#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 1.30 -4.53 1.61 2.88 -1.26 -4.87 113.62 108.75 2yu0 n SER 2 Ca 0.00 -0.19 -0.33 0.00 -1.33 0.00 0.00 58.87 57.02 2yu0 n SER 2 Cb 0.00 -1.26 0.12 0.00 -0.75 0.00 0.00 64.21 62.33 2yu0 n SER 2 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 2yu0 n SER 3 N 13.28 -0.78 0.00 -3.46 2.88 -1.26 -4.70 113.62 119.57 2yu0 n SER 3 Ca 0.51 0.44 0.00 0.00 -1.33 0.00 0.00 58.87 58.50 2yu0 n SER 3 Cb 0.29 -1.33 0.00 0.00 -0.75 0.00 0.00 64.21 62.42 2yu0 n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2yu0 n GLY 4 N 1.06 0.51 3.78 0.46 0.00 -1.26 -5.10 105.19 104.64 2yu0 n GLY 4 Ca 0.10 -0.29 -0.37 0.00 0.00 0.00 0.00 46.02 45.46 2yu0 n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2yu0 s SER 5 N -4.00 6.81 -0.51 1.61 0.01 -1.26 -4.96 113.70 111.40 2yu0 s SER 5 Ca 0.00 2.11 0.02 0.00 1.31 0.00 0.00 55.95 59.39 2yu0 s SER 5 Cb 0.00 -2.60 0.47 0.00 0.21 0.00 0.00 66.02 64.11 2yu0 s SER 5 CO 0.00 -0.46 1.71 -1.54 0.41 0.00 0.00 173.24 173.36 2yu0 n SER 6 N 0.15 6.17 -4.57 2.44 3.41 -1.26 -4.96 113.62 115.01 2yu0 n SER 6 Ca 0.04 -3.77 -0.19 0.00 -0.26 0.00 0.00 58.87 54.69 2yu0 n SER 6 Cb 0.48 -0.74 -0.07 0.00 -0.26 0.00 0.00 64.21 63.62 2yu0 n SER 6 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2yu0 s GLY 7 N -2.43 -0.52 -0.04 5.00 0.00 -1.26 -4.88 107.32 103.20 2yu0 s GLY 7 Ca 0.58 -1.29 0.02 0.00 0.00 0.00 0.00 44.72 44.03 2yu0 s GLY 7 CO 0.01 3.98 -0.06 -0.42 0.00 0.00 0.00 173.10 176.61 2yu0 s ILE 8 N 13.64 0.62 0.18 0.90 1.01 -1.26 -5.08 121.20 131.20 2yu0 s ILE 8 Ca 0.82 -0.21 0.05 0.00 0.00 0.00 0.00 60.65 61.31 2yu0 s ILE 8 Cb -0.08 -0.60 -0.05 0.00 0.01 0.00 0.00 42.46 41.74 2yu0 s ILE 8 CO 0.08 0.23 -0.09 0.54 0.00 0.00 0.00 174.94 175.70 2yu0 s VAL 9 N 0.63 1.26 0.61 2.92 0.11 -1.26 -5.01 120.40 119.66 2yu0 s VAL 9 Ca -0.09 -2.08 0.27 0.00 -2.93 0.00 0.00 61.98 57.15 2yu0 s VAL 9 Cb -0.12 -1.99 0.35 0.00 -1.53 0.00 0.00 36.38 33.08 2yu0 s VAL 9 CO 0.01 -0.63 1.76 0.25 -3.33 0.00 0.00 175.10 173.16 2yu0 h LEU 10 N 2.67 0.00 -0.59 2.54 5.85 -2.01 0.70 115.31 124.48 2yu0 h LEU 10 Ca -0.37 0.00 -0.15 0.00 0.84 0.00 0.00 57.88 58.19 2yu0 h LEU 10 Cb 1.20 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.22 2yu0 h LEU 10 CO 0.64 0.00 -0.66 0.25 -0.34 0.00 0.00 178.44 178.33 2yu0 h LEU 11 N 0.00 0.25 -1.14 2.25 7.12 -2.01 -2.98 115.31 118.80 2yu0 h LEU 11 Ca 0.20 -0.16 0.00 0.00 0.13 0.00 0.00 57.88 58.05 2yu0 h LEU 11 Cb 1.39 -0.07 0.00 0.00 -0.53 0.00 0.00 40.66 41.45 2yu0 h LEU 11 CO -0.00 0.84 0.28 0.03 -0.13 0.00 0.00 178.44 179.46 2yu0 h ARG 12 N 0.16 0.00 0.00 1.25 2.47 0.04 -2.08 114.38 116.22 2yu0 h ARG 12 Ca -0.01 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.71 2yu0 h ARG 12 Cb 1.18 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.50 2yu0 h ARG 12 CO 0.10 0.00 0.45 0.78 0.56 0.00 0.00 179.97 181.87 2yu0 h GLY 13 N 0.00 0.00 0.00 0.04 0.00 -1.64 0.21 103.07 101.68 2yu0 h GLY 13 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 47.33 47.20 2yu0 h GLY 13 CO 0.00 0.00 -1.05 1.04 0.00 0.00 0.00 176.54 176.53 2yu0 n LEU 14 N -2.33 1.86 -0.30 3.11 4.77 -0.78 -4.41 117.00 118.91 2yu0 n LEU 14 Ca -0.01 0.49 -0.03 0.00 -0.03 0.00 0.00 56.01 56.43 2yu0 n LEU 14 Cb 0.48 -0.88 0.09 0.00 -2.33 0.00 0.00 43.42 40.78 2yu0 n LEU 14 CO 0.07 -0.08 1.22 -0.33 -1.33 0.00 0.00 177.39 176.93 2yu0 h GLU 15 N -1.00 1.06 -0.60 3.23 4.39 -1.48 -3.10 114.58 117.08 2yu0 h GLU 15 Ca -0.20 -0.06 0.05 0.00 0.34 0.00 0.00 59.36 59.50 2yu0 h GLU 15 Cb 0.96 -0.24 -0.07 0.00 -0.10 0.00 0.00 28.75 29.30 2yu0 h GLU 15 CO -0.12 0.70 -0.35 0.00 -1.16 0.00 0.00 179.01 178.08 2yu0 s ILE 17 N -4.70 2.04 0.44 0.00 -4.36 -1.17 -4.92 121.20 108.53 2yu0 s ILE 17 Ca -0.07 0.04 -0.25 0.00 -0.26 0.00 0.00 60.65 60.11 2yu0 s ILE 17 Cb 0.07 -3.02 -0.09 0.00 1.25 0.00 0.00 42.46 40.66 2yu0 s ILE 17 CO 0.37 0.01 1.21 0.59 0.24 0.00 0.00 174.94 177.36 2yu0 n ASN 18 N 1.58 2.23 -0.66 4.36 3.02 -1.26 -4.50 115.26 120.03 2yu0 n ASN 18 Ca 0.06 1.07 0.50 0.00 -0.03 0.00 0.00 54.58 56.18 2yu0 n ASN 18 Cb 0.38 -1.47 0.77 0.00 -0.61 0.00 0.00 39.78 38.85 2yu0 n ASN 18 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2yu0 n LYS 19 N -0.07 0.00 0.05 3.52 4.76 -1.26 0.16 118.16 125.32 2yu0 n LYS 19 Ca 0.08 1.06 -0.11 0.00 -2.87 0.00 0.00 58.31 56.46 2yu0 n LYS 19 Cb 0.40 -2.46 -0.04 0.00 -1.84 0.00 0.00 35.03 31.09 2yu0 n LYS 19 CO 0.00 0.00 0.00 1.25 -1.37 0.00 0.00 177.40 177.28 2yu0 h HIS 20 N 0.00 -0.76 -0.03 2.13 -0.00 -2.01 -1.71 115.15 112.77 2yu0 h HIS 20 Ca 0.89 0.03 -0.08 0.00 -0.00 0.00 0.00 60.37 61.20 2yu0 h HIS 20 Cb 3.65 0.34 0.00 0.00 -0.00 0.00 0.00 27.41 31.40 2yu0 h HIS 20 CO 0.00 -0.37 -0.29 1.88 -0.00 0.00 0.00 177.93 179.15 2yu0 h TYR 21 N -0.41 0.35 -0.95 5.26 0.05 -0.60 -3.28 116.97 117.39 2yu0 h TYR 21 Ca 0.07 -0.17 0.27 0.00 0.05 0.00 0.00 58.73 58.95 2yu0 h TYR 21 Cb 0.51 -0.05 -0.17 0.00 1.01 0.00 0.00 36.73 38.03 2yu0 h TYR 21 CO -0.33 0.93 0.11 0.35 -1.05 0.00 0.00 178.16 178.17 2yu0 h PHE 22 N -0.34 0.10 -0.49 4.88 3.57 -1.31 0.52 116.94 123.88 2yu0 h PHE 22 Ca -0.03 0.06 0.07 0.00 3.53 0.00 0.00 57.97 61.61 2yu0 h PHE 22 Cb 0.99 0.11 -0.06 0.00 2.79 0.00 0.00 35.95 39.78 2yu0 h PHE 22 CO 0.15 -0.38 0.13 1.03 -2.23 0.00 0.00 178.31 177.02 2yu0 h SER 23 N 0.05 0.09 -0.12 0.41 0.87 -1.37 -2.32 113.55 111.17 2yu0 h SER 23 Ca 0.60 0.07 0.03 0.00 -1.23 0.00 0.00 61.79 61.26 2yu0 h SER 23 Cb 1.26 0.08 -0.04 0.00 -0.44 0.00 0.00 62.40 63.26 2yu0 h SER 23 CO -0.84 0.08 -0.11 -0.07 -0.53 0.00 0.00 176.83 175.36 2yu0 h LEU 24 N 0.29 -0.34 -0.79 2.23 4.07 -0.07 -2.08 115.31 118.62 2yu0 h LEU 24 Ca 0.24 0.07 0.18 0.00 0.08 0.00 0.00 57.88 58.45 2yu0 h LEU 24 Cb 0.29 0.17 -0.12 0.00 1.08 0.00 0.00 40.66 42.07 2yu0 h LEU 24 CO -0.28 -0.15 0.18 0.15 -1.08 0.00 0.00 178.44 177.27 2yu0 h PHE 25 N -0.13 0.28 -0.50 1.13 3.57 -0.96 0.40 116.94 120.73 2yu0 h PHE 25 Ca 0.08 0.05 -0.02 0.00 3.53 0.00 0.00 57.97 61.60 2yu0 h PHE 25 Cb 0.24 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 38.96 2yu0 h PHE 25 CO -0.23 -0.13 0.22 0.87 -2.23 0.00 0.00 178.31 176.81 2yu0 h LYS 26 N 0.24 0.71 -0.41 1.11 1.57 -1.06 -0.91 116.57 117.83 2yu0 h LYS 26 Ca 0.46 -0.09 -0.08 0.00 -1.87 0.00 0.00 60.65 59.07 2yu0 h LYS 26 Cb 0.83 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.99 2yu0 h LYS 26 CO -0.57 0.58 -0.05 0.77 -0.57 0.00 0.00 179.45 179.61 2yu0 h SER 27 N 0.71 0.75 -0.29 0.86 0.02 0.28 1.11 113.55 116.99 2yu0 h SER 27 Ca 0.17 -0.34 -0.12 0.00 -0.84 0.00 0.00 61.79 60.67 2yu0 h SER 27 Cb 0.12 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 62.44 2yu0 h SER 27 CO -0.02 0.91 -0.25 -0.07 -1.14 0.00 0.00 176.83 176.26 2yu0 h LEU 28 N 0.57 0.80 0.00 5.07 3.38 -0.82 -2.98 115.31 121.34 2yu0 h LEU 28 Ca 0.11 -0.30 -0.08 0.00 0.09 0.00 0.00 57.88 57.70 2yu0 h LEU 28 Cb 0.55 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.07 2yu0 h LEU 28 CO 0.03 1.01 -0.70 -0.07 0.09 0.00 0.00 178.44 178.80 2yu0 h LEU 29 N 0.67 0.00 -0.70 1.67 -0.00 -1.07 -3.37 115.31 112.52 2yu0 h LEU 29 Ca 0.09 0.00 0.13 0.00 -0.00 0.00 0.00 57.88 58.10 2yu0 h LEU 29 Cb 0.77 0.00 -0.13 0.00 -0.00 0.00 0.00 40.66 41.30 2yu0 h LEU 29 CO 0.06 0.31 -0.20 0.00 -0.00 0.00 0.00 178.44 178.61 2yu0 n ALA 30 N -2.23 0.10 0.11 1.53 0.00 0.38 0.43 120.51 120.84 2yu0 n ALA 30 Ca -0.01 0.75 -0.14 0.00 0.00 0.00 0.00 53.44 54.04 2yu0 n ALA 30 Cb 0.68 -0.42 -0.08 0.00 0.00 0.00 0.00 19.45 19.62 2yu0 n ALA 30 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 177.50 177.57 2yu0 h ARG 31 N 0.00 -0.63 0.58 0.00 0.11 -1.74 1.95 114.38 114.65 2yu0 h ARG 31 Ca 0.31 0.04 -0.03 0.00 0.10 0.00 0.00 59.98 60.41 2yu0 h ARG 31 Cb 0.49 0.14 0.01 0.00 1.11 0.00 0.00 29.97 31.71 2yu0 h ARG 31 CO -0.71 -0.42 -0.28 -0.44 0.10 0.00 0.00 179.97 178.22 2yu0 h ASP 32 N -0.65 -0.66 0.00 0.08 5.19 -0.65 -2.71 116.42 117.01 2yu0 h ASP 32 Ca -0.01 0.02 0.00 0.00 -0.62 0.00 0.00 57.03 56.42 2yu0 h ASP 32 Cb 0.64 0.17 0.00 0.00 0.18 0.00 0.00 39.33 40.32 2yu0 h ASP 32 CO -0.22 -0.40 0.04 0.18 -3.12 0.00 0.00 179.24 175.73 2yu0 n LEU 33 N -4.52 0.16 -3.57 1.55 4.77 0.17 -4.80 117.00 110.75 2yu0 n LEU 33 Ca -0.10 0.54 -0.26 0.00 -0.03 0.00 0.00 56.01 56.17 2yu0 n LEU 33 Cb 0.31 -0.56 0.04 0.00 -2.33 0.00 0.00 43.42 40.88 2yu0 n LEU 33 CO 0.23 -0.60 0.11 0.59 -1.33 0.00 0.00 177.39 176.39 2yu0 n ASN 34 N -1.69 -5.39 -3.37 -1.43 4.13 0.64 -4.96 115.26 103.19 2yu0 n ASN 34 Ca -0.00 -0.56 -0.25 0.00 1.68 0.00 0.00 54.58 55.44 2yu0 n ASN 34 Cb 0.05 -4.31 0.21 0.00 -1.54 0.00 0.00 39.78 34.20 2yu0 n ASN 34 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 2yu0 n LEU 35 N -4.52 0.00 -4.69 3.41 4.77 -0.11 -4.95 117.00 110.92 2yu0 n LEU 35 Ca -0.00 -0.96 -0.42 0.00 -0.03 0.00 0.00 56.01 54.60 2yu0 n LEU 35 Cb 0.56 -0.85 -0.03 0.00 -2.33 0.00 0.00 43.42 40.77 2yu0 n LEU 35 CO 0.64 -2.05 0.97 -1.61 -1.33 0.00 0.00 177.39 174.01 2yu0 s GLU 36 N -5.06 4.35 0.17 3.23 8.01 -1.26 -4.90 118.70 123.24 2yu0 s GLU 36 Ca 0.60 1.74 -0.08 0.00 0.01 0.00 0.00 54.97 57.23 2yu0 s GLU 36 Cb -0.06 -3.53 0.23 0.00 -4.31 0.00 0.00 34.13 26.45 2yu0 s GLU 36 CO 0.46 -0.44 1.01 0.54 0.01 0.00 0.00 175.26 176.84 2yu0 n ARG 37 N 5.05 -0.11 0.00 1.61 1.74 -1.26 -3.26 116.66 120.44 2yu0 n ARG 37 Ca 0.11 1.01 0.00 0.00 -0.77 0.00 0.00 57.85 58.20 2yu0 n ARG 37 Cb 0.46 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.40 2yu0 n ARG 37 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 2yu0 n ASP 38 N -5.01 2.82 -1.85 0.55 9.92 -1.26 -4.80 116.55 116.92 2yu0 n ASP 38 Ca 0.09 0.00 -0.05 0.00 -0.53 0.00 0.00 54.79 54.29 2yu0 n ASP 38 Cb 0.29 0.36 -0.08 0.00 -0.64 0.00 0.00 41.12 41.06 2yu0 n ASP 38 CO 0.00 0.00 0.00 -3.20 0.13 0.00 0.00 177.20 174.13 2yu0 n ASN 39 N -1.21 4.42 0.07 -2.24 4.05 -1.20 -4.14 115.26 115.01 2yu0 n ASN 39 Ca 0.00 -2.25 -0.05 0.00 0.45 0.00 0.00 54.58 52.72 2yu0 n ASN 39 Cb 0.20 -1.07 -0.10 0.00 1.23 0.00 0.00 39.78 40.04 2yu0 n ASN 39 CO 0.00 0.00 0.00 1.56 -3.05 0.00 0.00 177.26 175.77 2yu0 h GLN 40 N 2.56 0.00 -1.00 1.20 4.20 -1.87 -3.30 115.11 116.90 2yu0 h GLN 40 Ca 0.08 0.00 0.18 0.00 0.06 0.00 0.00 58.65 58.98 2yu0 h GLN 40 Cb 1.07 0.00 -0.10 0.00 0.30 0.00 0.00 27.48 28.75 2yu0 h GLN 40 CO 0.15 0.87 0.62 1.49 -0.67 0.00 0.00 178.83 181.28 2yu0 h GLU 41 N 0.00 0.77 -1.16 1.46 4.81 -1.93 0.12 114.58 118.65 2yu0 h GLU 41 Ca -0.03 -0.05 0.33 0.00 -0.13 0.00 0.00 59.36 59.48 2yu0 h GLU 41 Cb 1.72 -0.17 -0.06 0.00 0.63 0.00 0.00 28.75 30.87 2yu0 h GLU 41 CO 0.11 0.51 0.81 -0.56 -0.73 0.00 0.00 179.01 179.16 2yu0 h GLN 42 N 0.79 0.08 -7.20 1.92 3.07 -1.92 -3.40 115.11 108.45 2yu0 h GLN 42 Ca 0.57 -0.00 -0.48 0.00 0.09 0.00 0.00 58.65 58.82 2yu0 h GLN 42 Cb 0.85 -0.02 0.04 0.00 0.08 0.00 0.00 27.48 28.43 2yu0 h GLN 42 CO -0.36 0.05 0.38 0.71 0.09 0.00 0.00 178.83 179.70 2yu0 s TYR 43 N -5.07 3.26 0.12 0.06 2.02 0.41 -5.07 117.35 113.07 2yu0 s TYR 43 Ca -0.06 1.48 0.11 0.00 -0.37 0.00 0.00 57.07 58.23 2yu0 s TYR 43 Cb 0.24 -2.88 -0.04 0.00 -0.40 0.00 0.00 41.96 38.87 2yu0 s TYR 43 CO 0.80 -0.70 -0.26 0.95 -1.57 0.00 0.00 175.55 174.77 2yu0 s THR 44 N -2.56 2.28 0.37 -0.71 -4.23 -1.26 -5.00 115.64 104.53 2yu0 s THR 44 Ca 0.61 -1.71 0.29 0.00 -1.18 0.00 0.00 61.69 59.70 2yu0 s THR 44 Cb -0.13 -2.00 0.44 0.00 1.34 0.00 0.00 72.50 72.15 2yu0 s THR 44 CO 0.34 0.12 1.25 0.35 -0.54 0.00 0.00 174.62 176.14 2yu0 n THR 45 N 0.99 -0.16 0.12 3.99 -2.24 -1.26 -0.40 114.28 115.31 2yu0 n THR 45 Ca -0.18 1.40 -0.05 0.00 -2.27 0.00 0.00 64.05 62.95 2yu0 n THR 45 Cb 0.53 -2.30 -0.02 0.00 -2.10 0.00 0.00 70.33 66.44 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 -0.98 2.28 5.03 -1.98 -1.16 117.51 120.71 2yu0 h ILE 46 Ca 0.72 -0.11 0.31 0.00 -0.12 0.00 0.00 64.86 65.65 2yu0 h ILE 46 Cb 2.42 0.00 -0.15 0.00 -3.03 0.00 0.00 36.82 36.06 2yu0 h ILE 46 CO -0.30 0.00 0.48 1.56 -0.68 0.00 0.00 178.15 179.21 2yu0 h GLN 47 N -0.44 0.27 0.00 2.37 1.08 -1.13 1.44 115.11 118.71 2yu0 h GLN 47 Ca -0.03 -0.02 -0.09 0.00 -1.45 0.00 0.00 58.65 57.06 2yu0 h GLN 47 Cb 0.25 -0.06 -0.01 0.00 -0.05 0.00 0.00 27.48 27.61 2yu0 h GLN 47 CO 0.05 0.18 -0.41 0.82 -0.95 0.00 0.00 178.83 178.52 2yu0 h ILE 48 N 0.27 1.12 0.03 2.54 1.08 -1.33 -1.81 117.51 119.41 2yu0 h ILE 48 Ca 0.70 -1.50 -0.06 0.00 -0.39 0.00 0.00 64.86 63.61 2yu0 h ILE 48 Cb 1.57 1.85 0.01 0.00 -3.07 0.00 0.00 36.82 37.18 2yu0 h ILE 48 CO -0.63 0.40 -0.24 0.00 -0.69 0.00 0.00 178.15 176.99 2yu0 h ALA 49 N 1.59 -0.01 -0.64 1.87 0.00 0.31 -2.94 119.26 119.45 2yu0 h ALA 49 Ca -0.00 -0.52 -0.02 0.00 0.00 0.00 0.00 54.91 54.37 2yu0 h ALA 49 Cb 0.82 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.60 2yu0 h ALA 49 CO 0.05 0.09 0.33 -0.91 0.00 0.00 0.00 179.25 178.82 2yu0 h ASN 50 N -0.69 0.81 -0.39 0.00 2.35 -0.68 0.62 115.58 117.61 2yu0 h ASN 50 Ca -0.04 -0.11 0.00 0.00 -0.55 0.00 0.00 56.30 55.60 2yu0 h ASN 50 Cb 1.10 -0.21 -0.02 0.00 0.05 0.00 0.00 38.32 39.25 2yu0 h ASN 50 CO 0.05 0.69 0.25 0.24 -1.65 0.00 0.00 177.43 177.01 2yu0 h MET 51 N 0.87 0.51 -0.36 0.81 2.86 -1.44 -2.88 114.93 115.31 2yu0 h MET 51 Ca 0.22 -0.03 -0.07 0.00 -2.06 0.00 0.00 59.70 57.76 2yu0 h MET 51 Cb 0.08 -0.11 -0.01 0.00 0.06 0.00 0.00 31.60 31.61 2yu0 h MET 51 CO -0.03 0.34 -0.06 0.52 1.06 0.00 0.00 176.91 178.74 2yu0 h MET 52 N 0.52 0.67 -1.09 1.72 2.86 -1.31 -0.07 114.93 118.23 2yu0 h MET 52 Ca 0.14 -0.24 0.42 0.00 -2.06 0.00 0.00 59.70 57.96 2yu0 h MET 52 Cb -0.05 -0.04 -0.16 0.00 0.06 0.00 0.00 31.60 31.40 2yu0 h MET 52 CO -0.03 0.81 0.63 0.93 1.06 0.00 0.00 176.91 180.32 2yu0 h GLU 53 N 0.47 0.05 0.02 1.72 5.08 -0.65 0.25 114.58 121.53 2yu0 h GLU 53 Ca 0.09 -0.00 -0.35 0.00 -1.00 0.00 0.00 59.36 58.10 2yu0 h GLU 53 Cb 0.55 -0.01 -0.05 0.00 0.50 0.00 0.00 28.75 29.74 2yu0 h GLU 53 CO 0.03 0.03 -1.96 0.39 -1.00 0.00 0.00 179.01 176.51 2yu0 n GLU 54 N -5.09 0.62 -0.30 2.33 1.02 -1.14 -4.20 120.64 113.88 2yu0 n GLU 54 Ca 0.38 0.37 -0.01 0.00 -0.02 0.00 0.00 57.16 57.87 2yu0 n GLU 54 Cb 1.31 -1.63 0.05 0.00 -0.02 0.00 0.00 31.44 31.15 2yu0 n GLU 54 CO 0.00 0.00 0.00 -0.22 1.18 0.00 0.00 177.13 178.09 2yu0 h LYS 55 N -0.68 -0.05 -3.35 3.49 1.63 0.34 -3.17 116.57 114.77 2yu0 h LYS 55 Ca -0.51 0.00 -0.65 0.00 -0.85 0.00 0.00 60.65 58.65 2yu0 h LYS 55 Cb 1.61 0.01 -0.40 0.00 -0.60 0.00 0.00 32.23 32.85 2yu0 h LYS 55 CO -0.21 -0.04 -0.57 -0.06 -3.45 0.00 0.00 179.45 175.12 2yu0 s PHE 56 N -6.05 3.30 -1.70 1.91 0.40 -0.05 -4.92 117.98 110.86 2yu0 s PHE 56 Ca -0.14 -3.15 0.15 0.00 -0.60 0.00 0.00 56.93 53.19 2yu0 s PHE 56 Cb 0.20 -2.86 0.84 0.00 0.51 0.00 0.00 43.02 41.71 2yu0 s PHE 56 CO 0.72 -0.72 1.38 -0.35 0.70 0.00 0.00 175.22 176.95 2yu0 n PRO 57 N 2.92 0.34 -0.06 0.24 -0.04 -1.20 0.10 135.00 137.31 2yu0 n PRO 57 Ca 0.08 0.08 -0.04 0.00 -0.04 0.00 0.00 63.50 63.59 2yu0 n PRO 57 Cb 0.33 -1.50 -0.03 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 2.83 0.00 0.00 0.55 0.00 -1.91 -3.40 119.26 117.33 2yu0 h ALA 58 Ca 0.00 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 54.74 2yu0 h ALA 58 Cb 0.07 0.02 -0.06 0.00 0.00 0.00 0.00 17.79 17.83 2yu0 h ALA 58 CO 0.00 0.02 -0.43 -0.40 0.00 0.00 0.00 179.25 178.44 2yu0 n ASP 59 N -4.73 1.64 -2.53 0.00 5.68 -1.21 -4.96 116.55 110.43 2yu0 n ASP 59 Ca -0.03 -3.20 -0.02 0.00 -0.50 0.00 0.00 54.79 51.04 2yu0 n ASP 59 Cb 0.12 -0.43 -0.00 0.00 -1.14 0.00 0.00 41.12 39.67 2yu0 n ASP 59 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 2yu0 n SER 60 N -0.87 -1.00 0.00 -1.12 3.41 0.12 0.23 113.62 114.37 2yu0 n SER 60 Ca 0.14 0.39 0.00 0.00 -0.26 0.00 0.00 58.87 59.15 2yu0 n SER 60 Cb 0.74 -0.99 0.00 0.00 -0.26 0.00 0.00 64.21 63.70 2yu0 n SER 60 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2yu0 n GLY 61 N -0.51 2.82 0.34 5.00 0.00 -1.23 -4.15 105.19 107.46 2yu0 n GLY 61 Ca 0.01 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.13 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 -0.23 0.11 0.99 7.94 0.61 -0.22 117.00 126.20 2yu0 n LEU 62 Ca 0.00 1.63 -0.13 0.00 -1.11 0.00 0.00 56.01 56.40 2yu0 n LEU 62 Cb 0.00 -0.54 -0.06 0.00 0.53 0.00 0.00 43.42 43.35 2yu0 n LEU 62 CO 0.00 -1.61 0.67 1.23 -1.11 0.00 0.00 177.39 176.57 2yu0 h GLY 63 N 0.00 -0.53 0.55 -3.96 0.00 -1.89 0.10 103.07 97.34 2yu0 h GLY 63 Ca 0.52 0.34 0.18 0.00 0.00 0.00 0.00 47.33 48.37 2yu0 h GLY 63 CO -0.94 -0.23 0.53 1.70 0.00 0.00 0.00 176.54 177.60 2yu0 h LYS 64 N -0.50 0.29 0.01 4.80 1.63 -0.93 -1.64 116.57 120.23 2yu0 h LYS 64 Ca 0.03 -0.02 -0.00 0.00 -0.85 0.00 0.00 60.65 59.82 2yu0 h LYS 64 Cb 0.53 -0.07 0.00 0.00 -0.60 0.00 0.00 32.23 32.10 2yu0 h LYS 64 CO -0.18 0.19 -0.00 1.25 -3.45 0.00 0.00 179.45 177.26 2yu0 h LEU 65 N 0.30 -0.01 -0.53 5.20 7.12 -0.39 -2.99 115.31 124.01 2yu0 h LEU 65 Ca 0.39 -0.65 0.11 0.00 0.13 0.00 0.00 57.88 57.85 2yu0 h LEU 65 Cb 1.08 0.00 -0.10 0.00 -0.53 0.00 0.00 40.66 41.11 2yu0 h LEU 65 CO -0.10 0.66 -0.13 0.40 -0.13 0.00 0.00 178.44 179.13 2yu0 h ILE 66 N -0.69 0.47 -0.69 4.05 2.04 0.07 -0.38 117.51 122.39 2yu0 h ILE 66 Ca -0.00 -0.00 0.05 0.00 1.00 0.00 0.00 64.86 65.91 2yu0 h ILE 66 Cb 0.67 0.47 -0.05 0.00 -0.74 0.00 0.00 36.82 37.16 2yu0 h ILE 66 CO 0.00 0.00 0.40 -0.33 0.00 0.00 0.00 178.15 178.23 2yu0 h GLU 67 N 0.00 0.74 -0.63 2.37 5.08 -1.47 -0.98 114.58 119.68 2yu0 h GLU 67 Ca 0.25 -0.04 0.14 0.00 -1.00 0.00 0.00 59.36 58.71 2yu0 h GLU 67 Cb 0.39 -0.17 -0.04 0.00 0.50 0.00 0.00 28.75 29.44 2yu0 h GLU 67 CO -0.54 0.49 0.43 0.35 -1.00 0.00 0.00 179.01 178.74 2yu0 h PHE 68 N 0.76 0.27 0.05 4.33 3.57 -0.92 -0.70 116.94 124.29 2yu0 h PHE 68 Ca 0.30 0.01 -0.27 0.00 3.53 0.00 0.00 57.97 61.53 2yu0 h PHE 68 Cb 0.13 -0.08 0.02 0.00 2.79 0.00 0.00 35.95 38.81 2yu0 h PHE 68 CO -0.06 0.11 -1.11 0.00 -2.23 0.00 0.00 178.31 175.01 2yu0 h GLU 70 N 0.31 -0.31 -0.41 0.00 5.08 -0.48 0.15 114.58 118.91 2yu0 h GLU 70 Ca -0.14 0.02 0.12 0.00 -1.00 0.00 0.00 59.36 58.36 2yu0 h GLU 70 Cb 1.77 0.07 -0.02 0.00 0.50 0.00 0.00 28.75 31.08 2yu0 h GLU 70 CO 0.21 -0.21 0.62 1.05 -1.00 0.00 0.00 179.01 179.69 2yu0 h GLU 71 N -0.32 0.00 -5.30 2.33 4.11 -1.60 -3.38 114.58 110.42 2yu0 h GLU 71 Ca 0.11 0.00 -0.64 0.00 0.07 0.00 0.00 59.36 58.90 2yu0 h GLU 71 Cb 0.48 0.00 -0.21 0.00 0.50 0.00 0.00 28.75 29.52 2yu0 h GLU 71 CO -0.33 0.00 -0.67 0.08 0.07 0.00 0.00 179.01 178.16 2yu0 s VAL 72 N -4.41 3.90 0.30 -1.06 1.01 0.51 -5.00 120.40 115.66 2yu0 s VAL 72 Ca -0.03 -0.35 0.14 0.00 0.00 0.00 0.00 61.98 61.73 2yu0 s VAL 72 Cb 0.12 -2.71 0.08 0.00 0.00 0.00 0.00 36.38 33.87 2yu0 s VAL 72 CO 0.43 0.49 1.76 1.55 0.00 0.00 0.00 175.10 179.33 2yu0 h PRO 73 N 6.69 0.00 0.00 2.72 0.13 -1.76 0.40 132.00 140.17 2yu0 h PRO 73 Ca -0.31 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.82 2yu0 h PRO 73 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 2yu0 h PRO 73 CO 0.63 0.43 0.00 0.00 -0.23 0.00 0.00 178.00 178.83 2yu0 n ALA 74 N -2.41 2.29 -0.02 -0.56 0.00 -1.26 -3.44 120.51 115.11 2yu0 n ALA 74 Ca -0.01 -0.04 0.06 0.00 0.00 0.00 0.00 53.44 53.45 2yu0 n ALA 74 Cb 0.48 -1.47 -0.11 0.00 0.00 0.00 0.00 19.45 18.35 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 -2.13 0.00 -0.16 0.00 4.77 -1.01 -4.57 117.00 113.90 2yu0 n LEU 75 Ca 0.06 0.00 -0.03 0.00 -0.03 0.00 0.00 56.01 56.00 2yu0 n LEU 75 Cb 0.41 0.05 0.03 0.00 -2.33 0.00 0.00 43.42 41.58 2yu0 n LEU 75 CO 0.30 0.05 0.74 0.03 -1.33 0.00 0.00 177.39 177.17 2yu0 h ARG 76 N 0.00 -0.04 -0.13 3.23 3.08 -0.77 0.58 114.38 120.33 2yu0 h ARG 76 Ca -0.05 0.00 0.04 0.00 0.07 0.00 0.00 59.98 60.04 2yu0 h ARG 76 Cb 0.84 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.89 2yu0 h ARG 76 CO 0.00 -0.03 0.24 -0.22 -1.07 0.00 0.00 179.97 178.89 2yu0 h LYS 77 N -0.05 0.00 0.12 0.04 1.63 -1.81 -1.30 116.57 115.21 2yu0 h LYS 77 Ca 0.24 0.00 -0.31 0.00 -0.85 0.00 0.00 60.65 59.73 2yu0 h LYS 77 Cb 0.41 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 32.04 2yu0 h LYS 77 CO -0.54 0.00 -1.60 -0.09 -3.45 0.00 0.00 179.45 173.78 2yu0 h ARG 78 N 0.00 0.26 0.00 1.90 9.65 -0.23 -3.35 114.38 122.62 2yu0 h ARG 78 Ca 0.06 -0.45 0.01 0.00 -1.10 0.00 0.00 59.98 58.51 2yu0 h ARG 78 Cb 0.54 0.17 -0.03 0.00 -1.39 0.00 0.00 29.97 29.26 2yu0 h ARG 78 CO -0.00 1.21 -0.31 0.00 2.80 0.00 0.00 179.97 183.67 2yu0 h ALA 79 N -0.02 -0.76 -0.92 2.80 0.00 0.30 -1.86 119.26 118.79 2yu0 h ALA 79 Ca -0.34 -0.05 0.22 0.00 0.00 0.00 0.00 54.91 54.73 2yu0 h ALA 79 Cb 1.86 0.77 -0.17 0.00 0.00 0.00 0.00 17.79 20.24 2yu0 h ALA 79 CO 0.07 -0.86 -0.08 1.05 0.00 0.00 0.00 179.25 179.43 2yu0 h GLU 80 N -0.40 0.02 -0.73 0.00 -0.00 -1.71 0.60 114.58 112.38 2yu0 h GLU 80 Ca 0.01 -0.00 0.12 0.00 -0.00 0.00 0.00 59.36 59.48 2yu0 h GLU 80 Cb 0.42 -0.01 -0.08 0.00 -0.00 0.00 0.00 28.75 29.08 2yu0 h GLU 80 CO -0.21 0.02 0.33 0.82 -0.00 0.00 0.00 179.01 179.96 2yu0 h ILE 81 N 0.03 0.76 0.00 -1.06 2.04 -1.49 0.34 117.51 118.12 2yu0 h ILE 81 Ca 0.50 -0.18 0.00 0.00 1.00 0.00 0.00 64.86 66.18 2yu0 h ILE 81 Cb 0.91 0.19 0.00 0.00 -0.74 0.00 0.00 36.82 37.18 2yu0 h ILE 81 CO -0.88 0.09 0.00 -0.07 0.00 0.00 0.00 178.15 177.29 2yu0 h LEU 82 N 0.52 0.00 0.21 1.44 3.38 0.80 -3.02 115.31 118.64 2yu0 h LEU 82 Ca 0.38 0.00 -0.35 0.00 0.09 0.00 0.00 57.88 58.00 2yu0 h LEU 82 Cb 0.49 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.26 2yu0 h LEU 82 CO -0.33 0.00 -1.64 0.11 0.09 0.00 0.00 178.44 176.67 2yu0 h LYS 83 N 0.00 0.45 0.06 1.13 1.57 0.88 -2.81 116.57 117.85 2yu0 h LYS 83 Ca 0.00 -0.76 0.03 0.00 -1.87 0.00 0.00 60.65 58.04 2yu0 h LYS 83 Cb 0.49 0.28 -0.04 0.00 0.08 0.00 0.00 32.23 33.04 2yu0 h LYS 83 CO 0.00 1.36 -0.30 -0.22 -0.57 0.00 0.00 179.45 179.72 2yu0 h LYS 84 N 0.12 -0.46 -0.33 3.15 3.64 -0.92 -2.73 116.57 119.04 2yu0 h LYS 84 Ca -0.31 0.03 -0.06 0.00 -1.27 0.00 0.00 60.65 59.04 2yu0 h LYS 84 Cb 2.13 0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 34.04 2yu0 h LYS 84 CO 0.22 -0.31 -0.04 1.05 -2.27 0.00 0.00 179.45 178.10 2yu0 h GLU 85 N -0.48 0.61 -0.78 1.90 4.11 -1.71 -3.25 114.58 114.98 2yu0 h GLU 85 Ca 0.05 -0.21 0.08 0.00 0.07 0.00 0.00 59.36 59.34 2yu0 h GLU 85 Cb 0.54 -0.04 -0.10 0.00 0.50 0.00 0.00 28.75 29.65 2yu0 h GLU 85 CO -0.22 0.76 -0.43 -2.13 0.07 0.00 0.00 179.01 177.06 2yu0 n ARG 86 N -4.48 -0.32 -3.49 1.06 0.63 -1.05 -4.21 116.66 104.80 2yu0 n ARG 86 Ca -0.02 1.18 -0.38 0.00 -0.92 0.00 0.00 57.85 57.71 2yu0 n ARG 86 Cb 0.30 -1.73 -0.06 0.00 0.45 0.00 0.00 32.46 31.42 2yu0 n ARG 86 CO 0.00 0.00 0.00 -1.12 -2.51 0.00 0.00 177.63 174.00 2yu0 s SER 87 N -5.37 6.81 -0.76 6.15 0.01 -1.12 -5.04 113.70 114.38 2yu0 s SER 87 Ca -0.10 0.98 -0.00 0.00 1.31 0.00 0.00 55.95 58.14 2yu0 s SER 87 Cb 0.10 -2.25 0.19 0.00 0.21 0.00 0.00 66.02 64.26 2yu0 s SER 87 CO 0.49 0.30 0.60 -1.83 0.41 0.00 0.00 173.24 173.21 2yu0 s GLU 88 N -1.20 2.84 -1.63 12.44 -1.05 -1.26 -4.78 118.70 124.06 2yu0 s GLU 88 Ca 0.26 -3.05 -0.14 0.00 -0.15 0.00 0.00 54.97 51.89 2yu0 s GLU 88 Cb -0.17 -3.75 0.12 0.00 -0.44 0.00 0.00 34.13 29.89 2yu0 s GLU 88 CO 0.14 -1.23 0.67 0.45 0.95 0.00 0.00 175.26 176.24 2yu0 n SER 89 N 2.62 -2.47 -4.39 0.83 2.88 -1.26 -4.81 113.62 107.02 2yu0 n SER 89 Ca 0.16 -1.02 -0.42 0.00 -1.33 0.00 0.00 58.87 56.27 2yu0 n SER 89 Cb 0.36 -2.78 0.00 0.00 -0.75 0.00 0.00 64.21 61.05 2yu0 n SER 89 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2yu0 n GLY 90 N -1.58 -2.04 3.65 0.46 0.00 -1.26 -4.82 105.19 99.59 2yu0 n GLY 90 Ca -0.03 0.01 -0.43 0.00 0.00 0.00 0.00 46.02 45.58 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 -1.35 4.06 -0.20 1.61 0.04 -1.26 -5.00 135.00 132.89 2yu0 s PRO 91 Ca 0.62 1.89 0.00 0.00 0.04 0.00 0.00 61.00 63.55 2yu0 s PRO 91 Cb -0.61 -3.95 0.05 0.00 0.04 0.00 0.00 34.50 30.02 2yu0 s PRO 91 CO 0.60 -0.97 -0.07 0.45 0.04 0.00 0.00 177.00 177.04 2yu0 s SER 92 N 3.34 3.40 -0.26 6.66 0.15 -1.26 -5.10 113.70 120.63 2yu0 s SER 92 Ca 0.68 -0.93 -0.03 0.00 0.70 0.00 0.00 55.95 56.37 2yu0 s SER 92 Cb -0.28 -1.14 0.02 0.00 -1.71 0.00 0.00 66.02 62.91 2yu0 s SER 92 CO 0.26 -0.18 -0.02 -0.55 1.20 0.00 0.00 173.24 173.95 2yu0 s SER 93 N 1.45 4.54 0.00 5.45 0.15 -1.26 -5.30 113.70 118.73 2yu0 s SER 93 Ca -0.02 -0.76 0.00 0.00 0.70 0.00 0.00 55.95 55.87 2yu0 s SER 93 Cb -0.17 -1.73 0.00 0.00 -1.71 0.00 0.00 66.02 62.41 2yu0 s SER 93 CO -0.07 -0.13 0.00 0.61 1.20 0.00 0.00 173.24 174.84