#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yl3 n GLU 2 N 0.00 0.00 -3.53 3.17 1.02 -1.26 -0.98 120.64 119.06 1yl3 n GLU 2 Ca 0.00 0.00 -0.40 0.00 -0.02 0.00 0.00 57.16 56.74 1yl3 n GLU 2 Cb 0.00 -0.58 -0.04 0.00 -0.02 0.00 0.00 31.44 30.80 1yl3 n GLU 2 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1yl3 s ALA 3 N 0.96 4.38 -0.06 0.62 0.00 -0.25 -4.80 121.76 122.62 1yl3 s ALA 3 Ca 0.00 -3.79 -0.30 0.00 0.00 0.00 0.00 51.96 47.87 1yl3 s ALA 3 Cb 0.00 -3.09 -0.08 0.00 0.00 0.00 0.00 23.12 19.94 1yl3 s ALA 3 CO 0.00 -2.17 2.05 0.25 0.00 0.00 0.00 175.76 175.89 1yl3 n THR 4 N 2.57 0.62 -2.83 0.00 -2.24 -1.26 -0.95 114.28 110.19 1yl3 n THR 4 Ca 0.21 -0.23 -0.42 0.00 -2.27 0.00 0.00 64.05 61.34 1yl3 n THR 4 Cb 0.38 -2.33 -0.04 0.00 -2.10 0.00 0.00 70.33 66.24 1yl3 n THR 4 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1yl3 s ILE 5 N 5.62 4.84 0.13 2.28 1.01 -0.64 -4.03 121.20 130.41 1yl3 s ILE 5 Ca 0.93 1.74 -0.01 0.00 0.00 0.00 0.00 60.65 63.31 1yl3 s ILE 5 Cb -0.44 -4.18 0.02 0.00 0.01 0.00 0.00 42.46 37.86 1yl3 s ILE 5 CO 0.41 -0.01 0.04 -1.22 0.00 0.00 0.00 174.94 174.16 1yl3 n TYR 6 N 5.37 -0.71 -3.58 3.97 4.02 -0.07 -3.97 117.16 122.19 1yl3 n TYR 6 Ca 0.06 0.06 -0.22 0.00 -0.01 0.00 0.00 57.90 57.79 1yl3 n TYR 6 Cb 0.48 -0.24 0.07 0.00 -0.02 0.00 0.00 39.34 39.63 1yl3 n TYR 6 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 176.86 172.38 1yl3 n ASP 7 N -0.39 -3.84 0.00 7.72 2.03 -1.26 -4.46 116.55 116.36 1yl3 n ASP 7 Ca 0.01 -0.63 0.00 0.00 0.52 0.00 0.00 54.79 54.68 1yl3 n ASP 7 Cb 0.03 -4.82 0.00 0.00 -0.72 0.00 0.00 41.12 35.60 1yl3 n ASP 7 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 1yl3 n ASN 11 N -3.05 0.00 -0.41 1.67 3.02 -1.25 -0.65 115.26 114.58 1yl3 n ASN 11 Ca -0.14 0.00 0.31 0.00 -0.03 0.00 0.00 54.58 54.72 1yl3 n ASN 11 Cb 0.61 0.00 0.48 0.00 -0.61 0.00 0.00 39.78 40.26 1yl3 n ASN 11 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 1yl3 n THR 12 N 0.00 0.00 -0.98 3.41 -2.24 -1.26 -4.40 114.28 108.82 1yl3 n THR 12 Ca 0.00 0.87 -0.30 0.00 -2.27 0.00 0.00 64.05 62.35 1yl3 n THR 12 Cb 0.00 -1.45 0.16 0.00 -2.10 0.00 0.00 70.33 66.94 1yl3 n THR 12 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1yl3 s ASP 13 N -3.91 2.99 0.77 3.42 1.11 0.18 -5.00 116.67 116.22 1yl3 s ASP 13 Ca -0.03 1.68 -0.11 0.00 0.18 0.00 0.00 52.55 54.28 1yl3 s ASP 13 Cb 0.16 -2.32 -0.01 0.00 1.07 0.00 0.00 42.92 41.82 1yl3 s ASP 13 CO 0.52 -2.97 -0.34 0.61 1.18 0.00 0.00 175.17 174.17 1yl3 n GLY 14 N -0.49 -1.91 3.42 0.21 0.00 -1.26 -4.69 105.19 100.48 1yl3 n GLY 14 Ca 0.08 -0.24 -0.30 0.00 0.00 0.00 0.00 46.02 45.55 1yl3 n GLY 14 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1yl3 s GLU 15 N -2.39 1.93 0.30 1.61 2.02 -1.26 -1.63 118.70 119.28 1yl3 s GLU 15 Ca 0.20 -1.06 0.04 0.00 0.02 0.00 0.00 54.97 54.17 1yl3 s GLU 15 Cb 0.01 -2.10 -0.06 0.00 0.10 0.00 0.00 34.13 32.08 1yl3 s GLU 15 CO 0.27 0.52 0.04 0.08 0.02 0.00 0.00 175.26 176.19 1yl3 s VAL 16 N -0.92 1.18 -0.11 2.63 1.01 -0.13 -4.89 120.40 119.18 1yl3 s VAL 16 Ca 0.14 -2.02 -0.10 0.00 0.00 0.00 0.00 61.98 60.00 1yl3 s VAL 16 Cb -0.10 -2.67 -0.05 0.00 0.00 0.00 0.00 36.38 33.56 1yl3 s VAL 16 CO 0.05 -0.09 0.21 1.51 0.00 0.00 0.00 175.10 176.78 1yl3 s ASP 17 N -3.44 6.46 -0.28 3.32 -4.77 -1.26 -1.09 116.67 115.61 1yl3 s ASP 17 Ca 0.34 0.55 -0.29 0.00 -3.30 0.00 0.00 52.55 49.86 1yl3 s ASP 17 Cb 0.08 -2.12 -0.00 0.00 -1.09 0.00 0.00 42.92 39.78 1yl3 s ASP 17 CO 0.14 0.34 1.38 -0.76 0.70 0.00 0.00 175.17 176.96 1yl3 s LEU 18 N -0.75 3.88 0.66 2.11 1.43 -0.15 -4.78 118.68 121.07 1yl3 s LEU 18 Ca 0.16 1.29 -0.12 0.00 -1.03 0.00 0.00 54.13 54.43 1yl3 s LEU 18 Cb -0.13 -3.54 -0.01 0.00 0.03 0.00 0.00 46.19 42.55 1yl3 s LEU 18 CO 0.05 -1.13 1.06 -2.16 0.23 0.00 0.00 176.35 174.40 1yl3 s PRO 19 N 4.30 3.04 0.26 1.29 0.04 -1.26 -2.98 135.00 139.70 1yl3 s PRO 19 Ca 0.60 1.05 -0.04 0.00 0.04 0.00 0.00 61.00 62.65 1yl3 s PRO 19 Cb -0.18 -2.00 0.52 0.00 0.04 0.00 0.00 34.50 32.87 1yl3 s PRO 19 CO 0.25 -1.02 1.63 -0.44 0.04 0.00 0.00 177.00 177.45 1yl3 h ASP 20 N -0.33 -0.31 0.00 6.66 3.32 -1.98 -0.87 116.42 122.92 1yl3 h ASP 20 Ca -0.45 0.21 0.00 0.00 0.02 0.00 0.00 57.03 56.81 1yl3 h ASP 20 Cb 1.21 0.35 0.00 0.00 0.22 0.00 0.00 39.33 41.11 1yl3 h ASP 20 CO 0.57 -0.19 0.00 0.52 -1.72 0.00 0.00 179.24 178.41 1yl3 n VAL 21 N -5.34 0.00 -0.27 -1.35 0.31 -1.26 -1.52 118.33 108.90 1yl3 n VAL 21 Ca 0.16 0.80 0.07 0.00 -0.01 0.00 0.00 64.34 65.36 1yl3 n VAL 21 Cb 0.54 -1.29 0.21 0.00 -0.91 0.00 0.00 33.84 32.39 1yl3 n VAL 21 CO 0.00 0.00 0.00 -0.26 -1.32 0.00 0.00 176.83 175.25 1yl3 h PHE 22 N 0.00 0.51 0.00 3.52 -1.00 -1.88 -3.15 116.94 114.94 1yl3 h PHE 22 Ca 0.00 0.04 0.00 0.00 2.81 0.00 0.00 57.97 60.82 1yl3 h PHE 22 Cb 0.00 -0.11 0.00 0.00 3.61 0.00 0.00 35.95 39.45 1yl3 h PHE 22 CO 0.00 0.02 0.00 0.39 -1.61 0.00 0.00 178.31 177.11 1yl3 n GLU 23 N -5.03 0.00 0.00 1.51 1.02 -0.35 -4.47 120.64 113.32 1yl3 n GLU 23 Ca 0.16 0.54 0.00 0.00 -0.02 0.00 0.00 57.16 57.84 1yl3 n GLU 23 Cb 0.47 -0.97 0.00 0.00 -0.02 0.00 0.00 31.44 30.92 1yl3 n GLU 23 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 1yl3 n THR 24 N -1.39 0.00 0.15 2.62 -2.24 -0.60 -4.81 114.28 108.01 1yl3 n THR 24 Ca 0.00 0.00 0.02 0.00 -2.27 0.00 0.00 64.05 61.80 1yl3 n THR 24 Cb 0.00 0.00 -0.03 0.00 -2.10 0.00 0.00 70.33 68.20 1yl3 n THR 24 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 1yl3 n PRO 25 N 0.00 3.53 0.00 -0.78 -0.04 -1.26 -5.10 135.00 131.35 1yl3 n PRO 25 Ca 0.00 -0.02 0.00 0.00 -0.04 0.00 0.00 63.50 63.44 1yl3 n PRO 25 Cb 0.00 -0.87 0.00 0.00 -0.04 0.00 0.00 33.50 32.59 1yl3 n PRO 25 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1yl3 n VAL 26 N -1.31 0.00 -3.62 0.52 0.31 -1.26 -5.06 118.33 107.91 1yl3 n VAL 26 Ca 0.00 0.00 -0.28 0.00 -0.01 0.00 0.00 64.34 64.05 1yl3 n VAL 26 Cb 0.10 0.00 -0.11 0.00 -0.91 0.00 0.00 33.84 32.91 1yl3 n VAL 26 CO 0.00 0.00 0.00 -0.13 -1.32 0.00 0.00 176.83 175.38 1yl3 s ARG 27 N -5.01 1.49 0.03 5.55 0.52 -1.26 -5.05 118.95 115.22 1yl3 s ARG 27 Ca 0.00 -2.50 -0.11 0.00 -0.52 0.00 0.00 55.73 52.60 1yl3 s ARG 27 Cb 0.00 -2.24 -0.05 0.00 0.52 0.00 0.00 34.95 33.18 1yl3 s ARG 27 CO 0.00 -1.31 1.17 0.77 0.02 0.00 0.00 175.30 175.95 1yl3 h SER 28 N 5.75 -0.48 -0.60 0.23 0.02 -1.98 -0.48 113.55 116.02 1yl3 h SER 28 Ca 0.18 0.05 0.11 0.00 -0.84 0.00 0.00 61.79 61.29 1yl3 h SER 28 Cb 0.86 0.17 -0.11 0.00 0.14 0.00 0.00 62.40 63.47 1yl3 h SER 28 CO 0.50 -0.18 -0.18 0.47 -1.14 0.00 0.00 176.83 176.30 1yl3 n ASP 29 N -3.35 -0.29 0.42 3.07 8.00 -1.26 0.22 116.55 123.36 1yl3 n ASP 29 Ca -0.03 1.04 -0.17 0.00 0.71 0.00 0.00 54.79 56.34 1yl3 n ASP 29 Cb 0.13 -0.28 -0.08 0.00 -0.02 0.00 0.00 41.12 40.87 1yl3 n ASP 29 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 1yl3 h LEU 30 N 0.00 -0.92 -0.74 0.64 3.38 -1.96 -1.07 115.31 114.65 1yl3 h LEU 30 Ca 0.25 0.03 0.07 0.00 0.09 0.00 0.00 57.88 58.32 1yl3 h LEU 30 Cb 0.40 0.24 -0.09 0.00 0.09 0.00 0.00 40.66 41.30 1yl3 h LEU 30 CO -0.61 -0.64 -0.44 -0.38 0.09 0.00 0.00 178.44 176.47 1yl3 n ILE 31 N -4.98 -0.50 0.02 1.22 5.41 0.59 0.17 119.36 121.28 1yl3 n ILE 31 Ca -0.13 1.79 -0.13 0.00 1.00 0.00 0.00 62.75 65.28 1yl3 n ILE 31 Cb 0.43 -2.22 -0.06 0.00 -0.71 0.00 0.00 39.64 37.08 1yl3 n ILE 31 CO 0.00 0.00 0.00 1.23 0.00 0.00 0.00 176.55 177.78 1yl3 h GLY 32 N 0.00 -0.72 -0.72 7.39 0.00 -1.13 0.21 103.07 108.10 1yl3 h GLY 32 Ca 0.12 0.51 0.07 0.00 0.00 0.00 0.00 47.33 48.02 1yl3 h GLY 32 CO -0.70 -0.23 -0.43 0.28 0.00 0.00 0.00 176.54 175.46 1yl3 n LYS 33 N -5.44 -0.32 -0.05 4.80 5.02 0.44 0.60 118.16 123.22 1yl3 n LYS 33 Ca -0.05 1.17 -0.01 0.00 -2.02 0.00 0.00 58.31 57.40 1yl3 n LYS 33 Cb 0.36 -1.72 -0.01 0.00 -0.02 0.00 0.00 35.03 33.64 1yl3 n LYS 33 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1yl3 n ALA 34 N -3.35 -0.07 -0.14 7.82 0.00 0.60 -0.73 120.51 124.66 1yl3 n ALA 34 Ca 0.01 0.09 -0.04 0.00 0.00 0.00 0.00 53.44 53.51 1yl3 n ALA 34 Cb 0.19 0.40 -0.03 0.00 0.00 0.00 0.00 19.45 20.01 1yl3 n ALA 34 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1yl3 n VAL 35 N -3.20 -0.22 -0.06 0.00 0.31 0.20 0.63 118.33 115.99 1yl3 n VAL 35 Ca 0.00 1.30 -0.06 0.00 -0.01 0.00 0.00 64.34 65.57 1yl3 n VAL 35 Cb 0.03 -1.66 -0.04 0.00 -0.91 0.00 0.00 33.84 31.26 1yl3 n VAL 35 CO 0.00 0.00 0.00 0.03 -1.32 0.00 0.00 176.83 175.54 1yl3 h ARG 36 N 0.00 -0.17 -0.45 5.55 2.47 0.48 0.92 114.38 123.18 1yl3 h ARG 36 Ca 0.05 0.01 0.09 0.00 -1.26 0.00 0.00 59.98 58.88 1yl3 h ARG 36 Cb 0.13 0.04 -0.09 0.00 -1.65 0.00 0.00 29.97 28.41 1yl3 h ARG 36 CO -0.31 -0.12 -0.10 0.00 0.56 0.00 0.00 179.97 180.00 1yl3 n ALA 37 N -2.87 0.12 -1.00 0.04 0.00 0.20 -0.75 120.51 116.25 1yl3 n ALA 37 Ca -0.02 0.49 0.00 0.00 0.00 0.00 0.00 53.44 53.92 1yl3 n ALA 37 Cb 0.15 -0.30 0.00 0.00 0.00 0.00 0.00 19.45 19.30 1yl3 n ALA 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1yl3 n ALA 38 N -3.80 0.00 -0.34 0.00 0.00 0.31 -1.28 120.51 115.40 1yl3 n ALA 38 Ca 0.07 0.00 0.18 0.00 0.00 0.00 0.00 53.44 53.70 1yl3 n ALA 38 Cb 0.24 0.03 0.40 0.00 0.00 0.00 0.00 19.45 20.11 1yl3 n ALA 38 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 1yl3 h GLN 39 N 0.00 0.55 -0.29 0.00 7.50 -0.36 -1.57 115.11 120.94 1yl3 h GLN 39 Ca 0.00 -0.03 0.03 0.00 0.50 0.00 0.00 58.65 59.14 1yl3 h GLN 39 Cb 0.00 -0.12 -0.04 0.00 0.05 0.00 0.00 27.48 27.37 1yl3 h GLN 39 CO 0.00 0.36 -0.20 0.00 -1.50 0.00 0.00 178.83 177.49 1yl3 h ALA 40 N 1.72 -0.27 0.00 3.87 0.00 -0.90 1.13 119.26 124.81 1yl3 h ALA 40 Ca 0.64 0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.58 1yl3 h ALA 40 Cb 1.25 1.06 0.00 0.00 0.00 0.00 0.00 17.79 20.10 1yl3 h ALA 40 CO -0.46 -0.40 0.00 -0.91 0.00 0.00 0.00 179.25 177.48 1yl3 h ASN 41 N -0.04 0.00 0.02 0.00 2.35 -0.49 -3.33 115.58 114.09 1yl3 h ASN 41 Ca 0.05 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.80 1yl3 h ASN 41 Cb 0.16 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.53 1yl3 h ASN 41 CO -0.30 0.00 -0.01 -0.09 -1.65 0.00 0.00 177.43 175.39 1yl3 h ARG 42 N 0.00 -0.02 0.00 0.81 2.43 0.22 -3.46 114.38 114.35 1yl3 h ARG 42 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1yl3 h ARG 42 Cb 0.41 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.97 1yl3 h ARG 42 CO 0.00 0.56 0.00 1.63 -1.51 0.00 0.00 179.97 180.65 1yl3 n LYS 43 N -4.82 0.60 0.00 0.20 5.02 -0.25 -5.06 118.16 113.86 1yl3 n LYS 43 Ca -0.09 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.20 1yl3 n LYS 43 Cb 0.29 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.30 1yl3 n LYS 43 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 1yl3 n GLN 44 N 0.00 0.00 -3.55 1.97 6.02 -1.26 -5.06 117.38 115.50 1yl3 n GLN 44 Ca 0.00 0.00 -0.07 0.00 -0.01 0.00 0.00 57.00 56.92 1yl3 n GLN 44 Cb 0.00 0.00 -0.02 0.00 1.02 0.00 0.00 30.24 31.24 1yl3 n GLN 44 CO 0.00 0.00 0.00 0.16 -1.01 0.00 0.00 177.06 176.21 1yl3 s ASP 45 N 1.00 -0.29 0.11 1.08 -4.77 -1.26 -4.78 116.67 107.77 1yl3 s ASP 45 Ca 0.00 -0.04 -0.04 0.00 -3.30 0.00 0.00 52.55 49.17 1yl3 s ASP 45 Cb 0.00 0.33 -0.03 0.00 -1.09 0.00 0.00 42.92 42.13 1yl3 s ASP 45 CO 0.00 -0.55 0.10 -0.31 0.70 0.00 0.00 175.17 175.11 1yl3 s TYR 46 N -2.95 0.60 0.06 2.11 1.51 -1.26 -5.02 117.35 112.40 1yl3 s TYR 46 Ca 0.07 -1.02 -0.21 0.00 -1.01 0.00 0.00 57.07 54.90 1yl3 s TYR 46 Cb -0.01 -0.32 0.05 0.00 -0.11 0.00 0.00 41.96 41.57 1yl3 s TYR 46 CO -0.07 -0.53 0.49 0.20 -1.11 0.00 0.00 175.55 174.52 1yl3 s GLY 47 N -2.98 -0.38 -0.32 0.71 0.00 -0.80 -0.68 107.32 102.87 1yl3 s GLY 47 Ca 0.17 0.45 -0.06 0.00 0.00 0.00 0.00 44.72 45.27 1yl3 s GLY 47 CO -0.03 0.16 0.08 -1.35 0.00 0.00 0.00 173.10 171.97 1yl3 s SER 48 N -2.12 5.18 0.00 1.64 1.04 -1.23 -4.90 113.70 113.32 1yl3 s SER 48 Ca -0.04 -1.00 0.00 0.00 0.48 0.00 0.00 55.95 55.40 1yl3 s SER 48 Cb -0.00 -1.86 0.00 0.00 0.10 0.00 0.00 66.02 64.26 1yl3 s SER 48 CO -0.04 -0.27 0.00 -0.67 0.98 0.00 0.00 173.24 173.24 1yl3 n ASP 49 N 4.81 0.00 0.07 7.02 2.03 -1.26 -4.83 116.55 124.39 1yl3 n ASP 49 Ca -0.13 0.00 -0.12 0.00 0.52 0.00 0.00 54.79 55.05 1yl3 n ASP 49 Cb 0.46 0.00 -0.06 0.00 -0.72 0.00 0.00 41.12 40.80 1yl3 n ASP 49 CO 0.00 0.00 0.00 -0.33 -1.92 0.00 0.00 177.20 174.95 1yl3 h GLU 50 N 0.00 -0.50 0.10 -0.67 5.08 -1.97 -1.00 114.58 115.62 1yl3 h GLU 50 Ca 0.00 0.03 -0.00 0.00 -1.00 0.00 0.00 59.36 58.39 1yl3 h GLU 50 Cb 0.00 0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.35 1yl3 h GLU 50 CO 0.00 -0.33 -0.16 1.88 -1.00 0.00 0.00 179.01 179.40 1yl3 h TYR 51 N -0.51 -0.45 -0.86 4.33 0.99 -1.93 -0.05 116.97 118.48 1yl3 h TYR 51 Ca 0.05 0.01 0.18 0.00 2.00 0.00 0.00 58.73 60.97 1yl3 h TYR 51 Cb 0.59 0.18 -0.16 0.00 1.00 0.00 0.00 36.73 38.34 1yl3 h TYR 51 CO -0.36 -0.20 -0.18 0.00 -0.00 0.00 0.00 178.16 177.43 1yl3 h ALA 52 N -1.37 0.63 0.00 3.88 0.00 -1.94 0.89 119.26 121.35 1yl3 h ALA 52 Ca -0.01 0.33 -0.04 0.00 0.00 0.00 0.00 54.91 55.19 1yl3 h ALA 52 Cb 0.25 0.63 -0.01 0.00 0.00 0.00 0.00 17.79 18.67 1yl3 h ALA 52 CO -0.05 -0.41 -0.17 0.78 0.00 0.00 0.00 179.25 179.39 1yl3 h GLY 53 N 0.01 0.00 -1.81 0.00 0.00 -0.73 -3.38 103.07 97.16 1yl3 h GLY 53 Ca 0.43 0.00 -0.09 0.00 0.00 0.00 0.00 47.33 47.67 1yl3 h GLY 53 CO -0.87 0.00 -0.41 1.04 0.00 0.00 0.00 176.54 176.29 1yl3 n LEU 54 N -4.03 -0.15 0.09 3.11 4.32 -0.07 -4.05 117.00 116.22 1yl3 n LEU 54 Ca -0.02 -1.59 -0.04 0.00 -0.02 0.00 0.00 56.01 54.33 1yl3 n LEU 54 Cb 0.25 0.00 -0.02 0.00 -1.62 0.00 0.00 43.42 42.03 1yl3 n LEU 54 CO 0.34 0.96 0.26 0.08 -1.22 0.00 0.00 177.39 177.81 1yl3 h ARG 55 N 0.22 -0.25 0.00 3.23 0.11 -1.00 -3.48 114.38 113.20 1yl3 h ARG 55 Ca -0.26 0.02 0.00 0.00 0.10 0.00 0.00 59.98 59.83 1yl3 h ARG 55 Cb 1.41 0.06 0.00 0.00 1.11 0.00 0.00 29.97 32.55 1yl3 h ARG 55 CO -0.09 -0.17 0.00 0.25 0.10 0.00 0.00 179.97 180.06 1yl3 n THR 56 N -3.23 0.00 -0.03 0.08 -2.24 -1.26 -5.05 114.28 102.55 1yl3 n THR 56 Ca -0.03 0.00 0.01 0.00 -2.27 0.00 0.00 64.05 61.76 1yl3 n THR 56 Cb 0.10 -0.07 0.03 0.00 -2.10 0.00 0.00 70.33 68.30 1yl3 n THR 56 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 1yl3 n PRO 57 N 0.00 2.84 0.00 -0.78 -0.04 -1.26 -4.83 135.00 130.93 1yl3 n PRO 57 Ca 0.00 -1.59 0.00 0.00 -0.04 0.00 0.00 63.50 61.87 1yl3 n PRO 57 Cb 0.00 -1.06 0.00 0.00 -0.04 0.00 0.00 33.50 32.40 1yl3 n PRO 57 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1yl3 n ALA 58 N -0.26 -0.37 -3.19 0.55 0.00 -1.26 -4.81 120.51 111.17 1yl3 n ALA 58 Ca 0.03 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 53.05 1yl3 n ALA 58 Cb 0.28 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.72 1yl3 n ALA 58 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1yl3 n GLU 59 N 0.43 3.88 -0.81 0.00 -0.58 -1.26 -4.76 120.64 117.54 1yl3 n GLU 59 Ca 0.00 -4.54 -0.35 0.00 -0.42 0.00 0.00 57.16 51.85 1yl3 n GLU 59 Cb 0.00 -2.49 -0.12 0.00 -0.57 0.00 0.00 31.44 28.27 1yl3 n GLU 59 CO 0.00 0.00 0.00 0.43 -0.48 0.00 0.00 177.13 177.08 1yl3 n SER 60 N 1.72 1.00 -0.02 1.62 7.64 -1.26 -4.74 113.62 119.57 1yl3 n SER 60 Ca 0.25 -2.43 0.00 0.00 1.01 0.00 0.00 58.87 57.70 1yl3 n SER 60 Cb 0.36 -0.82 0.00 0.00 -1.01 0.00 0.00 64.21 62.74 1yl3 n SER 60 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 1yl3 n PHE 61 N 11.80 0.00 0.00 1.43 0.99 -1.26 -4.72 117.46 125.69 1yl3 n PHE 61 Ca 0.44 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.89 1yl3 n PHE 61 Cb 0.43 -0.00 0.00 0.00 -1.00 0.00 0.00 39.48 38.91 1yl3 n PHE 61 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1yl3 n GLY 62 N 0.02 0.55 0.00 1.37 0.00 -1.26 -4.78 105.19 101.09 1yl3 n GLY 62 Ca 0.00 0.40 0.00 0.00 0.00 0.00 0.00 46.02 46.42 1yl3 n GLY 62 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1yl3 n SER 63 N 1.72 0.00 0.00 1.61 7.64 -1.26 -4.65 113.62 118.68 1yl3 n SER 63 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1yl3 n SER 63 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 1yl3 n SER 63 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1yl3 n GLY 64 N 0.00 0.00 0.00 0.23 0.00 -1.26 -4.68 105.19 99.48 1yl3 n GLY 64 Ca 0.00 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.16 1yl3 n GLY 64 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1yl3 n ARG 65 N -0.10 0.32 -1.03 1.61 1.85 -1.26 -4.98 116.66 113.08 1yl3 n ARG 65 Ca 0.00 0.01 0.00 0.00 -1.00 0.00 0.00 57.85 56.86 1yl3 n ARG 65 Cb 0.00 -1.50 0.00 0.00 -1.05 0.00 0.00 32.46 29.91 1yl3 n ARG 65 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1yl3 n GLY 66 N 1.23 0.10 0.00 2.89 0.00 -1.26 -5.08 105.19 103.06 1yl3 n GLY 66 Ca 0.12 -0.37 0.00 0.00 0.00 0.00 0.00 46.02 45.77 1yl3 n GLY 66 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1yl3 n GLN 67 N -0.70 0.00 -3.16 1.61 6.02 -1.26 -5.17 117.38 114.72 1yl3 n GLN 67 Ca 0.00 0.00 0.05 0.00 -0.01 0.00 0.00 57.00 57.04 1yl3 n GLN 67 Cb 0.34 0.00 -0.02 0.00 1.02 0.00 0.00 30.24 31.58 1yl3 n GLN 67 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1yl3 s ALA 68 N -1.00 -3.74 0.00 -1.58 0.00 -1.26 -5.00 121.76 109.18 1yl3 s ALA 68 Ca 0.00 1.39 0.00 0.00 0.00 0.00 0.00 51.96 53.35 1yl3 s ALA 68 Cb 0.00 -2.55 0.00 0.00 0.00 0.00 0.00 23.12 20.57 1yl3 s ALA 68 CO 0.00 -1.40 0.00 0.72 0.00 0.00 0.00 175.76 175.08 1yl3 n HIS 69 N 5.32 0.00 0.00 0.00 8.25 -1.26 -5.02 115.22 122.51 1yl3 n HIS 69 Ca -0.09 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.37 1yl3 n HIS 69 Cb 0.55 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.66 1yl3 n HIS 69 CO 0.00 0.00 0.00 -2.13 0.64 0.00 0.00 176.34 174.85 1yl3 n ARG 79 N 0.00 0.00 -2.60 -0.41 0.63 -1.26 -4.43 116.66 108.59 1yl3 n ARG 79 Ca 0.00 0.00 -0.18 0.00 -0.92 0.00 0.00 57.85 56.75 1yl3 n ARG 79 Cb 0.00 -0.59 0.08 0.00 0.45 0.00 0.00 32.46 32.40 1yl3 n ARG 79 CO 0.00 0.00 0.00 0.28 -2.51 0.00 0.00 177.63 175.40 1yl3 n VAL 80 N 0.59 0.00 -2.40 5.15 0.31 -1.26 -4.46 118.33 116.26 1yl3 n VAL 80 Ca 0.00 -1.60 -0.42 0.00 -0.01 0.00 0.00 64.34 62.32 1yl3 n VAL 80 Cb 0.00 -0.71 -0.03 0.00 -0.91 0.00 0.00 33.84 32.19 1yl3 n VAL 80 CO 0.00 0.00 0.00 -2.84 -1.32 0.00 0.00 176.83 172.67 1yl3 s PRO 81 N -4.49 4.45 0.00 5.55 0.02 -1.26 -4.63 135.00 134.63 1yl3 s PRO 81 Ca 0.55 1.81 0.00 0.00 0.02 0.00 0.00 61.00 63.38 1yl3 s PRO 81 Cb -0.04 -3.32 0.00 0.00 0.02 0.00 0.00 34.50 31.17 1yl3 s PRO 81 CO 0.36 -0.22 0.00 0.00 -0.33 0.00 0.00 177.00 176.81 1yl3 n GLN 82 N 3.57 0.00 0.05 5.54 10.64 -1.26 -5.05 117.38 130.87 1yl3 n GLN 82 Ca 0.08 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.25 1yl3 n GLN 82 Cb 0.46 -0.30 0.00 0.00 -0.86 0.00 0.00 30.24 29.53 1yl3 n GLN 82 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 1yl3 n ALA 83 N -0.62 3.00 0.00 2.61 0.00 -1.26 -5.16 120.51 119.09 1yl3 n ALA 83 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1yl3 n ALA 83 Cb 0.05 0.25 0.00 0.00 0.00 0.00 0.00 19.45 19.75 1yl3 n ALA 83 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 1yl3 n VAL 84 N -3.45 0.00 0.00 0.00 0.24 -1.26 -5.00 118.33 108.86 1yl3 n VAL 84 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.30 1yl3 n VAL 84 Cb 0.04 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.41 1yl3 n VAL 84 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 1yl3 n LYS 85 N -0.10 -0.27 -3.44 7.34 4.01 -1.26 -4.54 118.16 119.90 1yl3 n LYS 85 Ca 0.00 0.00 -0.12 0.00 -0.51 0.00 0.00 58.31 57.68 1yl3 n LYS 85 Cb 0.00 -0.74 -0.04 0.00 -0.51 0.00 0.00 35.03 33.74 1yl3 n LYS 85 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1yl3 n GLY 86 N 0.40 2.77 1.95 0.72 0.00 -1.26 -4.95 105.19 104.82 1yl3 n GLY 86 Ca 0.00 -1.67 0.00 0.00 0.00 0.00 0.00 46.02 44.35 1yl3 n GLY 86 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1yl3 n ARG 87 N -0.43 0.00 0.00 1.61 1.74 -1.26 -4.68 116.66 113.64 1yl3 n ARG 87 Ca 0.03 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.11 1yl3 n ARG 87 Cb 0.43 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.87 1yl3 n ARG 87 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 1yl3 n SER 88 N 3.89 0.00 0.00 0.55 7.64 -1.26 -4.72 113.62 119.72 1yl3 n SER 88 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1yl3 n SER 88 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 1yl3 n SER 88 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1yl3 n ALA 89 N 1.46 0.00 0.00 -0.43 0.00 -1.26 -4.84 120.51 115.44 1yl3 n ALA 89 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1yl3 n ALA 89 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1yl3 n ALA 89 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.50 175.11 1yl3 n HIS 90 N 0.00 0.00 -0.53 0.00 1.44 -1.26 -5.17 115.22 109.69 1yl3 n HIS 90 Ca 0.00 0.00 -0.04 0.00 -2.01 0.00 0.00 57.72 55.67 1yl3 n HIS 90 Cb 0.00 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.11 1yl3 n HIS 90 CO 0.00 0.00 0.00 -0.35 -2.81 0.00 0.00 176.34 173.18 1yl3 n PRO 91 N 0.00 0.00 -1.86 -1.40 -0.04 -1.26 -4.60 135.00 125.84 1yl3 n PRO 91 Ca 0.00 0.00 -0.29 0.00 -0.04 0.00 0.00 63.50 63.17 1yl3 n PRO 91 Cb 0.00 -0.68 -0.07 0.00 -0.04 0.00 0.00 33.50 32.71 1yl3 n PRO 91 CO 0.00 0.00 0.00 -0.35 -0.04 0.00 0.00 175.50 175.11 1yl3 n PRO 92 N 1.40 1.38 -1.50 0.54 -0.04 -1.26 -4.83 135.00 130.69 1yl3 n PRO 92 Ca -0.00 -2.27 -0.48 0.00 -0.04 0.00 0.00 63.50 60.71 1yl3 n PRO 92 Cb 0.07 -3.63 -0.06 0.00 -0.04 0.00 0.00 33.50 29.85 1yl3 n PRO 92 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1yl3 n LYS 93 N 8.09 1.37 0.13 0.54 5.02 -1.22 -1.90 118.16 130.20 1yl3 n LYS 93 Ca 0.45 0.37 0.19 0.00 -2.02 0.00 0.00 58.31 57.31 1yl3 n LYS 93 Cb 0.46 -2.72 0.76 0.00 -0.02 0.00 0.00 35.03 33.50 1yl3 n LYS 93 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1yl3 h THR 94 N 7.11 0.34 -0.34 -0.18 1.03 -1.22 -1.08 112.91 118.56 1yl3 h THR 94 Ca -0.32 0.00 -0.72 0.00 -0.01 0.00 0.00 66.41 65.36 1yl3 h THR 94 Cb 1.29 0.66 -0.06 0.00 -1.07 0.00 0.00 68.15 68.97 1yl3 h THR 94 CO 1.00 0.00 2.93 -0.62 -0.01 0.00 0.00 175.52 178.82 1yl3 n GLU 95 N -3.62 3.14 -3.32 0.00 1.02 -1.26 -4.80 120.64 111.79 1yl3 n GLU 95 Ca 0.06 -2.80 -0.03 0.00 -0.02 0.00 0.00 57.16 54.37 1yl3 n GLU 95 Cb 0.57 -3.15 -0.05 0.00 -0.02 0.00 0.00 31.44 28.79 1yl3 n GLU 95 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 1yl3 s LYS 96 N 2.37 0.45 -0.98 3.49 1.02 -0.41 -5.10 119.74 120.58 1yl3 s LYS 96 Ca 0.47 0.85 -0.26 0.00 0.02 0.00 0.00 55.97 57.05 1yl3 s LYS 96 Cb 0.13 0.12 -0.17 0.00 -0.52 0.00 0.00 37.83 37.39 1yl3 s LYS 96 CO -0.07 -0.56 2.19 -0.51 -0.92 0.00 0.00 175.35 175.49 1yl3 s ASP 97 N 2.71 3.82 0.42 2.83 1.01 -1.26 -4.84 116.67 121.35 1yl3 s ASP 97 Ca 0.13 -0.66 0.21 0.00 0.71 0.00 0.00 52.55 52.94 1yl3 s ASP 97 Cb -0.15 -2.58 1.16 0.00 1.01 0.00 0.00 42.92 42.36 1yl3 s ASP 97 CO -0.18 -4.21 1.79 0.03 0.21 0.00 0.00 175.17 172.82 1yl3 h ARG 98 N 11.81 0.33 0.00 8.23 2.47 -1.94 -3.44 114.38 131.84 1yl3 h ARG 98 Ca 0.03 -0.02 -0.02 0.00 -1.26 0.00 0.00 59.98 58.71 1yl3 h ARG 98 Cb 0.99 -0.08 0.01 0.00 -1.65 0.00 0.00 29.97 29.25 1yl3 h ARG 98 CO 1.04 0.22 -0.01 -1.13 0.56 0.00 0.00 179.97 180.65 1yl3 n SER 99 N -4.55 -0.98 0.00 7.04 3.41 -1.26 -4.80 113.62 112.47 1yl3 n SER 99 Ca 0.24 -0.04 0.00 0.00 -0.26 0.00 0.00 58.87 58.81 1yl3 n SER 99 Cb 0.89 -0.20 0.00 0.00 -0.26 0.00 0.00 64.21 64.64 1yl3 n SER 99 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1yl3 n LEU 100 N 0.00 0.00 0.00 1.04 4.77 -1.26 -4.81 117.00 116.74 1yl3 n LEU 100 Ca 0.01 -0.03 0.00 0.00 -0.03 0.00 0.00 56.01 55.95 1yl3 n LEU 100 Cb 0.03 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.12 1yl3 n LEU 100 CO 0.02 0.14 0.00 0.47 -1.33 0.00 0.00 177.39 176.69 1yl3 n ASP 101 N 0.00 0.00 0.00 -1.43 9.92 -1.26 -4.90 116.55 118.88 1yl3 n ASP 101 Ca 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.26 1yl3 n ASP 101 Cb 0.12 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.60 1yl3 n ASP 101 CO 0.00 0.00 0.00 -0.11 0.13 0.00 0.00 177.20 177.22 1yl3 n LEU 102 N 0.00 0.00 0.00 0.64 0.00 -1.26 -5.02 117.00 111.36 1yl3 n LEU 102 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56.01 56.01 1yl3 n LEU 102 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43.42 43.42 1yl3 n LEU 102 CO 0.00 0.00 0.00 0.59 0.00 0.00 0.00 177.39 177.98 1yl3 n ASN 103 N 0.00 0.00 0.00 1.96 4.13 -1.26 -5.03 115.26 115.06 1yl3 n ASN 103 Ca 0.00 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.26 1yl3 n ASN 103 Cb 0.00 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.24 1yl3 n ASN 103 CO 0.00 0.00 0.00 0.47 0.28 0.00 0.00 177.26 178.01 1yl3 n ASP 104 N 0.00 0.00 -0.38 6.41 8.00 -1.26 -0.36 116.55 128.97 1yl3 n ASP 104 Ca 0.00 0.07 0.01 0.00 0.71 0.00 0.00 54.79 55.58 1yl3 n ASP 104 Cb 0.00 0.00 0.07 0.00 -0.02 0.00 0.00 41.12 41.17 1yl3 n ASP 104 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 1yl3 h LYS 105 N 0.00 -0.00 -0.08 -1.24 6.56 -1.99 0.14 116.57 119.97 1yl3 h LYS 105 Ca 0.00 0.00 0.01 0.00 -1.06 0.00 0.00 60.65 59.60 1yl3 h LYS 105 Cb 0.00 0.00 -0.01 0.00 -0.57 0.00 0.00 32.23 31.65 1yl3 h LYS 105 CO 0.00 -0.00 -0.09 0.93 -2.06 0.00 0.00 179.45 178.23 1yl3 h GLU 106 N -0.00 -0.05 -0.16 3.15 5.08 -1.10 -0.53 114.58 120.96 1yl3 h GLU 106 Ca 0.39 0.00 0.02 0.00 -1.00 0.00 0.00 59.36 58.77 1yl3 h GLU 106 Cb 0.64 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.87 1yl3 h GLU 106 CO -1.00 -0.03 -0.15 0.00 -1.00 0.00 0.00 179.01 176.83 1yl3 h ARG 107 N -0.05 -0.06 -0.68 2.33 3.08 0.14 0.03 114.38 119.16 1yl3 h ARG 107 Ca 0.01 0.00 0.12 0.00 0.07 0.00 0.00 59.98 60.18 1yl3 h ARG 107 Cb 0.09 0.01 -0.08 0.00 0.08 0.00 0.00 29.97 30.07 1yl3 h ARG 107 CO -0.10 -0.04 0.26 1.96 -1.07 0.00 0.00 179.97 180.98 1yl3 h GLN 108 N -0.07 0.41 -0.74 0.04 4.20 -1.15 1.34 115.11 119.15 1yl3 h GLN 108 Ca 0.03 -0.02 0.15 0.00 0.06 0.00 0.00 58.65 58.86 1yl3 h GLN 108 Cb 0.14 -0.09 -0.14 0.00 0.30 0.00 0.00 27.48 27.68 1yl3 h GLN 108 CO -0.18 0.27 -0.19 -0.07 -0.67 0.00 0.00 178.83 177.99 1yl3 h LEU 109 N 0.43 -0.71 -0.04 1.46 3.38 0.26 0.05 115.31 120.14 1yl3 h LEU 109 Ca 0.36 0.22 0.02 0.00 0.09 0.00 0.00 57.88 58.57 1yl3 h LEU 109 Cb 0.49 0.46 -0.04 0.00 0.09 0.00 0.00 40.66 41.67 1yl3 h LEU 109 CO -0.36 -0.25 -0.32 0.00 0.09 0.00 0.00 178.44 177.61 1yl3 h ALA 110 N 1.72 -0.73 -1.12 1.53 0.00 0.35 0.17 119.26 121.18 1yl3 h ALA 110 Ca 0.35 -0.04 0.33 0.00 0.00 0.00 0.00 54.91 55.55 1yl3 h ALA 110 Cb 0.54 0.80 -0.12 0.00 0.00 0.00 0.00 17.79 19.01 1yl3 h ALA 110 CO -0.76 -0.84 0.69 0.28 0.00 0.00 0.00 179.25 178.62 1yl3 h VAL 111 N -0.37 0.33 0.00 0.00 2.07 -0.13 -1.31 116.25 116.84 1yl3 h VAL 111 Ca 0.01 -0.10 0.00 0.00 0.82 0.00 0.00 66.70 67.44 1yl3 h VAL 111 Cb 0.41 0.02 0.00 0.00 -1.52 0.00 0.00 31.29 30.21 1yl3 h VAL 111 CO -0.24 0.05 0.00 0.54 0.02 0.00 0.00 177.57 177.95 1yl3 n ARG 112 N -4.78 0.00 -0.35 1.57 1.74 0.48 -0.84 116.66 114.48 1yl3 n ARG 112 Ca 0.31 0.01 0.32 0.00 -0.77 0.00 0.00 57.85 57.71 1yl3 n ARG 112 Cb 1.08 -0.54 0.65 0.00 -1.02 0.00 0.00 32.46 32.63 1yl3 n ARG 112 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 1yl3 h SER 113 N 0.00 0.19 0.33 0.55 0.87 -1.17 0.26 113.55 114.59 1yl3 h SER 113 Ca 0.00 0.05 -0.01 0.00 -1.23 0.00 0.00 61.79 60.59 1yl3 h SER 113 Cb 0.00 0.02 -0.01 0.00 -0.44 0.00 0.00 62.40 61.97 1yl3 h SER 113 CO 0.00 0.01 -0.24 0.00 -0.53 0.00 0.00 176.83 176.07 1yl3 h ALA 114 N 1.49 -1.03 -0.94 6.23 0.00 -1.28 -0.41 119.26 123.32 1yl3 h ALA 114 Ca 0.62 -0.11 0.28 0.00 0.00 0.00 0.00 54.91 55.69 1yl3 h ALA 114 Cb 2.08 0.40 -0.16 0.00 0.00 0.00 0.00 17.79 20.11 1yl3 h ALA 114 CO -0.16 -1.02 0.22 -0.07 0.00 0.00 0.00 179.25 178.21 1yl3 h LEU 115 N -0.55 -0.11 -0.49 0.00 -0.00 0.15 1.64 115.31 115.95 1yl3 h LEU 115 Ca -0.04 0.23 0.07 0.00 -0.00 0.00 0.00 57.88 58.14 1yl3 h LEU 115 Cb 0.46 0.34 -0.10 0.00 -0.00 0.00 0.00 40.66 41.36 1yl3 h LEU 115 CO 0.02 -0.27 -0.47 0.00 -0.00 0.00 0.00 178.44 177.72 1yl3 h ALA 116 N 1.88 -0.50 -0.90 1.53 0.00 0.12 1.63 119.26 123.03 1yl3 h ALA 116 Ca 0.62 0.06 0.17 0.00 0.00 0.00 0.00 54.91 55.76 1yl3 h ALA 116 Cb 1.33 1.00 -0.16 0.00 0.00 0.00 0.00 17.79 19.96 1yl3 h ALA 116 CO -0.76 -0.91 -0.28 0.00 0.00 0.00 0.00 179.25 177.30 1yl3 h ALA 117 N 0.37 0.43 -0.51 0.00 0.00 0.39 0.56 119.26 120.50 1yl3 h ALA 117 Ca 0.14 0.32 0.10 0.00 0.00 0.00 0.00 54.91 55.46 1yl3 h ALA 117 Cb 0.58 0.78 -0.08 0.00 0.00 0.00 0.00 17.79 19.06 1yl3 h ALA 117 CO -0.64 -0.47 0.00 1.79 0.00 0.00 0.00 179.25 179.93 1yl3 h THR 118 N -0.02 0.60 -0.90 0.00 1.35 0.40 0.22 112.91 114.56 1yl3 h THR 118 Ca 0.40 -0.04 0.24 0.00 -0.55 0.00 0.00 66.41 66.46 1yl3 h THR 118 Cb 0.64 0.47 -0.15 0.00 -1.73 0.00 0.00 68.15 67.37 1yl3 h THR 118 CO -0.93 0.02 0.17 0.00 -0.25 0.00 0.00 175.52 174.54 1yl3 h ALA 119 N 1.46 1.24 0.00 6.62 0.00 0.20 -3.50 119.26 125.28 1yl3 h ALA 119 Ca 0.26 0.26 0.00 0.00 0.00 0.00 0.00 54.91 55.43 1yl3 h ALA 119 Cb 0.40 0.40 0.00 0.00 0.00 0.00 0.00 17.79 18.58 1yl3 h ALA 119 CO -0.43 -0.51 0.00 -0.25 0.00 0.00 0.00 179.25 178.06 1yl3 n ASP 120 N -5.31 0.00 0.00 0.00 8.00 0.76 -5.13 116.55 114.88 1yl3 n ASP 120 Ca 0.22 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.72 1yl3 n ASP 120 Cb 0.71 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.81 1yl3 n ASP 120 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 1yl3 n VAL 138 N 0.00 0.00 0.00 2.53 0.31 0.87 -5.14 118.33 116.90 1yl3 n VAL 138 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 1yl3 n VAL 138 Cb 0.00 1.01 0.00 0.00 -0.91 0.00 0.00 33.84 33.94 1yl3 n VAL 138 CO 0.00 0.00 0.00 0.52 -1.32 0.00 0.00 176.83 176.03 1yl3 n VAL 139 N 0.00 0.00 -2.21 2.52 0.31 -1.26 -4.37 118.33 113.32 1yl3 n VAL 139 Ca 0.00 0.00 -0.39 0.00 -0.01 0.00 0.00 64.34 63.94 1yl3 n VAL 139 Cb 0.48 0.00 -0.03 0.00 -0.91 0.00 0.00 33.84 33.38 1yl3 n VAL 139 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 1yl3 s VAL 140 N -0.89 3.48 -0.11 2.52 1.01 -0.18 -0.89 120.40 125.34 1yl3 s VAL 140 Ca 0.00 0.27 -0.30 0.00 0.00 0.00 0.00 61.98 61.95 1yl3 s VAL 140 Cb 0.00 -4.27 -0.08 0.00 0.00 0.00 0.00 36.38 32.03 1yl3 s VAL 140 CO 0.00 -1.23 2.09 -1.54 0.00 0.00 0.00 175.10 174.42 1yl3 n SER 141 N 11.62 3.57 -0.11 3.32 3.41 -1.26 -1.17 113.62 133.01 1yl3 n SER 141 Ca 0.15 0.56 -0.02 0.00 -0.26 0.00 0.00 58.87 59.30 1yl3 n SER 141 Cb 0.51 -1.51 -0.01 0.00 -0.26 0.00 0.00 64.21 62.94 1yl3 n SER 141 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1yl3 n ASP 142 N 9.48 -0.24 -0.19 4.04 9.92 -1.26 -1.08 116.55 137.22 1yl3 n ASP 142 Ca 0.26 0.47 0.08 0.00 -0.53 0.00 0.00 54.79 55.07 1yl3 n ASP 142 Cb 0.40 -0.08 0.15 0.00 -0.64 0.00 0.00 41.12 40.96 1yl3 n ASP 142 CO 0.00 0.00 0.00 0.47 0.13 0.00 0.00 177.20 177.80 1yl3 n ASP 143 N -4.36 -0.07 -0.20 -2.24 9.92 -1.26 -0.82 116.55 117.53 1yl3 n ASP 143 Ca 0.01 0.93 0.30 0.00 -0.53 0.00 0.00 54.79 55.50 1yl3 n ASP 143 Cb 0.08 -0.33 0.63 0.00 -0.64 0.00 0.00 41.12 40.86 1yl3 n ASP 143 CO 0.00 0.00 0.00 -0.26 0.13 0.00 0.00 177.20 177.07 1yl3 h PHE 144 N 0.00 0.00 0.00 1.24 -1.00 -1.46 -1.04 116.94 114.67 1yl3 h PHE 144 Ca 0.32 0.00 0.00 0.00 2.81 0.00 0.00 57.97 61.10 1yl3 h PHE 144 Cb 0.66 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.22 1yl3 h PHE 144 CO -0.29 0.00 0.05 -1.91 -1.61 0.00 0.00 178.31 174.55 1yl3 n GLU 145 N -3.62 0.00 -0.10 1.51 2.13 0.00 -2.17 120.64 118.40 1yl3 n GLU 145 Ca 0.21 0.25 -0.19 0.00 0.66 0.00 0.00 57.16 58.09 1yl3 n GLU 145 Cb 1.26 -1.55 -0.13 0.00 0.27 0.00 0.00 31.44 31.29 1yl3 n GLU 145 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 1yl3 n ASP 146 N -1.21 1.99 -4.08 4.31 9.92 -0.40 -4.82 116.55 122.26 1yl3 n ASP 146 Ca 0.00 -0.05 -0.58 0.00 -0.53 0.00 0.00 54.79 53.62 1yl3 n ASP 146 Cb 0.05 -0.50 -0.09 0.00 -0.64 0.00 0.00 41.12 39.94 1yl3 n ASP 146 CO 0.00 0.00 0.00 0.18 0.13 0.00 0.00 177.20 177.51 1yl3 n LEU 147 N -3.31 1.00 -1.39 0.64 4.77 -0.92 -4.88 117.00 112.91 1yl3 n LEU 147 Ca -0.42 0.98 0.09 0.00 -0.03 0.00 0.00 56.01 56.62 1yl3 n LEU 147 Cb 1.01 -0.77 0.31 0.00 -2.33 0.00 0.00 43.42 41.64 1yl3 n LEU 147 CO 0.30 -0.72 0.76 0.52 -1.33 0.00 0.00 177.39 176.92 1yl3 n VAL 148 N 3.80 1.40 -3.75 4.08 0.31 -1.26 -4.74 118.33 118.17 1yl3 n VAL 148 Ca 0.30 -1.00 -0.13 0.00 -0.01 0.00 0.00 64.34 63.50 1yl3 n VAL 148 Cb -0.05 0.19 -0.13 0.00 -0.91 0.00 0.00 33.84 32.94 1yl3 n VAL 148 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 1yl3 s LYS 149 N -1.60 0.17 0.52 5.55 1.02 -1.26 -4.79 119.74 119.34 1yl3 s LYS 149 Ca 0.45 0.44 0.27 0.00 0.02 0.00 0.00 55.97 57.15 1yl3 s LYS 149 Cb 0.27 -0.11 1.39 0.00 -0.52 0.00 0.00 37.83 38.86 1yl3 s LYS 149 CO 0.25 -0.15 1.95 1.79 -0.92 0.00 0.00 175.35 178.27 1yl3 h THR 150 N 5.80 0.67 -0.20 2.17 1.35 -1.93 1.74 112.91 122.52 1yl3 h THR 150 Ca -0.39 -0.02 -0.11 0.00 -0.55 0.00 0.00 66.41 65.34 1yl3 h THR 150 Cb 1.16 0.62 -0.01 0.00 -1.73 0.00 0.00 68.15 68.18 1yl3 h THR 150 CO 0.39 0.01 -0.34 1.56 -0.25 0.00 0.00 175.52 176.89 1yl3 h GLN 151 N 0.05 0.41 -0.98 4.72 1.08 -1.98 -0.06 115.11 118.35 1yl3 h GLN 151 Ca 0.33 -0.18 0.08 0.00 -1.45 0.00 0.00 58.65 57.43 1yl3 h GLN 151 Cb 1.27 -0.01 -0.07 0.00 -0.05 0.00 0.00 27.48 28.62 1yl3 h GLN 151 CO -0.02 0.71 0.63 0.93 -0.95 0.00 0.00 178.83 180.13 1yl3 h GLU 152 N 0.35 1.06 0.32 1.46 5.08 0.22 0.24 114.58 123.31 1yl3 h GLU 152 Ca 0.04 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.33 1yl3 h GLU 152 Cb 0.78 -0.24 -0.02 0.00 0.50 0.00 0.00 28.75 29.76 1yl3 h GLU 152 CO 0.06 0.70 -0.39 0.28 -1.00 0.00 0.00 179.01 178.67 1yl3 h VAL 153 N 1.10 0.00 -0.37 3.13 2.07 0.43 0.16 116.25 122.76 1yl3 h VAL 153 Ca 0.44 0.00 0.05 0.00 0.82 0.00 0.00 66.70 68.01 1yl3 h VAL 153 Cb 0.26 0.00 -0.06 0.00 -1.52 0.00 0.00 31.29 29.97 1yl3 h VAL 153 CO -0.19 0.00 -0.17 0.52 0.02 0.00 0.00 177.57 177.75 1yl3 n VAL 154 N -4.73 -0.22 0.00 2.57 0.31 0.67 -0.79 118.33 116.14 1yl3 n VAL 154 Ca -0.09 0.89 0.00 0.00 -0.01 0.00 0.00 64.34 65.13 1yl3 n VAL 154 Cb 0.34 -1.15 0.00 0.00 -0.91 0.00 0.00 33.84 32.12 1yl3 n VAL 154 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1yl3 n SER 155 N -4.53 0.00 -0.48 4.52 2.88 0.43 -1.00 113.62 115.45 1yl3 n SER 155 Ca 0.03 0.66 0.40 0.00 -1.33 0.00 0.00 58.87 58.62 1yl3 n SER 155 Cb 0.13 -0.16 0.68 0.00 -0.75 0.00 0.00 64.21 64.12 1yl3 n SER 155 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 1yl3 h LEU 156 N 0.00 0.19 0.48 2.46 3.38 0.28 1.44 115.31 123.55 1yl3 h LEU 156 Ca 0.00 0.11 -0.02 0.00 0.09 0.00 0.00 57.88 58.07 1yl3 h LEU 156 Cb 0.00 0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.84 1yl3 h LEU 156 CO 0.00 -0.15 -0.44 -0.07 0.09 0.00 0.00 178.44 177.86 1yl3 h LEU 157 N 0.06 -1.20 -1.01 1.67 3.38 -0.30 0.56 115.31 118.48 1yl3 h LEU 157 Ca 0.83 0.09 0.34 0.00 0.09 0.00 0.00 57.88 59.23 1yl3 h LEU 157 Cb 2.76 0.39 -0.15 0.00 0.09 0.00 0.00 40.66 43.75 1yl3 h LEU 157 CO -0.35 -0.60 0.57 -0.33 0.09 0.00 0.00 178.44 177.83 1yl3 h GLU 158 N -0.91 0.27 -0.75 1.13 3.07 0.37 0.48 114.58 118.23 1yl3 h GLU 158 Ca -0.06 -0.02 0.12 0.00 -0.50 0.00 0.00 59.36 58.90 1yl3 h GLU 158 Cb 0.78 -0.06 -0.08 0.00 -0.84 0.00 0.00 28.75 28.54 1yl3 h GLU 158 CO -0.03 0.18 0.36 0.00 -1.40 0.00 0.00 179.01 178.11 1yl3 h ALA 159 N 1.87 1.07 0.00 3.43 0.00 0.18 -3.36 119.26 122.45 1yl3 h ALA 159 Ca 0.75 0.08 -0.06 0.00 0.00 0.00 0.00 54.91 55.69 1yl3 h ALA 159 Cb 1.77 -0.00 -0.12 0.00 0.00 0.00 0.00 17.79 19.44 1yl3 h ALA 159 CO -0.63 -0.10 -0.66 1.28 0.00 0.00 0.00 179.25 179.14 1yl3 n LEU 160 N -4.90 0.37 -2.34 0.00 4.77 0.15 -5.05 117.00 109.99 1yl3 n LEU 160 Ca 0.13 -1.36 -0.21 0.00 -0.03 0.00 0.00 56.01 54.54 1yl3 n LEU 160 Cb 0.35 -0.01 0.02 0.00 -2.33 0.00 0.00 43.42 41.44 1yl3 n LEU 160 CO 0.22 0.34 -0.66 0.47 -1.33 0.00 0.00 177.39 176.44 1yl3 n ASP 161 N 0.12 -3.09 0.00 -1.43 8.00 -0.13 -4.90 116.55 115.13 1yl3 n ASP 161 Ca 0.02 0.18 0.00 0.00 0.71 0.00 0.00 54.79 55.70 1yl3 n ASP 161 Cb 0.84 -0.45 0.00 0.00 -0.02 0.00 0.00 41.12 41.49 1yl3 n ASP 161 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 1yl3 n VAL 162 N -1.27 0.00 0.01 2.53 0.31 -1.26 -4.87 118.33 113.78 1yl3 n VAL 162 Ca 0.00 0.00 -0.14 0.00 -0.01 0.00 0.00 64.34 64.19 1yl3 n VAL 162 Cb 0.31 0.00 -0.03 0.00 -0.91 0.00 0.00 33.84 33.21 1yl3 n VAL 162 CO 0.00 0.00 0.00 0.45 -1.32 0.00 0.00 176.83 175.96 1yl3 h HIS 163 N 0.00 0.84 -0.90 3.52 -0.00 -1.98 -0.41 115.15 116.22 1yl3 h HIS 163 Ca 0.00 -0.38 0.11 0.00 -0.00 0.00 0.00 60.37 60.10 1yl3 h HIS 163 Cb 0.00 -0.13 -0.08 0.00 -0.00 0.00 0.00 27.41 27.20 1yl3 h HIS 163 CO 0.00 1.18 0.54 0.00 -0.00 0.00 0.00 177.93 179.65 1yl3 h ALA 164 N 0.71 1.33 0.03 2.45 0.00 -1.98 0.53 119.26 122.33 1yl3 h ALA 164 Ca -0.05 0.03 0.03 0.00 0.00 0.00 0.00 54.91 54.92 1yl3 h ALA 164 Cb 1.39 -0.15 -0.05 0.00 0.00 0.00 0.00 17.79 18.98 1yl3 h ALA 164 CO 0.15 0.14 -0.38 -0.44 0.00 0.00 0.00 179.25 178.71 1yl3 h ASP 165 N 0.86 -1.14 -0.74 0.00 5.19 -1.64 0.73 116.42 119.67 1yl3 h ASP 165 Ca 0.45 0.14 0.12 0.00 -0.62 0.00 0.00 57.03 57.11 1yl3 h ASP 165 Cb 0.45 0.45 -0.12 0.00 0.18 0.00 0.00 39.33 40.28 1yl3 h ASP 165 CO -0.27 -0.44 -0.29 -0.38 -3.12 0.00 0.00 179.24 174.75 1yl3 n ILE 166 N -5.44 -0.39 -0.11 0.35 5.41 0.17 0.35 119.36 119.69 1yl3 n ILE 166 Ca -0.06 1.74 -0.03 0.00 1.00 0.00 0.00 62.75 65.40 1yl3 n ILE 166 Cb 0.36 -2.30 -0.03 0.00 -0.71 0.00 0.00 39.64 36.95 1yl3 n ILE 166 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 176.55 176.99 1yl3 h ASP 167 N 0.00 -0.62 -5.83 4.38 5.19 0.19 -3.47 116.42 116.26 1yl3 h ASP 167 Ca 0.26 0.09 0.00 0.00 -0.62 0.00 0.00 57.03 56.76 1yl3 h ASP 167 Cb 0.45 0.27 -0.02 0.00 0.18 0.00 0.00 39.33 40.20 1yl3 h ASP 167 CO -0.74 -0.07 -0.81 -2.11 -3.12 0.00 0.00 179.24 172.38 1yl3 n ARG 168 N -3.63 -1.99 -4.38 3.56 -4.01 1.06 -4.59 116.66 102.68 1yl3 n ARG 168 Ca 0.00 1.79 -0.33 0.00 -1.04 0.00 0.00 57.85 58.27 1yl3 n ARG 168 Cb 0.08 -2.52 -0.16 0.00 -3.04 0.00 0.00 32.46 26.82 1yl3 n ARG 168 CO 0.00 0.00 0.00 -0.51 -3.04 0.00 0.00 177.63 174.08 1yl3 s LEU 193 N -0.77 2.35 -0.49 2.89 1.43 -0.22 -4.91 118.68 118.97 1yl3 s LEU 193 Ca -0.05 -0.54 -0.28 0.00 -1.03 0.00 0.00 54.13 52.23 1yl3 s LEU 193 Cb 0.00 -1.53 0.01 0.00 0.03 0.00 0.00 46.19 44.70 1yl3 s LEU 193 CO 0.30 0.05 1.41 -0.36 0.23 0.00 0.00 176.35 177.98 1yl3 s PHE 194 N 1.01 2.35 -0.13 0.29 2.99 -1.26 -1.26 117.98 121.96 1yl3 s PHE 194 Ca -0.02 0.58 -0.00 0.00 0.00 0.00 0.00 56.93 57.49 1yl3 s PHE 194 Cb -0.15 -4.35 0.03 0.00 0.00 0.00 0.00 43.02 38.55 1yl3 s PHE 194 CO -0.04 -1.95 -0.09 0.08 -0.00 0.00 0.00 175.22 173.21 1yl3 s VAL 195 N 5.77 1.21 0.33 -0.44 1.01 0.05 -1.00 120.40 127.32 1yl3 s VAL 195 Ca 0.56 -0.45 0.04 0.00 0.00 0.00 0.00 61.98 62.14 1yl3 s VAL 195 Cb -0.12 -1.22 0.04 0.00 0.00 0.00 0.00 36.38 35.09 1yl3 s VAL 195 CO 0.29 0.36 0.34 0.41 0.00 0.00 0.00 175.10 176.50 1yl3 n THR 196 N 4.88 0.00 -3.11 3.92 -1.04 -0.46 -0.36 114.28 118.11 1yl3 n THR 196 Ca -0.14 -1.22 -0.21 0.00 -2.04 0.00 0.00 64.05 60.44 1yl3 n THR 196 Cb 0.50 -0.44 -0.03 0.00 -1.82 0.00 0.00 70.33 68.53 1yl3 n THR 196 CO 0.00 0.00 0.00 -1.54 -0.64 0.00 0.00 175.07 172.89 1yl3 n SER 197 N -2.21 2.08 0.00 8.00 3.41 -1.26 -0.98 113.62 122.66 1yl3 n SER 197 Ca 0.04 -3.24 0.00 0.00 -0.26 0.00 0.00 58.87 55.40 1yl3 n SER 197 Cb 0.36 -0.60 0.00 0.00 -0.26 0.00 0.00 64.21 63.71 1yl3 n SER 197 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 1yl3 n ASP 198 N 0.10 0.00 0.00 4.04 -0.08 -1.26 -4.34 116.55 115.00 1yl3 n ASP 198 Ca 0.27 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.55 1yl3 n ASP 198 Cb 0.57 0.00 0.00 0.00 2.34 0.00 0.00 41.12 44.03 1yl3 n ASP 198 CO 0.00 0.00 0.00 1.21 0.12 0.00 0.00 177.20 178.53 1yl3 n GLU 199 N 0.00 0.00 0.00 -0.67 2.13 -1.26 -5.04 120.64 115.80 1yl3 n GLU 199 Ca 0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 1yl3 n GLU 199 Cb 0.00 0.00 0.00 0.00 0.27 0.00 0.00 31.44 31.71 1yl3 n GLU 199 CO 0.00 0.00 0.00 -2.30 -0.41 0.00 0.00 177.13 174.42 1yl3 n PRO 200 N 0.00 0.00 -1.72 5.31 -0.02 -1.26 -4.77 135.00 132.54 1yl3 n PRO 200 Ca 0.00 0.00 -0.33 0.00 -2.02 0.00 0.00 63.50 61.15 1yl3 n PRO 200 Cb 0.00 0.00 -0.03 0.00 -0.02 0.00 0.00 33.50 33.45 1yl3 n PRO 200 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 1yl3 n SER 201 N 0.00 7.25 0.00 2.55 7.64 -1.26 -4.95 113.62 124.85 1yl3 n SER 201 Ca 0.00 -3.14 0.00 0.00 1.01 0.00 0.00 58.87 56.74 1yl3 n SER 201 Cb 0.00 -1.31 0.00 0.00 -1.01 0.00 0.00 64.21 61.89 1yl3 n SER 201 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 1yl3 n THR 202 N 1.39 0.00 0.00 0.44 -1.04 -1.26 -1.04 114.28 112.77 1yl3 n THR 202 Ca 0.56 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.57 1yl3 n THR 202 Cb 0.41 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.92 1yl3 n THR 202 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1yl3 n ALA 203 N 0.00 0.00 -0.32 2.41 0.00 -1.26 -0.60 120.51 120.74 1yl3 n ALA 203 Ca 0.00 0.00 0.21 0.00 0.00 0.00 0.00 53.44 53.65 1yl3 n ALA 203 Cb 0.00 0.00 0.41 0.00 0.00 0.00 0.00 19.45 19.86 1yl3 n ALA 203 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1yl3 h ALA 204 N 0.00 1.63 0.00 0.00 0.00 -1.40 -1.08 119.26 118.41 1yl3 h ALA 204 Ca 0.00 0.27 0.00 0.00 0.00 0.00 0.00 54.91 55.18 1yl3 h ALA 204 Cb 0.00 0.39 0.00 0.00 0.00 0.00 0.00 17.79 18.18 1yl3 h ALA 204 CO 0.00 -0.67 0.29 0.54 0.00 0.00 0.00 179.25 179.41 1yl3 n ARG 205 N -5.30 0.07 -3.67 0.00 1.74 0.23 -4.35 116.66 105.39 1yl3 n ARG 205 Ca 0.29 0.51 -0.25 0.00 -0.77 0.00 0.00 57.85 57.63 1yl3 n ARG 205 Cb 0.95 -2.02 -0.17 0.00 -1.02 0.00 0.00 32.46 30.19 1yl3 n ARG 205 CO 0.00 0.00 0.00 -0.80 -1.52 0.00 0.00 177.63 175.31 1yl3 s ASN 206 N -3.23 2.12 0.19 0.55 0.01 -0.41 -2.97 114.94 111.20 1yl3 s ASN 206 Ca -0.01 -0.45 -0.22 0.00 -0.71 0.00 0.00 52.86 51.46 1yl3 s ASN 206 Cb 0.03 -0.31 0.07 0.00 0.41 0.00 0.00 41.25 41.45 1yl3 s ASN 206 CO 0.09 -0.30 1.00 -0.76 -1.51 0.00 0.00 177.10 175.62 1yl3 s LEU 207 N 2.07 -0.04 0.00 0.60 1.43 -1.26 -4.89 118.68 116.58 1yl3 s LEU 207 Ca 0.02 -0.64 -0.00 0.00 -1.03 0.00 0.00 54.13 52.48 1yl3 s LEU 207 Cb -0.15 2.16 -0.01 0.00 0.03 0.00 0.00 46.19 48.22 1yl3 s LEU 207 CO -0.07 -1.02 0.48 0.00 0.23 0.00 0.00 176.35 175.97 1yl3 n ALA 208 N -0.62 1.30 0.00 4.21 0.00 -1.26 -0.49 120.51 123.65 1yl3 n ALA 208 Ca -0.04 -0.05 0.00 0.00 0.00 0.00 0.00 53.44 53.35 1yl3 n ALA 208 Cb 0.60 -2.18 0.00 0.00 0.00 0.00 0.00 19.45 17.87 1yl3 n ALA 208 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1yl3 n GLY 209 N 2.73 0.00 2.11 0.00 0.00 -1.26 -5.11 105.19 103.66 1yl3 n GLY 209 Ca 0.01 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.78 1yl3 n GLY 209 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yl3 n ALA 210 N 0.00 -4.32 0.00 4.61 0.00 0.36 -4.77 120.51 116.39 1yl3 n ALA 210 Ca 0.00 -0.42 0.00 0.00 0.00 0.00 0.00 53.44 53.02 1yl3 n ALA 210 Cb 0.00 -0.82 0.00 0.00 0.00 0.00 0.00 19.45 18.63 1yl3 n ALA 210 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1yl3 n ASP 211 N 2.33 0.00 -3.07 0.00 5.75 -1.16 -4.93 116.55 115.47 1yl3 n ASP 211 Ca -0.00 0.00 0.03 0.00 -0.01 0.00 0.00 54.79 54.80 1yl3 n ASP 211 Cb 0.38 0.00 -0.00 0.00 -1.03 0.00 0.00 41.12 40.47 1yl3 n ASP 211 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 1yl3 s VAL 212 N -2.00 -0.67 0.91 2.12 1.01 -1.22 -4.29 120.40 116.27 1yl3 s VAL 212 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 61.98 61.84 1yl3 s VAL 212 Cb 0.00 -0.26 0.17 0.00 0.00 0.00 0.00 36.38 36.29 1yl3 s VAL 212 CO 0.00 0.00 1.26 0.00 0.00 0.00 0.00 175.10 176.36 1yl3 s ALA 213 N 2.29 2.45 -0.01 5.51 0.00 -0.17 -4.82 121.76 127.00 1yl3 s ALA 213 Ca 0.16 -1.14 0.01 0.00 0.00 0.00 0.00 51.96 50.99 1yl3 s ALA 213 Cb -0.03 -2.74 0.00 0.00 0.00 0.00 0.00 23.12 20.35 1yl3 s ALA 213 CO -0.16 -2.20 -0.02 0.95 0.00 0.00 0.00 175.76 174.34 1yl3 s THR 214 N -3.76 0.15 0.00 0.00 -4.23 -1.21 -1.35 115.64 105.24 1yl3 s THR 214 Ca 0.71 -0.05 0.00 0.00 -1.18 0.00 0.00 61.69 61.17 1yl3 s THR 214 Cb -0.05 -0.16 0.00 0.00 1.34 0.00 0.00 72.50 73.63 1yl3 s THR 214 CO 0.51 0.06 0.00 0.00 -0.54 0.00 0.00 174.62 174.66 1yl3 n ALA 215 N 3.24 0.00 -3.67 3.99 0.00 -0.15 -2.57 120.51 121.35 1yl3 n ALA 215 Ca -0.15 0.00 -0.15 0.00 0.00 0.00 0.00 53.44 53.14 1yl3 n ALA 215 Cb 0.58 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 19.88 1yl3 n ALA 215 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1yl3 s SER 216 N -1.43 0.56 0.00 0.00 1.04 -1.26 -1.27 113.70 111.34 1yl3 s SER 216 Ca 0.00 0.44 0.00 0.00 0.48 0.00 0.00 55.95 56.87 1yl3 s SER 216 Cb 0.00 0.44 0.00 0.00 0.10 0.00 0.00 66.02 66.56 1yl3 s SER 216 CO 0.00 -0.24 0.00 -0.62 0.98 0.00 0.00 173.24 173.36 1yl3 n GLU 217 N 5.28 0.00 -3.56 4.02 1.02 -1.06 -5.01 120.64 121.34 1yl3 n GLU 217 Ca -0.06 0.14 -0.10 0.00 -0.02 0.00 0.00 57.16 57.12 1yl3 n GLU 217 Cb 0.50 -0.42 -0.04 0.00 -0.02 0.00 0.00 31.44 31.46 1yl3 n GLU 217 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1yl3 s VAL 218 N -1.16 0.00 0.22 2.62 1.01 -1.26 -3.32 120.40 118.51 1yl3 s VAL 218 Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 61.98 61.81 1yl3 s VAL 218 Cb 0.00 -1.00 0.06 0.00 0.00 0.00 0.00 36.38 35.44 1yl3 s VAL 218 CO 0.00 0.00 0.86 0.59 0.00 0.00 0.00 175.10 176.55 1yl3 n ASN 219 N 0.50 -1.69 -0.25 3.32 3.02 -1.26 -4.94 115.26 113.96 1yl3 n ASN 219 Ca -0.10 -1.98 -0.11 0.00 -0.03 0.00 0.00 54.58 52.36 1yl3 n ASN 219 Cb 0.59 2.76 -0.07 0.00 -0.61 0.00 0.00 39.78 42.45 1yl3 n ASN 219 CO 0.00 0.00 0.00 0.71 -2.62 0.00 0.00 177.26 175.35 1yl3 h THR 220 N 1.88 0.02 -0.63 3.41 1.35 -1.90 1.75 112.91 118.79 1yl3 h THR 220 Ca -0.26 0.00 0.06 0.00 -0.55 0.00 0.00 66.41 65.66 1yl3 h THR 220 Cb 1.07 0.02 -0.08 0.00 -1.73 0.00 0.00 68.15 67.44 1yl3 h THR 220 CO 0.34 0.00 -0.37 -0.62 -0.25 0.00 0.00 175.52 174.62 1yl3 n GLU 221 N -5.35 -0.28 0.00 4.72 1.02 -1.26 0.64 120.64 120.12 1yl3 n GLU 221 Ca 0.00 0.98 0.00 0.00 -0.02 0.00 0.00 57.16 58.13 1yl3 n GLU 221 Cb 0.32 -1.45 0.00 0.00 -0.02 0.00 0.00 31.44 30.30 1yl3 n GLU 221 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 1yl3 n ASP 222 N -4.73 0.00 0.00 1.62 9.92 0.58 -4.52 116.55 119.41 1yl3 n ASP 222 Ca 0.01 0.58 0.00 0.00 -0.53 0.00 0.00 54.79 54.85 1yl3 n ASP 222 Cb 0.16 -0.14 0.00 0.00 -0.64 0.00 0.00 41.12 40.51 1yl3 n ASP 222 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1yl3 n LEU 223 N -1.54 0.10 -0.31 0.64 -0.00 0.21 -4.64 117.00 111.45 1yl3 n LEU 223 Ca 0.00 -0.12 0.16 0.00 -0.00 0.00 0.00 56.01 56.05 1yl3 n LEU 223 Cb 0.00 0.00 0.34 0.00 -0.00 0.00 0.00 43.42 43.76 1yl3 n LEU 223 CO 0.00 0.03 1.04 0.00 -0.00 0.00 0.00 177.39 178.46 1yl3 h ALA 224 N 0.00 1.53 -1.22 1.47 0.00 -0.88 -3.35 119.26 116.81 1yl3 h ALA 224 Ca 0.00 0.18 -0.79 0.00 0.00 0.00 0.00 54.91 54.30 1yl3 h ALA 224 Cb 0.33 0.18 0.03 0.00 0.00 0.00 0.00 17.79 18.33 1yl3 h ALA 224 CO 0.00 -0.41 0.50 -0.35 0.00 0.00 0.00 179.25 178.98 1yl3 n PRO 225 N -5.08 0.41 -0.33 0.00 -0.04 -1.23 -4.30 135.00 124.44 1yl3 n PRO 225 Ca 0.24 0.15 -0.08 0.00 -0.04 0.00 0.00 63.50 63.77 1yl3 n PRO 225 Cb 0.74 -1.71 -0.04 0.00 -0.04 0.00 0.00 33.50 32.45 1yl3 n PRO 225 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1yl3 n GLY 230 N 3.02 -0.11 0.00 0.55 0.00 -1.26 -4.76 105.19 102.63 1yl3 n GLY 230 Ca 0.25 0.21 0.00 0.00 0.00 0.00 0.00 46.02 46.48 1yl3 n GLY 230 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1yl3 n ARG 231 N 1.77 0.00 -3.65 1.61 1.74 -1.26 -5.04 116.66 111.83 1yl3 n ARG 231 Ca 0.15 0.00 -0.15 0.00 -0.77 0.00 0.00 57.85 57.07 1yl3 n ARG 231 Cb 0.01 0.00 -0.08 0.00 -1.02 0.00 0.00 32.46 31.38 1yl3 n ARG 231 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1yl3 s LEU 232 N 0.00 0.10 0.00 0.55 1.43 -1.26 -4.97 118.68 114.54 1yl3 s LEU 232 Ca 0.00 0.47 -0.00 0.00 -1.03 0.00 0.00 54.13 53.57 1yl3 s LEU 232 Cb 0.00 1.88 0.00 0.00 0.03 0.00 0.00 46.19 48.10 1yl3 s LEU 232 CO 0.00 -0.49 0.00 0.35 0.23 0.00 0.00 176.35 176.45 1yl3 n THR 233 N 1.29 0.00 -3.61 5.49 -2.24 -1.26 -1.05 114.28 112.90 1yl3 n THR 233 Ca -0.20 -0.01 -0.27 0.00 -2.27 0.00 0.00 64.05 61.31 1yl3 n THR 233 Cb 0.56 0.01 -0.17 0.00 -2.10 0.00 0.00 70.33 68.63 1yl3 n THR 233 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 1yl3 s VAL 234 N -2.95 -0.04 -0.10 2.28 -7.23 -0.39 -0.09 120.40 111.88 1yl3 s VAL 234 Ca 0.00 -0.30 -0.02 0.00 -1.81 0.00 0.00 61.98 59.86 1yl3 s VAL 234 Cb -0.00 -0.68 -0.03 0.00 0.56 0.00 0.00 36.38 36.23 1yl3 s VAL 234 CO 0.00 -0.36 -0.03 -0.36 -0.31 0.00 0.00 175.10 174.05 1yl3 s PHE 235 N 2.11 3.06 0.51 2.82 0.40 -1.26 -0.77 117.98 124.85 1yl3 s PHE 235 Ca 0.03 0.03 -0.21 0.00 -0.60 0.00 0.00 56.93 56.18 1yl3 s PHE 235 Cb -0.16 -1.81 -0.07 0.00 0.51 0.00 0.00 43.02 41.49 1yl3 s PHE 235 CO -0.14 0.31 1.12 0.95 0.70 0.00 0.00 175.22 178.16 1yl3 s THR 236 N -0.56 3.27 0.24 0.64 -4.23 0.51 -1.01 115.64 114.51 1yl3 s THR 236 Ca 0.09 0.84 -0.12 0.00 -1.18 0.00 0.00 61.69 61.32 1yl3 s THR 236 Cb -0.12 -3.36 0.33 0.00 1.34 0.00 0.00 72.50 70.69 1yl3 s THR 236 CO 0.02 -0.13 1.59 -0.33 -0.54 0.00 0.00 174.62 175.23 1yl3 h GLU 237 N 1.50 -0.01 0.00 3.99 5.08 -1.49 1.78 114.58 125.43 1yl3 h GLU 237 Ca -0.50 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.86 1yl3 h GLU 237 Cb 1.25 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.50 1yl3 h GLU 237 CO 0.58 -0.01 0.00 0.77 -1.00 0.00 0.00 179.01 179.35 1yl3 h SER 238 N -0.01 0.00 -0.19 1.42 0.02 -1.91 5.30 113.55 118.19 1yl3 h SER 238 Ca 0.38 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 61.32 1yl3 h SER 238 Cb 0.60 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.13 1yl3 h SER 238 CO -0.84 0.00 0.06 0.00 -1.14 0.00 0.00 176.83 174.91 1yl3 h ALA 239 N 2.03 0.24 -0.30 3.77 0.00 0.25 3.87 119.26 129.12 1yl3 h ALA 239 Ca 0.00 -0.12 0.09 0.00 0.00 0.00 0.00 54.91 54.88 1yl3 h ALA 239 Cb 0.08 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1yl3 h ALA 239 CO 0.00 -0.15 0.52 -0.07 0.00 0.00 0.00 179.25 179.55 1yl3 h LEU 240 N 0.13 0.00 -1.12 0.00 3.38 1.19 10.24 115.31 129.13 1yl3 h LEU 240 Ca 0.06 0.00 0.08 0.00 0.09 0.00 0.00 57.88 58.11 1yl3 h LEU 240 Cb 0.21 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 40.89 1yl3 h LEU 240 CO -0.00 0.00 0.60 0.00 0.09 0.00 0.00 178.44 179.13 1yl3 h ALA 241 N 1.25 1.52 -0.70 1.53 0.00 0.93 3.12 119.26 126.92 1yl3 h ALA 241 Ca 0.14 -0.01 0.15 0.00 0.00 0.00 0.00 54.91 55.19 1yl3 h ALA 241 Cb 1.17 -0.26 -0.12 0.00 0.00 0.00 0.00 17.79 18.58 1yl3 h ALA 241 CO -0.00 0.32 -0.06 0.93 0.00 0.00 0.00 179.25 180.44 1yl3 h GLU 242 N 1.03 0.06 -0.88 0.00 5.08 2.39 2.23 114.58 124.49 1yl3 h GLU 242 Ca 0.42 -0.00 0.08 0.00 -1.00 0.00 0.00 59.36 58.85 1yl3 h GLU 242 Cb 0.27 -0.01 -0.11 0.00 0.50 0.00 0.00 28.75 29.40 1yl3 h GLU 242 CO -0.17 0.04 -0.52 0.28 -1.00 0.00 0.00 179.01 177.64 1yl3 n VAL 243 N -5.37 -0.60 -0.33 3.13 0.31 1.03 0.17 118.33 116.66 1yl3 n VAL 243 Ca 0.11 2.17 -0.09 0.00 -0.01 0.00 0.00 64.34 66.52 1yl3 n VAL 243 Cb 0.40 -2.69 -0.08 0.00 -0.91 0.00 0.00 33.84 30.57 1yl3 n VAL 243 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1yl3 n ALA 244 N -3.30 -0.50 -0.36 3.52 0.00 0.74 0.30 120.51 120.90 1yl3 n ALA 244 Ca 0.02 0.67 0.04 0.00 0.00 0.00 0.00 53.44 54.17 1yl3 n ALA 244 Cb 0.23 -0.07 0.11 0.00 0.00 0.00 0.00 19.45 19.72 1yl3 n ALA 244 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1yl3 h GLU 245 N 0.00 -0.00 0.00 0.00 3.07 0.34 -3.51 114.58 114.48 1yl3 h GLU 245 Ca 0.13 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.99 1yl3 h GLU 245 Cb 0.32 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.23 1yl3 h GLU 245 CO -0.74 -0.00 0.00 0.54 -1.40 0.00 0.00 179.01 177.41