#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 0.59 -0.79 0.03 1.02 -1.26 -2.26 120.64 117.97 1l6t n GLU 2 Ca 0.00 -0.21 -0.03 0.00 -0.02 0.00 0.00 57.16 56.90 1l6t n GLU 2 Cb 0.00 -1.50 -0.03 0.00 -0.02 0.00 0.00 31.44 29.90 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 -1.02 -0.36 0.00 1.62 4.13 -1.26 -4.42 115.26 113.95 1l6t n ASN 3 Ca 0.13 -1.57 0.00 0.00 1.68 0.00 0.00 54.58 54.82 1l6t n ASN 3 Cb 0.29 0.09 0.00 0.00 -1.54 0.00 0.00 39.78 38.62 1l6t n ASN 3 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 1l6t n LEU 4 N 0.04 0.40 -0.07 3.41 4.32 -1.25 -4.66 117.00 119.18 1l6t n LEU 4 Ca -0.12 0.00 -0.08 0.00 -0.02 0.00 0.00 56.01 55.79 1l6t n LEU 4 Cb 0.65 0.00 -0.07 0.00 -1.62 0.00 0.00 43.42 42.37 1l6t n LEU 4 CO -0.06 0.00 -0.93 -3.20 -1.22 0.00 0.00 177.39 171.98 1l6t n ASN 5 N -2.84 2.66 -0.07 -1.43 2.85 -1.24 -4.57 115.26 110.62 1l6t n ASN 5 Ca 0.00 -0.05 -0.12 0.00 -0.11 0.00 0.00 54.58 54.31 1l6t n ASN 5 Cb 0.43 0.15 -0.05 0.00 1.24 0.00 0.00 39.78 41.54 1l6t n ASN 5 CO 0.00 0.00 0.00 0.24 -2.11 0.00 0.00 177.26 175.39 1l6t h MET 6 N 0.00 0.38 -0.92 1.20 2.86 -1.74 -2.97 114.93 113.74 1l6t h MET 6 Ca -0.31 -0.13 0.25 0.00 -2.06 0.00 0.00 59.70 57.45 1l6t h MET 6 Cb 1.56 -0.03 -0.16 0.00 0.06 0.00 0.00 31.60 33.03 1l6t h MET 6 CO -0.02 0.59 0.11 0.22 1.06 0.00 0.00 176.91 178.87 1l6t h ASP 7 N 0.13 -0.27 0.49 1.22 3.58 -1.82 0.43 116.42 120.18 1l6t h ASP 7 Ca 0.06 0.24 -0.02 0.00 0.42 0.00 0.00 57.03 57.73 1l6t h ASP 7 Cb 0.43 0.38 -0.00 0.00 1.72 0.00 0.00 39.33 41.87 1l6t h ASP 7 CO 0.01 -0.27 -0.31 0.25 -2.88 0.00 0.00 179.24 176.05 1l6t h LEU 8 N 0.09 -0.77 -0.22 2.28 6.46 -1.77 -0.56 115.31 120.82 1l6t h LEU 8 Ca 0.57 0.04 0.03 0.00 -0.12 0.00 0.00 57.88 58.40 1l6t h LEU 8 Cb 1.16 0.23 -0.04 0.00 -0.73 0.00 0.00 40.66 41.27 1l6t h LEU 8 CO -0.79 -0.47 -0.30 0.25 -0.62 0.00 0.00 178.44 176.51 1l6t h LEU 9 N -0.75 -1.02 -0.91 2.25 5.85 -0.82 -1.30 115.31 118.62 1l6t h LEU 9 Ca -0.07 0.13 0.11 0.00 0.84 0.00 0.00 57.88 58.89 1l6t h LEU 9 Cb 0.60 0.41 -0.13 0.00 0.37 0.00 0.00 40.66 41.92 1l6t h LEU 9 CO 0.06 -0.22 -0.45 0.00 -0.34 0.00 0.00 178.44 177.49 1l6t n TYR 10 N -4.16 -0.21 -0.25 1.25 4.19 0.13 0.63 117.16 118.74 1l6t n TYR 10 Ca -0.02 1.13 0.01 0.00 3.31 0.00 0.00 57.90 62.33 1l6t n TYR 10 Cb 0.19 -0.69 0.09 0.00 0.49 0.00 0.00 39.34 39.41 1l6t n TYR 10 CO 0.00 0.00 0.00 1.98 0.91 0.00 0.00 176.86 179.75 1l6t h MET 11 N 0.00 0.01 -0.68 2.98 4.05 0.00 1.14 114.93 122.44 1l6t h MET 11 Ca 0.22 -0.00 0.08 0.00 -0.28 0.00 0.00 59.70 59.72 1l6t h MET 11 Cb 0.45 -0.00 -0.04 0.00 -0.80 0.00 0.00 31.60 31.20 1l6t h MET 11 CO -0.87 0.01 0.45 0.00 0.23 0.00 0.00 176.91 176.72 1l6t h ALA 12 N 1.73 1.81 -0.50 0.39 0.00 0.10 0.34 119.26 123.13 1l6t h ALA 12 Ca 0.36 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.25 1l6t h ALA 12 Cb 0.55 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.19 1l6t h ALA 12 CO -0.74 0.07 0.00 0.00 0.00 0.00 0.00 179.25 178.58 1l6t n ALA 13 N -2.47 -0.17 -0.25 0.00 0.00 0.35 -1.91 120.51 116.06 1l6t n ALA 13 Ca 0.10 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.45 1l6t n ALA 13 Cb 0.28 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.65 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 -0.49 -0.87 0.00 0.00 -0.19 0.47 119.26 116.18 1l6t h ALA 14 Ca 0.00 0.06 0.14 0.00 0.00 0.00 0.00 54.91 55.12 1l6t h ALA 14 Cb 0.00 1.20 -0.15 0.00 0.00 0.00 0.00 17.79 18.84 1l6t h ALA 14 CO 0.00 -0.77 -0.35 0.28 0.00 0.00 0.00 179.25 178.41 1l6t h VAL 15 N -0.09 0.06 -0.87 0.00 2.07 -0.46 1.03 116.25 118.00 1l6t h VAL 15 Ca 0.10 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.71 1l6t h VAL 15 Cb 0.35 0.06 -0.07 0.00 -1.52 0.00 0.00 31.29 30.11 1l6t h VAL 15 CO -0.62 0.00 0.52 0.24 0.02 0.00 0.00 177.57 177.72 1l6t h MET 16 N -0.05 0.86 0.53 1.57 2.86 0.31 -1.36 114.93 119.65 1l6t h MET 16 Ca 0.33 -0.05 -0.03 0.00 -2.06 0.00 0.00 59.70 57.89 1l6t h MET 16 Cb 0.59 -0.19 0.01 0.00 0.06 0.00 0.00 31.60 32.07 1l6t h MET 16 CO -0.90 0.57 -0.25 0.52 1.06 0.00 0.00 176.91 177.91 1l6t h MET 17 N 0.88 -0.69 -0.97 1.72 2.07 0.51 -2.33 114.93 116.13 1l6t h MET 17 Ca 0.41 0.05 0.32 0.00 -2.07 0.00 0.00 59.70 58.40 1l6t h MET 17 Cb 0.32 0.16 -0.16 0.00 -1.87 0.00 0.00 31.60 30.04 1l6t h MET 17 CO -0.23 -0.46 0.36 0.78 1.07 0.00 0.00 176.91 178.44 1l6t h GLY 18 N -0.86 1.78 0.00 8.32 0.00 -0.10 0.31 103.07 112.51 1l6t h GLY 18 Ca -0.07 -0.07 0.00 0.00 0.00 0.00 0.00 47.33 47.18 1l6t h GLY 18 CO 0.12 -0.56 0.00 1.04 0.00 0.00 0.00 176.54 177.14 1l6t n LEU 19 N -5.26 0.00 -0.23 3.11 4.32 -0.52 -0.24 117.00 118.18 1l6t n LEU 19 Ca 0.29 0.96 -0.13 0.00 -0.02 0.00 0.00 56.01 57.12 1l6t n LEU 19 Cb 0.95 -0.46 -0.10 0.00 -1.62 0.00 0.00 43.42 42.19 1l6t n LEU 19 CO 0.02 -0.46 0.49 0.00 -1.22 0.00 0.00 177.39 176.22 1l6t h ALA 20 N -1.93 -0.71 -0.83 -1.18 0.00 -0.68 0.21 119.26 114.14 1l6t h ALA 20 Ca 0.00 0.04 0.13 0.00 0.00 0.00 0.00 54.91 55.08 1l6t h ALA 20 Cb 0.00 1.21 -0.14 0.00 0.00 0.00 0.00 17.79 18.86 1l6t h ALA 20 CO 0.00 -1.03 -0.38 0.00 0.00 0.00 0.00 179.25 177.84 1l6t h ALA 21 N 0.13 0.03 -0.69 0.00 0.00 -0.44 0.99 119.26 119.28 1l6t h ALA 21 Ca 0.10 0.22 0.13 0.00 0.00 0.00 0.00 54.91 55.37 1l6t h ALA 21 Cb 0.53 0.95 -0.09 0.00 0.00 0.00 0.00 17.79 19.18 1l6t h ALA 21 CO -0.71 -0.67 0.22 0.82 0.00 0.00 0.00 179.25 178.91 1l6t h ILE 22 N -0.07 0.63 -0.05 0.00 2.04 0.23 0.21 117.51 120.50 1l6t h ILE 22 Ca 0.29 -0.12 0.01 0.00 1.00 0.00 0.00 64.86 66.05 1l6t h ILE 22 Cb 0.57 0.25 -0.03 0.00 -0.74 0.00 0.00 36.82 36.87 1l6t h ILE 22 CO -0.86 0.06 -0.29 1.23 0.00 0.00 0.00 178.15 178.29 1l6t h GLY 23 N 0.35 -1.29 0.52 5.37 0.00 0.34 0.38 103.07 108.75 1l6t h GLY 23 Ca 0.38 0.67 -0.02 0.00 0.00 0.00 0.00 47.33 48.35 1l6t h GLY 23 CO -0.42 -0.38 -0.44 -1.80 0.00 0.00 0.00 176.54 173.51 1l6t h ASP 24 N -0.33 -1.17 -1.57 0.19 1.82 -0.79 0.17 116.42 114.74 1l6t h ASP 24 Ca 0.01 0.08 0.46 0.00 -0.39 0.00 0.00 57.03 57.19 1l6t h ASP 24 Cb 0.38 0.37 -0.06 0.00 0.68 0.00 0.00 39.33 40.69 1l6t h ASP 24 CO -0.22 -0.61 1.27 0.00 -1.61 0.00 0.00 179.24 178.06 1l6t h ALA 25 N -1.11 3.48 0.00 -0.78 0.00 -0.43 1.36 119.26 121.79 1l6t h ALA 25 Ca -0.07 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.79 1l6t h ALA 25 Cb 0.79 0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.70 1l6t h ALA 25 CO -0.01 -2.08 -0.00 0.82 0.00 0.00 0.00 179.25 177.99 1l6t h ILE 26 N 0.00 1.64 -0.78 0.00 2.04 0.18 -2.79 117.51 117.80 1l6t h ILE 26 Ca 0.75 -2.18 0.25 0.00 1.00 0.00 0.00 64.86 64.68 1l6t h ILE 26 Cb 3.27 3.08 -0.14 0.00 -0.74 0.00 0.00 36.82 42.28 1l6t h ILE 26 CO -0.01 0.55 0.14 0.61 0.00 0.00 0.00 178.15 179.44 1l6t n GLY 27 N 1.53 -0.92 0.07 5.37 0.00 0.46 0.12 105.19 111.82 1l6t n GLY 27 Ca -0.09 0.73 -0.14 0.00 0.00 0.00 0.00 46.02 46.52 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 1.64 -0.73 -0.61 5.03 -1.58 -2.26 117.51 119.00 1l6t h ILE 28 Ca 0.53 -1.91 0.14 0.00 -0.12 0.00 0.00 64.86 63.51 1l6t h ILE 28 Cb 1.22 2.93 -0.14 0.00 -3.03 0.00 0.00 36.82 37.80 1l6t h ILE 28 CO -0.70 0.50 -0.20 1.23 -0.68 0.00 0.00 178.15 178.30 1l6t h GLY 29 N -0.77 0.48 1.83 5.37 0.00 0.13 0.92 103.07 111.02 1l6t h GLY 29 Ca -0.00 0.26 -0.10 0.00 0.00 0.00 0.00 47.33 47.48 1l6t h GLY 29 CO 0.01 -0.28 -0.42 -2.22 0.00 0.00 0.00 176.54 173.63 1l6t h ILE 30 N -0.01 1.31 -0.83 2.60 5.03 -0.41 -2.64 117.51 122.56 1l6t h ILE 30 Ca 0.35 -1.53 -0.01 0.00 -0.12 0.00 0.00 64.86 63.54 1l6t h ILE 30 Cb 0.54 1.72 -0.04 0.00 -3.03 0.00 0.00 36.82 36.01 1l6t h ILE 30 CO -0.76 0.45 0.47 0.25 -0.68 0.00 0.00 178.15 177.88 1l6t h LEU 31 N 0.16 1.02 -1.22 1.44 6.46 0.13 0.65 115.31 123.95 1l6t h LEU 31 Ca 0.01 -0.08 0.16 0.00 -0.12 0.00 0.00 57.88 57.85 1l6t h LEU 31 Cb 0.82 -0.26 -0.08 0.00 -0.73 0.00 0.00 40.66 40.41 1l6t h LEU 31 CO 0.06 0.81 0.60 1.23 -0.62 0.00 0.00 178.44 180.52 1l6t h GLY 32 N 1.18 1.34 1.42 3.75 0.00 -0.03 0.31 103.07 111.04 1l6t h GLY 32 Ca 0.29 -0.32 -0.27 0.00 0.00 0.00 0.00 47.33 47.04 1l6t h GLY 32 CO -0.05 0.06 -1.40 -1.33 0.00 0.00 0.00 176.54 173.81 1l6t h GLY 33 N 0.71 0.13 1.19 4.60 0.00 -1.38 -3.21 103.07 105.11 1l6t h GLY 33 Ca 0.49 -0.34 0.00 0.00 0.00 0.00 0.00 47.33 47.48 1l6t h GLY 33 CO -0.25 0.29 0.00 1.17 0.00 0.00 0.00 176.54 177.76 1l6t n LYS 34 N -3.33 0.67 -0.03 4.80 0.00 0.14 -2.67 118.16 117.75 1l6t n LYS 34 Ca -0.11 0.02 -0.11 0.00 0.00 0.00 0.00 58.31 58.10 1l6t n LYS 34 Cb 1.01 -1.50 -0.14 0.00 0.00 0.00 0.00 35.03 34.40 1l6t n LYS 34 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.40 177.74 1l6t n PHE 35 N -1.09 0.92 -0.56 5.64 7.35 0.94 -2.98 117.46 127.69 1l6t n PHE 35 Ca 0.17 0.30 0.45 0.00 -0.76 0.00 0.00 57.45 57.61 1l6t n PHE 35 Cb 0.13 -1.16 0.72 0.00 0.35 0.00 0.00 39.48 39.52 1l6t n PHE 35 CO 0.00 0.00 0.00 -0.11 -0.76 0.00 0.00 176.76 175.89 1l6t n LEU 36 N -3.10 0.13 -0.13 -2.13 0.00 -1.09 0.94 117.00 111.62 1l6t n LEU 36 Ca -0.22 1.21 -0.22 0.00 0.00 0.00 0.00 56.01 56.78 1l6t n LEU 36 Cb 1.06 -0.60 -0.10 0.00 0.00 0.00 0.00 43.42 43.78 1l6t n LEU 36 CO 0.44 -1.28 -1.35 1.21 0.00 0.00 0.00 177.39 176.41 1l6t n GLU 37 N -4.37 0.58 0.15 1.96 2.13 -1.26 -3.55 120.64 116.29 1l6t n GLU 37 Ca 0.41 0.19 0.19 0.00 0.66 0.00 0.00 57.16 58.61 1l6t n GLU 37 Cb 1.72 -1.46 0.74 0.00 0.27 0.00 0.00 31.44 32.71 1l6t n GLU 37 CO 0.00 0.00 0.00 0.78 -0.41 0.00 0.00 177.13 177.50 1l6t h GLY 38 N 0.55 0.00 0.40 8.31 0.00 -0.58 0.79 103.07 112.55 1l6t h GLY 38 Ca -0.60 0.00 -0.16 0.00 0.00 0.00 0.00 47.33 46.57 1l6t h GLY 38 CO -0.23 0.00 -1.84 0.00 0.00 0.00 0.00 176.54 174.46 1l6t n ALA 39 N -2.19 2.12 -0.16 3.60 0.00 0.27 -4.08 120.51 120.07 1l6t n ALA 39 Ca 0.05 -0.74 0.28 0.00 0.00 0.00 0.00 53.44 53.03 1l6t n ALA 39 Cb 0.59 -0.68 0.72 0.00 0.00 0.00 0.00 19.45 20.08 1l6t n ALA 39 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1l6t h ALA 40 N 1.52 2.77 -0.91 0.00 0.00 0.57 0.50 119.26 123.70 1l6t h ALA 40 Ca -0.21 -0.03 0.20 0.00 0.00 0.00 0.00 54.91 54.87 1l6t h ALA 40 Cb 1.55 0.06 -0.07 0.00 0.00 0.00 0.00 17.79 19.34 1l6t h ALA 40 CO 0.02 -1.12 0.60 0.00 0.00 0.00 0.00 179.25 178.76 1l6t h ARG 41 N 0.00 0.41 -4.87 0.00 -0.00 -1.68 -3.37 114.38 104.87 1l6t h ARG 41 Ca 0.41 -0.02 -0.62 0.00 -0.50 0.00 0.00 59.98 59.25 1l6t h ARG 41 Cb 1.75 -0.09 -0.35 0.00 0.00 0.00 0.00 29.97 31.28 1l6t h ARG 41 CO -0.00 0.27 -0.85 1.14 0.00 0.00 0.00 179.97 180.53 1l6t s GLN 42 N -5.45 2.48 0.00 0.04 0.00 0.18 -4.98 119.66 111.92 1l6t s GLN 42 Ca -0.08 -0.65 0.24 0.00 -0.00 0.00 0.00 55.36 54.86 1l6t s GLN 42 Cb 0.23 -2.09 1.38 0.00 0.00 0.00 0.00 33.01 32.52 1l6t s GLN 42 CO 0.78 -0.08 1.79 -0.35 0.00 0.00 0.00 175.29 177.43 1l6t n PRO 43 N 4.26 0.67 -0.58 9.60 -0.04 -1.26 -2.20 135.00 145.45 1l6t n PRO 43 Ca -0.19 0.01 0.09 0.00 -0.04 0.00 0.00 63.50 63.38 1l6t n PRO 43 Cb 0.51 -1.50 0.35 0.00 -0.04 0.00 0.00 33.50 32.82 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 -1.06 4.57 -0.63 3.54 8.00 -1.26 -3.93 116.55 125.79 1l6t n ASP 44 Ca 0.17 -2.40 0.05 0.00 0.71 0.00 0.00 54.79 53.32 1l6t n ASP 44 Cb 0.10 -0.57 0.10 0.00 -0.02 0.00 0.00 41.12 40.74 1l6t n ASP 44 CO 0.00 0.00 0.00 -0.11 -0.39 0.00 0.00 177.20 176.70 1l6t n LEU 45 N 1.14 1.65 -0.02 0.64 0.00 -0.93 -4.74 117.00 114.73 1l6t n LEU 45 Ca 0.25 -2.63 -0.12 0.00 0.00 0.00 0.00 56.01 53.51 1l6t n LEU 45 Cb 0.85 -0.27 -0.10 0.00 0.00 0.00 0.00 43.42 43.90 1l6t n LEU 45 CO 0.23 0.76 0.44 0.40 0.00 0.00 0.00 177.39 179.22 1l6t h ILE 46 N 3.33 1.29 0.00 1.96 5.03 -1.74 -0.45 117.51 126.94 1l6t h ILE 46 Ca -0.05 -1.57 0.00 0.00 -0.12 0.00 0.00 64.86 63.12 1l6t h ILE 46 Cb 1.28 2.27 0.00 0.00 -3.03 0.00 0.00 36.82 37.34 1l6t h ILE 46 CO 0.02 0.37 0.00 1.55 -0.68 0.00 0.00 178.15 179.41 1l6t h PRO 47 N -0.82 0.00 0.00 2.37 0.13 -1.88 -2.86 132.00 128.93 1l6t h PRO 47 Ca -0.01 0.00 -0.19 0.00 -0.87 0.00 0.00 66.00 64.93 1l6t h PRO 47 Cb 0.66 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.76 1l6t h PRO 47 CO 0.01 0.00 -1.17 -0.07 -0.23 0.00 0.00 178.00 176.54 1l6t h LEU 48 N 0.00 0.00 0.00 1.56 3.38 -1.85 -3.22 115.31 115.18 1l6t h LEU 48 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1l6t h LEU 48 Cb 0.70 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.45 1l6t h LEU 48 CO 0.00 0.76 0.00 -0.11 0.09 0.00 0.00 178.44 179.18 1l6t n LEU 49 N -3.11 0.00 0.08 1.67 0.00 -0.18 -0.47 117.00 114.99 1l6t n LEU 49 Ca -0.06 0.93 -0.16 0.00 0.00 0.00 0.00 56.01 56.72 1l6t n LEU 49 Cb 0.89 -0.43 -0.09 0.00 0.00 0.00 0.00 43.42 43.79 1l6t n LEU 49 CO 0.44 -0.43 0.53 0.03 0.00 0.00 0.00 177.39 177.96 1l6t h ARG 50 N 0.00 -0.67 -0.90 1.96 3.08 -1.74 -0.78 114.38 115.33 1l6t h ARG 50 Ca 0.00 0.05 0.25 0.00 0.07 0.00 0.00 59.98 60.34 1l6t h ARG 50 Cb 0.00 0.15 -0.17 0.00 0.08 0.00 0.00 29.97 30.03 1l6t h ARG 50 CO 0.00 -0.45 0.02 2.41 -1.07 0.00 0.00 179.97 180.88 1l6t n THR 51 N -5.47 -0.38 0.22 2.04 -1.04 -1.19 0.71 114.28 109.17 1l6t n THR 51 Ca -0.08 1.98 -0.15 0.00 -2.04 0.00 0.00 64.05 63.77 1l6t n THR 51 Cb 0.40 -2.90 -0.08 0.00 -1.82 0.00 0.00 70.33 65.93 1l6t n THR 51 CO 0.00 0.00 0.00 1.56 -0.64 0.00 0.00 175.07 175.99 1l6t h GLN 52 N 0.00 -0.52 -0.06 -2.82 4.20 0.59 -2.84 115.11 113.66 1l6t h GLN 52 Ca 0.55 0.04 0.02 0.00 0.06 0.00 0.00 58.65 59.31 1l6t h GLN 52 Cb 1.13 0.12 -0.04 0.00 0.30 0.00 0.00 27.48 28.99 1l6t h GLN 52 CO -0.85 -0.28 -0.32 0.35 -0.67 0.00 0.00 178.83 177.07 1l6t h PHE 53 N -0.66 -0.95 -0.86 2.96 3.57 0.15 0.17 116.94 121.32 1l6t h PHE 53 Ca -0.06 0.03 0.11 0.00 3.53 0.00 0.00 57.97 61.59 1l6t h PHE 53 Cb 0.48 0.42 -0.12 0.00 2.79 0.00 0.00 35.95 39.52 1l6t h PHE 53 CO -0.02 -0.33 -0.41 0.34 -2.23 0.00 0.00 178.31 175.67 1l6t n PHE 54 N -4.25 -0.14 -0.00 0.41 -0.00 0.14 0.90 117.46 114.52 1l6t n PHE 54 Ca -0.04 1.07 -0.10 0.00 -0.00 0.00 0.00 57.45 58.38 1l6t n PHE 54 Cb 0.23 -0.72 -0.04 0.00 -0.00 0.00 0.00 39.48 38.95 1l6t n PHE 54 CO 0.00 0.00 0.00 0.82 -0.00 0.00 0.00 176.76 177.58 1l6t h ILE 55 N 0.00 0.80 0.03 -2.13 2.04 -1.15 -2.05 117.51 115.03 1l6t h ILE 55 Ca 0.23 0.00 0.01 0.00 1.00 0.00 0.00 64.86 66.10 1l6t h ILE 55 Cb 0.45 0.80 -0.02 0.00 -0.74 0.00 0.00 36.82 37.31 1l6t h ILE 55 CO -0.84 0.00 -0.20 0.58 0.00 0.00 0.00 178.15 177.69 1l6t h VAL 56 N -0.06 0.00 -1.82 1.67 2.07 0.36 0.17 116.25 118.64 1l6t h VAL 56 Ca 0.07 0.00 0.53 0.00 0.82 0.00 0.00 66.70 68.11 1l6t h VAL 56 Cb 0.16 0.00 -0.07 0.00 -1.52 0.00 0.00 31.29 29.86 1l6t h VAL 56 CO -0.15 0.00 1.34 -0.03 0.02 0.00 0.00 177.57 178.74 1l6t h MET 57 N -0.27 0.00 -0.00 1.57 -1.53 0.05 1.62 114.93 116.37 1l6t h MET 57 Ca 0.00 0.00 -0.17 0.00 -3.44 0.00 0.00 59.70 56.09 1l6t h MET 57 Cb 0.28 0.00 0.01 0.00 -0.55 0.00 0.00 31.60 31.34 1l6t h MET 57 CO -0.12 0.00 -0.65 0.78 0.14 0.00 0.00 176.91 177.06 1l6t h GLY 58 N 0.00 0.50 1.85 1.39 0.00 -0.03 -2.48 103.07 104.31 1l6t h GLY 58 Ca 0.86 -0.87 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1l6t h GLY 58 CO -0.01 0.77 0.00 1.04 0.00 0.00 0.00 176.54 178.34 1l6t n LEU 59 N -4.18 0.00 0.06 3.11 4.32 0.50 -0.28 117.00 120.54 1l6t n LEU 59 Ca -0.10 0.43 -0.23 0.00 -0.02 0.00 0.00 56.01 56.09 1l6t n LEU 59 Cb 0.70 -0.43 -0.15 0.00 -1.62 0.00 0.00 43.42 41.92 1l6t n LEU 59 CO 0.48 -0.05 -0.51 0.58 -1.22 0.00 0.00 177.39 176.66 1l6t h VAL 60 N 0.00 0.96 0.00 4.08 2.07 0.10 -1.51 116.25 121.94 1l6t h VAL 60 Ca 0.00 -2.49 0.00 0.00 0.82 0.00 0.00 66.70 65.03 1l6t h VAL 60 Cb 0.38 2.76 0.00 0.00 -1.52 0.00 0.00 31.29 32.91 1l6t h VAL 60 CO 0.00 0.83 -0.85 0.59 0.02 0.00 0.00 177.57 178.16 1l6t n ASN 61 N -3.65 0.72 -0.00 0.57 5.03 -0.94 -4.02 115.26 112.97 1l6t n ASN 61 Ca -0.25 0.12 -0.21 0.00 0.87 0.00 0.00 54.58 55.11 1l6t n ASN 61 Cb 1.05 0.41 -0.14 0.00 -1.02 0.00 0.00 39.78 40.08 1l6t n ASN 61 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1l6t h ALA 62 N 2.34 0.21 -0.97 5.41 0.00 -0.76 -2.81 119.26 122.68 1l6t h ALA 62 Ca 0.00 -1.12 0.17 0.00 0.00 0.00 0.00 54.91 53.95 1l6t h ALA 62 Cb 0.83 0.52 -0.17 0.00 0.00 0.00 0.00 17.79 18.97 1l6t h ALA 62 CO 0.00 0.86 -0.33 -0.89 0.00 0.00 0.00 179.25 178.90 1l6t n ILE 63 N -3.92 -0.47 0.02 0.00 5.41 -0.57 0.29 119.36 120.13 1l6t n ILE 63 Ca -0.26 2.24 -0.18 0.00 1.00 0.00 0.00 62.75 65.55 1l6t n ILE 63 Cb 0.90 -3.02 -0.08 0.00 -0.71 0.00 0.00 39.64 36.73 1l6t n ILE 63 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 176.55 178.10 1l6t h PRO 64 N 0.00 0.70 -0.26 0.38 0.13 -1.73 -2.08 132.00 129.15 1l6t h PRO 64 Ca 0.38 -0.69 0.06 0.00 -0.87 0.00 0.00 66.00 64.89 1l6t h PRO 64 Cb 0.62 0.18 -0.08 0.00 0.13 0.00 0.00 31.00 31.86 1l6t h PRO 64 CO -0.97 1.28 -0.35 1.98 -0.23 0.00 0.00 178.00 179.71 1l6t h MET 65 N 0.43 -0.33 -0.03 0.86 4.05 0.12 0.45 114.93 120.48 1l6t h MET 65 Ca -0.10 0.02 -0.11 0.00 -0.28 0.00 0.00 59.70 59.23 1l6t h MET 65 Cb 1.59 0.08 -0.01 0.00 -0.80 0.00 0.00 31.60 32.45 1l6t h MET 65 CO 0.19 -0.22 -0.51 0.82 0.23 0.00 0.00 176.91 177.41 1l6t h ILE 66 N -0.35 1.36 0.00 1.77 2.04 -0.39 0.39 117.51 122.34 1l6t h ILE 66 Ca 0.13 -1.76 0.00 0.00 1.00 0.00 0.00 64.86 64.23 1l6t h ILE 66 Cb 0.56 1.91 0.00 0.00 -0.74 0.00 0.00 36.82 38.55 1l6t h ILE 66 CO -0.45 0.51 0.00 0.00 0.00 0.00 0.00 178.15 178.20 1l6t n ALA 67 N -2.45 -0.41 0.23 1.87 0.00 0.06 -0.86 120.51 118.96 1l6t n ALA 67 Ca -0.02 0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.49 1l6t n ALA 67 Cb 0.53 0.02 0.55 0.00 0.00 0.00 0.00 19.45 20.55 1l6t n ALA 67 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1l6t h VAL 68 N 0.00 1.05 -0.02 0.00 2.07 -0.28 -2.44 116.25 116.62 1l6t h VAL 68 Ca 0.00 -0.55 0.03 0.00 0.82 0.00 0.00 66.70 67.00 1l6t h VAL 68 Cb 0.00 1.30 -0.04 0.00 -1.52 0.00 0.00 31.29 31.03 1l6t h VAL 68 CO 0.00 0.15 -0.21 1.23 0.02 0.00 0.00 177.57 178.77 1l6t h GLY 69 N 0.51 -0.27 0.81 2.17 0.00 -0.07 0.22 103.07 106.44 1l6t h GLY 69 Ca -0.00 0.25 -0.02 0.00 0.00 0.00 0.00 47.33 47.56 1l6t h GLY 69 CO 0.02 -0.19 -0.22 -2.00 0.00 0.00 0.00 176.54 174.16 1l6t h LEU 70 N -0.32 -0.51 -0.92 3.11 6.46 -0.69 -0.38 115.31 122.06 1l6t h LEU 70 Ca 0.07 -0.07 0.26 0.00 -0.12 0.00 0.00 57.88 58.02 1l6t h LEU 70 Cb 0.41 0.13 -0.15 0.00 -0.73 0.00 0.00 40.66 40.32 1l6t h LEU 70 CO -0.21 -0.22 0.29 1.23 -0.62 0.00 0.00 178.44 178.91 1l6t h GLY 71 N -0.81 1.52 0.44 3.75 0.00 -1.26 0.59 103.07 107.30 1l6t h GLY 71 Ca -0.06 -0.06 -0.02 0.00 0.00 0.00 0.00 47.33 47.19 1l6t h GLY 71 CO 0.10 -0.43 -0.21 1.41 0.00 0.00 0.00 176.54 177.41 1l6t h LEU 72 N 0.20 -0.50 -0.89 3.11 3.38 -0.38 -1.60 115.31 118.63 1l6t h LEU 72 Ca 0.60 0.02 0.35 0.00 0.09 0.00 0.00 57.88 58.94 1l6t h LEU 72 Cb 1.28 0.13 -0.16 0.00 0.09 0.00 0.00 40.66 42.00 1l6t h LEU 72 CO -0.68 -0.25 0.40 0.00 0.09 0.00 0.00 178.44 178.00 1l6t n TYR 73 N -4.22 0.96 0.01 1.13 4.19 -0.17 0.18 117.16 119.24 1l6t n TYR 73 Ca -0.07 1.05 -0.13 0.00 3.31 0.00 0.00 57.90 62.06 1l6t n TYR 73 Cb 0.23 -1.41 -0.09 0.00 0.49 0.00 0.00 39.34 38.56 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 1.27 0.48 2.97 2.07 -0.86 0.18 116.25 122.35 1l6t h VAL 74 Ca 0.72 -0.90 -0.01 0.00 0.82 0.00 0.00 66.70 67.32 1l6t h VAL 74 Cb 1.85 1.87 -0.02 0.00 -1.52 0.00 0.00 31.29 33.48 1l6t h VAL 74 CO -0.71 0.23 -0.40 -0.03 0.02 0.00 0.00 177.57 176.68 1l6t h MET 75 N -0.42 -0.84 -0.00 1.57 4.05 0.29 -2.13 114.93 117.44 1l6t h MET 75 Ca -0.00 0.06 0.02 0.00 -0.28 0.00 0.00 59.70 59.49 1l6t h MET 75 Cb 0.40 0.19 -0.02 0.00 -0.80 0.00 0.00 31.60 31.37 1l6t h MET 75 CO 0.00 -0.56 -0.09 0.35 0.23 0.00 0.00 176.91 176.84 1l6t h PHE 76 N -0.87 -0.24 -0.47 1.39 3.57 -0.37 0.70 116.94 120.65 1l6t h PHE 76 Ca -0.05 0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.50 1l6t h PHE 76 Cb 0.75 0.11 -0.06 0.00 2.79 0.00 0.00 35.95 39.54 1l6t h PHE 76 CO -0.19 -0.15 -0.29 0.00 -2.23 0.00 0.00 178.31 175.46 1l6t h ALA 77 N 0.82 -0.30 -0.82 2.41 0.00 -0.51 0.32 119.26 121.18 1l6t h ALA 77 Ca 0.04 0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.96 1l6t h ALA 77 Cb 0.21 1.16 -0.04 0.00 0.00 0.00 0.00 17.79 19.12 1l6t h ALA 77 CO -0.10 -0.50 0.36 -0.24 0.00 0.00 0.00 179.25 178.78 1l6t h VAL 78 N -0.02 1.26 0.00 0.00 3.04 -1.25 -3.51 116.25 115.77 1l6t h VAL 78 Ca 0.07 -0.78 0.00 0.00 -1.01 0.00 0.00 66.70 64.99 1l6t h VAL 78 Cb 0.21 0.24 0.00 0.00 -2.01 0.00 0.00 31.29 29.73 1l6t h VAL 78 CO -0.45 0.33 0.00 0.00 -1.01 0.00 0.00 177.57 176.44