#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yu4 n SER 2 N 0.00 3.15 -2.68 1.61 7.64 -1.26 -4.72 113.62 117.36 2yu4 n SER 2 Ca 0.00 -3.64 -0.31 0.00 1.01 0.00 0.00 58.87 55.93 2yu4 n SER 2 Cb 0.00 -0.71 -0.03 0.00 -1.01 0.00 0.00 64.21 62.46 2yu4 n SER 2 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2yu4 n SER 3 N -1.02 6.83 -3.58 6.43 7.64 -1.26 -4.90 113.62 123.75 2yu4 n SER 3 Ca 0.42 -3.35 -0.11 0.00 1.01 0.00 0.00 58.87 56.85 2yu4 n SER 3 Cb 1.27 -1.21 -0.04 0.00 -1.01 0.00 0.00 64.21 63.23 2yu4 n SER 3 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2yu4 s GLY 4 N 0.01 -0.36 0.48 0.23 0.00 -1.26 -5.18 107.32 101.24 2yu4 s GLY 4 Ca 0.57 0.09 0.03 0.00 0.00 0.00 0.00 44.72 45.41 2yu4 s GLY 4 CO -0.25 -0.16 0.01 -0.45 0.00 0.00 0.00 173.10 172.25 2yu4 s SER 5 N -2.80 3.99 -0.61 1.64 0.15 -1.26 -5.04 113.70 109.77 2yu4 s SER 5 Ca 0.03 -1.58 -0.02 0.00 0.70 0.00 0.00 55.95 55.08 2yu4 s SER 5 Cb 0.01 0.28 0.43 0.00 -1.71 0.00 0.00 66.02 65.02 2yu4 s SER 5 CO -0.11 -0.75 2.03 -0.24 1.20 0.00 0.00 173.24 175.36 2yu4 n SER 6 N -1.18 7.36 0.00 5.45 2.88 -1.26 -4.89 113.62 121.97 2yu4 n SER 6 Ca -0.15 -3.68 0.00 0.00 -1.33 0.00 0.00 58.87 53.72 2yu4 n SER 6 Cb 0.67 -0.98 0.00 0.00 -0.75 0.00 0.00 64.21 63.15 2yu4 n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2yu4 n GLY 7 N -0.75 1.12 2.76 0.46 0.00 -1.26 -5.10 105.19 102.42 2yu4 n GLY 7 Ca 0.58 -0.80 -0.25 0.00 0.00 0.00 0.00 46.02 45.55 2yu4 n GLY 7 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2yu4 s PHE 8 N 3.45 0.84 -0.06 1.61 0.40 -1.26 -5.10 117.98 117.87 2yu4 s PHE 8 Ca 0.00 -0.48 0.05 0.00 -0.60 0.00 0.00 56.93 55.91 2yu4 s PHE 8 Cb 0.00 -0.91 -0.01 0.00 0.51 0.00 0.00 43.02 42.61 2yu4 s PHE 8 CO 0.00 -0.46 -0.22 0.95 0.70 0.00 0.00 175.22 176.20 2yu4 s THR 9 N 1.92 1.81 0.01 0.64 -4.23 -1.26 -1.97 115.64 112.56 2yu4 s THR 9 Ca 0.03 -0.92 -0.30 0.00 -1.18 0.00 0.00 61.69 59.31 2yu4 s THR 9 Cb -0.14 -1.54 -0.03 0.00 1.34 0.00 0.00 72.50 72.12 2yu4 s THR 9 CO -0.07 0.51 0.99 0.00 -0.54 0.00 0.00 174.62 175.51 2yu4 n PRO 11 N 3.79 0.10 -0.06 0.00 -0.04 -1.26 0.11 135.00 137.63 2yu4 n PRO 11 Ca 0.06 0.20 -0.05 0.00 -0.04 0.00 0.00 63.50 63.67 2yu4 n PRO 11 Cb 0.51 -1.50 -0.02 0.00 -0.04 0.00 0.00 33.50 32.45 2yu4 n PRO 11 CO 0.00 0.00 0.00 -0.89 -0.04 0.00 0.00 175.50 174.57 2yu4 n ILE 12 N -1.40 1.10 1.27 0.52 5.41 -1.26 -4.49 119.36 120.52 2yu4 n ILE 12 Ca 0.05 0.26 0.14 0.00 1.00 0.00 0.00 62.75 64.20 2yu4 n ILE 12 Cb 0.14 -2.16 0.66 0.00 -0.71 0.00 0.00 39.64 37.57 2yu4 n ILE 12 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 176.55 176.90 2yu4 n THR 13 N -4.01 0.00 -2.35 1.39 -2.24 -1.24 -4.90 114.28 100.94 2yu4 n THR 13 Ca -0.08 -0.01 -0.13 0.00 -2.27 0.00 0.00 64.05 61.56 2yu4 n THR 13 Cb 0.30 -0.37 -0.01 0.00 -2.10 0.00 0.00 70.33 68.16 2yu4 n THR 13 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2yu4 n LYS 14 N -1.29 -2.10 -4.32 -0.78 4.01 0.12 -4.93 118.16 108.87 2yu4 n LYS 14 Ca 0.12 0.65 -0.16 0.00 -0.51 0.00 0.00 58.31 58.40 2yu4 n LYS 14 Cb 0.28 -5.22 -0.10 0.00 -0.51 0.00 0.00 35.03 29.48 2yu4 n LYS 14 CO 0.00 0.00 0.00 -1.83 -1.11 0.00 0.00 177.40 174.46 2yu4 s GLU 15 N -4.87 1.36 0.58 1.97 -1.05 -1.23 -4.86 118.70 110.60 2yu4 s GLU 15 Ca 0.00 -1.71 -0.18 0.00 -0.15 0.00 0.00 54.97 52.93 2yu4 s GLU 15 Cb 0.00 -0.40 -0.07 0.00 -0.44 0.00 0.00 34.13 33.22 2yu4 s GLU 15 CO 0.00 -0.21 0.74 -1.91 0.95 0.00 0.00 175.26 174.83 2yu4 n GLU 16 N -0.43 0.69 -4.23 -4.83 2.13 -1.26 -1.24 120.64 111.47 2yu4 n GLU 16 Ca -0.03 0.27 -0.34 0.00 0.66 0.00 0.00 57.16 57.72 2yu4 n GLU 16 Cb 0.65 -1.92 -0.11 0.00 0.27 0.00 0.00 31.44 30.33 2yu4 n GLU 16 CO 0.00 0.00 0.00 -1.64 -0.41 0.00 0.00 177.13 175.08 2yu4 s MET 17 N -2.41 3.80 -0.21 5.31 -1.94 -0.83 -4.72 119.30 118.30 2yu4 s MET 17 Ca 0.72 -0.45 0.10 0.00 -1.71 0.00 0.00 55.69 54.35 2yu4 s MET 17 Cb -0.43 -3.04 -0.22 0.00 2.01 0.00 0.00 34.83 33.15 2yu4 s MET 17 CO 0.51 0.25 0.01 1.63 -0.01 0.00 0.00 175.02 177.41 2yu4 n LYS 18 N 3.55 0.67 -3.81 2.03 4.76 -1.26 -4.74 118.16 119.37 2yu4 n LYS 18 Ca -0.17 0.09 -0.28 0.00 -2.87 0.00 0.00 58.31 55.08 2yu4 n LYS 18 Cb 0.52 -1.55 -0.12 0.00 -1.84 0.00 0.00 35.03 32.04 2yu4 n LYS 18 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 2yu4 s LYS 19 N -2.51 1.97 0.09 1.97 1.02 -1.26 -5.05 119.74 115.95 2yu4 s LYS 19 Ca -0.20 -2.83 -0.31 0.00 0.02 0.00 0.00 55.97 52.65 2yu4 s LYS 19 Cb 0.07 -2.94 -0.07 0.00 -0.52 0.00 0.00 37.83 34.37 2yu4 s LYS 19 CO 0.74 -1.25 1.38 -1.25 -0.92 0.00 0.00 175.35 174.05 2yu4 s PRO 20 N -0.75 4.32 -0.04 -1.68 0.04 -1.26 -1.34 135.00 134.30 2yu4 s PRO 20 Ca 0.23 2.03 0.03 0.00 0.04 0.00 0.00 61.00 63.33 2yu4 s PRO 20 Cb -0.10 -3.33 0.00 0.00 0.04 0.00 0.00 34.50 31.11 2yu4 s PRO 20 CO -0.11 -0.45 -0.12 0.14 0.04 0.00 0.00 177.00 176.50 2yu4 s VAL 21 N 1.39 1.01 0.14 -0.36 -7.23 0.88 -3.03 120.40 113.20 2yu4 s VAL 21 Ca 0.64 -0.47 0.03 0.00 -1.81 0.00 0.00 61.98 60.37 2yu4 s VAL 21 Cb -0.35 -0.89 -0.04 0.00 0.56 0.00 0.00 36.38 35.66 2yu4 s VAL 21 CO 0.29 0.31 0.25 -0.75 -0.31 0.00 0.00 175.10 174.89 2yu4 s LYS 22 N 0.26 3.35 -0.22 4.82 2.36 -1.00 -0.22 119.74 129.08 2yu4 s LYS 22 Ca -0.06 -0.62 -0.06 0.00 -2.55 0.00 0.00 55.97 52.68 2yu4 s LYS 22 Cb -0.11 -2.92 -0.03 0.00 -1.05 0.00 0.00 37.83 33.72 2yu4 s LYS 22 CO 0.01 0.53 0.03 1.21 1.55 0.00 0.00 175.35 178.68 2yu4 s ASN 23 N -3.13 5.00 0.60 1.43 2.47 -0.69 -2.44 114.94 118.18 2yu4 s ASN 23 Ca 0.34 -0.19 0.39 0.00 0.42 0.00 0.00 52.86 53.82 2yu4 s ASN 23 Cb -0.11 -1.88 1.90 0.00 -1.45 0.00 0.00 41.25 39.71 2yu4 s ASN 23 CO 0.28 0.03 2.17 0.07 -3.72 0.00 0.00 177.10 175.92 2yu4 h LYS 24 N 7.77 0.00 0.17 0.43 2.10 -1.90 0.25 116.57 125.39 2yu4 h LYS 24 Ca -0.37 0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 58.27 2yu4 h LYS 24 Cb 1.17 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.51 2yu4 h LYS 24 CO 0.60 0.00 -0.08 0.28 -2.00 0.00 0.00 179.45 178.25 2yu4 h VAL 25 N 0.00 0.00 0.00 0.07 2.07 -1.93 -3.42 116.25 113.04 2yu4 h VAL 25 Ca 0.00 -0.21 -0.08 0.00 0.82 0.00 0.00 66.70 67.23 2yu4 h VAL 25 Cb 0.24 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.00 2yu4 h VAL 25 CO 0.00 0.00 -0.80 0.00 0.02 0.00 0.00 177.57 176.79 2yu4 n GLY 27 N 1.55 1.65 3.47 0.00 0.00 0.86 -5.02 105.19 107.70 2yu4 n GLY 27 Ca -0.16 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.58 2yu4 n GLY 27 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2yu4 s HIS 28 N -1.23 1.23 0.07 1.61 3.76 -1.26 -4.36 115.29 115.11 2yu4 s HIS 28 Ca 0.00 1.09 0.08 0.00 -0.15 0.00 0.00 55.06 56.09 2yu4 s HIS 28 Cb 0.00 -3.08 -0.03 0.00 1.11 0.00 0.00 32.58 30.58 2yu4 s HIS 28 CO 0.00 -3.99 -0.23 0.95 -0.85 0.00 0.00 174.74 170.62 2yu4 s THR 29 N -2.46 1.84 0.29 1.30 -4.23 -1.26 -1.71 115.64 109.41 2yu4 s THR 29 Ca 0.68 -1.38 -0.00 0.00 -1.18 0.00 0.00 61.69 59.81 2yu4 s THR 29 Cb -0.24 -1.61 -0.02 0.00 1.34 0.00 0.00 72.50 71.96 2yu4 s THR 29 CO 0.64 0.17 0.31 -0.31 -0.54 0.00 0.00 174.62 174.89 2yu4 s TYR 30 N -0.91 1.22 0.16 3.99 2.02 0.69 -4.93 117.35 119.60 2yu4 s TYR 30 Ca 0.09 -1.37 -0.16 0.00 -0.37 0.00 0.00 57.07 55.27 2yu4 s TYR 30 Cb -0.09 -0.39 -0.07 0.00 -0.40 0.00 0.00 41.96 41.01 2yu4 s TYR 30 CO 0.03 -0.89 0.59 -2.00 -1.57 0.00 0.00 175.55 171.70 2yu4 s GLU 31 N -3.61 4.04 0.02 -0.62 2.12 -1.26 -0.08 118.70 119.31 2yu4 s GLU 31 Ca 0.35 0.58 -0.07 0.00 0.36 0.00 0.00 54.97 56.19 2yu4 s GLU 31 Cb 0.03 -2.93 -0.03 0.00 0.26 0.00 0.00 34.13 31.46 2yu4 s GLU 31 CO 0.19 0.47 1.10 1.49 -0.54 0.00 0.00 175.26 177.97 2yu4 h GLU 32 N 3.56 -0.17 -0.98 4.30 4.81 -1.58 0.23 114.58 124.75 2yu4 h GLU 32 Ca -0.48 0.01 0.28 0.00 -0.13 0.00 0.00 59.36 59.03 2yu4 h GLU 32 Cb 1.19 0.04 -0.05 0.00 0.63 0.00 0.00 28.75 30.56 2yu4 h GLU 32 CO 0.66 -0.11 0.69 -0.44 -0.73 0.00 0.00 179.01 179.08 2yu4 h ASP 33 N -0.18 0.09 0.46 1.04 5.19 -1.95 0.30 116.42 121.36 2yu4 h ASP 33 Ca -0.01 0.01 -0.02 0.00 -0.62 0.00 0.00 57.03 56.39 2yu4 h ASP 33 Cb 0.16 -0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.67 2yu4 h ASP 33 CO -0.02 0.02 -0.22 0.00 -3.12 0.00 0.00 179.24 175.90 2yu4 h ALA 34 N 1.53 -0.74 0.00 3.45 0.00 -1.76 0.26 119.26 121.99 2yu4 h ALA 34 Ca 0.48 -0.13 -0.00 0.00 0.00 0.00 0.00 54.91 55.26 2yu4 h ALA 34 Cb 1.77 0.24 -0.00 0.00 0.00 0.00 0.00 17.79 19.80 2yu4 h ALA 34 CO -0.05 -0.69 -0.00 0.97 0.00 0.00 0.00 179.25 179.47 2yu4 h ILE 35 N -0.95 0.03 0.15 0.00 6.09 0.14 0.27 117.51 123.25 2yu4 h ILE 35 Ca -0.06 -0.15 -0.33 0.00 -1.37 0.00 0.00 64.86 62.94 2yu4 h ILE 35 Cb 0.47 1.15 0.00 0.00 0.47 0.00 0.00 36.82 38.91 2yu4 h ILE 35 CO 0.10 0.00 -1.67 0.58 -3.07 0.00 0.00 178.15 174.09 2yu4 h VAL 36 N 0.00 1.01 0.00 2.19 2.07 -0.41 -3.07 116.25 118.05 2yu4 h VAL 36 Ca -0.00 -2.62 -0.09 0.00 0.82 0.00 0.00 66.70 64.81 2yu4 h VAL 36 Cb 0.15 2.75 -0.01 0.00 -1.52 0.00 0.00 31.29 32.65 2yu4 h VAL 36 CO 0.00 0.83 -0.57 0.08 0.02 0.00 0.00 177.57 177.93 2yu4 h ARG 37 N 0.09 0.00 0.17 1.57 0.11 0.14 -3.19 114.38 113.27 2yu4 h ARG 37 Ca -0.31 0.00 -0.01 0.00 0.10 0.00 0.00 59.98 59.77 2yu4 h ARG 37 Cb 2.06 0.00 0.00 0.00 1.11 0.00 0.00 29.97 33.15 2yu4 h ARG 37 CO 0.17 0.34 -0.08 1.98 0.10 0.00 0.00 179.97 182.48 2yu4 h MET 38 N 0.00 -0.22 -0.74 0.08 4.05 -0.61 -1.71 114.93 115.77 2yu4 h MET 38 Ca -0.03 0.02 0.16 0.00 -0.28 0.00 0.00 59.70 59.57 2yu4 h MET 38 Cb 1.31 0.05 -0.05 0.00 -0.80 0.00 0.00 31.60 32.12 2yu4 h MET 38 CO 0.05 0.05 0.50 0.82 0.23 0.00 0.00 176.91 178.56 2yu4 h ILE 39 N -1.00 0.75 0.03 1.77 2.04 -1.68 0.31 117.51 119.73 2yu4 h ILE 39 Ca -0.02 -0.11 -0.22 0.00 1.00 0.00 0.00 64.86 65.51 2yu4 h ILE 39 Cb 0.38 0.41 -0.02 0.00 -0.74 0.00 0.00 36.82 36.85 2yu4 h ILE 39 CO 0.04 0.06 -1.00 -0.33 0.00 0.00 0.00 178.15 176.91 2yu4 h GLU 40 N 0.31 0.13 0.00 2.37 4.39 -1.62 -1.73 114.58 118.43 2yu4 h GLU 40 Ca 0.37 -0.18 -0.07 0.00 0.34 0.00 0.00 59.36 59.82 2yu4 h GLU 40 Cb 0.98 0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 29.68 2yu4 h GLU 40 CO -0.10 1.02 -0.32 0.77 -1.16 0.00 0.00 179.01 179.22 2yu4 h SER 41 N 0.05 0.00 0.00 1.42 0.02 0.12 -3.08 113.55 112.08 2yu4 h SER 41 Ca -0.05 0.00 -0.14 0.00 -0.84 0.00 0.00 61.79 60.76 2yu4 h SER 41 Cb 1.70 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 64.22 2yu4 h SER 41 CO 0.15 0.32 -0.79 0.03 -1.14 0.00 0.00 176.83 175.40 2yu4 h ARG 42 N 0.00 0.00 -0.89 3.45 2.47 -0.52 -3.28 114.38 115.60 2yu4 h ARG 42 Ca -0.00 0.00 0.13 0.00 -1.26 0.00 0.00 59.98 58.85 2yu4 h ARG 42 Cb 1.19 0.00 -0.09 0.00 -1.65 0.00 0.00 29.97 29.42 2yu4 h ARG 42 CO 0.04 0.95 0.50 1.96 0.56 0.00 0.00 179.97 183.98 2yu4 h GLN 43 N -1.00 0.73 0.00 0.04 4.20 -1.43 0.35 115.11 118.00 2yu4 h GLN 43 Ca -0.21 -0.04 -0.03 0.00 0.06 0.00 0.00 58.65 58.42 2yu4 h GLN 43 Cb 1.15 -0.16 -0.00 0.00 0.30 0.00 0.00 27.48 28.76 2yu4 h GLN 43 CO -0.13 0.48 -0.14 1.57 -0.67 0.00 0.00 178.83 179.95 2yu4 h LYS 44 N 0.75 0.00 -0.58 1.46 5.09 -1.70 -1.87 116.57 119.73 2yu4 h LYS 44 Ca 0.47 0.00 -0.12 0.00 0.09 0.00 0.00 60.65 61.09 2yu4 h LYS 44 Cb 0.58 0.00 -0.07 0.00 0.10 0.00 0.00 32.23 32.84 2yu4 h LYS 44 CO -0.32 0.14 0.13 0.54 -2.09 0.00 0.00 179.45 177.85 2yu4 n ARG 45 N -3.66 3.70 -2.48 0.07 1.74 0.86 -4.91 116.66 111.97 2yu4 n ARG 45 Ca -0.02 -3.07 -0.13 0.00 -0.77 0.00 0.00 57.85 53.86 2yu4 n ARG 45 Cb 0.26 -2.13 -0.01 0.00 -1.02 0.00 0.00 32.46 29.56 2yu4 n ARG 45 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 2yu4 n LYS 46 N -0.13 -2.28 -1.21 5.56 5.02 -0.70 -4.94 118.16 119.47 2yu4 n LYS 46 Ca 0.34 0.60 -0.01 0.00 -2.02 0.00 0.00 58.31 57.21 2yu4 n LYS 46 Cb 1.22 -5.21 0.00 0.00 -0.02 0.00 0.00 35.03 31.03 2yu4 n LYS 46 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 2yu4 n LYS 47 N -2.85 1.06 -4.16 1.97 4.81 0.84 -4.99 118.16 114.84 2yu4 n LYS 47 Ca -0.14 -0.20 -0.14 0.00 -0.87 0.00 0.00 58.31 56.95 2yu4 n LYS 47 Cb 0.61 -0.01 -0.11 0.00 0.02 0.00 0.00 35.03 35.54 2yu4 n LYS 47 CO 0.00 0.00 0.00 -1.59 1.17 0.00 0.00 177.40 176.98 2yu4 s LYS 48 N -2.16 0.81 -0.40 1.64 -2.85 -1.26 -4.26 119.74 111.26 2yu4 s LYS 48 Ca 0.03 -1.10 -0.22 0.00 -1.00 0.00 0.00 55.97 53.68 2yu4 s LYS 48 Cb -0.00 -0.52 0.02 0.00 -2.06 0.00 0.00 37.83 35.27 2yu4 s LYS 48 CO 0.02 0.08 0.74 0.00 0.10 0.00 0.00 175.35 176.30 2yu4 s ALA 49 N -2.27 3.37 0.20 0.59 0.00 -1.26 -4.98 121.76 117.41 2yu4 s ALA 49 Ca 0.03 -0.88 0.08 0.00 0.00 0.00 0.00 51.96 51.19 2yu4 s ALA 49 Cb -0.04 -3.37 -0.04 0.00 0.00 0.00 0.00 23.12 19.67 2yu4 s ALA 49 CO 0.00 -1.66 -0.01 1.52 0.00 0.00 0.00 175.76 175.61 2yu4 s TYR 50 N 3.08 2.80 -0.58 0.00 1.13 -1.26 -1.22 117.35 121.29 2yu4 s TYR 50 Ca 0.29 -0.17 -0.31 0.00 -1.41 0.00 0.00 57.07 55.47 2yu4 s TYR 50 Cb -0.13 -1.33 -0.13 0.00 -1.10 0.00 0.00 41.96 39.27 2yu4 s TYR 50 CO 0.19 0.54 2.42 0.00 -2.51 0.00 0.00 175.55 176.19 2yu4 n PRO 52 N 8.58 0.07 -2.06 0.00 -0.04 -1.26 -4.67 135.00 135.61 2yu4 n PRO 52 Ca 0.47 0.22 -0.41 0.00 -0.04 0.00 0.00 63.50 63.74 2yu4 n PRO 52 Cb 0.29 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.22 2yu4 n PRO 52 CO 0.00 0.00 0.00 -1.14 -0.04 0.00 0.00 175.50 174.32 2yu4 s GLN 53 N -2.85 3.03 -0.14 0.54 2.00 -1.26 -4.81 119.66 116.17 2yu4 s GLN 53 Ca 0.09 0.98 -0.37 0.00 -2.00 0.00 0.00 55.36 54.06 2yu4 s GLN 53 Cb 0.09 -4.26 -0.14 0.00 0.80 0.00 0.00 33.01 29.50 2yu4 s GLN 53 CO 0.25 -2.23 1.76 -0.89 -0.50 0.00 0.00 175.29 173.68 2yu4 n ILE 54 N 7.27 0.38 0.00 -2.34 2.08 -1.26 -1.32 119.36 124.18 2yu4 n ILE 54 Ca 0.21 -0.07 0.00 0.00 0.56 0.00 0.00 62.75 63.45 2yu4 n ILE 54 Cb 0.49 -1.50 0.00 0.00 -0.75 0.00 0.00 39.64 37.89 2yu4 n ILE 54 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 2yu4 n GLY 55 N 4.12 2.38 3.87 7.39 0.00 -1.26 -5.10 105.19 116.59 2yu4 n GLY 55 Ca 0.24 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.95 2yu4 n GLY 55 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2yu4 n SER 57 N -2.11 1.51 -4.52 0.00 2.88 -1.26 -5.00 113.62 105.11 2yu4 n SER 57 Ca 0.05 0.00 -0.37 0.00 -1.33 0.00 0.00 58.87 57.21 2yu4 n SER 57 Cb 0.54 1.16 0.05 0.00 -0.75 0.00 0.00 64.21 65.21 2yu4 n SER 57 CO 0.00 0.00 0.00 1.57 -1.23 0.00 0.00 175.04 175.38 2yu4 n HIS 58 N -2.34 -0.19 -2.45 0.66 -0.00 -1.26 -4.95 115.22 104.69 2yu4 n HIS 58 Ca -0.16 0.41 -0.02 0.00 -0.00 0.00 0.00 57.72 57.95 2yu4 n HIS 58 Cb 0.76 -2.00 0.03 0.00 -0.00 0.00 0.00 29.99 28.77 2yu4 n HIS 58 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 176.34 176.59 2yu4 n THR 59 N -1.97 0.23 -3.58 3.57 -2.24 -1.26 -2.89 114.28 106.15 2yu4 n THR 59 Ca 0.12 -1.02 -0.29 0.00 -2.27 0.00 0.00 64.05 60.59 2yu4 n THR 59 Cb 0.48 0.89 -0.15 0.00 -2.10 0.00 0.00 70.33 69.46 2yu4 n THR 59 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 2yu4 s ASP 60 N -1.76 3.62 -0.05 3.42 1.01 -1.24 -4.37 116.67 117.30 2yu4 s ASP 60 Ca 0.15 -1.40 0.04 0.00 0.71 0.00 0.00 52.55 52.04 2yu4 s ASP 60 Cb 0.27 -0.46 -0.00 0.00 1.01 0.00 0.00 42.92 43.74 2yu4 s ASP 60 CO -0.08 -0.43 -0.16 -0.63 0.21 0.00 0.00 175.17 174.08 2yu4 s ILE 61 N 1.96 1.36 0.01 0.77 1.01 -0.36 -4.88 121.20 121.06 2yu4 s ILE 61 Ca 0.10 -0.67 0.07 0.00 0.00 0.00 0.00 60.65 60.15 2yu4 s ILE 61 Cb -0.17 -1.18 -0.02 0.00 0.01 0.00 0.00 42.46 41.11 2yu4 s ILE 61 CO -0.33 0.40 -0.21 -0.13 0.00 0.00 0.00 174.94 174.66 2yu4 s ARG 62 N 0.14 1.61 0.59 2.79 0.52 -1.26 -4.55 118.95 118.80 2yu4 s ARG 62 Ca -0.06 -0.84 0.29 0.00 -0.52 0.00 0.00 55.73 54.60 2yu4 s ARG 62 Cb -0.12 -1.63 1.67 0.00 0.52 0.00 0.00 34.95 35.39 2yu4 s ARG 62 CO 0.02 0.44 2.09 -0.22 0.02 0.00 0.00 175.30 177.65 2yu4 h LYS 63 N 5.31 0.00 0.00 3.54 3.64 -1.98 0.24 116.57 127.32 2yu4 h LYS 63 Ca -0.41 0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 58.94 2yu4 h LYS 63 Cb 1.14 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.96 2yu4 h LYS 63 CO 0.46 0.00 -0.15 0.77 -2.27 0.00 0.00 179.45 178.26 2yu4 h SER 64 N 0.00 0.00 -0.57 4.20 0.02 -2.04 -2.70 113.55 112.47 2yu4 h SER 64 Ca 0.09 0.00 -0.15 0.00 -0.84 0.00 0.00 61.79 60.89 2yu4 h SER 64 Cb 0.52 0.00 -0.09 0.00 0.14 0.00 0.00 62.40 62.97 2yu4 h SER 64 CO -0.00 0.15 0.19 0.47 -1.14 0.00 0.00 176.83 176.50 2yu4 n ASP 65 N -3.29 4.24 -4.50 3.07 8.00 0.84 -4.87 116.55 120.05 2yu4 n ASP 65 Ca 0.00 -2.91 -0.38 0.00 0.71 0.00 0.00 54.79 52.21 2yu4 n ASP 65 Cb 0.40 -0.69 -0.12 0.00 -0.02 0.00 0.00 41.12 40.69 2yu4 n ASP 65 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2yu4 s LEU 66 N -2.27 3.98 0.26 0.64 1.43 -1.02 -3.08 118.68 118.61 2yu4 s LEU 66 Ca 0.43 -0.28 0.10 0.00 -1.03 0.00 0.00 54.13 53.34 2yu4 s LEU 66 Cb 0.34 -2.04 -0.05 0.00 0.03 0.00 0.00 46.19 44.47 2yu4 s LEU 66 CO 0.11 -0.12 -0.16 0.27 0.23 0.00 0.00 176.35 176.68 2yu4 s ILE 67 N 1.67 2.10 -0.36 -0.59 -4.36 -1.02 -5.02 121.20 113.62 2yu4 s ILE 67 Ca 0.06 -2.29 -0.19 0.00 -0.26 0.00 0.00 60.65 57.97 2yu4 s ILE 67 Cb -0.16 -2.24 0.00 0.00 1.25 0.00 0.00 42.46 41.31 2yu4 s ILE 67 CO 0.08 -0.45 0.55 -1.10 0.24 0.00 0.00 174.94 174.25 2yu4 s GLN 68 N -3.59 3.59 -0.14 0.37 -0.21 -1.26 -2.38 119.66 116.04 2yu4 s GLN 68 Ca 0.27 -0.15 -0.28 0.00 0.02 0.00 0.00 55.36 55.22 2yu4 s GLN 68 Cb -0.02 -3.82 -0.01 0.00 1.00 0.00 0.00 33.01 30.16 2yu4 s GLN 68 CO 0.12 -0.70 0.97 0.34 -2.12 0.00 0.00 175.29 173.90 2yu4 s ASP 69 N 1.79 7.15 -0.19 5.90 -1.08 -1.17 -4.94 116.67 124.13 2yu4 s ASP 69 Ca 0.20 1.42 -0.18 0.00 -0.52 0.00 0.00 52.55 53.47 2yu4 s ASP 69 Cb -0.15 -2.53 -0.20 0.00 -1.46 0.00 0.00 42.92 38.57 2yu4 s ASP 69 CO 0.14 -0.47 0.23 1.21 0.52 0.00 0.00 175.17 176.79 2yu4 n GLU 70 N 5.27 0.61 0.16 4.34 2.13 -1.26 -2.88 120.64 129.02 2yu4 n GLU 70 Ca 0.08 0.49 0.18 0.00 0.66 0.00 0.00 57.16 58.58 2yu4 n GLU 70 Cb 0.48 -1.73 0.79 0.00 0.27 0.00 0.00 31.44 31.25 2yu4 n GLU 70 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2yu4 h ALA 71 N -0.38 1.95 0.05 4.31 0.00 -2.00 -1.31 119.26 121.87 2yu4 h ALA 71 Ca -0.38 -0.01 -0.23 0.00 0.00 0.00 0.00 54.91 54.29 2yu4 h ALA 71 Cb 1.49 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 19.28 2yu4 h ALA 71 CO -0.15 -0.42 -1.23 1.25 0.00 0.00 0.00 179.25 178.70 2yu4 h LEU 72 N 0.00 0.16 -0.05 0.00 6.46 -1.97 -3.32 115.31 116.59 2yu4 h LEU 72 Ca 0.13 -0.72 0.04 0.00 -0.12 0.00 0.00 57.88 57.20 2yu4 h LEU 72 Cb 0.69 -0.05 -0.05 0.00 -0.73 0.00 0.00 40.66 40.51 2yu4 h LEU 72 CO -0.00 1.51 -0.27 0.03 -0.62 0.00 0.00 178.44 179.09 2yu4 h ARG 73 N -0.67 -0.37 -0.74 1.25 3.08 -1.25 -0.13 114.38 115.55 2yu4 h ARG 73 Ca -0.30 0.03 0.21 0.00 0.07 0.00 0.00 59.98 59.99 2yu4 h ARG 73 Cb 1.49 0.08 -0.03 0.00 0.08 0.00 0.00 29.97 31.59 2yu4 h ARG 73 CO -0.07 -0.25 0.53 0.00 -1.07 0.00 0.00 179.97 179.11 2yu4 h ARG 74 N -0.39 0.01 0.34 0.04 3.08 -1.46 -1.41 114.38 114.60 2yu4 h ARG 74 Ca 0.08 -0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.11 2yu4 h ARG 74 Cb 0.49 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.54 2yu4 h ARG 74 CO -0.27 0.01 -0.16 0.00 -1.07 0.00 0.00 179.97 178.48 2yu4 h ALA 75 N 1.63 -0.45 -0.90 0.04 0.00 -1.12 -1.38 119.26 117.08 2yu4 h ALA 75 Ca 0.35 -0.13 0.05 0.00 0.00 0.00 0.00 54.91 55.18 2yu4 h ALA 75 Cb 1.39 0.18 -0.06 0.00 0.00 0.00 0.00 17.79 19.30 2yu4 h ALA 75 CO -0.01 -0.71 0.58 0.82 0.00 0.00 0.00 179.25 179.93 2yu4 h ILE 76 N -0.55 1.09 -0.37 0.00 2.04 -1.06 -1.36 117.51 117.30 2yu4 h ILE 76 Ca -0.05 -0.37 -0.04 0.00 1.00 0.00 0.00 64.86 65.41 2yu4 h ILE 76 Cb 0.41 -0.08 -0.02 0.00 -0.74 0.00 0.00 36.82 36.39 2yu4 h ILE 76 CO 0.08 0.20 0.06 -0.33 0.00 0.00 0.00 178.15 178.15 2yu4 h GLU 77 N 1.07 0.56 0.00 2.37 4.39 -1.31 -0.36 114.58 121.31 2yu4 h GLU 77 Ca 0.38 -0.10 -0.06 0.00 0.34 0.00 0.00 59.36 59.92 2yu4 h GLU 77 Cb 0.11 -0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 28.66 2yu4 h GLU 77 CO -0.15 0.54 -0.29 -0.97 -1.16 0.00 0.00 179.01 176.98 2yu4 h ASN 78 N 0.55 0.00 0.81 1.42 -0.73 -0.12 -2.78 115.58 114.72 2yu4 h ASN 78 Ca 0.12 0.00 -0.17 0.00 1.87 0.00 0.00 56.30 58.12 2yu4 h ASN 78 Cb 0.25 0.00 -0.03 0.00 0.27 0.00 0.00 38.32 38.82 2yu4 h ASN 78 CO 0.00 0.29 -1.29 -0.74 -0.37 0.00 0.00 177.43 175.32 2yu4 h HIS 79 N 0.00 0.00 0.00 0.67 2.76 -0.90 -3.33 115.15 114.35 2yu4 h HIS 79 Ca -0.00 0.00 -0.05 0.00 -2.20 0.00 0.00 60.37 58.12 2yu4 h HIS 79 Cb 0.66 0.00 -0.01 0.00 1.55 0.00 0.00 27.41 29.61 2yu4 h HIS 79 CO 0.00 0.62 -0.23 -0.91 -1.30 0.00 0.00 177.93 176.12 2yu4 h ASN 80 N 0.00 0.00 -0.42 3.26 2.35 -0.81 -2.34 115.58 117.62 2yu4 h ASN 80 Ca -0.15 0.00 0.12 0.00 -0.55 0.00 0.00 56.30 55.73 2yu4 h ASN 80 Cb 1.60 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.96 2yu4 h ASN 80 CO 0.06 0.23 0.33 0.07 -1.65 0.00 0.00 177.43 176.47 2yu4 h LYS 81 N 0.00 0.00 -0.43 0.81 5.09 -1.65 0.35 116.57 120.74 2yu4 h LYS 81 Ca -0.00 0.00 0.11 0.00 0.09 0.00 0.00 60.65 60.85 2yu4 h LYS 81 Cb 0.42 0.00 -0.02 0.00 0.10 0.00 0.00 32.23 32.73 2yu4 h LYS 81 CO 0.03 0.00 0.30 -0.22 -2.09 0.00 0.00 179.45 177.47 2yu4 h LYS 82 N 0.00 0.07 -5.07 0.07 3.64 -1.65 -3.45 116.57 110.18 2yu4 h LYS 82 Ca 0.20 -0.00 -0.39 0.00 -1.27 0.00 0.00 60.65 59.18 2yu4 h LYS 82 Cb 0.87 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 32.66 2yu4 h LYS 82 CO -0.00 0.04 -0.58 -2.13 -2.27 0.00 0.00 179.45 174.51 2yu4 n ARG 83 N -4.43 -4.16 -2.97 1.90 3.00 0.11 -3.36 116.66 106.75 2yu4 n ARG 83 Ca 0.07 0.67 -0.11 0.00 -0.00 0.00 0.00 57.85 58.48 2yu4 n ARG 83 Cb 0.46 -5.45 0.01 0.00 0.00 0.00 0.00 32.46 27.48 2yu4 n ARG 83 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.63 179.21 2yu4 n HIS 84 N -4.21 -3.16 -2.59 -0.14 -0.00 -1.26 -4.82 115.22 99.04 2yu4 n HIS 84 Ca -0.05 1.32 -0.42 0.00 -0.00 0.00 0.00 57.72 58.56 2yu4 n HIS 84 Cb 0.57 -3.37 -0.01 0.00 -0.00 0.00 0.00 29.99 27.19 2yu4 n HIS 84 CO 0.00 0.00 0.00 0.50 -0.00 0.00 0.00 176.34 176.84 2yu4 s ARG 85 N -2.18 3.87 -0.71 1.57 3.52 -1.22 -4.86 118.95 118.94 2yu4 s ARG 85 Ca 0.19 -1.76 0.05 0.00 -0.13 0.00 0.00 55.73 54.08 2yu4 s ARG 85 Cb -0.04 -5.46 0.20 0.00 -1.56 0.00 0.00 34.95 28.09 2yu4 s ARG 85 CO 0.72 -2.22 0.61 1.58 -0.81 0.00 0.00 175.30 175.18 2yu4 n HIS 86 N 8.43 3.45 -3.82 5.12 -0.00 -1.26 -5.04 115.22 122.10 2yu4 n HIS 86 Ca 0.44 -4.23 -0.16 0.00 0.46 0.00 0.00 57.72 54.23 2yu4 n HIS 86 Cb 0.47 -0.66 -0.16 0.00 -0.12 0.00 0.00 29.99 29.52 2yu4 n HIS 86 CO 0.00 0.00 0.00 0.45 0.46 0.00 0.00 176.34 177.25 2yu4 s SER 87 N -1.68 0.18 -0.97 0.26 0.15 -1.26 -5.09 113.70 105.30 2yu4 s SER 87 Ca 0.30 0.02 -0.04 0.00 0.70 0.00 0.00 55.95 56.93 2yu4 s SER 87 Cb 0.01 -0.11 0.25 0.00 -1.71 0.00 0.00 66.02 64.46 2yu4 s SER 87 CO -0.12 -0.12 0.98 1.21 1.20 0.00 0.00 173.24 176.39 2yu4 n GLU 88 N 4.18 3.16 0.00 5.44 4.07 -1.26 -4.50 120.64 131.72 2yu4 n GLU 88 Ca -0.27 -4.50 0.00 0.00 -0.06 0.00 0.00 57.16 52.33 2yu4 n GLU 88 Cb 0.50 -2.46 0.00 0.00 -0.06 0.00 0.00 31.44 29.43 2yu4 n GLU 88 CO 0.00 0.00 0.00 -1.13 -0.06 0.00 0.00 177.13 175.94 2yu4 n SER 89 N 2.16 0.00 -2.83 4.31 3.41 -1.26 -5.11 113.62 114.30 2yu4 n SER 89 Ca 0.24 0.00 -0.07 0.00 -0.26 0.00 0.00 58.87 58.78 2yu4 n SER 89 Cb 0.37 0.17 0.01 0.00 -0.26 0.00 0.00 64.21 64.50 2yu4 n SER 89 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2yu4 n GLY 90 N -1.41 -2.05 3.56 5.00 0.00 -1.26 -4.85 105.19 104.18 2yu4 n GLY 90 Ca 0.00 1.06 -0.40 0.00 0.00 0.00 0.00 46.02 46.68 2yu4 n GLY 90 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2yu4 s PRO 91 N -2.35 2.83 -0.41 1.61 0.04 -1.26 -4.75 135.00 130.71 2yu4 s PRO 91 Ca 0.19 0.80 0.06 0.00 0.04 0.00 0.00 61.00 62.08 2yu4 s PRO 91 Cb -0.05 -4.33 0.31 0.00 0.04 0.00 0.00 34.50 30.47 2yu4 s PRO 91 CO 0.77 -2.49 1.22 -1.13 0.04 0.00 0.00 177.00 175.42 2yu4 n SER 92 N 12.03 -1.91 -0.05 6.66 3.41 -1.26 -5.00 113.62 127.49 2yu4 n SER 92 Ca 0.21 -2.90 -0.08 0.00 -0.26 0.00 0.00 58.87 55.83 2yu4 n SER 92 Cb 0.51 1.53 -0.04 0.00 -0.26 0.00 0.00 64.21 65.94 2yu4 n SER 92 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2yu4 n SER 93 N 0.16 2.46 0.00 4.04 3.41 -1.26 -5.31 113.62 117.12 2yu4 n SER 93 Ca -0.01 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.60 2yu4 n SER 93 Cb 0.74 -0.21 0.00 0.00 -0.26 0.00 0.00 64.21 64.48 2yu4 n SER 93 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49