#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 1.04 -1.08 1.61 3.41 -1.26 -5.13 113.62 112.21 2yu4 n SER 2 Ca 0.00 0.05 0.08 0.00 -0.26 0.00 0.00 58.87 58.74 2yu4 n SER 2 Cb 0.00 -0.16 -0.02 0.00 -0.26 0.00 0.00 64.21 63.77 2yu4 n SER 2 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 2yu4 n SER 3 N -3.16 -6.44 0.00 4.04 2.88 -1.26 -5.04 113.62 104.65 2yu4 n SER 3 Ca -0.12 0.60 0.00 0.00 -1.33 0.00 0.00 58.87 58.02 2yu4 n SER 3 Cb 0.59 -1.69 0.00 0.00 -0.75 0.00 0.00 64.21 62.36 2yu4 n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2yu4 n GLY 4 N -1.68 0.93 3.63 0.46 0.00 -1.26 -5.06 105.19 102.21 2yu4 n GLY 4 Ca 0.00 -0.37 -0.43 0.00 0.00 0.00 0.00 46.02 45.23 2yu4 n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2yu4 s SER 5 N -4.00 6.85 -0.07 1.61 1.04 -1.26 -5.01 113.70 112.86 2yu4 s SER 5 Ca 0.00 0.92 -0.03 0.00 0.48 0.00 0.00 55.95 57.32 2yu4 s SER 5 Cb 0.00 -2.50 0.04 0.00 0.10 0.00 0.00 66.02 63.66 2yu4 s SER 5 CO 0.00 -0.81 0.15 -0.44 0.98 0.00 0.00 173.24 173.12 2yu4 s SER 6 N 1.66 -0.08 0.00 7.02 0.01 -1.26 -5.14 113.70 115.91 2yu4 s SER 6 Ca 0.42 0.30 0.00 0.00 1.31 0.00 0.00 55.95 57.98 2yu4 s SER 6 Cb -0.13 0.19 0.00 0.00 0.21 0.00 0.00 66.02 66.30 2yu4 s SER 6 CO 0.15 -0.15 0.00 0.61 0.41 0.00 0.00 173.24 174.26 2yu4 n GLY 7 N 4.25 4.03 2.76 3.44 0.00 -1.26 -5.14 105.19 113.26 2yu4 n GLY 7 Ca -0.26 -0.65 -0.25 0.00 0.00 0.00 0.00 46.02 44.87 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 -0.32 0.78 -0.01 1.61 0.08 -1.26 -5.12 117.98 113.74 2yu4 s PHE 8 Ca 0.00 -0.40 0.07 0.00 0.12 0.00 0.00 56.93 56.72 2yu4 s PHE 8 Cb 0.00 -0.88 -0.02 0.00 -0.57 0.00 0.00 43.02 41.55 2yu4 s PHE 8 CO 0.00 -0.43 -0.23 0.95 -0.10 0.00 0.00 175.22 175.41 2yu4 s THR 9 N 1.94 1.82 -0.04 0.64 -4.23 -1.26 -1.75 115.64 112.76 2yu4 s THR 9 Ca 0.03 -1.01 -0.25 0.00 -1.18 0.00 0.00 61.69 59.28 2yu4 s THR 9 Cb -0.14 -1.52 -0.04 0.00 1.34 0.00 0.00 72.50 72.15 2yu4 s THR 9 CO -0.06 0.49 0.79 0.00 -0.54 0.00 0.00 174.62 175.30 2yu4 n PRO 11 N 3.76 0.05 -0.01 0.00 -0.04 -1.26 -0.51 135.00 136.99 2yu4 n PRO 11 Ca 0.01 0.23 -0.01 0.00 -0.04 0.00 0.00 63.50 63.69 2yu4 n PRO 11 Cb 0.51 -1.50 -0.00 0.00 -0.04 0.00 0.00 33.50 32.47 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 -1.45 0.18 0.29 0.52 5.41 -1.26 -4.58 119.36 118.46 2yu4 n ILE 12 Ca 0.04 0.46 0.18 0.00 1.00 0.00 0.00 62.75 64.43 2yu4 n ILE 12 Cb 0.16 -1.60 0.76 0.00 -0.71 0.00 0.00 39.64 38.25 2yu4 n ILE 12 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 176.55 177.26 2yu4 h THR 13 N -0.12 0.01 -4.58 1.39 1.35 -1.97 -3.46 112.91 105.53 2yu4 h THR 13 Ca 0.00 -0.44 -0.33 0.00 -0.55 0.00 0.00 66.41 65.08 2yu4 h THR 13 Cb 0.11 1.44 0.09 0.00 -1.73 0.00 0.00 68.15 68.07 2yu4 h THR 13 CO 0.00 0.00 -0.54 0.29 -0.25 0.00 0.00 175.52 175.02 2yu4 n LYS 14 N -3.09 -5.73 -4.23 4.72 4.76 0.34 -5.00 118.16 109.92 2yu4 n LYS 14 Ca 0.00 0.71 -0.19 0.00 -2.87 0.00 0.00 58.31 55.97 2yu4 n LYS 14 Cb 0.27 -5.30 -0.07 0.00 -1.84 0.00 0.00 35.03 28.10 2yu4 n LYS 14 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 2yu4 s GLU 15 N -5.88 1.86 0.56 1.97 2.02 -1.24 -4.88 118.70 113.11 2yu4 s GLU 15 Ca 0.41 -1.98 -0.21 0.00 0.02 0.00 0.00 54.97 53.21 2yu4 s GLU 15 Cb -0.18 0.37 -0.04 0.00 0.10 0.00 0.00 34.13 34.38 2yu4 s GLU 15 CO 0.50 -0.72 1.30 -2.00 0.02 0.00 0.00 175.26 174.36 2yu4 s GLU 16 N -3.23 3.07 -0.11 1.61 2.12 -1.26 -0.47 118.70 120.43 2yu4 s GLU 16 Ca 0.38 2.07 -0.03 0.00 0.36 0.00 0.00 54.97 57.75 2yu4 s GLU 16 Cb 0.01 -2.14 -0.03 0.00 0.26 0.00 0.00 34.13 32.23 2yu4 s GLU 16 CO 0.27 -1.20 0.00 -1.64 -0.54 0.00 0.00 175.26 172.16 2yu4 s MET 17 N -3.05 3.22 -0.03 4.30 -1.94 -0.72 -4.74 119.30 116.35 2yu4 s MET 17 Ca 0.74 -0.42 0.03 0.00 -1.71 0.00 0.00 55.69 54.33 2yu4 s MET 17 Cb -0.37 -2.87 -0.04 0.00 2.01 0.00 0.00 34.83 33.57 2yu4 s MET 17 CO 0.42 0.57 0.01 1.63 -0.01 0.00 0.00 175.02 177.65 2yu4 n LYS 18 N 2.54 3.46 -3.82 2.03 4.76 -1.26 -4.87 118.16 120.99 2yu4 n LYS 18 Ca -0.18 -0.00 -0.28 0.00 -2.87 0.00 0.00 58.31 54.97 2yu4 n LYS 18 Cb 0.53 -1.08 -0.12 0.00 -1.84 0.00 0.00 35.03 32.52 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 -2.08 2.04 0.02 1.97 3.01 -1.26 -4.95 119.74 118.49 2yu4 s LYS 19 Ca -0.02 -2.90 -0.30 0.00 -1.01 0.00 0.00 55.97 51.74 2yu4 s LYS 19 Cb 0.01 -3.02 -0.06 0.00 -1.01 0.00 0.00 37.83 33.75 2yu4 s LYS 19 CO 0.13 -1.25 1.43 -1.25 0.51 0.00 0.00 175.35 174.92 2yu4 s PRO 20 N -0.84 4.28 -0.17 -1.68 0.04 -1.26 -1.44 135.00 133.93 2yu4 s PRO 20 Ca 0.24 2.02 0.00 0.00 0.04 0.00 0.00 61.00 63.30 2yu4 s PRO 20 Cb -0.10 -3.53 0.01 0.00 0.04 0.00 0.00 34.50 30.92 2yu4 s PRO 20 CO -0.12 -0.57 -0.17 0.14 0.04 0.00 0.00 177.00 176.32 2yu4 s VAL 21 N 2.25 2.40 -0.01 -0.36 -7.23 0.86 -2.38 120.40 115.93 2yu4 s VAL 21 Ca 0.65 -0.84 -0.11 0.00 -1.81 0.00 0.00 61.98 59.87 2yu4 s VAL 21 Cb -0.33 -2.01 -0.05 0.00 0.56 0.00 0.00 36.38 34.54 2yu4 s VAL 21 CO 0.28 0.52 0.32 -0.75 -0.31 0.00 0.00 175.10 175.16 2yu4 s LYS 22 N 1.09 3.72 0.21 4.82 2.20 -0.37 -1.78 119.74 129.63 2yu4 s LYS 22 Ca -0.00 0.16 -0.11 0.00 -0.36 0.00 0.00 55.97 55.66 2yu4 s LYS 22 Cb -0.14 -3.15 -0.07 0.00 -1.51 0.00 0.00 37.83 32.95 2yu4 s LYS 22 CO -0.06 0.68 0.56 1.21 -0.36 0.00 0.00 175.35 177.38 2yu4 s ASN 23 N -1.28 6.69 0.19 1.43 2.47 -0.97 -1.87 114.94 121.61 2yu4 s ASN 23 Ca 0.24 0.99 0.17 0.00 0.42 0.00 0.00 52.86 54.67 2yu4 s ASN 23 Cb -0.15 -2.25 -0.01 0.00 -1.45 0.00 0.00 41.25 37.39 2yu4 s ASN 23 CO 0.12 -0.02 1.16 0.11 -3.72 0.00 0.00 177.10 174.75 2yu4 h LYS 24 N 2.85 0.00 0.04 0.43 1.57 -1.64 -2.96 116.57 116.85 2yu4 h LYS 24 Ca -0.47 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.30 2yu4 h LYS 24 Cb 1.18 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.49 2yu4 h LYS 24 CO 0.68 0.34 -0.02 0.28 -0.57 0.00 0.00 179.45 180.16 2yu4 h VAL 25 N 0.00 0.00 0.00 0.50 2.07 -1.93 -3.43 116.25 113.46 2yu4 h VAL 25 Ca -0.07 -0.36 0.00 0.00 0.82 0.00 0.00 66.70 67.09 2yu4 h VAL 25 Cb 1.41 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 31.18 2yu4 h VAL 25 CO 0.05 0.00 -0.06 0.00 0.02 0.00 0.00 177.57 177.58 2yu4 n GLY 27 N 1.85 1.41 3.24 0.00 0.00 -1.12 -4.99 105.19 105.57 2yu4 n GLY 27 Ca -0.01 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.73 2yu4 n GLY 27 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2yu4 n HIS 28 N 0.00 -2.00 -4.48 1.61 8.25 -1.26 -4.22 115.22 113.11 2yu4 n HIS 28 Ca 0.00 -0.10 -0.20 0.00 -0.26 0.00 0.00 57.72 57.15 2yu4 n HIS 28 Cb 0.00 -1.50 -0.15 0.00 1.12 0.00 0.00 29.99 29.46 2yu4 n HIS 28 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 2yu4 s THR 29 N -2.20 0.88 0.31 1.59 2.01 -1.26 -2.28 115.64 114.69 2yu4 s THR 29 Ca 0.55 -0.46 0.04 0.00 0.31 0.00 0.00 61.69 62.14 2yu4 s THR 29 Cb -0.13 -0.75 -0.03 0.00 0.01 0.00 0.00 72.50 71.60 2yu4 s THR 29 CO 0.57 0.26 0.28 -0.31 -0.69 0.00 0.00 174.62 174.72 2yu4 s TYR 30 N -0.14 1.56 0.28 4.92 2.02 -0.74 -4.90 117.35 120.35 2yu4 s TYR 30 Ca 0.02 -1.56 -0.20 0.00 -0.37 0.00 0.00 57.07 54.96 2yu4 s TYR 30 Cb -0.06 -0.60 -0.09 0.00 -0.40 0.00 0.00 41.96 40.81 2yu4 s TYR 30 CO -0.00 -0.86 0.78 -2.00 -1.57 0.00 0.00 175.55 171.90 2yu4 s GLU 31 N -3.54 4.24 0.02 -0.62 2.12 -1.26 -0.10 118.70 119.57 2yu4 s GLU 31 Ca 0.39 0.91 -0.07 0.00 0.36 0.00 0.00 54.97 56.57 2yu4 s GLU 31 Cb 0.03 -2.71 -0.03 0.00 0.26 0.00 0.00 34.13 31.68 2yu4 s GLU 31 CO 0.24 0.29 1.11 1.49 -0.54 0.00 0.00 175.26 177.84 2yu4 h GLU 32 N 2.99 -0.18 -0.94 4.30 4.81 -1.62 0.21 114.58 124.15 2yu4 h GLU 32 Ca -0.48 0.01 0.27 0.00 -0.13 0.00 0.00 59.36 59.03 2yu4 h GLU 32 Cb 1.19 0.04 -0.04 0.00 0.63 0.00 0.00 28.75 30.57 2yu4 h GLU 32 CO 0.65 -0.12 0.67 -0.44 -0.73 0.00 0.00 179.01 179.04 2yu4 h ASP 33 N -0.19 0.03 0.44 1.04 5.19 -1.95 0.29 116.42 121.28 2yu4 h ASP 33 Ca -0.01 0.00 -0.02 0.00 -0.62 0.00 0.00 57.03 56.38 2yu4 h ASP 33 Cb 0.17 -0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.68 2yu4 h ASP 33 CO -0.02 0.01 -0.21 0.00 -3.12 0.00 0.00 179.24 175.90 2yu4 h ALA 34 N 1.54 -0.71 0.00 3.45 0.00 -1.77 0.26 119.26 122.02 2yu4 h ALA 34 Ca 0.45 -0.13 -0.00 0.00 0.00 0.00 0.00 54.91 55.23 2yu4 h ALA 34 Cb 1.76 0.23 -0.00 0.00 0.00 0.00 0.00 17.79 19.78 2yu4 h ALA 34 CO -0.02 -0.67 -0.01 0.97 0.00 0.00 0.00 179.25 179.52 2yu4 h ILE 35 N -0.95 0.08 0.17 0.00 6.09 0.07 0.26 117.51 123.24 2yu4 h ILE 35 Ca -0.06 -0.19 -0.34 0.00 -1.37 0.00 0.00 64.86 62.90 2yu4 h ILE 35 Cb 0.46 1.17 0.01 0.00 0.47 0.00 0.00 36.82 38.93 2yu4 h ILE 35 CO 0.10 0.01 -1.68 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 -0.43 -3.07 116.25 118.02 2yu4 h VAL 36 Ca -0.00 -2.60 -0.11 0.00 0.82 0.00 0.00 66.70 64.82 2yu4 h VAL 36 Cb 0.17 2.78 -0.02 0.00 -1.52 0.00 0.00 31.29 32.70 2yu4 h VAL 36 CO 0.00 0.84 -0.57 0.08 0.02 0.00 0.00 177.57 177.94 2yu4 h ARG 37 N 0.10 0.00 0.14 1.57 0.11 0.07 -3.07 114.38 113.31 2yu4 h ARG 37 Ca -0.31 0.00 -0.01 0.00 0.10 0.00 0.00 59.98 59.76 2yu4 h ARG 37 Cb 2.09 0.00 0.00 0.00 1.11 0.00 0.00 29.97 33.17 2yu4 h ARG 37 CO 0.18 0.46 -0.07 1.98 0.10 0.00 0.00 179.97 182.62 2yu4 h MET 38 N 0.00 -0.19 -0.96 0.08 4.05 -0.63 -1.70 114.93 115.58 2yu4 h MET 38 Ca -0.02 0.01 0.06 0.00 -0.28 0.00 0.00 59.70 59.47 2yu4 h MET 38 Cb 1.39 0.04 -0.06 0.00 -0.80 0.00 0.00 31.60 32.17 2yu4 h MET 38 CO 0.06 0.24 0.62 0.82 0.23 0.00 0.00 176.91 178.89 2yu4 h ILE 39 N -0.89 1.10 -0.28 1.77 2.04 -1.67 0.26 117.51 119.84 2yu4 h ILE 39 Ca -0.02 -0.39 -0.15 0.00 1.00 0.00 0.00 64.86 65.31 2yu4 h ILE 39 Cb 0.52 -0.13 -0.01 0.00 -0.74 0.00 0.00 36.82 36.46 2yu4 h ILE 39 CO 0.03 0.21 -0.41 -0.33 0.00 0.00 0.00 178.15 177.65 2yu4 h GLU 40 N 1.13 0.69 -0.21 2.37 4.39 -1.61 -2.32 114.58 119.01 2yu4 h GLU 40 Ca 0.40 -0.36 -0.20 0.00 0.34 0.00 0.00 59.36 59.54 2yu4 h GLU 40 Cb 0.14 0.01 0.00 0.00 -0.10 0.00 0.00 28.75 28.81 2yu4 h GLU 40 CO -0.15 0.98 -0.67 0.77 -1.16 0.00 0.00 179.01 178.78 2yu4 h SER 41 N 0.56 0.92 0.25 1.42 0.02 -0.41 -3.05 113.55 113.26 2yu4 h SER 41 Ca 0.04 -0.55 -0.01 0.00 -0.84 0.00 0.00 61.79 60.43 2yu4 h SER 41 Cb 0.95 -0.27 0.00 0.00 0.14 0.00 0.00 62.40 63.23 2yu4 h SER 41 CO 0.09 1.34 -0.12 0.03 -1.14 0.00 0.00 176.83 177.03 2yu4 h ARG 42 N 0.58 -0.32 -0.93 3.45 2.47 -0.48 -2.74 114.38 116.41 2yu4 h ARG 42 Ca -0.02 0.02 0.20 0.00 -1.26 0.00 0.00 59.98 58.92 2yu4 h ARG 42 Cb 1.28 0.07 -0.08 0.00 -1.65 0.00 0.00 29.97 29.60 2yu4 h ARG 42 CO 0.14 -0.12 0.60 1.96 0.56 0.00 0.00 179.97 183.11 2yu4 h GLN 43 N -0.46 0.51 -0.65 0.04 4.20 -1.49 0.31 115.11 117.57 2yu4 h GLN 43 Ca -0.03 -0.03 -0.01 0.00 0.06 0.00 0.00 58.65 58.64 2yu4 h GLN 43 Cb 0.35 -0.12 -0.03 0.00 0.30 0.00 0.00 27.48 27.98 2yu4 h GLN 43 CO 0.06 0.34 0.37 0.87 -0.67 0.00 0.00 178.83 179.80 2yu4 h LYS 44 N 0.53 0.89 -0.83 1.46 1.79 -1.37 -1.68 116.57 117.36 2yu4 h LYS 44 Ca 0.50 -0.09 -0.31 0.00 -2.18 0.00 0.00 60.65 58.57 2yu4 h LYS 44 Cb 1.06 -0.18 -0.18 0.00 -1.58 0.00 0.00 32.23 31.35 2yu4 h LYS 44 CO -0.23 0.64 0.39 0.54 -1.08 0.00 0.00 179.45 179.71 2yu4 n ARG 45 N -4.39 3.30 -3.41 3.15 3.00 0.54 -4.90 116.66 113.96 2yu4 n ARG 45 Ca 0.06 -3.04 -0.25 0.00 -0.01 0.00 0.00 57.85 54.62 2yu4 n ARG 45 Cb 0.09 -2.21 0.01 0.00 0.00 0.00 0.00 32.46 30.35 2yu4 n ARG 45 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.63 179.26 2yu4 n LYS 46 N -0.43 -4.02 -1.59 5.56 4.76 -0.63 -4.96 118.16 116.86 2yu4 n LYS 46 Ca 0.47 0.57 -0.04 0.00 -2.87 0.00 0.00 58.31 56.44 2yu4 n LYS 46 Cb 1.48 -5.34 0.01 0.00 -1.84 0.00 0.00 35.03 29.33 2yu4 n LYS 46 CO 0.00 0.00 0.00 1.17 -1.37 0.00 0.00 177.40 177.20 2yu4 n LYS 47 N -3.96 1.08 -4.08 1.97 4.81 0.79 -4.97 118.16 113.81 2yu4 n LYS 47 Ca -0.02 -0.61 -0.14 0.00 -0.87 0.00 0.00 58.31 56.67 2yu4 n LYS 47 Cb 0.55 -0.00 -0.12 0.00 0.02 0.00 0.00 35.03 35.48 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 -2.47 0.54 -0.22 1.64 -2.85 -1.26 -4.14 119.74 110.98 2yu4 s LYS 48 Ca 0.09 -0.73 -0.29 0.00 -1.00 0.00 0.00 55.97 54.04 2yu4 s LYS 48 Cb -0.01 -0.34 -0.00 0.00 -2.06 0.00 0.00 37.83 35.41 2yu4 s LYS 48 CO 0.06 0.07 1.24 0.00 0.10 0.00 0.00 175.35 176.81 2yu4 s ALA 49 N -1.28 3.57 0.19 0.59 0.00 -1.26 -5.00 121.76 118.57 2yu4 s ALA 49 Ca -0.09 0.29 0.10 0.00 0.00 0.00 0.00 51.96 52.27 2yu4 s ALA 49 Cb -0.09 -3.66 -0.04 0.00 0.00 0.00 0.00 23.12 19.32 2yu4 s ALA 49 CO 0.00 -1.36 -0.21 1.52 0.00 0.00 0.00 175.76 175.72 2yu4 s TYR 50 N 3.74 2.10 -0.58 0.00 -0.85 -1.26 -0.38 117.35 120.13 2yu4 s TYR 50 Ca 0.53 -0.40 -0.31 0.00 -0.52 0.00 0.00 57.07 56.38 2yu4 s TYR 50 Cb -0.19 -1.03 -0.13 0.00 0.38 0.00 0.00 41.96 41.00 2yu4 s TYR 50 CO 0.16 0.46 2.41 0.00 -1.52 0.00 0.00 175.55 177.07 2yu4 h PRO 52 N 14.92 0.00 -5.92 0.00 0.13 -1.96 -3.43 132.00 135.74 2yu4 h PRO 52 Ca -0.20 0.00 -0.52 0.00 -0.87 0.00 0.00 66.00 64.41 2yu4 h PRO 52 Cb 1.30 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.42 2yu4 h PRO 52 CO 1.17 0.00 1.46 -1.14 -0.23 0.00 0.00 178.00 179.26 2yu4 s GLN 53 N -3.36 2.69 -0.56 0.86 2.00 -1.26 -4.86 119.66 115.17 2yu4 s GLN 53 Ca 0.04 1.33 -0.31 0.00 -2.00 0.00 0.00 55.36 54.42 2yu4 s GLN 53 Cb 0.09 -4.41 -0.12 0.00 0.80 0.00 0.00 33.01 29.37 2yu4 s GLN 53 CO 0.40 -2.62 2.40 -0.89 -0.50 0.00 0.00 175.29 174.08 2yu4 n ILE 54 N 7.63 0.05 0.00 -2.34 5.41 -1.26 -1.36 119.36 127.49 2yu4 n ILE 54 Ca 0.28 -0.39 0.00 0.00 1.00 0.00 0.00 62.75 63.64 2yu4 n ILE 54 Cb 0.51 -1.80 0.00 0.00 -0.71 0.00 0.00 39.64 37.64 2yu4 n ILE 54 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2yu4 n GLY 55 N 6.33 1.17 3.85 7.39 0.00 -1.26 -5.13 105.19 117.53 2yu4 n GLY 55 Ca 0.46 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 46.15 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 -0.36 0.15 -4.47 0.00 2.88 -1.26 -4.97 113.62 105.59 2yu4 n SER 57 Ca 0.04 0.07 -0.35 0.00 -1.33 0.00 0.00 58.87 57.29 2yu4 n SER 57 Cb 0.53 1.26 0.08 0.00 -0.75 0.00 0.00 64.21 65.34 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 -2.57 -0.78 -2.44 0.66 -0.00 -1.26 -4.96 115.22 103.88 2yu4 n HIS 58 Ca -0.17 0.33 -0.03 0.00 -0.00 0.00 0.00 57.72 57.86 2yu4 n HIS 58 Cb 0.85 -1.91 0.03 0.00 -0.00 0.00 0.00 29.99 28.97 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 -2.64 0.19 -3.58 3.57 -2.24 -1.26 -3.48 114.28 104.84 2yu4 n THR 59 Ca 0.10 -0.93 -0.29 0.00 -2.27 0.00 0.00 64.05 60.65 2yu4 n THR 59 Cb 0.51 0.87 -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 -1.60 3.62 -0.07 3.42 1.11 -1.24 -4.52 116.67 117.38 2yu4 s ASP 60 Ca 0.12 -1.40 0.03 0.00 0.18 0.00 0.00 52.55 51.48 2yu4 s ASP 60 Cb 0.26 -0.45 0.01 0.00 1.07 0.00 0.00 42.92 43.81 2yu4 s ASP 60 CO -0.08 -0.43 -0.15 -0.63 1.18 0.00 0.00 175.17 175.06 2yu4 s ILE 61 N 1.96 1.37 0.01 0.77 1.01 0.49 -4.88 121.20 121.92 2yu4 s ILE 61 Ca 0.10 -0.62 0.07 0.00 0.00 0.00 0.00 60.65 60.19 2yu4 s ILE 61 Cb -0.17 -1.22 -0.02 0.00 0.01 0.00 0.00 42.46 41.06 2yu4 s ILE 61 CO -0.33 0.41 -0.21 -0.13 0.00 0.00 0.00 174.94 174.67 2yu4 s ARG 62 N 0.53 1.62 0.58 2.79 0.52 -1.26 -4.34 118.95 119.39 2yu4 s ARG 62 Ca -0.15 -0.84 0.28 0.00 -0.52 0.00 0.00 55.73 54.51 2yu4 s ARG 62 Cb -0.16 -1.63 1.60 0.00 0.52 0.00 0.00 34.95 35.28 2yu4 s ARG 62 CO 0.05 0.44 2.05 -0.22 0.02 0.00 0.00 175.30 177.64 2yu4 h LYS 63 N 5.33 0.00 0.00 3.54 3.64 -1.97 0.24 116.57 127.35 2yu4 h LYS 63 Ca -0.41 0.00 -0.07 0.00 -1.27 0.00 0.00 60.65 58.90 2yu4 h LYS 63 Cb 1.14 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.95 2yu4 h LYS 63 CO 0.46 0.00 -0.32 1.03 -2.27 0.00 0.00 179.45 178.35 2yu4 h SER 64 N 0.00 0.00 -0.63 4.20 0.87 -2.04 -2.77 113.55 113.17 2yu4 h SER 64 Ca 0.12 0.00 -0.22 0.00 -1.23 0.00 0.00 61.79 60.46 2yu4 h SER 64 Cb 0.65 0.00 -0.13 0.00 -0.44 0.00 0.00 62.40 62.48 2yu4 h SER 64 CO -0.00 0.32 0.28 0.47 -0.53 0.00 0.00 176.83 177.37 2yu4 n ASP 65 N -3.52 4.12 -4.41 6.23 8.00 0.84 -4.88 116.55 122.94 2yu4 n ASP 65 Ca -0.00 -3.02 -0.34 0.00 0.71 0.00 0.00 54.79 52.14 2yu4 n ASP 65 Cb 0.47 -0.71 -0.13 0.00 -0.02 0.00 0.00 41.12 40.73 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 -2.40 3.03 0.14 0.64 1.43 -1.05 -1.49 118.68 118.99 2yu4 s LEU 66 Ca 0.44 -0.26 0.05 0.00 -1.03 0.00 0.00 54.13 53.33 2yu4 s LEU 66 Cb 0.35 -1.74 -0.04 0.00 0.03 0.00 0.00 46.19 44.79 2yu4 s LEU 66 CO 0.10 0.09 -0.11 0.27 0.23 0.00 0.00 176.35 176.94 2yu4 s ILE 67 N 0.81 1.22 -0.39 -0.59 -4.36 -0.78 -5.00 121.20 112.10 2yu4 s ILE 67 Ca -0.02 -1.99 -0.20 0.00 -0.26 0.00 0.00 60.65 58.18 2yu4 s ILE 67 Cb -0.15 -1.78 0.01 0.00 1.25 0.00 0.00 42.46 41.80 2yu4 s ILE 67 CO 0.02 -0.68 0.63 -1.10 0.24 0.00 0.00 174.94 174.05 2yu4 s GLN 68 N -3.52 3.49 -0.10 0.37 -0.21 -1.26 -1.23 119.66 117.20 2yu4 s GLN 68 Ca 0.15 -0.16 -0.30 0.00 0.02 0.00 0.00 55.36 55.08 2yu4 s GLN 68 Cb 0.01 -3.87 -0.02 0.00 1.00 0.00 0.00 33.01 30.12 2yu4 s GLN 68 CO 0.01 -0.86 1.22 0.34 -2.12 0.00 0.00 175.29 173.89 2yu4 s ASP 69 N 1.89 7.01 -0.12 5.90 -1.08 -1.00 -4.93 116.67 124.34 2yu4 s ASP 69 Ca 0.23 1.76 -0.23 0.00 -0.52 0.00 0.00 52.55 53.79 2yu4 s ASP 69 Cb -0.14 -2.55 -0.27 0.00 -1.46 0.00 0.00 42.92 38.50 2yu4 s ASP 69 CO 0.17 -0.65 0.67 -0.08 0.52 0.00 0.00 175.17 175.79 2yu4 h GLU 70 N 7.75 0.13 -0.88 4.34 4.81 -1.96 -2.60 114.58 126.17 2yu4 h GLU 70 Ca -0.31 -0.23 0.21 0.00 -0.13 0.00 0.00 59.36 58.90 2yu4 h GLU 70 Cb 1.14 0.09 -0.06 0.00 0.63 0.00 0.00 28.75 30.54 2yu4 h GLU 70 CO 0.92 1.11 0.60 0.00 -0.73 0.00 0.00 179.01 180.90 2yu4 h ALA 71 N -0.07 2.32 0.00 2.92 0.00 -2.00 0.12 119.26 122.56 2yu4 h ALA 71 Ca -0.16 0.01 -0.25 0.00 0.00 0.00 0.00 54.91 54.51 2yu4 h ALA 71 Cb 1.39 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 19.13 2yu4 h ALA 71 CO 0.02 -0.60 -1.40 1.25 0.00 0.00 0.00 179.25 178.52 2yu4 h LEU 72 N 0.32 0.00 0.71 0.00 5.85 -1.96 -3.21 115.31 117.02 2yu4 h LEU 72 Ca 0.45 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 59.14 2yu4 h LEU 72 Cb 1.25 0.00 0.01 0.00 0.37 0.00 0.00 40.66 42.29 2yu4 h LEU 72 CO -0.14 0.97 -0.34 0.03 -0.34 0.00 0.00 178.44 178.61 2yu4 h ARG 73 N 0.00 -0.92 -0.04 1.25 2.47 -0.41 -2.67 114.38 114.07 2yu4 h ARG 73 Ca -0.17 0.06 0.01 0.00 -1.26 0.00 0.00 59.98 58.62 2yu4 h ARG 73 Cb 1.89 0.21 -0.00 0.00 -1.65 0.00 0.00 29.97 30.41 2yu4 h ARG 73 CO 0.10 -0.59 0.03 0.00 0.56 0.00 0.00 179.97 180.06 2yu4 h ARG 74 N -1.17 0.00 0.88 0.04 3.08 -1.38 -2.81 114.38 113.03 2yu4 h ARG 74 Ca -0.10 0.00 -0.04 0.00 0.07 0.00 0.00 59.98 59.91 2yu4 h ARG 74 Cb 0.76 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.82 2yu4 h ARG 74 CO 0.16 0.00 -0.42 0.00 -1.07 0.00 0.00 179.97 178.64 2yu4 h ALA 75 N 1.98 -1.19 -0.82 0.04 0.00 -1.52 0.75 119.26 118.49 2yu4 h ALA 75 Ca 0.02 -0.26 0.17 0.00 0.00 0.00 0.00 54.91 54.84 2yu4 h ALA 75 Cb 0.08 0.46 -0.06 0.00 0.00 0.00 0.00 17.79 18.27 2yu4 h ALA 75 CO -0.00 -1.15 0.55 0.82 0.00 0.00 0.00 179.25 179.47 2yu4 h ILE 76 N -1.21 0.75 -0.22 0.00 2.04 -1.23 -0.66 117.51 116.98 2yu4 h ILE 76 Ca -0.12 -0.15 -0.14 0.00 1.00 0.00 0.00 64.86 65.45 2yu4 h ILE 76 Cb 0.91 0.28 0.00 0.00 -0.74 0.00 0.00 36.82 37.27 2yu4 h ILE 76 CO 0.20 0.08 -0.42 -0.33 0.00 0.00 0.00 178.15 177.68 2yu4 h GLU 77 N 0.44 0.68 -0.07 2.37 5.08 -1.31 -0.19 114.58 121.57 2yu4 h GLU 77 Ca 0.42 -0.43 0.02 0.00 -1.00 0.00 0.00 59.36 58.36 2yu4 h GLU 77 Cb 0.96 0.05 -0.00 0.00 0.50 0.00 0.00 28.75 30.26 2yu4 h GLU 77 CO -0.15 1.05 0.07 -0.97 -1.00 0.00 0.00 179.01 178.01 2yu4 h ASN 78 N 0.38 0.00 0.08 1.42 -1.24 0.70 0.24 115.58 117.16 2yu4 h ASN 78 Ca 0.01 0.00 -0.33 0.00 0.71 0.00 0.00 56.30 56.69 2yu4 h ASN 78 Cb 1.02 0.00 -0.03 0.00 0.73 0.00 0.00 38.32 40.05 2yu4 h ASN 78 CO 0.09 0.00 -1.80 1.57 -1.29 0.00 0.00 177.43 176.00 2yu4 n HIS 79 N -3.96 1.11 0.24 0.67 -0.00 -0.93 -4.14 115.22 108.21 2yu4 n HIS 79 Ca -0.01 0.30 0.07 0.00 0.46 0.00 0.00 57.72 58.54 2yu4 n HIS 79 Cb 0.16 -1.13 0.57 0.00 -0.12 0.00 0.00 29.99 29.47 2yu4 n HIS 79 CO 0.00 0.00 0.00 -0.97 0.46 0.00 0.00 176.34 175.83 2yu4 h ASN 80 N -0.30 0.00 -0.12 0.26 -0.73 -0.61 -1.55 115.58 112.53 2yu4 h ASN 80 Ca -0.42 0.00 0.03 0.00 1.87 0.00 0.00 56.30 57.79 2yu4 h ASN 80 Cb 1.79 0.00 -0.00 0.00 0.27 0.00 0.00 38.32 40.38 2yu4 h ASN 80 CO -0.03 0.10 0.12 0.07 -0.37 0.00 0.00 177.43 177.32 2yu4 h LYS 81 N 0.00 0.00 -0.30 6.67 5.09 -1.12 0.14 116.57 127.05 2yu4 h LYS 81 Ca -0.00 0.00 -0.04 0.00 0.09 0.00 0.00 60.65 60.70 2yu4 h LYS 81 Cb 0.17 0.00 -0.02 0.00 0.10 0.00 0.00 32.23 32.48 2yu4 h LYS 81 CO 0.01 0.00 0.01 -0.22 -2.09 0.00 0.00 179.45 177.16 2yu4 h LYS 82 N 0.00 0.46 0.06 0.07 3.11 -1.48 -3.18 116.57 115.60 2yu4 h LYS 82 Ca 0.06 -0.09 -0.38 0.00 -2.81 0.00 0.00 60.65 57.43 2yu4 h LYS 82 Cb 0.30 -0.07 -0.05 0.00 -1.00 0.00 0.00 32.23 31.41 2yu4 h LYS 82 CO -0.00 0.48 -2.26 -2.13 -2.81 0.00 0.00 179.45 172.73 2yu4 n ARG 83 N -4.31 0.70 -0.26 1.90 0.63 -0.22 -4.88 116.66 110.23 2yu4 n ARG 83 Ca 0.01 0.20 -0.31 0.00 -0.92 0.00 0.00 57.85 56.83 2yu4 n ARG 83 Cb 0.22 -1.61 0.30 0.00 0.45 0.00 0.00 32.46 31.82 2yu4 n ARG 83 CO 0.00 0.00 0.00 -1.01 -2.51 0.00 0.00 177.63 174.11 2yu4 s HIS 84 N -2.54 -0.83 0.00 -0.14 3.76 0.32 -3.97 115.29 111.89 2yu4 s HIS 84 Ca -0.29 0.59 0.00 0.00 -0.15 0.00 0.00 55.06 55.21 2yu4 s HIS 84 Cb 0.08 -2.80 0.00 0.00 1.11 0.00 0.00 32.58 30.97 2yu4 s HIS 84 CO 0.68 -5.19 0.00 0.54 -0.85 0.00 0.00 174.74 169.92 2yu4 n ARG 85 N -5.79 0.00 -2.06 1.40 5.12 -1.26 -4.76 116.66 109.31 2yu4 n ARG 85 Ca 0.13 0.00 -0.41 0.00 -1.93 0.00 0.00 57.85 55.63 2yu4 n ARG 85 Cb 0.60 0.00 -0.03 0.00 -1.16 0.00 0.00 32.46 31.87 2yu4 n ARG 85 CO 0.00 0.00 0.00 -1.01 -1.93 0.00 0.00 177.63 174.69 2yu4 s HIS 86 N 0.00 1.82 0.48 -1.55 3.76 -1.25 -4.98 115.29 113.57 2yu4 s HIS 86 Ca 0.00 0.70 0.06 0.00 -0.15 0.00 0.00 55.06 55.67 2yu4 s HIS 86 Cb 0.00 -4.13 0.03 0.00 1.11 0.00 0.00 32.58 29.58 2yu4 s HIS 86 CO 0.00 -2.59 0.66 0.45 -0.85 0.00 0.00 174.74 172.41 2yu4 s SER 87 N 6.61 5.46 0.73 1.40 0.15 -1.26 -4.96 113.70 121.83 2yu4 s SER 87 Ca 0.73 -0.36 -0.11 0.00 0.70 0.00 0.00 55.95 56.91 2yu4 s SER 87 Cb -0.18 -0.60 0.03 0.00 -1.71 0.00 0.00 66.02 63.57 2yu4 s SER 87 CO 0.29 -0.95 1.07 -0.70 1.20 0.00 0.00 173.24 174.14 2yu4 s GLU 88 N -4.51 2.62 -0.49 5.44 -6.30 -1.26 -4.90 118.70 109.30 2yu4 s GLU 88 Ca 0.57 0.91 -0.26 0.00 -2.50 0.00 0.00 54.97 53.68 2yu4 s GLU 88 Cb -0.10 -1.96 -0.05 0.00 0.00 0.00 0.00 34.13 32.02 2yu4 s GLU 88 CO 0.35 -1.31 2.25 -1.12 0.02 0.00 0.00 175.26 175.45 2yu4 s SER 89 N -3.76 4.77 0.00 -1.70 0.01 -1.26 -4.67 113.70 107.09 2yu4 s SER 89 Ca 0.59 1.00 0.00 0.00 1.31 0.00 0.00 55.95 58.85 2yu4 s SER 89 Cb -0.15 -2.51 0.00 0.00 0.21 0.00 0.00 66.02 63.58 2yu4 s SER 89 CO 0.55 -2.64 0.00 0.61 0.41 0.00 0.00 173.24 172.17 2yu4 n GLY 90 N 5.89 0.81 0.18 3.44 0.00 -1.26 -4.68 105.19 109.57 2yu4 n GLY 90 Ca 0.32 -2.05 -0.02 0.00 0.00 0.00 0.00 46.02 44.27 2yu4 n GLY 90 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2yu4 h PRO 91 N 0.00 0.17 -5.27 1.61 0.13 -2.03 -3.42 132.00 123.20 2yu4 h PRO 91 Ca 0.00 -0.09 -0.61 0.00 -0.87 0.00 0.00 66.00 64.43 2yu4 h PRO 91 Cb 0.00 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 31.01 2yu4 h PRO 91 CO 0.00 0.61 -0.40 -1.12 -0.23 0.00 0.00 178.00 176.86 2yu4 s SER 92 N -6.88 6.27 0.29 1.44 0.01 -1.26 -5.05 113.70 108.51 2yu4 s SER 92 Ca -0.04 0.30 0.08 0.00 1.31 0.00 0.00 55.95 57.60 2yu4 s SER 92 Cb 0.13 -2.15 -0.04 0.00 0.21 0.00 0.00 66.02 64.18 2yu4 s SER 92 CO 0.77 0.06 0.17 -0.94 0.41 0.00 0.00 173.24 173.70 2yu4 s SER 93 N 0.83 5.13 0.00 2.44 1.04 -1.26 -4.78 113.70 117.11 2yu4 s SER 93 Ca 0.12 -0.47 0.26 0.00 0.48 0.00 0.00 55.95 56.34 2yu4 s SER 93 Cb -0.13 -1.08 0.66 0.00 0.10 0.00 0.00 66.02 65.57 2yu4 s SER 93 CO 0.04 -0.15 1.52 0.61 0.98 0.00 0.00 173.24 176.25