#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yhu s ALA 5 N 0.01 0.25 0.36 0.00 0.00 -1.26 -4.76 121.76 116.35 1yhu s ALA 5 Ca 0.30 -0.05 0.07 0.00 0.00 0.00 0.00 51.96 52.28 1yhu s ALA 5 Cb -0.01 -3.25 0.67 0.00 0.00 0.00 0.00 23.12 20.54 1yhu s ALA 5 CO -0.17 -3.37 1.87 1.98 0.00 0.00 0.00 175.76 176.08 1yhu h MET 6 N -2.29 0.36 -0.16 0.00 1.85 -1.99 -1.02 114.93 111.69 1yhu h MET 6 Ca -0.56 -0.09 -0.05 0.00 -0.61 0.00 0.00 59.70 58.39 1yhu h MET 6 Cb 1.32 -0.05 -0.00 0.00 0.43 0.00 0.00 31.60 33.30 1yhu h MET 6 CO 0.51 0.48 -0.08 -0.07 -0.40 0.00 0.00 176.91 177.34 1yhu h LEU 7 N 0.34 0.34 -1.55 3.39 3.38 -1.99 -1.33 115.31 117.89 1yhu h LEU 7 Ca 0.07 -0.42 0.11 0.00 0.09 0.00 0.00 57.88 57.73 1yhu h LEU 7 Cb 0.40 -0.09 -0.04 0.00 0.09 0.00 0.00 40.66 41.01 1yhu h LEU 7 CO 0.02 0.69 0.46 -0.33 0.09 0.00 0.00 178.44 179.37 1yhu h GLU 8 N -0.00 0.48 0.15 1.13 5.08 -1.75 0.12 114.58 119.78 1yhu h GLU 8 Ca 0.03 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.36 1yhu h GLU 8 Cb 0.56 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.70 1yhu h GLU 8 CO 0.02 0.32 -0.07 0.00 -1.00 0.00 0.00 179.01 178.28 1yhu h ARG 9 N 0.49 -0.19 -0.96 2.33 3.08 -0.94 0.42 114.38 118.61 1yhu h ARG 9 Ca 0.33 0.01 0.24 0.00 0.07 0.00 0.00 59.98 60.62 1yhu h ARG 9 Cb 0.61 0.04 -0.12 0.00 0.08 0.00 0.00 29.97 30.58 1yhu h ARG 9 CO -0.11 0.26 0.51 0.00 -1.07 0.00 0.00 179.97 179.57 1yhu h ALA 10 N -0.13 1.65 -0.05 0.04 0.00 -0.46 0.16 119.26 120.47 1yhu h ALA 10 Ca -0.02 0.14 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 1yhu h ALA 10 Cb 0.53 0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.39 1yhu h ALA 10 CO 0.03 -0.30 -0.03 -0.22 0.00 0.00 0.00 179.25 178.74 1yhu h LYS 11 N 0.51 0.11 -0.88 0.00 3.64 -0.63 -1.48 116.57 117.83 1yhu h LYS 11 Ca 0.61 -0.05 0.06 0.00 -1.27 0.00 0.00 60.65 60.00 1yhu h LYS 11 Cb 1.16 -0.00 -0.06 0.00 -0.41 0.00 0.00 32.23 32.91 1yhu h LYS 11 CO -0.50 0.50 0.55 0.28 -2.27 0.00 0.00 179.45 178.02 1yhu h VAL 12 N -0.29 1.05 0.72 2.00 2.07 0.23 -1.30 116.25 120.72 1yhu h VAL 12 Ca 0.01 -0.34 -0.04 0.00 0.82 0.00 0.00 66.70 67.15 1yhu h VAL 12 Cb 0.47 -0.04 0.01 0.00 -1.52 0.00 0.00 31.29 30.21 1yhu h VAL 12 CO 0.01 0.18 -0.34 0.11 0.02 0.00 0.00 177.57 177.55 1yhu h LYS 13 N 1.00 -0.93 -0.96 1.57 1.57 -0.76 -0.06 116.57 118.01 1yhu h LYS 13 Ca 0.38 0.06 0.13 0.00 -1.87 0.00 0.00 60.65 59.35 1yhu h LYS 13 Cb 0.17 0.21 -0.14 0.00 0.08 0.00 0.00 32.23 32.55 1yhu h LYS 13 CO -0.17 -0.61 -0.46 -0.44 -0.57 0.00 0.00 179.45 177.20 1yhu h ASP 14 N -1.00 -1.70 -0.29 0.86 3.32 -0.65 0.88 116.42 117.84 1yhu h ASP 14 Ca -0.10 0.31 -0.03 0.00 0.02 0.00 0.00 57.03 57.24 1yhu h ASP 14 Cb 0.75 0.82 -0.01 0.00 0.22 0.00 0.00 39.33 41.11 1yhu h ASP 14 CO 0.16 -0.27 0.07 -0.33 -1.72 0.00 0.00 179.24 177.15 1yhu h GLU 15 N -0.02 0.45 -0.54 3.56 5.08 -1.17 -2.28 114.58 119.67 1yhu h GLU 15 Ca 0.27 -0.11 0.10 0.00 -1.00 0.00 0.00 59.36 58.62 1yhu h GLU 15 Cb 0.53 -0.06 -0.08 0.00 0.50 0.00 0.00 28.75 29.64 1yhu h GLU 15 CO -0.94 0.53 0.09 2.35 -1.00 0.00 0.00 179.01 180.04 1yhu h TRP 16 N 0.30 0.14 0.03 4.33 2.91 0.43 0.11 115.95 124.21 1yhu h TRP 16 Ca 0.09 0.03 0.03 0.00 1.13 0.00 0.00 58.89 60.17 1yhu h TRP 16 Cb 0.28 0.02 -0.05 0.00 -0.51 0.00 0.00 29.16 28.90 1yhu h TRP 16 CO 0.01 -0.03 -0.33 0.00 -1.03 0.00 0.00 178.44 177.05 1yhu h ALA 17 N 1.43 -0.51 -0.48 2.65 0.00 -0.64 0.75 119.26 122.46 1yhu h ALA 17 Ca 0.28 -0.03 0.06 0.00 0.00 0.00 0.00 54.91 55.22 1yhu h ALA 17 Cb 0.39 0.58 -0.06 0.00 0.00 0.00 0.00 17.79 18.71 1yhu h ALA 17 CO -0.37 -0.86 0.16 -0.22 0.00 0.00 0.00 179.25 177.97 1yhu h LYS 18 N -0.50 0.32 0.12 0.00 1.63 -0.76 -2.59 116.57 114.79 1yhu h LYS 18 Ca 0.05 -0.02 -0.01 0.00 -0.85 0.00 0.00 60.65 59.83 1yhu h LYS 18 Cb 0.58 -0.07 0.00 0.00 -0.60 0.00 0.00 32.23 32.13 1yhu h LYS 18 CO -0.25 0.21 -0.06 0.00 -3.45 0.00 0.00 179.45 175.90 1yhu h ALA 19 N 1.32 -0.16 -0.12 5.00 0.00 -0.15 -3.11 119.26 122.05 1yhu h ALA 19 Ca 0.23 -0.22 0.04 0.00 0.00 0.00 0.00 54.91 54.95 1yhu h ALA 19 Cb 0.24 0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.09 1yhu h ALA 19 CO -0.24 -0.35 0.28 -0.92 0.00 0.00 0.00 179.25 178.02 1yhu h TYR 20 N -0.64 0.00 -0.69 0.00 3.20 0.54 -3.47 116.97 115.91 1yhu h TYR 20 Ca -0.02 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.85 1yhu h TYR 20 Cb 0.49 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.76 1yhu h TYR 20 CO 0.07 0.00 0.00 0.41 -1.64 0.00 0.00 178.16 177.00 1yhu n GLY 21 N -1.29 -1.49 0.24 1.82 0.00 -0.98 -3.56 105.19 99.93 1yhu n GLY 21 Ca 0.00 -1.24 -0.06 0.00 0.00 0.00 0.00 46.02 44.72 1yhu n GLY 21 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1yhu n ILE 22 N -0.63 1.24 0.00 -0.61 5.41 -1.26 -4.83 119.36 118.68 1yhu n ILE 22 Ca 0.00 0.22 0.00 0.00 1.00 0.00 0.00 62.75 63.97 1yhu n ILE 22 Cb 0.00 -2.10 0.00 0.00 -0.71 0.00 0.00 39.64 36.83 1yhu n ILE 22 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1yhu n GLY 23 N 1.82 0.30 0.22 7.39 0.00 -1.26 -4.77 105.19 108.89 1yhu n GLY 23 Ca -0.10 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.02 1yhu n GLY 23 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yhu h ALA 24 N 0.32 0.97 -0.45 4.61 0.00 -1.98 -2.81 119.26 119.92 1yhu h ALA 24 Ca 0.00 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.70 1yhu h ALA 24 Cb 0.00 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 1yhu h ALA 24 CO 0.00 0.26 0.21 0.00 0.00 0.00 0.00 179.25 179.72 1yhu h ALA 25 N 1.79 1.53 -0.02 0.00 0.00 -1.89 -2.16 119.26 118.51 1yhu h ALA 25 Ca -0.00 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 54.81 1yhu h ALA 25 Cb 0.83 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.43 1yhu h ALA 25 CO 0.03 0.38 0.00 0.00 0.00 0.00 0.00 179.25 179.66 1yhu h ARG 26 N 0.63 0.03 -0.21 0.00 3.08 -1.54 0.56 114.38 116.93 1yhu h ARG 26 Ca 0.16 -0.01 0.05 0.00 0.07 0.00 0.00 59.98 60.25 1yhu h ARG 26 Cb 0.08 -0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.07 1yhu h ARG 26 CO -0.02 0.25 -0.14 1.03 -1.07 0.00 0.00 179.97 180.02 1yhu h SER 27 N -0.19 -0.46 -0.32 7.04 0.87 -1.56 0.87 113.55 119.80 1yhu h SER 27 Ca 0.01 0.10 0.07 0.00 -1.23 0.00 0.00 61.79 60.74 1yhu h SER 27 Cb 0.23 0.24 -0.08 0.00 -0.44 0.00 0.00 62.40 62.36 1yhu h SER 27 CO 0.00 -0.18 -0.21 0.50 -0.53 0.00 0.00 176.83 176.41 1yhu h LYS 28 N -0.14 -0.17 -0.07 2.24 3.64 -1.15 0.51 116.57 121.44 1yhu h LYS 28 Ca 0.12 0.01 0.04 0.00 -1.27 0.00 0.00 60.65 59.55 1yhu h LYS 28 Cb 0.32 0.04 -0.04 0.00 -0.41 0.00 0.00 32.23 32.13 1yhu h LYS 28 CO -0.29 -0.11 -0.19 0.35 -2.27 0.00 0.00 179.45 176.94 1yhu h PHE 29 N -0.18 -0.49 -0.37 1.91 3.57 -0.22 0.68 116.94 121.84 1yhu h PHE 29 Ca 0.16 0.02 0.07 0.00 3.53 0.00 0.00 57.97 61.76 1yhu h PHE 29 Cb 0.43 0.23 -0.07 0.00 2.79 0.00 0.00 35.95 39.33 1yhu h PHE 29 CO -0.41 -0.27 -0.05 0.78 -2.23 0.00 0.00 178.31 176.14 1yhu h GLY 30 N -0.27 0.32 1.06 2.40 0.00 -0.03 0.18 103.07 106.73 1yhu h GLY 30 Ca 0.08 0.08 0.02 0.00 0.00 0.00 0.00 47.33 47.52 1yhu h GLY 30 CO -0.22 -0.12 0.58 -0.55 0.00 0.00 0.00 176.54 176.23 1yhu h ASP 31 N 0.05 0.98 0.23 0.19 3.45 -0.27 -1.65 116.42 119.39 1yhu h ASP 31 Ca 0.18 -0.02 -0.01 0.00 0.43 0.00 0.00 57.03 57.61 1yhu h ASP 31 Cb 0.27 -0.23 0.00 0.00 -0.56 0.00 0.00 39.33 38.81 1yhu h ASP 31 CO -0.35 0.69 -0.11 0.00 -1.57 0.00 0.00 179.24 177.90 1yhu h ALA 32 N 1.47 -0.31 -0.19 3.45 0.00 0.35 -2.06 119.26 121.98 1yhu h ALA 32 Ca 0.34 -0.15 0.05 0.00 0.00 0.00 0.00 54.91 55.15 1yhu h ALA 32 Cb -0.05 0.12 -0.07 0.00 0.00 0.00 0.00 17.79 17.79 1yhu h ALA 32 CO -0.09 -0.56 -0.40 1.25 0.00 0.00 0.00 179.25 179.45 1yhu h LEU 33 N -0.53 -1.27 -1.31 0.00 5.85 -0.30 -2.06 115.31 115.69 1yhu h LEU 33 Ca -0.03 0.18 -0.06 0.00 0.84 0.00 0.00 57.88 58.80 1yhu h LEU 33 Cb 0.39 0.53 -0.01 0.00 0.37 0.00 0.00 40.66 41.94 1yhu h LEU 33 CO 0.05 -0.40 -0.22 -0.50 -0.34 0.00 0.00 178.44 177.03 1yhu h TRP 34 N -0.44 0.20 -0.67 1.25 4.06 -1.35 -0.53 115.95 118.47 1yhu h TRP 34 Ca 0.09 -0.03 0.02 0.00 2.06 0.00 0.00 58.89 61.03 1yhu h TRP 34 Cb 0.60 -0.05 -0.04 0.00 -1.00 0.00 0.00 29.16 28.67 1yhu h TRP 34 CO -0.50 0.40 0.43 -0.09 -3.56 0.00 0.00 178.44 175.12 1yhu h ARG 35 N 0.17 0.83 0.07 0.49 2.43 -0.75 -1.49 114.38 116.13 1yhu h ARG 35 Ca 0.03 -0.05 -0.00 0.00 -0.81 0.00 0.00 59.98 59.15 1yhu h ARG 35 Cb 0.49 -0.19 0.00 0.00 -0.42 0.00 0.00 29.97 29.86 1yhu h ARG 35 CO 0.03 0.55 -0.03 -0.91 -1.51 0.00 0.00 179.97 178.10 1yhu h ASN 36 N 0.86 -0.08 -0.62 -3.80 -0.26 -0.72 -1.64 115.58 109.33 1yhu h ASN 36 Ca 0.26 -0.12 0.13 0.00 -0.56 0.00 0.00 56.30 56.00 1yhu h ASN 36 Cb -0.03 0.02 -0.10 0.00 -1.06 0.00 0.00 38.32 37.14 1yhu h ASN 36 CO -0.08 0.08 -0.00 0.58 -1.06 0.00 0.00 177.43 176.94 1yhu h VAL 37 N -0.23 0.49 0.00 2.81 2.07 -0.64 0.19 116.25 120.94 1yhu h VAL 37 Ca -0.01 -0.04 0.00 0.00 0.82 0.00 0.00 66.70 67.47 1yhu h VAL 37 Cb 0.19 0.37 0.00 0.00 -1.52 0.00 0.00 31.29 30.33 1yhu h VAL 37 CO 0.02 0.02 0.00 0.49 0.02 0.00 0.00 177.57 178.12 1yhu n PHE 38 N -5.28 0.75 -0.03 1.57 0.99 -0.61 -1.85 117.46 113.00 1yhu n PHE 38 Ca 0.09 0.24 -0.10 0.00 -0.00 0.00 0.00 57.45 57.69 1yhu n PHE 38 Cb 0.35 -0.90 -0.14 0.00 -1.00 0.00 0.00 39.48 37.79 1yhu n PHE 38 CO 0.00 0.00 0.00 0.09 -0.00 0.00 0.00 176.76 176.85 1yhu n ASN 39 N -2.14 0.84 0.03 4.37 5.03 -0.28 -1.94 115.26 121.17 1yhu n ASN 39 Ca 0.05 0.34 -0.10 0.00 0.87 0.00 0.00 54.58 55.74 1yhu n ASN 39 Cb 0.35 0.03 0.04 0.00 -1.02 0.00 0.00 39.78 39.18 1yhu n ASN 39 CO 0.00 0.00 0.00 1.88 -1.83 0.00 0.00 177.26 177.31 1yhu h TYR 40 N 0.00 0.64 -2.08 3.10 -1.99 -0.63 -3.38 116.97 112.63 1yhu h TYR 40 Ca -0.33 -0.25 -0.53 0.00 2.00 0.00 0.00 58.73 59.62 1yhu h TYR 40 Cb 2.05 -0.11 -0.35 0.00 2.00 0.00 0.00 36.73 40.31 1yhu h TYR 40 CO 0.00 0.99 -0.94 0.00 -0.00 0.00 0.00 178.16 178.22 1yhu n ALA 41 N -2.52 2.17 0.23 3.88 0.00 -0.77 -4.99 120.51 118.51 1yhu n ALA 41 Ca -0.04 -2.90 0.17 0.00 0.00 0.00 0.00 53.44 50.68 1yhu n ALA 41 Cb 0.65 -0.86 0.78 0.00 0.00 0.00 0.00 19.45 20.03 1yhu n ALA 41 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1yhu h PRO 42 N 5.20 0.00 0.00 0.00 0.13 -1.57 -0.24 132.00 135.52 1yhu h PRO 42 Ca 0.20 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.29 1yhu h PRO 42 Cb 0.93 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.05 1yhu h PRO 42 CO 0.35 0.00 -0.16 -0.91 -0.23 0.00 0.00 178.00 177.05 1yhu h ASN 43 N 0.00 0.00 0.51 1.44 4.21 -1.94 -3.13 115.58 116.66 1yhu h ASN 43 Ca 0.08 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.59 1yhu h ASN 43 Cb 0.84 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.04 1yhu h ASN 43 CO -0.00 0.16 0.00 0.00 -1.29 0.00 0.00 177.43 176.30 1yhu n ALA 44 N -2.15 1.83 -0.08 -0.83 0.00 -0.10 -3.20 120.51 115.99 1yhu n ALA 44 Ca 0.03 -0.07 -0.11 0.00 0.00 0.00 0.00 53.44 53.29 1yhu n ALA 44 Cb 0.55 -1.28 -0.05 0.00 0.00 0.00 0.00 19.45 18.67 1yhu n ALA 44 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 1yhu h ARG 45 N 0.00 0.43 -0.15 0.00 2.43 -1.69 -2.72 114.38 112.68 1yhu h ARG 45 Ca 0.00 -0.15 0.04 0.00 -0.81 0.00 0.00 59.98 59.07 1yhu h ARG 45 Cb 0.25 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.76 1yhu h ARG 45 CO 0.00 0.63 0.36 -0.44 -1.51 0.00 0.00 179.97 179.01 1yhu h ASP 46 N 0.18 0.00 -0.31 -3.80 3.32 -1.79 0.24 116.42 114.27 1yhu h ASP 46 Ca 0.06 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 57.06 1yhu h ASP 46 Cb 0.45 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.98 1yhu h ASP 46 CO 0.02 0.00 0.03 0.40 -1.72 0.00 0.00 179.24 177.97 1yhu h ILE 47 N 0.00 1.21 -0.91 0.35 2.04 -1.68 -3.07 117.51 115.46 1yhu h ILE 47 Ca 0.07 -0.82 -0.45 0.00 1.00 0.00 0.00 64.86 64.67 1yhu h ILE 47 Cb 0.79 0.87 -0.27 0.00 -0.74 0.00 0.00 36.82 37.48 1yhu h ILE 47 CO -0.00 0.29 0.57 0.49 0.00 0.00 0.00 178.15 179.49 1yhu n PHE 48 N -4.27 2.82 0.28 1.37 3.01 0.07 -4.45 117.46 116.29 1yhu n PHE 48 Ca 0.02 -1.68 0.18 0.00 1.01 0.00 0.00 57.45 56.98 1yhu n PHE 48 Cb 0.25 -0.87 0.72 0.00 -0.01 0.00 0.00 39.48 39.56 1yhu n PHE 48 CO 0.00 0.00 0.00 1.05 1.01 0.00 0.00 176.76 178.82 1yhu h GLU 49 N 1.19 0.00 0.00 -1.08 4.11 -1.65 -1.43 114.58 115.73 1yhu h GLU 49 Ca 0.55 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.97 1yhu h GLU 49 Cb 2.70 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 31.94 1yhu h GLU 49 CO 1.00 0.01 -0.06 0.77 0.07 0.00 0.00 179.01 180.80 1yhu h SER 50 N 0.00 0.00 -0.42 3.06 0.02 -1.86 -1.57 113.55 112.78 1yhu h SER 50 Ca -0.00 0.00 -0.27 0.00 -0.84 0.00 0.00 61.79 60.68 1yhu h SER 50 Cb 0.48 0.00 -0.18 0.00 0.14 0.00 0.00 62.40 62.84 1yhu h SER 50 CO 0.00 0.06 -0.28 1.33 -1.14 0.00 0.00 176.83 176.79 1yhu n VAL 51 N -3.57 2.56 -3.72 2.27 0.24 -0.56 -4.97 118.33 110.57 1yhu n VAL 51 Ca -0.02 -3.25 -0.33 0.00 -2.04 0.00 0.00 64.34 58.70 1yhu n VAL 51 Cb 0.17 -0.57 0.04 0.00 -1.47 0.00 0.00 33.84 32.01 1yhu n VAL 51 CO 0.00 0.00 0.00 -3.20 -2.14 0.00 0.00 176.83 171.49 1yhu n ASN 52 N -1.01 -5.06 0.00 -1.34 4.05 -0.59 -2.89 115.26 108.42 1yhu n ASN 52 Ca 0.35 -1.04 0.13 0.00 0.45 0.00 0.00 54.58 54.47 1yhu n ASN 52 Cb 0.92 -3.24 0.66 0.00 1.23 0.00 0.00 39.78 39.34 1yhu n ASN 52 CO 0.00 0.00 0.00 -1.54 -3.05 0.00 0.00 177.26 172.67 1yhu n SER 53 N -2.64 0.00 -0.06 1.20 3.41 -1.04 -2.96 113.62 111.53 1yhu n SER 53 Ca -0.10 -0.14 -0.10 0.00 -0.26 0.00 0.00 58.87 58.27 1yhu n SER 53 Cb 0.59 -0.26 -0.03 0.00 -0.26 0.00 0.00 64.21 64.25 1yhu n SER 53 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 1yhu h LYS 54 N 0.00 0.32 -4.00 4.33 1.79 -1.88 -3.34 116.57 113.79 1yhu h LYS 54 Ca 0.00 -0.03 -0.73 0.00 -2.18 0.00 0.00 60.65 57.71 1yhu h LYS 54 Cb 0.22 -0.06 -0.31 0.00 -1.58 0.00 0.00 32.23 30.50 1yhu h LYS 54 CO 0.00 0.28 -0.29 0.34 -1.08 0.00 0.00 179.45 178.70 1yhu s ASP 55 N -5.50 5.77 0.00 0.86 3.68 -1.15 -4.93 116.67 115.39 1yhu s ASP 55 Ca -0.13 -2.35 0.02 0.00 2.13 0.00 0.00 52.55 52.22 1yhu s ASP 55 Cb 0.08 -2.00 0.12 0.00 -1.45 0.00 0.00 42.92 39.67 1yhu s ASP 55 CO 0.70 -0.57 0.85 0.80 0.13 0.00 0.00 175.17 177.08 1yhu n MET 56 N 4.30 0.04 -0.03 4.34 0.00 -1.26 -0.62 117.12 123.89 1yhu n MET 56 Ca 0.01 0.23 0.03 0.00 -0.00 0.00 0.00 57.70 57.97 1yhu n MET 56 Cb 0.41 -1.50 0.04 0.00 0.00 0.00 0.00 33.22 32.17 1yhu n MET 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1yhu n ALA 57 N -1.25 2.39 -1.77 -5.12 0.00 -1.26 -4.68 120.51 108.82 1yhu n ALA 57 Ca 0.01 -0.69 -0.39 0.00 0.00 0.00 0.00 53.44 52.37 1yhu n ALA 57 Cb 0.02 -0.22 -0.01 0.00 0.00 0.00 0.00 19.45 19.24 1yhu n ALA 57 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1yhu s SER 58 N -0.65 6.39 0.37 0.00 1.04 0.20 -4.82 113.70 116.24 1yhu s SER 58 Ca 0.09 2.50 0.09 0.00 0.48 0.00 0.00 55.95 59.11 1yhu s SER 58 Cb 0.06 -2.63 0.83 0.00 0.10 0.00 0.00 66.02 64.38 1yhu s SER 58 CO 0.08 -0.78 1.92 1.55 0.98 0.00 0.00 173.24 177.00 1yhu h PRO 59 N 2.64 0.64 -0.47 4.02 0.13 -1.95 0.01 132.00 137.01 1yhu h PRO 59 Ca -0.49 -0.04 0.09 0.00 -0.87 0.00 0.00 66.00 64.69 1yhu h PRO 59 Cb 1.24 -0.14 -0.08 0.00 0.13 0.00 0.00 31.00 32.15 1yhu h PRO 59 CO 0.62 0.42 -0.03 0.93 -0.23 0.00 0.00 178.00 179.71 1yhu h GLU 60 N 0.66 0.08 0.09 0.86 3.07 -1.90 0.17 114.58 117.59 1yhu h GLU 60 Ca 0.37 -0.00 -0.28 0.00 -0.50 0.00 0.00 59.36 58.94 1yhu h GLU 60 Cb 0.53 -0.02 0.02 0.00 -0.84 0.00 0.00 28.75 28.44 1yhu h GLU 60 CO -0.14 0.05 -1.17 0.35 -1.40 0.00 0.00 179.01 176.70 1yhu h PHE 61 N 0.08 0.93 -0.73 4.33 3.57 -1.09 -2.68 116.94 121.36 1yhu h PHE 61 Ca 0.23 -0.57 0.04 0.00 3.53 0.00 0.00 57.97 61.21 1yhu h PHE 61 Cb 0.35 -0.08 -0.04 0.00 2.79 0.00 0.00 35.95 38.97 1yhu h PHE 61 CO -0.33 1.41 0.48 0.87 -2.23 0.00 0.00 178.31 178.51 1yhu h LYS 62 N 0.28 0.84 -0.68 1.11 1.57 -0.67 0.20 116.57 119.22 1yhu h LYS 62 Ca -0.16 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.56 1yhu h LYS 62 Cb 1.84 -0.19 -0.03 0.00 0.08 0.00 0.00 32.23 33.93 1yhu h LYS 62 CO 0.22 0.56 0.40 0.00 -0.57 0.00 0.00 179.45 180.05 1yhu h ALA 63 N 1.58 0.87 0.53 3.86 0.00 -0.63 0.13 119.26 125.60 1yhu h ALA 63 Ca 0.29 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 55.09 1yhu h ALA 63 Cb 0.09 -0.27 0.01 0.00 0.00 0.00 0.00 17.79 17.61 1yhu h ALA 63 CO -0.09 0.35 -0.25 1.25 0.00 0.00 0.00 179.25 180.51 1yhu h HIS 64 N 0.93 -0.66 -0.69 0.00 -0.00 -0.70 -1.28 115.15 112.74 1yhu h HIS 64 Ca 0.24 -0.02 0.15 0.00 -0.00 0.00 0.00 60.37 60.75 1yhu h HIS 64 Cb -0.01 0.22 -0.12 0.00 -0.00 0.00 0.00 27.41 27.50 1yhu h HIS 64 CO -0.01 -0.37 -0.00 0.82 -0.00 0.00 0.00 177.93 178.37 1yhu h ILE 65 N -0.81 0.41 -0.41 6.26 2.04 -0.38 0.17 117.51 124.79 1yhu h ILE 65 Ca -0.07 -0.04 0.08 0.00 1.00 0.00 0.00 64.86 65.83 1yhu h ILE 65 Cb 0.59 0.29 -0.08 0.00 -0.74 0.00 0.00 36.82 36.88 1yhu h ILE 65 CO 0.12 0.02 -0.08 0.00 0.00 0.00 0.00 178.15 178.21 1yhu h ALA 66 N 1.64 0.30 -0.04 1.87 0.00 -0.38 0.48 119.26 123.13 1yhu h ALA 66 Ca 0.37 0.15 -0.00 0.00 0.00 0.00 0.00 54.91 55.43 1yhu h ALA 66 Cb 0.62 0.29 -0.00 0.00 0.00 0.00 0.00 17.79 18.70 1yhu h ALA 66 CO -0.61 -0.44 0.02 0.00 0.00 0.00 0.00 179.25 178.22 1yhu h ARG 67 N 0.02 0.06 -0.66 0.00 3.08 0.43 -0.50 114.38 116.82 1yhu h ARG 67 Ca 0.20 -0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.23 1yhu h ARG 67 Cb 0.30 -0.01 -0.03 0.00 0.08 0.00 0.00 29.97 30.31 1yhu h ARG 67 CO -0.40 0.18 0.37 -0.24 -1.07 0.00 0.00 179.97 178.80 1yhu h VAL 68 N -0.07 1.20 -0.77 2.04 3.04 -0.68 1.00 116.25 122.01 1yhu h VAL 68 Ca 0.01 -0.49 -0.02 0.00 -1.01 0.00 0.00 66.70 65.19 1yhu h VAL 68 Cb 0.14 0.34 -0.04 0.00 -2.01 0.00 0.00 31.29 29.72 1yhu h VAL 68 CO -0.00 0.22 0.39 -0.07 -1.01 0.00 0.00 177.57 177.09 1yhu h LEU 69 N 0.89 0.99 -1.13 3.16 3.38 -0.81 0.18 115.31 121.96 1yhu h LEU 69 Ca 0.23 -0.12 0.02 0.00 0.09 0.00 0.00 57.88 58.10 1yhu h LEU 69 Cb 0.02 -0.25 -0.05 0.00 0.09 0.00 0.00 40.66 40.47 1yhu h LEU 69 CO -0.04 0.83 0.59 1.23 0.09 0.00 0.00 178.44 181.14 1yhu h GLY 70 N 1.07 1.26 0.81 0.83 0.00 -0.22 0.29 103.07 107.11 1yhu h GLY 70 Ca 0.27 -0.46 -0.02 0.00 0.00 0.00 0.00 47.33 47.12 1yhu h GLY 70 CO -0.04 0.43 -0.19 -1.33 0.00 0.00 0.00 176.54 175.41 1yhu h GLY 71 N 1.17 -0.55 -0.26 4.60 0.00 0.24 -1.07 103.07 107.20 1yhu h GLY 71 Ca 0.34 0.20 0.18 0.00 0.00 0.00 0.00 47.33 48.05 1yhu h GLY 71 CO -0.08 -0.20 0.13 1.41 0.00 0.00 0.00 176.54 177.80 1yhu h LEU 72 N -0.72 -0.11 0.73 3.11 3.38 0.00 -0.10 115.31 121.61 1yhu h LEU 72 Ca -0.05 0.18 -0.04 0.00 0.09 0.00 0.00 57.88 58.06 1yhu h LEU 72 Cb 0.50 0.26 0.01 0.00 0.09 0.00 0.00 40.66 41.53 1yhu h LEU 72 CO 0.09 -0.11 -0.35 -0.78 0.09 0.00 0.00 178.44 177.37 1yhu h ASP 73 N 0.20 -0.84 -0.45 -0.43 -0.00 -0.28 -1.17 116.42 113.44 1yhu h ASP 73 Ca 0.45 0.01 0.13 0.00 -0.00 0.00 0.00 57.03 57.62 1yhu h ASP 73 Cb 0.82 0.22 -0.02 0.00 -0.00 0.00 0.00 39.33 40.34 1yhu h ASP 73 CO -0.60 -0.48 0.35 0.08 -0.00 0.00 0.00 179.24 178.59 1yhu h ARG 74 N -1.20 0.00 0.04 0.28 0.11 -0.69 0.81 114.38 113.74 1yhu h ARG 74 Ca -0.10 0.00 -0.00 0.00 0.10 0.00 0.00 59.98 59.98 1yhu h ARG 74 Cb 0.77 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.85 1yhu h ARG 74 CO 0.17 0.00 -0.02 0.28 0.10 0.00 0.00 179.97 180.49 1yhu h VAL 75 N 0.00 0.99 -0.31 0.08 2.07 -0.96 -3.14 116.25 114.99 1yhu h VAL 75 Ca 0.22 -1.60 0.06 0.00 0.82 0.00 0.00 66.70 66.19 1yhu h VAL 75 Cb 0.91 1.83 -0.06 0.00 -1.52 0.00 0.00 31.29 32.45 1yhu h VAL 75 CO -0.00 0.32 -0.06 0.40 0.02 0.00 0.00 177.57 178.25 1yhu h ILE 76 N -0.96 0.71 -0.04 4.57 2.04 -0.70 -0.34 117.51 122.79 1yhu h ILE 76 Ca -0.01 -0.01 0.01 0.00 1.00 0.00 0.00 64.86 65.86 1yhu h ILE 76 Cb 0.56 0.69 -0.00 0.00 -0.74 0.00 0.00 36.82 37.33 1yhu h ILE 76 CO 0.01 0.00 0.13 0.77 0.00 0.00 0.00 178.15 179.06 1yhu h SER 77 N 0.02 0.00 -0.34 1.72 4.64 -0.98 0.54 113.55 119.15 1yhu h SER 77 Ca 0.15 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.47 1yhu h SER 77 Cb 0.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.31 1yhu h SER 77 CO -0.30 0.00 0.00 0.23 -0.87 0.00 0.00 176.83 175.89 1yhu n MET 78 N -3.29 2.22 0.14 4.77 2.81 -0.15 -4.39 117.12 119.23 1yhu n MET 78 Ca -0.02 -1.85 0.19 0.00 -1.81 0.00 0.00 57.70 54.22 1yhu n MET 78 Cb 0.21 -1.46 0.78 0.00 -0.71 0.00 0.00 33.22 32.03 1yhu n MET 78 CO 0.00 0.00 0.00 -0.07 1.51 0.00 0.00 175.97 177.41 1yhu h LEU 79 N 3.54 0.00 -3.38 4.03 3.38 -0.69 -0.42 115.31 121.76 1yhu h LEU 79 Ca 0.00 0.00 -0.36 0.00 0.09 0.00 0.00 57.88 57.61 1yhu h LEU 79 Cb 0.78 0.00 -0.20 0.00 0.09 0.00 0.00 40.66 41.33 1yhu h LEU 79 CO 0.00 0.00 0.46 -0.90 0.09 0.00 0.00 178.44 178.09 1yhu n ASP 80 N -3.74 4.06 -2.77 -0.43 3.85 -1.26 -4.46 116.55 111.79 1yhu n ASP 80 Ca 0.05 -3.11 -0.06 0.00 -0.71 0.00 0.00 54.79 50.96 1yhu n ASP 80 Cb 0.50 -0.78 0.02 0.00 -1.35 0.00 0.00 41.12 39.51 1yhu n ASP 80 CO 0.00 0.00 0.00 -3.20 -1.01 0.00 0.00 177.20 172.99 1yhu n ASN 81 N -0.52 -3.26 -0.34 -1.12 4.05 -0.17 -5.02 115.26 108.88 1yhu n ASN 81 Ca 0.40 -3.00 0.05 0.00 0.45 0.00 0.00 54.58 52.48 1yhu n ASN 81 Cb 1.17 1.72 0.12 0.00 1.23 0.00 0.00 39.78 44.03 1yhu n ASN 81 CO 0.00 0.00 0.00 1.56 -3.05 0.00 0.00 177.26 175.77 1yhu h GLN 82 N 4.77 -0.00 0.00 1.20 1.08 -1.78 -0.67 115.11 119.70 1yhu h GLN 82 Ca 0.01 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.21 1yhu h GLN 82 Cb 1.09 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.52 1yhu h GLN 82 CO 0.10 -0.00 0.00 0.00 -0.95 0.00 0.00 178.83 177.97 1yhu n ALA 83 N -3.54 0.00 0.10 3.87 0.00 -1.26 -0.39 120.51 119.29 1yhu n ALA 83 Ca 0.14 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.45 1yhu n ALA 83 Cb 0.47 0.35 -0.08 0.00 0.00 0.00 0.00 19.45 20.19 1yhu n ALA 83 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1yhu h THR 84 N 0.00 0.89 -0.81 0.00 2.02 -1.79 -3.04 112.91 110.18 1yhu h THR 84 Ca 0.00 -0.07 0.13 0.00 0.77 0.00 0.00 66.41 67.23 1yhu h THR 84 Cb 0.00 0.93 -0.14 0.00 -1.74 0.00 0.00 68.15 67.21 1yhu h THR 84 CO 0.00 0.02 -0.38 0.25 0.37 0.00 0.00 175.52 175.78 1yhu h LEU 85 N -0.22 -1.37 -0.17 2.58 5.85 -0.62 0.11 115.31 121.47 1yhu h LEU 85 Ca -0.02 0.28 0.02 0.00 0.84 0.00 0.00 57.88 59.00 1yhu h LEU 85 Cb 0.17 0.69 -0.02 0.00 0.37 0.00 0.00 40.66 41.87 1yhu h LEU 85 CO 0.03 -0.30 0.04 0.44 -0.34 0.00 0.00 178.44 178.32 1yhu h ASP 86 N -0.08 0.03 -0.01 1.25 3.32 -0.70 0.19 116.42 120.42 1yhu h ASP 86 Ca 0.28 0.02 0.02 0.00 0.02 0.00 0.00 57.03 57.37 1yhu h ASP 86 Cb 0.57 0.02 -0.02 0.00 0.22 0.00 0.00 39.33 40.13 1yhu h ASP 86 CO -0.85 0.05 -0.08 0.00 -1.72 0.00 0.00 179.24 176.64 1yhu h ALA 87 N 1.12 -0.07 -0.66 3.45 0.00 -1.06 0.29 119.26 122.32 1yhu h ALA 87 Ca 0.08 0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.95 1yhu h ALA 87 Cb 0.06 0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 1yhu h ALA 87 CO -0.09 -0.56 0.23 0.22 0.00 0.00 0.00 179.25 179.05 1yhu h ASP 88 N -0.12 0.95 -0.71 0.00 3.58 -0.68 0.42 116.42 119.85 1yhu h ASP 88 Ca 0.03 -0.19 -0.02 0.00 0.42 0.00 0.00 57.03 57.27 1yhu h ASP 88 Cb 0.17 -0.25 -0.03 0.00 1.72 0.00 0.00 39.33 40.94 1yhu h ASP 88 CO -0.09 0.89 0.37 -0.07 -2.88 0.00 0.00 179.24 177.45 1yhu h LEU 89 N 0.95 0.90 -0.77 2.28 3.38 -0.31 -0.62 115.31 121.13 1yhu h LEU 89 Ca 0.22 -0.11 0.06 0.00 0.09 0.00 0.00 57.88 58.13 1yhu h LEU 89 Cb 0.26 -0.23 -0.06 0.00 0.09 0.00 0.00 40.66 40.72 1yhu h LEU 89 CO -0.01 0.76 0.46 0.00 0.09 0.00 0.00 178.44 179.73 1yhu h ALA 90 N 1.18 1.04 0.11 1.53 0.00 0.29 -0.26 119.26 123.15 1yhu h ALA 90 Ca 0.25 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.16 1yhu h ALA 90 Cb 0.07 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 1yhu h ALA 90 CO -0.04 0.18 -0.08 1.25 0.00 0.00 0.00 179.25 180.56 1yhu h HIS 91 N 0.84 -0.21 -0.73 0.00 -0.00 0.01 -1.60 115.15 113.45 1yhu h HIS 91 Ca 0.34 -0.00 0.07 0.00 -0.00 0.00 0.00 60.37 60.77 1yhu h HIS 91 Cb 0.17 0.08 -0.05 0.00 -0.00 0.00 0.00 27.41 27.61 1yhu h HIS 91 CO -0.05 -0.13 0.48 -0.07 -0.00 0.00 0.00 177.93 178.16 1yhu h LEU 92 N -0.20 0.67 -0.39 0.26 3.38 -0.49 -1.06 115.31 117.47 1yhu h LEU 92 Ca -0.00 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 1yhu h LEU 92 Cb 0.18 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.77 1yhu h LEU 92 CO -0.00 0.43 0.23 0.50 0.09 0.00 0.00 178.44 179.68 1yhu h LYS 93 N 0.76 0.53 -0.84 1.13 3.64 -0.26 -0.61 116.57 120.91 1yhu h LYS 93 Ca 0.32 -0.05 0.11 0.00 -1.27 0.00 0.00 60.65 59.76 1yhu h LYS 93 Cb 0.27 -0.11 -0.06 0.00 -0.41 0.00 0.00 32.23 31.92 1yhu h LYS 93 CO -0.11 0.41 0.55 0.77 -2.27 0.00 0.00 179.45 178.80 1yhu h SER 94 N 0.51 0.68 0.89 4.20 0.02 -0.30 0.39 113.55 119.94 1yhu h SER 94 Ca 0.14 0.03 -0.12 0.00 -0.84 0.00 0.00 61.79 60.99 1yhu h SER 94 Cb 0.02 -0.11 -0.02 0.00 0.14 0.00 0.00 62.40 62.43 1yhu h SER 94 CO -0.02 0.38 -0.59 1.56 -1.14 0.00 0.00 176.83 177.02 1yhu h GLN 95 N 0.74 0.00 0.00 3.45 4.20 -0.60 -3.35 115.11 119.55 1yhu h GLN 95 Ca 0.40 0.00 -0.27 0.00 0.06 0.00 0.00 58.65 58.84 1yhu h GLN 95 Cb 0.53 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 28.26 1yhu h GLN 95 CO -0.17 0.59 -2.22 0.72 -0.67 0.00 0.00 178.83 177.09 1yhu n HIS 96 N -3.55 0.09 -0.13 2.96 8.25 -0.35 -4.59 115.22 117.90 1yhu n HIS 96 Ca -0.00 0.03 -0.05 0.00 -0.26 0.00 0.00 57.72 57.44 1yhu n HIS 96 Cb 0.66 -0.90 0.02 0.00 1.12 0.00 0.00 29.99 30.89 1yhu n HIS 96 CO 0.00 0.00 0.00 -0.44 0.64 0.00 0.00 176.34 176.54 1yhu h ASP 97 N 0.00 -0.64 0.18 0.41 3.45 -0.39 -0.95 116.42 118.48 1yhu h ASP 97 Ca -0.39 0.16 0.00 0.00 0.43 0.00 0.00 57.03 57.23 1yhu h ASP 97 Cb 1.92 0.36 0.00 0.00 -0.56 0.00 0.00 39.33 41.05 1yhu h ASP 97 CO 0.03 -0.22 0.00 -0.81 -1.57 0.00 0.00 179.24 176.67 1yhu n PRO 98 N -5.38 0.15 0.00 3.56 -0.04 -1.26 -1.64 135.00 130.39 1yhu n PRO 98 Ca 0.03 0.58 0.14 0.00 -0.04 0.00 0.00 63.50 64.21 1yhu n PRO 98 Cb 0.29 -1.92 0.58 0.00 -0.04 0.00 0.00 33.50 32.41 1yhu n PRO 98 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1yhu n ARG 99 N -2.22 0.65 -3.74 0.54 3.00 -0.36 -4.96 116.66 109.56 1yhu n ARG 99 Ca -0.00 -0.24 -0.23 0.00 -0.01 0.00 0.00 57.85 57.37 1yhu n ARG 99 Cb 0.08 -1.50 0.00 0.00 0.00 0.00 0.00 32.46 31.05 1yhu n ARG 99 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.63 177.88 1yhu n THR 100 N -0.97 -3.93 -3.86 0.55 -2.24 -0.65 -4.93 114.28 98.25 1yhu n THR 100 Ca 0.14 -0.05 -0.36 0.00 -2.27 0.00 0.00 64.05 61.51 1yhu n THR 100 Cb 0.29 -3.28 -0.08 0.00 -2.10 0.00 0.00 70.33 65.17 1yhu n THR 100 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1yhu s ILE 101 N -3.01 5.30 -0.10 2.28 1.01 -1.26 -5.04 121.20 120.39 1yhu s ILE 101 Ca 0.01 0.14 -0.29 0.00 0.00 0.00 0.00 60.65 60.51 1yhu s ILE 101 Cb -0.01 -3.37 -0.05 0.00 0.01 0.00 0.00 42.46 39.04 1yhu s ILE 101 CO 0.89 0.52 1.80 -0.62 0.00 0.00 0.00 174.94 177.53 1yhu s ASP 102 N -0.22 6.36 0.53 3.58 3.68 -1.26 -4.83 116.67 124.50 1yhu s ASP 102 Ca 0.10 2.12 0.21 0.00 2.13 0.00 0.00 52.55 57.12 1yhu s ASP 102 Cb -0.12 -2.53 1.15 0.00 -1.45 0.00 0.00 42.92 39.98 1yhu s ASP 102 CO 0.01 -1.20 1.61 1.55 0.13 0.00 0.00 175.17 177.26 1yhu h PRO 103 N 10.92 0.00 -0.46 4.34 0.13 -1.96 0.12 132.00 145.10 1yhu h PRO 103 Ca -0.41 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.71 1yhu h PRO 103 Cb 1.19 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.30 1yhu h PRO 103 CO 0.97 0.00 0.22 0.28 -0.23 0.00 0.00 178.00 179.23 1yhu h VAL 104 N 0.00 1.16 -0.73 1.56 2.07 -1.93 -0.69 116.25 117.69 1yhu h VAL 104 Ca 0.00 -0.44 0.08 0.00 0.82 0.00 0.00 66.70 67.15 1yhu h VAL 104 Cb 0.72 0.58 -0.05 0.00 -1.52 0.00 0.00 31.29 31.03 1yhu h VAL 104 CO 0.00 0.18 0.48 0.78 0.02 0.00 0.00 177.57 179.03 1yhu h ASN 105 N 0.64 0.63 0.57 0.57 -0.26 -1.12 0.20 115.58 116.81 1yhu h ASN 105 Ca 0.16 0.01 0.00 0.00 -0.56 0.00 0.00 56.30 55.91 1yhu h ASN 105 Cb 0.07 -0.13 0.00 0.00 -1.06 0.00 0.00 38.32 37.20 1yhu h ASN 105 CO -0.02 0.40 0.00 -0.26 -1.06 0.00 0.00 177.43 176.49 1yhu h PHE 106 N 0.71 0.00 0.10 1.19 -1.00 -1.28 -0.34 116.94 116.33 1yhu h PHE 106 Ca 0.32 0.00 -0.14 0.00 2.81 0.00 0.00 57.97 60.96 1yhu h PHE 106 Cb 0.34 0.00 0.02 0.00 3.61 0.00 0.00 35.95 39.91 1yhu h PHE 106 CO -0.00 0.00 -0.62 0.28 -1.61 0.00 0.00 178.31 176.36 1yhu h VAL 107 N 0.00 1.57 -0.41 -0.55 2.07 -0.59 -2.41 116.25 115.92 1yhu h VAL 107 Ca 0.00 -2.47 0.08 0.00 0.82 0.00 0.00 66.70 65.13 1yhu h VAL 107 Cb 0.28 3.21 -0.07 0.00 -1.52 0.00 0.00 31.29 33.20 1yhu h VAL 107 CO 0.00 0.69 -0.03 0.58 0.02 0.00 0.00 177.57 178.83 1yhu h VAL 108 N -0.50 0.66 0.02 2.57 2.07 -0.79 -0.61 116.25 119.67 1yhu h VAL 108 Ca -0.11 -0.03 0.03 0.00 0.82 0.00 0.00 66.70 67.42 1yhu h VAL 108 Cb 1.48 0.58 -0.05 0.00 -1.52 0.00 0.00 31.29 31.77 1yhu h VAL 108 CO 0.12 0.01 -0.42 0.15 0.02 0.00 0.00 177.57 177.45 1yhu h PHE 109 N 0.07 -1.18 -0.74 1.57 3.57 -1.13 0.11 116.94 119.22 1yhu h PHE 109 Ca 0.20 0.04 0.16 0.00 3.53 0.00 0.00 57.97 61.90 1yhu h PHE 109 Cb 0.30 0.51 -0.13 0.00 2.79 0.00 0.00 35.95 39.42 1yhu h PHE 109 CO -0.30 -0.50 -0.02 -0.09 -2.23 0.00 0.00 178.31 175.17 1yhu h ARG 110 N -0.58 0.08 0.49 1.11 2.43 -0.66 0.71 114.38 117.95 1yhu h ARG 110 Ca 0.04 -0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.19 1yhu h ARG 110 Cb 0.65 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 30.18 1yhu h ARG 110 CO -0.30 0.06 -0.38 0.87 -1.51 0.00 0.00 179.97 178.71 1yhu h LYS 111 N 0.09 -0.80 -0.93 0.20 1.79 -0.17 -0.35 116.57 116.40 1yhu h LYS 111 Ca 0.40 0.05 0.21 0.00 -2.18 0.00 0.00 60.65 59.13 1yhu h LYS 111 Cb 0.68 0.18 -0.12 0.00 -1.58 0.00 0.00 32.23 31.40 1yhu h LYS 111 CO -0.67 -0.53 0.49 0.00 -1.08 0.00 0.00 179.45 177.66 1yhu h ALA 112 N -1.24 1.53 -0.05 3.86 0.00 0.83 0.54 119.26 124.73 1yhu h ALA 112 Ca -0.06 0.12 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 1yhu h ALA 112 Cb 0.69 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.52 1yhu h ALA 112 CO 0.01 -0.22 0.03 1.25 0.00 0.00 0.00 179.25 180.32 1yhu h LEU 113 N 0.56 0.07 -0.29 0.00 5.85 0.72 -0.35 115.31 121.86 1yhu h LEU 113 Ca 0.56 -0.07 0.06 0.00 0.84 0.00 0.00 57.88 59.27 1yhu h LEU 113 Cb 0.99 -0.02 -0.07 0.00 0.37 0.00 0.00 40.66 41.94 1yhu h LEU 113 CO -0.46 0.12 -0.15 0.40 -0.34 0.00 0.00 178.44 178.02 1yhu h ILE 114 N 0.01 0.55 0.11 4.05 2.04 0.80 0.30 117.51 125.36 1yhu h ILE 114 Ca 0.02 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.88 1yhu h ILE 114 Cb 0.07 0.55 -0.03 0.00 -0.74 0.00 0.00 36.82 36.67 1yhu h ILE 114 CO -0.00 0.00 -0.31 0.00 0.00 0.00 0.00 178.15 177.84 1yhu h ALA 115 N 1.10 -0.85 -0.64 1.87 0.00 -0.79 0.38 119.26 120.33 1yhu h ALA 115 Ca 0.15 -0.07 0.12 0.00 0.00 0.00 0.00 54.91 55.10 1yhu h ALA 115 Cb 0.34 0.68 -0.09 0.00 0.00 0.00 0.00 17.79 18.73 1yhu h ALA 115 CO -0.36 -0.91 0.20 1.15 0.00 0.00 0.00 179.25 179.33 1yhu h THR 116 N -0.47 0.67 -0.10 0.00 2.02 -0.50 0.42 112.91 114.96 1yhu h THR 116 Ca -0.01 -0.12 -0.06 0.00 0.77 0.00 0.00 66.41 67.00 1yhu h THR 116 Cb 0.46 0.30 -0.00 0.00 -1.74 0.00 0.00 68.15 67.17 1yhu h THR 116 CO -0.15 0.06 -0.16 0.58 0.37 0.00 0.00 175.52 176.23 1yhu h VAL 117 N 0.34 1.39 -0.37 3.16 2.07 -0.29 -2.20 116.25 120.35 1yhu h VAL 117 Ca 0.34 -1.41 -0.03 0.00 0.82 0.00 0.00 66.70 66.42 1yhu h VAL 117 Cb 0.49 2.08 -0.02 0.00 -1.52 0.00 0.00 31.29 32.33 1yhu h VAL 117 CO -0.38 0.40 0.12 0.00 0.02 0.00 0.00 177.57 177.74 1yhu h ALA 118 N 0.53 0.48 -0.32 1.67 0.00 -0.76 0.91 119.26 121.77 1yhu h ALA 118 Ca 0.01 -0.16 0.09 0.00 0.00 0.00 0.00 54.91 54.86 1yhu h ALA 118 Cb 0.73 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 1yhu h ALA 118 CO 0.04 0.11 0.24 0.78 0.00 0.00 0.00 179.25 180.42 1yhu h GLY 119 N 0.45 0.00 0.29 0.00 0.00 -0.17 -0.12 103.07 103.51 1yhu h GLY 119 Ca 0.12 0.00 -0.37 0.00 0.00 0.00 0.00 47.33 47.08 1yhu h GLY 119 CO -0.01 0.00 -2.23 2.41 0.00 0.00 0.00 176.54 176.71 1yhu n THR 120 N -4.34 1.56 0.05 4.70 -1.04 -0.83 -4.58 114.28 109.80 1yhu n THR 120 Ca 0.05 -0.69 -0.18 0.00 -2.04 0.00 0.00 64.05 61.19 1yhu n THR 120 Cb 0.41 -1.22 -0.09 0.00 -1.82 0.00 0.00 70.33 67.62 1yhu n THR 120 CO 0.00 0.00 0.00 0.15 -0.64 0.00 0.00 175.07 174.58 1yhu h PHE 121 N 0.02 0.89 0.00 -1.42 3.04 0.13 -3.48 116.94 116.13 1yhu h PHE 121 Ca -0.49 -0.49 0.00 0.00 3.98 0.00 0.00 57.97 60.96 1yhu h PHE 121 Cb 2.03 -0.10 0.00 0.00 2.56 0.00 0.00 35.95 40.44 1yhu h PHE 121 CO 0.03 1.32 0.00 0.41 -2.02 0.00 0.00 178.31 178.06 1yhu n GLY 122 N 1.06 2.22 0.08 2.40 0.00 -0.10 -4.74 105.19 106.10 1yhu n GLY 122 Ca -0.10 -2.15 0.04 0.00 0.00 0.00 0.00 46.02 43.81 1yhu n GLY 122 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1yhu n VAL 123 N -0.68 1.22 0.29 1.61 0.24 -1.26 -1.34 118.33 118.41 1yhu n VAL 123 Ca 0.00 0.61 0.15 0.00 -2.04 0.00 0.00 64.34 63.07 1yhu n VAL 123 Cb 0.00 -1.61 0.53 0.00 -1.47 0.00 0.00 33.84 31.28 1yhu n VAL 123 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1yhu n PHE 125 N -2.98 1.19 -3.04 0.00 -0.00 -0.45 -4.86 117.46 107.33 1yhu n PHE 125 Ca 0.02 0.98 -0.45 0.00 -0.00 0.00 0.00 57.45 58.01 1yhu n PHE 125 Cb 0.36 -2.19 -0.02 0.00 -0.00 0.00 0.00 39.48 37.63 1yhu n PHE 125 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.76 177.10 1yhu s ASP 126 N 1.21 6.72 0.16 -2.13 -1.08 -1.26 -4.92 116.67 115.36 1yhu s ASP 126 Ca 0.95 -2.32 -0.24 0.00 -0.52 0.00 0.00 52.55 50.41 1yhu s ASP 126 Cb -1.28 -2.35 0.03 0.00 -1.46 0.00 0.00 42.92 37.87 1yhu s ASP 126 CO 0.63 -0.90 1.60 0.58 0.52 0.00 0.00 175.17 177.61 1yhu h VAL 127 N 5.42 0.23 -0.31 1.11 2.07 -1.97 -1.36 116.25 121.44 1yhu h VAL 127 Ca 0.16 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.69 1yhu h VAL 127 Cb 1.01 0.23 -0.02 0.00 -1.52 0.00 0.00 31.29 31.00 1yhu h VAL 127 CO 1.03 0.00 0.19 1.55 0.02 0.00 0.00 177.57 180.36 1yhu h PRO 128 N -0.30 0.38 -0.93 1.57 0.13 -2.00 -0.69 132.00 130.16 1yhu h PRO 128 Ca 0.15 -0.02 0.08 0.00 -0.87 0.00 0.00 66.00 65.33 1yhu h PRO 128 Cb 0.55 -0.09 -0.06 0.00 0.13 0.00 0.00 31.00 31.53 1yhu h PRO 128 CO -0.49 0.25 0.60 0.00 -0.23 0.00 0.00 178.00 178.13 1yhu h ALA 129 N 1.13 1.52 -0.04 -0.56 0.00 -1.80 0.05 119.26 119.56 1yhu h ALA 129 Ca 0.12 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 1yhu h ALA 129 Cb -0.02 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.51 1yhu h ALA 129 CO -0.04 0.32 -0.03 -1.49 0.00 0.00 0.00 179.25 178.01 1yhu h TRP 130 N 1.02 0.10 -0.72 0.00 4.06 -0.81 -1.82 115.95 117.77 1yhu h TRP 130 Ca 0.41 -0.03 0.05 0.00 2.06 0.00 0.00 58.89 61.38 1yhu h TRP 130 Cb 0.27 -0.02 -0.05 0.00 -1.00 0.00 0.00 29.16 28.35 1yhu h TRP 130 CO -0.00 0.51 0.44 1.96 -3.56 0.00 0.00 178.44 177.79 1yhu h GLN 131 N -0.35 0.80 0.93 0.49 4.20 -0.72 0.44 115.11 120.90 1yhu h GLN 131 Ca 0.01 -0.05 -0.05 0.00 0.06 0.00 0.00 58.65 58.62 1yhu h GLN 131 Cb 0.49 -0.18 0.01 0.00 0.30 0.00 0.00 27.48 28.10 1yhu h GLN 131 CO 0.01 0.53 -0.45 0.78 -0.67 0.00 0.00 178.83 179.03 1yhu h GLY 132 N 0.82 -1.31 2.00 3.46 0.00 -0.95 -1.94 103.07 105.15 1yhu h GLY 132 Ca 0.31 0.49 -0.05 0.00 0.00 0.00 0.00 47.33 48.08 1yhu h GLY 132 CO -0.15 -0.48 -0.22 0.00 0.00 0.00 0.00 176.54 175.70 1yhu h TYR 134 N 0.00 1.18 -0.59 0.00 3.20 0.02 -2.65 116.97 118.13 1yhu h TYR 134 Ca -0.00 -0.15 -0.03 0.00 3.14 0.00 0.00 58.73 61.68 1yhu h TYR 134 Cb 0.52 -0.33 -0.03 0.00 1.54 0.00 0.00 36.73 38.43 1yhu h TYR 134 CO 0.00 0.97 0.23 -0.91 -1.64 0.00 0.00 178.16 176.82 1yhu h ASN 135 N 1.05 0.79 -0.86 -2.11 2.35 -0.51 -0.13 115.58 116.16 1yhu h ASN 135 Ca 0.21 -0.10 0.12 0.00 -0.55 0.00 0.00 56.30 55.98 1yhu h ASN 135 Cb 0.41 -0.20 -0.06 0.00 0.05 0.00 0.00 38.32 38.51 1yhu h ASN 135 CO 0.01 0.71 0.56 0.40 -1.65 0.00 0.00 177.43 177.45 1yhu h ILE 136 N 0.85 0.89 -0.00 2.81 1.08 -1.13 0.56 117.51 122.56 1yhu h ILE 136 Ca 0.20 -0.25 -0.02 0.00 -0.39 0.00 0.00 64.86 64.40 1yhu h ILE 136 Cb 0.17 0.09 0.00 0.00 -3.07 0.00 0.00 36.82 34.02 1yhu h ILE 136 CO -0.02 0.13 -0.07 0.40 -0.69 0.00 0.00 178.15 177.90 1yhu h ILE 137 N 0.73 1.60 -0.61 -0.67 2.04 -1.16 -2.29 117.51 117.14 1yhu h ILE 137 Ca 0.42 -1.86 0.07 0.00 1.00 0.00 0.00 64.86 64.48 1yhu h ILE 137 Cb 0.59 2.83 -0.06 0.00 -0.74 0.00 0.00 36.82 39.45 1yhu h ILE 137 CO -0.18 0.49 0.30 0.00 0.00 0.00 0.00 178.15 178.76 1yhu h ALA 138 N 0.23 0.80 0.39 1.87 0.00 -0.32 -0.22 119.26 122.02 1yhu h ALA 138 Ca -0.01 0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 1yhu h ALA 138 Cb 0.84 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.55 1yhu h ALA 138 CO 0.01 -0.07 -0.43 -0.22 0.00 0.00 0.00 179.25 178.55 1yhu h LYS 139 N 0.55 -0.82 -0.80 0.00 1.63 0.04 0.13 116.57 117.31 1yhu h LYS 139 Ca 0.28 0.06 0.19 0.00 -0.85 0.00 0.00 60.65 60.33 1yhu h LYS 139 Cb 0.24 0.19 -0.05 0.00 -0.60 0.00 0.00 32.23 32.01 1yhu h LYS 139 CO -0.22 -0.54 0.54 0.78 -3.45 0.00 0.00 179.45 176.56 1yhu h GLY 140 N -0.85 0.55 1.47 5.01 0.00 -0.83 0.41 103.07 108.83 1yhu h GLY 140 Ca -0.03 -0.13 -0.26 0.00 0.00 0.00 0.00 47.33 46.91 1yhu h GLY 140 CO -0.09 0.02 -1.37 -2.22 0.00 0.00 0.00 176.54 172.88 1yhu h ILE 141 N 0.28 1.28 -1.07 2.60 2.04 -0.36 -3.40 117.51 118.88 1yhu h ILE 141 Ca 0.40 -3.04 -0.37 0.00 1.00 0.00 0.00 64.86 62.85 1yhu h ILE 141 Cb 1.13 2.66 -0.39 0.00 -0.74 0.00 0.00 36.82 39.48 1yhu h ILE 141 CO -0.10 0.75 -1.15 0.35 0.00 0.00 0.00 178.15 178.00 1yhu n THR 142 N -3.24 0.79 0.00 -0.27 -2.24 0.38 -4.29 114.28 105.41 1yhu n THR 142 Ca -0.09 -3.15 0.00 0.00 -2.27 0.00 0.00 64.05 58.54 1yhu n THR 142 Cb 1.00 0.58 0.00 0.00 -2.10 0.00 0.00 70.33 69.81 1yhu n THR 142 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1yhu n GLY 143 N -0.04 0.00 0.00 3.38 0.00 0.14 -4.81 105.19 103.86 1yhu n GLY 143 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.12 1yhu n GLY 143 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1yhu n SER 144 N 0.00 0.00 0.00 1.61 2.88 -1.26 -5.06 113.62 111.79 1yhu n SER 144 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1yhu n SER 144 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 1yhu n SER 144 CO 0.00 0.00 0.00 -0.90 -1.23 0.00 0.00 175.04 172.91 1yhu n ASP 145 N 0.00 0.00 0.00 -3.46 5.75 -1.26 -4.76 116.55 112.82 1yhu n ASP 145 Ca 0.00 0.74 0.00 0.00 -0.01 0.00 0.00 54.79 55.52 1yhu n ASP 145 Cb 0.00 -0.24 0.00 0.00 -1.03 0.00 0.00 41.12 39.85 1yhu n ASP 145 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1yhu n ALA 146 N -1.23 0.67 -1.58 2.12 0.00 -1.26 -5.11 120.51 114.11 1yhu n ALA 146 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.40 1yhu n ALA 146 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1yhu n ALA 146 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50