#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yu0 s SER 2 N 0.00 4.04 0.40 1.61 1.04 -1.26 -5.11 113.70 114.42 2yu0 s SER 2 Ca 0.00 0.49 0.03 0.00 0.48 0.00 0.00 55.95 56.96 2yu0 s SER 2 Cb 0.00 -0.84 -0.04 0.00 0.10 0.00 0.00 66.02 65.25 2yu0 s SER 2 CO 0.00 -2.16 0.09 -0.55 0.98 0.00 0.00 173.24 171.60 2yu0 s SER 3 N -4.69 2.91 0.00 7.02 0.15 -1.26 -5.10 113.70 112.73 2yu0 s SER 3 Ca 0.66 -1.58 0.00 0.00 0.70 0.00 0.00 55.95 55.73 2yu0 s SER 3 Cb -0.08 0.31 0.00 0.00 -1.71 0.00 0.00 66.02 64.54 2yu0 s SER 3 CO 0.50 -0.81 0.00 0.61 1.20 0.00 0.00 173.24 174.73 2yu0 n GLY 4 N -0.90 -0.71 2.45 9.45 0.00 -1.26 -5.03 105.19 109.19 2yu0 n GLY 4 Ca -0.07 -1.96 -0.11 0.00 0.00 0.00 0.00 46.02 43.88 2yu0 n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2yu0 n SER 5 N 0.00 -3.64 -2.23 1.61 2.88 -1.26 -4.95 113.62 106.03 2yu0 n SER 5 Ca 0.00 -0.28 -0.30 0.00 -1.33 0.00 0.00 58.87 56.96 2yu0 n SER 5 Cb 0.00 -2.75 0.05 0.00 -0.75 0.00 0.00 64.21 60.76 2yu0 n SER 5 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2yu0 n SER 6 N -1.06 6.41 -3.38 -3.46 7.64 -1.26 -4.79 113.62 113.72 2yu0 n SER 6 Ca -0.03 -3.77 -0.38 0.00 1.01 0.00 0.00 58.87 55.70 2yu0 n SER 6 Cb 0.54 -0.69 0.01 0.00 -1.01 0.00 0.00 64.21 63.06 2yu0 n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2yu0 n GLY 7 N -0.80 5.97 3.88 0.23 0.00 -1.26 -5.01 105.19 108.20 2yu0 n GLY 7 Ca 0.54 -2.61 -0.35 0.00 0.00 0.00 0.00 46.02 43.59 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 -4.51 5.38 0.01 -0.61 1.09 -1.26 -5.07 121.20 116.23 2yu0 s ILE 8 Ca 0.43 0.16 0.03 0.00 -1.10 0.00 0.00 60.65 60.16 2yu0 s ILE 8 Cb 0.25 -3.52 -0.01 0.00 -1.06 0.00 0.00 42.46 38.12 2yu0 s ILE 8 CO -0.17 0.45 -0.08 -0.69 -0.10 0.00 0.00 174.94 174.35 2yu0 s VAL 9 N -1.21 0.62 0.64 2.92 1.01 -1.26 -5.01 120.40 118.12 2yu0 s VAL 9 Ca 0.23 -0.58 0.25 0.00 0.00 0.00 0.00 61.98 61.88 2yu0 s VAL 9 Cb -0.13 -0.57 0.28 0.00 0.00 0.00 0.00 36.38 35.96 2yu0 s VAL 9 CO 0.13 0.00 1.73 -0.07 0.00 0.00 0.00 175.10 176.89 2yu0 h LEU 10 N 5.47 0.00 0.13 3.92 3.38 -1.97 0.28 115.31 126.52 2yu0 h LEU 10 Ca -0.32 0.00 -0.36 0.00 0.09 0.00 0.00 57.88 57.29 2yu0 h LEU 10 Cb 1.19 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.92 2yu0 h LEU 10 CO 0.47 0.00 -1.92 0.25 0.09 0.00 0.00 178.44 177.32 2yu0 h LEU 11 N 0.00 0.42 -1.56 1.67 7.12 -1.94 -3.34 115.31 117.68 2yu0 h LEU 11 Ca 0.09 -0.87 0.00 0.00 0.13 0.00 0.00 57.88 57.22 2yu0 h LEU 11 Cb 1.16 -0.14 0.00 0.00 -0.53 0.00 0.00 40.66 41.15 2yu0 h LEU 11 CO -0.00 1.77 0.44 -0.09 -0.13 0.00 0.00 178.44 180.43 2yu0 h ARG 12 N 0.07 0.00 -0.22 1.25 2.43 -0.83 -1.91 114.38 115.17 2yu0 h ARG 12 Ca -0.40 0.00 0.06 0.00 -0.81 0.00 0.00 59.98 58.84 2yu0 h ARG 12 Cb 2.04 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 31.59 2yu0 h ARG 12 CO 0.11 0.00 0.79 0.78 -1.51 0.00 0.00 179.97 180.13 2yu0 h GLY 13 N 0.00 0.00 0.00 2.80 0.00 -1.66 0.13 103.07 104.34 2yu0 h GLY 13 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.30 2yu0 h GLY 13 CO 0.00 0.00 -0.83 1.04 0.00 0.00 0.00 176.54 176.75 2yu0 n LEU 14 N -2.87 1.87 0.09 3.11 4.77 -0.72 -4.31 117.00 118.96 2yu0 n LEU 14 Ca 0.04 0.49 0.20 0.00 -0.03 0.00 0.00 56.01 56.71 2yu0 n LEU 14 Cb 0.87 -0.82 0.71 0.00 -2.33 0.00 0.00 43.42 41.86 2yu0 n LEU 14 CO 0.11 -0.31 1.18 -0.33 -1.33 0.00 0.00 177.39 176.70 2yu0 h GLU 15 N -1.00 0.00 0.03 3.23 4.39 -1.49 -0.89 114.58 118.85 2yu0 h GLU 15 Ca -0.04 0.00 0.01 0.00 0.34 0.00 0.00 59.36 59.67 2yu0 h GLU 15 Cb 0.80 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.43 2yu0 h GLU 15 CO -0.03 0.00 -0.10 0.00 -1.16 0.00 0.00 179.01 177.72 2yu0 s ILE 17 N -6.16 3.90 0.30 0.00 -4.36 -0.34 -5.02 121.20 109.52 2yu0 s ILE 17 Ca -0.14 0.67 -0.26 0.00 -0.26 0.00 0.00 60.65 60.66 2yu0 s ILE 17 Cb 0.07 -3.34 -0.10 0.00 1.25 0.00 0.00 42.46 40.35 2yu0 s ILE 17 CO 0.66 -0.76 0.93 0.20 0.24 0.00 0.00 174.94 176.22 2yu0 s ASN 18 N -3.55 7.38 0.33 4.36 -0.87 -1.26 -4.83 114.94 116.50 2yu0 s ASN 18 Ca 0.59 1.83 0.22 0.00 -1.57 0.00 0.00 52.86 53.93 2yu0 s ASN 18 Cb -0.15 -2.57 1.17 0.00 -0.02 0.00 0.00 41.25 39.67 2yu0 s ASN 18 CO 0.52 -0.02 1.29 1.17 -2.57 0.00 0.00 177.10 177.48 2yu0 n LYS 19 N 0.74 -0.04 0.01 -0.60 0.00 -1.26 -0.56 118.16 116.45 2yu0 n LYS 19 Ca 0.01 1.08 -0.05 0.00 0.00 0.00 0.00 58.31 59.35 2yu0 n LYS 19 Cb 0.50 -2.03 -0.03 0.00 0.00 0.00 0.00 35.03 33.46 2yu0 n LYS 19 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.40 178.65 2yu0 h HIS 20 N 0.00 -0.53 -0.83 5.64 2.76 -2.02 -1.17 115.15 119.01 2yu0 h HIS 20 Ca 0.71 0.02 0.03 0.00 -2.20 0.00 0.00 60.37 58.93 2yu0 h HIS 20 Cb 2.09 0.23 -0.05 0.00 1.55 0.00 0.00 27.41 31.24 2yu0 h HIS 20 CO -0.01 -0.19 0.54 1.88 -1.30 0.00 0.00 177.93 178.85 2yu0 h TYR 21 N -0.21 1.01 -0.68 5.26 0.05 -1.20 -2.69 116.97 118.51 2yu0 h TYR 21 Ca 0.01 0.03 0.13 0.00 0.05 0.00 0.00 58.73 58.95 2yu0 h TYR 21 Cb 0.23 -0.33 -0.13 0.00 1.01 0.00 0.00 36.73 37.51 2yu0 h TYR 21 CO -0.45 0.59 -0.21 0.35 -1.05 0.00 0.00 178.16 177.38 2yu0 h PHE 22 N 1.05 -0.50 -0.88 4.88 3.57 -0.87 0.11 116.94 124.30 2yu0 h PHE 22 Ca 0.33 0.07 0.23 0.00 3.53 0.00 0.00 57.97 62.12 2yu0 h PHE 22 Cb -0.02 0.33 -0.15 0.00 2.79 0.00 0.00 35.95 38.90 2yu0 h PHE 22 CO -0.02 -0.32 0.12 1.03 -2.23 0.00 0.00 178.31 176.89 2yu0 h SER 23 N -0.04 -0.22 -0.52 0.41 0.87 -0.87 0.37 113.55 113.54 2yu0 h SER 23 Ca 0.31 0.22 0.01 0.00 -1.23 0.00 0.00 61.79 61.10 2yu0 h SER 23 Cb 0.52 0.35 -0.03 0.00 -0.44 0.00 0.00 62.40 62.81 2yu0 h SER 23 CO -0.71 -0.22 0.35 -0.07 -0.53 0.00 0.00 176.83 175.64 2yu0 h LEU 24 N 0.12 0.60 -0.65 2.23 4.07 -0.88 -2.45 115.31 118.36 2yu0 h LEU 24 Ca 0.53 -0.02 0.09 0.00 0.08 0.00 0.00 57.88 58.57 2yu0 h LEU 24 Cb 1.07 -0.15 -0.07 0.00 1.08 0.00 0.00 40.66 42.58 2yu0 h LEU 24 CO -0.73 0.44 0.28 0.15 -1.08 0.00 0.00 178.44 177.49 2yu0 h PHE 25 N 0.71 0.49 -0.26 1.13 3.57 -0.02 0.06 116.94 122.61 2yu0 h PHE 25 Ca 0.19 0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.69 2yu0 h PHE 25 Cb -0.08 -0.12 -0.01 0.00 2.79 0.00 0.00 35.95 38.52 2yu0 h PHE 25 CO -0.04 0.15 0.04 0.87 -2.23 0.00 0.00 178.31 177.10 2yu0 h LYS 26 N 0.48 0.38 -0.30 1.11 1.57 -0.98 -1.97 116.57 116.85 2yu0 h LYS 26 Ca 0.32 -0.06 -0.11 0.00 -1.87 0.00 0.00 60.65 58.94 2yu0 h LYS 26 Cb 0.37 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.61 2yu0 h LYS 26 CO -0.29 0.38 -0.24 0.77 -0.57 0.00 0.00 179.45 179.49 2yu0 h SER 27 N 0.37 0.73 0.63 0.86 0.02 -0.58 0.57 113.55 116.16 2yu0 h SER 27 Ca 0.09 -0.45 -0.03 0.00 -0.84 0.00 0.00 61.79 60.56 2yu0 h SER 27 Cb 0.19 -0.21 -0.00 0.00 0.14 0.00 0.00 62.40 62.52 2yu0 h SER 27 CO 0.00 1.03 -0.15 -0.07 -1.14 0.00 0.00 176.83 176.50 2yu0 h LEU 28 N 0.45 0.00 0.00 5.07 3.38 -0.85 -2.59 115.31 120.76 2yu0 h LEU 28 Ca 0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.03 2yu0 h LEU 28 Cb 0.80 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.55 2yu0 h LEU 28 CO 0.06 0.15 -1.57 0.18 0.09 0.00 0.00 178.44 177.35 2yu0 n LEU 29 N -3.46 0.39 -0.35 1.67 7.99 -0.78 -4.40 117.00 118.06 2yu0 n LEU 29 Ca -0.01 -0.14 0.29 0.00 -0.01 0.00 0.00 56.01 56.15 2yu0 n LEU 29 Cb 0.31 -0.01 0.55 0.00 -0.11 0.00 0.00 43.42 44.17 2yu0 n LEU 29 CO 0.31 0.07 1.12 0.00 -1.51 0.00 0.00 177.39 177.37 2yu0 h ALA 30 N 2.35 2.19 -0.03 -1.18 0.00 0.57 0.79 119.26 123.95 2yu0 h ALA 30 Ca 0.00 0.21 -0.02 0.00 0.00 0.00 0.00 54.91 55.09 2yu0 h ALA 30 Cb 0.83 0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.85 2yu0 h ALA 30 CO 0.00 -0.87 -0.07 0.07 0.00 0.00 0.00 179.25 178.38 2yu0 h ARG 31 N 0.15 0.09 0.51 0.00 -0.00 -1.77 0.29 114.38 113.66 2yu0 h ARG 31 Ca 0.79 -0.07 -0.03 0.00 -0.00 0.00 0.00 59.98 60.68 2yu0 h ARG 31 Cb 2.07 0.01 0.01 0.00 -0.00 0.00 0.00 29.97 32.05 2yu0 h ARG 31 CO -0.63 0.67 -0.25 -0.44 -0.00 0.00 0.00 179.97 179.33 2yu0 h ASP 32 N -0.47 -0.58 0.60 0.08 3.32 -0.71 -3.11 116.42 115.55 2yu0 h ASP 32 Ca -0.00 0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.07 2yu0 h ASP 32 Cb 0.68 0.15 0.00 0.00 0.22 0.00 0.00 39.33 40.38 2yu0 h ASP 32 CO 0.02 -0.30 0.00 -0.07 -1.72 0.00 0.00 179.24 177.17 2yu0 h LEU 33 N -0.92 0.00 0.41 1.55 3.38 0.24 -3.46 115.31 116.51 2yu0 h LEU 33 Ca -0.07 0.00 -0.27 0.00 0.09 0.00 0.00 57.88 57.63 2yu0 h LEU 33 Cb 0.53 0.00 0.04 0.00 0.09 0.00 0.00 40.66 41.32 2yu0 h LEU 33 CO 0.12 0.00 -0.40 -3.20 0.09 0.00 0.00 178.44 175.04 2yu0 n ASN 34 N -2.51 -4.59 -3.62 -0.43 5.15 0.84 -4.99 115.26 105.10 2yu0 n ASN 34 Ca 0.01 -0.20 -0.26 0.00 -0.60 0.00 0.00 54.58 53.53 2yu0 n ASN 34 Cb 0.20 -3.45 0.23 0.00 -0.53 0.00 0.00 39.78 36.23 2yu0 n ASN 34 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 2yu0 n LEU 35 N -2.78 -1.07 -4.58 1.20 4.77 -0.08 -4.98 117.00 109.49 2yu0 n LEU 35 Ca -0.07 -0.55 -0.30 0.00 -0.03 0.00 0.00 56.01 55.06 2yu0 n LEU 35 Cb 0.58 -0.95 0.24 0.00 -2.33 0.00 0.00 43.42 40.96 2yu0 n LEU 35 CO 0.32 -3.84 0.61 -1.61 -1.33 0.00 0.00 177.39 171.53 2yu0 s GLU 36 N -4.26 -1.26 -0.16 3.23 0.41 -1.26 -4.92 118.70 110.47 2yu0 s GLU 36 Ca 0.55 -0.02 0.09 0.00 -0.41 0.00 0.00 54.97 55.18 2yu0 s GLU 36 Cb -0.12 -1.59 -0.23 0.00 -1.78 0.00 0.00 34.13 30.42 2yu0 s GLU 36 CO 0.50 -3.75 0.20 2.89 -0.49 0.00 0.00 175.26 174.61 2yu0 n ARG 37 N -4.79 0.68 0.00 1.61 1.85 -1.26 -4.59 116.66 110.16 2yu0 n ARG 37 Ca 0.13 0.15 0.00 0.00 -1.00 0.00 0.00 57.85 57.13 2yu0 n ARG 37 Cb 0.59 -1.62 0.00 0.00 -1.05 0.00 0.00 32.46 30.38 2yu0 n ARG 37 CO 0.00 0.00 0.00 -0.25 -0.01 0.00 0.00 177.63 177.37 2yu0 n ASP 38 N -3.07 0.39 -1.90 2.89 8.00 -1.26 -4.76 116.55 116.84 2yu0 n ASP 38 Ca -0.32 -0.86 -0.22 0.00 0.71 0.00 0.00 54.79 54.11 2yu0 n ASP 38 Cb 1.07 0.09 0.12 0.00 -0.02 0.00 0.00 41.12 42.39 2yu0 n ASP 38 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 2yu0 n ASN 39 N -0.09 4.86 0.01 -2.24 5.03 -1.26 -4.52 115.26 117.04 2yu0 n ASN 39 Ca 0.00 -3.75 0.13 0.00 0.87 0.00 0.00 54.58 51.82 2yu0 n ASN 39 Cb 0.10 -0.72 0.37 0.00 -1.02 0.00 0.00 39.78 38.51 2yu0 n ASN 39 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2yu0 n GLN 40 N -0.98 0.03 -0.04 3.52 6.02 -1.26 -3.79 117.38 120.88 2yu0 n GLN 40 Ca 0.50 0.01 -0.13 0.00 -0.01 0.00 0.00 57.00 57.37 2yu0 n GLN 40 Cb 1.01 -1.53 -0.14 0.00 1.02 0.00 0.00 30.24 30.61 2yu0 n GLN 40 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.06 176.44 2yu0 n GLU 41 N -1.58 0.68 0.08 -1.09 1.02 -1.26 -3.98 120.64 114.51 2yu0 n GLU 41 Ca 0.06 0.23 0.07 0.00 -0.02 0.00 0.00 57.16 57.49 2yu0 n GLU 41 Cb 0.35 -1.70 0.34 0.00 -0.02 0.00 0.00 31.44 30.41 2yu0 n GLU 41 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2yu0 n GLN 42 N -3.14 0.08 -1.91 3.49 10.64 -1.25 -4.70 117.38 120.60 2yu0 n GLN 42 Ca -0.26 0.49 -0.29 0.00 -1.83 0.00 0.00 57.00 55.11 2yu0 n GLN 42 Cb 1.06 -1.72 0.09 0.00 -0.86 0.00 0.00 30.24 28.81 2yu0 n GLN 42 CO 0.00 0.00 0.00 0.71 -1.83 0.00 0.00 177.06 175.94 2yu0 s TYR 43 N -3.24 2.94 0.02 2.61 2.02 -1.26 -5.10 117.35 115.34 2yu0 s TYR 43 Ca 0.01 0.74 -0.02 0.00 -0.37 0.00 0.00 57.07 57.43 2yu0 s TYR 43 Cb 0.05 -3.49 -0.01 0.00 -0.40 0.00 0.00 41.96 38.10 2yu0 s TYR 43 CO 0.18 -1.77 0.02 0.95 -1.57 0.00 0.00 175.55 173.36 2yu0 s THR 44 N -3.57 0.11 0.58 -0.71 -4.23 -1.26 -5.01 115.64 101.54 2yu0 s THR 44 Ca 0.62 -0.90 0.41 0.00 -1.18 0.00 0.00 61.69 60.64 2yu0 s THR 44 Cb -0.11 -0.41 0.61 0.00 1.34 0.00 0.00 72.50 73.93 2yu0 s THR 44 CO 0.49 -0.50 1.46 0.35 -0.54 0.00 0.00 174.62 175.88 2yu0 n THR 45 N 1.43 0.00 0.06 3.99 -2.24 -1.26 -0.94 114.28 115.32 2yu0 n THR 45 Ca -0.23 1.40 -0.02 0.00 -2.27 0.00 0.00 64.05 62.93 2yu0 n THR 45 Cb 0.56 -2.40 -0.01 0.00 -2.10 0.00 0.00 70.33 66.38 2yu0 n THR 45 CO 0.00 0.00 0.00 0.40 -0.57 0.00 0.00 175.07 174.90 2yu0 h ILE 46 N 0.00 0.00 -1.03 2.28 1.08 -1.98 0.11 117.51 117.97 2yu0 h ILE 46 Ca 0.77 -0.10 0.26 0.00 -0.39 0.00 0.00 64.86 65.39 2yu0 h ILE 46 Cb 3.46 0.00 -0.09 0.00 -3.07 0.00 0.00 36.82 37.12 2yu0 h ILE 46 CO -0.01 0.00 0.66 1.56 -0.69 0.00 0.00 178.15 179.67 2yu0 h GLN 47 N -0.26 0.40 -0.11 2.37 4.20 -1.44 0.25 115.11 120.52 2yu0 h GLN 47 Ca -0.02 -0.02 -0.21 0.00 0.06 0.00 0.00 58.65 58.46 2yu0 h GLN 47 Cb 0.12 -0.09 0.00 0.00 0.30 0.00 0.00 27.48 27.81 2yu0 h GLN 47 CO 0.03 0.27 -0.78 0.82 -0.67 0.00 0.00 178.83 178.49 2yu0 h ILE 48 N 0.41 1.33 0.60 2.54 1.08 -1.32 -3.04 117.51 119.11 2yu0 h ILE 48 Ca 0.58 -2.08 -0.02 0.00 -0.39 0.00 0.00 64.86 62.95 2yu0 h ILE 48 Cb 1.45 2.07 -0.01 0.00 -3.07 0.00 0.00 36.82 37.27 2yu0 h ILE 48 CO -0.29 0.64 -0.38 0.00 -0.69 0.00 0.00 178.15 177.43 2yu0 h ALA 49 N 0.72 -0.95 -0.92 1.87 0.00 0.22 -2.06 119.26 118.14 2yu0 h ALA 49 Ca -0.05 -0.19 0.14 0.00 0.00 0.00 0.00 54.91 54.82 2yu0 h ALA 49 Cb 1.39 0.47 -0.09 0.00 0.00 0.00 0.00 17.79 19.56 2yu0 h ALA 49 CO 0.15 -1.05 0.54 -0.91 0.00 0.00 0.00 179.25 177.97 2yu0 h ASN 50 N -0.93 0.72 -0.74 0.00 2.35 -1.47 0.35 115.58 115.86 2yu0 h ASN 50 Ca -0.07 0.07 0.05 0.00 -0.55 0.00 0.00 56.30 55.80 2yu0 h ASN 50 Cb 0.76 -0.06 -0.05 0.00 0.05 0.00 0.00 38.32 39.02 2yu0 h ASN 50 CO 0.07 0.33 0.45 0.24 -1.65 0.00 0.00 177.43 176.86 2yu0 h MET 51 N 0.78 0.81 -0.26 0.81 2.86 -1.36 -2.31 114.93 116.25 2yu0 h MET 51 Ca 0.49 -0.05 -0.19 0.00 -2.06 0.00 0.00 59.70 57.89 2yu0 h MET 51 Cb 0.62 -0.18 0.00 0.00 0.06 0.00 0.00 31.60 32.10 2yu0 h MET 51 CO -0.32 0.53 -0.57 0.52 1.06 0.00 0.00 176.91 178.13 2yu0 h MET 52 N 0.83 0.83 -0.47 1.72 2.86 -0.40 -2.08 114.93 118.22 2yu0 h MET 52 Ca 0.32 -0.54 0.09 0.00 -2.06 0.00 0.00 59.70 57.50 2yu0 h MET 52 Cb 0.14 0.07 -0.10 0.00 0.06 0.00 0.00 31.60 31.77 2yu0 h MET 52 CO -0.16 1.17 -0.35 0.93 1.06 0.00 0.00 176.91 179.57 2yu0 h GLU 53 N 0.63 -0.22 0.13 1.72 5.08 -0.44 0.86 114.58 122.34 2yu0 h GLU 53 Ca 0.01 0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.38 2yu0 h GLU 53 Cb 1.18 0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.48 2yu0 h GLU 53 CO 0.12 -0.15 -0.06 1.05 -1.00 0.00 0.00 179.01 178.97 2yu0 h GLU 54 N -0.23 -0.17 0.07 2.33 4.11 -1.56 -2.96 114.58 116.18 2yu0 h GLU 54 Ca 0.19 0.01 0.00 0.00 0.07 0.00 0.00 59.36 59.63 2yu0 h GLU 54 Cb 0.55 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.83 2yu0 h GLU 54 CO -0.60 0.29 -0.17 -0.22 0.07 0.00 0.00 179.01 178.37 2yu0 h LYS 55 N -0.76 -0.26 -3.46 1.06 1.63 -1.04 -3.31 116.57 110.43 2yu0 h LYS 55 Ca -0.02 0.02 -0.73 0.00 -0.85 0.00 0.00 60.65 59.06 2yu0 h LYS 55 Cb 0.54 0.06 -0.33 0.00 -0.60 0.00 0.00 32.23 31.90 2yu0 h LYS 55 CO 0.03 -0.17 0.02 -0.06 -3.45 0.00 0.00 179.45 175.82 2yu0 s PHE 56 N -3.91 3.92 -1.01 1.91 0.08 0.30 -4.87 117.98 114.39 2yu0 s PHE 56 Ca -0.06 -2.81 0.14 0.00 0.12 0.00 0.00 56.93 54.32 2yu0 s PHE 56 Cb 0.02 -3.44 0.60 0.00 -0.57 0.00 0.00 43.02 39.64 2yu0 s PHE 56 CO 0.20 -0.83 1.45 -0.35 -0.10 0.00 0.00 175.22 175.59 2yu0 n PRO 57 N 2.71 0.00 0.34 0.24 -0.04 -1.12 0.33 135.00 137.48 2yu0 n PRO 57 Ca 0.20 0.26 -0.17 0.00 -0.04 0.00 0.00 63.50 63.75 2yu0 n PRO 57 Cb 0.39 -1.50 -0.08 0.00 -0.04 0.00 0.00 33.50 32.26 2yu0 n PRO 57 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2yu0 h ALA 58 N 2.49 -0.87 0.00 0.55 0.00 -1.89 -3.38 119.26 116.16 2yu0 h ALA 58 Ca 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.70 2yu0 h ALA 58 Cb 0.24 0.33 0.00 0.00 0.00 0.00 0.00 17.79 18.36 2yu0 h ALA 58 CO 0.00 -0.92 -0.45 -0.25 0.00 0.00 0.00 179.25 177.63 2yu0 n ASP 59 N -5.42 2.24 -1.04 0.00 8.00 -1.22 -5.01 116.55 114.10 2yu0 n ASP 59 Ca -0.13 -0.26 -0.09 0.00 0.71 0.00 0.00 54.79 55.02 2yu0 n ASP 59 Cb 0.37 0.97 -0.01 0.00 -0.02 0.00 0.00 41.12 42.43 2yu0 n ASP 59 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 2yu0 n SER 60 N -1.19 -3.21 0.00 -2.24 7.64 0.15 -2.95 113.62 111.82 2yu0 n SER 60 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 2yu0 n SER 60 Cb 0.00 -2.46 0.00 0.00 -1.01 0.00 0.00 64.21 60.74 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 -1.04 2.52 0.36 0.23 0.00 -1.25 -4.24 105.19 101.75 2yu0 n GLY 61 Ca -0.11 -0.08 0.01 0.00 0.00 0.00 0.00 46.02 45.85 2yu0 n GLY 61 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2yu0 h LEU 62 N 0.00 -1.16 0.79 0.99 5.85 -1.74 0.22 115.31 120.27 2yu0 h LEU 62 Ca 0.00 0.29 -0.04 0.00 0.84 0.00 0.00 57.88 58.97 2yu0 h LEU 62 Cb 0.00 0.66 0.01 0.00 0.37 0.00 0.00 40.66 41.70 2yu0 h LEU 62 CO 0.00 -0.30 -0.38 1.23 -0.34 0.00 0.00 178.44 178.65 2yu0 h GLY 63 N -0.02 -1.11 -0.63 3.75 0.00 -1.92 0.16 103.07 103.31 2yu0 h GLY 63 Ca 0.38 0.41 0.36 0.00 0.00 0.00 0.00 47.33 48.48 2yu0 h GLY 63 CO -0.94 -0.40 0.79 1.70 0.00 0.00 0.00 176.54 177.69 2yu0 h LYS 64 N -1.23 0.20 0.18 4.80 1.63 -1.75 -0.89 116.57 119.51 2yu0 h LYS 64 Ca -0.11 -0.01 -0.01 0.00 -0.85 0.00 0.00 60.65 59.67 2yu0 h LYS 64 Cb 0.82 -0.05 0.00 0.00 -0.60 0.00 0.00 32.23 32.40 2yu0 h LYS 64 CO 0.18 0.13 -0.09 1.25 -3.45 0.00 0.00 179.45 177.48 2yu0 h LEU 65 N 0.21 -0.20 -0.72 5.20 7.12 -0.43 -3.23 115.31 123.26 2yu0 h LEU 65 Ca 0.70 -0.24 0.17 0.00 0.13 0.00 0.00 57.88 58.64 2yu0 h LEU 65 Cb 2.11 0.05 -0.14 0.00 -0.53 0.00 0.00 40.66 42.16 2yu0 h LEU 65 CO -0.30 0.35 -0.09 -0.38 -0.13 0.00 0.00 178.44 177.89 2yu0 n ILE 66 N -4.92 -0.30 0.09 4.05 5.41 0.03 0.13 119.36 123.85 2yu0 n ILE 66 Ca -0.06 1.61 -0.13 0.00 1.00 0.00 0.00 62.75 65.17 2yu0 n ILE 66 Cb 0.21 -2.29 -0.07 0.00 -0.71 0.00 0.00 39.64 36.78 2yu0 n ILE 66 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 176.55 176.22 2yu0 h GLU 67 N 0.00 -0.15 -0.81 0.38 4.39 -1.59 -1.77 114.58 115.03 2yu0 h GLU 67 Ca 0.39 0.01 0.23 0.00 0.34 0.00 0.00 59.36 60.33 2yu0 h GLU 67 Cb 0.71 0.03 -0.03 0.00 -0.10 0.00 0.00 28.75 29.36 2yu0 h GLU 67 CO -0.71 -0.09 0.77 0.35 -1.16 0.00 0.00 179.01 178.17 2yu0 h PHE 68 N -0.16 0.00 0.14 4.33 3.57 0.11 0.49 116.94 125.42 2yu0 h PHE 68 Ca -0.02 0.00 -0.32 0.00 3.53 0.00 0.00 57.97 61.16 2yu0 h PHE 68 Cb 0.12 0.00 0.00 0.00 2.79 0.00 0.00 35.95 38.87 2yu0 h PHE 68 CO -0.07 0.00 -1.59 0.00 -2.23 0.00 0.00 178.31 174.42 2yu0 h GLU 70 N 0.08 0.33 -0.99 0.00 4.39 0.65 -1.83 114.58 117.21 2yu0 h GLU 70 Ca -0.27 -0.02 0.12 0.00 0.34 0.00 0.00 59.36 59.53 2yu0 h GLU 70 Cb 2.05 -0.07 -0.09 0.00 -0.10 0.00 0.00 28.75 30.54 2yu0 h GLU 70 CO 0.17 0.22 0.62 1.05 -1.16 0.00 0.00 179.01 179.91 2yu0 h GLU 71 N 0.34 0.95 -6.13 2.33 4.11 -1.57 -3.41 114.58 111.21 2yu0 h GLU 71 Ca 0.18 -0.06 -0.56 0.00 0.07 0.00 0.00 59.36 59.00 2yu0 h GLU 71 Cb 0.14 -0.21 -0.05 0.00 0.50 0.00 0.00 28.75 29.13 2yu0 h GLU 71 CO -0.16 0.63 0.08 0.08 0.07 0.00 0.00 179.01 179.71 2yu0 s VAL 72 N -5.96 4.92 0.29 -1.06 1.01 -0.73 -4.96 120.40 113.90 2yu0 s VAL 72 Ca -0.12 1.45 0.17 0.00 0.00 0.00 0.00 61.98 63.47 2yu0 s VAL 72 Cb 0.22 -4.03 0.12 0.00 0.00 0.00 0.00 36.38 32.68 2yu0 s VAL 72 CO 0.81 0.33 1.79 1.55 0.00 0.00 0.00 175.10 179.58 2yu0 h PRO 73 N 6.14 0.00 -0.00 2.72 0.13 -1.79 0.51 132.00 139.71 2yu0 h PRO 73 Ca -0.43 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 2yu0 h PRO 73 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 2yu0 h PRO 73 CO 0.72 0.38 -0.10 0.00 -0.23 0.00 0.00 178.00 178.77 2yu0 n ALA 74 N -2.37 2.70 0.01 -0.56 0.00 -1.26 -3.57 120.51 115.45 2yu0 n ALA 74 Ca -0.01 -0.22 0.03 0.00 0.00 0.00 0.00 53.44 53.24 2yu0 n ALA 74 Cb 0.45 -1.38 -0.04 0.00 0.00 0.00 0.00 19.45 18.49 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 -1.17 0.01 -0.29 0.00 4.77 -0.97 -4.62 117.00 114.74 2yu0 n LEU 75 Ca 0.13 -0.03 0.19 0.00 -0.03 0.00 0.00 56.01 56.27 2yu0 n LEU 75 Cb 0.28 0.00 0.47 0.00 -2.33 0.00 0.00 43.42 41.85 2yu0 n LEU 75 CO 0.25 0.00 1.22 0.03 -1.33 0.00 0.00 177.39 177.56 2yu0 h ARG 76 N 0.00 0.46 -0.36 3.23 3.08 -0.43 0.41 114.38 120.77 2yu0 h ARG 76 Ca 0.00 -0.03 -0.02 0.00 0.07 0.00 0.00 59.98 60.00 2yu0 h ARG 76 Cb 0.23 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 30.15 2yu0 h ARG 76 CO 0.00 0.30 0.14 -0.22 -1.07 0.00 0.00 179.97 179.13 2yu0 h LYS 77 N 0.47 0.50 0.17 0.04 1.63 -1.82 -2.89 116.57 114.68 2yu0 h LYS 77 Ca 0.53 -0.06 -0.33 0.00 -0.85 0.00 0.00 60.65 59.95 2yu0 h LYS 77 Cb 1.24 -0.10 0.01 0.00 -0.60 0.00 0.00 32.23 32.78 2yu0 h LYS 77 CO -0.25 0.42 -1.62 0.00 -3.45 0.00 0.00 179.45 174.54 2yu0 h ARG 78 N 0.50 0.36 -0.82 1.90 2.47 -0.64 -3.32 114.38 114.83 2yu0 h ARG 78 Ca 0.13 -0.62 0.18 0.00 -1.26 0.00 0.00 59.98 58.41 2yu0 h ARG 78 Cb 0.10 0.23 -0.15 0.00 -1.65 0.00 0.00 29.97 28.50 2yu0 h ARG 78 CO -0.01 1.30 -0.12 0.00 0.56 0.00 0.00 179.97 181.69 2yu0 h ALA 79 N 0.07 0.68 -0.45 0.04 0.00 -0.55 0.66 119.26 119.71 2yu0 h ALA 79 Ca -0.32 0.30 -0.06 0.00 0.00 0.00 0.00 54.91 54.83 2yu0 h ALA 79 Cb 2.00 0.57 -0.02 0.00 0.00 0.00 0.00 17.79 20.34 2yu0 h ALA 79 CO 0.15 -0.43 0.05 1.05 0.00 0.00 0.00 179.25 180.07 2yu0 h GLU 80 N 0.03 0.71 -0.34 0.00 -0.00 -1.68 -1.49 114.58 111.80 2yu0 h GLU 80 Ca 0.42 -0.16 -0.12 0.00 -0.00 0.00 0.00 59.36 59.50 2yu0 h GLU 80 Cb 0.71 -0.10 -0.01 0.00 -0.00 0.00 0.00 28.75 29.35 2yu0 h GLU 80 CO -0.81 0.69 -0.27 0.82 -0.00 0.00 0.00 179.01 179.44 2yu0 h ILE 81 N 0.68 1.28 0.03 -1.06 2.04 0.05 -3.01 117.51 117.52 2yu0 h ILE 81 Ca 0.14 -1.39 -0.00 0.00 1.00 0.00 0.00 64.86 64.61 2yu0 h ILE 81 Cb 0.35 1.31 0.00 0.00 -0.74 0.00 0.00 36.82 37.74 2yu0 h ILE 81 CO 0.01 0.46 -0.01 -0.07 0.00 0.00 0.00 178.15 178.53 2yu0 h LEU 82 N 0.61 -0.03 -0.57 1.44 3.38 -0.24 -3.28 115.31 116.62 2yu0 h LEU 82 Ca 0.08 -0.46 0.10 0.00 0.09 0.00 0.00 57.88 57.69 2yu0 h LEU 82 Cb 0.78 0.01 -0.11 0.00 0.09 0.00 0.00 40.66 41.43 2yu0 h LEU 82 CO 0.06 0.45 -0.35 0.11 0.09 0.00 0.00 178.44 178.80 2yu0 h LYS 83 N -0.53 -0.18 -0.99 1.13 1.57 -1.29 0.98 116.57 117.25 2yu0 h LYS 83 Ca -0.00 0.01 0.30 0.00 -1.87 0.00 0.00 60.65 59.09 2yu0 h LYS 83 Cb 0.49 0.04 -0.18 0.00 0.08 0.00 0.00 32.23 32.66 2yu0 h LYS 83 CO 0.01 -0.12 0.11 1.17 -0.57 0.00 0.00 179.45 180.05 2yu0 n LYS 84 N -5.43 -0.08 -0.08 3.15 3.00 -1.14 0.10 118.16 117.69 2yu0 n LYS 84 Ca 0.03 1.47 -0.15 0.00 -0.00 0.00 0.00 58.31 59.67 2yu0 n LYS 84 Cb 0.35 -2.39 -0.05 0.00 0.00 0.00 0.00 35.03 32.95 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 0.82 0.03 1.64 4.39 -0.94 -3.30 114.58 117.22 2yu0 h GLU 85 Ca 0.65 -0.51 0.02 0.00 0.34 0.00 0.00 59.36 59.86 2yu0 h GLU 85 Cb 1.42 0.06 -0.05 0.00 -0.10 0.00 0.00 28.75 30.07 2yu0 h GLU 85 CO -0.91 1.14 -0.54 -0.09 -1.16 0.00 0.00 179.01 177.46 2yu0 h ARG 86 N 0.58 -0.67 -7.09 2.33 2.43 0.18 -3.41 114.38 108.72 2yu0 h ARG 86 Ca 0.02 0.05 -0.54 0.00 -0.81 0.00 0.00 59.98 58.70 2yu0 h ARG 86 Cb 1.09 0.15 0.12 0.00 -0.42 0.00 0.00 29.97 30.91 2yu0 h ARG 86 CO 0.11 -0.45 0.50 -1.12 -1.51 0.00 0.00 179.97 177.50 2yu0 s SER 87 N -4.72 5.13 0.18 -3.80 0.01 -0.68 -4.96 113.70 104.85 2yu0 s SER 87 Ca -0.16 2.48 0.00 0.00 1.31 0.00 0.00 55.95 59.58 2yu0 s SER 87 Cb 0.06 -2.61 0.00 0.00 0.21 0.00 0.00 66.02 63.69 2yu0 s SER 87 CO 0.61 -1.64 0.00 -0.62 0.41 0.00 0.00 173.24 172.00 2yu0 n GLU 88 N -1.53 0.00 -1.64 12.44 1.02 -1.26 -4.89 120.64 124.78 2yu0 n GLU 88 Ca 0.13 0.00 -0.21 0.00 -0.02 0.00 0.00 57.16 57.07 2yu0 n GLU 88 Cb 0.49 -0.25 0.07 0.00 -0.02 0.00 0.00 31.44 31.72 2yu0 n GLU 88 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 2yu0 n SER 89 N -3.41 4.79 -0.33 1.62 7.64 -1.26 -5.06 113.62 117.61 2yu0 n SER 89 Ca 0.00 -3.78 0.00 0.00 1.01 0.00 0.00 58.87 56.10 2yu0 n SER 89 Cb 0.03 -0.49 0.00 0.00 -1.01 0.00 0.00 64.21 62.74 2yu0 n SER 89 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2yu0 n GLY 90 N -0.83 -3.31 3.61 0.23 0.00 -1.26 -5.01 105.19 98.61 2yu0 n GLY 90 Ca 0.44 -1.08 -0.30 0.00 0.00 0.00 0.00 46.02 45.08 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 -5.46 -0.96 -1.18 1.61 0.04 -1.26 -4.94 135.00 122.86 2yu0 s PRO 91 Ca 0.00 0.03 -0.14 0.00 0.04 0.00 0.00 61.00 60.93 2yu0 s PRO 91 Cb 0.00 -1.62 0.17 0.00 0.04 0.00 0.00 34.50 33.09 2yu0 s PRO 91 CO 0.00 -3.55 1.40 0.45 0.04 0.00 0.00 177.00 175.34 2yu0 s SER 92 N -3.81 7.04 -0.21 6.66 0.15 -1.26 -4.99 113.70 117.28 2yu0 s SER 92 Ca 0.70 -2.93 -0.29 0.00 0.70 0.00 0.00 55.95 54.13 2yu0 s SER 92 Cb -0.11 -2.40 -0.02 0.00 -1.71 0.00 0.00 66.02 61.78 2yu0 s SER 92 CO 0.56 -0.76 1.54 -0.55 1.20 0.00 0.00 173.24 175.23 2yu0 s SER 93 N 2.87 6.51 0.00 5.45 0.15 -1.26 -5.34 113.70 122.07 2yu0 s SER 93 Ca 0.42 1.64 0.00 0.00 0.70 0.00 0.00 55.95 58.70 2yu0 s SER 93 Cb -0.03 -2.53 0.00 0.00 -1.71 0.00 0.00 66.02 61.74 2yu0 s SER 93 CO -0.01 -1.15 0.08 0.61 1.20 0.00 0.00 173.24 173.97