#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 1.11 -1.44 0.03 1.02 -1.26 -4.58 120.64 115.52 1l6t n GLU 2 Ca 0.00 -0.86 -0.04 0.00 -0.02 0.00 0.00 57.16 56.24 1l6t n GLU 2 Cb 0.00 -0.71 -0.02 0.00 -0.02 0.00 0.00 31.44 30.70 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 -0.19 -0.60 0.11 1.62 3.02 -1.26 -4.81 115.26 113.15 1l6t n ASN 3 Ca 0.00 -2.04 0.00 0.00 -0.03 0.00 0.00 54.58 52.51 1l6t n ASN 3 Cb 0.38 0.22 0.00 0.00 -0.61 0.00 0.00 39.78 39.77 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 -0.19 -0.12 0.12 3.41 7.94 -1.26 -4.84 117.00 122.06 1l6t n LEU 4 Ca -0.19 0.37 -0.24 0.00 -1.11 0.00 0.00 56.01 54.84 1l6t n LEU 4 Cb 0.81 0.30 -0.16 0.00 0.53 0.00 0.00 43.42 44.91 1l6t n LEU 4 CO -0.12 -0.72 -0.32 0.78 -1.11 0.00 0.00 177.39 175.90 1l6t h ASN 5 N 0.00 0.75 -0.28 1.96 4.21 -1.93 -3.35 115.58 116.94 1l6t h ASN 5 Ca 0.00 -0.93 0.07 0.00 1.21 0.00 0.00 56.30 56.65 1l6t h ASN 5 Cb 0.00 -0.24 -0.08 0.00 -1.12 0.00 0.00 38.32 36.88 1l6t h ASN 5 CO 0.00 1.72 -0.29 0.24 -1.29 0.00 0.00 177.43 177.81 1l6t h MET 6 N 0.09 -0.27 -0.99 0.81 2.86 -1.87 0.12 114.93 115.67 1l6t h MET 6 Ca -0.28 0.02 0.29 0.00 -2.06 0.00 0.00 59.70 57.66 1l6t h MET 6 Cb 2.11 0.06 -0.18 0.00 0.06 0.00 0.00 31.60 33.65 1l6t h MET 6 CO 0.23 -0.18 0.08 -0.44 1.06 0.00 0.00 176.91 177.66 1l6t h ASP 7 N -0.28 -0.39 0.40 1.22 3.32 -1.89 0.43 116.42 119.23 1l6t h ASP 7 Ca 0.14 0.28 -0.02 0.00 0.02 0.00 0.00 57.03 57.45 1l6t h ASP 7 Cb 0.51 0.46 0.00 0.00 0.22 0.00 0.00 39.33 40.53 1l6t h ASP 7 CO -0.44 -0.36 -0.19 0.25 -1.72 0.00 0.00 179.24 176.78 1l6t h LEU 8 N 0.01 -0.45 -0.61 1.55 6.46 -1.16 -2.44 115.31 118.67 1l6t h LEU 8 Ca 0.63 0.02 0.06 0.00 -0.12 0.00 0.00 57.88 58.46 1l6t h LEU 8 Cb 1.34 0.12 -0.07 0.00 -0.73 0.00 0.00 40.66 41.31 1l6t h LEU 8 CO -0.91 -0.29 -0.37 0.25 -0.62 0.00 0.00 178.44 176.50 1l6t h LEU 9 N -0.59 -1.36 -0.88 2.25 5.85 -0.01 0.32 115.31 120.88 1l6t h LEU 9 Ca -0.05 0.21 0.15 0.00 0.84 0.00 0.00 57.88 59.03 1l6t h LEU 9 Cb 0.41 0.60 -0.15 0.00 0.37 0.00 0.00 40.66 41.89 1l6t h LEU 9 CO 0.09 -0.15 -0.29 0.00 -0.34 0.00 0.00 178.44 177.75 1l6t n TYR 10 N -4.42 0.16 0.11 1.25 4.19 0.13 -0.24 117.16 118.34 1l6t n TYR 10 Ca 0.01 1.08 -0.15 0.00 3.31 0.00 0.00 57.90 62.16 1l6t n TYR 10 Cb 0.17 -0.91 -0.09 0.00 0.49 0.00 0.00 39.34 38.99 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 -0.67 -0.88 2.98 4.05 0.13 0.42 114.93 120.96 1l6t h MET 11 Ca 0.36 0.05 0.18 0.00 -0.28 0.00 0.00 59.70 60.01 1l6t h MET 11 Cb 0.58 0.15 -0.11 0.00 -0.80 0.00 0.00 31.60 31.42 1l6t h MET 11 CO -0.89 -0.44 0.43 0.00 0.23 0.00 0.00 176.91 176.24 1l6t h ALA 12 N -0.69 1.38 -2.42 0.39 0.00 0.10 0.48 119.26 118.50 1l6t h ALA 12 Ca -0.01 0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1l6t h ALA 12 Cb 0.68 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.52 1l6t h ALA 12 CO -0.24 -0.20 0.00 0.00 0.00 0.00 0.00 179.25 178.81 1l6t n ALA 13 N -2.45 -0.09 -0.30 0.00 0.00 0.67 -0.57 120.51 117.77 1l6t n ALA 13 Ca 0.20 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.56 1l6t n ALA 13 Cb 0.54 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.92 1l6t n ALA 13 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1l6t n ALA 14 N -0.79 -0.46 -0.38 0.00 0.00 0.13 0.51 120.51 119.53 1l6t n ALA 14 Ca 0.00 0.60 -0.02 0.00 0.00 0.00 0.00 53.44 54.03 1l6t n ALA 14 Cb 0.00 0.02 0.03 0.00 0.00 0.00 0.00 19.45 19.50 1l6t n ALA 14 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1l6t h VAL 15 N 0.00 0.01 -0.52 0.00 2.07 -0.11 0.91 116.25 118.61 1l6t h VAL 15 Ca 0.11 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.69 1l6t h VAL 15 Cb 0.29 0.01 -0.05 0.00 -1.52 0.00 0.00 31.29 30.02 1l6t h VAL 15 CO -0.67 0.00 0.23 0.24 0.02 0.00 0.00 177.57 177.39 1l6t h MET 16 N -0.01 0.43 0.77 1.57 2.86 0.26 -1.14 114.93 119.67 1l6t h MET 16 Ca 0.33 -0.03 -0.03 0.00 -2.06 0.00 0.00 59.70 57.91 1l6t h MET 16 Cb 0.59 -0.10 -0.00 0.00 0.06 0.00 0.00 31.60 32.15 1l6t h MET 16 CO -0.98 0.28 -0.48 0.52 1.06 0.00 0.00 176.91 177.32 1l6t h MET 17 N 0.44 -1.13 -0.92 1.72 2.07 0.45 0.03 114.93 117.59 1l6t h MET 17 Ca 0.24 0.08 0.24 0.00 -2.07 0.00 0.00 59.70 58.18 1l6t h MET 17 Cb 0.20 0.26 -0.13 0.00 -1.87 0.00 0.00 31.60 30.06 1l6t h MET 17 CO -0.20 -0.75 0.41 0.78 1.07 0.00 0.00 176.91 178.21 1l6t h GLY 18 N -1.17 1.61 0.01 8.32 0.00 -0.14 0.36 103.07 112.06 1l6t h GLY 18 Ca -0.10 -0.17 -0.00 0.00 0.00 0.00 0.00 47.33 47.06 1l6t h GLY 18 CO 0.11 -0.31 -0.01 1.41 0.00 0.00 0.00 176.54 177.74 1l6t h LEU 19 N 0.38 -0.01 -0.46 3.11 4.07 -0.85 0.95 115.31 122.49 1l6t h LEU 19 Ca 0.59 0.00 0.05 0.00 0.08 0.00 0.00 57.88 58.59 1l6t h LEU 19 Cb 1.16 0.00 -0.07 0.00 1.08 0.00 0.00 40.66 42.84 1l6t h LEU 19 CO -0.55 -0.01 -0.37 0.00 -1.08 0.00 0.00 178.44 176.43 1l6t h ALA 20 N -1.99 -0.48 -0.83 1.53 0.00 -0.43 0.16 119.26 117.22 1l6t h ALA 20 Ca -0.00 0.04 0.09 0.00 0.00 0.00 0.00 54.91 55.04 1l6t h ALA 20 Cb 0.01 1.12 -0.12 0.00 0.00 0.00 0.00 17.79 18.80 1l6t h ALA 20 CO 0.00 -0.70 -0.52 0.00 0.00 0.00 0.00 179.25 178.03 1l6t h ALA 21 N -0.26 -0.42 -0.77 0.00 0.00 -0.36 0.68 119.26 118.13 1l6t h ALA 21 Ca 0.08 0.13 0.16 0.00 0.00 0.00 0.00 54.91 55.27 1l6t h ALA 21 Cb 0.32 1.20 -0.14 0.00 0.00 0.00 0.00 17.79 19.17 1l6t h ALA 21 CO -0.50 -0.90 -0.12 0.82 0.00 0.00 0.00 179.25 178.55 1l6t h ILE 22 N -0.10 0.26 -0.10 0.00 2.04 0.13 0.37 117.51 120.11 1l6t h ILE 22 Ca 0.18 -0.01 0.02 0.00 1.00 0.00 0.00 64.86 66.05 1l6t h ILE 22 Cb 0.50 0.23 -0.04 0.00 -0.74 0.00 0.00 36.82 36.77 1l6t h ILE 22 CO -0.85 0.01 -0.34 1.23 0.00 0.00 0.00 178.15 178.19 1l6t h GLY 23 N 0.03 -1.28 0.37 5.37 0.00 0.30 0.42 103.07 108.29 1l6t h GLY 23 Ca 0.39 0.69 -0.01 0.00 0.00 0.00 0.00 47.33 48.39 1l6t h GLY 23 CO -0.75 -0.35 -0.34 -1.80 0.00 0.00 0.00 176.54 173.30 1l6t h ASP 24 N -0.36 -0.92 -1.88 0.19 3.58 -0.35 0.30 116.42 116.98 1l6t h ASP 24 Ca 0.02 0.07 0.54 0.00 0.42 0.00 0.00 57.03 58.09 1l6t h ASP 24 Cb 0.43 0.30 -0.08 0.00 1.72 0.00 0.00 39.33 41.70 1l6t h ASP 24 CO -0.28 -0.46 1.39 0.00 -2.88 0.00 0.00 179.24 177.01 1l6t h ALA 25 N -1.23 3.78 0.01 -0.78 0.00 -0.15 1.47 119.26 122.37 1l6t h ALA 25 Ca -0.05 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 1l6t h ALA 25 Cb 0.60 0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.53 1l6t h ALA 25 CO -0.02 -2.35 -0.00 0.82 0.00 0.00 0.00 179.25 177.69 1l6t h ILE 26 N 0.00 1.55 -0.74 0.00 2.04 0.18 -2.80 117.51 117.72 1l6t h ILE 26 Ca 0.89 -2.05 0.22 0.00 1.00 0.00 0.00 64.86 64.93 1l6t h ILE 26 Cb 3.66 2.87 -0.14 0.00 -0.74 0.00 0.00 36.82 42.46 1l6t h ILE 26 CO -0.01 0.50 0.07 0.61 0.00 0.00 0.00 178.15 179.32 1l6t n GLY 27 N 1.44 -0.95 0.07 5.37 0.00 0.50 0.14 105.19 111.76 1l6t n GLY 27 Ca -0.09 0.71 -0.14 0.00 0.00 0.00 0.00 46.02 46.51 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 1.59 -0.71 -0.61 5.03 -1.58 -2.20 117.51 119.04 1l6t h ILE 28 Ca 0.48 -1.80 0.14 0.00 -0.12 0.00 0.00 64.86 63.55 1l6t h ILE 28 Cb 1.03 2.80 -0.13 0.00 -3.03 0.00 0.00 36.82 37.49 1l6t h ILE 28 CO -0.68 0.47 -0.22 1.23 -0.68 0.00 0.00 178.15 178.27 1l6t h GLY 29 N -0.71 0.38 1.99 5.37 0.00 0.15 0.97 103.07 111.23 1l6t h GLY 29 Ca -0.00 0.29 -0.09 0.00 0.00 0.00 0.00 47.33 47.52 1l6t h GLY 29 CO 0.01 -0.26 -0.43 -2.22 0.00 0.00 0.00 176.54 173.63 1l6t h ILE 30 N -0.03 1.31 -0.84 2.60 1.08 -0.37 -2.59 117.51 118.66 1l6t h ILE 30 Ca 0.33 -1.49 -0.03 0.00 -0.39 0.00 0.00 64.86 63.27 1l6t h ILE 30 Cb 0.54 1.80 -0.04 0.00 -3.07 0.00 0.00 36.82 36.05 1l6t h ILE 30 CO -0.75 0.43 0.39 0.25 -0.69 0.00 0.00 178.15 177.78 1l6t h LEU 31 N 0.01 1.12 -1.37 1.44 6.46 0.14 -0.55 115.31 122.56 1l6t h LEU 31 Ca -0.00 -0.14 0.12 0.00 -0.12 0.00 0.00 57.88 57.73 1l6t h LEU 31 Cb 0.77 -0.29 -0.06 0.00 -0.73 0.00 0.00 40.66 40.36 1l6t h LEU 31 CO 0.06 0.95 0.53 1.23 -0.62 0.00 0.00 178.44 180.59 1l6t h GLY 32 N 1.21 1.04 1.19 3.75 0.00 -0.05 0.12 103.07 110.32 1l6t h GLY 32 Ca 0.29 -0.28 -0.30 0.00 0.00 0.00 0.00 47.33 47.03 1l6t h GLY 32 CO -0.03 0.13 -1.30 -1.33 0.00 0.00 0.00 176.54 174.00 1l6t h GLY 33 N 0.66 0.64 1.93 4.60 0.00 -1.39 -2.83 103.07 106.68 1l6t h GLY 33 Ca 0.39 -1.47 0.00 0.00 0.00 0.00 0.00 47.33 46.25 1l6t h GLY 33 CO -0.16 1.29 0.00 1.17 0.00 0.00 0.00 176.54 178.84 1l6t n LYS 34 N -3.80 0.03 -0.06 4.80 4.81 -0.29 -1.80 118.16 121.85 1l6t n LYS 34 Ca -0.15 0.27 -0.10 0.00 -0.87 0.00 0.00 58.31 57.45 1l6t n LYS 34 Cb 1.02 -1.50 -0.15 0.00 0.02 0.00 0.00 35.03 34.42 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 -1.47 0.57 -0.14 5.64 7.35 0.34 -3.70 117.46 126.05 1l6t n PHE 35 Ca 0.03 0.20 -0.03 0.00 -0.76 0.00 0.00 57.45 56.89 1l6t n PHE 35 Cb 0.14 -1.10 0.05 0.00 0.35 0.00 0.00 39.48 38.92 1l6t n PHE 35 CO 0.00 0.00 0.00 -0.07 -0.76 0.00 0.00 176.76 175.93 1l6t h LEU 36 N 0.00 -0.05 -0.67 -2.13 3.38 -1.10 0.74 115.31 115.48 1l6t h LEU 36 Ca -0.41 0.09 -0.11 0.00 0.09 0.00 0.00 57.88 57.54 1l6t h LEU 36 Cb 2.10 0.13 -0.02 0.00 0.09 0.00 0.00 40.66 42.97 1l6t h LEU 36 CO 0.05 0.00 -0.13 -0.08 0.09 0.00 0.00 178.44 178.38 1l6t h GLU 37 N 0.19 0.90 0.42 1.13 4.81 -1.74 -0.10 114.58 120.20 1l6t h GLU 37 Ca 0.23 -0.32 -0.02 0.00 -0.13 0.00 0.00 59.36 59.11 1l6t h GLU 37 Cb 0.31 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.63 1l6t h GLU 37 CO -0.32 0.97 -0.20 0.78 -0.73 0.00 0.00 179.01 179.51 1l6t h GLY 38 N 0.96 -0.59 2.00 1.92 0.00 -1.21 -2.23 103.07 103.92 1l6t h GLY 38 Ca 0.13 0.22 0.00 0.00 0.00 0.00 0.00 47.33 47.67 1l6t h GLY 38 CO 0.05 -0.21 0.00 0.00 0.00 0.00 0.00 176.54 176.37 1l6t h ALA 39 N -0.20 1.00 -0.06 3.60 0.00 0.45 -2.16 119.26 121.88 1l6t h ALA 39 Ca -0.06 0.00 0.02 0.00 0.00 0.00 0.00 54.91 54.87 1l6t h ALA 39 Cb 0.51 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.30 1l6t h ALA 39 CO 0.09 0.00 0.34 0.00 0.00 0.00 0.00 179.25 179.69 1l6t h ALA 40 N 2.10 1.45 0.00 0.00 0.00 -0.35 1.15 119.26 123.60 1l6t h ALA 40 Ca 0.00 -0.00 -0.11 0.00 0.00 0.00 0.00 54.91 54.80 1l6t h ALA 40 Cb 0.26 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 1l6t h ALA 40 CO 0.00 -0.37 -0.52 -0.09 0.00 0.00 0.00 179.25 178.27 1l6t h ARG 41 N 0.00 0.00 -4.83 0.00 9.65 -1.50 -3.41 114.38 114.30 1l6t h ARG 41 Ca 0.03 0.00 -0.68 0.00 -1.10 0.00 0.00 59.98 58.23 1l6t h ARG 41 Cb 0.71 0.00 -0.34 0.00 -1.39 0.00 0.00 29.97 28.95 1l6t h ARG 41 CO -0.00 0.52 -0.75 1.14 2.80 0.00 0.00 179.97 183.68 1l6t s GLN 42 N -3.39 2.40 0.00 0.20 0.00 0.40 -4.95 119.66 114.32 1l6t s GLN 42 Ca 0.01 -1.26 0.23 0.00 -0.00 0.00 0.00 55.36 54.34 1l6t s GLN 42 Cb 0.11 -3.03 1.38 0.00 0.00 0.00 0.00 33.01 31.47 1l6t s GLN 42 CO 0.73 -0.57 1.76 -0.35 0.00 0.00 0.00 175.29 176.86 1l6t n PRO 43 N 4.55 0.75 -0.27 9.60 -0.04 -1.26 -1.92 135.00 146.41 1l6t n PRO 43 Ca -0.14 0.00 0.07 0.00 -0.04 0.00 0.00 63.50 63.39 1l6t n PRO 43 Cb 0.43 -1.49 0.19 0.00 -0.04 0.00 0.00 33.50 32.60 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 -0.99 3.27 -0.00 3.54 8.00 -1.26 -4.28 116.55 124.83 1l6t n ASP 44 Ca 0.17 -2.28 0.00 0.00 0.71 0.00 0.00 54.79 53.39 1l6t n ASP 44 Cb 0.08 -0.33 0.00 0.00 -0.02 0.00 0.00 41.12 40.85 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 0.29 0.65 -0.02 0.64 4.32 -0.81 -4.76 117.00 117.30 1l6t n LEU 45 Ca 0.15 -0.65 -0.11 0.00 -0.02 0.00 0.00 56.01 55.37 1l6t n LEU 45 Cb 0.57 -0.00 -0.09 0.00 -1.62 0.00 0.00 43.42 42.27 1l6t n LEU 45 CO 0.11 0.16 0.38 0.40 -1.22 0.00 0.00 177.39 177.22 1l6t h ILE 46 N 2.05 1.26 0.00 -0.08 1.08 -1.73 -1.24 117.51 118.85 1l6t h ILE 46 Ca 0.00 -1.66 0.00 0.00 -0.39 0.00 0.00 64.86 62.81 1l6t h ILE 46 Cb 0.84 2.26 0.00 0.00 -3.07 0.00 0.00 36.82 36.85 1l6t h ILE 46 CO 0.00 0.38 0.00 -0.81 -0.69 0.00 0.00 178.15 177.03 1l6t n PRO 47 N -4.75 0.75 -0.11 2.37 -0.04 -1.26 -1.70 135.00 130.25 1l6t n PRO 47 Ca -0.08 0.00 -0.17 0.00 -0.04 0.00 0.00 63.50 63.21 1l6t n PRO 47 Cb 0.33 -1.49 -0.06 0.00 -0.04 0.00 0.00 33.50 32.24 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 -0.99 1.94 -0.32 1.53 4.32 -1.21 -3.80 117.00 118.47 1l6t n LEU 48 Ca 0.18 0.35 -0.02 0.00 -0.02 0.00 0.00 56.01 56.49 1l6t n LEU 48 Cb 0.08 -0.78 0.13 0.00 -1.62 0.00 0.00 43.42 41.23 1l6t n LEU 48 CO 0.13 0.04 1.22 0.17 -1.22 0.00 0.00 177.39 177.73 1l6t h LEU 49 N -1.00 1.08 0.64 2.23 -0.00 -1.22 -2.79 115.31 114.25 1l6t h LEU 49 Ca -0.26 -0.06 -0.03 0.00 -0.00 0.00 0.00 57.88 57.53 1l6t h LEU 49 Cb 1.20 -0.27 -0.00 0.00 -0.00 0.00 0.00 40.66 41.59 1l6t h LEU 49 CO -0.16 0.83 -0.39 0.03 -0.00 0.00 0.00 178.44 178.75 1l6t h ARG 50 N 1.24 -0.93 -0.94 0.17 3.08 -1.55 0.10 114.38 115.56 1l6t h ARG 50 Ca 0.32 0.06 0.11 0.00 0.07 0.00 0.00 59.98 60.55 1l6t h ARG 50 Cb -0.05 0.21 -0.13 0.00 0.08 0.00 0.00 29.97 30.07 1l6t h ARG 50 CO -0.06 -0.62 -0.46 2.41 -1.07 0.00 0.00 179.97 180.17 1l6t n THR 51 N -4.84 -0.57 0.34 2.04 -1.04 -1.14 -0.31 114.28 108.76 1l6t n THR 51 Ca -0.12 2.23 -0.18 0.00 -2.04 0.00 0.00 64.05 63.94 1l6t n THR 51 Cb 0.40 -2.85 -0.09 0.00 -1.82 0.00 0.00 70.33 65.97 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 -1.01 -0.99 -2.82 4.20 -1.37 -2.13 115.11 110.99 1l6t h GLN 52 Ca 0.24 0.07 0.37 0.00 0.06 0.00 0.00 58.65 59.39 1l6t h GLN 52 Cb 0.47 0.23 -0.18 0.00 0.30 0.00 0.00 27.48 28.30 1l6t h GLN 52 CO -0.90 -0.67 0.42 0.35 -0.67 0.00 0.00 178.83 177.35 1l6t h PHE 53 N -1.05 0.63 0.66 2.96 3.57 0.13 0.30 116.94 124.14 1l6t h PHE 53 Ca -0.08 0.05 -0.03 0.00 3.53 0.00 0.00 57.97 61.44 1l6t h PHE 53 Cb 0.88 -0.11 -0.01 0.00 2.79 0.00 0.00 35.95 39.50 1l6t h PHE 53 CO -0.19 -0.43 -0.46 0.35 -2.23 0.00 0.00 178.31 175.35 1l6t h PHE 54 N 0.04 -1.26 -0.65 0.41 3.04 0.01 0.30 116.94 118.83 1l6t h PHE 54 Ca 0.77 -0.01 0.09 0.00 3.98 0.00 0.00 57.97 62.80 1l6t h PHE 54 Cb 1.93 0.46 -0.04 0.00 2.56 0.00 0.00 35.95 40.86 1l6t h PHE 54 CO -0.13 -0.67 0.43 0.82 -2.02 0.00 0.00 178.31 176.75 1l6t h ILE 55 N -1.07 0.94 0.05 1.41 2.04 -0.41 -1.09 117.51 119.38 1l6t h ILE 55 Ca -0.09 -0.19 -0.00 0.00 1.00 0.00 0.00 64.86 65.58 1l6t h ILE 55 Cb 0.88 0.34 0.00 0.00 -0.74 0.00 0.00 36.82 37.30 1l6t h ILE 55 CO 0.05 0.10 -0.02 0.58 0.00 0.00 0.00 178.15 178.86 1l6t h VAL 56 N 0.55 1.01 -1.00 1.67 2.07 0.08 -2.18 116.25 118.44 1l6t h VAL 56 Ca 0.30 -0.18 0.21 0.00 0.82 0.00 0.00 66.70 67.85 1l6t h VAL 56 Cb 0.44 1.13 -0.11 0.00 -1.52 0.00 0.00 31.29 31.23 1l6t h VAL 56 CO -0.09 0.05 0.61 -0.03 0.02 0.00 0.00 177.57 178.13 1l6t h MET 57 N -0.14 0.64 0.00 1.57 -1.53 0.88 0.18 114.93 116.52 1l6t h MET 57 Ca -0.01 -0.04 -0.00 0.00 -3.44 0.00 0.00 59.70 56.21 1l6t h MET 57 Cb 0.12 -0.14 0.00 0.00 -0.55 0.00 0.00 31.60 31.03 1l6t h MET 57 CO 0.01 0.42 -0.00 0.78 0.14 0.00 0.00 176.91 178.26 1l6t h GLY 58 N 0.66 -0.01 -0.56 1.39 0.00 -1.03 -2.12 103.07 101.40 1l6t h GLY 58 Ca 0.59 0.00 0.26 0.00 0.00 0.00 0.00 47.33 48.19 1l6t h GLY 58 CO -0.39 -0.00 0.27 0.17 0.00 0.00 0.00 176.54 176.59 1l6t h LEU 59 N -0.01 0.02 -0.95 3.11 8.10 -1.13 1.63 115.31 126.09 1l6t h LEU 59 Ca -0.00 0.21 0.16 0.00 0.11 0.00 0.00 57.88 58.36 1l6t h LEU 59 Cb 0.00 0.28 -0.10 0.00 -0.44 0.00 0.00 40.66 40.41 1l6t h LEU 59 CO 0.00 -0.20 0.55 0.58 -4.11 0.00 0.00 178.44 175.26 1l6t h VAL 60 N 0.18 0.75 0.00 0.15 2.07 -0.61 0.85 116.25 119.64 1l6t h VAL 60 Ca 0.60 -0.26 0.00 0.00 0.82 0.00 0.00 66.70 67.86 1l6t h VAL 60 Cb 1.27 -0.07 0.00 0.00 -1.52 0.00 0.00 31.29 30.97 1l6t h VAL 60 CO -0.69 0.14 -0.17 0.78 0.02 0.00 0.00 177.57 177.65 1l6t h ASN 61 N 0.75 0.00 0.13 0.57 -0.26 0.28 -2.96 115.58 114.09 1l6t h ASN 61 Ca 0.52 -0.00 0.00 0.00 -0.56 0.00 0.00 56.30 56.26 1l6t h ASN 61 Cb 0.73 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.99 1l6t h ASN 61 CO -0.35 0.00 -0.06 0.00 -1.06 0.00 0.00 177.43 175.96 1l6t n ALA 62 N -2.08 2.71 -0.00 -0.83 0.00 0.25 -2.62 120.51 117.93 1l6t n ALA 62 Ca 0.03 -0.33 -0.07 0.00 0.00 0.00 0.00 53.44 53.07 1l6t n ALA 62 Cb 0.52 -1.29 -0.06 0.00 0.00 0.00 0.00 19.45 18.62 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 1.15 0.66 -0.05 0.00 2.04 -0.03 -2.56 117.51 118.72 1l6t h ILE 63 Ca 0.00 -1.31 -0.24 0.00 1.00 0.00 0.00 64.86 64.30 1l6t h ILE 63 Cb 0.34 1.20 0.01 0.00 -0.74 0.00 0.00 36.82 37.64 1l6t h ILE 63 CO 0.00 0.21 -0.93 1.55 0.00 0.00 0.00 178.15 178.98 1l6t h PRO 64 N -0.98 0.68 -0.36 2.37 0.13 -1.71 -0.60 132.00 131.53 1l6t h PRO 64 Ca -0.01 -0.65 0.01 0.00 -0.87 0.00 0.00 66.00 64.47 1l6t h PRO 64 Cb 0.43 0.17 -0.02 0.00 0.13 0.00 0.00 31.00 31.70 1l6t h PRO 64 CO 0.02 1.25 0.23 1.98 -0.23 0.00 0.00 178.00 181.25 1l6t h MET 65 N 0.41 0.45 0.00 0.86 1.85 -1.66 0.42 114.93 117.26 1l6t h MET 65 Ca -0.09 -0.03 -0.14 0.00 -0.61 0.00 0.00 59.70 58.83 1l6t h MET 65 Cb 1.57 -0.10 -0.02 0.00 0.43 0.00 0.00 31.60 33.47 1l6t h MET 65 CO 0.18 0.30 -0.68 0.82 -0.40 0.00 0.00 176.91 177.13 1l6t h ILE 66 N 0.46 1.39 0.00 1.77 2.04 -1.51 0.32 117.51 121.98 1l6t h ILE 66 Ca 0.14 -2.40 0.00 0.00 1.00 0.00 0.00 64.86 63.60 1l6t h ILE 66 Cb -0.02 2.33 0.00 0.00 -0.74 0.00 0.00 36.82 38.38 1l6t h ILE 66 CO -0.05 0.66 0.00 0.00 0.00 0.00 0.00 178.15 178.77 1l6t n ALA 67 N -2.37 -0.22 0.03 1.87 0.00 -0.23 -1.70 120.51 117.89 1l6t n ALA 67 Ca -0.00 0.00 0.04 0.00 0.00 0.00 0.00 53.44 53.47 1l6t n ALA 67 Cb 0.70 0.00 0.43 0.00 0.00 0.00 0.00 19.45 20.57 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 1.11 -0.27 0.00 2.07 -0.32 -2.28 116.25 116.56 1l6t h VAL 68 Ca 0.00 -0.28 0.06 0.00 0.82 0.00 0.00 66.70 67.30 1l6t h VAL 68 Cb 0.00 0.64 -0.05 0.00 -1.52 0.00 0.00 31.29 30.35 1l6t h VAL 68 CO 0.00 0.12 -0.09 1.23 0.02 0.00 0.00 177.57 178.85 1l6t h GLY 69 N 0.55 0.16 0.72 2.17 0.00 -0.42 0.14 103.07 106.40 1l6t h GLY 69 Ca 0.13 0.11 -0.04 0.00 0.00 0.00 0.00 47.33 47.54 1l6t h GLY 69 CO -0.02 -0.12 -0.35 1.41 0.00 0.00 0.00 176.54 177.46 1l6t h LEU 70 N -0.03 -0.82 -0.96 3.11 3.38 -0.77 0.13 115.31 119.34 1l6t h LEU 70 Ca 0.13 0.03 0.25 0.00 0.09 0.00 0.00 57.88 58.38 1l6t h LEU 70 Cb 0.24 0.21 -0.18 0.00 0.09 0.00 0.00 40.66 41.02 1l6t h LEU 70 CO -0.30 -0.55 -0.00 1.23 0.09 0.00 0.00 178.44 178.91 1l6t h GLY 71 N -1.04 1.14 0.56 0.83 0.00 -1.29 0.97 103.07 104.24 1l6t h GLY 71 Ca -0.10 0.17 -0.03 0.00 0.00 0.00 0.00 47.33 47.37 1l6t h GLY 71 CO 0.16 -0.47 -0.27 1.41 0.00 0.00 0.00 176.54 177.38 1l6t h LEU 72 N 0.02 -0.63 -0.90 3.11 3.38 -0.56 -1.35 115.31 118.38 1l6t h LEU 72 Ca 0.56 0.02 0.35 0.00 0.09 0.00 0.00 57.88 58.90 1l6t h LEU 72 Cb 1.11 0.16 -0.16 0.00 0.09 0.00 0.00 40.66 41.86 1l6t h LEU 72 CO -0.90 -0.39 0.37 0.00 0.09 0.00 0.00 178.44 177.61 1l6t n TYR 73 N -4.35 0.94 0.02 1.13 4.19 0.44 0.18 117.16 119.70 1l6t n TYR 73 Ca -0.09 1.06 -0.13 0.00 3.31 0.00 0.00 57.90 62.05 1l6t n TYR 73 Cb 0.30 -1.40 -0.09 0.00 0.49 0.00 0.00 39.34 38.64 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 1.21 0.17 2.97 2.07 -0.72 0.31 116.25 122.26 1l6t h VAL 74 Ca 0.71 -0.77 0.01 0.00 0.82 0.00 0.00 66.70 67.47 1l6t h VAL 74 Cb 1.81 1.73 -0.03 0.00 -1.52 0.00 0.00 31.29 33.27 1l6t h VAL 74 CO -0.73 0.20 -0.28 -0.03 0.02 0.00 0.00 177.57 176.75 1l6t h MET 75 N -0.38 -0.50 -0.52 1.57 4.05 0.30 -1.81 114.93 117.64 1l6t h MET 75 Ca -0.00 0.03 -0.01 0.00 -0.28 0.00 0.00 59.70 59.44 1l6t h MET 75 Cb 0.35 0.11 -0.03 0.00 -0.80 0.00 0.00 31.60 31.24 1l6t h MET 75 CO 0.01 -0.33 0.30 0.35 0.23 0.00 0.00 176.91 177.47 1l6t h PHE 76 N -0.52 0.70 -0.03 1.39 3.04 -0.44 0.45 116.94 121.53 1l6t h PHE 76 Ca 0.02 -0.01 0.00 0.00 3.98 0.00 0.00 57.97 61.96 1l6t h PHE 76 Cb 0.52 -0.23 -0.01 0.00 2.56 0.00 0.00 35.95 38.80 1l6t h PHE 76 CO -0.23 0.50 -0.04 0.00 -2.02 0.00 0.00 178.31 176.52 1l6t h ALA 77 N 1.14 -0.37 -0.68 2.41 0.00 -0.01 -0.78 119.26 120.97 1l6t h ALA 77 Ca 0.19 -0.00 0.01 0.00 0.00 0.00 0.00 54.91 55.11 1l6t h ALA 77 Cb 0.01 0.70 -0.03 0.00 0.00 0.00 0.00 17.79 18.47 1l6t h ALA 77 CO -0.03 -0.39 0.45 -0.24 0.00 0.00 0.00 179.25 179.04 1l6t h VAL 78 N -0.04 1.16 0.00 0.00 3.04 -1.32 -3.51 116.25 115.59 1l6t h VAL 78 Ca 0.00 -0.31 0.00 0.00 -1.01 0.00 0.00 66.70 65.38 1l6t h VAL 78 Cb 0.05 0.17 0.00 0.00 -2.01 0.00 0.00 31.29 29.50 1l6t h VAL 78 CO -0.04 0.17 0.00 0.00 -1.01 0.00 0.00 177.57 176.68