#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yl3 n SER 15 N 0.00 0.25 0.15 4.04 7.64 -1.26 0.23 113.62 124.67 1yl3 n SER 15 Ca 0.00 1.23 -0.06 0.00 1.01 0.00 0.00 58.87 61.04 1yl3 n SER 15 Cb 0.00 -0.59 -0.03 0.00 -1.01 0.00 0.00 64.21 62.57 1yl3 n SER 15 CO 0.00 0.00 0.00 0.45 -3.01 0.00 0.00 175.04 172.48 1yl3 h HIS 16 N 0.00 -0.38 -0.74 1.43 3.86 -2.05 -0.44 115.15 116.84 1yl3 h HIS 16 Ca 0.62 -0.01 0.12 0.00 -1.16 0.00 0.00 60.37 59.94 1yl3 h HIS 16 Cb 1.65 0.13 -0.12 0.00 1.06 0.00 0.00 27.41 30.12 1yl3 h HIS 16 CO -0.01 -0.24 -0.28 0.54 0.86 0.00 0.00 177.93 178.80 1yl3 n ARG 17 N -3.91 -0.17 0.00 2.45 5.12 0.63 0.74 116.66 121.52 1yl3 n ARG 17 Ca -0.05 1.14 0.00 0.00 -1.93 0.00 0.00 57.85 57.01 1yl3 n ARG 17 Cb 0.16 -1.69 0.00 0.00 -1.16 0.00 0.00 32.46 29.77 1yl3 n ARG 17 CO 0.00 0.00 0.00 -0.11 -1.93 0.00 0.00 177.63 175.59 1yl3 n LEU 18 N -5.10 0.00 0.00 0.55 -0.00 -0.39 -1.44 117.00 110.63 1yl3 n LEU 18 Ca 0.08 0.88 0.00 0.00 -0.00 0.00 0.00 56.01 56.97 1yl3 n LEU 18 Cb 0.30 -0.38 0.00 0.00 -0.00 0.00 0.00 43.42 43.34 1yl3 n LEU 18 CO -0.10 -0.38 0.00 0.00 -0.00 0.00 0.00 177.39 176.91 1yl3 n ALA 19 N -1.80 0.00 0.21 1.96 0.00 0.23 0.13 120.51 121.24 1yl3 n ALA 19 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.36 1yl3 n ALA 19 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.41 1yl3 n ALA 19 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1yl3 h LEU 20 N 0.00 -0.48 -1.67 0.00 7.12 -0.92 -0.84 115.31 118.52 1yl3 h LEU 20 Ca 0.00 0.02 0.53 0.00 0.13 0.00 0.00 57.88 58.56 1yl3 h LEU 20 Cb 0.00 0.13 -0.11 0.00 -0.53 0.00 0.00 40.66 40.14 1yl3 h LEU 20 CO 0.00 -0.33 1.15 1.88 -0.13 0.00 0.00 178.44 181.00 1yl3 h TYR 21 N -0.55 0.27 0.00 1.25 0.99 0.23 -0.83 116.97 118.33 1yl3 h TYR 21 Ca -0.05 0.01 0.00 0.00 2.00 0.00 0.00 58.73 60.69 1yl3 h TYR 21 Cb 0.42 -0.06 0.00 0.00 1.00 0.00 0.00 36.73 38.09 1yl3 h TYR 21 CO 0.12 -0.16 0.00 -2.13 -0.00 0.00 0.00 178.16 175.99 1yl3 n ARG 22 N -4.36 0.00 -0.35 4.88 0.63 0.17 -0.90 116.66 116.73 1yl3 n ARG 22 Ca 0.43 0.00 0.11 0.00 -0.92 0.00 0.00 57.85 57.47 1yl3 n ARG 22 Cb 1.79 -0.60 0.23 0.00 0.45 0.00 0.00 32.46 34.33 1yl3 n ARG 22 CO 0.00 0.00 0.00 -2.95 -2.51 0.00 0.00 177.63 172.17 1yl3 h ASN 23 N 0.00 -0.68 0.00 6.15 -1.07 -0.62 -0.10 115.58 119.25 1yl3 h ASN 23 Ca 0.00 0.29 0.00 0.00 0.07 0.00 0.00 56.30 56.66 1yl3 h ASN 23 Cb 0.00 0.55 0.00 0.00 -2.07 0.00 0.00 38.32 36.80 1yl3 h ASN 23 CO 0.00 -0.35 0.00 0.00 0.07 0.00 0.00 177.43 177.15 1yl3 n GLN 24 N -5.56 0.00 -0.19 4.14 6.02 -0.37 -1.11 117.38 120.31 1yl3 n GLN 24 Ca 0.20 0.43 0.04 0.00 -0.01 0.00 0.00 57.00 57.67 1yl3 n GLN 24 Cb 0.65 -1.42 0.09 0.00 1.02 0.00 0.00 30.24 30.58 1yl3 n GLN 24 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1yl3 n ALA 25 N -1.80 0.16 -0.21 -1.58 0.00 -0.08 -0.90 120.51 116.10 1yl3 n ALA 25 Ca 0.00 0.60 0.00 0.00 0.00 0.00 0.00 53.44 54.04 1yl3 n ALA 25 Cb 0.00 -0.37 0.00 0.00 0.00 0.00 0.00 19.45 19.08 1yl3 n ALA 25 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1yl3 n LYS 26 N -4.85 0.00 -0.28 0.00 5.02 -0.34 -0.96 118.16 116.76 1yl3 n LYS 26 Ca 0.09 0.51 0.10 0.00 -2.02 0.00 0.00 58.31 57.00 1yl3 n LYS 26 Cb 0.30 -1.39 0.25 0.00 -0.02 0.00 0.00 35.03 34.16 1yl3 n LYS 26 CO 0.00 0.00 0.00 0.77 -0.52 0.00 0.00 177.40 177.65 1yl3 h SER 27 N 0.00 0.07 -0.00 4.39 0.02 0.32 -0.80 113.55 117.54 1yl3 h SER 27 Ca 0.00 0.17 0.00 0.00 -0.84 0.00 0.00 61.79 61.12 1yl3 h SER 27 Cb 0.00 0.22 -0.00 0.00 0.14 0.00 0.00 62.40 62.75 1yl3 h SER 27 CO 0.00 -0.08 -0.00 0.25 -1.14 0.00 0.00 176.83 175.86 1yl3 h LEU 28 N 0.27 -0.01 -0.98 5.07 7.12 -0.85 1.03 115.31 126.95 1yl3 h LEU 28 Ca 0.50 0.00 0.34 0.00 0.13 0.00 0.00 57.88 58.85 1yl3 h LEU 28 Cb 0.94 0.01 -0.16 0.00 -0.53 0.00 0.00 40.66 40.91 1yl3 h LEU 28 CO -0.58 -0.00 0.44 -0.07 -0.13 0.00 0.00 178.44 178.10 1yl3 h LEU 29 N -0.01 0.24 -0.83 2.25 -0.00 0.27 0.79 115.31 118.03 1yl3 h LEU 29 Ca 0.00 0.23 0.15 0.00 -0.00 0.00 0.00 57.88 58.26 1yl3 h LEU 29 Cb 0.01 0.25 -0.09 0.00 -0.00 0.00 0.00 40.66 40.82 1yl3 h LEU 29 CO -0.00 -0.28 0.41 0.74 -0.00 0.00 0.00 178.44 179.30 1yl3 h THR 30 N 0.14 0.71 0.00 0.22 2.02 0.23 -3.29 112.91 112.94 1yl3 h THR 30 Ca 0.74 -0.20 -0.30 0.00 0.77 0.00 0.00 66.41 67.41 1yl3 h THR 30 Cb 1.76 0.08 -0.06 0.00 -1.74 0.00 0.00 68.15 68.19 1yl3 h THR 30 CO -0.72 0.11 -2.29 1.41 0.37 0.00 0.00 175.52 174.40 1yl3 n HIS 31 N -4.90 0.04 -0.41 3.16 8.25 0.25 -5.01 115.22 116.61 1yl3 n HIS 31 Ca 0.17 0.02 0.00 0.00 -0.26 0.00 0.00 57.72 57.64 1yl3 n HIS 31 Cb 0.44 -0.92 0.00 0.00 1.12 0.00 0.00 29.99 30.62 1yl3 n HIS 31 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1yl3 n GLY 32 N 1.66 1.47 3.61 -1.41 0.00 0.36 -4.92 105.19 105.96 1yl3 n GLY 32 Ca -0.27 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.70 1yl3 n GLY 32 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1yl3 s ARG 33 N -0.26 0.81 0.11 1.61 1.70 -1.25 -0.88 118.95 120.79 1yl3 s ARG 33 Ca 0.00 -0.38 -0.26 0.00 -0.47 0.00 0.00 55.73 54.62 1yl3 s ARG 33 Cb 0.00 0.32 0.08 0.00 -0.57 0.00 0.00 34.95 34.79 1yl3 s ARG 33 CO 0.00 -0.36 1.09 0.42 -1.08 0.00 0.00 175.30 175.37 1yl3 s ILE 34 N -2.99 0.00 -0.22 4.99 -1.09 0.16 -4.81 121.20 117.25 1yl3 s ILE 34 Ca 0.09 -0.49 -0.01 0.00 -2.23 0.00 0.00 60.65 58.01 1yl3 s ILE 34 Cb -0.00 -2.30 0.02 0.00 -1.58 0.00 0.00 42.46 38.59 1yl3 s ILE 34 CO -0.04 0.00 -0.11 -0.89 -1.23 0.00 0.00 174.94 172.67 1yl3 s THR 35 N -2.68 2.67 0.00 2.92 2.01 -1.26 -1.29 115.64 118.02 1yl3 s THR 35 Ca 0.16 -0.89 0.00 0.00 0.31 0.00 0.00 61.69 61.27 1yl3 s THR 35 Cb 0.00 -2.26 0.00 0.00 0.01 0.00 0.00 72.50 70.25 1yl3 s THR 35 CO 0.01 0.37 0.00 0.41 -0.69 0.00 0.00 174.62 174.72 1yl3 n THR 36 N 4.67 0.00 -4.32 -0.82 -1.04 -0.60 -4.96 114.28 107.21 1yl3 n THR 36 Ca -0.18 0.00 -0.25 0.00 -2.04 0.00 0.00 64.05 61.58 1yl3 n THR 36 Cb 0.49 0.00 -0.08 0.00 -1.82 0.00 0.00 70.33 68.91 1yl3 n THR 36 CO 0.00 0.00 0.00 0.42 -0.64 0.00 0.00 175.07 174.85 1yl3 s THR 37 N 0.63 2.56 0.00 12.58 -4.23 -1.26 -0.76 115.64 125.16 1yl3 s THR 37 Ca 0.00 -1.93 0.00 0.00 -1.18 0.00 0.00 61.69 58.58 1yl3 s THR 37 Cb 0.00 -2.84 0.00 0.00 1.34 0.00 0.00 72.50 71.00 1yl3 s THR 37 CO 0.00 -0.16 0.00 0.52 -0.54 0.00 0.00 174.62 174.44 1yl3 n VAL 38 N -1.00 0.00 -0.24 2.29 0.31 -0.40 -0.36 118.33 118.93 1yl3 n VAL 38 Ca -0.04 0.07 -0.10 0.00 -0.01 0.00 0.00 64.34 64.26 1yl3 n VAL 38 Cb 0.63 -0.14 -0.06 0.00 -0.91 0.00 0.00 33.84 33.36 1yl3 n VAL 38 CO 0.00 0.00 0.00 -0.65 -1.32 0.00 0.00 176.83 174.86 1yl3 h PRO 39 N 0.00 -0.21 -0.49 5.55 0.11 -1.97 -0.50 132.00 134.49 1yl3 h PRO 39 Ca 0.00 0.01 0.05 0.00 0.11 0.00 0.00 66.00 66.17 1yl3 h PRO 39 Cb 0.00 0.05 -0.06 0.00 0.11 0.00 0.00 31.00 31.10 1yl3 h PRO 39 CO 0.00 -0.14 -0.28 1.63 -0.21 0.00 0.00 178.00 179.00 1yl3 n LYS 40 N -5.37 -0.21 0.00 1.05 5.02 -0.52 0.16 118.16 118.30 1yl3 n LYS 40 Ca 0.01 0.75 0.00 0.00 -2.02 0.00 0.00 58.31 57.04 1yl3 n LYS 40 Cb 0.33 -1.10 0.00 0.00 -0.02 0.00 0.00 35.03 34.25 1yl3 n LYS 40 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1yl3 n ALA 41 N -3.64 -0.32 -0.23 7.82 0.00 0.51 -1.40 120.51 123.25 1yl3 n ALA 41 Ca 0.01 0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.52 1yl3 n ALA 41 Cb 0.14 0.05 0.13 0.00 0.00 0.00 0.00 19.45 19.77 1yl3 n ALA 41 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1yl3 n LYS 42 N -1.68 -0.06 0.04 0.00 5.02 0.43 0.74 118.16 122.66 1yl3 n LYS 42 Ca 0.00 1.00 -0.09 0.00 -2.02 0.00 0.00 58.31 57.20 1yl3 n LYS 42 Cb 0.00 -1.54 -0.13 0.00 -0.02 0.00 0.00 35.03 33.34 1yl3 n LYS 42 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 1yl3 h GLU 43 N 0.00 0.05 -0.97 1.97 3.07 -1.19 -1.50 114.58 116.01 1yl3 h GLU 43 Ca 0.35 -0.09 0.25 0.00 -0.50 0.00 0.00 59.36 59.37 1yl3 h GLU 43 Cb 0.62 0.03 -0.06 0.00 -0.84 0.00 0.00 28.75 28.50 1yl3 h GLU 43 CO -0.65 0.91 0.66 1.25 -1.40 0.00 0.00 179.01 179.78 1yl3 h LEU 44 N 0.01 0.26 0.00 1.33 7.12 0.15 -0.66 115.31 123.53 1yl3 h LEU 44 Ca -0.11 0.04 0.00 0.00 0.13 0.00 0.00 57.88 57.93 1yl3 h LEU 44 Cb 1.87 -0.01 0.00 0.00 -0.53 0.00 0.00 40.66 41.99 1yl3 h LEU 44 CO 0.13 0.08 0.00 -1.14 -0.13 0.00 0.00 178.44 177.38 1yl3 n ARG 45 N -4.44 0.00 -0.10 1.25 0.63 -0.29 -0.76 116.66 112.95 1yl3 n ARG 45 Ca 0.21 0.08 -0.02 0.00 -0.92 0.00 0.00 57.85 57.21 1yl3 n ARG 45 Cb 0.88 -1.03 -0.01 0.00 0.45 0.00 0.00 32.46 32.75 1yl3 n ARG 45 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1yl3 n GLY 46 N -0.29 -0.56 0.08 5.14 0.00 -0.36 -1.00 105.19 108.21 1yl3 n GLY 46 Ca 0.00 0.28 -0.16 0.00 0.00 0.00 0.00 46.02 46.13 1yl3 n GLY 46 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1yl3 h PHE 47 N 0.00 0.14 -0.75 1.61 3.57 -1.33 -1.21 116.94 118.97 1yl3 h PHE 47 Ca 0.06 -0.10 0.14 0.00 3.53 0.00 0.00 57.97 61.59 1yl3 h PHE 47 Cb 0.12 -0.01 -0.05 0.00 2.79 0.00 0.00 35.95 38.80 1yl3 h PHE 47 CO -0.23 1.12 0.50 0.28 -2.23 0.00 0.00 178.31 177.75 1yl3 h VAL 48 N -0.83 0.83 0.00 1.41 2.07 -0.58 -0.45 116.25 118.70 1yl3 h VAL 48 Ca -0.06 -0.16 0.00 0.00 0.82 0.00 0.00 66.70 67.29 1yl3 h VAL 48 Cb 1.19 0.31 0.00 0.00 -1.52 0.00 0.00 31.29 31.27 1yl3 h VAL 48 CO 0.03 0.09 0.00 -0.67 0.02 0.00 0.00 177.57 177.03 1yl3 n ASP 49 N -4.49 0.00 -0.43 0.57 2.03 -0.17 -1.08 116.55 112.99 1yl3 n ASP 49 Ca 0.14 0.88 0.38 0.00 0.52 0.00 0.00 54.79 56.71 1yl3 n ASP 49 Cb 0.48 -0.38 0.72 0.00 -0.72 0.00 0.00 41.12 41.22 1yl3 n ASP 49 CO 0.00 0.00 0.00 -0.74 -1.92 0.00 0.00 177.20 174.54 1yl3 h HIS 50 N 0.00 0.18 0.10 -0.67 -0.00 -0.48 0.82 115.15 115.10 1yl3 h HIS 50 Ca 0.00 0.01 0.02 0.00 -0.00 0.00 0.00 60.37 60.40 1yl3 h HIS 50 Cb 0.00 -0.05 -0.03 0.00 -0.00 0.00 0.00 27.41 27.33 1yl3 h HIS 50 CO 0.10 -0.02 -0.25 -0.07 -0.00 0.00 0.00 177.93 177.69 1yl3 h LEU 51 N 0.07 -0.71 -0.54 0.26 3.38 -0.78 -0.54 115.31 116.45 1yl3 h LEU 51 Ca 0.69 0.09 0.09 0.00 0.09 0.00 0.00 57.88 58.84 1yl3 h LEU 51 Cb 2.54 0.27 -0.10 0.00 0.09 0.00 0.00 40.66 43.45 1yl3 h LEU 51 CO -0.12 -0.34 -0.40 -0.29 0.09 0.00 0.00 178.44 177.39 1yl3 h ILE 52 N -0.45 0.12 -0.74 1.22 2.10 0.22 -0.16 117.51 119.84 1yl3 h ILE 52 Ca 0.03 0.00 0.16 0.00 1.08 0.00 0.00 64.86 66.13 1yl3 h ILE 52 Cb 0.48 0.12 -0.11 0.00 -1.09 0.00 0.00 36.82 36.23 1yl3 h ILE 52 CO -0.15 0.00 0.21 -0.74 -1.08 0.00 0.00 178.15 176.38 1yl3 h HIS 53 N -0.23 0.33 -0.55 2.19 2.76 0.32 0.46 115.15 120.44 1yl3 h HIS 53 Ca 0.19 0.04 -0.06 0.00 -2.20 0.00 0.00 60.37 58.33 1yl3 h HIS 53 Cb 0.56 -0.03 -0.02 0.00 1.55 0.00 0.00 27.41 29.47 1yl3 h HIS 53 CO -0.66 -0.05 0.09 -0.07 -1.30 0.00 0.00 177.93 175.93 1yl3 h LEU 54 N 0.31 0.83 -0.87 0.26 4.07 -0.38 -0.68 115.31 118.85 1yl3 h LEU 54 Ca 0.42 -0.18 0.22 0.00 0.08 0.00 0.00 57.88 58.42 1yl3 h LEU 54 Cb 0.70 -0.22 -0.13 0.00 1.08 0.00 0.00 40.66 42.09 1yl3 h LEU 54 CO -0.48 0.84 0.31 0.00 -1.08 0.00 0.00 178.44 178.03 1yl3 h ALA 55 N 1.26 1.31 -1.09 1.53 0.00 0.17 0.11 119.26 122.55 1yl3 h ALA 55 Ca 0.17 0.18 0.00 0.00 0.00 0.00 0.00 54.91 55.27 1yl3 h ALA 55 Cb 0.38 0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.38 1yl3 h ALA 55 CO 0.01 -0.39 0.00 1.63 0.00 0.00 0.00 179.25 180.50 1yl3 n LYS 56 N -5.12 0.00 0.00 0.00 5.02 -0.21 -2.98 118.16 114.86 1yl3 n LYS 56 Ca 0.21 0.32 0.00 0.00 -2.02 0.00 0.00 58.31 56.82 1yl3 n LYS 56 Cb 0.64 -1.31 0.00 0.00 -0.02 0.00 0.00 35.03 34.33 1yl3 n LYS 56 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1yl3 n ARG 57 N -1.46 0.00 -2.26 1.97 1.74 0.20 -4.75 116.66 112.10 1yl3 n ARG 57 Ca 0.00 0.00 -0.01 0.00 -0.77 0.00 0.00 57.85 57.07 1yl3 n ARG 57 Cb 0.00 0.00 -0.01 0.00 -1.02 0.00 0.00 32.46 31.43 1yl3 n ARG 57 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1yl3 n GLY 58 N -0.94 -5.51 0.00 -0.13 0.00 -0.10 -5.01 105.19 93.50 1yl3 n GLY 58 Ca 0.00 0.27 0.00 0.00 0.00 0.00 0.00 46.02 46.29 1yl3 n GLY 58 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1yl3 n ASP 59 N 1.64 0.00 0.00 1.61 5.75 -1.26 -4.91 116.55 119.38 1yl3 n ASP 59 Ca -0.06 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.72 1yl3 n ASP 59 Cb 0.09 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.18 1yl3 n ASP 59 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1yl3 n LEU 60 N 0.00 0.00 0.05 -2.12 -0.00 -1.26 -0.97 117.00 112.71 1yl3 n LEU 60 Ca 0.00 0.00 -0.02 0.00 -0.00 0.00 0.00 56.01 55.99 1yl3 n LEU 60 Cb 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 43.42 43.41 1yl3 n LEU 60 CO 0.00 0.00 0.44 0.45 -0.00 0.00 0.00 177.39 178.28 1yl3 h HIS 61 N 0.00 -0.12 -0.71 1.47 3.86 -1.98 -0.01 115.15 117.66 1yl3 h HIS 61 Ca 0.00 -0.00 0.13 0.00 -1.16 0.00 0.00 60.37 59.34 1yl3 h HIS 61 Cb 0.00 0.04 -0.13 0.00 1.06 0.00 0.00 27.41 28.38 1yl3 h HIS 61 CO 0.00 -0.07 -0.28 0.00 0.86 0.00 0.00 177.93 178.43 1yl3 h ALA 62 N -1.93 0.21 -0.30 2.45 0.00 -1.66 0.12 119.26 118.14 1yl3 h ALA 62 Ca -0.01 0.23 0.06 0.00 0.00 0.00 0.00 54.91 55.19 1yl3 h ALA 62 Cb 0.10 0.72 -0.08 0.00 0.00 0.00 0.00 17.79 18.53 1yl3 h ALA 62 CO 0.02 -0.56 -0.44 0.00 0.00 0.00 0.00 179.25 178.28 1yl3 h ARG 63 N -0.08 -0.38 -0.03 0.00 3.08 -1.10 0.23 114.38 116.11 1yl3 h ARG 63 Ca 0.30 0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.38 1yl3 h ARG 63 Cb 0.56 0.09 -0.00 0.00 0.08 0.00 0.00 29.97 30.69 1yl3 h ARG 63 CO -0.76 -0.25 -0.03 0.07 -1.07 0.00 0.00 179.97 177.93 1yl3 h ARG 64 N -0.39 -0.01 -0.30 0.04 0.11 0.12 -0.92 114.38 113.02 1yl3 h ARG 64 Ca 0.11 0.00 0.03 0.00 0.10 0.00 0.00 59.98 60.22 1yl3 h ARG 64 Cb 0.60 0.00 -0.05 0.00 1.11 0.00 0.00 29.97 31.63 1yl3 h ARG 64 CO -0.51 -0.01 -0.34 -0.07 0.10 0.00 0.00 179.97 179.14 1yl3 h LEU 65 N -0.01 -1.16 -1.22 0.08 3.38 0.11 0.21 115.31 116.70 1yl3 h LEU 65 Ca 0.00 0.16 0.20 0.00 0.09 0.00 0.00 57.88 58.33 1yl3 h LEU 65 Cb 0.02 0.48 -0.09 0.00 0.09 0.00 0.00 40.66 41.17 1yl3 h LEU 65 CO -0.03 -0.23 0.61 0.58 0.09 0.00 0.00 178.44 179.46 1yl3 h VAL 66 N -0.21 0.69 -0.31 1.22 2.07 -1.10 1.76 116.25 120.37 1yl3 h VAL 66 Ca 0.05 -0.21 -0.07 0.00 0.82 0.00 0.00 66.70 67.29 1yl3 h VAL 66 Cb 0.35 0.02 -0.01 0.00 -1.52 0.00 0.00 31.29 30.13 1yl3 h VAL 66 CO -0.39 0.11 -0.09 0.25 0.02 0.00 0.00 177.57 177.47 1yl3 h LEU 67 N 0.62 0.61 -1.64 2.57 7.12 0.22 -0.17 115.31 124.64 1yl3 h LEU 67 Ca 0.54 -0.37 0.50 0.00 0.13 0.00 0.00 57.88 58.67 1yl3 h LEU 67 Cb 1.03 -0.17 -0.09 0.00 -0.53 0.00 0.00 40.66 40.90 1yl3 h LEU 67 CO -0.29 0.85 1.15 -1.14 -0.13 0.00 0.00 178.44 178.87 1yl3 n ARG 68 N -4.45 -0.01 -0.10 1.25 0.63 0.59 -0.42 116.66 114.15 1yl3 n ARG 68 Ca -0.03 1.05 -0.20 0.00 -0.92 0.00 0.00 57.85 57.76 1yl3 n ARG 68 Cb 0.34 -2.30 -0.07 0.00 0.45 0.00 0.00 32.46 30.87 1yl3 n ARG 68 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 1yl3 n ASP 69 N -4.04 1.53 0.23 6.15 9.92 -0.51 -4.66 116.55 125.17 1yl3 n ASP 69 Ca 0.40 0.19 0.10 0.00 -0.53 0.00 0.00 54.79 54.96 1yl3 n ASP 69 Cb 1.72 -0.54 0.49 0.00 -0.64 0.00 0.00 41.12 42.16 1yl3 n ASP 69 CO 0.00 0.00 0.00 -0.07 0.13 0.00 0.00 177.20 177.26 1yl3 h LEU 70 N -0.61 0.00 -2.00 0.64 3.38 -0.53 -3.48 115.31 112.71 1yl3 h LEU 70 Ca -0.48 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.49 1yl3 h LEU 70 Cb 1.46 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.20 1yl3 h LEU 70 CO -0.27 0.21 -0.45 0.00 0.09 0.00 0.00 178.44 178.03 1yl3 n GLN 71 N -3.41 -2.24 0.00 1.13 6.02 0.44 -4.98 117.38 114.34 1yl3 n GLN 71 Ca -0.00 1.65 0.00 0.00 -0.01 0.00 0.00 57.00 58.64 1yl3 n GLN 71 Cb 0.41 -2.31 0.00 0.00 1.02 0.00 0.00 30.24 29.36 1yl3 n GLN 71 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.06 172.58 1yl3 n ASP 72 N 1.98 0.00 0.10 1.08 2.03 -1.26 -5.02 116.55 115.46 1yl3 n ASP 72 Ca -0.02 0.00 -0.04 0.00 0.52 0.00 0.00 54.79 55.24 1yl3 n ASP 72 Cb 0.04 0.00 -0.02 0.00 -0.72 0.00 0.00 41.12 40.42 1yl3 n ASP 72 CO 0.00 0.00 0.00 0.58 -1.92 0.00 0.00 177.20 175.86 1yl3 h VAL 73 N 0.00 0.00 0.00 5.18 2.07 -1.98 -0.81 116.25 120.71 1yl3 h VAL 73 Ca 0.00 -0.23 0.00 0.00 0.82 0.00 0.00 66.70 67.29 1yl3 h VAL 73 Cb 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 29.77 1yl3 h VAL 73 CO 0.00 0.00 0.00 0.29 0.02 0.00 0.00 177.57 177.88 1yl3 n LYS 74 N -3.42 0.00 0.36 1.57 5.02 -1.26 0.10 118.16 120.53 1yl3 n LYS 74 Ca -0.04 0.09 -0.14 0.00 -2.02 0.00 0.00 58.31 56.20 1yl3 n LYS 74 Cb 0.11 -0.14 -0.07 0.00 -0.02 0.00 0.00 35.03 34.92 1yl3 n LYS 74 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 1yl3 h LEU 75 N 0.00 -0.80 -0.14 -0.35 6.46 -1.97 -0.03 115.31 118.48 1yl3 h LEU 75 Ca 0.00 0.03 0.01 0.00 -0.12 0.00 0.00 57.88 57.80 1yl3 h LEU 75 Cb 0.00 0.21 -0.02 0.00 -0.73 0.00 0.00 40.66 40.12 1yl3 h LEU 75 CO 0.00 -0.43 -0.08 0.52 -0.62 0.00 0.00 178.44 177.83 1yl3 n VAL 76 N -5.33 -0.09 0.11 1.05 0.31 0.29 0.33 118.33 114.99 1yl3 n VAL 76 Ca -0.12 0.69 -0.13 0.00 -0.01 0.00 0.00 64.34 64.77 1yl3 n VAL 76 Cb 0.37 -0.89 -0.08 0.00 -0.91 0.00 0.00 33.84 32.33 1yl3 n VAL 76 CO 0.00 0.00 0.00 0.03 -1.32 0.00 0.00 176.83 175.54 1yl3 h ARG 77 N 0.00 -0.26 -0.35 5.55 3.08 -1.19 -0.57 114.38 120.65 1yl3 h ARG 77 Ca 0.02 0.02 0.03 0.00 0.07 0.00 0.00 59.98 60.12 1yl3 h ARG 77 Cb 0.06 0.06 -0.04 0.00 0.08 0.00 0.00 29.97 30.12 1yl3 h ARG 77 CO -0.13 0.03 -0.20 1.17 -1.07 0.00 0.00 179.97 179.77 1yl3 n LYS 78 N -5.08 -0.15 0.10 0.04 4.81 0.99 0.20 118.16 119.07 1yl3 n LYS 78 Ca -0.09 0.69 -0.10 0.00 -0.87 0.00 0.00 58.31 57.94 1yl3 n LYS 78 Cb 0.22 -1.02 -0.06 0.00 0.02 0.00 0.00 35.03 34.19 1yl3 n LYS 78 CO 0.00 0.00 0.00 1.25 1.17 0.00 0.00 177.40 179.82 1yl3 h LEU 79 N 0.00 -0.91 -0.83 3.14 6.46 -0.35 0.12 115.31 122.94 1yl3 h LEU 79 Ca 0.06 0.09 0.12 0.00 -0.12 0.00 0.00 57.88 58.03 1yl3 h LEU 79 Cb 0.14 0.32 -0.14 0.00 -0.73 0.00 0.00 40.66 40.26 1yl3 h LEU 79 CO -0.33 -0.35 -0.41 0.15 -0.62 0.00 0.00 178.44 176.88 1yl3 h PHE 80 N -0.50 -1.17 0.03 1.25 3.57 0.39 -0.69 116.94 119.82 1yl3 h PHE 80 Ca -0.02 0.10 -0.29 0.00 3.53 0.00 0.00 57.97 61.29 1yl3 h PHE 80 Cb 0.47 0.63 -0.04 0.00 2.79 0.00 0.00 35.95 39.81 1yl3 h PHE 80 CO -0.32 -0.40 -1.59 0.38 -2.23 0.00 0.00 178.31 174.15 1yl3 h ASP 81 N -0.08 0.10 0.85 0.41 2.03 -0.87 -3.34 116.42 115.52 1yl3 h ASP 81 Ca 0.27 -0.18 -0.04 0.00 -0.73 0.00 0.00 57.03 56.35 1yl3 h ASP 81 Cb 0.56 -0.03 0.01 0.00 -0.83 0.00 0.00 39.33 39.04 1yl3 h ASP 81 CO -0.86 1.16 -0.41 -0.33 -1.03 0.00 0.00 179.24 177.77 1yl3 h GLU 82 N 0.02 -1.10 0.00 4.15 4.39 0.19 -3.39 114.58 118.84 1yl3 h GLU 82 Ca -0.25 0.07 -0.05 0.00 0.34 0.00 0.00 59.36 59.48 1yl3 h GLU 82 Cb 1.98 0.25 -0.01 0.00 -0.10 0.00 0.00 28.75 30.87 1yl3 h GLU 82 CO 0.10 -0.72 -1.18 -0.89 -1.16 0.00 0.00 179.01 175.16 1yl3 n ILE 83 N -5.56 0.18 -0.27 3.13 2.08 -0.36 -4.57 119.36 114.00 1yl3 n ILE 83 Ca -0.15 -0.09 -0.05 0.00 0.56 0.00 0.00 62.75 63.02 1yl3 n ILE 83 Cb 0.45 -0.79 -0.04 0.00 -0.75 0.00 0.00 39.64 38.51 1yl3 n ILE 83 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1yl3 n ALA 84 N -2.31 -0.31 -0.48 -1.39 0.00 -1.08 0.21 120.51 115.15 1yl3 n ALA 84 Ca -0.05 0.58 0.00 0.00 0.00 0.00 0.00 53.44 53.97 1yl3 n ALA 84 Cb 0.57 -0.15 0.00 0.00 0.00 0.00 0.00 19.45 19.87 1yl3 n ALA 84 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1yl3 n PRO 85 N -4.86 0.00 -0.08 0.00 -0.02 -1.26 -0.45 135.00 128.33 1yl3 n PRO 85 Ca 0.03 0.71 0.07 0.00 -2.02 0.00 0.00 63.50 62.29 1yl3 n PRO 85 Cb 0.20 -1.26 0.13 0.00 -0.02 0.00 0.00 33.50 32.54 1yl3 n PRO 85 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1yl3 n ARG 86 N -1.96 -0.02 -0.06 -0.52 1.74 0.58 0.96 116.66 117.38 1yl3 n ARG 86 Ca 0.00 0.35 -0.10 0.00 -0.77 0.00 0.00 57.85 57.33 1yl3 n ARG 86 Cb 0.00 -0.61 -0.15 0.00 -1.02 0.00 0.00 32.46 30.69 1yl3 n ARG 86 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 1yl3 n TYR 87 N -3.71 0.56 -1.49 -1.55 0.53 0.13 -4.90 117.16 106.72 1yl3 n TYR 87 Ca 0.08 0.19 -0.42 0.00 -1.02 0.00 0.00 57.90 56.74 1yl3 n TYR 87 Cb 0.28 -1.10 -0.14 0.00 -1.03 0.00 0.00 39.34 37.35 1yl3 n TYR 87 CO 0.00 0.00 0.00 -2.13 -1.02 0.00 0.00 176.86 173.71 1yl3 n ARG 88 N -2.95 0.09 0.00 -0.72 3.00 0.27 -1.72 116.66 114.64 1yl3 n ARG 88 Ca -0.25 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.60 1yl3 n ARG 88 Cb 1.09 -1.67 0.00 0.00 0.00 0.00 0.00 32.46 31.89 1yl3 n ARG 88 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.63 177.23 1yl3 n ASP 89 N 10.79 0.00 -3.53 6.15 5.68 -1.26 -4.99 116.55 129.39 1yl3 n ASP 89 Ca 0.63 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.92 1yl3 n ASP 89 Cb 0.07 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.05 1yl3 n ASP 89 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 1yl3 n ARG 90 N 0.00 1.49 -3.40 0.11 1.74 -0.70 -5.03 116.66 110.87 1yl3 n ARG 90 Ca 0.00 0.00 -0.23 0.00 -0.77 0.00 0.00 57.85 56.85 1yl3 n ARG 90 Cb 0.00 0.00 -0.10 0.00 -1.02 0.00 0.00 32.46 31.34 1yl3 n ARG 90 CO 0.00 0.00 0.00 -1.14 -1.52 0.00 0.00 177.63 174.97 1yl3 s GLN 91 N 0.00 0.61 1.37 5.56 2.00 -1.26 -5.11 119.66 122.82 1yl3 s GLN 91 Ca 0.00 -1.11 0.00 0.00 -2.00 0.00 0.00 55.36 52.25 1yl3 s GLN 91 Cb 0.00 -1.00 0.00 0.00 0.80 0.00 0.00 33.01 32.81 1yl3 s GLN 91 CO 0.00 -1.21 0.00 0.41 -0.50 0.00 0.00 175.29 173.99 1yl3 n GLY 92 N 4.11 0.72 3.09 2.59 0.00 -1.26 -4.80 105.19 109.63 1yl3 n GLY 92 Ca 0.12 -0.84 0.00 0.00 0.00 0.00 0.00 46.02 45.30 1yl3 n GLY 92 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1yl3 n GLY 93 N 0.00 0.58 0.00 -0.02 0.00 -1.26 -4.80 105.19 99.68 1yl3 n GLY 93 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1yl3 n GLY 93 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1yl3 n TYR 94 N -2.17 0.00 -4.51 1.61 0.53 -1.26 -4.12 117.16 107.24 1yl3 n TYR 94 Ca 0.00 0.00 -0.27 0.00 -1.02 0.00 0.00 57.90 56.61 1yl3 n TYR 94 Cb 0.04 -0.19 -0.13 0.00 -1.03 0.00 0.00 39.34 38.03 1yl3 n TYR 94 CO 0.00 0.00 0.00 0.99 -1.02 0.00 0.00 176.86 176.83 1yl3 s THR 95 N -2.32 1.98 -0.16 -0.72 2.01 -1.26 -0.66 115.64 114.50 1yl3 s THR 95 Ca 0.00 -1.52 -0.04 0.00 0.31 0.00 0.00 61.69 60.44 1yl3 s THR 95 Cb 0.00 -1.74 0.05 0.00 0.01 0.00 0.00 72.50 70.82 1yl3 s THR 95 CO 0.00 0.13 0.06 0.00 -0.69 0.00 0.00 174.62 174.11 1yl3 s ARG 96 N -1.69 0.34 -0.17 4.92 1.70 0.05 -4.69 118.95 119.42 1yl3 s ARG 96 Ca 0.10 -0.16 -0.12 0.00 -0.47 0.00 0.00 55.73 55.08 1yl3 s ARG 96 Cb -0.10 -1.75 -0.05 0.00 -0.57 0.00 0.00 34.95 32.48 1yl3 s ARG 96 CO 0.04 -0.59 0.22 0.08 -1.08 0.00 0.00 175.30 173.96 1yl3 s VAL 97 N 2.01 5.36 -0.07 4.99 1.01 -1.26 -0.80 120.40 131.64 1yl3 s VAL 97 Ca 0.01 0.38 -0.00 0.00 0.00 0.00 0.00 61.98 62.37 1yl3 s VAL 97 Cb -0.16 -3.55 0.02 0.00 0.00 0.00 0.00 36.38 32.70 1yl3 s VAL 97 CO -0.08 0.43 -0.04 -0.76 0.00 0.00 0.00 175.10 174.65 1yl3 s LEU 98 N 0.31 1.04 0.38 3.92 1.43 0.56 -4.98 118.68 121.35 1yl3 s LEU 98 Ca 0.13 -0.15 -0.25 0.00 -1.03 0.00 0.00 54.13 52.83 1yl3 s LEU 98 Cb -0.12 -0.53 -0.12 0.00 0.03 0.00 0.00 46.19 45.45 1yl3 s LEU 98 CO 0.01 -0.11 0.99 1.17 0.23 0.00 0.00 176.35 178.64 1yl3 n LYS 99 N 4.59 1.33 -2.85 1.70 4.81 -1.26 -1.03 118.16 125.45 1yl3 n LYS 99 Ca -0.16 0.47 -0.20 0.00 -0.87 0.00 0.00 58.31 57.55 1yl3 n LYS 99 Cb 0.50 -1.96 0.05 0.00 0.02 0.00 0.00 35.03 33.64 1yl3 n LYS 99 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 1yl3 s LEU 100 N -0.09 3.31 0.00 3.14 2.01 -0.40 -4.66 118.68 122.00 1yl3 s LEU 100 Ca 0.61 -0.41 0.23 0.00 0.01 0.00 0.00 54.13 54.57 1yl3 s LEU 100 Cb -0.60 -2.35 -0.01 0.00 0.01 0.00 0.00 46.19 43.24 1yl3 s LEU 100 CO 0.58 -1.19 1.09 0.00 1.01 0.00 0.00 176.35 177.84 1yl3 n ALA 101 N -2.24 3.61 -2.37 4.21 0.00 -1.26 -4.83 120.51 117.63 1yl3 n ALA 101 Ca 0.11 -0.64 -0.19 0.00 0.00 0.00 0.00 53.44 52.71 1yl3 n ALA 101 Cb 0.60 -0.80 -0.10 0.00 0.00 0.00 0.00 19.45 19.15 1yl3 n ALA 101 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1yl3 s GLU 102 N -2.50 1.40 -0.09 0.00 2.56 -1.26 -5.07 118.70 113.74 1yl3 s GLU 102 Ca 0.18 -1.64 0.04 0.00 0.00 0.00 0.00 54.97 53.55 1yl3 s GLU 102 Cb 0.18 -1.19 0.00 0.00 2.00 0.00 0.00 34.13 35.13 1yl3 s GLU 102 CO 0.59 0.17 -0.22 -0.98 -0.56 0.00 0.00 175.26 174.26 1yl3 s ARG 103 N -3.65 2.73 0.23 4.30 1.70 -1.25 -1.72 118.95 121.28 1yl3 s ARG 103 Ca 0.24 -0.79 -0.31 0.00 -0.47 0.00 0.00 55.73 54.40 1yl3 s ARG 103 Cb -0.00 -2.11 -0.11 0.00 -0.57 0.00 0.00 34.95 32.16 1yl3 s ARG 103 CO 0.09 0.17 1.57 0.50 -1.08 0.00 0.00 175.30 176.55 1yl3 s ARG 104 N 0.34 4.18 1.11 3.89 3.52 -0.25 -4.67 118.95 127.07 1yl3 s ARG 104 Ca -0.16 2.46 -0.13 0.00 -0.13 0.00 0.00 55.73 57.76 1yl3 s ARG 104 Cb -0.17 -3.09 0.21 0.00 -1.56 0.00 0.00 34.95 30.34 1yl3 s ARG 104 CO 0.07 -0.60 0.80 0.54 -0.81 0.00 0.00 175.30 175.31 1yl3 n ARG 105 N 3.06 -1.83 0.00 5.12 3.00 -1.26 -0.47 116.66 124.28 1yl3 n ARG 105 Ca 0.11 -0.50 0.00 0.00 -0.01 0.00 0.00 57.85 57.45 1yl3 n ARG 105 Cb 0.38 -2.09 0.00 0.00 0.00 0.00 0.00 32.46 30.75 1yl3 n ARG 105 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1yl3 n GLY 106 N 1.12 0.67 0.00 -0.13 0.00 -1.26 -4.32 105.19 101.27 1yl3 n GLY 106 Ca 0.04 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.05 1yl3 n GLY 106 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1yl3 n ASP 107 N 1.74 0.00 0.00 1.61 2.03 -1.23 -4.98 116.55 115.73 1yl3 n ASP 107 Ca 0.00 0.21 0.00 0.00 0.52 0.00 0.00 54.79 55.52 1yl3 n ASP 107 Cb 0.00 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 1yl3 n ASP 107 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1yl3 n GLY 108 N -0.29 0.95 3.71 0.27 0.00 0.38 -5.04 105.19 105.17 1yl3 n GLY 108 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1yl3 n GLY 108 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yl3 s ALA 109 N -2.00 3.55 -0.71 4.61 0.00 -1.23 -4.75 121.76 121.22 1yl3 s ALA 109 Ca 0.00 1.01 -0.26 0.00 0.00 0.00 0.00 51.96 52.71 1yl3 s ALA 109 Cb 0.00 -3.53 -0.02 0.00 0.00 0.00 0.00 23.12 19.57 1yl3 s ALA 109 CO 0.00 -0.64 1.81 -1.25 0.00 0.00 0.00 175.76 175.68 1yl3 s PRO 110 N 1.38 2.70 0.68 0.00 0.04 -1.26 -1.09 135.00 137.45 1yl3 s PRO 110 Ca 0.63 0.25 -0.06 0.00 0.04 0.00 0.00 61.00 61.86 1yl3 s PRO 110 Cb -0.34 -4.57 0.05 0.00 0.04 0.00 0.00 34.50 29.68 1yl3 s PRO 110 CO 0.29 -2.82 0.99 -0.51 0.04 0.00 0.00 177.00 174.99 1yl3 s LEU 111 N 8.86 2.90 0.25 -3.56 1.43 -0.70 -1.27 118.68 126.58 1yl3 s LEU 111 Ca 0.64 0.49 -0.06 0.00 -1.03 0.00 0.00 54.13 54.17 1yl3 s LEU 111 Cb -0.10 -3.18 -0.02 0.00 0.03 0.00 0.00 46.19 42.92 1yl3 s LEU 111 CO 0.14 -1.49 0.33 0.00 0.23 0.00 0.00 176.35 175.56 1yl3 s ALA 112 N -3.18 0.54 -0.03 4.21 0.00 0.06 -1.27 121.76 122.08 1yl3 s ALA 112 Ca 0.59 -1.34 0.03 0.00 0.00 0.00 0.00 51.96 51.24 1yl3 s ALA 112 Cb -0.11 1.22 0.00 0.00 0.00 0.00 0.00 23.12 24.24 1yl3 s ALA 112 CO 0.45 -0.74 -0.11 -1.17 0.00 0.00 0.00 175.76 174.19 1yl3 s LEU 113 N -3.12 1.81 0.11 0.00 1.98 -0.20 -1.56 118.68 117.71 1yl3 s LEU 113 Ca 0.31 -0.22 0.01 0.00 -2.89 0.00 0.00 54.13 51.34 1yl3 s LEU 113 Cb 0.02 -0.64 -0.04 0.00 0.66 0.00 0.00 46.19 46.19 1yl3 s LEU 113 CO 0.13 0.08 -0.04 -0.69 -1.89 0.00 0.00 176.35 173.94 1yl3 s VAL 114 N 0.16 0.58 0.19 1.68 1.01 -0.41 -0.32 120.40 123.29 1yl3 s VAL 114 Ca -0.03 -1.93 -0.04 0.00 0.00 0.00 0.00 61.98 59.98 1yl3 s VAL 114 Cb -0.09 -1.79 0.02 0.00 0.00 0.00 0.00 36.38 34.51 1yl3 s VAL 114 CO 0.01 -0.76 0.33 -1.84 0.00 0.00 0.00 175.10 172.83 1yl3 n GLU 115 N -0.07 0.47 -3.74 2.72 0.28 0.02 -0.67 120.64 119.65 1yl3 n GLU 115 Ca -0.10 -1.33 -0.36 0.00 -0.16 0.00 0.00 57.16 55.20 1yl3 n GLU 115 Cb 0.62 1.43 -0.10 0.00 1.43 0.00 0.00 31.44 34.81 1yl3 n GLU 115 CO 0.00 0.00 0.00 -0.48 -0.16 0.00 0.00 177.13 176.49 1yl3 s LEU 116 N 0.00 3.92 -0.22 -1.84 0.05 -0.06 -0.77 118.68 119.77 1yl3 s LEU 116 Ca 0.12 0.03 -0.32 0.00 0.05 0.00 0.00 54.13 54.01 1yl3 s LEU 116 Cb -0.01 -2.05 -0.09 0.00 -2.05 0.00 0.00 46.19 41.99 1yl3 s LEU 116 CO 0.09 0.05 2.12 0.55 -0.55 0.00 0.00 176.35 178.60 1yl3 n VAL 117 N 4.38 0.37 -1.79 1.48 3.14 0.16 -4.86 118.33 121.21 1yl3 n VAL 117 Ca -0.15 -0.29 0.00 0.00 -2.96 0.00 0.00 64.34 60.94 1yl3 n VAL 117 Cb 0.52 -2.08 0.00 0.00 -1.06 0.00 0.00 33.84 31.22 1yl3 n VAL 117 CO 0.00 0.00 0.00 -0.62 -6.46 0.00 0.00 176.83 169.75