#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1l6t n GLU 2 N 0.00 1.15 -0.84 0.03 1.02 -1.26 -3.74 120.64 117.01 1l6t n GLU 2 Ca 0.00 -0.06 0.02 0.00 -0.02 0.00 0.00 57.16 57.10 1l6t n GLU 2 Cb 0.00 -1.34 0.02 0.00 -0.02 0.00 0.00 31.44 30.10 1l6t n GLU 2 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1l6t n ASN 3 N -1.34 0.48 -0.00 1.62 3.02 -1.26 -4.18 115.26 113.60 1l6t n ASN 3 Ca 0.04 -2.09 -0.00 0.00 -0.03 0.00 0.00 54.58 52.50 1l6t n ASN 3 Cb 0.28 -0.25 -0.00 0.00 -0.61 0.00 0.00 39.78 39.20 1l6t n ASN 3 CO 0.00 0.00 0.00 -0.11 -2.62 0.00 0.00 177.26 174.53 1l6t n LEU 4 N 0.09 1.11 -0.04 3.41 -0.00 -1.26 -4.77 117.00 115.53 1l6t n LEU 4 Ca 0.03 0.00 -0.07 0.00 -0.00 0.00 0.00 56.01 55.97 1l6t n LEU 4 Cb 0.86 -0.00 -0.04 0.00 -0.00 0.00 0.00 43.42 44.24 1l6t n LEU 4 CO -0.01 0.18 -0.79 0.59 -0.00 0.00 0.00 177.39 177.36 1l6t n ASN 5 N -2.82 2.36 -0.19 1.96 4.13 -1.26 -4.55 115.26 114.89 1l6t n ASN 5 Ca -0.00 0.01 -0.02 0.00 1.68 0.00 0.00 54.58 56.25 1l6t n ASN 5 Cb 0.50 -0.18 0.04 0.00 -1.54 0.00 0.00 39.78 38.60 1l6t n ASN 5 CO 0.00 0.00 0.00 0.24 0.28 0.00 0.00 177.26 177.78 1l6t h MET 6 N -0.12 -0.05 -0.58 3.52 2.86 -1.79 0.15 114.93 118.93 1l6t h MET 6 Ca -0.21 0.00 0.12 0.00 -2.06 0.00 0.00 59.70 57.55 1l6t h MET 6 Cb 1.26 0.01 -0.09 0.00 0.06 0.00 0.00 31.60 32.84 1l6t h MET 6 CO -0.07 -0.04 0.03 0.22 1.06 0.00 0.00 176.91 178.11 1l6t h ASP 7 N -0.05 -0.20 -0.05 1.22 1.82 -1.84 0.18 116.42 117.50 1l6t h ASP 7 Ca 0.27 0.13 0.04 0.00 -0.39 0.00 0.00 57.03 57.08 1l6t h ASP 7 Cb 0.47 0.23 -0.05 0.00 0.68 0.00 0.00 39.33 40.66 1l6t h ASP 7 CO -0.62 -0.08 -0.25 0.25 -1.61 0.00 0.00 179.24 176.93 1l6t h LEU 8 N 0.14 -0.76 -0.32 2.28 6.46 -1.00 0.17 115.31 122.28 1l6t h LEU 8 Ca 0.30 0.11 0.07 0.00 -0.12 0.00 0.00 57.88 58.24 1l6t h LEU 8 Cb 0.47 0.32 -0.07 0.00 -0.73 0.00 0.00 40.66 40.65 1l6t h LEU 8 CO -0.47 -0.32 -0.16 0.25 -0.62 0.00 0.00 178.44 177.12 1l6t h LEU 9 N -0.37 -0.55 -0.37 2.25 5.85 0.21 -1.36 115.31 120.97 1l6t h LEU 9 Ca 0.08 0.13 0.08 0.00 0.84 0.00 0.00 57.88 59.00 1l6t h LEU 9 Cb 0.47 0.30 -0.07 0.00 0.37 0.00 0.00 40.66 41.73 1l6t h LEU 9 CO -0.26 -0.20 -0.11 1.88 -0.34 0.00 0.00 178.44 179.42 1l6t h TYR 10 N -0.11 -0.23 -0.63 1.25 -1.99 0.15 -1.62 116.97 113.78 1l6t h TYR 10 Ca 0.17 0.03 0.12 0.00 2.00 0.00 0.00 58.73 61.05 1l6t h TYR 10 Cb 0.37 0.16 -0.12 0.00 2.00 0.00 0.00 36.73 39.14 1l6t h TYR 10 CO -0.37 -0.18 -0.27 1.98 -0.00 0.00 0.00 178.16 179.32 1l6t h MET 11 N -0.02 -0.10 0.00 4.88 4.05 0.41 1.58 114.93 125.74 1l6t h MET 11 Ca 0.18 0.01 -0.01 0.00 -0.28 0.00 0.00 59.70 59.60 1l6t h MET 11 Cb 0.29 0.02 -0.00 0.00 -0.80 0.00 0.00 31.60 31.11 1l6t h MET 11 CO -0.39 -0.06 -0.04 0.00 0.23 0.00 0.00 176.91 176.64 1l6t h ALA 12 N 1.27 1.39 -0.69 0.39 0.00 -0.86 0.23 119.26 120.99 1l6t h ALA 12 Ca 0.27 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.15 1l6t h ALA 12 Cb 0.54 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.32 1l6t h ALA 12 CO -0.70 0.05 0.00 0.00 0.00 0.00 0.00 179.25 178.60 1l6t n ALA 13 N -2.29 -0.07 -0.18 0.00 0.00 0.49 -2.12 120.51 116.36 1l6t n ALA 13 Ca -0.03 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.35 1l6t n ALA 13 Cb 0.14 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.58 1l6t n ALA 13 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1l6t h ALA 14 N -2.00 -0.10 -0.69 0.00 0.00 -0.15 0.38 119.26 116.70 1l6t h ALA 14 Ca 0.00 0.14 0.15 0.00 0.00 0.00 0.00 54.91 55.20 1l6t h ALA 14 Cb 0.00 0.76 -0.12 0.00 0.00 0.00 0.00 17.79 18.43 1l6t h ALA 14 CO 0.00 -0.70 -0.02 0.28 0.00 0.00 0.00 179.25 178.81 1l6t h VAL 15 N -0.19 0.40 0.56 0.00 2.07 -0.71 0.29 116.25 118.67 1l6t h VAL 15 Ca 0.21 -0.03 -0.02 0.00 0.82 0.00 0.00 66.70 67.67 1l6t h VAL 15 Cb 0.55 0.30 0.00 0.00 -1.52 0.00 0.00 31.29 30.62 1l6t h VAL 15 CO -0.63 0.02 -0.30 0.24 0.02 0.00 0.00 177.57 176.92 1l6t h MET 16 N 0.09 -0.76 -0.94 1.57 2.07 0.12 -1.23 114.93 115.85 1l6t h MET 16 Ca 0.36 0.05 0.20 0.00 -2.07 0.00 0.00 59.70 58.25 1l6t h MET 16 Cb 0.61 0.17 -0.08 0.00 -1.87 0.00 0.00 31.60 30.43 1l6t h MET 16 CO -0.61 -0.51 0.61 0.52 1.07 0.00 0.00 176.91 177.99 1l6t h MET 17 N -0.79 0.50 0.00 1.72 2.86 0.72 0.05 114.93 119.98 1l6t h MET 17 Ca -0.07 -0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.54 1l6t h MET 17 Cb 0.62 -0.11 0.00 0.00 0.06 0.00 0.00 31.60 32.17 1l6t h MET 17 CO 0.10 0.33 0.00 0.41 1.06 0.00 0.00 176.91 178.81 1l6t n GLY 18 N -1.46 -1.69 0.38 8.32 0.00 0.89 -0.58 105.19 111.04 1l6t n GLY 18 Ca 0.21 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.22 1l6t n GLY 18 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 1l6t n LEU 19 N -1.41 -0.62 0.05 0.99 -0.00 -0.51 0.55 117.00 116.04 1l6t n LEU 19 Ca 0.00 1.72 -0.12 0.00 -0.00 0.00 0.00 56.01 57.61 1l6t n LEU 19 Cb 0.00 -0.40 -0.05 0.00 -0.00 0.00 0.00 43.42 42.96 1l6t n LEU 19 CO 0.00 -1.55 0.63 0.00 -0.00 0.00 0.00 177.39 176.47 1l6t h ALA 20 N 1.40 -0.50 0.02 1.47 0.00 -1.07 0.21 119.26 120.80 1l6t h ALA 20 Ca 0.35 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 55.26 1l6t h ALA 20 Cb 0.60 0.62 -0.04 0.00 0.00 0.00 0.00 17.79 18.97 1l6t h ALA 20 CO -0.98 -0.86 -0.39 0.00 0.00 0.00 0.00 179.25 177.02 1l6t h ALA 21 N 0.22 -0.85 -0.91 0.00 0.00 0.26 -0.10 119.26 117.87 1l6t h ALA 21 Ca 0.07 -0.07 0.25 0.00 0.00 0.00 0.00 54.91 55.16 1l6t h ALA 21 Cb 0.58 0.82 -0.16 0.00 0.00 0.00 0.00 17.79 19.04 1l6t h ALA 21 CO -0.30 -0.96 0.14 0.82 0.00 0.00 0.00 179.25 178.95 1l6t h ILE 22 N -0.51 0.18 0.01 0.00 2.04 0.18 0.46 117.51 119.87 1l6t h ILE 22 Ca 0.00 -0.03 0.01 0.00 1.00 0.00 0.00 64.86 65.84 1l6t h ILE 22 Cb 0.54 0.07 -0.03 0.00 -0.74 0.00 0.00 36.82 36.66 1l6t h ILE 22 CO -0.25 0.02 -0.33 1.23 0.00 0.00 0.00 178.15 178.82 1l6t h GLY 23 N 0.10 -1.23 0.81 5.37 0.00 0.12 0.42 103.07 108.67 1l6t h GLY 23 Ca 0.57 0.64 -0.04 0.00 0.00 0.00 0.00 47.33 48.50 1l6t h GLY 23 CO -0.77 -0.35 -0.45 -1.80 0.00 0.00 0.00 176.54 173.17 1l6t h ASP 24 N -0.42 -1.10 -1.72 0.19 3.58 -0.11 0.27 116.42 117.11 1l6t h ASP 24 Ca 0.01 0.05 0.50 0.00 0.42 0.00 0.00 57.03 58.01 1l6t h ASP 24 Cb 0.45 0.30 -0.07 0.00 1.72 0.00 0.00 39.33 41.73 1l6t h ASP 24 CO -0.22 -0.72 1.32 0.00 -2.88 0.00 0.00 179.24 176.74 1l6t h ALA 25 N -1.33 3.63 0.02 -0.78 0.00 -0.07 1.33 119.26 122.07 1l6t h ALA 25 Ca -0.11 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.74 1l6t h ALA 25 Cb 0.91 0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.83 1l6t h ALA 25 CO 0.15 -2.20 -0.01 0.82 0.00 0.00 0.00 179.25 178.00 1l6t h ILE 26 N 0.00 1.38 -0.75 0.00 2.04 0.11 -2.72 117.51 117.56 1l6t h ILE 26 Ca 0.82 -1.84 0.21 0.00 1.00 0.00 0.00 64.86 65.05 1l6t h ILE 26 Cb 3.44 2.51 -0.14 0.00 -0.74 0.00 0.00 36.82 41.89 1l6t h ILE 26 CO -0.01 0.43 0.03 0.61 0.00 0.00 0.00 178.15 179.21 1l6t n GLY 27 N 1.30 -1.00 0.09 5.37 0.00 0.45 0.10 105.19 111.50 1l6t n GLY 27 Ca -0.08 0.73 -0.12 0.00 0.00 0.00 0.00 46.02 46.55 1l6t n GLY 27 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1l6t h ILE 28 N 0.00 1.21 -0.74 -0.61 5.03 -1.58 -2.14 117.51 118.69 1l6t h ILE 28 Ca 0.46 -1.43 0.13 0.00 -0.12 0.00 0.00 64.86 63.90 1l6t h ILE 28 Cb 0.97 2.08 -0.13 0.00 -3.03 0.00 0.00 36.82 36.70 1l6t h ILE 28 CO -0.70 0.33 -0.34 1.23 -0.68 0.00 0.00 178.15 177.99 1l6t h GLY 29 N -0.79 0.03 2.00 5.37 0.00 0.98 1.23 103.07 111.89 1l6t h GLY 29 Ca -0.01 0.44 -0.06 0.00 0.00 0.00 0.00 47.33 47.70 1l6t h GLY 29 CO 0.02 -0.22 -0.28 -2.22 0.00 0.00 0.00 176.54 173.84 1l6t h ILE 30 N -0.10 1.17 -0.20 2.60 1.08 -0.34 -2.59 117.51 119.14 1l6t h ILE 30 Ca 0.28 -0.96 0.01 0.00 -0.39 0.00 0.00 64.86 63.80 1l6t h ILE 30 Cb 0.57 1.52 -0.01 0.00 -3.07 0.00 0.00 36.82 35.83 1l6t h ILE 30 CO -0.79 0.27 0.12 0.25 -0.69 0.00 0.00 178.15 177.31 1l6t h LEU 31 N 0.00 0.20 -1.24 1.44 6.46 0.21 -0.13 115.31 122.25 1l6t h LEU 31 Ca -0.00 -0.00 0.22 0.00 -0.12 0.00 0.00 57.88 57.98 1l6t h LEU 31 Cb 0.50 -0.04 -0.09 0.00 -0.73 0.00 0.00 40.66 40.29 1l6t h LEU 31 CO 0.04 0.15 0.63 1.23 -0.62 0.00 0.00 178.44 179.86 1l6t h GLY 32 N 0.25 1.39 1.09 3.75 0.00 -0.40 0.52 103.07 109.68 1l6t h GLY 32 Ca 0.08 -0.27 -0.22 0.00 0.00 0.00 0.00 47.33 46.92 1l6t h GLY 32 CO -0.03 -0.08 -0.81 -1.33 0.00 0.00 0.00 176.54 174.29 1l6t h GLY 33 N 0.55 0.74 1.83 4.60 0.00 -1.34 -1.17 103.07 108.29 1l6t h GLY 33 Ca 0.56 -1.17 0.00 0.00 0.00 0.00 0.00 47.33 46.72 1l6t h GLY 33 CO -0.31 1.04 0.00 1.17 0.00 0.00 0.00 176.54 178.44 1l6t n LYS 34 N -3.99 0.11 -0.09 4.80 4.81 0.13 -2.54 118.16 121.39 1l6t n LYS 34 Ca -0.09 0.14 -0.13 0.00 -0.87 0.00 0.00 58.31 57.37 1l6t n LYS 34 Cb 0.77 -1.50 -0.15 0.00 0.02 0.00 0.00 35.03 34.17 1l6t n LYS 34 CO 0.00 0.00 0.00 0.34 1.17 0.00 0.00 177.40 178.91 1l6t n PHE 35 N -1.41 0.21 -0.19 5.64 7.35 0.16 -3.85 117.46 125.37 1l6t n PHE 35 Ca 0.06 0.06 -0.00 0.00 -0.76 0.00 0.00 57.45 56.82 1l6t n PHE 35 Cb 0.20 -1.03 0.10 0.00 0.35 0.00 0.00 39.48 39.09 1l6t n PHE 35 CO 0.00 0.00 0.00 1.25 -0.76 0.00 0.00 176.76 177.25 1l6t h LEU 36 N 0.00 0.09 -0.46 -2.13 5.85 -0.92 0.42 115.31 118.17 1l6t h LEU 36 Ca -0.51 0.09 -0.08 0.00 0.84 0.00 0.00 57.88 58.22 1l6t h LEU 36 Cb 2.12 0.11 -0.02 0.00 0.37 0.00 0.00 40.66 43.24 1l6t h LEU 36 CO 0.01 0.06 -0.01 -0.08 -0.34 0.00 0.00 178.44 178.08 1l6t h GLU 37 N 0.31 0.82 0.68 1.25 4.81 -1.75 -0.62 114.58 120.09 1l6t h GLU 37 Ca 0.30 -0.27 -0.03 0.00 -0.13 0.00 0.00 59.36 59.23 1l6t h GLU 37 Cb 0.41 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 29.73 1l6t h GLU 37 CO -0.35 0.88 -0.36 0.78 -0.73 0.00 0.00 179.01 179.23 1l6t h GLY 38 N 0.67 -1.07 2.00 1.92 0.00 -1.25 -1.75 103.07 103.59 1l6t h GLY 38 Ca 0.13 0.41 0.00 0.00 0.00 0.00 0.00 47.33 47.87 1l6t h GLY 38 CO 0.03 -0.38 0.00 0.00 0.00 0.00 0.00 176.54 176.19 1l6t h ALA 39 N -1.46 1.00 -0.27 3.60 0.00 -0.28 -1.01 119.26 120.85 1l6t h ALA 39 Ca -0.09 0.00 0.08 0.00 0.00 0.00 0.00 54.91 54.89 1l6t h ALA 39 Cb 0.75 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.53 1l6t h ALA 39 CO 0.13 0.00 0.41 0.00 0.00 0.00 0.00 179.25 179.79 1l6t h ALA 40 N 2.00 1.85 -0.51 0.00 0.00 -0.15 0.46 119.26 122.91 1l6t h ALA 40 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1l6t h ALA 40 Cb 0.00 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 1l6t h ALA 40 CO 0.00 -0.54 0.33 -0.09 0.00 0.00 0.00 179.25 178.94 1l6t h ARG 41 N 0.00 0.68 -5.02 0.00 9.65 -1.27 -3.38 114.38 115.03 1l6t h ARG 41 Ca 0.13 -0.05 -0.67 0.00 -1.10 0.00 0.00 59.98 58.29 1l6t h ARG 41 Cb 0.94 -0.15 -0.35 0.00 -1.39 0.00 0.00 29.97 29.01 1l6t h ARG 41 CO -0.00 0.46 -0.85 1.14 2.80 0.00 0.00 179.97 183.52 1l6t s GLN 42 N -5.58 2.85 0.00 0.20 0.00 0.16 -4.97 119.66 112.32 1l6t s GLN 42 Ca -0.09 -0.91 0.23 0.00 -0.00 0.00 0.00 55.36 54.59 1l6t s GLN 42 Cb 0.17 -2.62 1.39 0.00 0.00 0.00 0.00 33.01 31.96 1l6t s GLN 42 CO 0.75 -0.27 1.77 -0.35 0.00 0.00 0.00 175.29 177.18 1l6t n PRO 43 N 4.59 0.75 -0.41 9.60 -0.04 -1.26 -2.05 135.00 146.18 1l6t n PRO 43 Ca -0.20 0.00 0.11 0.00 -0.04 0.00 0.00 63.50 63.37 1l6t n PRO 43 Cb 0.49 -1.48 0.32 0.00 -0.04 0.00 0.00 33.50 32.78 1l6t n PRO 43 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1l6t n ASP 44 N -0.98 4.05 -0.09 3.54 8.00 -1.26 -4.00 116.55 125.80 1l6t n ASP 44 Ca 0.17 -2.11 0.00 0.00 0.71 0.00 0.00 54.79 53.57 1l6t n ASP 44 Cb 0.08 -0.49 0.00 0.00 -0.02 0.00 0.00 41.12 40.70 1l6t n ASP 44 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1l6t n LEU 45 N 1.42 0.32 -0.03 0.64 4.32 -0.87 -4.79 117.00 118.00 1l6t n LEU 45 Ca 0.24 -0.52 -0.10 0.00 -0.02 0.00 0.00 56.01 55.61 1l6t n LEU 45 Cb 0.67 -0.01 -0.09 0.00 -1.62 0.00 0.00 43.42 42.36 1l6t n LEU 45 CO 0.17 0.13 0.33 0.40 -1.22 0.00 0.00 177.39 177.20 1l6t h ILE 46 N 3.24 1.18 0.00 -0.08 2.04 -1.69 -2.31 117.51 119.89 1l6t h ILE 46 Ca 0.00 -1.71 0.00 0.00 1.00 0.00 0.00 64.86 64.15 1l6t h ILE 46 Cb 1.01 2.16 0.00 0.00 -0.74 0.00 0.00 36.82 39.25 1l6t h ILE 46 CO 0.00 0.37 0.00 -0.81 0.00 0.00 0.00 178.15 177.71 1l6t n PRO 47 N -4.73 0.75 -0.07 2.37 -0.04 -1.26 -0.85 135.00 131.17 1l6t n PRO 47 Ca -0.07 0.00 -0.06 0.00 -0.04 0.00 0.00 63.50 63.33 1l6t n PRO 47 Cb 0.32 -1.46 -0.02 0.00 -0.04 0.00 0.00 33.50 32.29 1l6t n PRO 47 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1l6t n LEU 48 N -0.96 1.62 0.08 1.53 4.32 -1.22 -3.68 117.00 118.68 1l6t n LEU 48 Ca 0.17 0.42 -0.02 0.00 -0.02 0.00 0.00 56.01 56.56 1l6t n LEU 48 Cb 0.08 -0.76 0.25 0.00 -1.62 0.00 0.00 43.42 41.37 1l6t n LEU 48 CO 0.13 -0.38 0.72 0.17 -1.22 0.00 0.00 177.39 176.81 1l6t h LEU 49 N -0.86 0.31 0.33 2.23 -0.00 -1.45 -2.62 115.31 113.25 1l6t h LEU 49 Ca 0.00 -0.11 -0.02 0.00 -0.00 0.00 0.00 57.88 57.76 1l6t h LEU 49 Cb 0.67 -0.09 0.00 0.00 -0.00 0.00 0.00 40.66 41.25 1l6t h LEU 49 CO 0.00 0.61 -0.16 -0.09 -0.00 0.00 0.00 178.44 178.80 1l6t h ARG 50 N 0.27 -0.43 -1.09 0.17 2.43 -1.20 -0.39 114.38 114.15 1l6t h ARG 50 Ca 0.04 0.03 0.32 0.00 -0.81 0.00 0.00 59.98 59.56 1l6t h ARG 50 Cb 0.68 0.10 -0.12 0.00 -0.42 0.00 0.00 29.97 30.20 1l6t h ARG 50 CO 0.05 -0.28 0.67 1.15 -1.51 0.00 0.00 179.97 180.05 1l6t h THR 51 N -0.45 0.37 0.28 0.20 2.02 -1.63 0.23 112.91 113.93 1l6t h THR 51 Ca -0.05 -0.11 -0.01 0.00 0.77 0.00 0.00 66.41 67.01 1l6t h THR 51 Cb 0.34 0.02 0.00 0.00 -1.74 0.00 0.00 68.15 66.77 1l6t h THR 51 CO 0.07 0.06 -0.13 1.56 0.37 0.00 0.00 175.52 177.45 1l6t h GLN 52 N 0.32 -0.36 -1.05 6.66 4.20 -1.20 -2.37 115.11 121.32 1l6t h GLN 52 Ca 0.69 0.02 0.28 0.00 0.06 0.00 0.00 58.65 59.70 1l6t h GLN 52 Cb 1.77 0.08 -0.09 0.00 0.30 0.00 0.00 27.48 29.54 1l6t h GLN 52 CO -0.43 -0.19 0.69 0.35 -0.67 0.00 0.00 178.83 178.58 1l6t h PHE 53 N -0.44 0.55 0.74 2.96 3.57 0.12 0.26 116.94 124.71 1l6t h PHE 53 Ca -0.04 0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.44 1l6t h PHE 53 Cb 0.33 -0.16 0.01 0.00 2.79 0.00 0.00 35.95 38.92 1l6t h PHE 53 CO -0.04 0.05 -0.36 0.35 -2.23 0.00 0.00 178.31 176.08 1l6t h PHE 54 N 0.33 -0.92 -0.52 0.41 3.57 -0.92 0.46 116.94 119.35 1l6t h PHE 54 Ca 0.58 -0.02 0.02 0.00 3.53 0.00 0.00 57.97 62.09 1l6t h PHE 54 Cb 1.61 0.31 -0.03 0.00 2.79 0.00 0.00 35.95 40.63 1l6t h PHE 54 CO -0.00 -0.55 0.35 0.82 -2.23 0.00 0.00 178.31 176.69 1l6t h ILE 55 N -1.12 1.08 -0.10 1.41 2.04 -0.91 0.75 117.51 120.65 1l6t h ILE 55 Ca -0.10 -0.21 -0.11 0.00 1.00 0.00 0.00 64.86 65.43 1l6t h ILE 55 Cb 0.78 0.40 -0.01 0.00 -0.74 0.00 0.00 36.82 37.25 1l6t h ILE 55 CO 0.17 0.11 -0.44 0.58 0.00 0.00 0.00 178.15 178.58 1l6t h VAL 56 N 0.63 1.32 0.19 1.67 2.07 -0.30 -2.80 116.25 119.02 1l6t h VAL 56 Ca 0.20 -1.58 -0.00 0.00 0.82 0.00 0.00 66.70 66.14 1l6t h VAL 56 Cb 0.05 1.73 -0.01 0.00 -1.52 0.00 0.00 31.29 31.54 1l6t h VAL 56 CO -0.05 0.47 -0.14 -0.03 0.02 0.00 0.00 177.57 177.84 1l6t h MET 57 N 0.19 -0.33 0.55 1.57 -1.53 0.24 0.30 114.93 115.92 1l6t h MET 57 Ca 0.01 0.02 -0.02 0.00 -3.44 0.00 0.00 59.70 56.27 1l6t h MET 57 Cb 0.85 0.07 -0.00 0.00 -0.55 0.00 0.00 31.60 31.97 1l6t h MET 57 CO 0.07 -0.22 -0.35 0.78 0.14 0.00 0.00 176.91 177.33 1l6t h GLY 58 N -0.34 -1.04 -0.15 1.39 0.00 -1.42 0.10 103.07 101.61 1l6t h GLY 58 Ca -0.01 0.43 0.19 0.00 0.00 0.00 0.00 47.33 47.94 1l6t h GLY 58 CO -0.00 -0.35 0.26 0.17 0.00 0.00 0.00 176.54 176.61 1l6t h LEU 59 N -0.84 0.12 -0.78 3.11 8.10 -1.50 0.68 115.31 124.20 1l6t h LEU 59 Ca -0.07 0.15 0.06 0.00 0.11 0.00 0.00 57.88 58.13 1l6t h LEU 59 Cb 0.68 0.18 -0.06 0.00 -0.44 0.00 0.00 40.66 41.02 1l6t h LEU 59 CO 0.07 -0.03 0.46 0.58 -4.11 0.00 0.00 178.44 175.41 1l6t h VAL 60 N 0.31 1.00 0.00 0.15 2.07 -0.07 0.59 116.25 120.31 1l6t h VAL 60 Ca 0.48 -0.29 0.00 0.00 0.82 0.00 0.00 66.70 67.71 1l6t h VAL 60 Cb 0.86 0.09 0.00 0.00 -1.52 0.00 0.00 31.29 30.72 1l6t h VAL 60 CO -0.53 0.15 0.00 0.59 0.02 0.00 0.00 177.57 177.80 1l6t n ASN 61 N -4.70 0.00 0.03 0.57 5.03 0.20 -2.47 115.26 113.92 1l6t n ASN 61 Ca 0.11 -0.53 0.01 0.00 0.87 0.00 0.00 54.58 55.03 1l6t n ASN 61 Cb 0.18 -0.14 -0.09 0.00 -1.02 0.00 0.00 39.78 38.72 1l6t n ASN 61 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1l6t n ALA 62 N -1.14 1.99 0.14 5.41 0.00 0.20 -2.62 120.51 124.50 1l6t n ALA 62 Ca 0.18 -0.57 -0.13 0.00 0.00 0.00 0.00 53.44 52.92 1l6t n ALA 62 Cb 0.16 -0.91 -0.07 0.00 0.00 0.00 0.00 19.45 18.63 1l6t n ALA 62 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 1l6t h ILE 63 N 0.00 0.66 -0.00 0.00 2.04 -0.93 0.39 117.51 119.67 1l6t h ILE 63 Ca -0.17 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.68 1l6t h ILE 63 Cb 1.56 0.66 0.00 0.00 -0.74 0.00 0.00 36.82 38.30 1l6t h ILE 63 CO 0.04 0.00 -0.05 1.55 0.00 0.00 0.00 178.15 179.69 1l6t h PRO 64 N -0.37 0.04 -0.89 2.37 0.13 -1.72 -1.05 132.00 130.52 1l6t h PRO 64 Ca -0.01 -0.04 0.23 0.00 -0.87 0.00 0.00 66.00 65.31 1l6t h PRO 64 Cb 0.33 0.01 -0.13 0.00 0.13 0.00 0.00 31.00 31.33 1l6t h PRO 64 CO -0.01 0.78 0.34 0.52 -0.23 0.00 0.00 178.00 179.40 1l6t h MET 65 N -0.68 0.31 0.00 0.86 2.86 -1.51 0.82 114.93 117.59 1l6t h MET 65 Ca -0.01 -0.02 -0.19 0.00 -2.06 0.00 0.00 59.70 57.42 1l6t h MET 65 Cb 0.79 -0.07 -0.03 0.00 0.06 0.00 0.00 31.60 32.36 1l6t h MET 65 CO 0.01 0.20 -0.92 0.82 1.06 0.00 0.00 176.91 178.08 1l6t h ILE 66 N 0.32 1.60 0.04 -1.22 2.04 -0.97 0.18 117.51 119.49 1l6t h ILE 66 Ca 0.56 -3.22 -0.00 0.00 1.00 0.00 0.00 64.86 63.20 1l6t h ILE 66 Cb 1.11 2.77 0.00 0.00 -0.74 0.00 0.00 36.82 39.96 1l6t h ILE 66 CO -0.58 0.90 -0.02 0.00 0.00 0.00 0.00 178.15 178.46 1l6t h ALA 67 N 1.08 -0.81 -0.08 1.87 0.00 0.18 -2.61 119.26 118.88 1l6t h ALA 67 Ca -0.01 -0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.80 1l6t h ALA 67 Cb 1.69 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.49 1l6t h ALA 67 CO 0.12 -0.81 -0.35 0.28 0.00 0.00 0.00 179.25 178.49 1l6t h VAL 68 N -0.06 1.27 -0.44 0.00 2.07 -0.30 -2.49 116.25 116.31 1l6t h VAL 68 Ca -0.00 -1.31 0.07 0.00 0.82 0.00 0.00 66.70 66.28 1l6t h VAL 68 Cb 0.04 1.60 -0.09 0.00 -1.52 0.00 0.00 31.29 31.32 1l6t h VAL 68 CO 0.01 0.39 -0.44 1.23 0.02 0.00 0.00 177.57 178.77 1l6t h GLY 69 N 1.11 -0.59 0.52 2.17 0.00 -0.66 0.37 103.07 106.00 1l6t h GLY 69 Ca 0.02 0.57 -0.02 0.00 0.00 0.00 0.00 47.33 47.90 1l6t h GLY 69 CO 0.05 -0.17 -0.17 1.41 0.00 0.00 0.00 176.54 177.66 1l6t h LEU 70 N -0.32 -0.40 -1.01 3.11 -0.00 -1.41 -2.78 115.31 112.51 1l6t h LEU 70 Ca 0.14 -0.15 0.40 0.00 -0.00 0.00 0.00 57.88 58.27 1l6t h LEU 70 Cb 0.58 0.10 -0.16 0.00 -0.00 0.00 0.00 40.66 41.19 1l6t h LEU 70 CO -0.60 0.04 0.57 0.61 -0.00 0.00 0.00 178.44 179.06 1l6t n GLY 71 N 0.07 -0.71 0.18 0.83 0.00 -0.94 -0.22 105.19 104.39 1l6t n GLY 71 Ca -0.09 0.73 -0.07 0.00 0.00 0.00 0.00 46.02 46.60 1l6t n GLY 71 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1l6t h LEU 72 N 0.00 -0.36 -0.87 0.99 3.38 -0.20 -1.09 115.31 117.15 1l6t h LEU 72 Ca 0.79 0.01 0.35 0.00 0.09 0.00 0.00 57.88 59.12 1l6t h LEU 72 Cb 2.20 0.09 -0.16 0.00 0.09 0.00 0.00 40.66 42.89 1l6t h LEU 72 CO -0.64 -0.16 0.41 0.00 0.09 0.00 0.00 178.44 178.14 1l6t n TYR 73 N -3.70 0.95 0.21 1.13 4.19 0.69 0.23 117.16 120.87 1l6t n TYR 73 Ca -0.05 1.04 -0.09 0.00 3.31 0.00 0.00 57.90 62.10 1l6t n TYR 73 Cb 0.17 -1.40 -0.04 0.00 0.49 0.00 0.00 39.34 38.55 1l6t n TYR 73 CO 0.00 0.00 0.00 0.28 0.91 0.00 0.00 176.86 178.05 1l6t h VAL 74 N 0.00 0.00 -0.34 2.97 2.07 -1.11 0.75 116.25 120.60 1l6t h VAL 74 Ca 0.71 -0.32 0.10 0.00 0.82 0.00 0.00 66.70 68.01 1l6t h VAL 74 Cb 1.84 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 31.60 1l6t h VAL 74 CO -0.70 0.00 0.66 -0.03 0.02 0.00 0.00 177.57 177.52 1l6t h MET 75 N -0.91 0.00 0.00 1.57 4.05 0.95 0.93 114.93 121.54 1l6t h MET 75 Ca -0.06 0.00 -0.33 0.00 -0.28 0.00 0.00 59.70 59.03 1l6t h MET 75 Cb 0.45 0.00 -0.06 0.00 -0.80 0.00 0.00 31.60 31.19 1l6t h MET 75 CO 0.10 0.00 -2.05 0.34 0.23 0.00 0.00 176.91 175.53 1l6t n PHE 76 N -3.16 0.52 0.09 1.39 -0.00 0.13 -3.42 117.46 113.02 1l6t n PHE 76 Ca 0.06 0.18 -0.13 0.00 -0.00 0.00 0.00 57.45 57.57 1l6t n PHE 76 Cb 0.79 -1.10 -0.08 0.00 -0.00 0.00 0.00 39.48 39.09 1l6t n PHE 76 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 1l6t h ALA 77 N 0.94 -0.22 -0.27 3.13 0.00 0.75 -3.11 119.26 120.49 1l6t h ALA 77 Ca -0.42 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.34 1l6t h ALA 77 Cb 2.12 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 19.98 1l6t h ALA 77 CO 0.05 -0.49 0.18 -0.24 0.00 0.00 0.00 179.25 178.75 1l6t h VAL 78 N -0.49 1.07 0.00 0.00 3.04 -1.23 -3.50 116.25 115.14 1l6t h VAL 78 Ca -0.02 -0.12 0.00 0.00 -1.01 0.00 0.00 66.70 65.54 1l6t h VAL 78 Cb 0.38 0.68 0.00 0.00 -2.01 0.00 0.00 31.29 30.33 1l6t h VAL 78 CO 0.04 0.07 0.00 0.00 -1.01 0.00 0.00 177.57 176.66