 N 1.62 0.70 -0.50 1.87 0.00 -0.42 -1.38 119.26 121.14 2fcc h ALA 112 Ca 0.22 -0.58 -0.10 0.00 0.00 0.00 0.00 54.91 54.45 2fcc h ALA 112 Cb -0.08 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 2fcc h ALA 112 CO -0.05 0.75 -0.10 0.82 0.00 0.00 0.00 179.25 180.68 2fcc h ILE 113 N 0.25 1.26 -0.42 0.00 2.04 -0.15 -0.68 117.51 119.82 2fcc h ILE 113 Ca -0.02 -1.21 -0.07 0.00 1.00 0.00 0.00 64.86 64.55 2fcc h ILE 113 Cb 1.22 0.98 -0.01 0.00 -0.74 0.00 0.00 36.82 38.26 2fcc h ILE 113 CO 0.11 0.42 -0.03 -1.28 0.00 0.00 0.00 178.15 177.37 2fcc h SER 114 N 0.83 0.75 -0.71 1.72 0.87 -1.16 -2.85 113.55 113.00 2fcc h SER 114 Ca 0.14 -0.33 -0.06 0.00 -1.23 0.00 0.00 61.79 60.31 2fcc h SER 114 Cb 0.63 -0.20 -0.03 0.00 -0.44 0.00 0.00 62.40 62.35 2fcc h SER 114 CO 0.04 0.89 0.19 -0.61 -0.53 0.00 0.00 176.83 176.82 2fcc h GLN 115 N 0.58 1.13 -0.67 2.24 5.75 -1.07 -2.67 115.11 120.40 2fcc h GLN 115 Ca 0.11 -0.26 0.00 0.00 -0.15 0.00 0.00 58.65 58.35 2fcc h GLN 115 Cb 0.53 -0.15 -0.03 0.00 1.07 0.00 0.00 27.48 28.89 2fcc h GLN 115 CO 0.03 0.98 0.43 0.00 -2.65 0.00 0.00 178.83 177.62 2fcc h ALA 116 N 1.09 1.48 -0.17 3.38 0.00 -0.99 0.11 119.26 124.17 2fcc h ALA 116 Ca 0.23 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 55.04 2fcc h ALA 116 Cb 0.35 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 2fcc h ALA 116 CO -0.00 0.46 -0.02 -0.09 0.00 0.00 0.00 179.25 179.60 2fcc h ARG 117 N 0.92 0.32 -0.28 0.00 9.65 -1.26 -0.12 114.38 123.60 2fcc h ARG 117 Ca 0.24 -0.11 0.04 0.00 -1.10 0.00 0.00 59.98 59.05 2fcc h ARG 117 Cb -0.07 -0.02 -0.04 0.00 -1.39 0.00 0.00 29.97 28.45 2fcc h ARG 117 CO -0.05 0.56 0.05 -0.07 2.80 0.00 0.00 179.97 183.27 2fcc h LEU 118 N 0.04 0.00 -1.34 3.80 4.07 -1.08 -1.60 115.31 119.20 2fcc h LEU 118 Ca 0.05 0.05 -0.01 0.00 0.08 0.00 0.00 57.88 58.04 2fcc h LEU 118 Cb 0.44 0.06 -0.02 0.00 1.08 0.00 0.00 40.66 42.21 2fcc h LEU 118 CO 0.01 0.04 0.25 0.44 -1.08 0.00 0.00 178.44 178.10 2fcc h ASP 119 N 0.15 0.63 -0.19 -0.43 3.32 -0.64 -1.72 116.42 117.53 2fcc h ASP 119 Ca 0.13 -0.05 -0.10 0.00 0.02 0.00 0.00 57.03 57.03 2fcc h ASP 119 Cb 0.14 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.51 2fcc h ASP 119 CO -0.18 0.53 -0.19 -0.08 -1.72 0.00 0.00 179.24 177.60 2fcc h GLU 120 N 0.70 0.63 -0.30 3.56 4.81 -0.38 -1.22 114.58 122.38 2fcc h GLU 120 Ca 0.18 -0.23 -0.18 0.00 -0.13 0.00 0.00 59.36 59.00 2fcc h GLU 120 Cb 0.06 -0.04 -0.00 0.00 0.63 0.00 0.00 28.75 29.39 2fcc h GLU 120 CO -0.03 0.78 -0.52 0.87 -0.73 0.00 0.00 179.01 179.39 2fcc h LYS 121 N 0.56 0.88 -0.60 1.92 1.79 -0.63 -3.16 116.57 117.34 2fcc h LYS 121 Ca 0.09 -0.54 -0.09 0.00 -2.18 0.00 0.00 60.65 57.92 2fcc h LYS 121 Cb 0.64 0.06 -0.02 0.00 -1.58 0.00 0.00 32.23 31.33 2fcc h LYS 121 CO 0.05 1.18 0.01 0.82 -1.08 0.00 0.00 179.45 180.42 2fcc h ILE 122 N 0.68 1.26 0.00 1.86 2.04 -1.16 -2.46 117.51 119.74 2fcc h ILE 122 Ca 0.02 -1.13 0.00 0.00 1.00 0.00 0.00 64.86 64.75 2fcc h ILE 122 Cb 1.13 0.79 0.00 0.00 -0.74 0.00 0.00 36.82 38.00 2fcc h ILE 122 CO 0.12 0.41 0.00 0.00 0.00 0.00 0.00 178.15 178.68 2fcc h ALA 123 N 1.04 1.00 0.00 1.87 0.00 -1.19 0.67 119.26 122.65 2fcc h ALA 123 Ca 0.17 0.00 -0.11 0.00 0.00 0.00 0.00 54.91 54.97 2fcc h ALA 123 Cb 0.54 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.31 2fcc h ALA 123 CO 0.03 0.00 -0.76 1.96 0.00 0.00 0.00 179.25 180.48 2fcc h GLN 124 N 0.00 0.00 -1.10 0.00 4.20 -1.42 -3.39 115.11 113.40 2fcc h GLN 124 Ca 0.00 0.00 -0.37 0.00 0.06 0.00 0.00 58.65 58.34 2fcc h GLN 124 Cb 0.13 0.00 -0.31 0.00 0.30 0.00 0.00 27.48 27.60 2fcc h GLN 124 CO 0.00 0.41 -0.92 0.54 -0.67 0.00 0.00 178.83 178.19 2fcc n ARG 125 N -3.11 1.04 0.15 1.46 1.74 -0.47 -5.00 116.66 112.47 2fcc n ARG 125 Ca -0.01 -2.83 0.18 0.00 -0.77 0.00 0.00 57.85 54.42 2fcc n ARG 125 Cb 0.75 -1.27 0.79 0.00 -1.02 0.00 0.00 32.46 31.70 2fcc n ARG 125 CO 0.00 0.00 0.00 -1.00 -1.52 0.00 0.00 177.63 175.11 2fcc h PRO 126 N 2.89 0.00 0.00 5.56 0.13 -1.13 -1.10 132.00 138.36 2fcc h PRO 126 Ca -0.03 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.10 2fcc h PRO 126 Cb 1.08 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.21 2fcc h PRO 126 CO 0.35 0.00 -0.65 0.25 -0.23 0.00 0.00 178.00 177.72 2fcc n THR 127 N -3.83 0.05 -0.06 1.56 -2.24 -1.26 -1.25 114.28 107.24 2fcc n THR 127 Ca 0.04 -0.05 -0.20 0.00 -2.27 0.00 0.00 64.05 61.57 2fcc n THR 127 Cb 0.44 0.33 -0.13 0.00 -2.10 0.00 0.00 70.33 68.87 2fcc n THR 127 CO 0.00 0.00 0.00 1.87 -0.57 0.00 0.00 175.07 176.37 2fcc n TRP 128 N -1.60 0.66 -1.63 4.78 -0.00 -0.44 -4.84 117.44 114.36 2fcc n TRP 128 Ca 0.05 0.14 -0.36 0.00 -0.00 0.00 0.00 57.50 57.33 2fcc n TRP 128 Cb 0.35 -1.09 0.08 0.00 -0.00 0.00 0.00 31.31 30.66 2fcc n TRP 128 CO 0.00 0.00 0.00 0.71 -0.00 0.00 0.00 177.69 178.40 2fcc s TYR 129 N -2.54 2.06 0.13 5.87 2.02 -1.02 -4.97 117.35 118.89 2fcc s TYR 129 Ca -0.29 1.53 0.03 0.00 -0.37 0.00 0.00 57.07 57.98 2fcc s TYR 129 Cb 0.08 -3.61 -0.04 0.00 -0.40 0.00 0.00 41.96 37.98 2fcc s TYR 129 CO 0.69 -2.80 -0.08 0.15 -1.57 0.00 0.00 175.55 171.94 2fcc s LYS 130 N -3.57 0.96 -0.12 -0.62 1.02 -1.26 -4.43 119.74 111.73 2fcc s LYS 130 Ca 0.80 -1.40 -0.02 0.00 0.02 0.00 0.00 55.97 55.37 2fcc s LYS 130 Cb -0.34 -0.40 0.04 0.00 -0.52 0.00 0.00 37.83 36.61 2fcc s LYS 130 CO 0.41 0.01 -0.00 -0.47 -0.92 0.00 0.00 175.35 174.38 2fcc s TYR 131 N -3.49 0.96 -1.46 3.18 5.04 0.15 0.56 117.35 122.28 2fcc s TYR 131 Ca 0.15 -0.50 -0.11 0.00 -2.44 0.00 0.00 57.07 54.17 2fcc s TYR 131 Cb 0.04 -0.96 0.06 0.00 0.35 0.00 0.00 41.96 41.45 2fcc s TYR 131 CO -0.02 -0.45 0.79 0.66 -1.34 0.00 0.00 175.55 175.19 2fcc n TYR 132 N 5.07 -2.14 -0.89 4.97 4.02 -1.26 -1.28 117.16 125.66 2fcc n TYR 132 Ca -0.09 0.72 0.00 0.00 -0.01 0.00 0.00 57.90 58.52 2fcc n TYR 132 Cb 0.49 -3.86 0.00 0.00 -0.02 0.00 0.00 39.34 35.95 2fcc n TYR 132 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2fcc n GLY 133 N -1.54 1.19 3.74 2.72 0.00 -1.26 -5.03 105.19 105.01 2fcc n GLY 133 Ca -0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 2fcc n GLY 133 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2fcc s LYS 134 N -0.02 2.95 -1.35 1.61 -0.14 -0.40 -5.00 119.74 117.40 2fcc s LYS 134 Ca 0.00 -0.53 -0.11 0.00 -1.36 0.00 0.00 55.97 53.97 2fcc s LYS 134 Cb 0.00 -2.78 0.12 0.00 -1.68 0.00 0.00 37.83 33.49 2fcc s LYS 134 CO 0.00 0.64 2.01 0.00 -0.76 0.00 0.00 175.35 177.24 2fcc n ALA 135 N 1.32 5.43 1.19 5.17 0.00 -1.26 -0.68 120.51 131.67 2fcc n ALA 135 Ca -0.14 -4.15 0.14 0.00 0.00 0.00 0.00 53.44 49.29 2fcc n ALA 135 Cb 0.53 -3.19 0.68 0.00 0.00 0.00 0.00 19.45 17.47 2fcc n ALA 135 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 2fcc n ILE 136 N 4.00 0.02 0.69 0.00 -5.35 -1.26 -3.42 119.36 114.04 2fcc n ILE 136 Ca 0.44 0.01 0.11 0.00 -0.27 0.00 0.00 62.75 63.04 2fcc n ILE 136 Cb 0.37 -0.51 0.02 0.00 -1.74 0.00 0.00 39.64 37.78 2fcc n ILE 136 CO 0.00 0.00 0.00 -1.22 -1.76 0.00 0.00 176.55 173.57 2fcc n TYR 137 N -1.40 0.17 0.00 4.28 4.01 -1.26 -5.12 117.16 117.84 2fcc n TYR 137 Ca 0.10 0.05 0.00 0.00 -0.16 0.00 0.00 57.90 57.89 2fcc n TYR 137 Cb 0.29 -0.33 0.00 0.00 -0.31 0.00 0.00 39.34 38.99 2fcc n TYR 137 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40