#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yl3 n ARG 3 N 0.00 2.61 -2.67 -0.52 1.85 -1.26 -4.98 116.66 111.70 1yl3 n ARG 3 Ca 0.00 0.95 -0.27 0.00 -1.00 0.00 0.00 57.85 57.53 1yl3 n ARG 3 Cb 0.00 -2.83 -0.02 0.00 -1.05 0.00 0.00 32.46 28.56 1yl3 n ARG 3 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1yl3 n ALA 4 N 5.90 4.92 -0.20 2.89 0.00 -1.26 -4.95 120.51 127.82 1yl3 n ALA 4 Ca 0.19 -4.49 -0.06 0.00 0.00 0.00 0.00 53.44 49.09 1yl3 n ALA 4 Cb 0.35 -0.63 -0.01 0.00 0.00 0.00 0.00 19.45 19.17 1yl3 n ALA 4 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1yl3 n LYS 5 N -0.38 0.56 0.00 0.00 5.02 -1.26 -4.71 118.16 117.38 1yl3 n LYS 5 Ca 0.36 -0.74 0.00 0.00 -2.02 0.00 0.00 58.31 55.91 1yl3 n LYS 5 Cb 0.55 -2.11 0.00 0.00 -0.02 0.00 0.00 35.03 33.45 1yl3 n LYS 5 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1yl3 n THR 6 N 4.73 0.01 0.00 -0.18 -2.24 -1.26 -4.36 114.28 110.98 1yl3 n THR 6 Ca 0.12 0.19 0.00 0.00 -2.27 0.00 0.00 64.05 62.09 1yl3 n THR 6 Cb 0.04 -1.19 0.00 0.00 -2.10 0.00 0.00 70.33 67.08 1yl3 n THR 6 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1yl3 n GLY 7 N -0.70 0.00 0.00 3.38 0.00 -1.26 -1.48 105.19 105.13 1yl3 n GLY 7 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1yl3 n GLY 7 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1yl3 n ILE 8 N 0.00 0.00 0.00 -0.61 -0.00 -1.26 -0.11 119.36 117.37 1yl3 n ILE 8 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 62.75 62.75 1yl3 n ILE 8 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 39.64 39.64 1yl3 n ILE 8 CO 0.00 0.00 0.00 0.52 -0.00 0.00 0.00 176.55 177.07 1yl3 n VAL 9 N -3.16 0.00 -0.31 1.39 0.31 -1.07 -0.99 118.33 114.50 1yl3 n VAL 9 Ca 0.00 0.95 0.21 0.00 -0.01 0.00 0.00 64.34 65.49 1yl3 n VAL 9 Cb 0.00 -1.70 0.50 0.00 -0.91 0.00 0.00 33.84 31.73 1yl3 n VAL 9 CO 0.00 0.00 0.00 -0.09 -1.32 0.00 0.00 176.83 175.42 1yl3 h ARG 10 N 0.00 0.41 0.48 5.55 2.43 0.62 0.51 114.38 124.38 1yl3 h ARG 10 Ca 0.00 -0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.13 1yl3 h ARG 10 Cb 0.00 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 29.44 1yl3 h ARG 10 CO 0.00 0.27 -0.38 0.07 -1.51 0.00 0.00 179.97 178.43 1yl3 h ARG 11 N 0.42 -0.81 0.00 0.20 0.11 -1.25 -0.76 114.38 112.29 1yl3 h ARG 11 Ca 0.57 0.06 0.00 0.00 0.10 0.00 0.00 59.98 60.71 1yl3 h ARG 11 Cb 1.41 0.19 0.00 0.00 1.11 0.00 0.00 29.97 32.68 1yl3 h ARG 11 CO -0.28 -0.54 0.00 0.54 0.10 0.00 0.00 179.97 179.79 1yl3 n ARG 12 N -5.49 0.00 -0.25 0.08 1.74 0.17 -0.72 116.66 112.19 1yl3 n ARG 12 Ca -0.11 0.87 0.02 0.00 -0.77 0.00 0.00 57.85 57.86 1yl3 n ARG 12 Cb 0.39 -1.33 0.09 0.00 -1.02 0.00 0.00 32.46 30.59 1yl3 n ARG 12 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1yl3 h ARG 13 N 0.00 0.01 -0.17 5.56 -0.00 -0.95 0.51 114.38 119.35 1yl3 h ARG 13 Ca 0.00 -0.00 0.05 0.00 -0.50 0.00 0.00 59.98 59.53 1yl3 h ARG 13 Cb 0.00 -0.00 -0.06 0.00 0.00 0.00 0.00 29.97 29.91 1yl3 h ARG 13 CO 0.00 0.01 -0.20 0.45 0.00 0.00 0.00 179.97 180.23 1yl3 h HIS 14 N 0.01 -0.53 -0.88 3.04 3.86 0.59 1.32 115.15 122.57 1yl3 h HIS 14 Ca 0.36 0.03 0.17 0.00 -1.16 0.00 0.00 60.37 59.77 1yl3 h HIS 14 Cb 0.56 0.26 -0.07 0.00 1.06 0.00 0.00 27.41 29.23 1yl3 h HIS 14 CO -0.56 -0.28 0.57 -0.22 0.86 0.00 0.00 177.93 178.30 1yl3 h LYS 15 N -0.23 0.53 -0.09 2.45 3.64 0.17 0.14 116.57 123.19 1yl3 h LYS 15 Ca 0.11 -0.03 0.01 0.00 -1.27 0.00 0.00 60.65 59.47 1yl3 h LYS 15 Cb 0.40 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 32.09 1yl3 h LYS 15 CO -0.31 0.35 -0.12 0.87 -2.27 0.00 0.00 179.45 177.97 1yl3 h LYS 16 N 0.55 -0.08 -0.91 1.90 1.57 0.37 0.29 116.57 120.25 1yl3 h LYS 16 Ca 0.45 0.01 0.20 0.00 -1.87 0.00 0.00 60.65 59.44 1yl3 h LYS 16 Cb 0.92 0.02 -0.07 0.00 0.08 0.00 0.00 32.23 33.18 1yl3 h LYS 16 CO -0.19 -0.05 0.60 0.28 -0.57 0.00 0.00 179.45 179.51 1yl3 h VAL 17 N -0.08 0.69 -0.59 0.50 2.07 0.40 0.24 116.25 119.47 1yl3 h VAL 17 Ca 0.02 -0.15 0.12 0.00 0.82 0.00 0.00 66.70 67.50 1yl3 h VAL 17 Cb 0.12 0.20 -0.11 0.00 -1.52 0.00 0.00 31.29 29.98 1yl3 h VAL 17 CO -0.13 0.08 -0.08 -0.07 0.02 0.00 0.00 177.57 177.40 1yl3 h LEU 18 N 0.45 -0.42 -0.44 2.57 -0.00 0.14 0.35 115.31 117.97 1yl3 h LEU 18 Ca 0.48 0.16 -0.02 0.00 -0.00 0.00 0.00 57.88 58.50 1yl3 h LEU 18 Cb 1.13 0.32 -0.02 0.00 -0.00 0.00 0.00 40.66 42.09 1yl3 h LEU 18 CO -0.20 -0.16 0.20 0.11 -0.00 0.00 0.00 178.44 178.40 1yl3 h LYS 19 N 0.05 0.63 -0.98 1.13 1.57 0.13 0.16 116.57 119.27 1yl3 h LYS 19 Ca 0.30 -0.10 0.27 0.00 -1.87 0.00 0.00 60.65 59.25 1yl3 h LYS 19 Cb 0.47 -0.11 -0.18 0.00 0.08 0.00 0.00 32.23 32.49 1yl3 h LYS 19 CO -0.56 0.56 0.02 0.54 -0.57 0.00 0.00 179.45 179.44 1yl3 n ARG 20 N -4.65 -0.08 -1.73 3.15 5.12 0.98 -3.40 116.66 116.06 1yl3 n ARG 20 Ca 0.01 1.47 -0.22 0.00 -1.93 0.00 0.00 57.85 57.17 1yl3 n ARG 20 Cb 0.12 -2.33 -0.06 0.00 -1.16 0.00 0.00 32.46 29.03 1yl3 n ARG 20 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1yl3 s ALA 21 N -5.97 1.17 0.00 7.54 0.00 0.57 -4.92 121.76 120.15 1yl3 s ALA 21 Ca -0.13 -0.86 0.00 0.00 0.00 0.00 0.00 51.96 50.97 1yl3 s ALA 21 Cb 0.29 -4.52 0.00 0.00 0.00 0.00 0.00 23.12 18.89 1yl3 s ALA 21 CO 0.76 -5.29 0.00 1.63 0.00 0.00 0.00 175.76 172.86 1yl3 n LYS 22 N 8.88 0.00 0.00 0.00 5.02 -1.22 -4.91 118.16 125.93 1yl3 n LYS 22 Ca 0.42 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.71 1yl3 n LYS 22 Cb 0.46 -0.19 0.00 0.00 -0.02 0.00 0.00 35.03 35.28 1yl3 n LYS 22 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1yl3 n GLY 23 N 0.75 0.00 0.00 0.72 0.00 -1.26 -5.04 105.19 100.36 1yl3 n GLY 23 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1yl3 n GLY 23 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 1yl3 n PHE 24 N -0.65 0.00 -1.70 1.61 1.16 -1.26 -4.60 117.46 112.02 1yl3 n PHE 24 Ca 0.00 0.00 -0.42 0.00 -1.87 0.00 0.00 57.45 55.16 1yl3 n PHE 24 Cb 0.06 0.00 -0.03 0.00 -1.61 0.00 0.00 39.48 37.90 1yl3 n PHE 24 CO 0.00 0.00 0.00 0.91 -1.87 0.00 0.00 176.76 175.80 1yl3 n TRP 25 N 0.00 2.67 -1.06 2.97 7.02 -1.26 -4.77 117.44 123.01 1yl3 n TRP 25 Ca 0.00 -0.13 -0.50 0.00 -1.02 0.00 0.00 57.50 55.84 1yl3 n TRP 25 Cb 0.00 -2.73 -0.10 0.00 -2.42 0.00 0.00 31.31 26.06 1yl3 n TRP 25 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1yl3 n GLY 26 N 4.21 -0.12 0.00 6.99 0.00 -1.26 -1.28 105.19 113.73 1yl3 n GLY 26 Ca 0.18 0.94 0.00 0.00 0.00 0.00 0.00 46.02 47.14 1yl3 n GLY 26 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1yl3 n SER 27 N 6.26 0.00 0.00 1.61 7.64 -1.26 -4.77 113.62 123.10 1yl3 n SER 27 Ca 0.46 0.00 0.06 0.00 1.01 0.00 0.00 58.87 60.40 1yl3 n SER 27 Cb -0.03 0.00 0.29 0.00 -1.01 0.00 0.00 64.21 63.46 1yl3 n SER 27 CO 0.00 0.00 0.00 -2.11 -3.01 0.00 0.00 175.04 169.92 1yl3 n ARG 28 N 0.00 0.11 -0.08 1.43 1.85 -0.41 -0.32 116.66 119.24 1yl3 n ARG 28 Ca 0.00 0.22 0.26 0.00 -1.00 0.00 0.00 57.85 57.33 1yl3 n ARG 28 Cb 0.00 -1.50 0.68 0.00 -1.05 0.00 0.00 32.46 30.59 1yl3 n ARG 28 CO 0.00 0.00 0.00 0.66 -0.01 0.00 0.00 177.63 178.28 1yl3 h SER 29 N 0.00 0.00 0.00 2.89 4.64 -1.81 -2.68 113.55 116.59 1yl3 h SER 29 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1yl3 h SER 29 Cb 0.15 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.24 1yl3 h SER 29 CO 0.00 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 176.25 1yl3 n LYS 30 N -3.72 0.00 -0.51 4.77 4.01 0.56 -4.99 118.16 118.28 1yl3 n LYS 30 Ca 0.16 0.00 -0.41 0.00 -0.51 0.00 0.00 58.31 57.54 1yl3 n LYS 30 Cb 0.99 -0.31 -0.11 0.00 -0.51 0.00 0.00 35.03 35.09 1yl3 n LYS 30 CO 0.00 0.00 0.00 1.04 -1.11 0.00 0.00 177.40 177.33 1yl3 n GLN 31 N 0.00 0.00 0.00 1.97 6.02 -0.03 -4.69 117.38 120.65 1yl3 n GLN 31 Ca 0.00 -0.93 0.00 0.00 -0.01 0.00 0.00 57.00 56.06 1yl3 n GLN 31 Cb 0.24 -2.41 0.00 0.00 1.02 0.00 0.00 30.24 29.10 1yl3 n GLN 31 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 1yl3 n TYR 32 N 8.60 0.00 0.00 1.08 0.53 -1.26 0.44 117.16 126.55 1yl3 n TYR 32 Ca 0.43 0.00 0.00 0.00 -1.02 0.00 0.00 57.90 57.31 1yl3 n TYR 32 Cb 0.40 0.00 0.00 0.00 -1.03 0.00 0.00 39.34 38.71 1yl3 n TYR 32 CO 0.00 0.00 0.00 -2.13 -1.02 0.00 0.00 176.86 173.71 1yl3 n ARG 33 N 0.00 0.00 0.30 -0.72 0.63 -1.26 -4.65 116.66 110.96 1yl3 n ARG 33 Ca 0.00 0.00 0.13 0.00 -0.92 0.00 0.00 57.85 57.06 1yl3 n ARG 33 Cb 0.00 0.00 0.67 0.00 0.45 0.00 0.00 32.46 33.58 1yl3 n ARG 33 CO 0.00 0.00 0.00 -0.91 -2.51 0.00 0.00 177.63 174.21 1yl3 h ASN 34 N 0.00 0.00 0.00 6.15 2.35 -1.55 4.16 115.58 126.69 1yl3 h ASN 34 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1yl3 h ASN 34 Cb 0.00 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.37 1yl3 h ASN 34 CO 0.00 0.00 0.00 0.00 -1.65 0.00 0.00 177.43 175.78 1yl3 n ALA 35 N -1.87 0.00 -0.07 -0.83 0.00 1.53 -0.49 120.51 118.78 1yl3 n ALA 35 Ca -0.00 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.42 1yl3 n ALA 35 Cb 0.53 0.03 -0.01 0.00 0.00 0.00 0.00 19.45 20.00 1yl3 n ALA 35 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1yl3 n PHE 36 N -0.37 -0.05 0.25 0.00 3.01 1.35 0.79 117.46 122.44 1yl3 n PHE 36 Ca 0.00 0.22 -0.13 0.00 1.01 0.00 0.00 57.45 58.55 1yl3 n PHE 36 Cb 0.00 -0.53 -0.07 0.00 -0.01 0.00 0.00 39.48 38.87 1yl3 n PHE 36 CO 0.00 0.00 0.00 0.37 1.01 0.00 0.00 176.76 178.14 1yl3 h GLN 37 N 0.00 -0.73 -0.69 -1.08 4.15 -0.90 0.12 115.11 115.98 1yl3 h GLN 37 Ca 0.04 0.05 0.20 0.00 0.77 0.00 0.00 58.65 59.71 1yl3 h GLN 37 Cb 0.08 0.17 -0.13 0.00 0.21 0.00 0.00 27.48 27.81 1yl3 h GLN 37 CO -0.17 -0.48 0.04 0.25 -1.93 0.00 0.00 178.83 176.53 1yl3 n THR 38 N -4.48 -0.29 0.10 2.39 -2.24 0.24 0.44 114.28 110.43 1yl3 n THR 38 Ca -0.09 1.52 -0.06 0.00 -2.27 0.00 0.00 64.05 63.15 1yl3 n THR 38 Cb 0.33 -2.23 -0.03 0.00 -2.10 0.00 0.00 70.33 66.30 1yl3 n THR 38 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 1yl3 h LEU 39 N 0.00 -0.42 -0.50 3.22 3.38 0.87 -0.58 115.31 121.29 1yl3 h LEU 39 Ca 0.43 0.03 0.10 0.00 0.09 0.00 0.00 57.88 58.53 1yl3 h LEU 39 Cb 0.91 0.13 -0.09 0.00 0.09 0.00 0.00 40.66 41.70 1yl3 h LEU 39 CO -0.64 -0.21 -0.12 0.18 0.09 0.00 0.00 178.44 177.74 1yl3 n LEU 40 N -3.23 -0.17 -0.04 1.67 7.99 1.53 0.19 117.00 124.93 1yl3 n LEU 40 Ca -0.04 0.85 -0.14 0.00 -0.01 0.00 0.00 56.01 56.67 1yl3 n LEU 40 Cb 0.14 -0.26 -0.08 0.00 -0.11 0.00 0.00 43.42 43.11 1yl3 n LEU 40 CO 0.08 -0.82 0.50 -0.55 -1.51 0.00 0.00 177.39 175.10 1yl3 h ASN 41 N 0.00 0.43 -0.68 -1.43 -1.07 -0.93 -1.55 115.58 110.35 1yl3 h ASN 41 Ca 0.24 -0.57 0.09 0.00 0.07 0.00 0.00 56.30 56.13 1yl3 h ASN 41 Cb 0.37 -0.13 -0.11 0.00 -2.07 0.00 0.00 38.32 36.39 1yl3 h ASN 41 CO -0.51 0.93 -0.49 0.00 0.07 0.00 0.00 177.43 177.43 1yl3 h ALA 42 N 0.52 -0.41 -1.19 4.14 0.00 0.36 -0.72 119.26 121.96 1yl3 h ALA 42 Ca 0.00 0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1yl3 h ALA 42 Cb 0.86 1.09 0.00 0.00 0.00 0.00 0.00 17.79 19.74 1yl3 h ALA 42 CO 0.06 -0.88 0.00 0.00 0.00 0.00 0.00 179.25 178.43 1yl3 n ALA 43 N -3.20 -0.19 -0.30 0.00 0.00 -0.03 -0.84 120.51 115.95 1yl3 n ALA 43 Ca 0.02 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.50 1yl3 n ALA 43 Cb 0.33 0.15 0.11 0.00 0.00 0.00 0.00 19.45 20.05 1yl3 n ALA 43 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1yl3 n THR 44 N -1.70 -0.36 0.00 0.00 -1.04 -0.60 -0.32 114.28 110.26 1yl3 n THR 44 Ca 0.00 1.92 0.00 0.00 -2.04 0.00 0.00 64.05 63.93 1yl3 n THR 44 Cb 0.00 -2.65 0.00 0.00 -1.82 0.00 0.00 70.33 65.86 1yl3 n THR 44 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 1yl3 n TYR 45 N -5.35 0.00 -0.53 -1.42 4.02 -0.29 0.05 117.16 113.64 1yl3 n TYR 45 Ca 0.13 0.00 0.44 0.00 -0.01 0.00 0.00 57.90 58.46 1yl3 n TYR 45 Cb 0.41 -0.21 0.77 0.00 -0.02 0.00 0.00 39.34 40.29 1yl3 n TYR 45 CO 0.00 0.00 0.00 0.93 -1.01 0.00 0.00 176.86 176.78 1yl3 h GLU 46 N 0.00 0.02 0.48 -0.72 5.08 0.14 0.57 114.58 120.15 1yl3 h GLU 46 Ca 0.00 -0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.34 1yl3 h GLU 46 Cb 0.00 -0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.23 1yl3 h GLU 46 CO 0.00 0.01 -0.43 1.88 -1.00 0.00 0.00 179.01 179.47 1yl3 h TYR 47 N 0.02 -1.18 -0.81 4.33 0.99 0.97 0.17 116.97 121.46 1yl3 h TYR 47 Ca 0.78 0.00 0.16 0.00 2.00 0.00 0.00 58.73 61.67 1yl3 h TYR 47 Cb 3.03 0.45 -0.15 0.00 1.00 0.00 0.00 36.73 41.05 1yl3 h TYR 47 CO -0.00 -0.58 -0.20 0.00 -0.00 0.00 0.00 178.16 177.37 1yl3 h ARG 48 N -0.89 -0.00 -0.24 4.88 3.08 0.12 0.54 114.38 121.88 1yl3 h ARG 48 Ca -0.06 0.00 0.06 0.00 0.07 0.00 0.00 59.98 60.05 1yl3 h ARG 48 Cb 0.76 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 30.75 1yl3 h ARG 48 CO -0.02 -0.00 -0.20 -0.44 -1.07 0.00 0.00 179.97 178.24 1yl3 h ASP 49 N -0.00 -0.63 -0.97 7.04 5.19 -0.21 -1.18 116.42 125.66 1yl3 h ASP 49 Ca 0.39 0.12 0.10 0.00 -0.62 0.00 0.00 57.03 57.03 1yl3 h ASP 49 Cb 0.59 0.31 -0.13 0.00 0.18 0.00 0.00 39.33 40.29 1yl3 h ASP 49 CO -0.84 -0.24 -0.52 0.54 -3.12 0.00 0.00 179.24 175.07 1yl3 n ARG 50 N -5.35 -0.37 -0.05 3.56 1.74 0.18 -1.17 116.66 115.20 1yl3 n ARG 50 Ca -0.01 1.47 -0.14 0.00 -0.77 0.00 0.00 57.85 58.40 1yl3 n ARG 50 Cb 0.26 -2.16 -0.07 0.00 -1.02 0.00 0.00 32.46 29.47 1yl3 n ARG 50 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1yl3 h ARG 51 N 0.00 0.50 0.00 5.56 -0.00 -0.94 -3.36 114.38 116.13 1yl3 h ARG 51 Ca 0.20 -0.32 0.00 0.00 -0.50 0.00 0.00 59.98 59.36 1yl3 h ARG 51 Cb 0.44 0.04 0.00 0.00 0.00 0.00 0.00 29.97 30.45 1yl3 h ARG 51 CO -0.92 0.92 0.00 0.09 0.00 0.00 0.00 179.97 180.06 1yl3 n ASN 52 N -4.36 0.00 0.00 7.04 3.02 -0.37 -3.57 115.26 117.02 1yl3 n ASN 52 Ca -0.06 0.84 0.00 0.00 -0.03 0.00 0.00 54.58 55.33 1yl3 n ASN 52 Cb 0.48 -0.34 0.00 0.00 -0.61 0.00 0.00 39.78 39.31 1yl3 n ASN 52 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1yl3 n LYS 53 N -2.30 0.00 -0.33 3.52 5.02 -0.32 0.27 118.16 124.03 1yl3 n LYS 53 Ca 0.00 0.00 0.22 0.00 -2.02 0.00 0.00 58.31 56.51 1yl3 n LYS 53 Cb 0.00 0.00 0.42 0.00 -0.02 0.00 0.00 35.03 35.43 1yl3 n LYS 53 CO 0.00 0.00 0.00 0.87 -0.52 0.00 0.00 177.40 177.75 1yl3 h LYS 54 N 0.00 0.03 0.46 1.97 1.57 -1.81 0.36 116.57 119.15 1yl3 h LYS 54 Ca 0.00 -0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.76 1yl3 h LYS 54 Cb 0.00 -0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.30 1yl3 h LYS 54 CO 0.00 0.02 -0.29 0.00 -0.57 0.00 0.00 179.45 178.61 1yl3 h ARG 55 N 0.03 -0.68 -0.69 3.15 3.08 -0.38 0.08 114.38 118.98 1yl3 h ARG 55 Ca 0.70 0.05 0.17 0.00 0.07 0.00 0.00 59.98 60.97 1yl3 h ARG 55 Cb 1.64 0.15 -0.13 0.00 0.08 0.00 0.00 29.97 31.72 1yl3 h ARG 55 CO -0.83 -0.45 -0.04 -0.25 -1.07 0.00 0.00 179.97 177.32 1yl3 n ASP 56 N -4.14 -0.13 0.36 7.04 8.00 -0.01 0.42 116.55 128.09 1yl3 n ASP 56 Ca -0.09 1.17 -0.18 0.00 0.71 0.00 0.00 54.79 56.41 1yl3 n ASP 56 Cb 0.29 -0.41 -0.09 0.00 -0.02 0.00 0.00 41.12 40.90 1yl3 n ASP 56 CO 0.00 0.00 0.00 -0.26 -0.39 0.00 0.00 177.20 176.55 1yl3 h PHE 57 N 0.00 -0.82 -0.23 1.24 -1.00 -0.29 0.30 116.94 116.14 1yl3 h PHE 57 Ca 0.39 -0.02 0.02 0.00 2.81 0.00 0.00 57.97 61.17 1yl3 h PHE 57 Cb 0.75 0.27 -0.03 0.00 3.61 0.00 0.00 35.95 40.56 1yl3 h PHE 57 CO -0.40 -0.50 -0.14 0.54 -1.61 0.00 0.00 178.31 176.20 1yl3 n ARG 58 N -5.46 -0.10 0.19 1.51 1.74 1.44 0.40 116.66 116.38 1yl3 n ARG 58 Ca -0.13 0.35 -0.09 0.00 -0.77 0.00 0.00 57.85 57.21 1yl3 n ARG 58 Cb 0.36 -0.52 -0.05 0.00 -1.02 0.00 0.00 32.46 31.24 1yl3 n ARG 58 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1yl3 h ARG 59 N 0.00 -0.53 -0.26 5.56 2.47 -0.76 -0.47 114.38 120.40 1yl3 h ARG 59 Ca 0.04 0.04 0.03 0.00 -1.26 0.00 0.00 59.98 58.82 1yl3 h ARG 59 Cb 0.10 0.12 -0.03 0.00 -1.65 0.00 0.00 29.97 28.50 1yl3 h ARG 59 CO -0.22 -0.35 -0.14 1.28 0.56 0.00 0.00 179.97 181.10 1yl3 n LEU 60 N -3.75 -0.25 0.40 3.04 4.77 1.33 0.49 117.00 123.03 1yl3 n LEU 60 Ca -0.07 0.45 -0.15 0.00 -0.03 0.00 0.00 56.01 56.21 1yl3 n LEU 60 Cb 0.23 -0.07 -0.07 0.00 -2.33 0.00 0.00 43.42 41.18 1yl3 n LEU 60 CO 0.16 -0.38 0.50 -0.50 -1.33 0.00 0.00 177.39 175.84 1yl3 h TRP 61 N 0.00 -0.94 -0.10 -1.77 4.06 -0.97 -1.16 115.95 115.07 1yl3 h TRP 61 Ca 0.05 -0.02 0.01 0.00 2.06 0.00 0.00 58.89 60.99 1yl3 h TRP 61 Cb 0.12 0.31 -0.01 0.00 -1.00 0.00 0.00 29.16 28.57 1yl3 h TRP 61 CO -0.26 -0.58 -0.05 -0.89 -3.56 0.00 0.00 178.44 173.10 1yl3 n ILE 62 N -4.84 -0.06 0.07 1.49 2.08 1.84 -0.67 119.36 119.27 1yl3 n ILE 62 Ca -0.13 0.24 -0.04 0.00 0.56 0.00 0.00 62.75 63.39 1yl3 n ILE 62 Cb 0.40 -0.31 -0.02 0.00 -0.75 0.00 0.00 39.64 38.96 1yl3 n ILE 62 CO 0.00 0.00 0.00 -0.61 0.56 0.00 0.00 176.55 176.50 1yl3 h GLN 63 N 0.00 -0.25 -0.73 0.38 4.15 -0.04 0.11 115.11 118.74 1yl3 h GLN 63 Ca 0.03 0.02 0.26 0.00 0.77 0.00 0.00 58.65 59.73 1yl3 h GLN 63 Cb 0.05 0.06 -0.13 0.00 0.21 0.00 0.00 27.48 27.67 1yl3 h GLN 63 CO -0.10 -0.16 0.24 0.54 -1.93 0.00 0.00 178.83 177.42 1yl3 n ARG 64 N -4.16 -0.05 0.00 1.69 1.74 0.15 0.29 116.66 116.32 1yl3 n ARG 64 Ca -0.03 1.03 0.00 0.00 -0.77 0.00 0.00 57.85 58.08 1yl3 n ARG 64 Cb 0.10 -1.77 0.00 0.00 -1.02 0.00 0.00 32.46 29.77 1yl3 n ARG 64 CO 0.00 0.00 0.00 -0.89 -1.52 0.00 0.00 177.63 175.22 1yl3 n ILE 65 N -4.78 0.00 -0.31 0.55 2.08 0.03 -0.24 119.36 116.70 1yl3 n ILE 65 Ca 0.23 1.40 0.10 0.00 0.56 0.00 0.00 62.75 65.05 1yl3 n ILE 65 Cb 0.79 -2.04 0.23 0.00 -0.75 0.00 0.00 39.64 37.87 1yl3 n ILE 65 CO 0.00 0.00 0.00 0.78 0.56 0.00 0.00 176.55 177.89 1yl3 h ASN 66 N 0.00 -0.41 -0.92 4.38 2.35 0.65 0.56 115.58 122.18 1yl3 h ASN 66 Ca 0.00 0.24 0.13 0.00 -0.55 0.00 0.00 56.30 56.12 1yl3 h ASN 66 Cb 0.00 0.42 -0.14 0.00 0.05 0.00 0.00 38.32 38.65 1yl3 h ASN 66 CO 0.00 -0.27 -0.44 0.00 -1.65 0.00 0.00 177.43 175.07 1yl3 h ALA 67 N 1.87 -0.08 0.14 -0.83 0.00 0.11 -0.51 119.26 119.94 1yl3 h ALA 67 Ca 0.52 0.21 -0.01 0.00 0.00 0.00 0.00 54.91 55.64 1yl3 h ALA 67 Cb 1.00 1.08 0.00 0.00 0.00 0.00 0.00 17.79 19.88 1yl3 h ALA 67 CO -0.81 -0.74 -0.07 0.78 0.00 0.00 0.00 179.25 178.42 1yl3 h GLY 68 N -0.04 -0.19 0.51 0.00 0.00 0.85 -0.94 103.07 103.26 1yl3 h GLY 68 Ca 0.28 0.07 0.07 0.00 0.00 0.00 0.00 47.33 47.74 1yl3 h GLY 68 CO -0.92 -0.07 0.14 0.00 0.00 0.00 0.00 176.54 175.69 1yl3 h ALA 69 N -0.15 0.55 0.40 3.60 0.00 -0.72 0.24 119.26 123.18 1yl3 h ALA 69 Ca -0.02 0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 1yl3 h ALA 69 Cb 0.54 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.40 1yl3 h ALA 69 CO 0.03 -0.25 -0.19 0.00 0.00 0.00 0.00 179.25 178.84 1yl3 h ARG 70 N 0.30 -0.52 -0.42 0.00 3.08 -0.96 -0.40 114.38 115.46 1yl3 h ARG 70 Ca 0.23 0.04 0.04 0.00 0.07 0.00 0.00 59.98 60.35 1yl3 h ARG 70 Cb 0.25 0.12 -0.05 0.00 0.08 0.00 0.00 29.97 30.37 1yl3 h ARG 70 CO -0.25 -0.23 -0.25 -0.11 -1.07 0.00 0.00 179.97 178.06 1yl3 n LEU 71 N -5.22 -0.45 0.30 3.04 0.00 -0.05 0.17 117.00 114.78 1yl3 n LEU 71 Ca -0.10 0.77 -0.16 0.00 0.00 0.00 0.00 56.01 56.51 1yl3 n LEU 71 Cb 0.28 -0.10 -0.09 0.00 0.00 0.00 0.00 43.42 43.51 1yl3 n LEU 71 CO 0.32 -0.62 0.64 0.45 0.00 0.00 0.00 177.39 178.18 1yl3 h HIS 72 N 0.00 -0.68 0.00 1.96 3.86 -1.15 -3.47 115.15 115.68 1yl3 h HIS 72 Ca 0.07 -0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.26 1yl3 h HIS 72 Cb 0.17 0.23 0.00 0.00 1.06 0.00 0.00 27.41 28.87 1yl3 h HIS 72 CO -0.45 -0.39 0.00 0.41 0.86 0.00 0.00 177.93 178.36 1yl3 n GLY 73 N -1.21 0.00 3.63 2.45 0.00 0.45 -5.13 105.19 105.38 1yl3 n GLY 73 Ca -0.12 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.79 1yl3 n GLY 73 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1yl3 s MET 74 N 0.00 0.72 0.86 1.61 -1.94 -0.27 -4.99 119.30 115.29 1yl3 s MET 74 Ca 0.00 0.94 -0.12 0.00 -1.71 0.00 0.00 55.69 54.80 1yl3 s MET 74 Cb 0.00 0.31 0.10 0.00 2.01 0.00 0.00 34.83 37.26 1yl3 s MET 74 CO 0.00 -0.10 1.10 1.21 -0.01 0.00 0.00 175.02 177.22 1yl3 s ASN 75 N 0.61 3.94 0.51 3.03 3.84 -1.26 -2.88 114.94 122.73 1yl3 s ASN 75 Ca -0.01 1.27 0.16 0.00 0.21 0.00 0.00 52.86 54.48 1yl3 s ASN 75 Cb -0.05 -1.95 1.25 0.00 -0.55 0.00 0.00 41.25 39.94 1yl3 s ASN 75 CO -0.05 -2.32 2.14 1.88 -2.79 0.00 0.00 177.10 175.97 1yl3 h TYR 76 N -1.33 0.02 0.45 0.43 -1.99 -1.97 0.23 116.97 112.80 1yl3 h TYR 76 Ca -0.49 0.00 -0.01 0.00 2.00 0.00 0.00 58.73 60.23 1yl3 h TYR 76 Cb 1.29 -0.01 -0.02 0.00 2.00 0.00 0.00 36.73 39.99 1yl3 h TYR 76 CO 0.41 0.02 -0.46 0.66 -0.00 0.00 0.00 178.16 178.78 1yl3 h SER 77 N 0.02 -1.27 0.68 3.88 4.64 -1.99 -0.59 113.55 118.92 1yl3 h SER 77 Ca 0.00 0.10 -0.03 0.00 -0.47 0.00 0.00 61.79 61.40 1yl3 h SER 77 Cb 0.01 0.42 -0.01 0.00 -0.31 0.00 0.00 62.40 62.51 1yl3 h SER 77 CO -0.00 -0.61 -0.47 0.71 -0.87 0.00 0.00 176.83 175.60 1yl3 h THR 78 N -0.91 0.00 -0.85 2.95 1.35 -1.69 -0.98 112.91 112.79 1yl3 h THR 78 Ca -0.06 0.00 0.08 0.00 -0.55 0.00 0.00 66.41 65.88 1yl3 h THR 78 Cb 0.79 0.00 -0.11 0.00 -1.73 0.00 0.00 68.15 67.10 1yl3 h THR 78 CO -0.06 0.00 -0.58 -0.26 -0.25 0.00 0.00 175.52 174.37 1yl3 h PHE 79 N -1.08 -1.83 -0.66 4.73 -1.00 -0.95 0.60 116.94 116.75 1yl3 h PHE 79 Ca -0.09 0.12 0.12 0.00 2.81 0.00 0.00 57.97 60.93 1yl3 h PHE 79 Cb 0.89 0.91 -0.09 0.00 3.61 0.00 0.00 35.95 41.27 1yl3 h PHE 79 CO -0.13 -0.40 0.22 0.82 -1.61 0.00 0.00 178.31 177.20 1yl3 h ILE 80 N -0.10 0.68 0.57 -0.55 2.04 -1.07 -0.26 117.51 118.82 1yl3 h ILE 80 Ca 0.14 -0.13 -0.03 0.00 1.00 0.00 0.00 64.86 65.85 1yl3 h ILE 80 Cb 0.46 0.28 0.01 0.00 -0.74 0.00 0.00 36.82 36.83 1yl3 h ILE 80 CO -0.85 0.07 -0.27 0.78 0.00 0.00 0.00 178.15 177.87 1yl3 h ASN 81 N 0.37 -0.65 -0.68 1.72 4.21 0.16 -0.46 115.58 120.24 1yl3 h ASN 81 Ca 0.35 0.02 0.12 0.00 1.21 0.00 0.00 56.30 58.01 1yl3 h ASN 81 Cb 0.50 0.17 -0.09 0.00 -1.12 0.00 0.00 38.32 37.78 1yl3 h ASN 81 CO -0.38 -0.33 0.23 1.23 -1.29 0.00 0.00 177.43 176.89 1yl3 h GLY 82 N -1.04 0.97 -0.69 2.83 0.00 -1.04 0.21 103.07 104.31 1yl3 h GLY 82 Ca -0.08 -0.10 0.15 0.00 0.00 0.00 0.00 47.33 47.30 1yl3 h GLY 82 CO 0.13 -0.09 -0.30 1.41 0.00 0.00 0.00 176.54 177.69 1yl3 h LEU 83 N 0.37 -1.08 -0.91 3.11 3.38 -1.05 1.69 115.31 120.82 1yl3 h LEU 83 Ca 0.36 0.26 -0.11 0.00 0.09 0.00 0.00 57.88 58.48 1yl3 h LEU 83 Cb 0.53 0.61 -0.02 0.00 0.09 0.00 0.00 40.66 41.87 1yl3 h LEU 83 CO -0.39 -0.29 -0.54 0.11 0.09 0.00 0.00 178.44 177.42 1yl3 h LYS 84 N -0.05 0.02 -0.95 1.13 1.57 0.44 0.25 116.57 118.98 1yl3 h LYS 84 Ca 0.34 -0.01 0.30 0.00 -1.87 0.00 0.00 60.65 59.40 1yl3 h LYS 84 Cb 0.59 0.00 -0.16 0.00 0.08 0.00 0.00 32.23 32.74 1yl3 h LYS 84 CO -0.85 0.55 0.31 0.00 -0.57 0.00 0.00 179.45 178.89 1yl3 h ARG 85 N 0.01 0.13 0.00 3.15 3.08 0.44 -3.39 114.38 117.81 1yl3 h ARG 85 Ca -0.00 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.04 1yl3 h ARG 85 Cb 0.96 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.97 1yl3 h ARG 85 CO 0.07 0.09 0.00 0.00 -1.07 0.00 0.00 179.97 179.06 1yl3 n ALA 86 N -2.64 0.00 0.00 0.04 0.00 0.08 -5.00 120.51 112.99 1yl3 n ALA 86 Ca 0.27 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.71 1yl3 n ALA 86 Cb 0.88 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.33 1yl3 n ALA 86 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1yl3 n ASN 87 N 0.00 0.00 -0.96 0.00 5.15 -1.26 -4.86 115.26 113.32 1yl3 n ASN 87 Ca 0.00 0.00 0.10 0.00 -0.60 0.00 0.00 54.58 54.08 1yl3 n ASN 87 Cb 0.00 0.00 0.19 0.00 -0.53 0.00 0.00 39.78 39.44 1yl3 n ASN 87 CO 0.00 0.00 0.00 -0.38 1.40 0.00 0.00 177.26 178.28 1yl3 n ILE 88 N 0.00 0.59 -3.64 -1.44 2.08 -1.26 -4.93 119.36 110.75 1yl3 n ILE 88 Ca 0.00 -0.79 -0.05 0.00 0.56 0.00 0.00 62.75 62.47 1yl3 n ILE 88 Cb 0.00 0.87 -0.07 0.00 -0.75 0.00 0.00 39.64 39.69 1yl3 n ILE 88 CO 0.00 0.00 0.00 -1.81 0.56 0.00 0.00 176.55 175.30 1yl3 s ASP 89 N -1.25 -0.65 -0.25 4.38 1.01 -1.26 -5.12 116.67 113.54 1yl3 s ASP 89 Ca 0.33 1.23 -0.02 0.00 0.71 0.00 0.00 52.55 54.79 1yl3 s ASP 89 Cb 0.19 1.77 0.11 0.00 1.01 0.00 0.00 42.92 46.00 1yl3 s ASP 89 CO 0.26 -0.23 0.25 -0.76 0.21 0.00 0.00 175.17 174.90 1yl3 s LEU 90 N 2.74 -0.10 -0.14 1.23 1.43 -1.26 -4.72 118.68 117.86 1yl3 s LEU 90 Ca -0.03 -0.55 -0.07 0.00 -1.03 0.00 0.00 54.13 52.45 1yl3 s LEU 90 Cb -0.12 0.37 0.06 0.00 0.03 0.00 0.00 46.19 46.53 1yl3 s LEU 90 CO -0.16 -0.36 0.32 0.21 0.23 0.00 0.00 176.35 176.59 1yl3 s ASN 91 N 2.32 -0.30 -0.22 2.29 3.84 -1.26 -5.07 114.94 116.55 1yl3 s ASN 91 Ca 0.08 0.71 -0.05 0.00 0.21 0.00 0.00 52.86 53.81 1yl3 s ASN 91 Cb -0.15 0.64 -0.12 0.00 -0.55 0.00 0.00 41.25 41.08 1yl3 s ASN 91 CO -0.24 -0.19 -0.24 0.54 -2.79 0.00 0.00 177.10 174.19 1yl3 n ARG 92 N 4.44 0.49 -3.31 0.43 1.74 -1.26 -4.77 116.66 114.41 1yl3 n ARG 92 Ca -0.22 0.16 -0.42 0.00 -0.77 0.00 0.00 57.85 56.61 1yl3 n ARG 92 Cb 0.53 -1.35 -0.09 0.00 -1.02 0.00 0.00 32.46 30.54 1yl3 n ARG 92 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 1yl3 s LYS 93 N -2.41 3.29 0.00 5.56 -0.14 -1.26 -2.77 119.74 122.01 1yl3 s LYS 93 Ca -0.29 -0.57 0.00 0.00 -1.36 0.00 0.00 55.97 53.74 1yl3 s LYS 93 Cb 0.10 -3.91 0.00 0.00 -1.68 0.00 0.00 37.83 32.34 1yl3 s LYS 93 CO 0.43 -0.76 0.00 0.28 -0.76 0.00 0.00 175.35 174.54 1yl3 n VAL 94 N 5.42 0.00 0.00 3.17 0.31 -1.26 -5.01 118.33 120.96 1yl3 n VAL 94 Ca -0.07 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.26 1yl3 n VAL 94 Cb 0.48 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.41 1yl3 n VAL 94 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 1yl3 n LEU 95 N 0.00 0.00 -0.03 7.52 4.77 -1.11 -0.90 117.00 127.25 1yl3 n LEU 95 Ca 0.00 0.82 -0.02 0.00 -0.03 0.00 0.00 56.01 56.78 1yl3 n LEU 95 Cb 0.00 -0.32 -0.02 0.00 -2.33 0.00 0.00 43.42 40.75 1yl3 n LEU 95 CO 0.00 -0.32 0.50 0.00 -1.33 0.00 0.00 177.39 176.24 1yl3 h ALA 96 N -1.62 -0.33 -0.02 -1.18 0.00 -1.94 -0.74 119.26 113.44 1yl3 h ALA 96 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1yl3 h ALA 96 Cb 0.00 0.81 -0.00 0.00 0.00 0.00 0.00 17.79 18.59 1yl3 h ALA 96 CO 0.00 -0.38 -0.00 -0.25 0.00 0.00 0.00 179.25 178.62 1yl3 n ASP 97 N -3.14 -0.00 0.11 0.00 8.00 -0.95 0.54 116.55 121.10 1yl3 n ASP 97 Ca -0.00 0.03 -0.23 0.00 0.71 0.00 0.00 54.79 55.29 1yl3 n ASP 97 Cb 0.05 -0.01 -0.14 0.00 -0.02 0.00 0.00 41.12 41.00 1yl3 n ASP 97 CO 0.00 0.00 0.00 0.40 -0.39 0.00 0.00 177.20 177.21 1yl3 h ILE 98 N 0.00 1.30 -1.14 0.53 5.03 0.13 0.28 117.51 123.65 1yl3 h ILE 98 Ca 0.01 -2.53 0.41 0.00 -0.12 0.00 0.00 64.86 62.62 1yl3 h ILE 98 Cb 0.02 2.86 -0.13 0.00 -3.03 0.00 0.00 36.82 36.53 1yl3 h ILE 98 CO -0.02 0.76 0.71 0.00 -0.68 0.00 0.00 178.15 178.92 1yl3 n ALA 99 N -2.69 1.13 -0.81 1.87 0.00 2.14 -0.27 120.51 121.87 1yl3 n ALA 99 Ca -0.15 0.79 0.00 0.00 0.00 0.00 0.00 53.44 54.09 1yl3 n ALA 99 Cb 1.01 -0.92 0.00 0.00 0.00 0.00 0.00 19.45 19.53 1yl3 n ALA 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1yl3 n ALA 100 N -2.49 -0.04 -0.28 0.00 0.00 -0.47 -4.05 120.51 113.17 1yl3 n ALA 100 Ca 0.35 0.00 0.28 0.00 0.00 0.00 0.00 53.44 54.07 1yl3 n ALA 100 Cb 1.32 0.00 0.52 0.00 0.00 0.00 0.00 19.45 21.29 1yl3 n ALA 100 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1yl3 n ARG 101 N -0.78 -0.05 -3.30 0.00 5.12 0.62 -4.02 116.66 114.25 1yl3 n ARG 101 Ca 0.00 1.20 -0.10 0.00 -1.93 0.00 0.00 57.85 57.02 1yl3 n ARG 101 Cb 0.00 -2.16 -0.05 0.00 -1.16 0.00 0.00 32.46 29.09 1yl3 n ARG 101 CO 0.00 0.00 0.00 -2.00 -1.93 0.00 0.00 177.63 173.70 1yl3 s GLU 102 N -5.31 0.62 0.17 5.56 2.56 0.03 -5.04 118.70 117.28 1yl3 s GLU 102 Ca -0.08 -0.40 -0.16 0.00 0.00 0.00 0.00 54.97 54.34 1yl3 s GLU 102 Cb 0.30 -0.37 0.14 0.00 2.00 0.00 0.00 34.13 36.19 1yl3 s GLU 102 CO 0.68 -1.15 1.20 -0.35 -0.56 0.00 0.00 175.26 175.08 1yl3 n PRO 103 N 4.63 -0.21 0.16 4.30 -0.04 -1.26 -1.00 135.00 141.58 1yl3 n PRO 103 Ca 0.08 1.18 -0.06 0.00 -0.04 0.00 0.00 63.50 64.66 1yl3 n PRO 103 Cb 0.50 -1.75 -0.03 0.00 -0.04 0.00 0.00 33.50 32.17 1yl3 n PRO 103 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 1yl3 h GLU 104 N 0.00 -0.40 -0.43 0.54 5.08 -1.93 0.42 114.58 117.86 1yl3 h GLU 104 Ca 0.24 0.03 0.04 0.00 -1.00 0.00 0.00 59.36 58.66 1yl3 h GLU 104 Cb 0.43 0.09 -0.05 0.00 0.50 0.00 0.00 28.75 29.72 1yl3 h GLU 104 CO -0.76 -0.27 -0.25 0.00 -1.00 0.00 0.00 179.01 176.73 1yl3 n ALA 105 N -2.23 -0.28 0.09 3.43 0.00 -0.17 0.29 120.51 121.64 1yl3 n ALA 105 Ca -0.05 0.37 -0.04 0.00 0.00 0.00 0.00 53.44 53.71 1yl3 n ALA 105 Cb 0.16 -0.04 -0.02 0.00 0.00 0.00 0.00 19.45 19.55 1yl3 n ALA 105 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 1yl3 h PHE 106 N 0.00 -0.32 0.00 0.00 3.57 -1.29 -1.15 116.94 117.75 1yl3 h PHE 106 Ca 0.07 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.57 1yl3 h PHE 106 Cb 0.18 0.12 0.00 0.00 2.79 0.00 0.00 35.95 39.04 1yl3 h PHE 106 CO -0.48 -0.17 0.00 1.63 -2.23 0.00 0.00 178.31 177.06 1yl3 n LYS 107 N -2.98 0.00 -0.25 1.11 4.76 0.84 0.37 118.16 122.01 1yl3 n LYS 107 Ca -0.03 0.02 -0.06 0.00 -2.87 0.00 0.00 58.31 55.36 1yl3 n LYS 107 Cb 0.11 -0.03 -0.06 0.00 -1.84 0.00 0.00 35.03 33.22 1yl3 n LYS 107 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1yl3 n ALA 108 N -1.42 -0.37 -0.36 7.82 0.00 0.25 0.17 120.51 126.59 1yl3 n ALA 108 Ca 0.00 0.50 0.04 0.00 0.00 0.00 0.00 53.44 53.98 1yl3 n ALA 108 Cb 0.00 0.09 0.11 0.00 0.00 0.00 0.00 19.45 19.65 1yl3 n ALA 108 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 1yl3 n LEU 109 N -4.33 -0.43 -0.04 0.00 0.00 1.16 0.13 117.00 113.48 1yl3 n LEU 109 Ca 0.01 1.70 -0.08 0.00 0.00 0.00 0.00 56.01 57.64 1yl3 n LEU 109 Cb 0.15 -0.48 -0.02 0.00 0.00 0.00 0.00 43.42 43.07 1yl3 n LEU 109 CO -0.09 -1.60 0.71 0.58 0.00 0.00 0.00 177.39 176.99 1yl3 h VAL 110 N 0.00 0.44 0.00 1.96 2.07 0.35 -0.72 116.25 120.36 1yl3 h VAL 110 Ca 0.44 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.96 1yl3 h VAL 110 Cb 0.68 0.44 0.00 0.00 -1.52 0.00 0.00 31.29 30.89 1yl3 h VAL 110 CO -1.00 0.00 0.00 0.47 0.02 0.00 0.00 177.57 177.06 1yl3 n ASP 111 N -5.36 0.00 -0.33 0.57 9.92 0.34 -0.44 116.55 121.25 1yl3 n ASP 111 Ca -0.01 0.57 0.04 0.00 -0.53 0.00 0.00 54.79 54.86 1yl3 n ASP 111 Cb 0.27 -0.07 0.10 0.00 -0.64 0.00 0.00 41.12 40.78 1yl3 n ASP 111 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1yl3 n ALA 112 N -1.08 0.12 0.04 2.24 0.00 -0.49 0.27 120.51 121.60 1yl3 n ALA 112 Ca 0.00 0.96 -0.10 0.00 0.00 0.00 0.00 53.44 54.29 1yl3 n ALA 112 Cb 0.00 -0.53 -0.04 0.00 0.00 0.00 0.00 19.45 18.87 1yl3 n ALA 112 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1yl3 h SER 113 N 0.00 -0.39 -0.96 0.00 4.64 -0.75 0.11 113.55 116.20 1yl3 h SER 113 Ca 0.39 0.06 0.24 0.00 -0.47 0.00 0.00 61.79 62.02 1yl3 h SER 113 Cb 0.62 0.17 -0.18 0.00 -0.31 0.00 0.00 62.40 62.70 1yl3 h SER 113 CO -0.91 -0.18 -0.07 0.54 -0.87 0.00 0.00 176.83 175.34 1yl3 n ARG 114 N -5.27 -0.08 -0.05 4.77 1.74 0.78 0.44 116.66 118.99 1yl3 n ARG 114 Ca -0.05 1.45 -0.15 0.00 -0.77 0.00 0.00 57.85 58.34 1yl3 n ARG 114 Cb 0.19 -2.26 -0.07 0.00 -1.02 0.00 0.00 32.46 29.29 1yl3 n ARG 114 CO 0.00 0.00 0.00 -0.91 -1.52 0.00 0.00 177.63 175.20 1yl3 h ASN 115 N 0.00 0.59 -0.43 0.55 2.35 -0.66 -0.57 115.58 117.41 1yl3 h ASN 115 Ca 0.54 -0.59 0.13 0.00 -0.55 0.00 0.00 56.30 55.83 1yl3 h ASN 115 Cb 1.03 -0.17 -0.08 0.00 0.05 0.00 0.00 38.32 39.15 1yl3 h ASN 115 CO -0.93 1.07 0.05 0.00 -1.65 0.00 0.00 177.43 175.98 1yl3 n ALA 116 N -2.52 0.27 -1.09 -0.83 0.00 1.50 -1.95 120.51 115.89 1yl3 n ALA 116 Ca -0.07 0.46 0.00 0.00 0.00 0.00 0.00 53.44 53.83 1yl3 n ALA 116 Cb 0.53 -0.36 0.00 0.00 0.00 0.00 0.00 19.45 19.62 1yl3 n ALA 116 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39 1yl3 n ARG 117 N -4.36 0.00 0.00 0.00 1.85 -0.15 -4.82 116.66 109.18 1yl3 n ARG 117 Ca 0.11 0.00 0.06 0.00 -1.00 0.00 0.00 57.85 57.02 1yl3 n ARG 117 Cb 0.38 -0.12 0.05 0.00 -1.05 0.00 0.00 32.46 31.71 1yl3 n ARG 117 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62