#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yl4 s ILE 4 N 0.00 1.24 -0.13 -0.18 1.01 -0.31 -4.27 121.20 118.56 1yl4 s ILE 4 Ca 0.00 -1.10 -0.01 0.00 0.00 0.00 0.00 60.65 59.54 1yl4 s ILE 4 Cb 0.00 -1.12 -0.02 0.00 0.01 0.00 0.00 42.46 41.33 1yl4 s ILE 4 CO 0.00 0.01 -0.08 -0.60 0.00 0.00 0.00 174.94 174.26 1yl4 s ARG 5 N -1.26 3.38 -0.11 2.79 3.52 -0.58 -1.21 118.95 125.48 1yl4 s ARG 5 Ca 0.02 -0.60 0.02 0.00 -0.13 0.00 0.00 55.73 55.05 1yl4 s ARG 5 Cb -0.08 -2.73 0.01 0.00 -1.56 0.00 0.00 34.95 30.59 1yl4 s ARG 5 CO 0.02 0.30 -0.18 0.96 -0.81 0.00 0.00 175.30 175.59 1yl4 s ILE 6 N 0.15 1.70 -0.24 4.11 -4.36 -1.25 -1.08 121.20 120.22 1yl4 s ILE 6 Ca -0.04 -0.77 0.02 0.00 -0.26 0.00 0.00 60.65 59.60 1yl4 s ILE 6 Cb -0.14 -1.52 0.05 0.00 1.25 0.00 0.00 42.46 42.10 1yl4 s ILE 6 CO 0.04 0.48 -0.13 -0.75 0.24 0.00 0.00 174.94 174.82 1yl4 s LYS 7 N 0.81 2.47 -0.23 0.37 2.20 0.17 -4.21 119.74 121.31 1yl4 s LYS 7 Ca -0.10 -1.20 -0.00 0.00 -0.36 0.00 0.00 55.97 54.32 1yl4 s LYS 7 Cb -0.16 -2.81 0.03 0.00 -1.51 0.00 0.00 37.83 33.38 1yl4 s LYS 7 CO 0.01 -0.47 -0.11 -0.51 -0.36 0.00 0.00 175.35 173.91 1yl4 s LEU 8 N 1.16 2.92 0.04 5.43 1.43 -0.19 -0.94 118.68 128.53 1yl4 s LEU 8 Ca -0.05 -0.90 -0.11 0.00 -1.03 0.00 0.00 54.13 52.04 1yl4 s LEU 8 Cb -0.18 -1.59 -0.06 0.00 0.03 0.00 0.00 46.19 44.39 1yl4 s LEU 8 CO -0.07 -0.10 0.39 0.00 0.23 0.00 0.00 176.35 176.80 1yl4 s ARG 9 N 1.27 3.79 0.26 1.70 1.70 -1.17 -0.96 118.95 125.54 1yl4 s ARG 9 Ca -0.00 0.24 -0.14 0.00 -0.47 0.00 0.00 55.73 55.36 1yl4 s ARG 9 Cb -0.16 -3.09 0.00 0.00 -0.57 0.00 0.00 34.95 31.13 1yl4 s ARG 9 CO -0.07 0.62 0.52 0.20 -1.08 0.00 0.00 175.30 175.49 1yl4 s GLY 10 N -1.48 0.47 0.00 3.88 0.00 -0.22 -3.12 107.32 106.85 1yl4 s GLY 10 Ca 0.29 -0.81 0.00 0.00 0.00 0.00 0.00 44.72 44.19 1yl4 s GLY 10 CO 0.16 -0.55 0.00 0.69 0.00 0.00 0.00 173.10 173.39 1yl4 n PHE 11 N -0.40 0.00 -1.54 1.90 0.99 -1.26 -0.96 117.46 116.19 1yl4 n PHE 11 Ca -0.02 0.00 -0.49 0.00 -0.00 0.00 0.00 57.45 56.94 1yl4 n PHE 11 Cb 0.61 0.00 -0.06 0.00 -1.00 0.00 0.00 39.48 39.04 1yl4 n PHE 11 CO 0.00 0.00 0.00 -3.47 -0.00 0.00 0.00 176.76 173.29 1yl4 n ASP 12 N -1.37 2.64 -0.49 4.37 -0.08 -1.26 -4.66 116.55 115.70 1yl4 n ASP 12 Ca 0.00 0.50 0.00 0.00 -1.51 0.00 0.00 54.79 53.78 1yl4 n ASP 12 Cb 0.00 -1.34 0.00 0.00 2.34 0.00 0.00 41.12 42.12 1yl4 n ASP 12 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1yl4 n HIS 13 N 9.44 0.00 -0.03 -0.67 1.44 -1.26 -2.50 115.22 121.63 1yl4 n HIS 13 Ca 0.34 0.00 -0.08 0.00 -2.01 0.00 0.00 57.72 55.97 1yl4 n HIS 13 Cb 0.28 0.00 -0.03 0.00 0.12 0.00 0.00 29.99 30.37 1yl4 n HIS 13 CO 0.00 0.00 0.00 1.63 -2.81 0.00 0.00 176.34 175.16 1yl4 n LYS 14 N 0.47 0.23 -0.34 -1.40 5.02 -1.26 -4.53 118.16 116.36 1yl4 n LYS 14 Ca 0.00 0.10 0.20 0.00 -2.02 0.00 0.00 58.31 56.59 1yl4 n LYS 14 Cb 0.00 -0.90 0.43 0.00 -0.02 0.00 0.00 35.03 34.54 1yl4 n LYS 14 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1yl4 h THR 15 N -0.42 0.46 -0.10 -0.18 1.03 -1.88 0.97 112.91 112.79 1yl4 h THR 15 Ca -0.15 -0.16 -0.08 0.00 -0.01 0.00 0.00 66.41 66.01 1yl4 h THR 15 Cb 0.85 -0.06 -0.01 0.00 -1.07 0.00 0.00 68.15 67.85 1yl4 h THR 15 CO -0.09 0.09 -0.30 -0.07 -0.01 0.00 0.00 175.52 175.13 1yl4 h LEU 16 N 0.48 0.19 0.16 0.00 -0.00 -1.85 0.06 115.31 114.34 1yl4 h LEU 16 Ca 0.67 -0.06 -0.01 0.00 -0.00 0.00 0.00 57.88 58.48 1yl4 h LEU 16 Cb 1.42 -0.05 0.00 0.00 -0.00 0.00 0.00 40.66 42.03 1yl4 h LEU 16 CO -0.49 0.49 -0.08 0.44 -0.00 0.00 0.00 178.44 178.81 1yl4 h ASP 17 N 0.17 -0.18 0.08 -0.43 3.32 0.67 0.12 116.42 120.17 1yl4 h ASP 17 Ca 0.02 -0.26 0.02 0.00 0.02 0.00 0.00 57.03 56.84 1yl4 h ASP 17 Cb 0.62 0.05 -0.04 0.00 0.22 0.00 0.00 39.33 40.18 1yl4 h ASP 17 CO 0.05 0.18 -0.28 0.00 -1.72 0.00 0.00 179.24 177.47 1yl4 h ALA 18 N 0.20 -0.45 0.57 3.45 0.00 -0.91 -0.50 119.26 121.64 1yl4 h ALA 18 Ca -0.02 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 1yl4 h ALA 18 Cb 0.43 0.46 -0.01 0.00 0.00 0.00 0.00 17.79 18.67 1yl4 h ALA 18 CO 0.04 -0.81 -0.46 1.03 0.00 0.00 0.00 179.25 179.05 1yl4 h SER 19 N -0.47 -1.21 -0.69 0.00 0.87 -1.00 -0.24 113.55 110.81 1yl4 h SER 19 Ca 0.04 0.08 0.02 0.00 -1.23 0.00 0.00 61.79 60.70 1yl4 h SER 19 Cb 0.52 0.38 -0.04 0.00 -0.44 0.00 0.00 62.40 62.82 1yl4 h SER 19 CO -0.19 -0.64 0.45 0.00 -0.53 0.00 0.00 176.83 175.92 1yl4 h ALA 20 N -1.10 0.89 -0.50 6.23 0.00 -0.96 -0.65 119.26 123.17 1yl4 h ALA 20 Ca -0.07 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.74 1yl4 h ALA 20 Cb 0.83 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.35 1yl4 h ALA 20 CO 0.01 0.26 0.08 0.37 0.00 0.00 0.00 179.25 179.97 1yl4 h GLN 21 N 0.90 0.83 -0.48 0.00 4.15 -1.08 -0.17 115.11 119.25 1yl4 h GLN 21 Ca 0.26 -0.22 0.06 0.00 0.77 0.00 0.00 58.65 59.52 1yl4 h GLN 21 Cb -0.06 -0.10 -0.05 0.00 0.21 0.00 0.00 27.48 27.48 1yl4 h GLN 21 CO -0.07 0.82 0.19 0.87 -1.93 0.00 0.00 178.83 178.71 1yl4 h LYS 22 N 0.70 0.36 0.15 1.69 1.79 -0.64 -0.44 116.57 120.19 1yl4 h LYS 22 Ca 0.15 -0.02 0.02 0.00 -2.18 0.00 0.00 60.65 58.62 1yl4 h LYS 22 Cb 0.40 -0.08 -0.04 0.00 -1.58 0.00 0.00 32.23 30.93 1yl4 h LYS 22 CO 0.01 0.24 -0.32 0.82 -1.08 0.00 0.00 179.45 179.12 1yl4 h ILE 23 N 0.38 0.32 -0.91 1.86 5.03 -0.41 0.22 117.51 123.99 1yl4 h ILE 23 Ca 0.23 0.00 0.19 0.00 -0.12 0.00 0.00 64.86 65.16 1yl4 h ILE 23 Cb 0.22 0.32 -0.11 0.00 -3.03 0.00 0.00 36.82 34.22 1yl4 h ILE 23 CO -0.22 0.00 0.47 0.58 -0.68 0.00 0.00 178.15 178.31 1yl4 h VAL 24 N -0.56 0.62 0.03 1.67 2.07 -0.45 -1.21 116.25 118.42 1yl4 h VAL 24 Ca 0.02 -0.20 -0.36 0.00 0.82 0.00 0.00 66.70 66.99 1yl4 h VAL 24 Cb 0.58 -0.00 -0.05 0.00 -1.52 0.00 0.00 31.29 30.29 1yl4 h VAL 24 CO -0.17 0.10 -2.17 -0.62 0.02 0.00 0.00 177.57 174.74 1yl4 n GLU 25 N -4.91 0.68 0.17 1.57 1.02 -0.23 -3.69 120.64 115.26 1yl4 n GLU 25 Ca 0.21 0.17 -0.07 0.00 -0.02 0.00 0.00 57.16 57.45 1yl4 n GLU 25 Cb 0.57 -1.63 -0.03 0.00 -0.02 0.00 0.00 31.44 30.33 1yl4 n GLU 25 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1yl4 h ALA 26 N 0.49 -0.76 0.00 0.62 0.00 -0.94 -2.03 119.26 116.64 1yl4 h ALA 26 Ca -0.47 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.34 1yl4 h ALA 26 Cb 2.05 0.18 0.00 0.00 0.00 0.00 0.00 17.79 20.02 1yl4 h ALA 26 CO 0.02 -0.73 0.22 0.00 0.00 0.00 0.00 179.25 178.77 1yl4 n ALA 27 N -2.38 0.69 0.37 0.00 0.00 -0.46 -2.52 120.51 116.20 1yl4 n ALA 27 Ca -0.06 0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.48 1yl4 n ALA 27 Cb 0.18 -0.83 0.00 0.00 0.00 0.00 0.00 19.45 18.81 1yl4 n ALA 27 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1yl4 n ARG 28 N -1.89 0.52 -2.71 0.00 1.74 -0.76 -1.71 116.66 111.85 1yl4 n ARG 28 Ca -0.01 0.00 -0.04 0.00 -0.77 0.00 0.00 57.85 57.03 1yl4 n ARG 28 Cb 0.24 -1.24 0.10 0.00 -1.02 0.00 0.00 32.46 30.54 1yl4 n ARG 28 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1yl4 n ARG 29 N 0.94 1.36 0.00 5.56 1.74 -1.05 -4.93 116.66 120.27 1yl4 n ARG 29 Ca 0.00 -2.08 0.00 0.00 -0.77 0.00 0.00 57.85 55.00 1yl4 n ARG 29 Cb 0.26 -0.30 0.00 0.00 -1.02 0.00 0.00 32.46 31.40 1yl4 n ARG 29 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 1yl4 n SER 30 N -0.91 0.00 -2.36 0.55 3.41 -0.95 -4.73 113.62 108.64 1yl4 n SER 30 Ca -0.06 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.55 1yl4 n SER 30 Cb 0.85 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.80 1yl4 n SER 30 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1yl4 n GLY 31 N 0.00 0.33 0.05 5.00 0.00 -0.69 -4.25 105.19 105.63 1yl4 n GLY 31 Ca 0.00 -1.66 -0.02 0.00 0.00 0.00 0.00 46.02 44.34 1yl4 n GLY 31 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yl4 h ALA 32 N -1.79 -1.00 0.00 4.61 0.00 -0.20 -3.46 119.26 117.43 1yl4 h ALA 32 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1yl4 h ALA 32 Cb 0.00 0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1yl4 h ALA 32 CO 0.00 -0.99 0.00 1.04 0.00 0.00 0.00 179.25 179.30 1yl4 n GLN 33 N -2.39 0.00 -0.05 0.00 6.02 -1.26 -4.97 117.38 114.72 1yl4 n GLN 33 Ca -0.02 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.97 1yl4 n GLN 33 Cb 0.05 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.31 1yl4 n GLN 33 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 1yl4 n VAL 34 N 0.00 -1.00 0.84 5.09 0.31 -1.26 -4.78 118.33 117.52 1yl4 n VAL 34 Ca 0.00 0.00 0.06 0.00 -0.01 0.00 0.00 64.34 64.39 1yl4 n VAL 34 Cb 0.00 -1.00 0.33 0.00 -0.91 0.00 0.00 33.84 32.26 1yl4 n VAL 34 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1yl4 n SER 35 N -0.40 0.00 -0.39 4.52 2.88 0.08 -4.95 113.62 115.36 1yl4 n SER 35 Ca 0.00 -0.50 0.00 0.00 -1.33 0.00 0.00 58.87 57.04 1yl4 n SER 35 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 1yl4 n SER 35 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1yl4 n GLY 36 N -0.14 -3.35 3.45 0.46 0.00 -1.26 -4.75 105.19 99.59 1yl4 n GLY 36 Ca 0.08 -1.07 -0.49 0.00 0.00 0.00 0.00 46.02 44.54 1yl4 n GLY 36 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1yl4 n PRO 37 N -1.08 0.96 -3.57 1.61 -0.04 -1.26 -3.50 135.00 128.12 1yl4 n PRO 37 Ca 0.00 0.24 -0.28 0.00 -0.04 0.00 0.00 63.50 63.41 1yl4 n PRO 37 Cb 0.02 -2.43 -0.09 0.00 -0.04 0.00 0.00 33.50 30.96 1yl4 n PRO 37 CO 0.00 0.00 0.00 0.44 -0.04 0.00 0.00 175.50 175.90 1yl4 n ILE 38 N 7.25 2.29 0.00 0.52 -5.35 -1.26 -4.81 119.36 118.00 1yl4 n ILE 38 Ca 0.43 -5.14 0.00 0.00 -0.27 0.00 0.00 62.75 57.77 1yl4 n ILE 38 Cb 0.23 -2.14 0.00 0.00 -1.74 0.00 0.00 39.64 35.99 1yl4 n ILE 38 CO 0.00 0.00 0.00 -0.81 -1.76 0.00 0.00 176.55 173.98 1yl4 n PRO 39 N 1.28 0.00 -0.09 6.28 -0.04 -1.25 -3.07 135.00 138.11 1yl4 n PRO 39 Ca 0.26 0.10 0.00 0.00 -0.04 0.00 0.00 63.50 63.82 1yl4 n PRO 39 Cb 0.39 -0.19 0.00 0.00 -0.04 0.00 0.00 33.50 33.66 1yl4 n PRO 39 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1yl4 n LEU 40 N -0.76 -0.97 0.00 1.53 4.77 -1.26 -3.31 117.00 117.00 1yl4 n LEU 40 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 1yl4 n LEU 40 Cb 0.00 0.14 0.00 0.00 -2.33 0.00 0.00 43.42 41.23 1yl4 n LEU 40 CO 0.00 0.00 0.00 -0.81 -1.33 0.00 0.00 177.39 175.25 1yl4 n PRO 41 N 1.39 0.00 -1.48 3.23 -0.04 -1.26 -4.14 135.00 132.70 1yl4 n PRO 41 Ca 0.00 0.00 -0.36 0.00 -0.04 0.00 0.00 63.50 63.10 1yl4 n PRO 41 Cb 0.00 0.00 0.08 0.00 -0.04 0.00 0.00 33.50 33.54 1yl4 n PRO 41 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 1yl4 n THR 42 N 0.00 3.58 -4.13 0.52 -1.04 -1.26 -4.86 114.28 107.10 1yl4 n THR 42 Ca 0.00 -0.40 -0.16 0.00 -2.04 0.00 0.00 64.05 61.45 1yl4 n THR 42 Cb 0.00 -1.27 -0.12 0.00 -1.82 0.00 0.00 70.33 67.12 1yl4 n THR 42 CO 0.00 0.00 0.00 -0.13 -0.64 0.00 0.00 175.07 174.30 1yl4 s ARG 43 N -3.44 0.70 -0.01 -2.82 0.52 -0.08 -5.00 118.95 108.82 1yl4 s ARG 43 Ca 0.77 -0.87 0.02 0.00 -0.52 0.00 0.00 55.73 55.13 1yl4 s ARG 43 Cb -0.36 -0.60 -0.00 0.00 0.52 0.00 0.00 34.95 34.51 1yl4 s ARG 43 CO 0.46 0.13 -0.07 0.08 0.02 0.00 0.00 175.30 175.92 1yl4 s VAL 44 N -1.31 0.58 -0.08 3.52 1.01 -1.26 -0.90 120.40 121.96 1yl4 s VAL 44 Ca -0.05 -0.28 0.00 0.00 0.00 0.00 0.00 61.98 61.64 1yl4 s VAL 44 Cb -0.10 -0.51 -0.03 0.00 0.00 0.00 0.00 36.38 35.74 1yl4 s VAL 44 CO 0.01 0.18 -0.06 -0.13 0.00 0.00 0.00 175.10 175.10 1yl4 s ARG 45 N 0.02 2.88 0.01 2.72 1.81 -0.22 -5.01 118.95 121.16 1yl4 s ARG 45 Ca 0.00 -0.53 0.03 0.00 -1.72 0.00 0.00 55.73 53.50 1yl4 s ARG 45 Cb -0.05 -2.65 -0.01 0.00 -0.45 0.00 0.00 34.95 31.79 1yl4 s ARG 45 CO -0.00 0.62 -0.08 1.03 -0.68 0.00 0.00 175.30 176.19 1yl4 s ARG 46 N -0.68 0.61 -0.04 3.54 1.81 -1.26 -0.77 118.95 122.16 1yl4 s ARG 46 Ca 0.10 -0.43 -0.01 0.00 -1.72 0.00 0.00 55.73 53.67 1yl4 s ARG 46 Cb -0.11 -0.55 0.03 0.00 -0.45 0.00 0.00 34.95 33.87 1yl4 s ARG 46 CO 0.02 0.14 0.08 -0.59 -0.68 0.00 0.00 175.30 174.26 1yl4 s PHE 47 N -0.52 -0.05 0.13 -0.53 -0.12 -0.28 -5.01 117.98 111.60 1yl4 s PHE 47 Ca -0.00 0.27 0.06 0.00 -0.05 0.00 0.00 56.93 57.21 1yl4 s PHE 47 Cb -0.05 -0.17 -0.04 0.00 -0.63 0.00 0.00 43.02 42.13 1yl4 s PHE 47 CO 0.00 -0.12 -0.01 0.99 -0.05 0.00 0.00 175.22 176.04 1yl4 s THR 48 N 1.08 3.86 0.29 -4.49 2.01 -1.26 -1.25 115.64 115.88 1yl4 s THR 48 Ca -0.09 -1.18 0.05 0.00 0.31 0.00 0.00 61.69 60.78 1yl4 s THR 48 Cb -0.12 -2.88 -0.03 0.00 0.01 0.00 0.00 72.50 69.48 1yl4 s THR 48 CO -0.04 0.03 0.22 -0.69 -0.69 0.00 0.00 174.62 173.45 1yl4 s VAL 49 N -1.47 0.04 -0.32 3.82 1.01 -0.79 -5.00 120.40 117.69 1yl4 s VAL 49 Ca 0.26 -2.00 -0.13 0.00 0.00 0.00 0.00 61.98 60.11 1yl4 s VAL 49 Cb -0.11 -2.50 -0.03 0.00 0.00 0.00 0.00 36.38 33.75 1yl4 s VAL 49 CO 0.18 0.00 0.28 -0.63 0.00 0.00 0.00 175.10 174.93 1yl4 s ILE 50 N -3.65 5.25 0.29 2.22 1.01 -1.26 -2.85 121.20 122.20 1yl4 s ILE 50 Ca 0.40 0.05 -0.05 0.00 0.00 0.00 0.00 60.65 61.05 1yl4 s ILE 50 Cb 0.04 -3.69 0.07 0.00 0.01 0.00 0.00 42.46 38.89 1yl4 s ILE 50 CO 0.22 0.06 0.24 0.54 0.00 0.00 0.00 174.94 176.00 1yl4 n ARG 51 N 5.19 -1.78 -0.94 2.79 1.74 -1.26 -4.44 116.66 117.96 1yl4 n ARG 51 Ca -0.12 -0.38 0.00 0.00 -0.77 0.00 0.00 57.85 56.58 1yl4 n ARG 51 Cb 0.50 -0.39 0.00 0.00 -1.02 0.00 0.00 32.46 31.56 1yl4 n ARG 51 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1yl4 n GLY 52 N 0.30 0.00 3.35 -0.13 0.00 -1.26 -4.60 105.19 102.85 1yl4 n GLY 52 Ca 0.03 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.62 1yl4 n GLY 52 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1yl4 n PRO 53 N 0.68 0.11 -1.13 1.61 -0.04 -1.26 -4.66 135.00 130.32 1yl4 n PRO 53 Ca 0.00 0.04 0.00 0.00 -0.04 0.00 0.00 63.50 63.50 1yl4 n PRO 53 Cb 0.08 -1.09 0.00 0.00 -0.04 0.00 0.00 33.50 32.45 1yl4 n PRO 53 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 1yl4 n PHE 54 N -0.69 -1.82 -1.55 0.54 7.35 -1.26 -4.97 117.46 115.05 1yl4 n PHE 54 Ca 0.13 1.09 0.00 0.00 -0.76 0.00 0.00 57.45 57.91 1yl4 n PHE 54 Cb 0.36 -2.63 0.00 0.00 0.35 0.00 0.00 39.48 37.56 1yl4 n PHE 54 CO 0.00 0.00 0.00 0.36 -0.76 0.00 0.00 176.76 176.36 1yl4 n LYS 55 N 0.69 0.00 0.00 -4.13 2.85 -1.26 -5.05 118.16 111.26 1yl4 n LYS 55 Ca 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.26 1yl4 n LYS 55 Cb 0.00 -0.48 0.00 0.00 -0.65 0.00 0.00 35.03 33.90 1yl4 n LYS 55 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 177.40 178.07 1yl4 n HIS 56 N 1.59 0.00 0.15 5.58 8.25 -1.26 -5.01 115.22 124.51 1yl4 n HIS 56 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 1yl4 n HIS 56 Cb 0.00 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.11 1yl4 n HIS 56 CO 0.00 0.00 0.00 1.17 0.64 0.00 0.00 176.34 178.15 1yl4 n LYS 57 N 0.00 0.15 0.20 -0.41 4.81 -1.26 -3.72 118.16 117.94 1yl4 n LYS 57 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 1yl4 n LYS 57 Cb 0.00 -1.25 0.00 0.00 0.02 0.00 0.00 35.03 33.80 1yl4 n LYS 57 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 1yl4 n ASP 58 N 0.67 -2.97 0.00 3.14 8.00 -1.26 -5.00 116.55 119.13 1yl4 n ASP 58 Ca 0.00 0.76 0.00 0.00 0.71 0.00 0.00 54.79 56.26 1yl4 n ASP 58 Cb 0.06 2.84 0.00 0.00 -0.02 0.00 0.00 41.12 44.00 1yl4 n ASP 58 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1yl4 n SER 59 N -3.42 0.00 0.00 -2.24 7.64 -1.24 -4.56 113.62 109.80 1yl4 n SER 59 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1yl4 n SER 59 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 1yl4 n SER 59 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1yl4 n ARG 60 N 0.00 0.00 0.00 1.43 3.00 -1.13 -4.62 116.66 115.34 1yl4 n ARG 60 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.85 57.84 1yl4 n ARG 60 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.46 1yl4 n ARG 60 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.63 175.72 1yl4 n GLU 61 N -0.01 0.00 -3.53 5.56 2.13 -1.25 -4.66 120.64 118.88 1yl4 n GLU 61 Ca 0.00 0.00 -0.10 0.00 0.66 0.00 0.00 57.16 57.72 1yl4 n GLU 61 Cb 0.00 0.00 -0.02 0.00 0.27 0.00 0.00 31.44 31.69 1yl4 n GLU 61 CO 0.00 0.00 0.00 -3.38 -0.41 0.00 0.00 177.13 173.34 1yl4 s HIS 62 N -1.05 -0.43 0.24 4.31 -3.43 -1.26 -1.88 115.29 111.78 1yl4 s HIS 62 Ca 0.00 0.17 0.07 0.00 -0.80 0.00 0.00 55.06 54.50 1yl4 s HIS 62 Cb 0.00 0.59 -0.05 0.00 -1.43 0.00 0.00 32.58 31.69 1yl4 s HIS 62 CO 0.00 -0.90 -0.09 -0.06 -2.00 0.00 0.00 174.74 171.68 1yl4 s PHE 63 N -3.71 1.78 0.04 0.38 0.40 -0.38 -4.99 117.98 111.49 1yl4 s PHE 63 Ca 0.04 -0.67 0.06 0.00 -0.60 0.00 0.00 56.93 55.76 1yl4 s PHE 63 Cb -0.02 -0.93 -0.02 0.00 0.51 0.00 0.00 43.02 42.55 1yl4 s PHE 63 CO -0.08 0.27 -0.18 -1.83 0.70 0.00 0.00 175.22 174.10 1yl4 s GLU 64 N -3.71 1.26 -0.29 0.44 4.04 -1.26 -1.12 118.70 118.06 1yl4 s GLU 64 Ca 0.26 -0.85 0.03 0.00 0.04 0.00 0.00 54.97 54.45 1yl4 s GLU 64 Cb 0.02 -1.33 0.08 0.00 0.02 0.00 0.00 34.13 32.92 1yl4 s GLU 64 CO 0.09 0.34 -0.02 -1.17 -1.84 0.00 0.00 175.26 172.65 1yl4 s LEU 65 N -1.07 3.70 0.10 1.83 0.20 0.05 -5.00 118.68 118.49 1yl4 s LEU 65 Ca 0.06 -1.66 0.08 0.00 0.69 0.00 0.00 54.13 53.30 1yl4 s LEU 65 Cb -0.08 -1.46 -0.04 0.00 -0.43 0.00 0.00 46.19 44.17 1yl4 s LEU 65 CO 0.01 -0.29 -0.17 0.00 -0.29 0.00 0.00 176.35 175.62 1yl4 s ARG 66 N 1.11 1.88 -0.07 1.98 1.70 -1.26 -1.05 118.95 123.23 1yl4 s ARG 66 Ca 0.00 -1.12 0.05 0.00 -0.47 0.00 0.00 55.73 54.19 1yl4 s ARG 66 Cb -0.19 -2.15 -0.00 0.00 -0.57 0.00 0.00 34.95 32.03 1yl4 s ARG 66 CO -0.08 0.50 -0.24 0.99 -1.08 0.00 0.00 175.30 175.39 1yl4 s THR 67 N -1.11 1.99 0.33 4.99 2.01 -0.07 -4.59 115.64 119.19 1yl4 s THR 67 Ca 0.18 -1.01 0.09 0.00 0.31 0.00 0.00 61.69 61.26 1yl4 s THR 67 Cb -0.11 -1.70 -0.05 0.00 0.01 0.00 0.00 72.50 70.65 1yl4 s THR 67 CO 0.09 0.55 0.05 -1.00 -0.69 0.00 0.00 174.62 173.63 1yl4 s HIS 68 N 0.09 2.61 0.01 4.92 0.09 -0.13 -0.90 115.29 121.98 1yl4 s HIS 68 Ca -0.10 -0.40 -0.06 0.00 -0.00 0.00 0.00 55.06 54.50 1yl4 s HIS 68 Cb -0.15 -1.51 -0.00 0.00 -0.00 0.00 0.00 32.58 30.91 1yl4 s HIS 68 CO 0.06 0.45 0.10 -0.80 -0.00 0.00 0.00 174.74 174.55 1yl4 s ASN 69 N -3.75 0.08 -0.05 1.40 0.01 -1.26 -1.06 114.94 110.30 1yl4 s ASN 69 Ca 0.35 -0.29 0.06 0.00 -0.71 0.00 0.00 52.86 52.28 1yl4 s ASN 69 Cb -0.01 0.19 -0.01 0.00 0.41 0.00 0.00 41.25 41.82 1yl4 s ASN 69 CO 0.20 -0.37 -0.24 -0.13 -1.51 0.00 0.00 177.10 175.05 1yl4 s ARG 70 N -1.49 2.48 0.00 -0.60 1.81 -0.14 -3.97 118.95 117.05 1yl4 s ARG 70 Ca -0.14 -0.89 0.00 0.00 -1.72 0.00 0.00 55.73 52.97 1yl4 s ARG 70 Cb -0.08 -2.16 0.00 0.00 -0.45 0.00 0.00 34.95 32.26 1yl4 s ARG 70 CO 0.01 0.43 0.00 -0.11 -0.68 0.00 0.00 175.30 174.94 1yl4 n LEU 71 N 2.83 1.56 0.00 2.53 -0.00 -1.17 -1.03 117.00 121.72 1yl4 n LEU 71 Ca -0.17 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 55.84 1yl4 n LEU 71 Cb 0.52 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.94 1yl4 n LEU 71 CO 0.25 0.23 0.00 0.52 -0.00 0.00 0.00 177.39 178.39 1yl4 n VAL 72 N -2.57 0.00 0.00 1.96 0.31 -1.23 -3.94 118.33 112.86 1yl4 n VAL 72 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 1yl4 n VAL 72 Cb 0.42 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.35 1yl4 n VAL 72 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 1yl4 n ASP 73 N 3.26 0.00 -3.80 4.52 9.92 -1.26 -4.38 116.55 124.81 1yl4 n ASP 73 Ca 0.00 0.00 -0.13 0.00 -0.53 0.00 0.00 54.79 54.13 1yl4 n ASP 73 Cb 0.00 0.41 -0.11 0.00 -0.64 0.00 0.00 41.12 40.77 1yl4 n ASP 73 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 1yl4 s ILE 74 N -3.37 0.01 0.11 0.53 1.01 -0.35 -0.74 121.20 118.41 1yl4 s ILE 74 Ca 0.00 -0.08 0.05 0.00 0.00 0.00 0.00 60.65 60.62 1yl4 s ILE 74 Cb 0.00 -0.34 -0.04 0.00 0.01 0.00 0.00 42.46 42.09 1yl4 s ILE 74 CO 0.00 -0.04 0.02 -0.63 0.00 0.00 0.00 174.94 174.29 1yl4 s ILE 75 N -0.07 4.07 0.00 2.92 1.01 -1.26 -1.16 121.20 126.71 1yl4 s ILE 75 Ca -0.02 -1.06 0.00 0.00 0.00 0.00 0.00 60.65 59.57 1yl4 s ILE 75 Cb -0.02 -2.98 0.00 0.00 0.01 0.00 0.00 42.46 39.47 1yl4 s ILE 75 CO 0.01 0.05 0.00 0.59 0.00 0.00 0.00 174.94 175.59 1yl4 n ASN 76 N 0.32 -1.96 -4.09 3.58 3.02 -1.26 -0.54 115.26 114.32 1yl4 n ASN 76 Ca -0.10 0.00 -0.35 0.00 -0.03 0.00 0.00 54.58 54.10 1yl4 n ASN 76 Cb 0.53 -0.98 -0.12 0.00 -0.61 0.00 0.00 39.78 38.60 1yl4 n ASN 76 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 1yl4 s PRO 77 N -0.95 2.02 -0.07 3.52 0.04 -1.26 -2.02 135.00 136.27 1yl4 s PRO 77 Ca 0.00 -1.99 0.03 0.00 0.04 0.00 0.00 61.00 59.08 1yl4 s PRO 77 Cb 0.00 -3.54 -0.02 0.00 0.04 0.00 0.00 34.50 30.98 1yl4 s PRO 77 CO 0.00 -1.07 -0.13 -0.80 0.04 0.00 0.00 177.00 175.03 1yl4 s ASN 78 N 1.40 4.07 0.00 6.66 0.02 -1.26 -4.98 114.94 120.85 1yl4 s ASN 78 Ca 0.11 -0.21 0.00 0.00 -1.02 0.00 0.00 52.86 51.73 1yl4 s ASN 78 Cb -0.22 -1.04 0.00 0.00 0.02 0.00 0.00 41.25 40.01 1yl4 s ASN 78 CO -0.04 0.31 0.00 0.54 0.02 0.00 0.00 177.10 177.92 1yl4 n ARG 79 N 2.57 0.00 -0.03 -0.60 5.12 -1.26 -0.97 116.66 121.49 1yl4 n ARG 79 Ca -0.17 0.00 -0.01 0.00 -1.93 0.00 0.00 57.85 55.74 1yl4 n ARG 79 Cb 0.52 0.00 -0.01 0.00 -1.16 0.00 0.00 32.46 31.82 1yl4 n ARG 79 CO 0.00 0.00 0.00 1.17 -1.93 0.00 0.00 177.63 176.87 1yl4 n LYS 80 N 0.00 -0.03 -0.34 5.56 3.00 -1.26 -0.81 118.16 124.27 1yl4 n LYS 80 Ca 0.00 0.16 0.19 0.00 -0.00 0.00 0.00 58.31 58.66 1yl4 n LYS 80 Cb 0.00 -0.24 0.42 0.00 0.00 0.00 0.00 35.03 35.22 1yl4 n LYS 80 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.40 178.55 1yl4 h THR 81 N 0.00 0.56 0.00 3.15 2.02 -1.23 -0.86 112.91 116.55 1yl4 h THR 81 Ca 0.01 -0.18 0.00 0.00 0.77 0.00 0.00 66.41 67.01 1yl4 h THR 81 Cb 0.03 -0.02 0.00 0.00 -1.74 0.00 0.00 68.15 66.42 1yl4 h THR 81 CO -0.07 0.10 0.00 -0.38 0.37 0.00 0.00 175.52 175.53 1yl4 n ILE 82 N -4.76 0.00 0.26 3.11 5.41 0.00 -1.48 119.36 121.90 1yl4 n ILE 82 Ca 0.26 0.00 0.03 0.00 1.00 0.00 0.00 62.75 64.03 1yl4 n ILE 82 Cb 0.77 -0.72 -0.03 0.00 -0.71 0.00 0.00 39.64 38.95 1yl4 n ILE 82 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 176.55 177.76 1yl4 n GLU 83 N -0.74 5.08 -0.91 0.38 4.07 -0.33 -3.20 120.64 124.98 1yl4 n GLU 83 Ca 0.00 -0.00 -0.08 0.00 -0.06 0.00 0.00 57.16 57.02 1yl4 n GLU 83 Cb 0.00 -0.77 0.22 0.00 -0.06 0.00 0.00 31.44 30.83 1yl4 n GLU 83 CO 0.00 0.00 0.00 1.04 -0.06 0.00 0.00 177.13 178.11 1yl4 n GLN 84 N -1.14 2.43 0.00 5.31 6.02 -0.55 -4.31 117.38 125.14 1yl4 n GLN 84 Ca 0.01 -3.08 0.00 0.00 -0.01 0.00 0.00 57.00 53.92 1yl4 n GLN 84 Cb 0.09 -1.99 0.00 0.00 1.02 0.00 0.00 30.24 29.36 1yl4 n GLN 84 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 1yl4 n LEU 85 N -0.88 0.00 -0.15 1.08 4.77 -1.26 -3.96 117.00 116.61 1yl4 n LEU 85 Ca 0.40 0.00 0.11 0.00 -0.03 0.00 0.00 56.01 56.50 1yl4 n LEU 85 Cb 1.25 0.00 0.45 0.00 -2.33 0.00 0.00 43.42 42.79 1yl4 n LEU 85 CO 0.34 0.00 1.20 -0.03 -1.33 0.00 0.00 177.39 177.57 1yl4 h MET 86 N 0.00 0.51 -0.10 3.23 4.05 -1.73 -3.31 114.93 117.57 1yl4 h MET 86 Ca 0.00 -0.03 -0.19 0.00 -0.28 0.00 0.00 59.70 59.20 1yl4 h MET 86 Cb 0.00 -0.12 -0.14 0.00 -0.80 0.00 0.00 31.60 30.54 1yl4 h MET 86 CO 0.00 0.34 -0.44 2.41 0.23 0.00 0.00 176.91 179.45 1yl4 n THR 87 N -4.49 0.00 -1.97 -0.77 -1.04 -1.26 -4.91 114.28 99.84 1yl4 n THR 87 Ca 0.12 -1.34 0.00 0.00 -2.04 0.00 0.00 64.05 60.79 1yl4 n THR 87 Cb 0.38 1.39 0.00 0.00 -1.82 0.00 0.00 70.33 70.29 1yl4 n THR 87 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 1yl4 n LEU 88 N 1.78 0.00 -4.68 -4.42 4.77 -1.25 -4.94 117.00 108.25 1yl4 n LEU 88 Ca 0.09 -0.92 -0.30 0.00 -0.03 0.00 0.00 56.01 54.85 1yl4 n LEU 88 Cb 0.63 0.00 0.15 0.00 -2.33 0.00 0.00 43.42 41.87 1yl4 n LEU 88 CO 0.01 0.77 0.65 1.51 -1.33 0.00 0.00 177.39 179.01 1yl4 s ASP 89 N -0.20 3.16 0.00 -1.43 -4.77 -1.26 -4.87 116.67 107.30 1yl4 s ASP 89 Ca 0.00 1.67 0.00 0.00 -3.30 0.00 0.00 52.55 50.92 1yl4 s ASP 89 Cb 0.00 -2.31 0.00 0.00 -1.09 0.00 0.00 42.92 39.52 1yl4 s ASP 89 CO 0.00 -2.86 0.00 0.18 0.70 0.00 0.00 175.17 173.19 1yl4 n LEU 90 N -4.05 0.00 -4.54 2.11 4.77 -1.26 -5.13 117.00 108.91 1yl4 n LEU 90 Ca 0.08 0.00 -0.30 0.00 -0.03 0.00 0.00 56.01 55.75 1yl4 n LEU 90 Cb 0.54 0.11 0.26 0.00 -2.33 0.00 0.00 43.42 42.00 1yl4 n LEU 90 CO 0.54 -0.44 0.59 -2.16 -1.33 0.00 0.00 177.39 174.59 1yl4 s PRO 91 N -1.88 -1.71 0.00 3.23 0.04 -1.26 -5.02 135.00 128.41 1yl4 s PRO 91 Ca 0.00 -0.13 0.00 0.00 0.04 0.00 0.00 61.00 60.91 1yl4 s PRO 91 Cb 0.00 -1.54 0.00 0.00 0.04 0.00 0.00 34.50 33.00 1yl4 s PRO 91 CO 0.00 -4.02 0.07 -2.37 0.04 0.00 0.00 177.00 170.72 1yl4 n THR 92 N -4.97 0.00 0.56 1.26 5.66 -1.26 -4.89 114.28 110.64 1yl4 n THR 92 Ca 0.14 0.00 0.12 0.00 -3.05 0.00 0.00 64.05 61.26 1yl4 n THR 92 Cb 0.60 1.53 0.20 0.00 -1.55 0.00 0.00 70.33 71.10 1yl4 n THR 92 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1yl4 n GLY 93 N 0.00 1.45 0.00 1.09 0.00 -1.26 -4.93 105.19 101.54 1yl4 n GLY 93 Ca 0.00 -0.71 0.00 0.00 0.00 0.00 0.00 46.02 45.31 1yl4 n GLY 93 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1yl4 n VAL 94 N 1.39 0.00 -3.44 1.61 0.31 -1.26 -4.35 118.33 112.59 1yl4 n VAL 94 Ca 0.18 0.00 0.01 0.00 -0.01 0.00 0.00 64.34 64.52 1yl4 n VAL 94 Cb 0.59 -0.39 -0.05 0.00 -0.91 0.00 0.00 33.84 33.09 1yl4 n VAL 94 CO 0.00 0.00 0.00 -0.70 -1.32 0.00 0.00 176.83 174.81 1yl4 s GLU 95 N 2.11 0.21 0.05 5.55 2.12 -1.18 -4.98 118.70 122.57 1yl4 s GLU 95 Ca 0.00 0.46 -0.26 0.00 0.36 0.00 0.00 54.97 55.52 1yl4 s GLU 95 Cb 0.00 0.20 -0.05 0.00 0.26 0.00 0.00 34.13 34.54 1yl4 s GLU 95 CO 0.00 -0.06 0.82 0.96 -0.54 0.00 0.00 175.26 176.44 1yl4 s ILE 96 N 1.89 4.72 -0.24 -3.70 -4.36 -1.26 -3.03 121.20 115.22 1yl4 s ILE 96 Ca -0.04 1.74 0.01 0.00 -0.26 0.00 0.00 60.65 62.10 1yl4 s ILE 96 Cb -0.04 -4.17 0.06 0.00 1.25 0.00 0.00 42.46 39.56 1yl4 s ILE 96 CO -0.15 0.33 -0.06 -1.61 0.24 0.00 0.00 174.94 173.68 1yl4 s GLU 97 N 0.10 1.72 0.07 0.37 0.41 -0.11 -5.01 118.70 116.25 1yl4 s GLU 97 Ca 0.41 -1.03 0.07 0.00 -0.41 0.00 0.00 54.97 54.01 1yl4 s GLU 97 Cb -0.21 -2.62 -0.03 0.00 -1.78 0.00 0.00 34.13 29.49 1yl4 s GLU 97 CO 0.24 -0.59 -0.18 0.42 -0.49 0.00 0.00 175.26 174.66 1yl4 s ILE 98 N 1.36 1.49 0.00 -1.63 1.01 -1.26 -0.66 121.20 121.51 1yl4 s ILE 98 Ca -0.06 -1.32 0.00 0.00 0.00 0.00 0.00 60.65 59.27 1yl4 s ILE 98 Cb -0.19 -1.35 0.00 0.00 0.01 0.00 0.00 42.46 40.93 1yl4 s ILE 98 CO -0.06 -0.01 0.00 0.29 0.00 0.00 0.00 174.94 175.16 1yl4 n LYS 99 N 1.46 0.00 0.00 2.79 5.02 -0.24 -5.00 118.16 122.18 1yl4 n LYS 99 Ca -0.19 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.10 1yl4 n LYS 99 Cb 0.54 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.55 1yl4 n LYS 99 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13