#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kop h ASP -15 N 0.00 1.02 0.19 4.04 3.32 -2.05 -1.38 116.42 121.56 3kop h ASP -15 Ca 0.00 -0.29 -0.00 0.00 0.02 0.00 0.00 57.03 56.76 3kop h ASP -15 Cb 0.00 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.27 3kop h ASP -15 CO 0.00 1.07 -0.14 0.50 -1.72 0.00 0.00 179.24 178.96 3kop h LYS -14 N 0.95 -0.32 -0.63 3.56 1.63 -2.05 -0.62 116.57 119.09 3kop h LYS -14 Ca 0.17 0.02 0.02 0.00 -0.85 0.00 0.00 60.65 60.01 3kop h LYS -14 Cb 0.55 0.07 -0.04 0.00 -0.60 0.00 0.00 32.23 32.22 3kop h LYS -14 CO 0.03 -0.21 0.40 0.97 -3.45 0.00 0.00 179.45 177.19 3kop h ILE -13 N -0.33 1.12 -0.09 2.00 2.10 -1.97 0.83 117.51 121.17 3kop h ILE -13 Ca -0.01 -0.28 0.02 0.00 1.08 0.00 0.00 64.86 65.67 3kop h ILE -13 Cb 0.29 0.24 -0.02 0.00 -1.09 0.00 0.00 36.82 36.25 3kop h ILE -13 CO -0.01 0.15 -0.02 0.45 -1.08 0.00 0.00 178.15 177.64 3kop h HIS -12 N 0.81 -0.05 -0.58 2.19 3.86 -1.04 -0.20 115.15 120.14 3kop h HIS -12 Ca 0.24 0.01 -0.07 0.00 -1.16 0.00 0.00 60.37 59.39 3kop h HIS -12 Cb -0.03 0.03 -0.02 0.00 1.06 0.00 0.00 27.41 28.45 3kop h HIS -12 CO -0.04 -0.04 0.07 1.25 0.86 0.00 0.00 177.93 180.04 3kop h HIS -11 N -0.00 1.04 0.23 2.45 -0.00 -0.85 -0.74 115.15 117.28 3kop h HIS -11 Ca 0.04 -0.15 0.00 0.00 -0.00 0.00 0.00 60.37 60.26 3kop h HIS -11 Cb 0.06 -0.28 -0.01 0.00 -0.00 0.00 0.00 27.41 27.18 3kop h HIS -11 CO -0.14 0.91 -0.20 1.25 -0.00 0.00 0.00 177.93 179.75 3kop h HIS -10 N 0.87 -0.52 -0.59 5.26 6.17 -0.53 0.15 115.15 125.95 3kop h HIS -10 Ca 0.17 0.00 0.12 0.00 0.71 0.00 0.00 60.37 61.37 3kop h HIS -10 Cb 0.45 0.20 -0.09 0.00 2.52 0.00 0.00 27.41 30.48 3kop h HIS -10 CO 0.03 -0.30 0.05 0.45 0.71 0.00 0.00 177.93 178.87 3kop h HIS -9 N -0.45 0.05 -0.56 5.26 3.86 -0.90 0.28 115.15 122.69 3kop h HIS -9 Ca -0.01 0.04 -0.04 0.00 -1.16 0.00 0.00 60.37 59.20 3kop h HIS -9 Cb 0.41 0.07 -0.02 0.00 1.06 0.00 0.00 27.41 28.92 3kop h HIS -9 CO -0.14 -0.11 0.17 1.25 0.86 0.00 0.00 177.93 179.97 3kop h HIS -8 N 0.17 0.90 -0.30 2.45 2.76 -0.80 -0.94 115.15 119.37 3kop h HIS -8 Ca 0.31 -0.09 -0.01 0.00 -2.20 0.00 0.00 60.37 58.38 3kop h HIS -8 Cb 0.48 -0.26 -0.01 0.00 1.55 0.00 0.00 27.41 29.17 3kop h HIS -8 CO -0.31 0.76 0.16 1.25 -1.30 0.00 0.00 177.93 178.49 3kop h HIS -7 N 0.77 0.43 -0.67 5.26 6.17 0.11 -2.07 115.15 125.15 3kop h HIS -7 Ca 0.18 -0.01 0.04 0.00 0.71 0.00 0.00 60.37 61.29 3kop h HIS -7 Cb 0.28 -0.13 -0.05 0.00 2.52 0.00 0.00 27.41 30.03 3kop h HIS -7 CO 0.02 0.36 0.40 0.93 0.71 0.00 0.00 177.93 180.35 3kop h GLU -6 N 0.37 0.74 -0.41 5.26 5.08 -0.19 -0.68 114.58 124.75 3kop h GLU -6 Ca 0.11 -0.04 -0.00 0.00 -1.00 0.00 0.00 59.36 58.42 3kop h GLU -6 Cb 0.08 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.15 3kop h GLU -6 CO -0.02 0.49 0.25 -0.97 -1.00 0.00 0.00 179.01 177.76 3kop h ASN -5 N 0.76 0.49 -0.55 1.42 -1.24 -1.00 -1.86 115.58 113.59 3kop h ASN -5 Ca 0.28 -0.05 -0.04 0.00 0.71 0.00 0.00 56.30 57.20 3kop h ASN -5 Cb 0.09 -0.12 -0.02 0.00 0.73 0.00 0.00 38.32 38.99 3kop h ASN -5 CO -0.14 0.39 0.19 -0.07 -1.29 0.00 0.00 177.43 176.52 3kop h LEU -4 N 0.54 0.78 -0.13 0.34 3.38 -1.01 -0.67 115.31 118.53 3kop h LEU -4 Ca 0.15 -0.19 0.04 0.00 0.09 0.00 0.00 57.88 57.97 3kop h LEU -4 Cb -0.01 -0.20 -0.05 0.00 0.09 0.00 0.00 40.66 40.49 3kop h LEU -4 CO -0.03 0.76 -0.18 0.22 0.09 0.00 0.00 178.44 179.31 3kop h TYR -3 N 0.76 -0.45 -0.18 1.13 3.20 -0.92 0.12 116.97 120.62 3kop h TYR -3 Ca 0.18 0.02 -0.11 0.00 3.14 0.00 0.00 58.73 61.97 3kop h TYR -3 Cb 0.24 0.22 -0.01 0.00 1.54 0.00 0.00 36.73 38.72 3kop h TYR -3 CO 0.01 -0.25 -0.35 0.74 -1.64 0.00 0.00 178.16 176.68 3kop h PHE -2 N -0.22 0.44 -0.38 -3.82 0.04 -1.18 -2.18 116.94 109.64 3kop h PHE -2 Ca 0.10 -0.11 0.01 0.00 2.80 0.00 0.00 57.97 60.77 3kop h PHE -2 Cb 0.36 -0.10 -0.02 0.00 2.20 0.00 0.00 35.95 38.39 3kop h PHE -2 CO -0.29 0.68 0.23 1.96 -0.60 0.00 0.00 178.31 180.29 3kop h GLN -1 N 0.33 0.45 -0.54 1.51 4.20 -0.85 -0.91 115.11 119.30 3kop h GLN -1 Ca 0.04 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.72 3kop h GLN -1 Cb 0.77 -0.10 0.00 0.00 0.30 0.00 0.00 27.48 28.45 3kop h GLN -1 CO 0.06 0.30 0.00 0.41 -0.67 0.00 0.00 178.83 178.93 3kop n GLY 0 N -1.20 0.10 0.00 3.46 0.00 0.39 -4.91 105.19 103.02 3kop n GLY 0 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 3kop n GLY 0 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kop n ALA 2 N 0.60 0.00 -2.52 4.61 0.00 -0.35 -5.10 120.51 117.74 3kop n ALA 2 Ca 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 53.44 53.19 3kop n ALA 2 Cb 0.02 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.37 3kop n ALA 2 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 3kop s ARG 3 N -5.17 1.87 0.09 0.00 1.70 -1.26 -5.06 118.95 111.11 3kop s ARG 3 Ca 0.00 -1.49 0.05 0.00 -0.47 0.00 0.00 55.73 53.82 3kop s ARG 3 Cb 0.00 -1.98 -0.03 0.00 -0.57 0.00 0.00 34.95 32.36 3kop s ARG 3 CO 0.00 0.39 -0.13 0.71 -1.08 0.00 0.00 175.30 175.19 3kop s TYR 4 N -2.02 1.20 0.09 5.89 2.02 -1.26 -1.37 117.35 121.91 3kop s TYR 4 Ca 0.26 -0.52 0.09 0.00 -0.37 0.00 0.00 57.07 56.54 3kop s TYR 4 Cb -0.07 -0.66 -0.03 0.00 -0.40 0.00 0.00 41.96 40.79 3kop s TYR 4 CO 0.15 0.06 -0.25 0.96 -1.57 0.00 0.00 175.55 174.90 3kop s ILE 5 N -1.68 2.03 -0.02 2.71 -4.36 0.04 -1.38 121.20 118.55 3kop s ILE 5 Ca 0.01 -1.53 -0.13 0.00 -0.26 0.00 0.00 60.65 58.75 3kop s ILE 5 Cb -0.08 -1.78 -0.05 0.00 1.25 0.00 0.00 42.46 41.80 3kop s ILE 5 CO 0.02 0.16 0.36 0.20 0.24 0.00 0.00 174.94 175.92 3kop s ASN 6 N -1.66 6.73 -0.15 4.36 0.01 0.17 -0.78 114.94 123.63 3kop s ASN 6 Ca 0.11 0.87 0.00 0.00 -0.71 0.00 0.00 52.86 53.13 3kop s ASN 6 Cb -0.10 -2.22 0.03 0.00 0.41 0.00 0.00 41.25 39.38 3kop s ASN 6 CO 0.04 0.33 -0.10 -0.63 -1.51 0.00 0.00 177.10 175.23 3kop s ILE 7 N -1.09 1.32 -0.02 0.60 1.01 -0.03 -1.38 121.20 121.61 3kop s ILE 7 Ca 0.23 -0.57 0.03 0.00 0.00 0.00 0.00 60.65 60.33 3kop s ILE 7 Cb -0.16 -1.33 -0.00 0.00 0.01 0.00 0.00 42.46 40.98 3kop s ILE 7 CO 0.12 0.33 -0.10 -0.89 0.00 0.00 0.00 174.94 174.40 3kop s THR 8 N 1.57 0.83 -0.32 2.92 2.01 -0.39 -0.64 115.64 121.63 3kop s THR 8 Ca 0.03 -0.41 -0.13 0.00 0.31 0.00 0.00 61.69 61.49 3kop s THR 8 Cb -0.14 -0.72 -0.02 0.00 0.01 0.00 0.00 72.50 71.63 3kop s THR 8 CO -0.09 0.25 0.28 -0.76 -0.69 0.00 0.00 174.62 173.61 3kop s LEU 9 N 0.00 4.36 0.11 4.42 1.43 0.69 -0.63 118.68 129.07 3kop s LEU 9 Ca -0.00 -0.23 -0.08 0.00 -1.03 0.00 0.00 54.13 52.79 3kop s LEU 9 Cb -0.07 -2.22 -0.13 0.00 0.03 0.00 0.00 46.19 43.80 3kop s LEU 9 CO 0.00 -0.23 1.28 -0.33 0.23 0.00 0.00 176.35 177.30 3kop h GLU 10 N 8.43 0.54 0.00 1.70 4.39 -1.61 0.19 114.58 128.23 3kop h GLU 10 Ca -0.32 -0.55 -0.00 0.00 0.34 0.00 0.00 59.36 58.83 3kop h GLU 10 Cb 1.16 0.15 0.00 0.00 -0.10 0.00 0.00 28.75 29.96 3kop h GLU 10 CO 0.64 1.18 -0.00 -0.22 -1.16 0.00 0.00 179.01 179.44 3kop h LYS 11 N 0.32 -0.01 0.00 2.33 3.64 -1.82 -3.21 116.57 117.83 3kop h LYS 11 Ca -0.09 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.29 3kop h LYS 11 Cb 1.58 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.40 3kop h LYS 11 CO 0.17 0.87 0.00 0.00 -2.27 0.00 0.00 179.45 178.22 3kop h ARG 12 N -0.92 0.00 -4.11 1.90 3.08 -1.95 -3.47 114.38 108.92 3kop h ARG 12 Ca -0.00 0.00 -0.25 0.00 0.07 0.00 0.00 59.98 59.79 3kop h ARG 12 Cb 0.88 0.00 0.09 0.00 0.08 0.00 0.00 29.97 31.02 3kop h ARG 12 CO 0.00 0.00 -0.44 0.41 -1.07 0.00 0.00 179.97 178.87 3kop n GLY 13 N -0.11 -0.01 3.34 0.04 0.00 0.63 -5.02 105.19 104.06 3kop n GLY 13 Ca 0.01 -0.08 -0.33 0.00 0.00 0.00 0.00 46.02 45.62 3kop n GLY 13 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3kop s VAL 14 N -3.21 2.75 0.01 1.61 1.01 -0.92 -4.97 120.40 116.68 3kop s VAL 14 Ca 0.37 -0.78 0.05 0.00 0.00 0.00 0.00 61.98 61.61 3kop s VAL 14 Cb -0.16 -2.12 -0.02 0.00 0.00 0.00 0.00 36.38 34.09 3kop s VAL 14 CO 0.47 0.54 -0.16 -0.89 0.00 0.00 0.00 175.10 175.06 3kop s THR 15 N 0.20 1.23 0.29 3.92 2.01 -1.26 -0.22 115.64 121.82 3kop s THR 15 Ca -0.10 -0.79 0.05 0.00 0.31 0.00 0.00 61.69 61.16 3kop s THR 15 Cb -0.16 -1.05 -0.06 0.00 0.01 0.00 0.00 72.50 71.24 3kop s THR 15 CO 0.06 0.25 -0.01 0.00 -0.69 0.00 0.00 174.62 174.23 3kop s LYS 17 N -3.80 2.11 -0.02 0.00 2.20 -0.14 -0.85 119.74 119.24 3kop s LYS 17 Ca 0.32 -0.88 0.05 0.00 -0.36 0.00 0.00 55.97 55.09 3kop s LYS 17 Cb 0.06 -1.97 -0.01 0.00 -1.51 0.00 0.00 37.83 34.40 3kop s LYS 17 CO 0.13 0.49 -0.15 0.00 -0.36 0.00 0.00 175.35 175.46 3kop s ALA 18 N -0.48 1.29 0.01 3.13 0.00 0.04 -0.37 121.76 125.38 3kop s ALA 18 Ca 0.06 -0.65 -0.29 0.00 0.00 0.00 0.00 51.96 51.08 3kop s ALA 18 Cb -0.10 -0.34 -0.03 0.00 0.00 0.00 0.00 23.12 22.64 3kop s ALA 18 CO 0.00 0.30 0.93 -1.17 0.00 0.00 0.00 175.76 175.83 3kop s LEU 19 N -0.30 4.38 0.03 0.00 2.96 0.24 -0.78 118.68 125.21 3kop s LEU 19 Ca 0.05 1.61 -0.28 0.00 -0.22 0.00 0.00 54.13 55.28 3kop s LEU 19 Cb -0.07 -3.50 -0.04 0.00 0.50 0.00 0.00 46.19 43.08 3kop s LEU 19 CO -0.00 -0.21 0.87 -0.22 -1.32 0.00 0.00 176.35 175.47 3kop s LEU 20 N 0.83 4.42 -1.27 -0.68 2.96 -0.47 -1.24 118.68 123.23 3kop s LEU 20 Ca 0.49 1.57 -0.08 0.00 -0.22 0.00 0.00 54.13 55.89 3kop s LEU 20 Cb -0.21 -3.41 0.17 0.00 0.50 0.00 0.00 46.19 43.25 3kop s LEU 20 CO 0.27 -0.11 1.95 0.18 -1.32 0.00 0.00 176.35 177.31 3kop n LEU 21 N 3.30 6.96 0.26 -0.68 4.77 0.46 -4.69 117.00 127.38 3kop n LEU 21 Ca 0.02 -4.77 0.11 0.00 -0.03 0.00 0.00 56.01 51.34 3kop n LEU 21 Cb 0.50 -1.43 0.70 0.00 -2.33 0.00 0.00 43.42 40.87 3kop n LEU 21 CO 0.50 1.57 0.97 0.44 -1.33 0.00 0.00 177.39 179.54 3kop h ASP 22 N 5.43 0.00 0.10 -1.43 3.32 -1.85 0.29 116.42 122.28 3kop h ASP 22 Ca 0.44 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.49 3kop h ASP 22 Cb 0.55 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.10 3kop h ASP 22 CO 1.56 0.12 -0.05 -2.24 -1.72 0.00 0.00 179.24 176.92 3kop h ASP 23 N 0.00 -0.11 0.00 6.45 2.03 -1.97 -3.28 116.42 119.54 3kop h ASP 23 Ca -0.00 -0.40 0.00 0.00 -0.73 0.00 0.00 57.03 55.90 3kop h ASP 23 Cb 0.30 0.03 0.00 0.00 -0.83 0.00 0.00 39.33 38.83 3kop h ASP 23 CO 0.02 0.37 -1.50 1.33 -1.03 0.00 0.00 179.24 178.42 3kop n VAL 24 N -4.93 0.00 -2.92 4.15 0.24 -1.16 -4.52 118.33 109.19 3kop n VAL 24 Ca -0.09 -0.31 -0.21 0.00 -2.04 0.00 0.00 64.34 61.70 3kop n VAL 24 Cb 0.26 0.39 -0.02 0.00 -1.47 0.00 0.00 33.84 33.00 3kop n VAL 24 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3kop n ALA 25 N -1.90 3.58 -0.25 2.33 0.00 0.10 -4.32 120.51 120.06 3kop n ALA 25 Ca -0.01 -3.94 -0.07 0.00 0.00 0.00 0.00 53.44 49.42 3kop n ALA 25 Cb 0.41 -0.81 0.04 0.00 0.00 0.00 0.00 19.45 19.10 3kop n ALA 25 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 3kop h PRO 26 N 2.93 1.01 -0.23 0.00 0.13 -1.63 -0.61 132.00 133.60 3kop h PRO 26 Ca 0.11 -0.17 -0.05 0.00 -0.87 0.00 0.00 66.00 65.01 3kop h PRO 26 Cb 0.83 -0.17 -0.01 0.00 0.13 0.00 0.00 31.00 31.79 3kop h PRO 26 CO 0.66 0.83 -0.06 0.00 -0.23 0.00 0.00 178.00 179.20 3kop h ARG 27 N 0.96 0.45 -0.32 0.86 3.08 -1.92 -2.10 114.38 115.40 3kop h ARG 27 Ca 0.23 -0.18 -0.15 0.00 0.07 0.00 0.00 59.98 59.95 3kop h ARG 27 Cb 0.18 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.20 3kop h ARG 27 CO -0.02 0.69 -0.40 1.15 -1.07 0.00 0.00 179.97 180.32 3kop h THR 28 N 0.19 1.28 -0.56 2.04 2.02 -1.90 -1.58 112.91 114.41 3kop h THR 28 Ca 0.06 -1.57 -0.02 0.00 0.77 0.00 0.00 66.41 65.65 3kop h THR 28 Cb 0.52 1.45 -0.03 0.00 -1.74 0.00 0.00 68.15 68.36 3kop h THR 28 CO 0.02 0.51 0.27 0.28 0.37 0.00 0.00 175.52 176.98 3kop h SER 29 N 0.64 0.72 -0.21 4.18 0.02 -1.10 -1.14 113.55 116.66 3kop h SER 29 Ca 0.05 -0.12 -0.01 0.00 -0.84 0.00 0.00 61.79 60.86 3kop h SER 29 Cb 0.95 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 63.30 3kop h SER 29 CO 0.09 0.64 0.08 0.50 -1.14 0.00 0.00 176.83 177.00 3kop h LYS 30 N 0.75 0.32 -0.58 3.45 3.64 -1.31 0.21 116.57 123.05 3kop h LYS 30 Ca 0.19 -0.06 0.03 0.00 -1.27 0.00 0.00 60.65 59.53 3kop h LYS 30 Cb 0.11 -0.05 -0.04 0.00 -0.41 0.00 0.00 32.23 31.84 3kop h LYS 30 CO -0.03 0.40 0.35 0.00 -2.27 0.00 0.00 179.45 177.91 3kop h ALA 31 N 0.91 0.75 0.22 5.00 0.00 -1.03 0.24 119.26 125.35 3kop h ALA 31 Ca 0.07 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 3kop h ALA 31 Cb 0.20 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.82 3kop h ALA 31 CO -0.00 0.09 -0.11 0.28 0.00 0.00 0.00 179.25 179.51 3kop h VAL 32 N 0.70 0.82 -0.47 0.00 2.07 -1.17 -3.17 116.25 115.04 3kop h VAL 32 Ca 0.23 -0.83 0.09 0.00 0.82 0.00 0.00 66.70 67.02 3kop h VAL 32 Cb 0.02 1.27 -0.10 0.00 -1.52 0.00 0.00 31.29 30.96 3kop h VAL 32 CO -0.10 0.17 -0.22 -0.25 0.02 0.00 0.00 177.57 177.19 3kop h TRP 33 N -0.75 -0.55 -0.62 1.57 2.91 -0.76 -1.19 115.95 116.56 3kop h TRP 33 Ca -0.03 0.05 0.14 0.00 1.13 0.00 0.00 58.89 60.18 3kop h TRP 33 Cb 0.50 0.31 -0.03 0.00 -0.51 0.00 0.00 29.16 29.43 3kop h TRP 33 CO 0.05 -0.30 0.42 -0.44 -1.03 0.00 0.00 178.44 177.14 3kop h ASP 34 N -0.12 0.22 -0.02 2.65 5.19 -1.04 -2.58 116.42 120.72 3kop h ASP 34 Ca 0.22 0.01 0.00 0.00 -0.62 0.00 0.00 57.03 56.64 3kop h ASP 34 Cb 0.46 -0.03 0.00 0.00 0.18 0.00 0.00 39.33 39.94 3kop h ASP 34 CO -0.54 0.12 -0.17 0.00 -3.12 0.00 0.00 179.24 175.53 3kop n ALA 35 N -2.57 2.86 -1.78 3.45 0.00 -0.50 -4.97 120.51 117.00 3kop n ALA 35 Ca 0.11 -0.66 -0.35 0.00 0.00 0.00 0.00 53.44 52.54 3kop n ALA 35 Cb 0.52 -0.82 -0.01 0.00 0.00 0.00 0.00 19.45 19.14 3kop n ALA 35 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3kop s LEU 36 N -2.18 3.82 0.57 0.00 1.43 -0.93 -4.39 118.68 117.00 3kop s LEU 36 Ca 0.25 2.17 -0.11 0.00 -1.03 0.00 0.00 54.13 55.41 3kop s LEU 36 Cb 0.19 -4.50 -0.05 0.00 0.03 0.00 0.00 46.19 41.86 3kop s LEU 36 CO 0.40 -1.09 0.97 -2.16 0.23 0.00 0.00 176.35 174.70 3kop s PRO 37 N -3.14 3.68 -0.05 1.29 0.04 -1.26 -4.93 135.00 130.63 3kop s PRO 37 Ca 0.70 0.70 0.02 0.00 0.04 0.00 0.00 61.00 62.47 3kop s PRO 37 Cb -0.24 -2.15 0.01 0.00 0.04 0.00 0.00 34.50 32.16 3kop s PRO 37 CO 0.28 -0.43 -0.11 -0.65 0.04 0.00 0.00 177.00 176.13 3kop s GLN 38 N -4.81 1.42 -0.18 4.56 -1.52 -0.18 -4.99 119.66 113.97 3kop s GLN 38 Ca 0.55 -0.37 -0.09 0.00 -1.95 0.00 0.00 55.36 53.50 3kop s GLN 38 Cb -0.11 -1.23 0.07 0.00 -0.22 0.00 0.00 33.01 31.52 3kop s GLN 38 CO 0.47 0.06 0.42 0.45 -0.25 0.00 0.00 175.29 176.43 3kop s SER 39 N 0.51 -0.46 0.14 5.90 0.15 -1.26 0.36 113.70 119.05 3kop s SER 39 Ca -0.10 0.93 -0.25 0.00 0.70 0.00 0.00 55.95 57.23 3kop s SER 39 Cb -0.13 0.92 0.06 0.00 -1.71 0.00 0.00 66.02 65.16 3kop s SER 39 CO 0.02 -0.20 0.89 -0.55 1.20 0.00 0.00 173.24 174.60 3kop s SER 40 N 1.71 -0.25 0.13 5.45 0.15 -0.98 -4.99 113.70 114.93 3kop s SER 40 Ca -0.08 -0.34 -0.34 0.00 0.70 0.00 0.00 55.95 55.90 3kop s SER 40 Cb -0.09 0.51 -0.17 0.00 -1.71 0.00 0.00 66.02 64.56 3kop s SER 40 CO -0.13 -0.92 1.00 1.67 1.20 0.00 0.00 173.24 176.06 3kop n GLN 41 N -0.42 0.61 -3.23 5.44 -0.06 -1.26 -1.01 117.38 117.45 3kop n GLN 41 Ca -0.07 0.22 -0.32 0.00 -2.00 0.00 0.00 57.00 54.83 3kop n GLN 41 Cb 0.61 -1.61 -0.06 0.00 -4.06 0.00 0.00 30.24 25.12 3kop n GLN 41 CO 0.00 0.00 0.00 0.54 -0.20 0.00 0.00 177.06 177.40 3kop s VAL 42 N -0.32 4.78 0.02 1.69 0.11 -1.02 -4.35 120.40 121.32 3kop s VAL 42 Ca 0.76 0.75 0.03 0.00 -2.93 0.00 0.00 61.98 60.59 3kop s VAL 42 Cb -0.98 -3.62 -0.02 0.00 -1.53 0.00 0.00 36.38 30.24 3kop s VAL 42 CO 0.54 -0.16 -0.10 -0.36 -3.33 0.00 0.00 175.10 171.69 3kop s PHE 43 N -1.95 0.86 0.07 1.54 0.08 0.69 -4.86 117.98 114.41 3kop s PHE 43 Ca 0.51 -0.29 -0.20 0.00 0.12 0.00 0.00 56.93 57.07 3kop s PHE 43 Cb -0.11 -0.53 -0.07 0.00 -0.57 0.00 0.00 43.02 41.75 3kop s PHE 43 CO 0.20 -0.01 0.60 -1.58 -0.10 0.00 0.00 175.22 174.32 3kop s HIS 44 N -0.70 3.80 0.56 0.36 5.65 -1.26 -0.88 115.29 122.82 3kop s HIS 44 Ca -0.01 1.30 -0.20 0.00 0.25 0.00 0.00 55.06 56.41 3kop s HIS 44 Cb -0.06 -2.55 -0.04 0.00 -1.18 0.00 0.00 32.58 28.75 3kop s HIS 44 CO 0.00 0.54 1.24 0.20 -0.65 0.00 0.00 174.74 176.07 3kop s GLY 45 N -0.95 2.78 -0.02 1.59 0.00 0.39 -4.95 107.32 106.16 3kop s GLY 45 Ca 0.30 1.07 0.15 0.00 0.00 0.00 0.00 44.72 46.24 3kop s GLY 45 CO 0.20 1.50 0.33 0.28 0.00 0.00 0.00 173.10 175.41 3kop n LYS 46 N -1.29 0.51 -0.01 2.90 5.02 -1.26 -4.66 118.16 119.37 3kop n LYS 46 Ca 0.12 -0.13 -0.01 0.00 -2.02 0.00 0.00 58.31 56.27 3kop n LYS 46 Cb 0.48 -1.34 -0.01 0.00 -0.02 0.00 0.00 35.03 34.14 3kop n LYS 46 CO 0.00 0.00 0.00 2.48 -0.52 0.00 0.00 177.40 179.36 3kop n TYR 47 N -1.98 0.00 1.83 2.13 0.18 -1.26 -4.76 117.16 113.30 3kop n TYR 47 Ca -0.02 0.00 0.13 0.00 1.88 0.00 0.00 57.90 59.88 3kop n TYR 47 Cb 0.37 -0.08 0.69 0.00 -0.38 0.00 0.00 39.34 39.94 3kop n TYR 47 CO 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 176.86 174.78 3kop n ALA 48 N -2.17 2.63 -0.16 -3.48 0.00 -1.26 -4.68 120.51 111.38 3kop n ALA 48 Ca -0.03 -0.25 0.00 0.00 0.00 0.00 0.00 53.44 53.16 3kop n ALA 48 Cb 0.55 -1.34 0.00 0.00 0.00 0.00 0.00 19.45 18.66 3kop n ALA 48 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 3kop n ARG 49 N -0.59 0.00 -2.05 0.00 0.63 -1.26 -4.21 116.66 109.17 3kop n ARG 49 Ca 0.19 0.00 -0.42 0.00 -0.92 0.00 0.00 57.85 56.71 3kop n ARG 49 Cb 0.16 0.00 -0.00 0.00 0.45 0.00 0.00 32.46 33.07 3kop n ARG 49 CO 0.00 0.00 0.00 0.09 -2.51 0.00 0.00 177.63 175.21 3kop n ASN 50 N 8.02 5.80 -3.98 6.15 3.02 -1.26 -4.59 115.26 128.41 3kop n ASN 50 Ca 0.00 -3.02 -0.18 0.00 -0.03 0.00 0.00 54.58 51.35 3kop n ASN 50 Cb 0.00 -1.50 -0.15 0.00 -0.61 0.00 0.00 39.78 37.53 3kop n ASN 50 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 3kop s GLU 51 N 0.77 0.67 0.21 3.52 2.12 -1.26 -0.86 118.70 123.86 3kop s GLU 51 Ca 0.47 -0.25 0.10 0.00 0.36 0.00 0.00 54.97 55.64 3kop s GLU 51 Cb 0.13 -0.65 -0.05 0.00 0.26 0.00 0.00 34.13 33.83 3kop s GLU 51 CO -0.04 0.12 -0.18 0.96 -0.54 0.00 0.00 175.26 175.58 3kop s ILE 52 N 0.01 2.03 0.22 -3.70 -4.36 -0.61 -0.47 121.20 114.33 3kop s ILE 52 Ca 0.00 -2.16 -0.22 0.00 -0.26 0.00 0.00 60.65 58.01 3kop s ILE 52 Cb -0.05 -2.06 0.04 0.00 1.25 0.00 0.00 42.46 41.64 3kop s ILE 52 CO -0.00 -0.41 0.69 -0.72 0.24 0.00 0.00 174.94 174.74 3kop s TYR 53 N -2.44 -0.32 0.37 1.37 1.13 -0.06 -0.94 117.35 116.46 3kop s TYR 53 Ca 0.22 -0.03 0.04 0.00 -1.41 0.00 0.00 57.07 55.90 3kop s TYR 53 Cb -0.04 0.64 -0.06 0.00 -1.10 0.00 0.00 41.96 41.40 3kop s TYR 53 CO 0.09 -1.05 0.05 0.54 -2.51 0.00 0.00 175.55 172.67 3kop s ASN 54 N -2.84 2.91 -0.08 -0.18 2.20 -0.54 -0.23 114.94 116.19 3kop s ASN 54 Ca 0.07 -1.42 0.01 0.00 -0.94 0.00 0.00 52.86 50.58 3kop s ASN 54 Cb -0.04 -0.07 0.02 0.00 -2.00 0.00 0.00 41.25 39.16 3kop s ASN 54 CO -0.01 -0.61 -0.08 -0.76 -2.94 0.00 0.00 177.10 172.70 3kop s LEU 55 N -3.58 1.32 0.10 3.54 1.43 -1.26 -2.13 118.68 118.10 3kop s LEU 55 Ca 0.33 -0.24 0.04 0.00 -1.03 0.00 0.00 54.13 53.23 3kop s LEU 55 Cb 0.08 -0.70 -0.03 0.00 0.03 0.00 0.00 46.19 45.56 3kop s LEU 55 CO 0.15 -0.06 -0.11 0.68 0.23 0.00 0.00 176.35 177.25 3kop s VAL 56 N 1.18 0.99 0.59 -1.59 -7.23 0.07 -4.86 120.40 109.54 3kop s VAL 56 Ca -0.06 -1.59 -0.20 0.00 -1.81 0.00 0.00 61.98 58.32 3kop s VAL 56 Cb -0.14 -1.32 -0.04 0.00 0.56 0.00 0.00 36.38 35.44 3kop s VAL 56 CO -0.02 -0.50 1.25 -2.65 -0.31 0.00 0.00 175.10 172.87 3kop n PRO 57 N 0.66 1.32 -1.62 4.82 -0.02 -1.26 -0.06 135.00 138.85 3kop n PRO 57 Ca -0.17 0.50 -0.43 0.00 -2.02 0.00 0.00 63.50 61.39 3kop n PRO 57 Cb 0.57 -2.47 -0.00 0.00 -0.02 0.00 0.00 33.50 31.58 3kop n PRO 57 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3kop n ALA 58 N -1.47 0.22 0.00 3.55 0.00 -0.71 -4.60 120.51 117.50 3kop n ALA 58 Ca 0.13 0.32 0.00 0.00 0.00 0.00 0.00 53.44 53.89 3kop n ALA 58 Cb 0.46 -2.09 0.00 0.00 0.00 0.00 0.00 19.45 17.82 3kop n ALA 58 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 177.50 179.47 3kop n PHE 59 N -0.06 0.00 -3.00 0.00 1.16 -1.26 -5.04 117.46 109.26 3kop n PHE 59 Ca 0.08 0.00 -0.34 0.00 -1.87 0.00 0.00 57.45 55.32 3kop n PHE 59 Cb 0.36 0.00 -0.06 0.00 -1.61 0.00 0.00 39.48 38.16 3kop n PHE 59 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 3kop s ALA 60 N -1.28 3.26 0.34 1.98 0.00 -1.26 -4.96 121.76 119.84 3kop s ALA 60 Ca 0.00 0.23 0.03 0.00 0.00 0.00 0.00 51.96 52.21 3kop s ALA 60 Cb 0.00 -2.93 0.62 0.00 0.00 0.00 0.00 23.12 20.81 3kop s ALA 60 CO 0.00 0.26 1.97 -1.35 0.00 0.00 0.00 175.76 176.64 3kop h PRO 61 N 2.62 0.75 -3.83 0.00 0.11 -1.97 -3.41 132.00 126.27 3kop h PRO 61 Ca -0.48 -0.08 -0.20 0.00 0.11 0.00 0.00 66.00 65.35 3kop h PRO 61 Cb 1.18 -0.15 -0.24 0.00 0.11 0.00 0.00 31.00 31.90 3kop h PRO 61 CO 0.64 0.56 -0.70 -1.59 -0.21 0.00 0.00 178.00 176.71 3kop s LYS 62 N -5.49 0.17 0.55 1.05 -2.85 -1.26 -5.14 119.74 106.77 3kop s LYS 62 Ca -0.09 -0.29 -0.21 0.00 -1.00 0.00 0.00 55.97 54.38 3kop s LYS 62 Cb 0.17 0.06 -0.04 0.00 -2.06 0.00 0.00 37.83 35.95 3kop s LYS 62 CO 0.77 -0.03 1.30 -1.21 0.10 0.00 0.00 175.35 176.28 3kop s GLU 63 N -0.72 3.12 0.52 1.78 0.41 -1.26 -4.90 118.70 117.65 3kop s GLU 63 Ca -0.08 2.10 0.31 0.00 -0.41 0.00 0.00 54.97 56.89 3kop s GLU 63 Cb -0.05 -2.18 1.23 0.00 -1.78 0.00 0.00 34.13 31.36 3kop s GLU 63 CO -0.00 -1.16 1.94 -1.00 -0.49 0.00 0.00 175.26 174.54 3kop h PRO 64 N 1.34 0.00 0.00 0.39 0.13 -1.98 -3.49 132.00 128.38 3kop h PRO 64 Ca -0.51 0.00 0.17 0.00 -0.87 0.00 0.00 66.00 64.79 3kop h PRO 64 Cb 1.30 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.39 3kop h PRO 64 CO 0.57 0.06 -0.22 0.41 -0.23 0.00 0.00 178.00 178.58 3kop n GLY 65 N 0.08 -1.99 3.69 1.56 0.00 -1.26 -4.80 105.19 102.46 3kop n GLY 65 Ca 0.01 -1.32 -0.42 0.00 0.00 0.00 0.00 46.02 44.28 3kop n GLY 65 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kop s ALA 66 N -1.60 3.75 -0.20 4.61 0.00 -1.26 -4.97 121.76 122.08 3kop s ALA 66 Ca 0.00 1.44 -0.09 0.00 0.00 0.00 0.00 51.96 53.31 3kop s ALA 66 Cb 0.00 -3.77 0.08 0.00 0.00 0.00 0.00 23.12 19.43 3kop s ALA 66 CO 0.00 -1.26 0.46 -2.00 0.00 0.00 0.00 175.76 172.96 3kop s GLU 67 N 2.90 0.41 -1.48 0.00 2.12 -1.26 -4.94 118.70 116.45 3kop s GLU 67 Ca 0.82 1.00 -0.05 0.00 0.36 0.00 0.00 54.97 57.09 3kop s GLU 67 Cb -0.46 0.22 0.04 0.00 0.26 0.00 0.00 34.13 34.20 3kop s GLU 67 CO 0.37 -0.20 0.56 -1.71 -0.54 0.00 0.00 175.26 173.73 3kop n ASN 68 N 4.85 -1.39 -4.83 -1.70 5.15 -1.26 -3.82 115.26 112.27 3kop n ASN 68 Ca -0.16 -0.98 -0.33 0.00 -0.60 0.00 0.00 54.58 52.51 3kop n ASN 68 Cb 0.53 -3.08 -0.03 0.00 -0.53 0.00 0.00 39.78 36.66 3kop n ASN 68 CO 0.00 0.00 0.00 0.42 1.40 0.00 0.00 177.26 179.08 3kop s THR 69 N -3.74 4.29 0.05 -0.44 -4.23 -1.26 -1.83 115.64 108.48 3kop s THR 69 Ca 0.23 1.18 0.03 0.00 -1.18 0.00 0.00 61.69 61.94 3kop s THR 69 Cb -0.12 -3.60 -0.03 0.00 1.34 0.00 0.00 72.50 70.09 3kop s THR 69 CO 0.89 -0.55 -0.09 0.28 -0.54 0.00 0.00 174.62 174.62 3kop s THR 70 N -2.45 0.63 -0.93 3.99 -1.32 -0.47 -4.90 115.64 110.18 3kop s THR 70 Ca 0.61 -1.15 0.09 0.00 -1.21 0.00 0.00 61.69 60.03 3kop s THR 70 Cb -0.12 -0.71 0.14 0.00 -1.51 0.00 0.00 72.50 70.30 3kop s THR 70 CO 0.28 -0.38 0.96 1.33 -2.21 0.00 0.00 174.62 174.60 3kop n VAL 71 N 1.38 0.43 -3.24 5.08 0.24 -1.26 -1.64 118.33 119.32 3kop n VAL 71 Ca -0.22 -0.72 -0.25 0.00 -2.04 0.00 0.00 64.34 61.11 3kop n VAL 71 Cb 0.55 0.89 -0.06 0.00 -1.47 0.00 0.00 33.84 33.74 3kop n VAL 71 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 3kop n THR 72 N 0.41 1.46 -2.07 3.34 -2.24 -1.26 -0.95 114.28 112.96 3kop n THR 72 Ca 0.07 -4.93 -0.36 0.00 -2.27 0.00 0.00 64.05 56.56 3kop n THR 72 Cb 0.29 -1.72 0.02 0.00 -2.10 0.00 0.00 70.33 66.83 3kop n THR 72 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 3kop s PRO 73 N -2.36 3.23 0.35 -0.78 0.04 -1.26 -4.96 135.00 129.26 3kop s PRO 73 Ca 0.41 1.84 0.09 0.00 0.04 0.00 0.00 61.00 63.38 3kop s PRO 73 Cb 0.20 -2.09 -0.07 0.00 0.04 0.00 0.00 34.50 32.59 3kop s PRO 73 CO -0.07 -1.01 -0.08 0.96 0.04 0.00 0.00 177.00 176.85 3kop s ILE 74 N -1.57 2.21 0.26 0.56 -4.36 -1.26 -4.27 121.20 112.78 3kop s ILE 74 Ca 0.73 -2.17 -0.31 0.00 -0.26 0.00 0.00 60.65 58.64 3kop s ILE 74 Cb -0.30 -2.70 -0.13 0.00 1.25 0.00 0.00 42.46 40.58 3kop s ILE 74 CO 0.35 -0.17 1.49 -2.65 0.24 0.00 0.00 174.94 174.19 3kop n PRO 75 N -0.82 2.32 0.00 0.37 -0.02 -1.20 -1.45 135.00 134.20 3kop n PRO 75 Ca -0.05 0.83 0.00 0.00 -2.02 0.00 0.00 63.50 62.26 3kop n PRO 75 Cb 0.64 -2.54 0.00 0.00 -0.02 0.00 0.00 33.50 31.58 3kop n PRO 75 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3kop n GLY 76 N 2.21 1.94 3.77 -1.23 0.00 -0.11 -4.94 105.19 106.83 3kop n GLY 76 Ca 0.10 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.73 3kop n GLY 76 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3kop s ASP 77 N -2.10 6.29 -0.15 1.61 1.01 -0.53 -0.90 116.67 121.91 3kop s ASP 77 Ca 0.00 2.71 0.01 0.00 0.71 0.00 0.00 52.55 55.99 3kop s ASP 77 Cb 0.00 -2.64 0.02 0.00 1.01 0.00 0.00 42.92 41.30 3kop s ASP 77 CO 0.00 -0.87 -0.18 -0.69 0.21 0.00 0.00 175.17 173.64 3kop s VAL 78 N -1.24 1.82 0.16 -1.27 1.01 -0.37 -1.08 120.40 119.44 3kop s VAL 78 Ca 0.57 -0.81 0.10 0.00 0.00 0.00 0.00 61.98 61.83 3kop s VAL 78 Cb -0.39 -1.65 -0.04 0.00 0.00 0.00 0.00 36.38 34.29 3kop s VAL 78 CO 0.51 0.50 -0.20 0.00 0.00 0.00 0.00 175.10 175.91 3kop s TYR 80 N -1.42 2.26 -0.02 0.00 6.14 0.23 -1.19 117.35 123.36 3kop s TYR 80 Ca 0.20 -0.97 0.05 0.00 0.64 0.00 0.00 57.07 56.99 3kop s TYR 80 Cb -0.09 -1.55 -0.01 0.00 0.42 0.00 0.00 41.96 40.73 3kop s TYR 80 CO 0.10 -0.42 -0.18 -0.06 0.64 0.00 0.00 175.55 175.63 3kop s PHE 81 N 0.56 1.64 -0.25 4.97 0.40 -0.54 -0.68 117.98 124.07 3kop s PHE 81 Ca -0.15 -0.36 -0.11 0.00 -0.60 0.00 0.00 56.93 55.71 3kop s PHE 81 Cb -0.17 -1.07 -0.05 0.00 0.51 0.00 0.00 43.02 42.24 3kop s PHE 81 CO 0.05 -0.07 0.19 0.99 0.70 0.00 0.00 175.22 177.09 3kop s THR 82 N -0.29 5.33 0.36 0.64 2.01 -1.26 -1.32 115.64 121.11 3kop s THR 82 Ca 0.04 0.22 0.06 0.00 0.31 0.00 0.00 61.69 62.32 3kop s THR 82 Cb -0.08 -3.53 -0.07 0.00 0.01 0.00 0.00 72.50 68.83 3kop s THR 82 CO 0.00 0.30 0.02 -0.36 -0.69 0.00 0.00 174.62 173.89 3kop s PHE 83 N 1.34 2.23 0.43 4.92 0.08 -0.06 -5.01 117.98 121.92 3kop s PHE 83 Ca 0.08 -0.79 0.07 0.00 0.12 0.00 0.00 56.93 56.41 3kop s PHE 83 Cb -0.14 -1.50 -0.03 0.00 -0.57 0.00 0.00 43.02 40.78 3kop s PHE 83 CO 0.07 0.25 0.30 0.95 -0.10 0.00 0.00 175.22 176.69 3kop s THR 84 N -2.98 2.37 0.50 0.64 -4.23 -1.26 -0.98 115.64 109.70 3kop s THR 84 Ca 0.35 -1.51 0.22 0.00 -1.18 0.00 0.00 61.69 59.58 3kop s THR 84 Cb 0.09 -2.88 0.38 0.00 1.34 0.00 0.00 72.50 71.43 3kop s THR 84 CO 0.16 0.00 1.98 0.28 -0.54 0.00 0.00 174.62 176.51 3kop h SER 85 N 1.15 0.10 0.10 3.99 0.02 -1.68 -2.21 113.55 115.03 3kop h SER 85 Ca -0.41 0.00 -0.11 0.00 -0.84 0.00 0.00 61.79 60.43 3kop h SER 85 Cb 1.27 -0.02 -0.01 0.00 0.14 0.00 0.00 62.40 63.78 3kop h SER 85 CO 0.63 0.06 -0.39 0.78 -1.14 0.00 0.00 176.83 176.76 3kop h ASN 86 N 0.11 0.40 -0.57 3.07 -0.26 -1.92 0.59 115.58 117.00 3kop h ASN 86 Ca 0.27 -0.17 -0.02 0.00 -0.56 0.00 0.00 56.30 55.83 3kop h ASN 86 Cb 0.93 -0.11 -0.03 0.00 -1.06 0.00 0.00 38.32 38.05 3kop h ASN 86 CO -0.03 0.75 0.29 0.44 -1.06 0.00 0.00 177.43 177.82 3kop h ASP 87 N 0.32 0.74 0.00 5.81 3.32 -1.79 -3.36 116.42 121.45 3kop h ASP 87 Ca 0.03 -0.11 -0.34 0.00 0.02 0.00 0.00 57.03 56.62 3kop h ASP 87 Cb 0.83 -0.19 -0.06 0.00 0.22 0.00 0.00 39.33 40.13 3kop h ASP 87 CO 0.07 0.64 -2.30 0.18 -1.72 0.00 0.00 179.24 176.11 3kop n LEU 88 N -4.57 2.13 0.00 1.55 4.77 -1.18 -5.05 117.00 114.66 3kop n LEU 88 Ca 0.03 -0.09 0.00 0.00 -0.03 0.00 0.00 56.01 55.92 3kop n LEU 88 Cb 0.11 -0.45 0.00 0.00 -2.33 0.00 0.00 43.42 40.74 3kop n LEU 88 CO 0.37 0.77 0.00 0.29 -1.33 0.00 0.00 177.39 177.49 3kop n LYS 89 N -3.04 0.00 -4.01 3.23 5.02 0.19 -5.13 118.16 114.42 3kop n LYS 89 Ca -0.38 0.00 -0.31 0.00 -2.02 0.00 0.00 58.31 55.60 3kop n LYS 89 Cb 0.98 -0.46 -0.15 0.00 -0.02 0.00 0.00 35.03 35.38 3kop n LYS 89 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3kop s VAL 104 N -0.02 2.08 0.10 -0.18 1.01 -1.26 -4.94 120.40 117.19 3kop s VAL 104 Ca 0.00 -1.90 0.03 0.00 0.00 0.00 0.00 61.98 60.10 3kop s VAL 104 Cb 0.00 -2.38 -0.04 0.00 0.00 0.00 0.00 36.38 33.96 3kop s VAL 104 CO 0.00 -0.33 0.16 -1.58 0.00 0.00 0.00 175.10 173.34 3kop s GLN 105 N 1.07 3.11 -0.21 2.72 0.74 -1.26 -4.93 119.66 120.90 3kop s GLN 105 Ca 0.02 -0.65 -0.12 0.00 0.05 0.00 0.00 55.36 54.66 3kop s GLN 105 Cb -0.19 -2.83 -0.05 0.00 1.10 0.00 0.00 33.01 31.04 3kop s GLN 105 CO -0.08 0.55 0.20 0.99 -0.55 0.00 0.00 175.29 176.41 3kop s THR 106 N -1.55 5.34 0.02 -0.34 2.01 -1.26 -1.68 115.64 118.18 3kop s THR 106 Ca 0.32 0.31 0.07 0.00 0.31 0.00 0.00 61.69 62.70 3kop s THR 106 Cb -0.12 -3.54 -0.03 0.00 0.01 0.00 0.00 72.50 68.82 3kop s THR 106 CO 0.25 0.37 -0.20 -0.63 -0.69 0.00 0.00 174.62 173.71 3kop s ILE 107 N 0.81 2.62 -0.14 1.82 -1.09 -0.15 -1.74 121.20 123.33 3kop s ILE 107 Ca 0.11 -1.13 -0.03 0.00 -2.23 0.00 0.00 60.65 57.37 3kop s ILE 107 Cb -0.13 -2.05 -0.03 0.00 -1.58 0.00 0.00 42.46 38.67 3kop s ILE 107 CO 0.03 0.42 -0.04 -0.69 -1.23 0.00 0.00 174.94 173.44 3kop s VAL 108 N -0.82 3.92 -0.31 2.92 1.01 0.92 -0.88 120.40 127.16 3kop s VAL 108 Ca 0.13 -0.36 -0.11 0.00 0.00 0.00 0.00 61.98 61.65 3kop s VAL 108 Cb -0.10 -2.70 -0.02 0.00 0.00 0.00 0.00 36.38 33.56 3kop s VAL 108 CO 0.03 0.52 0.17 -0.62 0.00 0.00 0.00 175.10 175.20 3kop s ASP 109 N 0.10 5.74 -0.25 3.32 -1.08 -0.43 -0.75 116.67 123.32 3kop s ASP 109 Ca -0.01 -0.35 -0.06 0.00 -0.52 0.00 0.00 52.55 51.61 3kop s ASP 109 Cb -0.14 -2.05 -0.02 0.00 -1.46 0.00 0.00 42.92 39.25 3kop s ASP 109 CO 0.03 -0.16 0.04 -0.76 0.52 0.00 0.00 175.17 174.84 3kop s LEU 110 N 1.67 3.32 0.05 -1.34 1.43 -0.90 -1.47 118.68 121.43 3kop s LEU 110 Ca 0.06 -0.30 0.06 0.00 -1.03 0.00 0.00 54.13 52.92 3kop s LEU 110 Cb -0.17 -1.87 -0.02 0.00 0.03 0.00 0.00 46.19 44.16 3kop s LEU 110 CO 0.08 -0.04 -0.18 0.00 0.23 0.00 0.00 176.35 176.44 3kop s ALA 111 N 1.57 1.52 -0.13 4.21 0.00 -0.33 -1.46 121.76 127.14 3kop s ALA 111 Ca 0.06 -0.98 0.03 0.00 0.00 0.00 0.00 51.96 51.07 3kop s ALA 111 Cb -0.15 -0.27 0.01 0.00 0.00 0.00 0.00 23.12 22.71 3kop s ALA 111 CO 0.02 0.32 -0.22 0.08 0.00 0.00 0.00 175.76 175.95 3kop s VAL 112 N -0.84 2.05 -0.27 0.00 1.01 -0.11 -0.38 120.40 121.86 3kop s VAL 112 Ca 0.05 -0.98 -0.11 0.00 0.00 0.00 0.00 61.98 60.94 3kop s VAL 112 Cb -0.08 -1.81 -0.05 0.00 0.00 0.00 0.00 36.38 34.44 3kop s VAL 112 CO 0.02 0.55 0.18 -0.36 0.00 0.00 0.00 175.10 175.49 3kop s PHE 113 N 0.72 3.24 -1.01 5.22 0.08 -0.24 -1.57 117.98 124.42 3kop s PHE 113 Ca -0.09 0.13 0.13 0.00 0.12 0.00 0.00 56.93 57.22 3kop s PHE 113 Cb -0.16 -2.35 -0.04 0.00 -0.57 0.00 0.00 43.02 39.90 3kop s PHE 113 CO 0.00 -0.11 0.68 2.48 -0.10 0.00 0.00 175.22 178.17 3kop n TYR 114 N 4.87 0.00 -3.90 0.36 0.18 -0.04 -0.93 117.16 117.70 3kop n TYR 114 Ca -0.14 0.00 -0.06 0.00 1.88 0.00 0.00 57.90 59.58 3kop n TYR 114 Cb 0.52 0.00 -0.02 0.00 -0.38 0.00 0.00 39.34 39.46 3kop n TYR 114 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 3kop n GLY 115 N 1.09 3.15 3.56 -7.48 0.00 -1.24 -4.77 105.19 99.50 3kop n GLY 115 Ca 0.04 -1.59 -0.25 0.00 0.00 0.00 0.00 46.02 44.22 3kop n GLY 115 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 3kop n ARG 116 N -0.22 0.74 -3.34 1.61 1.85 -1.26 -3.26 116.66 112.79 3kop n ARG 116 Ca 0.01 -3.26 -0.16 0.00 -1.00 0.00 0.00 57.85 53.44 3kop n ARG 116 Cb 0.22 0.42 0.08 0.00 -1.05 0.00 0.00 32.46 32.13 3kop n ARG 116 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 3kop n ASN 117 N -1.77 -2.30 -4.69 2.89 4.13 -1.26 -4.75 115.26 107.51 3kop n ASN 117 Ca -0.04 -0.57 -0.33 0.00 1.68 0.00 0.00 54.58 55.32 3kop n ASN 117 Cb 0.59 -4.78 -0.09 0.00 -1.54 0.00 0.00 39.78 33.97 3kop n ASN 117 CO 0.00 0.00 0.00 0.20 0.28 0.00 0.00 177.26 177.74 3kop s ASN 118 N -4.19 5.18 -0.08 6.41 0.01 -1.26 -4.90 114.94 116.10 3kop s ASN 118 Ca 0.04 0.02 0.02 0.00 -0.71 0.00 0.00 52.86 52.23 3kop s ASN 118 Cb -0.02 -1.37 0.01 0.00 0.41 0.00 0.00 41.25 40.28 3kop s ASN 118 CO 0.68 0.29 -0.15 -0.76 -1.51 0.00 0.00 177.10 175.64 3kop s LEU 119 N -1.53 1.74 -1.26 0.60 1.43 -1.26 -4.21 118.68 114.19 3kop s LEU 119 Ca 0.19 -0.38 -0.13 0.00 -1.03 0.00 0.00 54.13 52.78 3kop s LEU 119 Cb -0.12 -1.01 0.15 0.00 0.03 0.00 0.00 46.19 45.24 3kop s LEU 119 CO 0.10 0.05 1.65 0.18 0.23 0.00 0.00 176.35 178.56 3kop n LEU 120 N 3.87 5.68 -3.69 1.79 4.77 -0.13 -4.24 117.00 125.05 3kop n LEU 120 Ca -0.21 -4.42 -0.10 0.00 -0.03 0.00 0.00 56.01 51.25 3kop n LEU 120 Cb 0.52 -1.60 -0.10 0.00 -2.33 0.00 0.00 43.42 39.90 3kop n LEU 120 CO 0.25 0.85 0.08 -0.22 -1.33 0.00 0.00 177.39 177.03 3kop s LEU 121 N 1.49 -0.11 0.13 2.23 2.96 -1.26 -0.70 118.68 123.42 3kop s LEU 121 Ca 0.44 0.94 -0.01 0.00 -0.22 0.00 0.00 54.13 55.27 3kop s LEU 121 Cb 0.03 1.44 -0.04 0.00 0.50 0.00 0.00 46.19 48.11 3kop s LEU 121 CO 0.01 -0.19 0.05 0.54 -1.32 0.00 0.00 176.35 175.44 3kop s ASN 122 N 1.30 0.36 0.00 3.68 2.20 -0.06 -4.78 114.94 117.64 3kop s ASN 122 Ca -0.09 -1.21 0.24 0.00 -0.94 0.00 0.00 52.86 50.87 3kop s ASN 122 Cb -0.08 0.29 1.38 0.00 -2.00 0.00 0.00 41.25 40.84 3kop s ASN 122 CO -0.12 -0.72 1.89 0.61 -2.94 0.00 0.00 177.10 175.82 3kop n GLY 123 N -0.10 -0.91 0.08 0.45 0.00 -1.26 -1.03 105.19 102.42 3kop n GLY 123 Ca -0.06 -0.17 -0.16 0.00 0.00 0.00 0.00 46.02 45.64 3kop n GLY 123 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3kop h ASP 124 N 0.18 0.00 0.00 1.61 3.32 -2.00 -3.44 116.42 116.09 3kop h ASP 124 Ca 0.00 -0.71 0.00 0.00 0.02 0.00 0.00 57.03 56.34 3kop h ASP 124 Cb 0.04 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.59 3kop h ASP 124 CO 0.00 1.14 -0.00 0.35 -1.72 0.00 0.00 179.24 179.00 3kop n THR 125 N -4.56 0.00 -0.04 0.35 -2.24 -1.24 -5.14 114.28 101.42 3kop n THR 125 Ca -0.17 -0.19 0.00 0.00 -2.27 0.00 0.00 64.05 61.42 3kop n THR 125 Cb 0.51 1.00 0.00 0.00 -2.10 0.00 0.00 70.33 69.74 3kop n THR 125 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3kop n GLY 126 N 0.39 1.00 3.75 3.38 0.00 -0.20 -4.97 105.19 108.53 3kop n GLY 126 Ca 0.00 -1.42 -0.41 0.00 0.00 0.00 0.00 46.02 44.19 3kop n GLY 126 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3kop s TRP 127 N 0.00 3.36 -0.54 1.61 0.52 -1.26 -0.88 118.94 121.75 3kop s TRP 127 Ca 0.00 1.43 0.04 0.00 0.02 0.00 0.00 56.10 57.59 3kop s TRP 127 Cb 0.00 -3.48 0.16 0.00 -1.15 0.00 0.00 33.47 29.00 3kop s TRP 127 CO 0.00 -1.32 0.38 0.14 0.02 0.00 0.00 176.95 176.17 3kop s VAL 128 N -0.42 1.69 0.41 4.03 -7.23 0.12 -4.94 120.40 114.05 3kop s VAL 128 Ca 0.51 -3.34 -0.26 0.00 -1.81 0.00 0.00 61.98 57.08 3kop s VAL 128 Cb -0.34 -2.13 -0.09 0.00 0.56 0.00 0.00 36.38 34.37 3kop s VAL 128 CO 0.40 -1.06 1.38 -2.84 -0.31 0.00 0.00 175.10 172.67 3kop s PRO 129 N -0.53 3.94 -0.02 4.82 0.02 -1.26 -4.80 135.00 137.17 3kop s PRO 129 Ca 0.26 2.33 0.03 0.00 0.02 0.00 0.00 61.00 63.64 3kop s PRO 129 Cb -0.06 -2.80 -0.03 0.00 0.02 0.00 0.00 34.50 31.63 3kop s PRO 129 CO -0.14 -0.57 -0.08 0.20 -0.33 0.00 0.00 177.00 176.07 3kop s GLY 130 N -0.52 1.70 -0.17 0.52 0.00 -0.65 -4.88 107.32 103.31 3kop s GLY 130 Ca 0.57 -0.99 -0.29 0.00 0.00 0.00 0.00 44.72 44.00 3kop s GLY 130 CO 0.54 -0.82 1.24 -1.31 0.00 0.00 0.00 173.10 172.75 3kop s ASN 131 N -1.16 6.96 -0.40 1.64 -0.87 0.14 -1.37 114.94 119.88 3kop s ASN 131 Ca 0.15 1.67 -0.24 0.00 -1.57 0.00 0.00 52.86 52.87 3kop s ASN 131 Cb -0.11 -2.54 0.02 0.00 -0.02 0.00 0.00 41.25 38.60 3kop s ASN 131 CO 0.05 -0.75 0.82 -0.69 -2.57 0.00 0.00 177.10 173.96 3kop s VAL 132 N 3.43 4.65 0.00 1.60 1.01 -0.76 -0.60 120.40 129.73 3kop s VAL 132 Ca 0.54 0.76 0.00 0.00 0.00 0.00 0.00 61.98 63.28 3kop s VAL 132 Cb -0.21 -4.29 0.00 0.00 0.00 0.00 0.00 36.38 31.88 3kop s VAL 132 CO 0.14 -0.59 0.24 2.22 0.00 0.00 0.00 175.10 177.11 3kop n PHE 133 N 6.66 0.00 -3.59 5.22 -1.74 -0.11 -4.68 117.46 119.22 3kop n PHE 133 Ca 0.04 0.00 -0.12 0.00 -0.56 0.00 0.00 57.45 56.81 3kop n PHE 133 Cb 0.48 0.00 -0.04 0.00 1.52 0.00 0.00 39.48 41.44 3kop n PHE 133 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 3kop s ALA 134 N -0.41 -1.13 -0.08 1.98 0.00 -1.18 -0.41 121.76 120.52 3kop s ALA 134 Ca 0.00 0.20 0.00 0.00 0.00 0.00 0.00 51.96 52.17 3kop s ALA 134 Cb 0.00 0.63 0.02 0.00 0.00 0.00 0.00 23.12 23.77 3kop s ALA 134 CO 0.00 -0.62 -0.07 0.99 0.00 0.00 0.00 175.76 176.06 3kop s THR 135 N -3.39 0.85 -0.02 0.00 2.01 -0.37 -1.24 115.64 113.47 3kop s THR 135 Ca 0.00 -0.23 -0.30 0.00 0.31 0.00 0.00 61.69 61.47 3kop s THR 135 Cb 0.01 -0.87 -0.06 0.00 0.01 0.00 0.00 72.50 71.59 3kop s THR 135 CO -0.09 0.32 1.59 -0.63 -0.69 0.00 0.00 174.62 175.12 3kop s ILE 136 N 1.38 3.50 -0.23 1.82 1.01 -0.07 -0.59 121.20 128.01 3kop s ILE 136 Ca -0.02 0.75 0.09 0.00 0.00 0.00 0.00 60.65 61.47 3kop s ILE 136 Cb -0.14 -3.48 -0.11 0.00 0.01 0.00 0.00 42.46 38.74 3kop s ILE 136 CO -0.04 -0.04 0.29 1.33 0.00 0.00 0.00 174.94 176.49 3kop n VAL 137 N 5.14 0.00 -3.85 2.92 0.24 0.50 -4.90 118.33 118.38 3kop n VAL 137 Ca 0.16 -0.25 -0.12 0.00 -2.04 0.00 0.00 64.34 62.08 3kop n VAL 137 Cb 0.42 0.68 -0.14 0.00 -1.47 0.00 0.00 33.84 33.34 3kop n VAL 137 CO 0.00 0.00 0.00 -1.61 -2.14 0.00 0.00 176.83 173.08 3kop s GLU 138 N -2.18 0.05 0.00 7.34 2.02 -0.93 -4.91 118.70 120.09 3kop s GLU 138 Ca 0.00 0.08 0.00 0.00 0.02 0.00 0.00 54.97 55.08 3kop s GLU 138 Cb 0.06 0.01 0.00 0.00 0.10 0.00 0.00 34.13 34.30 3kop s GLU 138 CO 0.36 -0.02 0.00 0.41 0.02 0.00 0.00 175.26 176.03 3kop n GLY 139 N 3.15 0.49 0.23 -1.39 0.00 -1.26 -0.96 105.19 105.44 3kop n GLY 139 Ca -0.13 -0.57 -0.09 0.00 0.00 0.00 0.00 46.02 45.23 3kop n GLY 139 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3kop h LEU 140 N 0.00 0.69 -0.46 0.99 5.85 -1.91 -2.92 115.31 117.55 3kop h LEU 140 Ca 0.00 -0.20 0.02 0.00 0.84 0.00 0.00 57.88 58.54 3kop h LEU 140 Cb 0.00 -0.18 -0.03 0.00 0.37 0.00 0.00 40.66 40.82 3kop h LEU 140 CO 0.00 0.70 0.28 0.44 -0.34 0.00 0.00 178.44 179.53 3kop h ASP 141 N 0.64 0.47 0.00 1.25 3.32 -1.96 0.21 116.42 120.35 3kop h ASP 141 Ca 0.16 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.20 3kop h ASP 141 Cb 0.25 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 39.70 3kop h ASP 141 CO -0.01 0.34 0.00 -0.62 -1.72 0.00 0.00 179.24 177.23 3kop n GLU 142 N -4.81 0.32 0.00 3.56 4.71 -1.10 -1.58 120.64 121.74 3kop n GLU 142 Ca 0.02 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.17 3kop n GLU 142 Cb 0.05 -1.30 0.00 0.00 -1.01 0.00 0.00 31.44 29.19 3kop n GLU 142 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 3kop n ALA 144 N 0.72 0.00 -0.09 0.62 0.00 0.74 -1.61 120.51 120.89 3kop n ALA 144 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.42 3kop n ALA 144 Cb 0.14 0.00 0.21 0.00 0.00 0.00 0.00 19.45 19.81 3kop n ALA 144 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3kop h ALA 145 N 0.00 1.24 -0.54 0.00 0.00 -1.55 -1.57 119.26 116.84 3kop h ALA 145 Ca 0.00 -0.21 -0.11 0.00 0.00 0.00 0.00 54.91 54.59 3kop h ALA 145 Cb 0.00 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 3kop h ALA 145 CO 0.00 0.52 -0.09 0.00 0.00 0.00 0.00 179.25 179.68 3kop h ALA 146 N 1.37 0.82 -0.37 0.00 0.00 -1.58 -2.65 119.26 116.85 3kop h ALA 146 Ca 0.15 -0.34 -0.13 0.00 0.00 0.00 0.00 54.91 54.59 3kop h ALA 146 Cb 0.33 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 3kop h ALA 146 CO 0.01 0.66 -0.30 0.00 0.00 0.00 0.00 179.25 179.62 3kop h GLN 148 N 0.69 0.46 -0.07 0.00 4.15 -1.26 0.18 115.11 119.27 3kop h GLN 148 Ca 0.08 -0.03 -0.12 0.00 0.77 0.00 0.00 58.65 59.35 3kop h GLN 148 Cb 0.84 -0.10 -0.01 0.00 0.21 0.00 0.00 27.48 28.42 3kop h GLN 148 CO 0.07 0.30 -0.49 0.22 -1.93 0.00 0.00 178.83 177.00 3kop h ASP 149 N 0.47 0.19 -0.67 -0.69 3.58 -1.07 -2.21 116.42 116.03 3kop h ASP 149 Ca 0.32 -0.09 -0.05 0.00 0.42 0.00 0.00 57.03 57.63 3kop h ASP 149 Cb 0.38 -0.05 -0.03 0.00 1.72 0.00 0.00 39.33 41.34 3kop h ASP 149 CO -0.29 0.66 0.24 0.40 -2.88 0.00 0.00 179.24 177.36 3kop h ILE 150 N 0.14 1.25 0.00 2.25 2.04 -0.08 0.54 117.51 123.65 3kop h ILE 150 Ca 0.01 -0.82 0.00 0.00 1.00 0.00 0.00 64.86 65.05 3kop h ILE 150 Cb 0.93 0.52 0.00 0.00 -0.74 0.00 0.00 36.82 37.53 3kop h ILE 150 CO 0.07 0.32 0.00 1.87 0.00 0.00 0.00 178.15 180.41 3kop n TRP 151 N -4.36 0.00 0.00 1.37 -0.00 -0.04 -0.45 117.44 113.95 3kop n TRP 151 Ca 0.05 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.55 3kop n TRP 151 Cb 0.20 0.00 0.00 0.00 -0.00 0.00 0.00 31.31 31.51 3kop n TRP 151 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 3kop n GLY 153 N -0.66 0.00 0.00 5.87 0.00 0.19 -5.02 105.19 105.57 3kop n GLY 153 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 3kop n GLY 153 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3kop n GLY 154 N 0.00 0.93 0.63 -0.02 0.00 0.40 -4.82 105.19 102.31 3kop n GLY 154 Ca 0.00 -1.92 0.06 0.00 0.00 0.00 0.00 46.02 44.16 3kop n GLY 154 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kop n ALA 155 N 1.36 2.29 -1.76 4.61 0.00 -1.26 -4.43 120.51 121.32 3kop n ALA 155 Ca 0.00 -0.97 -0.42 0.00 0.00 0.00 0.00 53.44 52.05 3kop n ALA 155 Cb 0.00 -0.45 -0.03 0.00 0.00 0.00 0.00 19.45 18.97 3kop n ALA 155 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 3kop s ARG 156 N -1.00 4.14 -1.10 0.00 1.81 -1.26 -1.52 118.95 120.01 3kop s ARG 156 Ca 0.22 2.57 0.00 0.00 -1.72 0.00 0.00 55.73 56.80 3kop s ARG 156 Cb 0.12 -3.09 0.00 0.00 -0.45 0.00 0.00 34.95 31.54 3kop s ARG 156 CO 0.17 -0.73 0.00 -0.25 -0.68 0.00 0.00 175.30 173.80 3kop n ASP 157 N 3.99 -5.17 -4.80 0.23 8.00 -1.26 -4.96 116.55 112.57 3kop n ASP 157 Ca 0.16 0.26 -0.36 0.00 0.71 0.00 0.00 54.79 55.55 3kop n ASP 157 Cb 0.36 -3.59 -0.07 0.00 -0.02 0.00 0.00 41.12 37.80 3kop n ASP 157 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 3kop s GLU 158 N -2.73 3.52 -0.03 -1.24 2.56 -0.57 -4.64 118.70 115.57 3kop s GLU 158 Ca 0.00 -0.21 0.05 0.00 0.00 0.00 0.00 54.97 54.81 3kop s GLU 158 Cb 0.00 -3.16 -0.01 0.00 2.00 0.00 0.00 34.13 32.97 3kop s GLU 158 CO 0.00 0.65 -0.18 0.99 -0.56 0.00 0.00 175.26 176.15 3kop s THR 159 N -0.67 1.50 -0.24 -1.70 2.01 -1.26 -2.43 115.64 112.86 3kop s THR 159 Ca 0.12 -0.78 -0.07 0.00 0.31 0.00 0.00 61.69 61.28 3kop s THR 159 Cb -0.12 -1.27 -0.03 0.00 0.01 0.00 0.00 72.50 71.09 3kop s THR 159 CO 0.02 0.43 0.06 -0.22 -0.69 0.00 0.00 174.62 174.23 3kop s LEU 160 N -0.17 3.47 -0.14 4.42 2.96 -0.18 -1.66 118.68 127.37 3kop s LEU 160 Ca 0.01 -0.17 0.02 0.00 -0.22 0.00 0.00 54.13 53.77 3kop s LEU 160 Cb -0.10 -1.92 0.01 0.00 0.50 0.00 0.00 46.19 44.68 3kop s LEU 160 CO 0.01 -0.00 -0.21 -0.89 -1.32 0.00 0.00 176.35 173.94 3kop s THR 161 N 1.41 2.00 -0.20 3.68 2.01 0.19 -2.31 115.64 122.43 3kop s THR 161 Ca 0.05 -0.93 -0.09 0.00 0.31 0.00 0.00 61.69 61.03 3kop s THR 161 Cb -0.15 -1.78 -0.05 0.00 0.01 0.00 0.00 72.50 70.54 3kop s THR 161 CO 0.03 0.54 0.11 -0.36 -0.69 0.00 0.00 174.62 174.25 3kop s PHE 162 N 0.93 3.36 0.07 4.92 0.40 0.16 -1.26 117.98 126.55 3kop s PHE 162 Ca -0.05 0.25 -0.06 0.00 -0.60 0.00 0.00 56.93 56.47 3kop s PHE 162 Cb -0.15 -2.14 -0.01 0.00 0.51 0.00 0.00 43.02 41.22 3kop s PHE 162 CO -0.04 0.23 0.11 -1.54 0.70 0.00 0.00 175.22 174.69 3kop s SER 163 N 0.41 0.24 0.21 1.36 1.04 -0.48 -1.01 113.70 115.48 3kop s SER 163 Ca 0.07 -0.74 -0.30 0.00 0.48 0.00 0.00 55.95 55.46 3kop s SER 163 Cb -0.12 0.28 -0.08 0.00 0.10 0.00 0.00 66.02 66.21 3kop s SER 163 CO -0.01 -0.66 1.12 -0.13 0.98 0.00 0.00 173.24 174.54 3kop s ARG 164 N -3.73 4.59 -0.05 4.02 0.52 -1.26 -0.66 118.95 122.38 3kop s ARG 164 Ca 0.04 1.78 -0.18 0.00 -0.52 0.00 0.00 55.73 56.85 3kop s ARG 164 Cb 0.05 -3.24 -0.05 0.00 0.52 0.00 0.00 34.95 32.23 3kop s ARG 164 CO -0.10 0.09 0.51 0.00 0.02 0.00 0.00 175.30 175.82 3kop s ALA 165 N -0.51 3.52 -1.82 2.13 0.00 -0.48 -4.67 121.76 119.93 3kop s ALA 165 Ca 0.48 -0.11 0.00 0.00 0.00 0.00 0.00 51.96 52.33 3kop s ALA 165 Cb -0.31 -2.63 0.00 0.00 0.00 0.00 0.00 23.12 20.18 3kop s ALA 165 CO 0.37 0.16 0.46 0.39 0.00 0.00 0.00 175.76 177.14