#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 1.16 -4.59 1.61 3.41 -1.26 -5.00 113.62 108.96 2yu0 n SER 2 Ca 0.00 0.00 -0.41 0.00 -0.26 0.00 0.00 58.87 58.20 2yu0 n SER 2 Cb 0.00 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 63.92 2yu0 n SER 2 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2yu0 s SER 3 N -4.41 5.50 -0.38 4.04 1.04 -1.26 -4.94 113.70 113.29 2yu0 s SER 3 Ca 0.00 1.31 0.04 0.00 0.48 0.00 0.00 55.95 57.78 2yu0 s SER 3 Cb 0.00 -2.52 0.11 0.00 0.10 0.00 0.00 66.02 63.71 2yu0 s SER 3 CO 0.00 -2.02 0.10 -0.83 0.98 0.00 0.00 173.24 171.47 2yu0 s GLY 4 N 7.77 2.05 -1.08 7.32 0.00 -1.26 -5.03 107.32 117.09 2yu0 s GLY 4 Ca 0.86 -2.69 -0.09 0.00 0.00 0.00 0.00 44.72 42.80 2yu0 s GLY 4 CO 0.31 0.96 1.07 -0.56 0.00 0.00 0.00 173.10 174.88 2yu0 s SER 5 N 0.69 7.20 -0.15 1.64 0.01 -1.26 -4.89 113.70 116.94 2yu0 s SER 5 Ca 0.12 -3.56 -0.01 0.00 1.31 0.00 0.00 55.95 53.81 2yu0 s SER 5 Cb -0.21 -2.19 0.05 0.00 0.21 0.00 0.00 66.02 63.88 2yu0 s SER 5 CO -0.06 -0.29 2.27 -1.54 0.41 0.00 0.00 173.24 174.03 2yu0 n SER 6 N 2.74 5.82 -1.89 2.44 3.41 -1.26 -4.66 113.62 120.22 2yu0 n SER 6 Ca 0.23 -2.71 -0.09 0.00 -0.26 0.00 0.00 58.87 56.04 2yu0 n SER 6 Cb 0.39 -1.15 -0.12 0.00 -0.26 0.00 0.00 64.21 63.07 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 1.17 2.79 3.60 5.00 0.00 -1.26 -4.85 105.19 111.63 2yu0 n GLY 7 Ca 0.20 -0.86 -0.34 0.00 0.00 0.00 0.00 46.02 45.02 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 0.83 3.87 0.04 -0.61 1.01 -1.26 -5.11 121.20 119.97 2yu0 s ILE 8 Ca 0.48 -0.41 0.08 0.00 0.00 0.00 0.00 60.65 60.80 2yu0 s ILE 8 Cb 0.23 -2.60 -0.03 0.00 0.01 0.00 0.00 42.46 40.07 2yu0 s ILE 8 CO 0.00 0.59 -0.24 0.54 0.00 0.00 0.00 174.94 175.83 2yu0 s VAL 9 N -0.70 1.92 0.57 2.92 0.11 -1.26 -5.00 120.40 118.96 2yu0 s VAL 9 Ca 0.11 -1.28 0.42 0.00 -2.93 0.00 0.00 61.98 58.30 2yu0 s VAL 9 Cb -0.11 -1.65 0.61 0.00 -1.53 0.00 0.00 36.38 33.70 2yu0 s VAL 9 CO 0.02 0.31 1.59 -0.07 -3.33 0.00 0.00 175.10 173.62 2yu0 h LEU 10 N 4.89 0.00 -0.19 2.54 3.38 -1.99 0.85 115.31 124.79 2yu0 h LEU 10 Ca -0.44 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.48 2yu0 h LEU 10 Cb 1.15 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.89 2yu0 h LEU 10 CO 0.44 0.00 -0.08 0.25 0.09 0.00 0.00 178.44 179.14 2yu0 h LEU 11 N 0.00 0.39 -1.20 1.67 7.12 -1.94 -2.81 115.31 118.55 2yu0 h LEU 11 Ca 0.73 -0.40 0.05 0.00 0.13 0.00 0.00 57.88 58.39 2yu0 h LEU 11 Cb 3.15 -0.11 -0.01 0.00 -0.53 0.00 0.00 40.66 43.16 2yu0 h LEU 11 CO -0.01 0.71 0.68 -0.09 -0.13 0.00 0.00 178.44 179.60 2yu0 h ARG 12 N 0.08 0.00 -0.84 1.25 2.43 0.33 -1.96 114.38 115.68 2yu0 h ARG 12 Ca 0.04 0.00 0.24 0.00 -0.81 0.00 0.00 59.98 59.46 2yu0 h ARG 12 Cb 0.55 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 30.07 2yu0 h ARG 12 CO 0.03 0.00 1.18 0.41 -1.51 0.00 0.00 179.97 180.07 2yu0 n GLY 13 N -1.41 -0.71 0.05 2.80 0.00 -1.06 -0.37 105.19 104.49 2yu0 n GLY 13 Ca 0.03 0.29 -0.03 0.00 0.00 0.00 0.00 46.02 46.31 2yu0 n GLY 13 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2yu0 n LEU 14 N -3.09 1.20 0.32 0.99 4.77 -0.74 -4.20 117.00 116.26 2yu0 n LEU 14 Ca 0.19 0.46 0.11 0.00 -0.03 0.00 0.00 56.01 56.74 2yu0 n LEU 14 Cb 1.43 -0.73 0.59 0.00 -2.33 0.00 0.00 43.42 42.38 2yu0 n LEU 14 CO 0.19 -0.46 1.07 -0.08 -1.33 0.00 0.00 177.39 176.78 2yu0 h GLU 15 N -0.66 0.00 0.58 3.23 4.22 -1.38 -1.72 114.58 118.85 2yu0 h GLU 15 Ca 0.00 0.00 -0.03 0.00 0.08 0.00 0.00 59.36 59.41 2yu0 h GLU 15 Cb 0.39 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.64 2yu0 h GLU 15 CO 0.00 0.00 -0.28 0.00 -2.18 0.00 0.00 179.01 176.55 2yu0 s ILE 17 N -4.35 2.34 0.78 0.00 -4.36 -0.65 -4.95 121.20 110.01 2yu0 s ILE 17 Ca -0.11 0.28 -0.15 0.00 -0.26 0.00 0.00 60.65 60.40 2yu0 s ILE 17 Cb 0.01 -3.18 0.02 0.00 1.25 0.00 0.00 42.46 40.56 2yu0 s ILE 17 CO 0.34 0.04 0.84 0.59 0.24 0.00 0.00 174.94 177.00 2yu0 n ASN 18 N 2.59 -0.15 0.29 4.36 4.13 -1.26 -4.52 115.26 120.70 2yu0 n ASN 18 Ca 0.09 0.58 0.12 0.00 1.68 0.00 0.00 54.58 57.05 2yu0 n ASN 18 Cb 0.38 -1.36 0.63 0.00 -1.54 0.00 0.00 39.78 37.90 2yu0 n ASN 18 CO 0.00 0.00 0.00 0.50 0.28 0.00 0.00 177.26 178.04 2yu0 h LYS 19 N -0.64 0.00 0.10 3.52 1.63 -1.93 -0.29 116.57 118.96 2yu0 h LYS 19 Ca -0.46 0.00 -0.00 0.00 -0.85 0.00 0.00 60.65 59.34 2yu0 h LYS 19 Cb 1.32 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.95 2yu0 h LYS 19 CO 0.44 0.00 -0.05 1.25 -3.45 0.00 0.00 179.45 177.64 2yu0 h HIS 20 N 0.00 -0.12 -0.02 1.91 2.76 -2.01 -2.44 115.15 115.22 2yu0 h HIS 20 Ca 0.00 -0.00 -0.24 0.00 -2.20 0.00 0.00 60.37 57.93 2yu0 h HIS 20 Cb 0.76 0.04 0.02 0.00 1.55 0.00 0.00 27.41 29.78 2yu0 h HIS 20 CO 0.00 0.21 -0.92 1.88 -1.30 0.00 0.00 177.93 177.80 2yu0 h TYR 21 N -0.47 0.97 -0.67 5.26 0.05 -1.40 -3.28 116.97 117.43 2yu0 h TYR 21 Ca -0.01 -0.51 0.12 0.00 0.05 0.00 0.00 58.73 58.37 2yu0 h TYR 21 Cb 0.39 -0.12 -0.09 0.00 1.01 0.00 0.00 36.73 37.92 2yu0 h TYR 21 CO 0.03 1.35 0.23 0.35 -1.05 0.00 0.00 178.16 179.07 2yu0 h PHE 22 N 0.32 0.39 -1.00 4.88 3.57 -1.38 0.43 116.94 124.15 2yu0 h PHE 22 Ca -0.11 0.03 0.24 0.00 3.53 0.00 0.00 57.97 61.67 2yu0 h PHE 22 Cb 1.58 -0.07 -0.08 0.00 2.79 0.00 0.00 35.95 40.17 2yu0 h PHE 22 CO 0.11 0.04 0.65 1.03 -2.23 0.00 0.00 178.31 177.91 2yu0 h SER 23 N 0.38 0.45 -0.26 0.41 0.87 -1.49 0.98 113.55 114.90 2yu0 h SER 23 Ca 0.36 0.07 -0.13 0.00 -1.23 0.00 0.00 61.79 60.86 2yu0 h SER 23 Cb 0.52 -0.01 -0.00 0.00 -0.44 0.00 0.00 62.40 62.47 2yu0 h SER 23 CO -0.38 0.13 -0.34 -0.07 -0.53 0.00 0.00 176.83 175.63 2yu0 h LEU 24 N 0.42 0.75 -0.63 2.23 4.07 -1.05 -2.99 115.31 118.11 2yu0 h LEU 24 Ca 0.55 -0.50 0.06 0.00 0.08 0.00 0.00 57.88 58.07 2yu0 h LEU 24 Cb 1.36 -0.21 -0.05 0.00 1.08 0.00 0.00 40.66 42.84 2yu0 h LEU 24 CO -0.26 1.10 0.34 0.15 -1.08 0.00 0.00 178.44 178.70 2yu0 h PHE 25 N 0.41 0.63 -0.09 1.13 3.57 -0.52 -0.87 116.94 121.19 2yu0 h PHE 25 Ca 0.03 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.53 2yu0 h PHE 25 Cb 0.92 -0.19 -0.01 0.00 2.79 0.00 0.00 35.95 39.47 2yu0 h PHE 25 CO 0.08 0.30 -0.05 0.87 -2.23 0.00 0.00 178.31 177.28 2yu0 h LYS 26 N 0.64 0.13 -0.22 1.11 1.57 -1.35 -1.64 116.57 116.80 2yu0 h LYS 26 Ca 0.28 -0.02 -0.10 0.00 -1.87 0.00 0.00 60.65 58.94 2yu0 h LYS 26 Cb 0.18 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.45 2yu0 h LYS 26 CO -0.18 0.19 -0.31 1.03 -0.57 0.00 0.00 179.45 179.61 2yu0 h SER 27 N 0.13 0.45 1.25 0.86 0.87 -1.01 0.84 113.55 116.93 2yu0 h SER 27 Ca 0.03 -0.17 -0.14 0.00 -1.23 0.00 0.00 61.79 60.28 2yu0 h SER 27 Cb 0.18 -0.12 -0.02 0.00 -0.44 0.00 0.00 62.40 62.00 2yu0 h SER 27 CO 0.01 0.74 -0.68 -0.07 -0.53 0.00 0.00 176.83 176.30 2yu0 h LEU 28 N 0.38 0.00 0.00 2.23 3.38 -0.94 -3.26 115.31 117.10 2yu0 h LEU 28 Ca 0.05 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.95 2yu0 h LEU 28 Cb 0.74 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.47 2yu0 h LEU 28 CO 0.06 0.68 -1.40 0.18 0.09 0.00 0.00 178.44 178.05 2yu0 n LEU 29 N -3.30 0.64 -0.25 1.67 7.99 -0.70 -4.34 117.00 118.71 2yu0 n LEU 29 Ca 0.01 0.26 0.10 0.00 -0.01 0.00 0.00 56.01 56.37 2yu0 n LEU 29 Cb 0.79 0.02 0.19 0.00 -0.11 0.00 0.00 43.42 44.32 2yu0 n LEU 29 CO 0.43 -0.01 0.55 0.00 -1.51 0.00 0.00 177.39 176.84 2yu0 n ALA 30 N -2.29 0.33 0.01 -1.18 0.00 0.29 0.14 120.51 117.81 2yu0 n ALA 30 Ca -0.06 0.76 -0.13 0.00 0.00 0.00 0.00 53.44 54.02 2yu0 n ALA 30 Cb 0.67 -0.54 -0.09 0.00 0.00 0.00 0.00 19.45 19.50 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 -0.00 0.66 0.00 -0.00 -1.79 0.77 114.38 114.00 2yu0 h ARG 31 Ca 0.41 0.00 -0.03 0.00 -0.00 0.00 0.00 59.98 60.36 2yu0 h ARG 31 Cb 0.82 0.00 0.01 0.00 -0.00 0.00 0.00 29.97 30.80 2yu0 h ARG 31 CO -0.67 0.25 -0.31 -0.44 -0.00 0.00 0.00 179.97 178.80 2yu0 h ASP 32 N -0.26 -0.75 0.00 0.08 5.19 0.96 -2.88 116.42 118.77 2yu0 h ASP 32 Ca -0.00 0.03 0.00 0.00 -0.62 0.00 0.00 57.03 56.44 2yu0 h ASP 32 Cb 0.26 0.19 0.00 0.00 0.18 0.00 0.00 39.33 39.96 2yu0 h ASP 32 CO 0.00 -0.43 0.00 0.18 -3.12 0.00 0.00 179.24 175.87 2yu0 n LEU 33 N -4.92 0.00 -4.20 1.55 4.77 0.22 -4.85 117.00 109.57 2yu0 n LEU 33 Ca -0.11 0.00 -0.36 0.00 -0.03 0.00 0.00 56.01 55.51 2yu0 n LEU 33 Cb 0.35 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.41 2yu0 n LEU 33 CO 0.26 0.00 -0.01 -0.46 -1.33 0.00 0.00 177.39 175.85 2yu0 n ASN 34 N -0.92 -3.48 -3.18 -1.43 6.94 0.24 -4.91 115.26 108.52 2yu0 n ASN 34 Ca 0.13 -0.99 -0.15 0.00 -0.02 0.00 0.00 54.58 53.56 2yu0 n ASN 34 Cb 0.06 -2.84 0.15 0.00 -2.36 0.00 0.00 39.78 34.79 2yu0 n ASN 34 CO 0.00 0.00 0.00 0.18 -1.03 0.00 0.00 177.26 176.41 2yu0 n LEU 35 N -4.40 0.00 -4.81 -4.53 4.77 0.54 -4.98 117.00 103.60 2yu0 n LEU 35 Ca 0.08 -0.43 -0.30 0.00 -0.03 0.00 0.00 56.01 55.33 2yu0 n LEU 35 Cb 0.49 -0.54 0.20 0.00 -2.33 0.00 0.00 43.42 41.24 2yu0 n LEU 35 CO 0.85 -2.19 0.78 -1.61 -1.33 0.00 0.00 177.39 173.90 2yu0 s GLU 36 N -3.73 0.05 -0.18 3.23 8.01 -1.26 -4.94 118.70 119.89 2yu0 s GLU 36 Ca 0.33 -0.26 -0.19 0.00 0.01 0.00 0.00 54.97 54.86 2yu0 s GLU 36 Cb -0.06 -1.76 -0.16 0.00 -4.31 0.00 0.00 34.13 27.84 2yu0 s GLU 36 CO 0.28 -2.83 0.19 0.00 0.01 0.00 0.00 175.26 172.90 2yu0 h ARG 37 N -1.94 0.00 0.00 1.61 -0.00 -1.99 -3.42 114.38 108.63 2yu0 h ARG 37 Ca -0.45 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.03 2yu0 h ARG 37 Cb 1.26 0.00 0.00 0.00 0.00 0.00 0.00 29.97 31.23 2yu0 h ARG 37 CO 0.38 0.76 0.00 -0.25 0.00 0.00 0.00 179.97 180.86 2yu0 n ASP 38 N -4.50 0.57 -2.10 7.04 8.00 -1.26 -4.68 116.55 119.62 2yu0 n ASP 38 Ca -0.23 -0.80 -0.25 0.00 0.71 0.00 0.00 54.79 54.21 2yu0 n ASP 38 Cb 0.55 0.32 0.14 0.00 -0.02 0.00 0.00 41.12 42.10 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 -0.32 5.07 0.01 -2.24 5.15 -1.26 -4.44 115.26 117.23 2yu0 n ASN 39 Ca 0.00 -3.71 0.13 0.00 -0.60 0.00 0.00 54.58 50.40 2yu0 n ASN 39 Cb 0.02 -0.83 0.39 0.00 -0.53 0.00 0.00 39.78 38.83 2yu0 n ASN 39 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2yu0 n GLN 40 N -1.03 0.05 -0.05 1.20 6.02 -1.26 -3.95 117.38 118.35 2yu0 n GLN 40 Ca 0.56 0.02 -0.16 0.00 -0.01 0.00 0.00 57.00 57.42 2yu0 n GLN 40 Cb 1.17 -1.54 -0.13 0.00 1.02 0.00 0.00 30.24 30.76 2yu0 n GLN 40 CO 0.00 0.00 0.00 0.93 -1.01 0.00 0.00 177.06 176.98 2yu0 h GLU 41 N 0.00 0.06 -1.10 -1.09 5.08 -1.98 -3.29 114.58 112.27 2yu0 h GLU 41 Ca 0.00 -0.11 0.32 0.00 -1.00 0.00 0.00 59.36 58.57 2yu0 h GLU 41 Cb 0.54 0.04 -0.04 0.00 0.50 0.00 0.00 28.75 29.79 2yu0 h GLU 41 CO 0.00 1.05 0.98 -0.56 -1.00 0.00 0.00 179.01 179.49 2yu0 h GLN 42 N -0.86 0.00 -7.31 2.33 3.07 -1.91 -3.40 115.11 107.03 2yu0 h GLN 42 Ca -0.06 0.00 -0.51 0.00 0.09 0.00 0.00 58.65 58.17 2yu0 h GLN 42 Cb 1.16 0.00 0.14 0.00 0.08 0.00 0.00 27.48 28.86 2yu0 h GLN 42 CO 0.02 0.00 0.31 0.71 0.09 0.00 0.00 178.83 179.95 2yu0 s TYR 43 N -4.69 2.50 0.17 0.06 2.02 -1.24 -5.07 117.35 111.10 2yu0 s TYR 43 Ca -0.04 1.54 0.03 0.00 -0.37 0.00 0.00 57.07 58.24 2yu0 s TYR 43 Cb 0.19 -3.07 -0.05 0.00 -0.40 0.00 0.00 41.96 38.63 2yu0 s TYR 43 CO 0.65 -1.91 -0.05 0.95 -1.57 0.00 0.00 175.55 173.62 2yu0 s THR 44 N -2.89 0.97 0.63 -0.71 -4.23 -1.26 -5.01 115.64 103.15 2yu0 s THR 44 Ca 0.62 -2.02 0.26 0.00 -1.18 0.00 0.00 61.69 59.36 2yu0 s THR 44 Cb -0.18 -2.03 0.30 0.00 1.34 0.00 0.00 72.50 71.93 2yu0 s THR 44 CO 0.56 -0.58 1.76 0.71 -0.54 0.00 0.00 174.62 176.54 2yu0 h THR 45 N 2.69 0.13 0.03 3.99 1.35 -1.97 -1.72 112.91 117.41 2yu0 h THR 45 Ca -0.37 0.00 -0.00 0.00 -0.55 0.00 0.00 66.41 65.49 2yu0 h THR 45 Cb 1.20 0.52 0.00 0.00 -1.73 0.00 0.00 68.15 68.15 2yu0 h THR 45 CO 0.64 0.00 -0.01 0.40 -0.25 0.00 0.00 175.52 176.29 2yu0 h ILE 46 N 0.00 0.00 -0.97 6.82 1.08 -1.99 -1.86 117.51 120.59 2yu0 h ILE 46 Ca 0.11 -0.09 0.28 0.00 -0.39 0.00 0.00 64.86 64.78 2yu0 h ILE 46 Cb 1.17 0.00 -0.14 0.00 -3.07 0.00 0.00 36.82 34.78 2yu0 h ILE 46 CO -0.00 0.00 0.51 1.56 -0.69 0.00 0.00 178.15 179.53 2yu0 h GLN 47 N -0.12 0.36 -0.37 2.37 4.20 -1.86 0.30 115.11 119.98 2yu0 h GLN 47 Ca -0.00 -0.02 -0.10 0.00 0.06 0.00 0.00 58.65 58.59 2yu0 h GLN 47 Cb 0.03 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 27.72 2yu0 h GLN 47 CO 0.01 0.24 -0.15 0.82 -0.67 0.00 0.00 178.83 179.07 2yu0 h ILE 48 N 0.37 1.28 0.12 2.54 1.08 -1.45 -2.81 117.51 118.64 2yu0 h ILE 48 Ca 0.67 -1.26 0.02 0.00 -0.39 0.00 0.00 64.86 63.90 2yu0 h ILE 48 Cb 1.44 1.32 -0.05 0.00 -3.07 0.00 0.00 36.82 36.46 2yu0 h ILE 48 CO -0.58 0.42 -0.41 0.00 -0.69 0.00 0.00 178.15 176.88 2yu0 h ALA 49 N 0.81 -0.73 -0.79 1.87 0.00 0.46 -1.74 119.26 119.13 2yu0 h ALA 49 Ca 0.09 -0.07 0.11 0.00 0.00 0.00 0.00 54.91 55.03 2yu0 h ALA 49 Cb 0.69 0.69 -0.08 0.00 0.00 0.00 0.00 17.79 19.09 2yu0 h ALA 49 CO 0.05 -0.98 0.41 -0.91 0.00 0.00 0.00 179.25 177.82 2yu0 h ASN 50 N -0.65 0.54 -0.80 0.00 2.35 -1.44 0.84 115.58 116.42 2yu0 h ASN 50 Ca 0.02 0.07 0.11 0.00 -0.55 0.00 0.00 56.30 55.95 2yu0 h ASN 50 Cb 0.67 -0.03 -0.06 0.00 0.05 0.00 0.00 38.32 38.96 2yu0 h ASN 50 CO -0.24 0.29 0.52 0.24 -1.65 0.00 0.00 177.43 176.59 2yu0 h MET 51 N 0.66 0.65 0.10 0.81 2.86 -1.10 -2.29 114.93 116.63 2yu0 h MET 51 Ca 0.40 -0.04 -0.15 0.00 -2.06 0.00 0.00 59.70 57.84 2yu0 h MET 51 Cb 0.45 -0.15 0.02 0.00 0.06 0.00 0.00 31.60 31.98 2yu0 h MET 51 CO -0.29 0.43 -0.66 0.52 1.06 0.00 0.00 176.91 177.97 2yu0 h MET 52 N 0.67 0.28 -0.84 1.72 2.86 -0.19 -2.38 114.93 117.06 2yu0 h MET 52 Ca 0.38 -0.43 0.17 0.00 -2.06 0.00 0.00 59.70 57.76 2yu0 h MET 52 Cb 0.55 0.15 -0.16 0.00 0.06 0.00 0.00 31.60 32.21 2yu0 h MET 52 CO -0.15 1.18 -0.20 0.93 1.06 0.00 0.00 176.91 179.73 2yu0 h GLU 53 N -0.40 0.00 0.05 1.72 5.08 -0.36 0.87 114.58 121.54 2yu0 h GLU 53 Ca -0.11 -0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.25 2yu0 h GLU 53 Cb 1.48 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.73 2yu0 h GLU 53 CO 0.12 0.00 -0.03 1.05 -1.00 0.00 0.00 179.01 179.16 2yu0 h GLU 54 N 0.00 -0.07 0.10 2.33 -0.00 -1.60 -3.13 114.58 112.21 2yu0 h GLU 54 Ca 0.41 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 59.77 2yu0 h GLU 54 Cb 0.62 0.02 -0.02 0.00 -0.00 0.00 0.00 28.75 29.37 2yu0 h GLU 54 CO -0.86 0.53 -0.24 -0.22 -0.00 0.00 0.00 179.01 178.22 2yu0 h LYS 55 N -0.89 -0.36 -3.45 1.06 1.63 -0.81 -3.31 116.57 110.44 2yu0 h LYS 55 Ca -0.01 0.02 -0.73 0.00 -0.85 0.00 0.00 60.65 59.08 2yu0 h LYS 55 Cb 0.63 0.08 -0.33 0.00 -0.60 0.00 0.00 32.23 32.02 2yu0 h LYS 55 CO 0.01 -0.24 0.02 -0.06 -3.45 0.00 0.00 179.45 175.73 2yu0 s PHE 56 N -4.26 3.91 -2.00 1.91 0.08 0.30 -4.87 117.98 113.05 2yu0 s PHE 56 Ca -0.08 -2.82 0.15 0.00 0.12 0.00 0.00 56.93 54.31 2yu0 s PHE 56 Cb 0.02 -3.43 0.92 0.00 -0.57 0.00 0.00 43.02 39.97 2yu0 s PHE 56 CO 0.27 -0.82 1.34 -0.35 -0.10 0.00 0.00 175.22 175.56 2yu0 n PRO 57 N 2.70 0.48 0.09 0.24 -0.04 -1.18 -0.05 135.00 137.24 2yu0 n PRO 57 Ca 0.20 0.00 -0.06 0.00 -0.04 0.00 0.00 63.50 63.59 2yu0 n PRO 57 Cb 0.38 -1.50 -0.04 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 h ALA 58 N 2.96 -0.32 0.00 0.55 0.00 -1.89 -3.40 119.26 117.15 2yu0 h ALA 58 Ca 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.80 2yu0 h ALA 58 Cb 0.00 0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.92 2yu0 h ALA 58 CO 0.00 -0.32 0.00 -0.25 0.00 0.00 0.00 179.25 178.68 2yu0 n ASP 59 N -4.99 0.56 -2.63 0.00 8.00 -1.22 -5.00 116.55 111.27 2yu0 n ASP 59 Ca -0.05 -0.78 -0.20 0.00 0.71 0.00 0.00 54.79 54.47 2yu0 n ASP 59 Cb 0.17 0.41 0.00 0.00 -0.02 0.00 0.00 41.12 41.68 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 -0.41 -5.48 0.00 -2.24 7.64 0.92 -1.03 113.62 113.02 2yu0 n SER 60 Ca 0.00 -0.07 0.00 0.00 1.01 0.00 0.00 58.87 59.81 2yu0 n SER 60 Cb 0.00 -4.54 0.00 0.00 -1.01 0.00 0.00 64.21 58.67 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 -1.12 3.07 0.32 0.23 0.00 -1.26 -4.29 105.19 102.14 2yu0 n GLY 61 Ca -0.18 0.00 0.15 0.00 0.00 0.00 0.00 46.02 45.99 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 -0.20 0.40 0.99 5.85 -1.36 0.20 115.31 121.19 2yu0 h LEU 62 Ca 0.00 0.24 -0.02 0.00 0.84 0.00 0.00 57.88 58.94 2yu0 h LEU 62 Cb 0.00 0.37 0.00 0.00 0.37 0.00 0.00 40.66 41.40 2yu0 h LEU 62 CO 0.00 -0.27 -0.19 1.23 -0.34 0.00 0.00 178.44 178.87 2yu0 h GLY 63 N 0.09 -0.55 -0.67 3.75 0.00 -1.91 -1.46 103.07 102.32 2yu0 h GLY 63 Ca 0.59 0.21 0.36 0.00 0.00 0.00 0.00 47.33 48.49 2yu0 h GLY 63 CO -0.78 -0.20 0.80 1.70 0.00 0.00 0.00 176.54 178.05 2yu0 h LYS 64 N -0.92 0.19 0.31 4.80 1.63 -1.78 -0.99 116.57 119.82 2yu0 h LYS 64 Ca -0.05 -0.01 -0.02 0.00 -0.85 0.00 0.00 60.65 59.72 2yu0 h LYS 64 Cb 0.41 -0.04 0.00 0.00 -0.60 0.00 0.00 32.23 32.00 2yu0 h LYS 64 CO 0.09 0.13 -0.15 1.25 -3.45 0.00 0.00 179.45 177.32 2yu0 h LEU 65 N 0.20 -0.36 -0.74 5.20 7.12 -0.64 -3.21 115.31 122.87 2yu0 h LEU 65 Ca 0.71 -0.08 0.15 0.00 0.13 0.00 0.00 57.88 58.79 2yu0 h LEU 65 Cb 2.15 0.09 -0.14 0.00 -0.53 0.00 0.00 40.66 42.23 2yu0 h LEU 65 CO -0.32 0.11 -0.18 -0.38 -0.13 0.00 0.00 178.44 177.55 2yu0 n ILE 66 N -5.06 -0.31 -0.14 4.05 5.41 -0.40 0.19 119.36 123.09 2yu0 n ILE 66 Ca -0.07 1.70 -0.05 0.00 1.00 0.00 0.00 62.75 65.33 2yu0 n ILE 66 Cb 0.21 -2.36 0.04 0.00 -0.71 0.00 0.00 39.64 36.82 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 0.42 -0.66 0.38 4.39 -1.57 -1.05 114.58 116.48 2yu0 h GLU 67 Ca 0.36 -0.03 0.18 0.00 0.34 0.00 0.00 59.36 60.22 2yu0 h GLU 67 Cb 0.56 -0.09 -0.03 0.00 -0.10 0.00 0.00 28.75 29.09 2yu0 h GLU 67 CO -0.76 0.28 0.47 0.35 -1.16 0.00 0.00 179.01 178.19 2yu0 h PHE 68 N 0.43 0.07 0.00 4.33 3.57 0.20 0.37 116.94 125.91 2yu0 h PHE 68 Ca 0.20 0.00 -0.11 0.00 3.53 0.00 0.00 57.97 61.59 2yu0 h PHE 68 Cb 0.12 -0.02 -0.02 0.00 2.79 0.00 0.00 35.95 38.82 2yu0 h PHE 68 CO -0.11 0.02 -0.54 0.00 -2.23 0.00 0.00 178.31 175.46 2yu0 h GLU 70 N 0.00 -0.81 -1.37 0.00 5.08 0.05 -2.35 114.58 115.19 2yu0 h GLU 70 Ca -0.01 0.06 0.40 0.00 -1.00 0.00 0.00 59.36 58.81 2yu0 h GLU 70 Cb 1.23 0.18 -0.05 0.00 0.50 0.00 0.00 28.75 30.61 2yu0 h GLU 70 CO 0.07 -0.54 1.26 -0.85 -1.00 0.00 0.00 179.01 177.94 2yu0 n GLU 71 N -4.73 0.01 -3.95 2.33 0.28 -1.13 -3.87 120.64 109.57 2yu0 n GLU 71 Ca -0.10 1.00 -0.35 0.00 -0.16 0.00 0.00 57.16 57.54 2yu0 n GLU 71 Cb 0.33 -2.42 -0.12 0.00 1.43 0.00 0.00 31.44 30.66 2yu0 n GLU 71 CO 0.00 0.00 0.00 0.08 -0.16 0.00 0.00 177.13 177.05 2yu0 s VAL 72 N -4.51 4.12 0.13 3.84 1.01 -1.07 -4.98 120.40 118.94 2yu0 s VAL 72 Ca -0.03 -0.25 0.34 0.00 0.00 0.00 0.00 61.98 62.03 2yu0 s VAL 72 Cb 0.18 -2.88 0.39 0.00 0.00 0.00 0.00 36.38 34.07 2yu0 s VAL 72 CO 0.61 0.40 2.00 1.55 0.00 0.00 0.00 175.10 179.66 2yu0 h PRO 73 N 7.71 0.00 0.00 2.72 0.13 -1.78 -0.39 132.00 140.39 2yu0 h PRO 73 Ca -0.37 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.76 2yu0 h PRO 73 Cb 1.18 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.30 2yu0 h PRO 73 CO 0.61 0.01 -0.17 0.00 -0.23 0.00 0.00 178.00 178.21 2yu0 h ALA 74 N 1.99 0.91 0.00 -0.56 0.00 -1.91 -3.29 119.26 116.40 2yu0 h ALA 74 Ca -0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2yu0 h ALA 74 Cb 0.50 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.28 2yu0 h ALA 74 CO 0.00 0.02 -1.53 1.28 0.00 0.00 0.00 179.25 179.02 2yu0 n LEU 75 N -3.04 0.15 0.06 0.00 4.77 -0.98 -4.42 117.00 113.55 2yu0 n LEU 75 Ca 0.03 -0.10 0.21 0.00 -0.03 0.00 0.00 56.01 56.12 2yu0 n LEU 75 Cb 0.54 0.00 0.72 0.00 -2.33 0.00 0.00 43.42 42.35 2yu0 n LEU 75 CO 0.35 0.04 1.19 0.03 -1.33 0.00 0.00 177.39 177.67 2yu0 h ARG 76 N 0.00 0.00 -0.42 3.23 3.08 -0.54 0.30 114.38 120.03 2yu0 h ARG 76 Ca 0.00 0.00 -0.05 0.00 0.07 0.00 0.00 59.98 60.00 2yu0 h ARG 76 Cb 0.66 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.69 2yu0 h ARG 76 CO 0.00 0.00 0.06 -0.22 -1.07 0.00 0.00 179.97 178.74 2yu0 h LYS 77 N 0.00 0.64 0.11 0.04 3.64 -1.77 -2.91 116.57 116.31 2yu0 h LYS 77 Ca 0.22 -0.13 -0.17 0.00 -1.27 0.00 0.00 60.65 59.31 2yu0 h LYS 77 Cb 1.26 -0.10 0.01 0.00 -0.41 0.00 0.00 32.23 33.00 2yu0 h LYS 77 CO -0.00 0.61 -0.78 0.00 -2.27 0.00 0.00 179.45 177.01 2yu0 h ARG 78 N 0.61 0.23 -0.90 1.90 2.47 -0.72 -3.31 114.38 114.67 2yu0 h ARG 78 Ca 0.14 -0.40 0.25 0.00 -1.26 0.00 0.00 59.98 58.71 2yu0 h ARG 78 Cb 0.29 0.15 -0.15 0.00 -1.65 0.00 0.00 29.97 28.61 2yu0 h ARG 78 CO 0.00 1.19 0.24 0.00 0.56 0.00 0.00 179.97 181.96 2yu0 h ALA 79 N 0.03 1.33 -0.28 0.04 0.00 -1.38 0.92 119.26 119.93 2yu0 h ALA 79 Ca -0.15 0.24 -0.05 0.00 0.00 0.00 0.00 54.91 54.95 2yu0 h ALA 79 Cb 1.54 0.35 -0.02 0.00 0.00 0.00 0.00 17.79 19.67 2yu0 h ALA 79 CO 0.10 -0.51 -0.05 1.05 0.00 0.00 0.00 179.25 179.85 2yu0 h GLU 80 N 0.18 0.43 -0.18 0.00 4.11 -1.63 -0.25 114.58 117.24 2yu0 h GLU 80 Ca 0.58 -0.10 -0.20 0.00 0.07 0.00 0.00 59.36 59.72 2yu0 h GLU 80 Cb 1.20 -0.06 0.01 0.00 0.50 0.00 0.00 28.75 30.39 2yu0 h GLU 80 CO -0.69 0.50 -0.65 0.82 0.07 0.00 0.00 179.01 179.06 2yu0 h ILE 81 N 0.41 1.29 0.33 -1.06 2.04 0.68 -2.71 117.51 118.49 2yu0 h ILE 81 Ca 0.09 -1.86 -0.02 0.00 1.00 0.00 0.00 64.86 64.07 2yu0 h ILE 81 Cb 0.35 1.92 0.00 0.00 -0.74 0.00 0.00 36.82 38.36 2yu0 h ILE 81 CO 0.02 0.59 -0.16 -0.07 0.00 0.00 0.00 178.15 178.52 2yu0 h LEU 82 N 0.49 -0.38 -0.62 1.44 3.38 -0.63 -3.26 115.31 115.73 2yu0 h LEU 82 Ca -0.03 -0.17 0.13 0.00 0.09 0.00 0.00 57.88 57.90 2yu0 h LEU 82 Cb 1.28 0.10 -0.11 0.00 0.09 0.00 0.00 40.66 42.02 2yu0 h LEU 82 CO 0.14 0.04 -0.02 0.11 0.09 0.00 0.00 178.44 178.80 2yu0 h LYS 83 N -0.89 0.10 -1.00 1.13 1.57 -1.16 0.03 116.57 116.35 2yu0 h LYS 83 Ca -0.05 -0.01 0.34 0.00 -1.87 0.00 0.00 60.65 59.07 2yu0 h LYS 83 Cb 0.53 -0.02 -0.18 0.00 0.08 0.00 0.00 32.23 32.63 2yu0 h LYS 83 CO 0.08 0.06 0.26 -0.22 -0.57 0.00 0.00 179.45 179.06 2yu0 h LYS 84 N 0.10 0.01 0.04 3.15 1.63 -1.52 0.28 116.57 120.25 2yu0 h LYS 84 Ca 0.32 -0.00 -0.09 0.00 -0.85 0.00 0.00 60.65 60.02 2yu0 h LYS 84 Cb 0.51 -0.00 0.01 0.00 -0.60 0.00 0.00 32.23 32.15 2yu0 h LYS 84 CO -0.54 0.01 -0.39 0.93 -3.45 0.00 0.00 179.45 176.00 2yu0 h GLU 85 N 0.01 0.20 -1.01 1.90 4.39 -1.10 -3.29 114.58 115.68 2yu0 h GLU 85 Ca 0.71 -0.27 0.26 0.00 0.34 0.00 0.00 59.36 60.41 2yu0 h GLU 85 Cb 1.68 0.09 -0.13 0.00 -0.10 0.00 0.00 28.75 30.29 2yu0 h GLU 85 CO -0.85 1.04 0.59 -0.09 -1.16 0.00 0.00 179.01 178.55 2yu0 h ARG 86 N -0.52 0.50 -6.29 2.33 2.43 0.31 -3.39 114.38 109.77 2yu0 h ARG 86 Ca -0.06 -0.03 -0.54 0.00 -0.81 0.00 0.00 59.98 58.54 2yu0 h ARG 86 Cb 1.21 -0.11 -0.00 0.00 -0.42 0.00 0.00 29.97 30.65 2yu0 h ARG 86 CO 0.08 0.33 1.12 0.45 -1.51 0.00 0.00 179.97 180.43 2yu0 s SER 87 N -5.13 6.62 -0.54 -3.80 0.15 0.01 -4.95 113.70 106.06 2yu0 s SER 87 Ca -0.10 2.33 0.04 0.00 0.70 0.00 0.00 55.95 58.92 2yu0 s SER 87 Cb 0.28 -2.53 0.16 0.00 -1.71 0.00 0.00 66.02 62.22 2yu0 s SER 87 CO 0.80 -0.95 0.38 -1.61 1.20 0.00 0.00 173.24 173.05 2yu0 s GLU 88 N 4.11 1.66 -1.72 5.44 2.02 -1.26 -4.87 118.70 124.08 2yu0 s GLU 88 Ca 0.77 -2.60 -0.15 0.00 0.02 0.00 0.00 54.97 53.00 2yu0 s GLU 88 Cb -0.35 -2.51 0.15 0.00 0.10 0.00 0.00 34.13 31.51 2yu0 s GLU 88 CO 0.32 -1.28 0.54 0.43 0.02 0.00 0.00 175.26 175.29 2yu0 n SER 89 N 2.67 -1.67 -4.84 -0.19 7.64 -1.26 -4.92 113.62 111.04 2yu0 n SER 89 Ca 0.20 -1.15 -0.21 0.00 1.01 0.00 0.00 58.87 58.71 2yu0 n SER 89 Cb 0.39 -2.14 -0.04 0.00 -1.01 0.00 0.00 64.21 61.41 2yu0 n SER 89 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2yu0 s GLY 90 N -3.58 1.65 -1.06 0.23 0.00 -1.26 -5.02 107.32 98.28 2yu0 s GLY 90 Ca 0.57 -1.57 -0.24 0.00 0.00 0.00 0.00 44.72 43.48 2yu0 s GLY 90 CO 0.98 -1.54 1.94 2.56 0.00 0.00 0.00 173.10 177.04 2yu0 s PRO 91 N -3.95 2.52 -0.26 2.90 0.04 -1.26 -4.84 135.00 130.16 2yu0 s PRO 91 Ca 0.38 -0.77 -0.10 0.00 0.04 0.00 0.00 61.00 60.56 2yu0 s PRO 91 Cb -0.07 -5.16 0.10 0.00 0.04 0.00 0.00 34.50 29.42 2yu0 s PRO 91 CO 0.26 -3.71 0.57 0.45 0.04 0.00 0.00 177.00 174.62 2yu0 s SER 92 N 7.20 -0.81 -0.34 6.66 0.15 -1.26 -5.13 113.70 120.17 2yu0 s SER 92 Ca 0.69 1.34 -0.26 0.00 0.70 0.00 0.00 55.95 58.42 2yu0 s SER 92 Cb -0.03 1.76 0.01 0.00 -1.71 0.00 0.00 66.02 66.05 2yu0 s SER 92 CO 0.07 -0.22 0.95 -0.94 1.20 0.00 0.00 173.24 174.29 2yu0 s SER 93 N 2.49 6.76 0.00 5.45 1.04 -1.26 -5.14 113.70 123.04 2yu0 s SER 93 Ca -0.06 0.75 0.00 0.00 0.48 0.00 0.00 55.95 57.12 2yu0 s SER 93 Cb -0.11 -2.48 0.00 0.00 0.10 0.00 0.00 66.02 63.53 2yu0 s SER 93 CO -0.17 -0.82 0.00 0.61 0.98 0.00 0.00 173.24 173.84