#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yi2 n SER 11 N 0.00 0.21 0.28 2.89 7.64 -1.26 -3.85 113.62 119.52 1yi2 n SER 11 Ca 0.00 -2.00 0.15 0.00 1.01 0.00 0.00 58.87 58.02 1yi2 n SER 11 Cb 0.00 -0.08 0.79 0.00 -1.01 0.00 0.00 64.21 63.90 1yi2 n SER 11 CO 0.00 0.00 0.00 1.23 -3.01 0.00 0.00 175.04 173.26 1yi2 h GLY 12 N 5.83 0.00 2.00 0.23 0.00 -1.94 -1.02 103.07 108.17 1yi2 h GLY 12 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1yi2 h GLY 12 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 176.54 176.61 1yi2 h ARG 13 N 0.00 0.00 -0.01 4.80 0.11 -2.04 -2.62 114.38 114.63 1yi2 h ARG 13 Ca -0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 1yi2 h ARG 13 Cb 0.31 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.39 1yi2 h ARG 13 CO 0.01 0.00 -0.08 1.19 0.10 0.00 0.00 179.97 181.19 1yi2 n PHE 14 N -2.57 0.00 -3.05 4.08 0.99 -0.39 -5.02 117.46 111.50 1yi2 n PHE 14 Ca 0.01 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.46 1yi2 n PHE 14 Cb 0.24 -0.12 0.00 0.00 -1.00 0.00 0.00 39.48 38.60 1yi2 n PHE 14 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1yi2 n GLY 15 N 1.22 2.07 0.98 1.37 0.00 -0.99 -1.65 105.19 108.19 1yi2 n GLY 15 Ca 0.17 -0.38 0.03 0.00 0.00 0.00 0.00 46.02 45.84 1yi2 n GLY 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yi2 n ALA 16 N 6.85 2.96 -2.62 4.61 0.00 -1.26 -4.94 120.51 126.12 1yi2 n ALA 16 Ca 0.00 -0.73 -0.25 0.00 0.00 0.00 0.00 53.44 52.46 1yi2 n ALA 16 Cb 0.00 -1.04 -0.01 0.00 0.00 0.00 0.00 19.45 18.40 1yi2 n ALA 16 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1yi2 s ARG 17 N -1.69 3.50 0.00 0.00 0.52 -0.66 -4.63 118.95 115.99 1yi2 s ARG 17 Ca 0.22 -0.26 0.00 0.00 -0.52 0.00 0.00 55.73 55.16 1yi2 s ARG 17 Cb 0.16 -2.64 0.00 0.00 0.52 0.00 0.00 34.95 32.98 1yi2 s ARG 17 CO 0.08 0.13 0.00 0.66 0.02 0.00 0.00 175.30 176.19 1yi2 n TYR 18 N -1.72 0.00 0.00 -0.53 0.53 -1.26 -4.85 117.16 109.33 1yi2 n TYR 18 Ca -0.04 0.00 0.00 0.00 -1.02 0.00 0.00 57.90 56.84 1yi2 n TYR 18 Cb 0.56 -0.07 0.00 0.00 -1.03 0.00 0.00 39.34 38.79 1yi2 n TYR 18 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 1yi2 n GLY 19 N -1.53 -0.10 0.00 2.72 0.00 -1.26 -4.56 105.19 100.45 1yi2 n GLY 19 Ca 0.00 -1.79 0.00 0.00 0.00 0.00 0.00 46.02 44.23 1yi2 n GLY 19 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1yi2 n ARG 20 N 0.02 0.00 -0.31 1.61 1.74 -1.26 -2.86 116.66 115.59 1yi2 n ARG 20 Ca 0.00 0.25 0.01 0.00 -0.77 0.00 0.00 57.85 57.34 1yi2 n ARG 20 Cb 0.00 -1.15 0.05 0.00 -1.02 0.00 0.00 32.46 30.34 1yi2 n ARG 20 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 1yi2 n VAL 21 N -1.09 -0.41 0.25 1.55 0.31 -1.26 -0.19 118.33 117.48 1yi2 n VAL 21 Ca 0.00 1.92 -0.13 0.00 -0.01 0.00 0.00 64.34 66.12 1yi2 n VAL 21 Cb 0.00 -2.56 -0.07 0.00 -0.91 0.00 0.00 33.84 30.30 1yi2 n VAL 21 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 1yi2 h SER 22 N 0.00 -0.88 0.80 4.52 0.02 -1.80 -0.54 113.55 115.66 1yi2 h SER 22 Ca 0.31 0.06 0.00 0.00 -0.84 0.00 0.00 61.79 61.32 1yi2 h SER 22 Cb 0.52 0.27 0.00 0.00 0.14 0.00 0.00 62.40 63.33 1yi2 h SER 22 CO -0.82 -0.48 0.00 -2.11 -1.14 0.00 0.00 176.83 172.28 1yi2 n ARG 23 N -4.43 0.09 0.02 3.45 1.85 -0.88 -1.97 116.66 114.78 1yi2 n ARG 23 Ca -0.09 0.24 -0.18 0.00 -1.00 0.00 0.00 57.85 56.81 1yi2 n ARG 23 Cb 0.32 -1.64 -0.12 0.00 -1.05 0.00 0.00 32.46 29.97 1yi2 n ARG 23 CO 0.00 0.00 0.00 -0.09 -0.01 0.00 0.00 177.63 177.53 1yi2 h ARG 24 N 0.00 0.35 0.00 2.89 2.43 -0.37 -2.45 114.38 117.23 1yi2 h ARG 24 Ca 0.00 -0.45 -0.05 0.00 -0.81 0.00 0.00 59.98 58.67 1yi2 h ARG 24 Cb 0.40 0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 30.09 1yi2 h ARG 24 CO 0.00 1.15 -0.24 0.00 -1.51 0.00 0.00 179.97 179.37 1yi2 h ARG 25 N -0.24 0.00 0.01 0.20 3.08 -0.85 -1.43 114.38 115.15 1yi2 h ARG 25 Ca -0.10 0.00 -0.19 0.00 0.07 0.00 0.00 59.98 59.76 1yi2 h ARG 25 Cb 1.42 0.00 0.02 0.00 0.08 0.00 0.00 29.97 31.48 1yi2 h ARG 25 CO 0.13 0.24 -0.77 0.28 -1.07 0.00 0.00 179.97 178.77 1yi2 h VAL 26 N 0.00 1.38 0.14 2.04 2.07 -1.43 -1.51 116.25 118.94 1yi2 h VAL 26 Ca -0.00 -2.17 -0.00 0.00 0.82 0.00 0.00 66.70 65.35 1yi2 h VAL 26 Cb 0.70 2.57 -0.00 0.00 -1.52 0.00 0.00 31.29 33.04 1yi2 h VAL 26 CO 0.03 0.64 -0.08 0.00 0.02 0.00 0.00 177.57 178.18 1yi2 h ALA 27 N 0.33 -0.20 0.40 1.67 0.00 -1.21 -0.37 119.26 119.88 1yi2 h ALA 27 Ca -0.10 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.75 1yi2 h ALA 27 Cb 1.47 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 19.35 1yi2 h ALA 27 CO 0.15 -0.62 -0.30 0.93 0.00 0.00 0.00 179.25 179.41 1yi2 h GLU 28 N -0.21 -0.65 -0.60 0.00 5.08 -1.32 0.40 114.58 117.28 1yi2 h GLU 28 Ca -0.01 0.04 0.12 0.00 -1.00 0.00 0.00 59.36 58.51 1yi2 h GLU 28 Cb 0.17 0.15 -0.11 0.00 0.50 0.00 0.00 28.75 29.46 1yi2 h GLU 28 CO 0.02 -0.43 -0.09 0.82 -1.00 0.00 0.00 179.01 178.33 1yi2 h ILE 29 N -0.68 0.44 -0.13 3.13 2.04 -1.28 0.37 117.51 121.41 1yi2 h ILE 29 Ca -0.05 -0.01 -0.09 0.00 1.00 0.00 0.00 64.86 65.70 1yi2 h ILE 29 Cb 0.56 0.40 -0.01 0.00 -0.74 0.00 0.00 36.82 37.02 1yi2 h ILE 29 CO 0.02 0.01 -0.33 -0.33 0.00 0.00 0.00 178.15 177.51 1yi2 h GLU 30 N 0.04 0.26 0.45 2.37 5.08 -0.96 -1.04 114.58 120.78 1yi2 h GLU 30 Ca 0.30 -0.10 -0.02 0.00 -1.00 0.00 0.00 59.36 58.53 1yi2 h GLU 30 Cb 0.47 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.71 1yi2 h GLU 30 CO -0.57 0.57 -0.21 1.03 -1.00 0.00 0.00 179.01 178.82 1yi2 h SER 31 N 0.23 -0.51 -0.28 1.42 0.87 0.19 -0.34 113.55 115.13 1yi2 h SER 31 Ca 0.03 0.02 -0.06 0.00 -1.23 0.00 0.00 61.79 60.55 1yi2 h SER 31 Cb 0.70 0.13 -0.02 0.00 -0.44 0.00 0.00 62.40 62.77 1yi2 h SER 31 CO 0.05 -0.36 -0.00 -0.08 -0.53 0.00 0.00 176.83 175.91 1yi2 h GLU 32 N -0.60 0.61 -0.59 2.24 4.81 -1.24 -2.25 114.58 117.56 1yi2 h GLU 32 Ca -0.06 -0.14 -0.01 0.00 -0.13 0.00 0.00 59.36 59.02 1yi2 h GLU 32 Cb 0.46 -0.08 -0.03 0.00 0.63 0.00 0.00 28.75 29.73 1yi2 h GLU 32 CO 0.10 0.63 0.33 1.98 -0.73 0.00 0.00 179.01 181.33 1yi2 h MET 33 N 0.58 0.81 0.00 1.92 4.05 -0.80 -2.83 114.93 118.66 1yi2 h MET 33 Ca 0.12 -0.08 0.00 0.00 -0.28 0.00 0.00 59.70 59.46 1yi2 h MET 33 Cb 0.37 -0.17 0.00 0.00 -0.80 0.00 0.00 31.60 31.00 1yi2 h MET 33 CO 0.01 0.59 -0.52 0.09 0.23 0.00 0.00 176.91 177.30 1yi2 n ASN 34 N -4.40 0.69 -4.41 1.39 3.02 -0.17 -4.75 115.26 106.63 1yi2 n ASN 34 Ca 0.06 0.17 -0.33 0.00 -0.03 0.00 0.00 54.58 54.45 1yi2 n ASN 34 Cb 0.09 0.03 0.14 0.00 -0.61 0.00 0.00 39.78 39.42 1yi2 n ASN 34 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1yi2 n GLU 35 N -2.09 -0.59 -2.29 3.52 1.02 -0.89 -4.90 120.64 114.42 1yi2 n GLU 35 Ca 0.04 -0.13 -0.41 0.00 -0.02 0.00 0.00 57.16 56.64 1yi2 n GLU 35 Cb 0.43 -1.88 -0.03 0.00 -0.02 0.00 0.00 31.44 29.94 1yi2 n GLU 35 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1yi2 s ASP 36 N -2.04 7.01 -0.01 1.62 1.01 -1.26 -4.97 116.67 118.03 1yi2 s ASP 36 Ca 0.58 2.47 0.06 0.00 0.71 0.00 0.00 52.55 56.37 1yi2 s ASP 36 Cb -0.20 -2.64 -0.02 0.00 1.01 0.00 0.00 42.92 41.08 1yi2 s ASP 36 CO 0.66 -0.35 -0.21 -1.00 0.21 0.00 0.00 175.17 174.49 1yi2 s HIS 37 N -1.03 1.85 -0.35 4.23 3.76 -1.26 -5.00 115.29 117.49 1yi2 s HIS 37 Ca 0.47 -0.35 -0.29 0.00 -0.15 0.00 0.00 55.06 54.74 1yi2 s HIS 37 Cb -0.36 -1.18 0.01 0.00 1.11 0.00 0.00 32.58 32.16 1yi2 s HIS 37 CO 0.46 -0.02 1.27 0.00 -0.85 0.00 0.00 174.74 175.60 1yi2 s ALA 38 N -0.51 3.28 0.22 -1.40 0.00 -1.26 -1.96 121.76 120.13 1yi2 s ALA 38 Ca 0.08 -0.06 -0.32 0.00 0.00 0.00 0.00 51.96 51.66 1yi2 s ALA 38 Cb -0.08 -3.82 -0.13 0.00 0.00 0.00 0.00 23.12 19.09 1yi2 s ALA 38 CO -0.01 -1.95 1.55 0.00 0.00 0.00 0.00 175.76 175.36 1yi2 h PRO 40 N 5.25 0.98 0.00 0.00 0.11 -1.94 -3.33 132.00 133.08 1yi2 h PRO 40 Ca -0.45 -0.19 0.00 0.00 0.11 0.00 0.00 66.00 65.47 1yi2 h PRO 40 Cb 1.25 -0.15 0.00 0.00 0.11 0.00 0.00 31.00 32.20 1yi2 h PRO 40 CO 0.84 0.84 0.00 -1.71 -0.21 0.00 0.00 178.00 177.76 1yi2 n ASN 41 N -4.27 0.00 -0.84 -2.05 5.15 -1.26 -4.83 115.26 107.16 1yi2 n ASN 41 Ca 0.05 0.47 0.00 0.00 -0.60 0.00 0.00 54.58 54.50 1yi2 n ASN 41 Cb 0.21 -0.03 0.00 0.00 -0.53 0.00 0.00 39.78 39.44 1yi2 n ASN 41 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1yi2 n GLY 43 N 4.89 -1.27 3.74 0.00 0.00 -1.25 -4.67 105.19 106.63 1yi2 n GLY 43 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 1yi2 n GLY 43 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1yi2 s GLU 44 N -0.03 4.42 -1.18 1.61 2.56 -1.26 -4.47 118.70 120.35 1yi2 s GLU 44 Ca 0.00 2.04 -0.18 0.00 0.00 0.00 0.00 54.97 56.83 1yi2 s GLU 44 Cb 0.00 -3.18 -0.04 0.00 2.00 0.00 0.00 34.13 32.91 1yi2 s GLU 44 CO 0.00 -0.18 2.08 -0.25 -0.56 0.00 0.00 175.26 176.35 1yi2 n ASP 45 N 2.17 3.40 -1.77 -1.70 8.00 -1.26 -0.88 116.55 124.50 1yi2 n ASP 45 Ca 0.04 -2.78 0.01 0.00 0.71 0.00 0.00 54.79 52.77 1yi2 n ASP 45 Cb 0.43 -1.46 0.06 0.00 -0.02 0.00 0.00 41.12 40.12 1yi2 n ASP 45 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1yi2 n ARG 46 N 6.64 1.07 -3.59 -1.24 1.74 -0.83 -4.49 116.66 115.96 1yi2 n ARG 46 Ca 0.51 -2.83 -0.36 0.00 -0.77 0.00 0.00 57.85 54.40 1yi2 n ARG 46 Cb 0.40 -0.91 -0.08 0.00 -1.02 0.00 0.00 32.46 30.85 1yi2 n ARG 46 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1yi2 s VAL 47 N -1.99 5.32 0.09 1.55 1.01 -1.02 -0.10 120.40 125.26 1yi2 s VAL 47 Ca 0.34 0.39 0.07 0.00 0.00 0.00 0.00 61.98 62.78 1yi2 s VAL 47 Cb 0.37 -3.57 -0.03 0.00 0.00 0.00 0.00 36.38 33.14 1yi2 s VAL 47 CO -0.10 0.36 -0.18 -1.81 0.00 0.00 0.00 175.10 173.36 1yi2 s ASP 48 N 0.75 2.22 0.13 3.32 1.01 0.24 -4.01 116.67 120.34 1yi2 s ASP 48 Ca 0.12 -0.66 -0.30 0.00 0.71 0.00 0.00 52.55 52.42 1yi2 s ASP 48 Cb -0.13 -0.11 -0.07 0.00 1.01 0.00 0.00 42.92 43.62 1yi2 s ASP 48 CO 0.04 0.01 1.22 -0.60 0.21 0.00 0.00 175.17 176.05 1yi2 s ARG 49 N -1.83 4.45 -0.06 8.23 3.52 -1.26 -1.29 118.95 130.71 1yi2 s ARG 49 Ca 0.03 1.87 0.20 0.00 -0.13 0.00 0.00 55.73 57.70 1yi2 s ARG 49 Cb -0.10 -3.28 -0.31 0.00 -1.56 0.00 0.00 34.95 29.71 1yi2 s ARG 49 CO 0.03 -0.19 0.38 1.04 -0.81 0.00 0.00 175.30 175.75 1yi2 n GLN 50 N 3.18 0.67 -3.13 5.12 1.13 0.15 -4.93 117.38 119.57 1yi2 n GLN 50 Ca 0.07 -0.15 0.00 0.00 -1.94 0.00 0.00 57.00 54.97 1yi2 n GLN 50 Cb 0.45 -1.49 0.00 0.00 0.11 0.00 0.00 30.24 29.30 1yi2 n GLN 50 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1yi2 n GLY 51 N 1.42 -0.85 3.59 1.08 0.00 -1.21 -4.97 105.19 104.25 1yi2 n GLY 51 Ca -0.09 -0.74 -0.42 0.00 0.00 0.00 0.00 46.02 44.76 1yi2 n GLY 51 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1yi2 s THR 52 N -3.00 3.32 0.00 2.61 2.01 -1.26 -2.49 115.64 116.83 1yi2 s THR 52 Ca 0.00 0.31 0.00 0.00 0.31 0.00 0.00 61.69 62.31 1yi2 s THR 52 Cb 0.00 -3.47 0.00 0.00 0.01 0.00 0.00 72.50 69.04 1yi2 s THR 52 CO 0.00 -0.33 0.00 0.61 -0.69 0.00 0.00 174.62 174.21 1yi2 n GLY 53 N 5.56 1.78 3.68 4.40 0.00 -1.23 -4.98 105.19 114.42 1yi2 n GLY 53 Ca 0.25 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.92 1yi2 n GLY 53 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1yi2 s ILE 54 N -3.45 5.05 0.12 -0.61 1.01 -1.04 -1.46 121.20 120.83 1yi2 s ILE 54 Ca 0.00 0.06 0.07 0.00 0.00 0.00 0.00 60.65 60.78 1yi2 s ILE 54 Cb 0.00 -3.28 -0.04 0.00 0.01 0.00 0.00 42.46 39.15 1yi2 s ILE 54 CO 0.00 0.46 -0.18 0.26 0.00 0.00 0.00 174.94 175.49 1yi2 s TRP 55 N 0.28 1.63 -0.20 3.97 0.52 0.67 0.33 118.94 126.14 1yi2 s TRP 55 Ca 0.06 -0.47 -0.18 0.00 0.02 0.00 0.00 56.10 55.53 1yi2 s TRP 55 Cb -0.12 -0.86 0.05 0.00 -1.15 0.00 0.00 33.47 31.39 1yi2 s TRP 55 CO -0.01 0.21 0.54 -1.14 0.02 0.00 0.00 176.95 176.57 1yi2 s GLN 56 N -2.31 0.62 -0.23 4.98 0.74 -0.41 0.23 119.66 123.28 1yi2 s GLN 56 Ca 0.09 0.77 -0.24 0.00 0.05 0.00 0.00 55.36 56.03 1yi2 s GLN 56 Cb -0.08 0.28 -0.01 0.00 1.10 0.00 0.00 33.01 34.30 1yi2 s GLN 56 CO 0.04 -0.08 0.78 0.00 -0.55 0.00 0.00 175.29 175.48 1yi2 n SER 58 N 5.74 0.32 0.00 0.00 3.41 0.86 -0.53 113.62 123.41 1yi2 n SER 58 Ca 0.04 0.57 0.00 0.00 -0.26 0.00 0.00 58.87 59.22 1yi2 n SER 58 Cb 0.48 -0.64 0.00 0.00 -0.26 0.00 0.00 64.21 63.79 1yi2 n SER 58 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1yi2 n TYR 59 N -1.85 0.00 1.32 7.33 9.36 -1.26 -4.57 117.16 127.49 1yi2 n TYR 59 Ca 0.03 0.00 0.13 0.00 3.32 0.00 0.00 57.90 61.38 1yi2 n TYR 59 Cb 0.22 -0.33 0.42 0.00 -0.63 0.00 0.00 39.34 39.02 1yi2 n TYR 59 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1yi2 n ASP 61 N -0.44 -2.27 -4.68 0.00 8.00 0.31 -4.98 116.55 112.49 1yi2 n ASP 61 Ca 0.14 0.00 -0.46 0.00 0.71 0.00 0.00 54.79 55.18 1yi2 n ASP 61 Cb 0.35 -0.78 -0.04 0.00 -0.02 0.00 0.00 41.12 40.63 1yi2 n ASP 61 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1yi2 n TYR 62 N -2.55 2.33 -4.53 1.24 9.36 -1.24 -4.62 117.16 117.15 1yi2 n TYR 62 Ca 0.00 0.13 -0.33 0.00 3.32 0.00 0.00 57.90 61.02 1yi2 n TYR 62 Cb 0.05 -2.60 -0.15 0.00 -0.63 0.00 0.00 39.34 36.01 1yi2 n TYR 62 CO 0.00 0.00 0.00 0.21 0.22 0.00 0.00 176.86 177.29 1yi2 s LYS 63 N 2.15 3.20 0.22 2.98 2.20 -1.26 -0.41 119.74 128.82 1yi2 s LYS 63 Ca 0.84 -0.76 -0.12 0.00 -0.36 0.00 0.00 55.97 55.57 1yi2 s LYS 63 Cb -0.66 -2.61 -0.00 0.00 -1.51 0.00 0.00 37.83 33.04 1yi2 s LYS 63 CO 0.42 0.01 0.44 -0.59 -0.36 0.00 0.00 175.35 175.27 1yi2 s PHE 64 N 0.82 0.32 0.12 4.03 -0.12 0.14 -4.99 117.98 118.29 1yi2 s PHE 64 Ca -0.05 -0.67 -0.17 0.00 -0.05 0.00 0.00 56.93 55.98 1yi2 s PHE 64 Cb -0.15 0.15 -0.07 0.00 -0.63 0.00 0.00 43.02 42.32 1yi2 s PHE 64 CO -0.00 -0.92 0.58 0.95 -0.05 0.00 0.00 175.22 175.78 1yi2 s THR 65 N -3.99 4.76 0.10 -4.49 -4.23 -1.26 -0.23 115.64 106.30 1yi2 s THR 65 Ca 0.20 1.08 -0.02 0.00 -1.18 0.00 0.00 61.69 61.77 1yi2 s THR 65 Cb 0.00 -3.83 0.01 0.00 1.34 0.00 0.00 72.50 70.02 1yi2 s THR 65 CO 0.06 0.40 0.18 0.61 -0.54 0.00 0.00 174.62 175.32 1yi2 n GLY 66 N 1.26 2.21 3.25 3.99 0.00 -0.53 -4.92 105.19 110.45 1yi2 n GLY 66 Ca -0.08 -1.24 -0.28 0.00 0.00 0.00 0.00 46.02 44.43 1yi2 n GLY 66 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1yi2 n GLY 67 N -0.15 -2.75 0.25 -0.02 0.00 0.22 -4.56 105.19 98.18 1yi2 n GLY 67 Ca -0.01 -1.10 -0.10 0.00 0.00 0.00 0.00 46.02 44.80 1yi2 n GLY 67 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1yi2 h SER 68 N -2.74 0.83 0.00 1.61 0.02 -1.93 -3.32 113.55 108.02 1yi2 h SER 68 Ca -0.47 -0.37 0.00 0.00 -0.84 0.00 0.00 61.79 60.11 1yi2 h SER 68 Cb 1.22 -0.23 0.00 0.00 0.14 0.00 0.00 62.40 63.53 1yi2 h SER 68 CO 0.33 1.12 0.00 -1.22 -1.14 0.00 0.00 176.83 175.91 1yi2 n TYR 69 N -4.05 0.00 -4.60 3.45 4.02 -1.26 -3.50 117.16 111.23 1yi2 n TYR 69 Ca -0.02 0.00 -0.26 0.00 -0.01 0.00 0.00 57.90 57.61 1yi2 n TYR 69 Cb 0.53 0.00 -0.14 0.00 -0.02 0.00 0.00 39.34 39.71 1yi2 n TYR 69 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 176.86 176.00 1yi2 s LYS 70 N -0.74 1.41 0.37 -0.72 1.02 -1.26 -3.94 119.74 115.88 1yi2 s LYS 70 Ca 0.00 -1.04 0.19 0.00 0.02 0.00 0.00 55.97 55.14 1yi2 s LYS 70 Cb 0.00 -1.59 0.64 0.00 -0.52 0.00 0.00 37.83 36.36 1yi2 s LYS 70 CO 0.00 0.40 1.71 -1.00 -0.92 0.00 0.00 175.35 175.54 1yi2 h PRO 71 N 4.63 0.00 -5.17 -1.68 0.13 -1.92 0.62 132.00 128.62 1yi2 h PRO 71 Ca -0.45 0.00 -0.54 0.00 -0.87 0.00 0.00 66.00 64.14 1yi2 h PRO 71 Cb 1.16 0.00 -0.31 0.00 0.13 0.00 0.00 31.00 31.98 1yi2 h PRO 71 CO 0.43 0.37 -0.83 -1.21 -0.23 0.00 0.00 178.00 176.52 1yi2 s GLU 72 N -3.53 1.69 0.10 0.86 2.02 -1.26 -3.03 118.70 115.54 1yi2 s GLU 72 Ca 0.01 -0.56 0.07 0.00 0.02 0.00 0.00 54.97 54.51 1yi2 s GLU 72 Cb 0.10 -1.47 -0.04 0.00 0.10 0.00 0.00 34.13 32.83 1yi2 s GLU 72 CO 0.69 0.21 -0.11 0.95 0.02 0.00 0.00 175.26 177.02 1yi2 s THR 73 N 0.10 3.32 0.45 3.63 -4.23 -1.26 -4.76 115.64 112.89 1yi2 s THR 73 Ca -0.05 -1.26 0.25 0.00 -1.18 0.00 0.00 61.69 59.46 1yi2 s THR 73 Cb -0.11 -2.54 0.45 0.00 1.34 0.00 0.00 72.50 71.63 1yi2 s THR 73 CO 0.02 0.14 1.79 -0.65 -0.54 0.00 0.00 174.62 175.38 1yi2 h PRO 74 N 3.71 0.24 -0.04 3.99 0.11 -2.01 0.53 132.00 138.54 1yi2 h PRO 74 Ca -0.49 -0.01 -0.18 0.00 0.11 0.00 0.00 66.00 65.43 1yi2 h PRO 74 Cb 1.17 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 32.21 1yi2 h PRO 74 CO 0.52 0.16 -0.75 0.78 -0.21 0.00 0.00 178.00 178.49 1yi2 h GLY 75 N 0.25 0.27 1.26 -0.55 0.00 -2.00 -3.08 103.07 99.21 1yi2 h GLY 75 Ca 0.57 -0.40 -0.15 0.00 0.00 0.00 0.00 47.33 47.35 1yi2 h GLY 75 CO -0.19 0.36 -0.38 -1.33 0.00 0.00 0.00 176.54 175.00 1yi2 h GLY 76 N 1.62 0.89 2.00 4.60 0.00 -0.37 -2.78 103.07 109.02 1yi2 h GLY 76 Ca -0.03 -0.89 0.00 0.00 0.00 0.00 0.00 47.33 46.41 1yi2 h GLY 76 CO 0.12 0.81 0.00 0.50 0.00 0.00 0.00 176.54 177.97 1yi2 h LYS 77 N 0.67 0.00 0.11 4.80 1.57 -1.25 -2.49 116.57 119.98 1yi2 h LYS 77 Ca 0.06 0.00 -0.27 0.00 -1.87 0.00 0.00 60.65 58.57 1yi2 h LYS 77 Cb 0.94 0.00 0.01 0.00 0.08 0.00 0.00 32.23 33.26 1yi2 h LYS 77 CO 0.09 0.00 -1.18 1.15 -0.57 0.00 0.00 179.45 178.94 1yi2 h THR 78 N 0.00 1.45 -0.18 -0.16 2.02 -1.40 -3.32 112.91 111.32 1yi2 h THR 78 Ca 0.00 -2.85 0.03 0.00 0.77 0.00 0.00 66.41 64.36 1yi2 h THR 78 Cb 0.34 2.81 -0.03 0.00 -1.74 0.00 0.00 68.15 69.53 1yi2 h THR 78 CO 0.00 0.84 -0.01 0.58 0.37 0.00 0.00 175.52 177.30 1yi2 h VAL 79 N 0.13 0.86 -0.90 3.16 2.07 -1.40 -2.62 116.25 117.55 1yi2 h VAL 79 Ca -0.13 -0.02 0.11 0.00 0.82 0.00 0.00 66.70 67.49 1yi2 h VAL 79 Cb 1.88 0.81 -0.13 0.00 -1.52 0.00 0.00 31.29 32.33 1yi2 h VAL 79 CO 0.20 0.01 -0.47 0.03 0.02 0.00 0.00 177.57 177.35 1yi2 h ARG 80 N 0.05 -0.05 0.00 1.57 3.08 -1.65 -3.33 114.38 114.05 1yi2 h ARG 80 Ca 0.09 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.14 1yi2 h ARG 80 Cb 0.11 0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.17 1yi2 h ARG 80 CO -0.15 -0.04 0.00 0.54 -1.07 0.00 0.00 179.97 179.25 1yi2 n ARG 81 N -5.38 0.00 0.00 0.04 1.74 -0.99 -5.17 116.66 106.90 1yi2 n ARG 81 Ca 0.05 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.13 1yi2 n ARG 81 Cb 0.34 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.78 1yi2 n ARG 81 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98