#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yu0 n SER 2 N 0.00 1.71 -3.82 1.61 2.88 -1.26 -1.97 113.62 112.77 2yu0 n SER 2 Ca 0.00 0.16 -0.31 0.00 -1.33 0.00 0.00 58.87 57.40 2yu0 n SER 2 Cb 0.00 -1.25 -0.06 0.00 -0.75 0.00 0.00 64.21 62.15 2yu0 n SER 2 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2yu0 n SER 3 N 11.27 -0.99 -4.29 -3.46 3.41 -1.26 -4.82 113.62 113.48 2yu0 n SER 3 Ca 0.46 -0.95 -0.45 0.00 -0.26 0.00 0.00 58.87 57.67 2yu0 n SER 3 Cb 0.25 -1.21 -0.03 0.00 -0.26 0.00 0.00 64.21 62.96 2yu0 n SER 3 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2yu0 s GLY 4 N -2.95 2.70 0.57 5.00 0.00 -0.83 -5.06 107.32 106.75 2yu0 s GLY 4 Ca 0.52 -3.37 -0.19 0.00 0.00 0.00 0.00 44.72 41.68 2yu0 s GLY 4 CO 0.77 1.24 1.16 -0.56 0.00 0.00 0.00 173.10 175.71 2yu0 s SER 5 N 1.83 5.46 -1.75 1.64 0.01 -1.26 -3.06 113.70 116.57 2yu0 s SER 5 Ca 0.19 2.25 -0.20 0.00 1.31 0.00 0.00 55.95 59.50 2yu0 s SER 5 Cb -0.11 -2.59 0.19 0.00 0.21 0.00 0.00 66.02 63.71 2yu0 s SER 5 CO -0.08 -1.40 0.72 -1.54 0.41 0.00 0.00 173.24 171.35 2yu0 n SER 6 N -1.48 -2.84 -2.34 2.44 3.41 -1.26 -4.80 113.62 106.74 2yu0 n SER 6 Ca 0.12 -1.07 -0.23 0.00 -0.26 0.00 0.00 58.87 57.44 2yu0 n SER 6 Cb 0.50 -2.36 -0.08 0.00 -0.26 0.00 0.00 64.21 62.01 2yu0 n SER 6 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2yu0 n GLY 7 N -1.26 4.01 3.61 5.00 0.00 -1.17 -4.91 105.19 110.47 2yu0 n GLY 7 Ca 0.09 -1.68 -0.34 0.00 0.00 0.00 0.00 46.02 44.09 2yu0 n GLY 7 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2yu0 s ILE 8 N -1.49 4.45 0.01 -0.61 1.09 -1.26 -5.02 121.20 118.38 2yu0 s ILE 8 Ca 0.59 -0.16 -0.05 0.00 -1.10 0.00 0.00 60.65 59.93 2yu0 s ILE 8 Cb 0.36 -2.96 -0.01 0.00 -1.06 0.00 0.00 42.46 38.79 2yu0 s ILE 8 CO -0.16 0.51 0.08 0.54 -0.10 0.00 0.00 174.94 175.81 2yu0 s VAL 9 N 0.05 0.10 0.51 2.92 0.11 -1.26 -5.01 120.40 117.81 2yu0 s VAL 9 Ca 0.03 -0.83 0.34 0.00 -2.93 0.00 0.00 61.98 58.60 2yu0 s VAL 9 Cb -0.13 -0.48 0.54 0.00 -1.53 0.00 0.00 36.38 34.79 2yu0 s VAL 9 CO 0.02 -0.46 1.75 -0.07 -3.33 0.00 0.00 175.10 173.01 2yu0 h LEU 10 N 4.25 0.11 -0.61 2.54 3.38 -1.99 0.89 115.31 123.89 2yu0 h LEU 10 Ca -0.31 0.03 -0.15 0.00 0.09 0.00 0.00 57.88 57.54 2yu0 h LEU 10 Cb 1.20 0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.95 2yu0 h LEU 10 CO 0.43 -0.00 -0.50 0.25 0.09 0.00 0.00 178.44 178.70 2yu0 h LEU 11 N 0.09 0.54 -1.05 1.67 6.46 -1.93 -3.01 115.31 118.06 2yu0 h LEU 11 Ca 0.64 -0.27 0.13 0.00 -0.12 0.00 0.00 57.88 58.26 2yu0 h LEU 11 Cb 2.33 -0.15 -0.02 0.00 -0.73 0.00 0.00 40.66 42.09 2yu0 h LEU 11 CO -0.10 0.95 0.88 -0.09 -0.62 0.00 0.00 178.44 179.45 2yu0 h ARG 12 N 0.39 0.00 -1.00 1.25 2.43 0.44 0.13 114.38 118.01 2yu0 h ARG 12 Ca 0.02 0.00 0.29 0.00 -0.81 0.00 0.00 59.98 59.48 2yu0 h ARG 12 Cb 1.02 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 30.53 2yu0 h ARG 12 CO 0.09 0.00 0.74 0.78 -1.51 0.00 0.00 179.97 180.07 2yu0 h GLY 13 N 0.00 0.00 0.46 2.80 0.00 -1.63 0.33 103.07 105.03 2yu0 h GLY 13 Ca 0.21 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.54 2yu0 h GLY 13 CO -0.00 0.00 -0.02 1.41 0.00 0.00 0.00 176.54 177.93 2yu0 h LEU 14 N 0.00 0.03 -0.99 3.11 3.38 -1.02 -3.22 115.31 116.61 2yu0 h LEU 14 Ca 0.47 -0.56 -0.10 0.00 0.09 0.00 0.00 57.88 57.78 2yu0 h LEU 14 Cb 1.95 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 42.67 2yu0 h LEU 14 CO -0.00 0.59 -0.47 -0.33 0.09 0.00 0.00 178.44 178.31 2yu0 h GLU 15 N -0.52 0.00 0.01 1.13 5.08 -1.24 -3.24 114.58 115.80 2yu0 h GLU 15 Ca 0.00 0.00 0.03 0.00 -1.00 0.00 0.00 59.36 58.39 2yu0 h GLU 15 Cb 0.58 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.78 2yu0 h GLU 15 CO 0.00 0.47 -0.42 0.00 -1.00 0.00 0.00 179.01 178.07 2yu0 s ILE 17 N -5.90 2.84 0.66 0.00 -4.36 -1.22 -5.00 121.20 108.22 2yu0 s ILE 17 Ca -0.16 0.47 -0.15 0.00 -0.26 0.00 0.00 60.65 60.55 2yu0 s ILE 17 Cb 0.08 -3.10 -0.00 0.00 1.25 0.00 0.00 42.46 40.69 2yu0 s ILE 17 CO 0.64 -0.16 1.11 0.21 0.24 0.00 0.00 174.94 176.97 2yu0 s ASN 18 N -1.94 5.12 0.41 4.36 3.84 -1.26 -4.78 114.94 120.68 2yu0 s ASN 18 Ca 0.73 2.00 0.17 0.00 0.21 0.00 0.00 52.86 55.98 2yu0 s ASN 18 Cb -0.26 -2.55 1.08 0.00 -0.55 0.00 0.00 41.25 38.96 2yu0 s ASN 18 CO 0.36 -1.63 1.83 0.11 -2.79 0.00 0.00 177.10 174.98 2yu0 h LYS 19 N 0.05 0.41 0.09 0.43 1.79 -1.93 -0.80 116.57 116.60 2yu0 h LYS 19 Ca -0.47 -0.02 0.02 0.00 -2.18 0.00 0.00 60.65 58.00 2yu0 h LYS 19 Cb 1.25 -0.09 -0.04 0.00 -1.58 0.00 0.00 32.23 31.76 2yu0 h LYS 19 CO 0.54 0.27 -0.34 1.25 -1.08 0.00 0.00 179.45 180.10 2yu0 h HIS 20 N 0.42 -0.92 -0.27 -1.35 2.76 -2.02 -2.16 115.15 111.61 2yu0 h HIS 20 Ca 0.51 0.02 -0.10 0.00 -2.20 0.00 0.00 60.37 58.60 2yu0 h HIS 20 Cb 1.27 0.39 -0.01 0.00 1.55 0.00 0.00 27.41 30.61 2yu0 h HIS 20 CO -0.00 -0.44 -0.27 1.88 -1.30 0.00 0.00 177.93 177.80 2yu0 h TYR 21 N -0.54 0.60 -0.96 5.26 0.05 -1.64 -2.97 116.97 116.76 2yu0 h TYR 21 Ca 0.04 -0.13 0.18 0.00 0.05 0.00 0.00 58.73 58.87 2yu0 h TYR 21 Cb 0.59 -0.14 -0.11 0.00 1.01 0.00 0.00 36.73 38.08 2yu0 h TYR 21 CO -0.31 0.75 0.55 0.35 -1.05 0.00 0.00 178.16 178.45 2yu0 h PHE 22 N 0.46 0.97 -0.53 4.88 3.57 -0.58 -0.49 116.94 125.22 2yu0 h PHE 22 Ca 0.06 0.03 0.08 0.00 3.53 0.00 0.00 57.97 61.68 2yu0 h PHE 22 Cb 0.71 -0.28 -0.06 0.00 2.79 0.00 0.00 35.95 39.10 2yu0 h PHE 22 CO 0.03 0.20 0.17 1.03 -2.23 0.00 0.00 178.31 177.51 2yu0 h SER 23 N 0.70 0.15 -0.11 0.41 0.87 -1.25 -2.04 113.55 112.29 2yu0 h SER 23 Ca 0.55 0.07 0.00 0.00 -1.23 0.00 0.00 61.79 61.19 2yu0 h SER 23 Cb 0.85 0.07 -0.01 0.00 -0.44 0.00 0.00 62.40 62.87 2yu0 h SER 23 CO -0.39 0.11 0.06 -0.07 -0.53 0.00 0.00 176.83 176.01 2yu0 h LEU 24 N 0.34 0.10 -0.67 2.23 4.07 -1.22 -2.66 115.31 117.49 2yu0 h LEU 24 Ca 0.26 0.00 0.13 0.00 0.08 0.00 0.00 57.88 58.36 2yu0 h LEU 24 Cb 0.31 -0.02 -0.10 0.00 1.08 0.00 0.00 40.66 41.94 2yu0 h LEU 24 CO -0.28 0.07 0.17 0.15 -1.08 0.00 0.00 178.44 177.47 2yu0 h PHE 25 N 0.13 0.26 0.00 1.13 3.57 -1.03 0.40 116.94 121.40 2yu0 h PHE 25 Ca 0.04 0.04 -0.00 0.00 3.53 0.00 0.00 57.97 61.58 2yu0 h PHE 25 Cb -0.00 -0.01 -0.00 0.00 2.79 0.00 0.00 35.95 38.72 2yu0 h PHE 25 CO -0.08 -0.04 -0.02 0.87 -2.23 0.00 0.00 178.31 176.81 2yu0 h LYS 26 N 0.29 0.00 -0.09 1.11 1.57 -1.06 -1.00 116.57 117.39 2yu0 h LYS 26 Ca 0.36 0.00 -0.23 0.00 -1.87 0.00 0.00 60.65 58.92 2yu0 h LYS 26 Cb 0.57 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.90 2yu0 h LYS 26 CO -0.44 0.02 -0.84 1.03 -0.57 0.00 0.00 179.45 178.65 2yu0 h SER 27 N 0.00 0.89 1.05 0.86 0.87 0.07 0.36 113.55 117.65 2yu0 h SER 27 Ca -0.00 -0.68 -0.08 0.00 -1.23 0.00 0.00 61.79 59.80 2yu0 h SER 27 Cb 0.05 -0.27 -0.01 0.00 -0.44 0.00 0.00 62.40 61.73 2yu0 h SER 27 CO 0.00 1.43 -0.40 -0.07 -0.53 0.00 0.00 176.83 177.26 2yu0 h LEU 28 N 0.42 0.00 0.00 2.23 3.38 -0.71 -3.12 115.31 117.51 2yu0 h LEU 28 Ca -0.08 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.88 2yu0 h LEU 28 Cb 1.48 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.23 2yu0 h LEU 28 CO 0.17 0.40 -1.47 0.18 0.09 0.00 0.00 178.44 177.82 2yu0 n LEU 29 N -3.42 0.47 -0.35 1.67 7.99 -0.45 -4.29 117.00 118.61 2yu0 n LEU 29 Ca 0.00 0.18 0.32 0.00 -0.01 0.00 0.00 56.01 56.51 2yu0 n LEU 29 Cb 0.57 -0.03 0.59 0.00 -0.11 0.00 0.00 43.42 44.45 2yu0 n LEU 29 CO 0.38 -0.09 1.10 0.00 -1.51 0.00 0.00 177.39 177.27 2yu0 h ALA 30 N 1.98 2.26 -0.03 -1.18 0.00 -0.21 0.66 119.26 122.74 2yu0 h ALA 30 Ca -0.01 0.23 -0.02 0.00 0.00 0.00 0.00 54.91 55.11 2yu0 h ALA 30 Cb 1.02 0.28 -0.00 0.00 0.00 0.00 0.00 17.79 19.09 2yu0 h ALA 30 CO 0.00 -1.00 -0.05 0.07 0.00 0.00 0.00 179.25 178.27 2yu0 h ARG 31 N 0.06 0.09 0.49 0.00 -0.00 -1.76 0.23 114.38 113.49 2yu0 h ARG 31 Ca 0.83 -0.06 -0.02 0.00 -0.00 0.00 0.00 59.98 60.73 2yu0 h ARG 31 Cb 2.26 0.01 0.00 0.00 -0.00 0.00 0.00 29.97 32.24 2yu0 h ARG 31 CO -0.68 0.62 -0.24 -0.44 -0.00 0.00 0.00 179.97 179.23 2yu0 h ASP 32 N -0.43 -0.56 0.22 0.08 5.19 -0.37 -3.00 116.42 117.55 2yu0 h ASP 32 Ca 0.00 0.02 0.00 0.00 -0.62 0.00 0.00 57.03 56.43 2yu0 h ASP 32 Cb 0.61 0.14 0.00 0.00 0.18 0.00 0.00 39.33 40.27 2yu0 h ASP 32 CO 0.01 -0.29 0.00 0.18 -3.12 0.00 0.00 179.24 176.02 2yu0 n LEU 33 N -4.39 0.00 -3.77 1.55 4.77 0.18 -4.86 117.00 110.49 2yu0 n LEU 33 Ca -0.08 0.26 -0.23 0.00 -0.03 0.00 0.00 56.01 55.92 2yu0 n LEU 33 Cb 0.26 -0.26 0.02 0.00 -2.33 0.00 0.00 43.42 41.12 2yu0 n LEU 33 CO 0.20 -0.15 -0.07 0.59 -1.33 0.00 0.00 177.39 176.63 2yu0 n ASN 34 N -1.26 -1.54 -4.67 -1.43 3.02 0.33 -4.96 115.26 104.75 2yu0 n ASN 34 Ca 0.06 -0.84 -0.29 0.00 -0.03 0.00 0.00 54.58 53.48 2yu0 n ASN 34 Cb 0.10 -3.88 0.15 0.00 -0.61 0.00 0.00 39.78 35.54 2yu0 n ASN 34 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2yu0 s LEU 35 N -6.81 1.87 -0.60 3.41 1.43 0.55 -4.99 118.68 113.53 2yu0 s LEU 35 Ca 0.10 0.94 -0.18 0.00 -1.03 0.00 0.00 54.13 53.96 2yu0 s LEU 35 Cb -0.05 -3.19 0.11 0.00 0.03 0.00 0.00 46.19 43.09 2yu0 s LEU 35 CO 0.83 -2.78 0.69 -1.61 0.23 0.00 0.00 176.35 173.71 2yu0 s GLU 36 N -5.26 3.07 0.60 1.70 2.02 -1.26 -4.89 118.70 114.69 2yu0 s GLU 36 Ca 0.65 -1.43 0.29 0.00 0.02 0.00 0.00 54.97 54.50 2yu0 s GLU 36 Cb -0.15 -4.30 1.02 0.00 0.10 0.00 0.00 34.13 30.81 2yu0 s GLU 36 CO 0.54 -1.51 1.36 0.00 0.02 0.00 0.00 175.26 175.67 2yu0 h ARG 37 N 9.09 0.00 0.04 1.61 2.47 -1.94 1.98 114.38 127.63 2yu0 h ARG 37 Ca -0.27 0.00 -0.34 0.00 -1.26 0.00 0.00 59.98 58.12 2yu0 h ARG 37 Cb 1.09 0.00 -0.04 0.00 -1.65 0.00 0.00 29.97 29.36 2yu0 h ARG 37 CO 1.08 0.00 -1.97 -0.25 0.56 0.00 0.00 179.97 179.39 2yu0 n ASP 38 N -3.34 1.25 -2.40 7.04 8.00 -1.26 -4.33 116.55 121.51 2yu0 n ASP 38 Ca 0.24 0.24 -0.31 0.00 0.71 0.00 0.00 54.79 55.68 2yu0 n ASP 38 Cb 1.53 -0.20 0.03 0.00 -0.02 0.00 0.00 41.12 42.47 2yu0 n ASP 38 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 2yu0 n ASN 39 N -3.16 6.02 0.11 -2.24 5.15 0.64 -4.62 115.26 117.16 2yu0 n ASN 39 Ca -0.27 -3.77 0.08 0.00 -0.60 0.00 0.00 54.58 50.02 2yu0 n ASN 39 Cb 1.06 -0.67 0.01 0.00 -0.53 0.00 0.00 39.78 39.66 2yu0 n ASN 39 CO 0.00 0.00 0.00 1.56 1.40 0.00 0.00 177.26 180.22 2yu0 h GLN 40 N 2.42 0.00 -0.01 1.20 4.20 -0.81 -3.36 115.11 118.74 2yu0 h GLN 40 Ca 0.44 0.00 -0.04 0.00 0.06 0.00 0.00 58.65 59.12 2yu0 h GLN 40 Cb 0.89 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.68 2yu0 h GLN 40 CO 1.11 0.13 -0.13 1.49 -0.67 0.00 0.00 178.83 180.76 2yu0 h GLU 41 N 0.00 0.11 -1.25 1.46 4.81 -1.86 -3.20 114.58 114.66 2yu0 h GLU 41 Ca -0.04 -0.10 0.36 0.00 -0.13 0.00 0.00 59.36 59.45 2yu0 h GLU 41 Cb 1.19 0.03 -0.05 0.00 0.63 0.00 0.00 28.75 30.55 2yu0 h GLU 41 CO 0.02 0.82 0.95 -0.56 -0.73 0.00 0.00 179.01 179.51 2yu0 h GLN 42 N -0.56 0.00 -7.08 1.92 3.07 -1.92 -3.40 115.11 107.14 2yu0 h GLN 42 Ca -0.01 0.00 -0.47 0.00 0.09 0.00 0.00 58.65 58.25 2yu0 h GLN 42 Cb 0.86 0.00 0.03 0.00 0.08 0.00 0.00 27.48 28.45 2yu0 h GLN 42 CO 0.03 0.00 0.39 0.71 0.09 0.00 0.00 178.83 180.04 2yu0 s TYR 43 N -4.86 2.98 0.24 0.06 2.02 -1.21 -5.07 117.35 111.51 2yu0 s TYR 43 Ca -0.05 1.57 0.04 0.00 -0.37 0.00 0.00 57.07 58.26 2yu0 s TYR 43 Cb 0.22 -3.07 -0.05 0.00 -0.40 0.00 0.00 41.96 38.66 2yu0 s TYR 43 CO 0.77 -0.89 -0.00 0.95 -1.57 0.00 0.00 175.55 174.82 2yu0 s THR 44 N -2.00 1.05 0.61 -0.71 -4.23 -1.26 -4.99 115.64 104.10 2yu0 s THR 44 Ca 0.67 -2.03 0.27 0.00 -1.18 0.00 0.00 61.69 59.42 2yu0 s THR 44 Cb -0.17 -2.37 0.37 0.00 1.34 0.00 0.00 72.50 71.67 2yu0 s THR 44 CO 0.21 -0.30 1.52 0.71 -0.54 0.00 0.00 174.62 176.21 2yu0 h THR 45 N 2.45 0.12 0.02 3.99 1.35 -1.97 -1.54 112.91 117.33 2yu0 h THR 45 Ca -0.38 0.00 -0.00 0.00 -0.55 0.00 0.00 66.41 65.47 2yu0 h THR 45 Cb 1.22 0.24 0.00 0.00 -1.73 0.00 0.00 68.15 67.88 2yu0 h THR 45 CO 0.65 0.00 -0.01 0.40 -0.25 0.00 0.00 175.52 176.31 2yu0 h ILE 46 N 0.00 0.00 -0.55 6.82 1.08 -1.98 -2.19 117.51 120.69 2yu0 h ILE 46 Ca 0.36 -0.05 0.09 0.00 -0.39 0.00 0.00 64.86 64.88 2yu0 h ILE 46 Cb 2.23 0.00 -0.11 0.00 -3.07 0.00 0.00 36.82 35.87 2yu0 h ILE 46 CO -0.00 0.00 -0.37 1.56 -0.69 0.00 0.00 178.15 178.65 2yu0 h GLN 47 N -0.08 -0.20 -0.80 2.37 1.08 -1.71 0.10 115.11 115.88 2yu0 h GLN 47 Ca -0.00 0.01 0.09 0.00 -1.45 0.00 0.00 58.65 57.30 2yu0 h GLN 47 Cb 0.02 0.04 -0.07 0.00 -0.05 0.00 0.00 27.48 27.43 2yu0 h GLN 47 CO 0.00 -0.13 0.45 0.82 -0.95 0.00 0.00 178.83 179.02 2yu0 h ILE 48 N -0.20 0.91 -0.31 2.54 1.08 -1.49 0.02 117.51 120.06 2yu0 h ILE 48 Ca 0.20 -0.26 0.08 0.00 -0.39 0.00 0.00 64.86 64.49 2yu0 h ILE 48 Cb 0.56 0.08 -0.01 0.00 -3.07 0.00 0.00 36.82 34.37 2yu0 h ILE 48 CO -0.66 0.14 0.22 0.00 -0.69 0.00 0.00 178.15 177.16 2yu0 h ALA 49 N 1.44 2.23 0.29 1.87 0.00 -0.15 -2.36 119.26 122.58 2yu0 h ALA 49 Ca 0.38 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.27 2yu0 h ALA 49 Cb 0.34 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.14 2yu0 h ALA 49 CO -0.24 -0.31 -0.14 -0.91 0.00 0.00 0.00 179.25 177.65 2yu0 h ASN 50 N 0.05 -0.33 -0.87 0.00 2.35 -0.09 -2.05 115.58 114.64 2yu0 h ASN 50 Ca 0.15 -0.05 0.23 0.00 -0.55 0.00 0.00 56.30 56.07 2yu0 h ASN 50 Cb 0.52 0.09 -0.15 0.00 0.05 0.00 0.00 38.32 38.83 2yu0 h ASN 50 CO -0.01 0.14 0.13 0.24 -1.65 0.00 0.00 177.43 176.27 2yu0 h MET 51 N -1.08 0.13 0.22 0.81 2.86 -1.21 -0.42 114.93 116.25 2yu0 h MET 51 Ca -0.04 -0.01 -0.01 0.00 -2.06 0.00 0.00 59.70 57.58 2yu0 h MET 51 Cb 0.37 -0.03 0.00 0.00 0.06 0.00 0.00 31.60 32.00 2yu0 h MET 51 CO 0.07 0.08 -0.11 0.52 1.06 0.00 0.00 176.91 178.53 2yu0 h MET 52 N 0.13 -0.29 -1.47 1.72 2.86 -1.52 -0.21 114.93 116.15 2yu0 h MET 52 Ca 0.53 0.02 0.43 0.00 -2.06 0.00 0.00 59.70 58.61 2yu0 h MET 52 Cb 1.04 0.07 -0.06 0.00 0.06 0.00 0.00 31.60 32.71 2yu0 h MET 52 CO -0.72 0.01 1.21 0.93 1.06 0.00 0.00 176.91 179.41 2yu0 h GLU 53 N -0.60 0.00 0.00 1.72 4.39 -0.33 0.91 114.58 120.67 2yu0 h GLU 53 Ca -0.03 0.00 -0.26 0.00 0.34 0.00 0.00 59.36 59.41 2yu0 h GLU 53 Cb 0.44 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 29.05 2yu0 h GLU 53 CO 0.05 0.00 -1.54 0.39 -1.16 0.00 0.00 179.01 176.76 2yu0 n GLU 54 N -3.75 0.56 -0.02 2.33 -0.58 -0.93 -4.11 120.64 114.14 2yu0 n GLU 54 Ca 0.33 0.47 -0.12 0.00 -0.42 0.00 0.00 57.16 57.41 2yu0 n GLU 54 Cb 1.67 -1.66 -0.08 0.00 -0.57 0.00 0.00 31.44 30.80 2yu0 n GLU 54 CO 0.00 0.00 0.00 0.87 -0.48 0.00 0.00 177.13 177.52 2yu0 h LYS 55 N -1.00 -0.43 -3.49 3.49 1.79 0.98 -3.25 116.57 114.66 2yu0 h LYS 55 Ca -0.40 0.03 -0.74 0.00 -2.18 0.00 0.00 60.65 57.37 2yu0 h LYS 55 Cb 1.30 0.10 -0.32 0.00 -1.58 0.00 0.00 32.23 31.72 2yu0 h LYS 55 CO -0.24 -0.29 -0.00 -0.06 -1.08 0.00 0.00 179.45 177.78 2yu0 s PHE 56 N -5.19 3.86 -2.00 -1.35 0.08 -0.25 -4.88 117.98 108.26 2yu0 s PHE 56 Ca -0.12 -2.76 0.15 0.00 0.12 0.00 0.00 56.93 54.32 2yu0 s PHE 56 Cb 0.06 -3.44 0.88 0.00 -0.57 0.00 0.00 43.02 39.95 2yu0 s PHE 56 CO 0.50 -0.84 1.30 -0.35 -0.10 0.00 0.00 175.22 175.73 2yu0 n PRO 57 N 2.85 0.49 -0.10 0.24 -0.04 -1.23 0.14 135.00 137.36 2yu0 n PRO 57 Ca 0.18 0.00 -0.16 0.00 -0.04 0.00 0.00 63.50 63.48 2yu0 n PRO 57 Cb 0.39 -1.47 -0.07 0.00 -0.04 0.00 0.00 33.50 32.31 2yu0 n PRO 57 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2yu0 n ALA 58 N -0.97 0.78 0.02 0.55 0.00 -1.26 -4.66 120.51 114.96 2yu0 n ALA 58 Ca 0.11 -0.64 0.08 0.00 0.00 0.00 0.00 53.44 52.99 2yu0 n ALA 58 Cb 0.05 -0.15 -0.13 0.00 0.00 0.00 0.00 19.45 19.22 2yu0 n ALA 58 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2yu0 n ASP 59 N -4.46 1.18 -2.08 0.00 5.75 -1.19 -4.99 116.55 110.75 2yu0 n ASP 59 Ca -0.26 -0.03 -0.19 0.00 -0.01 0.00 0.00 54.79 54.30 2yu0 n ASP 59 Cb 0.57 1.74 -0.01 0.00 -1.03 0.00 0.00 41.12 42.39 2yu0 n ASP 59 CO 0.00 0.00 0.00 -1.20 -0.11 0.00 0.00 177.20 175.89 2yu0 n SER 60 N -2.06 -5.37 0.00 -1.12 7.64 0.37 -1.27 113.62 111.81 2yu0 n SER 60 Ca -0.03 0.01 0.00 0.00 1.01 0.00 0.00 58.87 59.86 2yu0 n SER 60 Cb 0.43 -4.43 0.00 0.00 -1.01 0.00 0.00 64.21 59.20 2yu0 n SER 60 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2yu0 n GLY 61 N -1.00 0.76 0.00 0.23 0.00 -1.26 -4.36 105.19 99.56 2yu0 n GLY 61 Ca -0.22 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.80 2yu0 n GLY 61 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2yu0 n LEU 62 N 0.00 0.00 -0.35 0.99 7.94 -0.40 -0.86 117.00 124.32 2yu0 n LEU 62 Ca 0.00 0.95 0.12 0.00 -1.11 0.00 0.00 56.01 55.97 2yu0 n LEU 62 Cb 0.00 -0.45 0.31 0.00 0.53 0.00 0.00 43.42 43.81 2yu0 n LEU 62 CO 0.00 -0.45 1.19 1.23 -1.11 0.00 0.00 177.39 178.25 2yu0 h GLY 63 N 0.00 1.76 0.97 -3.96 0.00 -1.94 -0.04 103.07 99.86 2yu0 h GLY 63 Ca 0.00 -0.35 0.01 0.00 0.00 0.00 0.00 47.33 46.99 2yu0 h GLY 63 CO 0.00 -0.06 0.50 1.70 0.00 0.00 0.00 176.54 178.68 2yu0 h LYS 64 N 0.76 0.98 -0.04 4.80 1.63 -1.93 -2.83 116.57 119.94 2yu0 h LYS 64 Ca 0.57 -0.06 -0.01 0.00 -0.85 0.00 0.00 60.65 60.30 2yu0 h LYS 64 Cb 0.87 -0.22 -0.00 0.00 -0.60 0.00 0.00 32.23 32.28 2yu0 h LYS 64 CO -0.38 0.65 0.00 1.25 -3.45 0.00 0.00 179.45 177.52 2yu0 h LEU 65 N 1.01 0.07 -0.80 5.20 7.12 0.84 -3.08 115.31 125.67 2yu0 h LEU 65 Ca 0.29 -0.31 0.16 0.00 0.13 0.00 0.00 57.88 58.14 2yu0 h LEU 65 Cb -0.08 -0.02 -0.15 0.00 -0.53 0.00 0.00 40.66 39.88 2yu0 h LEU 65 CO -0.07 0.36 -0.24 0.40 -0.13 0.00 0.00 178.44 178.76 2yu0 h ILE 66 N -0.22 0.16 0.09 4.05 2.04 -1.05 -0.15 117.51 122.43 2yu0 h ILE 66 Ca 0.01 0.00 0.02 0.00 1.00 0.00 0.00 64.86 65.89 2yu0 h ILE 66 Cb 0.33 0.16 -0.04 0.00 -0.74 0.00 0.00 36.82 36.53 2yu0 h ILE 66 CO 0.00 0.00 -0.26 -0.33 0.00 0.00 0.00 178.15 177.56 2yu0 h GLU 67 N -0.02 -0.44 -1.13 2.37 5.08 -1.47 -0.46 114.58 118.50 2yu0 h GLU 67 Ca 0.37 0.03 0.37 0.00 -1.00 0.00 0.00 59.36 59.13 2yu0 h GLU 67 Cb 0.59 0.10 -0.14 0.00 0.50 0.00 0.00 28.75 29.80 2yu0 h GLU 67 CO -0.83 -0.29 0.69 0.35 -1.00 0.00 0.00 179.01 177.93 2yu0 h PHE 68 N -0.45 0.72 0.10 4.33 3.57 -0.95 0.69 116.94 124.95 2yu0 h PHE 68 Ca 0.04 0.03 -0.28 0.00 3.53 0.00 0.00 57.97 61.29 2yu0 h PHE 68 Cb 0.49 -0.19 0.02 0.00 2.79 0.00 0.00 35.95 39.07 2yu0 h PHE 68 CO -0.25 -0.19 -1.19 0.00 -2.23 0.00 0.00 178.31 174.45 2yu0 h GLU 70 N 0.22 -0.03 -0.56 0.00 5.08 0.20 -1.41 114.58 118.07 2yu0 h GLU 70 Ca -0.16 0.00 0.07 0.00 -1.00 0.00 0.00 59.36 58.28 2yu0 h GLU 70 Cb 1.87 0.01 -0.06 0.00 0.50 0.00 0.00 28.75 31.06 2yu0 h GLU 70 CO 0.22 -0.02 0.25 0.93 -1.00 0.00 0.00 179.01 179.38 2yu0 h GLU 71 N -0.03 0.45 -5.96 2.33 4.39 -1.50 -3.40 114.58 110.86 2yu0 h GLU 71 Ca 0.19 -0.03 -0.58 0.00 0.34 0.00 0.00 59.36 59.28 2yu0 h GLU 71 Cb 0.32 -0.10 -0.07 0.00 -0.10 0.00 0.00 28.75 28.80 2yu0 h GLU 71 CO -0.43 0.30 0.52 0.08 -1.16 0.00 0.00 179.01 178.32 2yu0 s VAL 72 N -6.11 4.81 -1.55 3.13 1.01 -0.56 -4.91 120.40 116.22 2yu0 s VAL 72 Ca -0.13 1.74 0.15 0.00 0.00 0.00 0.00 61.98 63.74 2yu0 s VAL 72 Cb 0.15 -4.19 0.30 0.00 0.00 0.00 0.00 36.38 32.65 2yu0 s VAL 72 CO 0.74 -0.05 1.39 -0.81 0.00 0.00 0.00 175.10 176.37 2yu0 n PRO 73 N 5.68 0.27 -0.02 2.72 -0.04 -1.26 -1.50 135.00 140.85 2yu0 n PRO 73 Ca 0.07 0.11 0.07 0.00 -0.04 0.00 0.00 63.50 63.72 2yu0 n PRO 73 Cb 0.48 -1.50 -0.16 0.00 -0.04 0.00 0.00 33.50 32.28 2yu0 n PRO 73 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2yu0 n ALA 74 N -1.22 2.57 0.32 0.55 0.00 -1.26 -4.33 120.51 117.13 2yu0 n ALA 74 Ca 0.08 -0.64 0.09 0.00 0.00 0.00 0.00 53.44 52.97 2yu0 n ALA 74 Cb 0.10 -0.68 -0.13 0.00 0.00 0.00 0.00 19.45 18.74 2yu0 n ALA 74 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2yu0 n LEU 75 N -2.37 0.33 -0.34 0.00 4.77 -0.90 -4.42 117.00 114.07 2yu0 n LEU 75 Ca -0.09 -0.19 0.28 0.00 -0.03 0.00 0.00 56.01 55.98 2yu0 n LEU 75 Cb 0.67 0.00 0.59 0.00 -2.33 0.00 0.00 43.42 42.35 2yu0 n LEU 75 CO 0.45 0.08 1.25 0.03 -1.33 0.00 0.00 177.39 177.87 2yu0 h ARG 76 N 0.00 0.25 -0.25 3.23 3.08 -0.98 -0.02 114.38 119.70 2yu0 h ARG 76 Ca 0.00 -0.01 0.06 0.00 0.07 0.00 0.00 59.98 60.10 2yu0 h ARG 76 Cb 0.71 -0.06 -0.07 0.00 0.08 0.00 0.00 29.97 30.64 2yu0 h ARG 76 CO 0.00 0.16 -0.21 -0.22 -1.07 0.00 0.00 179.97 178.64 2yu0 h LYS 77 N 0.26 -0.20 -0.49 0.04 3.64 -1.84 -1.80 116.57 116.17 2yu0 h LYS 77 Ca 0.61 0.01 -0.11 0.00 -1.27 0.00 0.00 60.65 59.89 2yu0 h LYS 77 Cb 1.82 0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 33.67 2yu0 h LYS 77 CO -0.23 -0.13 -0.14 0.00 -2.27 0.00 0.00 179.45 176.68 2yu0 h ARG 78 N -0.20 0.97 -0.43 1.90 2.47 -1.33 -3.20 114.38 114.56 2yu0 h ARG 78 Ca 0.14 -0.38 0.08 0.00 -1.26 0.00 0.00 59.98 58.56 2yu0 h ARG 78 Cb 0.42 -0.05 -0.09 0.00 -1.65 0.00 0.00 29.97 28.59 2yu0 h ARG 78 CO -0.37 1.05 -0.34 0.00 0.56 0.00 0.00 179.97 180.87 2yu0 h ALA 79 N 0.89 -0.18 -0.09 0.04 0.00 -0.79 0.60 119.26 119.73 2yu0 h ALA 79 Ca 0.12 0.11 0.03 0.00 0.00 0.00 0.00 54.91 55.17 2yu0 h ALA 79 Cb 0.70 0.74 -0.00 0.00 0.00 0.00 0.00 17.79 19.23 2yu0 h ALA 79 CO 0.05 -0.73 0.12 1.05 0.00 0.00 0.00 179.25 179.74 2yu0 h GLU 80 N -0.25 0.00 0.22 0.00 4.11 -1.35 -1.37 114.58 115.94 2yu0 h GLU 80 Ca 0.18 0.00 -0.32 0.00 0.07 0.00 0.00 59.36 59.29 2yu0 h GLU 80 Cb 0.54 0.00 0.03 0.00 0.50 0.00 0.00 28.75 29.82 2yu0 h GLU 80 CO -0.57 0.00 -1.48 0.82 0.07 0.00 0.00 179.01 177.86 2yu0 h ILE 81 N 0.00 1.20 0.00 -1.06 2.04 0.02 -3.12 117.51 116.59 2yu0 h ILE 81 Ca 0.04 -2.61 -0.03 0.00 1.00 0.00 0.00 64.86 63.25 2yu0 h ILE 81 Cb 0.28 2.97 -0.00 0.00 -0.74 0.00 0.00 36.82 39.33 2yu0 h ILE 81 CO -0.00 0.81 -0.17 -0.07 0.00 0.00 0.00 178.15 178.72 2yu0 h LEU 82 N 0.05 0.00 0.14 1.44 3.38 0.52 -3.05 115.31 117.79 2yu0 h LEU 82 Ca -0.27 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.69 2yu0 h LEU 82 Cb 2.07 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.82 2yu0 h LEU 82 CO 0.23 0.17 -0.07 0.11 0.09 0.00 0.00 178.44 178.97 2yu0 h LYS 83 N 0.00 -0.18 -0.98 1.13 1.57 -1.46 -2.62 116.57 114.04 2yu0 h LYS 83 Ca -0.00 0.01 0.19 0.00 -1.87 0.00 0.00 60.65 58.98 2yu0 h LYS 83 Cb 0.33 0.04 -0.18 0.00 0.08 0.00 0.00 32.23 32.50 2yu0 h LYS 83 CO 0.02 0.28 -0.27 1.17 -0.57 0.00 0.00 179.45 180.07 2yu0 n LYS 84 N -4.89 -0.12 -0.13 3.15 3.00 -1.16 0.51 118.16 118.52 2yu0 n LYS 84 Ca -0.08 1.52 -0.11 0.00 -0.00 0.00 0.00 58.31 59.65 2yu0 n LYS 84 Cb 0.27 -2.27 -0.02 0.00 0.00 0.00 0.00 35.03 33.01 2yu0 n LYS 84 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.40 178.33 2yu0 h GLU 85 N 0.00 0.71 0.35 1.64 5.08 -1.64 -3.27 114.58 117.45 2yu0 h GLU 85 Ca 0.44 -0.25 -0.00 0.00 -1.00 0.00 0.00 59.36 58.55 2yu0 h GLU 85 Cb 0.69 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.85 2yu0 h GLU 85 CO -1.00 0.83 -0.49 -0.09 -1.00 0.00 0.00 179.01 177.26 2yu0 h ARG 86 N 0.52 -0.84 -5.94 2.33 2.43 0.47 -3.41 114.38 109.94 2yu0 h ARG 86 Ca 0.10 0.06 -0.68 0.00 -0.81 0.00 0.00 59.98 58.65 2yu0 h ARG 86 Cb 0.54 0.19 -0.25 0.00 -0.42 0.00 0.00 29.97 30.04 2yu0 h ARG 86 CO 0.03 -0.56 -0.77 0.45 -1.51 0.00 0.00 179.97 177.61 2yu0 s SER 87 N -4.34 4.02 -0.49 -3.80 0.15 0.17 -5.08 113.70 104.34 2yu0 s SER 87 Ca -0.16 -0.25 0.03 0.00 0.70 0.00 0.00 55.95 56.27 2yu0 s SER 87 Cb 0.05 -1.14 0.15 0.00 -1.71 0.00 0.00 66.02 63.37 2yu0 s SER 87 CO 0.57 0.28 0.32 -1.61 1.20 0.00 0.00 173.24 174.00 2yu0 s GLU 88 N -0.32 1.41 -1.70 5.44 8.01 -1.26 -4.45 118.70 125.83 2yu0 s GLU 88 Ca 0.03 -2.30 -0.16 0.00 0.01 0.00 0.00 54.97 52.54 2yu0 s GLU 88 Cb -0.13 -2.27 0.15 0.00 -4.31 0.00 0.00 34.13 27.57 2yu0 s GLU 88 CO 0.03 -1.26 0.65 -1.13 0.01 0.00 0.00 175.26 173.56 2yu0 n SER 89 N 3.02 -2.37 -4.66 -0.19 3.41 -1.26 -4.87 113.62 106.70 2yu0 n SER 89 Ca 0.17 -1.08 -0.31 0.00 -0.26 0.00 0.00 58.87 57.39 2yu0 n SER 89 Cb 0.38 -2.46 0.17 0.00 -0.26 0.00 0.00 64.21 62.04 2yu0 n SER 89 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2yu0 n GLY 90 N -1.48 -0.40 3.76 5.00 0.00 -1.26 -4.95 105.19 105.87 2yu0 n GLY 90 Ca 0.01 -0.70 -0.41 0.00 0.00 0.00 0.00 46.02 44.92 2yu0 n GLY 90 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2yu0 s PRO 91 N -4.57 4.45 0.09 1.61 0.04 -1.26 -4.94 135.00 130.41 2yu0 s PRO 91 Ca 0.67 2.06 -0.32 0.00 0.04 0.00 0.00 61.00 63.45 2yu0 s PRO 91 Cb -0.23 -3.13 -0.12 0.00 0.04 0.00 0.00 34.50 31.06 2yu0 s PRO 91 CO 0.58 -0.08 1.79 0.43 0.04 0.00 0.00 177.00 179.76 2yu0 n SER 92 N 1.28 3.71 -4.48 6.66 7.64 -1.26 -4.88 113.62 122.30 2yu0 n SER 92 Ca 0.01 1.01 -0.44 0.00 1.01 0.00 0.00 58.87 60.46 2yu0 n SER 92 Cb 0.43 -1.48 -0.01 0.00 -1.01 0.00 0.00 64.21 62.14 2yu0 n SER 92 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2yu0 n SER 93 N 5.35 -0.35 0.00 6.43 3.41 -1.26 -5.33 113.62 121.86 2yu0 n SER 93 Ca 0.19 1.02 0.00 0.00 -0.26 0.00 0.00 58.87 59.82 2yu0 n SER 93 Cb 0.34 -1.13 0.00 0.00 -0.26 0.00 0.00 64.21 63.16 2yu0 n SER 93 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49