#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1l6t h GLU 2 N 0.00 0.00 -0.01 2.12 4.11 -2.08 -2.90 114.58 115.82 1l6t h GLU 2 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 1l6t h GLU 2 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1l6t h GLU 2 CO 0.00 0.24 -0.10 0.09 0.07 0.00 0.00 179.01 179.31 1l6t n ASN 3 N -3.17 0.95 -0.32 3.06 4.13 -1.26 -4.08 115.26 114.57 1l6t n ASN 3 Ca 0.03 -1.04 0.22 0.00 1.68 0.00 0.00 54.58 55.47 1l6t n ASN 3 Cb 0.61 0.02 0.44 0.00 -1.54 0.00 0.00 39.78 39.32 1l6t n ASN 3 CO 0.00 0.00 0.00 0.25 0.28 0.00 0.00 177.26 177.79 1l6t h LEU 4 N 1.33 0.27 -1.51 3.41 5.85 -1.96 1.43 115.31 124.14 1l6t h LEU 4 Ca 0.00 0.21 0.44 0.00 0.84 0.00 0.00 57.88 59.37 1l6t h LEU 4 Cb 0.42 0.22 -0.12 0.00 0.37 0.00 0.00 40.66 41.55 1l6t h LEU 4 CO 0.00 -0.22 0.91 -1.13 -0.34 0.00 0.00 178.44 177.66 1l6t h ASN 5 N 0.20 0.21 0.02 1.25 -1.24 -1.83 0.23 115.58 114.43 1l6t h ASN 5 Ca 0.71 0.11 -0.00 0.00 0.71 0.00 0.00 56.30 57.83 1l6t h ASN 5 Cb 1.63 0.10 0.00 0.00 0.73 0.00 0.00 38.32 40.78 1l6t h ASN 5 CO -0.68 -0.14 -0.01 -0.03 -1.29 0.00 0.00 177.43 175.28 1l6t h MET 6 N 0.09 -0.03 -0.33 6.67 4.05 0.16 -2.79 114.93 122.75 1l6t h MET 6 Ca 0.81 0.00 0.10 0.00 -0.28 0.00 0.00 59.70 60.33 1l6t h MET 6 Cb 2.65 0.01 -0.01 0.00 -0.80 0.00 0.00 31.60 33.44 1l6t h MET 6 CO -0.34 -0.02 0.60 0.38 0.23 0.00 0.00 176.91 177.75 1l6t h ASP 7 N -0.04 0.00 0.85 1.39 2.03 -1.19 0.36 116.42 119.82 1l6t h ASP 7 Ca -0.00 0.00 -0.04 0.00 -0.73 0.00 0.00 57.03 56.26 1l6t h ASP 7 Cb 0.03 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.53 1l6t h ASP 7 CO 0.01 0.00 -0.47 0.25 -1.03 0.00 0.00 179.24 178.00 1l6t h LEU 8 N 0.00 -1.15 -0.01 0.15 5.85 -0.36 0.42 115.31 120.22 1l6t h LEU 8 Ca 0.16 0.05 -0.05 0.00 0.84 0.00 0.00 57.88 58.88 1l6t h LEU 8 Cb 1.35 0.32 0.00 0.00 0.37 0.00 0.00 40.66 42.70 1l6t h LEU 8 CO -0.00 -0.75 -0.18 0.25 -0.34 0.00 0.00 178.44 177.42 1l6t h LEU 9 N -1.22 0.17 -1.56 2.25 5.85 -0.64 -2.86 115.31 117.30 1l6t h LEU 9 Ca -0.11 -0.75 0.25 0.00 0.84 0.00 0.00 57.88 58.10 1l6t h LEU 9 Cb 0.96 -0.05 -0.07 0.00 0.37 0.00 0.00 40.66 41.86 1l6t h LEU 9 CO 0.15 0.90 0.66 0.22 -0.34 0.00 0.00 178.44 180.04 1l6t h TYR 10 N -0.55 0.47 0.32 1.25 5.03 -0.45 -0.49 116.97 122.54 1l6t h TYR 10 Ca -0.02 0.02 -0.02 0.00 2.58 0.00 0.00 58.73 61.29 1l6t h TYR 10 Cb 0.92 -0.14 0.00 0.00 1.55 0.00 0.00 36.73 39.07 1l6t h TYR 10 CO 0.18 0.08 -0.15 1.98 -1.32 0.00 0.00 178.16 178.92 1l6t h MET 11 N 0.31 -0.41 -0.13 1.82 4.05 -0.14 -2.36 114.93 118.07 1l6t h MET 11 Ca 0.53 0.03 0.04 0.00 -0.28 0.00 0.00 59.70 60.01 1l6t h MET 11 Cb 1.50 0.09 -0.01 0.00 -0.80 0.00 0.00 31.60 32.39 1l6t h MET 11 CO -0.19 -0.10 0.43 0.00 0.23 0.00 0.00 176.91 177.28 1l6t h ALA 12 N -0.64 1.62 -2.78 0.39 0.00 -1.05 0.36 119.26 117.16 1l6t h ALA 12 Ca -0.04 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1l6t h ALA 12 Cb 0.50 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.30 1l6t h ALA 12 CO 0.07 -0.50 0.00 0.00 0.00 0.00 0.00 179.25 178.83 1l6t n ALA 13 N -1.99 -0.01 -0.26 0.00 0.00 -0.30 -2.28 120.51 115.68 1l6t n ALA 13 Ca 0.01 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.44 1l6t n ALA 13 Cb 0.51 0.00 0.05 0.00 0.00 0.00 0.00 19.45 20.02 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 0.26 -0.54 0.00 0.00 -1.15 0.33 119.26 116.16 1l6t h ALA 14 Ca 0.00 0.25 0.10 0.00 0.00 0.00 0.00 54.91 55.26 1l6t h ALA 14 Cb 0.00 0.73 -0.11 0.00 0.00 0.00 0.00 17.79 18.41 1l6t h ALA 14 CO 0.00 -0.54 -0.34 0.28 0.00 0.00 0.00 179.25 178.65 1l6t h VAL 15 N -0.06 0.18 -0.76 0.00 2.07 -0.47 0.38 116.25 117.59 1l6t h VAL 15 Ca 0.32 0.00 0.12 0.00 0.82 0.00 0.00 66.70 67.96 1l6t h VAL 15 Cb 0.57 0.18 -0.08 0.00 -1.52 0.00 0.00 31.29 30.43 1l6t h VAL 15 CO -0.79 0.00 0.36 0.24 0.02 0.00 0.00 177.57 177.40 1l6t h MET 16 N -0.19 0.54 -0.45 1.57 2.86 0.02 0.27 114.93 119.54 1l6t h MET 16 Ca 0.21 -0.03 -0.02 0.00 -2.06 0.00 0.00 59.70 57.80 1l6t h MET 16 Cb 0.55 -0.12 -0.02 0.00 0.06 0.00 0.00 31.60 32.07 1l6t h MET 16 CO -0.64 0.36 0.22 0.52 1.06 0.00 0.00 176.91 178.43 1l6t h MET 17 N 0.56 0.65 -0.67 1.72 2.86 0.11 -0.67 114.93 119.48 1l6t h MET 17 Ca 0.40 -0.09 0.00 0.00 -2.06 0.00 0.00 59.70 57.95 1l6t h MET 17 Cb 0.53 -0.12 -0.03 0.00 0.06 0.00 0.00 31.60 32.03 1l6t h MET 17 CO -0.34 0.55 0.44 0.78 1.06 0.00 0.00 176.91 179.40 1l6t h GLY 18 N 0.59 0.96 0.12 8.32 0.00 0.85 0.35 103.07 114.26 1l6t h GLY 18 Ca 0.16 -0.37 -0.01 0.00 0.00 0.00 0.00 47.33 47.11 1l6t h GLY 18 CO -0.02 0.36 -0.06 1.41 0.00 0.00 0.00 176.54 178.23 1l6t h LEU 19 N 0.91 -0.14 -0.31 3.11 4.07 -0.72 0.27 115.31 122.51 1l6t h LEU 19 Ca 0.25 0.00 0.04 0.00 0.08 0.00 0.00 57.88 58.25 1l6t h LEU 19 Cb -0.09 0.04 -0.07 0.00 1.08 0.00 0.00 40.66 41.62 1l6t h LEU 19 CO -0.05 -0.09 -0.48 0.00 -1.08 0.00 0.00 178.44 176.74 1l6t h ALA 20 N -1.91 -0.74 -0.65 1.53 0.00 -1.13 0.35 119.26 116.71 1l6t h ALA 20 Ca -0.02 -0.01 0.11 0.00 0.00 0.00 0.00 54.91 54.99 1l6t h ALA 20 Cb 0.12 1.05 -0.12 0.00 0.00 0.00 0.00 17.79 18.85 1l6t h ALA 20 CO 0.03 -0.96 -0.37 0.00 0.00 0.00 0.00 179.25 177.95 1l6t h ALA 21 N -0.27 -0.09 -0.96 0.00 0.00 -0.37 1.19 119.26 118.77 1l6t h ALA 21 Ca 0.06 0.17 0.20 0.00 0.00 0.00 0.00 54.91 55.33 1l6t h ALA 21 Cb 0.52 0.86 -0.09 0.00 0.00 0.00 0.00 17.79 19.09 1l6t h ALA 21 CO -0.49 -0.71 0.61 0.82 0.00 0.00 0.00 179.25 179.48 1l6t h ILE 22 N -0.15 0.69 0.44 0.00 2.04 0.13 0.28 117.51 120.93 1l6t h ILE 22 Ca 0.23 -0.20 -0.02 0.00 1.00 0.00 0.00 64.86 65.88 1l6t h ILE 22 Cb 0.56 0.06 -0.01 0.00 -0.74 0.00 0.00 36.82 36.69 1l6t h ILE 22 CO -0.73 0.11 -0.31 1.23 0.00 0.00 0.00 178.15 178.45 1l6t h GLY 23 N 0.58 -0.98 0.79 5.37 0.00 0.53 -0.06 103.07 109.30 1l6t h GLY 23 Ca 0.53 0.42 -0.03 0.00 0.00 0.00 0.00 47.33 48.25 1l6t h GLY 23 CO -0.27 -0.33 -0.46 -1.80 0.00 0.00 0.00 176.54 173.68 1l6t h ASP 24 N -0.71 -1.17 -1.51 0.19 1.82 -0.61 0.47 116.42 114.90 1l6t h ASP 24 Ca -0.06 0.07 0.44 0.00 -0.39 0.00 0.00 57.03 57.09 1l6t h ASP 24 Cb 0.58 0.35 -0.06 0.00 0.68 0.00 0.00 39.33 40.88 1l6t h ASP 24 CO 0.03 -0.69 1.22 0.00 -1.61 0.00 0.00 179.24 178.19 1l6t h ALA 25 N -0.94 3.41 0.00 -0.78 0.00 -0.50 1.19 119.26 121.65 1l6t h ALA 25 Ca -0.09 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.77 1l6t h ALA 25 Cb 0.89 0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.80 1l6t h ALA 25 CO 0.07 -2.00 -0.00 0.82 0.00 0.00 0.00 179.25 178.15 1l6t h ILE 26 N 0.00 1.56 -0.76 0.00 2.04 0.68 -2.78 117.51 118.24 1l6t h ILE 26 Ca 0.71 -2.11 0.24 0.00 1.00 0.00 0.00 64.86 64.71 1l6t h ILE 26 Cb 3.15 2.92 -0.14 0.00 -0.74 0.00 0.00 36.82 42.01 1l6t h ILE 26 CO -0.01 0.52 0.12 0.61 0.00 0.00 0.00 178.15 179.39 1l6t n GLY 27 N 1.52 -0.92 0.08 5.37 0.00 0.41 0.10 105.19 111.74 1l6t n GLY 27 Ca -0.09 0.72 -0.12 0.00 0.00 0.00 0.00 46.02 46.53 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 1.39 -0.77 -0.61 5.03 -1.58 -2.30 117.51 118.66 1l6t h ILE 28 Ca 0.51 -1.71 0.14 0.00 -0.12 0.00 0.00 64.86 63.68 1l6t h ILE 28 Cb 1.15 2.47 -0.14 0.00 -3.03 0.00 0.00 36.82 37.27 1l6t h ILE 28 CO -0.69 0.41 -0.32 1.23 -0.68 0.00 0.00 178.15 178.11 1l6t h GLY 29 N -0.84 0.14 1.76 5.37 0.00 0.99 1.04 103.07 111.53 1l6t h GLY 29 Ca -0.00 0.42 -0.08 0.00 0.00 0.00 0.00 47.33 47.66 1l6t h GLY 29 CO 0.01 -0.23 -0.25 -2.22 0.00 0.00 0.00 176.54 173.84 1l6t h ILE 30 N -0.07 1.24 -0.43 2.60 5.03 -0.47 -2.69 117.51 122.72 1l6t h ILE 30 Ca 0.31 -1.15 0.05 0.00 -0.12 0.00 0.00 64.86 63.95 1l6t h ILE 30 Cb 0.58 1.41 -0.05 0.00 -3.03 0.00 0.00 36.82 35.73 1l6t h ILE 30 CO -0.82 0.35 0.16 0.25 -0.68 0.00 0.00 178.15 177.42 1l6t h LEU 31 N 0.26 0.19 -1.18 1.44 6.46 0.16 0.69 115.31 123.32 1l6t h LEU 31 Ca 0.04 0.05 0.25 0.00 -0.12 0.00 0.00 57.88 58.09 1l6t h LEU 31 Cb 0.59 0.02 -0.11 0.00 -0.73 0.00 0.00 40.66 40.44 1l6t h LEU 31 CO 0.04 0.14 0.63 1.23 -0.62 0.00 0.00 178.44 179.86 1l6t h GLY 32 N 0.34 1.54 1.33 3.75 0.00 -0.48 0.74 103.07 110.29 1l6t h GLY 32 Ca 0.20 -0.27 -0.29 0.00 0.00 0.00 0.00 47.33 46.98 1l6t h GLY 32 CO -0.20 -0.16 -1.22 -1.33 0.00 0.00 0.00 176.54 173.63 1l6t h GLY 33 N 0.51 0.63 1.19 4.60 0.00 -1.19 -2.70 103.07 106.11 1l6t h GLY 33 Ca 0.61 -1.32 0.00 0.00 0.00 0.00 0.00 47.33 46.62 1l6t h GLY 33 CO -0.37 1.16 0.00 0.28 0.00 0.00 0.00 176.54 177.61 1l6t n LYS 34 N -3.75 0.67 -0.10 4.80 5.02 0.45 -2.94 118.16 122.31 1l6t n LYS 34 Ca -0.12 0.02 -0.18 0.00 -2.02 0.00 0.00 58.31 56.01 1l6t n LYS 34 Cb 0.98 -1.50 -0.13 0.00 -0.02 0.00 0.00 35.03 34.36 1l6t n LYS 34 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1l6t n PHE 35 N -1.09 0.29 -0.13 2.13 7.35 0.23 -3.86 117.46 122.38 1l6t n PHE 35 Ca 0.17 0.06 -0.10 0.00 -0.76 0.00 0.00 57.45 56.82 1l6t n PHE 35 Cb 0.13 -1.04 -0.05 0.00 0.35 0.00 0.00 39.48 38.86 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 0.02 -1.48 -1.72 -2.13 5.85 -1.36 1.62 115.31 116.10 1l6t h LEU 36 Ca -0.54 0.22 -0.01 0.00 0.84 0.00 0.00 57.88 58.39 1l6t h LEU 36 Cb 1.96 0.64 -0.01 0.00 0.37 0.00 0.00 40.66 43.62 1l6t h LEU 36 CO -0.04 -0.38 0.04 -0.33 -0.34 0.00 0.00 178.44 177.40 1l6t h GLU 37 N -0.34 0.22 -0.11 1.25 5.08 -1.78 0.54 114.58 119.43 1l6t h GLU 37 Ca 0.13 -0.02 -0.05 0.00 -1.00 0.00 0.00 59.36 58.42 1l6t h GLU 37 Cb 0.59 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.79 1l6t h GLU 37 CO -0.57 0.20 -0.12 0.78 -1.00 0.00 0.00 179.01 178.30 1l6t h GLY 38 N 0.37 0.30 2.00 -3.84 0.00 -0.17 -2.94 103.07 98.79 1l6t h GLY 38 Ca 0.06 -0.32 0.00 0.00 0.00 0.00 0.00 47.33 47.07 1l6t h GLY 38 CO -0.00 0.29 0.00 0.00 0.00 0.00 0.00 176.54 176.82 1l6t h ALA 39 N 0.57 1.00 0.00 3.60 0.00 0.25 -2.99 119.26 121.70 1l6t h ALA 39 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1l6t h ALA 39 Cb 0.66 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.45 1l6t h ALA 39 CO 0.03 0.00 0.15 0.00 0.00 0.00 0.00 179.25 179.43 1l6t h ALA 40 N 2.38 1.14 -0.29 0.00 0.00 0.27 0.25 119.26 123.00 1l6t h ALA 40 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.84 1l6t h ALA 40 Cb 0.63 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.40 1l6t h ALA 40 CO 0.00 -0.14 -0.11 0.00 0.00 0.00 0.00 179.25 179.00 1l6t h ARG 41 N 0.00 0.49 -5.00 0.00 -0.00 -1.65 -3.40 114.38 104.82 1l6t h ARG 41 Ca 0.00 -0.14 -0.67 0.00 -0.50 0.00 0.00 59.98 58.67 1l6t h ARG 41 Cb 0.30 -0.05 -0.33 0.00 0.00 0.00 0.00 29.97 29.89 1l6t h ARG 41 CO 0.00 0.61 -0.80 1.14 0.00 0.00 0.00 179.97 180.91 1l6t s GLN 42 N -4.76 2.97 0.00 0.04 0.00 0.87 -4.97 119.66 113.82 1l6t s GLN 42 Ca -0.07 -0.87 0.23 0.00 -0.00 0.00 0.00 55.36 54.66 1l6t s GLN 42 Cb 0.15 -2.77 1.33 0.00 0.00 0.00 0.00 33.01 31.71 1l6t s GLN 42 CO 0.77 -0.28 1.77 -0.35 0.00 0.00 0.00 175.29 177.21 1l6t n PRO 43 N 4.65 0.60 -0.48 9.60 -0.04 -1.26 -2.06 135.00 146.01 1l6t n PRO 43 Ca -0.19 0.03 0.10 0.00 -0.04 0.00 0.00 63.50 63.40 1l6t n PRO 43 Cb 0.49 -1.50 0.32 0.00 -0.04 0.00 0.00 33.50 32.77 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 -1.10 4.27 -0.26 3.54 8.00 -1.26 -4.01 116.55 125.73 1l6t n ASP 44 Ca 0.15 -2.26 0.03 0.00 0.71 0.00 0.00 54.79 53.42 1l6t n ASP 44 Cb 0.12 -0.51 0.05 0.00 -0.02 0.00 0.00 41.12 40.75 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 1.19 0.93 -0.03 0.64 4.32 -0.87 -4.79 117.00 118.39 1l6t n LEU 45 Ca 0.24 -1.65 -0.12 0.00 -0.02 0.00 0.00 56.01 54.46 1l6t n LEU 45 Cb 0.75 -0.14 -0.10 0.00 -1.62 0.00 0.00 43.42 42.31 1l6t n LEU 45 CO 0.19 0.39 0.42 0.40 -1.22 0.00 0.00 177.39 177.58 1l6t h ILE 46 N 3.69 1.38 0.00 -0.08 1.08 -1.70 -1.10 117.51 120.78 1l6t h ILE 46 Ca 0.00 -1.72 0.00 0.00 -0.39 0.00 0.00 64.86 62.75 1l6t h ILE 46 Cb 1.15 2.47 0.00 0.00 -3.07 0.00 0.00 36.82 37.37 1l6t h ILE 46 CO 0.00 0.41 0.00 -0.81 -0.69 0.00 0.00 178.15 177.06 1l6t n PRO 47 N -4.74 0.75 -0.06 2.37 -0.04 -1.26 -2.06 135.00 129.95 1l6t n PRO 47 Ca -0.08 0.00 -0.06 0.00 -0.04 0.00 0.00 63.50 63.32 1l6t n PRO 47 Cb 0.35 -1.47 -0.02 0.00 -0.04 0.00 0.00 33.50 32.31 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 -0.97 1.29 0.12 1.53 7.99 -1.20 -3.65 117.00 122.10 1l6t n LEU 48 Ca 0.17 0.22 0.19 0.00 -0.01 0.00 0.00 56.01 56.58 1l6t n LEU 48 Cb 0.08 -0.66 0.76 0.00 -0.11 0.00 0.00 43.42 43.49 1l6t n LEU 48 CO 0.13 -0.35 1.17 0.17 -1.51 0.00 0.00 177.39 176.99 1l6t h LEU 49 N -0.66 0.00 0.17 2.23 -0.00 -1.26 -0.73 115.31 115.07 1l6t h LEU 49 Ca 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 57.88 57.87 1l6t h LEU 49 Cb 0.66 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.32 1l6t h LEU 49 CO 0.00 0.00 -0.08 0.03 -0.00 0.00 0.00 178.44 178.39 1l6t h ARG 50 N 0.00 -0.22 0.03 0.17 3.08 -1.63 -0.57 114.38 115.25 1l6t h ARG 50 Ca 0.16 0.01 0.03 0.00 0.07 0.00 0.00 59.98 60.25 1l6t h ARG 50 Cb 0.79 0.05 -0.04 0.00 0.08 0.00 0.00 29.97 30.85 1l6t h ARG 50 CO -0.00 0.21 -0.29 1.15 -1.07 0.00 0.00 179.97 179.96 1l6t h THR 51 N -0.81 0.36 -0.65 2.04 2.02 -1.28 0.14 112.91 114.72 1l6t h THR 51 Ca -0.02 0.00 0.05 0.00 0.77 0.00 0.00 66.41 67.20 1l6t h THR 51 Cb 0.53 0.36 -0.05 0.00 -1.74 0.00 0.00 68.15 67.24 1l6t h THR 51 CO 0.04 0.00 0.37 0.06 0.37 0.00 0.00 175.52 176.36 1l6t h GLN 52 N -0.46 0.69 -0.03 6.66 3.07 -1.29 -2.50 115.11 121.24 1l6t h GLN 52 Ca 0.05 -0.04 0.03 0.00 0.09 0.00 0.00 58.65 58.78 1l6t h GLN 52 Cb 0.53 -0.16 -0.04 0.00 0.08 0.00 0.00 27.48 27.90 1l6t h GLN 52 CO -0.23 0.46 -0.16 0.35 0.09 0.00 0.00 178.83 179.34 1l6t h PHE 53 N 0.71 -0.42 -0.57 0.06 3.57 -0.29 0.18 116.94 120.18 1l6t h PHE 53 Ca 0.28 0.02 0.10 0.00 3.53 0.00 0.00 57.97 61.90 1l6t h PHE 53 Cb 0.13 0.19 -0.11 0.00 2.79 0.00 0.00 35.95 38.95 1l6t h PHE 53 CO -0.07 -0.24 -0.32 0.35 -2.23 0.00 0.00 178.31 175.80 1l6t h PHE 54 N -0.25 -0.89 -0.21 0.41 3.57 -0.32 0.24 116.94 119.49 1l6t h PHE 54 Ca 0.06 0.07 0.01 0.00 3.53 0.00 0.00 57.97 61.65 1l6t h PHE 54 Cb 0.34 0.48 -0.02 0.00 2.79 0.00 0.00 35.95 39.53 1l6t h PHE 54 CO -0.23 -0.38 0.10 0.82 -2.23 0.00 0.00 178.31 176.39 1l6t h ILE 55 N -0.17 0.99 -0.65 1.41 5.03 -1.20 -2.11 117.51 120.81 1l6t h ILE 55 Ca 0.23 -0.07 0.14 0.00 -0.12 0.00 0.00 64.86 65.03 1l6t h ILE 55 Cb 0.55 0.76 -0.11 0.00 -3.03 0.00 0.00 36.82 34.98 1l6t h ILE 55 CO -0.66 0.04 -0.03 0.58 -0.68 0.00 0.00 178.15 177.40 1l6t h VAL 56 N 0.21 0.44 -0.61 1.67 2.07 0.12 0.24 116.25 120.39 1l6t h VAL 56 Ca 0.09 -0.03 0.11 0.00 0.82 0.00 0.00 66.70 67.68 1l6t h VAL 56 Cb 0.03 0.34 -0.08 0.00 -1.52 0.00 0.00 31.29 30.05 1l6t h VAL 56 CO -0.06 0.02 0.16 -0.03 0.02 0.00 0.00 177.57 177.67 1l6t h MET 57 N 0.09 0.29 -0.35 1.57 -1.53 0.02 0.53 114.93 115.56 1l6t h MET 57 Ca 0.34 -0.02 -0.03 0.00 -3.44 0.00 0.00 59.70 56.55 1l6t h MET 57 Cb 0.56 -0.07 -0.01 0.00 -0.55 0.00 0.00 31.60 31.52 1l6t h MET 57 CO -0.58 0.19 0.09 0.78 0.14 0.00 0.00 176.91 177.53 1l6t h GLY 58 N 0.30 0.60 1.75 1.39 0.00 -0.31 -2.17 103.07 104.64 1l6t h GLY 58 Ca 0.32 -0.38 -0.03 0.00 0.00 0.00 0.00 47.33 47.24 1l6t h GLY 58 CO -0.38 0.35 -0.00 -2.00 0.00 0.00 0.00 176.54 174.51 1l6t h LEU 59 N 0.41 0.29 -0.91 3.11 6.46 0.34 0.43 115.31 125.45 1l6t h LEU 59 Ca 0.11 -0.04 -0.06 0.00 -0.12 0.00 0.00 57.88 57.77 1l6t h LEU 59 Cb 0.30 -0.07 -0.03 0.00 -0.73 0.00 0.00 40.66 40.13 1l6t h LEU 59 CO 0.00 0.35 0.14 0.58 -0.62 0.00 0.00 178.44 178.88 1l6t h VAL 60 N 0.31 1.24 -0.01 1.05 2.07 0.52 0.25 116.25 121.67 1l6t h VAL 60 Ca 0.07 -0.89 0.00 0.00 0.82 0.00 0.00 66.70 66.70 1l6t h VAL 60 Cb 0.22 0.63 0.00 0.00 -1.52 0.00 0.00 31.29 30.62 1l6t h VAL 60 CO 0.01 0.34 -0.10 0.59 0.02 0.00 0.00 177.57 178.43 1l6t n ASN 61 N -4.25 1.52 -0.04 0.57 5.03 -0.52 -3.86 115.26 113.71 1l6t n ASN 61 Ca 0.04 -1.37 -0.21 0.00 0.87 0.00 0.00 54.58 53.92 1l6t n ASN 61 Cb 0.25 0.06 -0.13 0.00 -1.02 0.00 0.00 39.78 38.93 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 0.03 1.02 -0.10 5.41 0.00 0.14 -2.33 120.51 124.69 1l6t n ALA 62 Ca 0.16 -0.72 -0.06 0.00 0.00 0.00 0.00 53.44 52.83 1l6t n ALA 62 Cb 0.38 -0.52 0.01 0.00 0.00 0.00 0.00 19.45 19.32 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 -0.03 0.58 0.07 0.00 2.04 -0.67 0.37 117.51 119.86 1l6t h ILE 63 Ca -0.46 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.39 1l6t h ILE 63 Cb 1.95 0.58 0.00 0.00 -0.74 0.00 0.00 36.82 38.61 1l6t h ILE 63 CO 0.02 0.00 -0.03 1.55 0.00 0.00 0.00 178.15 179.68 1l6t h PRO 64 N -0.05 -0.09 -1.03 2.37 0.13 -1.74 -0.67 132.00 130.93 1l6t h PRO 64 Ca 0.17 0.01 0.30 0.00 -0.87 0.00 0.00 66.00 65.61 1l6t h PRO 64 Cb 0.31 0.02 -0.13 0.00 0.13 0.00 0.00 31.00 31.33 1l6t h PRO 64 CO -0.39 0.50 0.61 1.98 -0.23 0.00 0.00 178.00 180.47 1l6t h MET 65 N -0.84 0.37 0.00 0.86 1.85 -1.30 1.21 114.93 117.08 1l6t h MET 65 Ca -0.01 -0.02 -0.20 0.00 -0.61 0.00 0.00 59.70 58.86 1l6t h MET 65 Cb 0.62 -0.08 -0.03 0.00 0.43 0.00 0.00 31.60 32.54 1l6t h MET 65 CO 0.02 0.25 -1.08 0.82 -0.40 0.00 0.00 176.91 176.51 1l6t h ILE 66 N 0.38 1.23 0.09 1.77 2.04 -0.31 -0.71 117.51 122.00 1l6t h ILE 66 Ca 0.70 -2.87 -0.00 0.00 1.00 0.00 0.00 64.86 63.69 1l6t h ILE 66 Cb 1.61 2.58 0.00 0.00 -0.74 0.00 0.00 36.82 40.27 1l6t h ILE 66 CO -0.52 0.70 -0.04 0.00 0.00 0.00 0.00 178.15 178.28 1l6t h ALA 67 N 1.15 -0.76 0.00 1.87 0.00 0.29 -1.77 119.26 120.04 1l6t h ALA 67 Ca -0.08 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.77 1l6t h ALA 67 Cb 1.71 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 19.55 1l6t h ALA 67 CO 0.10 -0.76 -0.18 0.28 0.00 0.00 0.00 179.25 178.70 1l6t h VAL 68 N -0.16 0.63 0.32 0.00 2.07 -0.47 -2.66 116.25 115.98 1l6t h VAL 68 Ca -0.01 -0.78 -0.01 0.00 0.82 0.00 0.00 66.70 66.72 1l6t h VAL 68 Cb 0.09 1.50 -0.01 0.00 -1.52 0.00 0.00 31.29 31.36 1l6t h VAL 68 CO 0.02 0.17 -0.25 1.23 0.02 0.00 0.00 177.57 178.77 1l6t h GLY 69 N 1.24 -0.60 0.84 2.17 0.00 -1.11 -0.05 103.07 105.56 1l6t h GLY 69 Ca -0.00 0.28 -0.03 0.00 0.00 0.00 0.00 47.33 47.57 1l6t h GLY 69 CO 0.02 -0.24 -0.31 -2.00 0.00 0.00 0.00 176.54 174.02 1l6t h LEU 70 N -0.57 -0.74 -0.97 3.11 6.46 -1.17 -1.23 115.31 120.20 1l6t h LEU 70 Ca -0.02 -0.01 0.28 0.00 -0.12 0.00 0.00 57.88 58.00 1l6t h LEU 70 Cb 0.50 0.19 -0.18 0.00 -0.73 0.00 0.00 40.66 40.44 1l6t h LEU 70 CO -0.00 -0.42 0.10 1.23 -0.62 0.00 0.00 178.44 178.72 1l6t h GLY 71 N -1.04 1.35 0.67 3.75 0.00 -1.45 0.15 103.07 106.50 1l6t h GLY 71 Ca -0.09 0.11 -0.03 0.00 0.00 0.00 0.00 47.33 47.32 1l6t h GLY 71 CO 0.15 -0.52 -0.32 1.41 0.00 0.00 0.00 176.54 177.25 1l6t h LEU 72 N 0.03 -0.76 -1.00 3.11 3.38 -0.83 -1.69 115.31 117.56 1l6t h LEU 72 Ca 0.61 0.03 0.30 0.00 0.09 0.00 0.00 57.88 58.91 1l6t h LEU 72 Cb 1.30 0.20 -0.18 0.00 0.09 0.00 0.00 40.66 42.07 1l6t h LEU 72 CO -0.87 -0.46 0.12 0.00 0.09 0.00 0.00 178.44 177.31 1l6t n TYR 73 N -4.87 0.73 0.36 1.13 9.36 0.10 -0.48 117.16 123.51 1l6t n TYR 73 Ca -0.11 1.20 -0.14 0.00 3.32 0.00 0.00 57.90 62.16 1l6t n TYR 73 Cb 0.35 -1.31 -0.07 0.00 -0.63 0.00 0.00 39.34 37.69 1l6t n TYR 73 CO 0.00 0.00 0.00 0.28 0.22 0.00 0.00 176.86 177.36 1l6t h VAL 74 N 0.00 0.00 -0.99 2.97 2.07 -0.71 0.41 116.25 120.01 1l6t h VAL 74 Ca 0.65 -0.02 0.15 0.00 0.82 0.00 0.00 66.70 68.30 1l6t h VAL 74 Cb 1.43 0.00 -0.16 0.00 -1.52 0.00 0.00 31.29 31.04 1l6t h VAL 74 CO -0.91 0.00 -0.38 -0.03 0.02 0.00 0.00 177.57 176.27 1l6t h MET 75 N -0.95 -0.00 -0.12 1.57 1.85 0.19 0.30 114.93 117.77 1l6t h MET 75 Ca -0.09 0.00 -0.00 0.00 -0.61 0.00 0.00 59.70 58.99 1l6t h MET 75 Cb 0.71 0.00 -0.01 0.00 0.43 0.00 0.00 31.60 32.74 1l6t h MET 75 CO 0.16 -0.00 0.06 0.35 -0.40 0.00 0.00 176.91 177.07 1l6t h PHE 76 N -0.00 0.18 -0.51 1.39 3.57 -0.95 1.43 116.94 122.05 1l6t h PHE 76 Ca 0.35 -0.01 0.08 0.00 3.53 0.00 0.00 57.97 61.92 1l6t h PHE 76 Cb 0.60 -0.06 -0.10 0.00 2.79 0.00 0.00 35.95 39.19 1l6t h PHE 76 CO -0.87 0.24 -0.43 0.00 -2.23 0.00 0.00 178.31 175.02 1l6t h ALA 77 N 0.92 -0.36 -0.10 2.41 0.00 0.33 0.12 119.26 122.58 1l6t h ALA 77 Ca 0.04 0.09 -0.17 0.00 0.00 0.00 0.00 54.91 54.88 1l6t h ALA 77 Cb 0.13 0.93 -0.01 0.00 0.00 0.00 0.00 17.79 18.84 1l6t h ALA 77 CO -0.01 -0.84 -0.65 -0.24 0.00 0.00 0.00 179.25 177.52 1l6t h VAL 78 N -0.27 1.36 0.00 0.00 3.04 -0.74 -3.51 116.25 116.14 1l6t h VAL 78 Ca 0.16 -2.00 0.00 0.00 -1.01 0.00 0.00 66.70 63.85 1l6t h VAL 78 Cb 0.57 1.99 0.00 0.00 -2.01 0.00 0.00 31.29 31.84 1l6t h VAL 78 CO -0.64 0.60 0.00 0.00 -1.01 0.00 0.00 177.57 176.52