#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yl1 s VAL 2 N 0.00 4.31 0.61 3.15 1.01 -1.26 -1.37 120.40 126.85 1yl1 s VAL 2 Ca 0.00 -1.27 -0.17 0.00 0.00 0.00 0.00 61.98 60.55 1yl1 s VAL 2 Cb 0.00 -3.58 -0.02 0.00 0.00 0.00 0.00 36.38 32.78 1yl1 s VAL 2 CO 0.00 -0.44 1.11 -0.36 0.00 0.00 0.00 175.10 175.41 1yl1 s PHE 3 N 1.46 2.67 0.38 5.22 0.08 -0.25 -5.00 117.98 122.54 1yl1 s PHE 3 Ca 0.03 1.55 -0.04 0.00 0.12 0.00 0.00 56.93 58.58 1yl1 s PHE 3 Cb -0.22 -3.20 -0.04 0.00 -0.57 0.00 0.00 43.02 38.99 1yl1 s PHE 3 CO 0.03 -1.60 0.65 0.20 -0.10 0.00 0.00 175.22 174.41 1yl1 s GLY 4 N -2.32 1.58 0.10 4.36 0.00 -1.26 -4.86 107.32 104.93 1yl1 s GLY 4 Ca 0.69 -0.61 -0.32 0.00 0.00 0.00 0.00 44.72 44.47 1yl1 s GLY 4 CO 0.36 -0.49 1.58 -0.09 0.00 0.00 0.00 173.10 174.46 1yl1 h ARG 5 N 0.85 -0.72 -0.00 2.90 2.43 -1.96 -1.39 114.38 116.47 1yl1 h ARG 5 Ca -0.48 0.05 -0.09 0.00 -0.81 0.00 0.00 59.98 58.65 1yl1 h ARG 5 Cb 1.20 0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 30.90 1yl1 h ARG 5 CO 0.63 -0.48 -0.44 0.00 -1.51 0.00 0.00 179.97 178.17 1yl1 h GLU 7 N 0.01 1.05 -0.32 0.00 4.81 -1.89 -2.01 114.58 116.23 1yl1 h GLU 7 Ca -0.00 -0.28 -0.08 0.00 -0.13 0.00 0.00 59.36 58.86 1yl1 h GLU 7 Cb 0.78 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 30.03 1yl1 h GLU 7 CO 0.06 0.98 -0.11 1.25 -0.73 0.00 0.00 179.01 180.45 1yl1 h LEU 8 N 0.97 0.66 -0.48 1.64 5.85 -1.10 -2.08 115.31 120.78 1yl1 h LEU 8 Ca 0.19 -0.38 0.07 0.00 0.84 0.00 0.00 57.88 58.60 1yl1 h LEU 8 Cb 0.43 -0.18 -0.06 0.00 0.37 0.00 0.00 40.66 41.22 1yl1 h LEU 8 CO 0.01 0.90 0.13 0.00 -0.34 0.00 0.00 178.44 179.14 1yl1 h ALA 9 N 0.79 0.55 -0.62 1.25 0.00 -1.28 0.21 119.26 120.16 1yl1 h ALA 9 Ca 0.08 0.08 -0.06 0.00 0.00 0.00 0.00 54.91 55.01 1yl1 h ALA 9 Cb 0.62 0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.47 1yl1 h ALA 9 CO 0.04 -0.27 0.15 0.00 0.00 0.00 0.00 179.25 179.17 1yl1 h ALA 10 N 1.34 0.81 -0.68 0.00 0.00 -1.31 0.46 119.26 119.89 1yl1 h ALA 10 Ca 0.23 -0.23 -0.08 0.00 0.00 0.00 0.00 54.91 54.83 1yl1 h ALA 10 Cb 0.27 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 1yl1 h ALA 10 CO -0.27 0.53 0.12 0.00 0.00 0.00 0.00 179.25 179.63 1yl1 h ALA 11 N 1.04 0.90 -0.33 0.00 0.00 -0.65 -1.12 119.26 119.11 1yl1 h ALA 11 Ca 0.19 -0.27 -0.16 0.00 0.00 0.00 0.00 54.91 54.67 1yl1 h ALA 11 Cb 0.36 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.89 1yl1 h ALA 11 CO 0.00 0.67 -0.44 0.52 0.00 0.00 0.00 179.25 180.00 1yl1 h MET 12 N 1.05 0.84 -0.63 0.00 2.86 -0.39 -2.62 114.93 116.04 1yl1 h MET 12 Ca 0.21 -0.47 -0.04 0.00 -2.06 0.00 0.00 59.70 57.34 1yl1 h MET 12 Cb 0.44 0.03 -0.03 0.00 0.06 0.00 0.00 31.60 32.10 1yl1 h MET 12 CO 0.01 1.11 0.24 -0.22 1.06 0.00 0.00 176.91 179.11 1yl1 h LYS 13 N 0.67 0.95 0.00 1.72 3.64 -0.72 -2.06 116.57 120.78 1yl1 h LYS 13 Ca 0.04 -0.18 -0.03 0.00 -1.27 0.00 0.00 60.65 59.22 1yl1 h LYS 13 Cb 1.03 -0.15 -0.00 0.00 -0.41 0.00 0.00 32.23 32.69 1yl1 h LYS 13 CO 0.10 0.81 -0.13 -0.09 -2.27 0.00 0.00 179.45 177.88 1yl1 h ARG 14 N 0.89 0.00 -0.55 1.90 2.43 -1.13 -1.91 114.38 116.01 1yl1 h ARG 14 Ca 0.21 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.38 1yl1 h ARG 14 Cb 0.22 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.77 1yl1 h ARG 14 CO -0.01 0.13 0.00 0.72 -1.51 0.00 0.00 179.97 179.29 1yl1 n HIS 15 N -3.57 0.84 -1.92 2.20 8.25 -0.82 -4.94 115.22 115.25 1yl1 n HIS 15 Ca -0.01 -0.36 -0.05 0.00 -0.26 0.00 0.00 57.72 57.03 1yl1 n HIS 15 Cb 0.26 -0.10 -0.01 0.00 1.12 0.00 0.00 29.99 31.27 1yl1 n HIS 15 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1yl1 n GLY 16 N 1.06 0.27 0.10 -1.41 0.00 -0.72 -4.97 105.19 99.52 1yl1 n GLY 16 Ca 0.17 -0.70 0.02 0.00 0.00 0.00 0.00 46.02 45.51 1yl1 n GLY 16 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1yl1 h LEU 17 N 0.00 0.00 -9.13 0.99 3.38 -1.60 -3.41 115.31 105.54 1yl1 h LEU 17 Ca -0.12 0.00 -0.57 0.00 0.09 0.00 0.00 57.88 57.28 1yl1 h LEU 17 Cb 0.95 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.71 1yl1 h LEU 17 CO 0.15 0.47 1.35 -0.67 0.09 0.00 0.00 178.44 179.83 1yl1 n ASP 18 N -2.89 3.57 -0.95 -0.43 2.03 -1.26 -1.15 116.55 115.47 1yl1 n ASP 18 Ca -0.07 0.57 -0.12 0.00 0.52 0.00 0.00 54.79 55.69 1yl1 n ASP 18 Cb 0.78 -1.51 -0.04 0.00 -0.72 0.00 0.00 41.12 39.63 1yl1 n ASP 18 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 1yl1 n ASN 19 N 9.43 -4.32 -4.66 1.67 5.03 0.31 -4.87 115.26 117.85 1yl1 n ASN 19 Ca 0.26 0.25 -0.43 0.00 0.87 0.00 0.00 54.58 55.53 1yl1 n ASN 19 Cb 0.40 -2.94 -0.02 0.00 -1.02 0.00 0.00 39.78 36.20 1yl1 n ASN 19 CO 0.00 0.00 0.00 -0.47 -1.83 0.00 0.00 177.26 174.96 1yl1 s TYR 20 N -2.45 2.54 -1.70 3.10 5.04 -0.30 -1.89 117.35 121.69 1yl1 s TYR 20 Ca 0.00 0.69 0.00 0.00 -2.44 0.00 0.00 57.07 55.32 1yl1 s TYR 20 Cb 0.00 -3.67 0.00 0.00 0.35 0.00 0.00 41.96 38.64 1yl1 s TYR 20 CO 0.00 -2.57 0.00 0.54 -1.34 0.00 0.00 175.55 172.18 1yl1 n ARG 21 N 6.62 -1.38 -0.74 4.97 5.12 -1.26 -2.45 116.66 127.53 1yl1 n ARG 21 Ca 0.15 0.98 0.00 0.00 -1.93 0.00 0.00 57.85 57.05 1yl1 n ARG 21 Cb 0.44 -5.40 0.00 0.00 -1.16 0.00 0.00 32.46 26.34 1yl1 n ARG 21 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1yl1 n GLY 22 N -0.91 0.84 3.55 -0.13 0.00 -0.79 -5.03 105.19 102.72 1yl1 n GLY 22 Ca -0.20 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.41 1yl1 n GLY 22 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1yl1 s TYR 23 N -3.29 3.19 0.85 1.61 2.02 -1.03 -4.88 117.35 115.82 1yl1 s TYR 23 Ca 0.00 0.07 -0.11 0.00 -0.37 0.00 0.00 57.07 56.66 1yl1 s TYR 23 Cb 0.00 -2.81 0.10 0.00 -0.40 0.00 0.00 41.96 38.85 1yl1 s TYR 23 CO 0.00 -0.50 1.14 -1.54 -1.57 0.00 0.00 175.55 173.08 1yl1 s SER 24 N 1.75 3.54 0.27 2.29 1.04 -1.26 -0.53 113.70 120.80 1yl1 s SER 24 Ca 0.15 2.12 -0.01 0.00 0.48 0.00 0.00 55.95 58.70 1yl1 s SER 24 Cb -0.16 -2.56 0.57 0.00 0.10 0.00 0.00 66.02 63.98 1yl1 s SER 24 CO 0.13 -2.69 1.71 -0.07 0.98 0.00 0.00 173.24 173.30 1yl1 h LEU 25 N -1.41 0.25 -1.41 2.42 3.38 -1.90 -0.90 115.31 115.75 1yl1 h LEU 25 Ca -0.44 0.14 0.26 0.00 0.09 0.00 0.00 57.88 57.93 1yl1 h LEU 25 Cb 1.26 0.13 -0.09 0.00 0.09 0.00 0.00 40.66 42.05 1yl1 h LEU 25 CO 0.45 0.03 0.67 1.23 0.09 0.00 0.00 178.44 180.92 1yl1 h GLY 26 N 0.40 1.12 0.97 0.83 0.00 -1.91 -0.71 103.07 103.76 1yl1 h GLY 26 Ca 0.48 -0.20 -0.05 0.00 0.00 0.00 0.00 47.33 47.56 1yl1 h GLY 26 CO -0.48 -0.11 0.10 3.43 0.00 0.00 0.00 176.54 179.48 1yl1 h ASN 27 N 0.38 0.74 -0.22 0.19 2.35 -1.39 -1.79 115.58 115.84 1yl1 h ASN 27 Ca 0.58 -0.24 -0.15 0.00 -0.55 0.00 0.00 56.30 55.94 1yl1 h ASN 27 Cb 1.49 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 39.66 1yl1 h ASN 27 CO -0.27 0.79 -0.40 -0.50 -1.65 0.00 0.00 177.43 175.40 1yl1 h TRP 28 N 0.66 0.91 -0.24 1.19 4.06 -1.21 -1.67 115.95 119.64 1yl1 h TRP 28 Ca 0.15 -0.27 -0.16 0.00 2.06 0.00 0.00 58.89 60.67 1yl1 h TRP 28 Cb 0.35 -0.19 -0.01 0.00 -1.00 0.00 0.00 29.16 28.31 1yl1 h TRP 28 CO 0.02 1.04 -0.50 0.28 -3.56 0.00 0.00 178.44 175.72 1yl1 h VAL 29 N 0.62 1.30 -0.48 1.49 2.07 -1.39 -1.98 116.25 117.87 1yl1 h VAL 29 Ca 0.05 -1.71 -0.06 0.00 0.82 0.00 0.00 66.70 65.81 1yl1 h VAL 29 Cb 0.95 1.65 -0.02 0.00 -1.52 0.00 0.00 31.29 32.35 1yl1 h VAL 29 CO 0.09 0.54 0.07 0.00 0.02 0.00 0.00 177.57 178.29 1yl1 h ALA 31 N 0.96 0.40 -0.64 0.00 0.00 -1.22 -2.57 119.26 116.20 1yl1 h ALA 31 Ca 0.15 -0.10 -0.04 0.00 0.00 0.00 0.00 54.91 54.92 1yl1 h ALA 31 Cb 0.40 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.04 1yl1 h ALA 31 CO 0.01 -0.04 0.25 0.00 0.00 0.00 0.00 179.25 179.48 1yl1 h ALA 32 N 1.01 1.24 0.19 0.00 0.00 -1.25 -0.06 119.26 120.39 1yl1 h ALA 32 Ca 0.11 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1yl1 h ALA 32 Cb 0.12 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 1yl1 h ALA 32 CO -0.01 0.56 -0.16 -0.22 0.00 0.00 0.00 179.25 179.41 1yl1 h LYS 33 N 0.92 -0.36 0.00 0.00 1.63 -0.91 -1.79 116.57 116.06 1yl1 h LYS 33 Ca 0.22 0.02 0.00 0.00 -0.85 0.00 0.00 60.65 60.04 1yl1 h LYS 33 Cb 0.18 0.08 0.00 0.00 -0.60 0.00 0.00 32.23 31.89 1yl1 h LYS 33 CO -0.02 -0.24 -0.19 1.19 -3.45 0.00 0.00 179.45 176.74 1yl1 n PHE 34 N -5.29 0.81 -0.00 1.91 0.99 -0.99 -0.42 117.46 114.46 1yl1 n PHE 34 Ca -0.08 0.24 -0.21 0.00 -0.00 0.00 0.00 57.45 57.40 1yl1 n PHE 34 Cb 0.20 -0.85 -0.14 0.00 -1.00 0.00 0.00 39.48 37.70 1yl1 n PHE 34 CO 0.00 0.00 0.00 0.93 -0.00 0.00 0.00 176.76 177.69 1yl1 h GLU 35 N 0.00 0.21 0.00 -1.08 4.39 -0.92 -3.43 114.58 113.75 1yl1 h GLU 35 Ca 0.00 -0.36 0.00 0.00 0.34 0.00 0.00 59.36 59.34 1yl1 h GLU 35 Cb 0.74 0.13 0.00 0.00 -0.10 0.00 0.00 28.75 29.52 1yl1 h GLU 35 CO 0.00 1.17 0.00 -1.13 -1.16 0.00 0.00 179.01 177.89 1yl1 n SER 36 N -4.05 0.27 -3.38 1.42 3.41 -0.72 -4.85 113.62 105.73 1yl1 n SER 36 Ca -0.23 -0.97 -0.23 0.00 -0.26 0.00 0.00 58.87 57.17 1yl1 n SER 36 Cb 0.84 0.01 0.07 0.00 -0.26 0.00 0.00 64.21 64.86 1yl1 n SER 36 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1yl1 n ASN 37 N -0.01 -6.28 -1.21 4.04 5.15 0.43 -2.15 115.26 115.24 1yl1 n ASN 37 Ca 0.00 -0.45 -0.16 0.00 -0.60 0.00 0.00 54.58 53.37 1yl1 n ASN 37 Cb 0.18 -4.96 -0.07 0.00 -0.53 0.00 0.00 39.78 34.40 1yl1 n ASN 37 CO 0.00 0.00 0.00 0.49 1.40 0.00 0.00 177.26 179.15 1yl1 n PHE 38 N -4.84 0.00 -3.59 1.20 3.72 -1.17 -4.85 117.46 107.93 1yl1 n PHE 38 Ca -0.03 0.00 -0.39 0.00 -0.05 0.00 0.00 57.45 56.98 1yl1 n PHE 38 Cb 0.58 -2.81 -0.11 0.00 -0.94 0.00 0.00 39.48 36.20 1yl1 n PHE 38 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 176.76 177.92 1yl1 s ASN 39 N -2.78 5.84 0.45 4.37 2.47 -0.91 -1.09 114.94 123.28 1yl1 s ASN 39 Ca 0.00 -0.44 0.31 0.00 0.42 0.00 0.00 52.86 53.15 1yl1 s ASN 39 Cb 0.00 -2.08 1.44 0.00 -1.45 0.00 0.00 41.25 39.17 1yl1 s ASN 39 CO 0.00 -0.21 1.93 0.71 -3.72 0.00 0.00 177.10 175.81 1yl1 h THR 40 N 5.56 0.00 -0.56 -5.21 1.35 -1.54 -2.88 112.91 109.63 1yl1 h THR 40 Ca -0.32 -0.24 0.00 0.00 -0.55 0.00 0.00 66.41 65.30 1yl1 h THR 40 Cb 1.15 1.08 0.00 0.00 -1.73 0.00 0.00 68.15 68.65 1yl1 h THR 40 CO 0.62 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 175.89 1yl1 n GLN 41 N -2.70 2.38 -2.09 4.72 6.02 -1.26 -4.07 117.38 120.38 1yl1 n GLN 41 Ca -0.00 -2.14 -0.42 0.00 -0.01 0.00 0.00 57.00 54.43 1yl1 n GLN 41 Cb 0.19 -1.47 -0.03 0.00 1.02 0.00 0.00 30.24 29.95 1yl1 n GLN 41 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1yl1 s ALA 42 N -1.26 3.64 0.00 -1.58 0.00 -1.08 -4.84 121.76 116.64 1yl1 s ALA 42 Ca 0.40 1.21 0.01 0.00 0.00 0.00 0.00 51.96 53.59 1yl1 s ALA 42 Cb 0.21 -3.56 -0.01 0.00 0.00 0.00 0.00 23.12 19.77 1yl1 s ALA 42 CO 0.28 -0.67 -0.05 0.95 0.00 0.00 0.00 175.76 176.28 1yl1 s THR 43 N 0.89 0.35 -0.09 0.00 -4.23 -1.26 -1.39 115.64 109.91 1yl1 s THR 43 Ca 0.65 -0.31 -0.05 0.00 -1.18 0.00 0.00 61.69 60.80 1yl1 s THR 43 Cb -0.39 -0.32 0.04 0.00 1.34 0.00 0.00 72.50 73.16 1yl1 s THR 43 CO 0.33 0.02 0.22 0.20 -0.54 0.00 0.00 174.62 174.85 1yl1 s ASN 44 N -0.32 -0.22 0.05 3.99 0.01 -1.03 -4.99 114.94 112.43 1yl1 s ASN 44 Ca -0.00 0.46 -0.08 0.00 -0.71 0.00 0.00 52.86 52.53 1yl1 s ASN 44 Cb -0.03 0.37 -0.05 0.00 0.41 0.00 0.00 41.25 41.95 1yl1 s ASN 44 CO -0.00 -0.14 0.33 -0.60 -1.51 0.00 0.00 177.10 175.17 1yl1 s ARG 45 N 1.02 3.65 0.33 -0.60 3.52 -1.26 -0.61 118.95 125.00 1yl1 s ARG 45 Ca -0.07 0.01 0.07 0.00 -0.13 0.00 0.00 55.73 55.61 1yl1 s ARG 45 Cb -0.09 -3.03 -0.02 0.00 -1.56 0.00 0.00 34.95 30.25 1yl1 s ARG 45 CO -0.06 0.60 0.33 -0.80 -0.81 0.00 0.00 175.30 174.56 1yl1 s ASN 46 N -1.79 5.52 0.47 -2.12 -0.87 -0.30 -4.98 114.94 110.86 1yl1 s ASN 46 Ca 0.31 -0.38 0.15 0.00 -1.57 0.00 0.00 52.86 51.36 1yl1 s ASN 46 Cb -0.13 -1.10 1.07 0.00 -0.02 0.00 0.00 41.25 41.07 1yl1 s ASN 46 CO 0.18 -0.34 2.04 0.71 -2.57 0.00 0.00 177.10 177.11 1yl1 h THR 47 N 1.17 1.09 0.00 1.60 1.35 -1.99 -1.96 112.91 114.17 1yl1 h THR 47 Ca -0.45 -0.43 0.00 0.00 -0.55 0.00 0.00 66.41 64.98 1yl1 h THR 47 Cb 1.25 1.21 0.00 0.00 -1.73 0.00 0.00 68.15 68.88 1yl1 h THR 47 CO 0.57 0.12 0.00 -0.90 -0.25 0.00 0.00 175.52 175.07 1yl1 n ASP 48 N -4.39 0.00 0.00 5.36 5.75 -1.26 -4.86 116.55 117.15 1yl1 n ASP 48 Ca -0.02 -0.67 0.00 0.00 -0.01 0.00 0.00 54.79 54.09 1yl1 n ASP 48 Cb 0.19 -0.04 0.00 0.00 -1.03 0.00 0.00 41.12 40.24 1yl1 n ASP 48 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1yl1 n GLY 49 N 0.56 2.54 3.79 6.12 0.00 -0.74 -5.03 105.19 112.43 1yl1 n GLY 49 Ca 0.17 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.90 1yl1 n GLY 49 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1yl1 s SER 50 N -1.38 3.74 0.02 1.61 1.04 -1.26 -4.79 113.70 112.67 1yl1 s SER 50 Ca 0.00 1.04 0.01 0.00 0.48 0.00 0.00 55.95 57.49 1yl1 s SER 50 Cb 0.00 -1.65 -0.01 0.00 0.10 0.00 0.00 66.02 64.45 1yl1 s SER 50 CO 0.00 -2.42 -0.05 -0.89 0.98 0.00 0.00 173.24 170.86 1yl1 s THR 51 N -3.25 0.38 -0.14 2.02 2.01 -1.26 -1.15 115.64 114.25 1yl1 s THR 51 Ca 0.63 -0.66 -0.08 0.00 0.31 0.00 0.00 61.69 61.89 1yl1 s THR 51 Cb -0.15 -0.41 -0.04 0.00 0.01 0.00 0.00 72.50 71.91 1yl1 s THR 51 CO 0.53 -0.19 0.15 -1.81 -0.69 0.00 0.00 174.62 172.61 1yl1 s ASP 52 N -0.91 6.35 -0.00 3.53 1.01 0.22 -1.29 116.67 125.58 1yl1 s ASP 52 Ca -0.06 0.41 0.06 0.00 0.71 0.00 0.00 52.55 53.68 1yl1 s ASP 52 Cb -0.06 -2.09 -0.02 0.00 1.01 0.00 0.00 42.92 41.77 1yl1 s ASP 52 CO -0.00 0.33 -0.19 -0.31 0.21 0.00 0.00 175.17 175.21 1yl1 s TYR 53 N -0.57 1.68 0.00 4.23 2.02 -0.18 -2.45 117.35 122.09 1yl1 s TYR 53 Ca 0.13 -0.33 0.00 0.00 -0.37 0.00 0.00 57.07 56.50 1yl1 s TYR 53 Cb -0.12 -1.06 0.00 0.00 -0.40 0.00 0.00 41.96 40.38 1yl1 s TYR 53 CO 0.02 -0.00 0.00 0.41 -1.57 0.00 0.00 175.55 174.41 1yl1 n GLY 54 N 2.44 -1.79 0.37 0.71 0.00 -0.48 -1.38 105.19 105.06 1yl1 n GLY 54 Ca -0.15 -1.33 0.15 0.00 0.00 0.00 0.00 46.02 44.68 1yl1 n GLY 54 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1yl1 h ILE 55 N 0.00 0.82 -0.30 -0.61 6.09 -1.72 -1.87 117.51 119.92 1yl1 h ILE 55 Ca 0.00 -0.13 0.00 0.00 -1.37 0.00 0.00 64.86 63.36 1yl1 h ILE 55 Cb 0.00 0.40 0.00 0.00 0.47 0.00 0.00 36.82 37.69 1yl1 h ILE 55 CO 0.00 0.07 0.00 0.18 -3.07 0.00 0.00 178.15 175.33 1yl1 n LEU 56 N -4.47 3.13 -3.97 2.19 4.77 -1.26 -4.09 117.00 113.30 1yl1 n LEU 56 Ca 0.13 -2.30 -0.43 0.00 -0.03 0.00 0.00 56.01 53.38 1yl1 n LEU 56 Cb 0.49 -0.31 0.03 0.00 -2.33 0.00 0.00 43.42 41.30 1yl1 n LEU 56 CO 0.33 0.70 -0.14 0.00 -1.33 0.00 0.00 177.39 176.96 1yl1 n GLN 57 N 0.14 -0.51 -2.66 3.23 1.13 -0.70 -4.89 117.38 113.12 1yl1 n GLN 57 Ca 0.14 0.18 -0.42 0.00 -1.94 0.00 0.00 57.00 54.96 1yl1 n GLN 57 Cb 0.55 -2.96 -0.03 0.00 0.11 0.00 0.00 30.24 27.91 1yl1 n GLN 57 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 1yl1 s ILE 58 N -3.51 4.65 0.21 5.09 1.01 -0.48 -4.40 121.20 123.77 1yl1 s ILE 58 Ca 0.49 1.95 -0.30 0.00 0.00 0.00 0.00 60.65 62.79 1yl1 s ILE 58 Cb -0.24 -4.25 -0.08 0.00 0.01 0.00 0.00 42.46 37.89 1yl1 s ILE 58 CO 0.94 0.18 1.01 0.21 0.00 0.00 0.00 174.94 177.28 1yl1 s ASN 59 N 0.83 7.47 0.16 3.58 3.84 -1.26 -1.01 114.94 128.55 1yl1 s ASN 59 Ca 0.52 2.01 0.25 0.00 0.21 0.00 0.00 52.86 55.85 1yl1 s ASN 59 Cb -0.23 -2.61 0.92 0.00 -0.55 0.00 0.00 41.25 38.79 1yl1 s ASN 59 CO 0.29 -0.02 1.77 -1.54 -2.79 0.00 0.00 177.10 174.80 1yl1 n SER 60 N 1.87 0.54 -0.02 -4.21 3.41 -0.41 -1.99 113.62 112.81 1yl1 n SER 60 Ca -0.00 0.57 -0.03 0.00 -0.26 0.00 0.00 58.87 59.15 1yl1 n SER 60 Cb 0.47 -0.71 0.20 0.00 -0.26 0.00 0.00 64.21 63.91 1yl1 n SER 60 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 1yl1 h ARG 61 N 0.00 0.56 0.00 4.33 9.65 -1.84 -3.39 114.38 123.69 1yl1 h ARG 61 Ca 0.00 -0.18 0.00 0.00 -1.10 0.00 0.00 59.98 58.70 1yl1 h ARG 61 Cb 0.56 -0.05 0.00 0.00 -1.39 0.00 0.00 29.97 29.10 1yl1 h ARG 61 CO 0.00 0.71 -0.70 0.91 2.80 0.00 0.00 179.97 183.69 1yl1 n TRP 62 N -4.16 0.00 -0.08 2.20 7.02 -1.23 -1.71 117.44 119.47 1yl1 n TRP 62 Ca 0.00 0.00 -0.08 0.00 -1.02 0.00 0.00 57.50 56.40 1yl1 n TRP 62 Cb 0.36 0.00 -0.14 0.00 -2.42 0.00 0.00 31.31 29.12 1yl1 n TRP 62 CO 0.00 0.00 0.00 0.91 -2.02 0.00 0.00 177.69 176.58 1yl1 n TRP 63 N -1.32 0.00 -4.09 -5.99 7.02 -0.84 0.65 117.44 112.87 1yl1 n TRP 63 Ca 0.00 0.00 -0.08 0.00 -1.02 0.00 0.00 57.50 56.40 1yl1 n TRP 63 Cb 0.19 -0.84 -0.10 0.00 -2.42 0.00 0.00 31.31 28.15 1yl1 n TRP 63 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1yl1 s ASN 65 N -2.97 4.85 -0.03 0.00 2.47 -0.90 -4.49 114.94 113.87 1yl1 s ASN 65 Ca 0.14 -0.23 0.08 0.00 0.42 0.00 0.00 52.86 53.27 1yl1 s ASN 65 Cb 0.07 -1.84 0.22 0.00 -1.45 0.00 0.00 41.25 38.25 1yl1 s ASN 65 CO -0.05 0.02 1.18 -0.90 -3.72 0.00 0.00 177.10 173.63 1yl1 n ASP 66 N 4.55 2.67 0.00 -4.21 5.68 -1.26 -2.08 116.55 121.89 1yl1 n ASP 66 Ca -0.17 -2.17 0.00 0.00 -0.50 0.00 0.00 54.79 51.95 1yl1 n ASP 66 Cb 0.51 -0.19 0.00 0.00 -1.14 0.00 0.00 41.12 40.30 1yl1 n ASP 66 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1yl1 n GLY 67 N -0.05 0.32 0.54 6.12 0.00 -1.26 -4.78 105.19 106.08 1yl1 n GLY 67 Ca 0.09 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.12 1yl1 n GLY 67 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1yl1 n ARG 68 N -1.36 0.13 -3.93 1.61 1.85 -1.26 -4.98 116.66 108.72 1yl1 n ARG 68 Ca 0.00 -1.25 -0.31 0.00 -1.00 0.00 0.00 57.85 55.30 1yl1 n ARG 68 Cb 0.14 -0.56 -0.14 0.00 -1.05 0.00 0.00 32.46 30.85 1yl1 n ARG 68 CO 0.00 0.00 0.00 0.99 -0.01 0.00 0.00 177.63 178.61 1yl1 s THR 69 N -0.29 2.67 -0.06 8.89 2.01 -1.26 -4.92 115.64 122.69 1yl1 s THR 69 Ca 0.06 -3.23 -0.36 0.00 0.31 0.00 0.00 61.69 58.47 1yl1 s THR 69 Cb 0.06 -2.85 -0.14 0.00 0.01 0.00 0.00 72.50 69.58 1yl1 s THR 69 CO -0.01 -0.79 1.67 -2.65 -0.69 0.00 0.00 174.62 172.14 1yl1 n PRO 70 N 3.21 1.65 -1.83 4.92 -0.02 -1.26 -2.24 135.00 139.43 1yl1 n PRO 70 Ca 0.05 0.60 -0.02 0.00 -2.02 0.00 0.00 63.50 62.11 1yl1 n PRO 70 Cb 0.33 -2.34 -0.00 0.00 -0.02 0.00 0.00 33.50 31.47 1yl1 n PRO 70 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1yl1 n GLY 71 N 3.75 0.34 3.84 -1.23 0.00 -1.26 -5.04 105.19 105.59 1yl1 n GLY 71 Ca 0.22 -0.83 -0.33 0.00 0.00 0.00 0.00 46.02 45.08 1yl1 n GLY 71 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1yl1 s SER 72 N -2.91 6.82 0.01 1.61 1.04 -0.95 -4.97 113.70 114.35 1yl1 s SER 72 Ca 0.00 1.42 0.22 0.00 0.48 0.00 0.00 55.95 58.07 1yl1 s SER 72 Cb 0.00 -2.43 -0.23 0.00 0.10 0.00 0.00 66.02 63.46 1yl1 s SER 72 CO 0.00 -0.27 0.69 -1.14 0.98 0.00 0.00 173.24 173.50 1yl1 n ARG 73 N -0.50 0.48 -3.87 4.02 0.00 -0.70 -4.98 116.66 111.11 1yl1 n ARG 73 Ca 0.05 -0.10 -0.29 0.00 -0.00 0.00 0.00 57.85 57.50 1yl1 n ARG 73 Cb 0.53 -1.56 0.00 0.00 0.00 0.00 0.00 32.46 31.44 1yl1 n ARG 73 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.63 175.92 1yl1 n ASN 74 N -2.13 -2.22 0.27 6.15 2.85 -1.06 -4.87 115.26 114.26 1yl1 n ASN 74 Ca -0.01 -1.03 0.11 0.00 -0.11 0.00 0.00 54.58 53.53 1yl1 n ASN 74 Cb 0.51 -3.05 0.73 0.00 1.24 0.00 0.00 39.78 39.21 1yl1 n ASN 74 CO 0.00 0.00 0.00 -0.07 -2.11 0.00 0.00 177.26 175.08 1yl1 h LEU 75 N -1.92 0.00 -1.00 1.20 -0.00 0.19 -1.46 115.31 112.33 1yl1 h LEU 75 Ca -0.65 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.23 1yl1 h LEU 75 Cb 1.37 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 42.03 1yl1 h LEU 75 CO 0.57 0.01 0.00 0.00 -0.00 0.00 0.00 178.44 179.02 1yl1 n ASN 77 N 0.21 -5.09 -3.55 0.00 5.15 -0.55 -4.99 115.26 106.43 1yl1 n ASN 77 Ca 0.18 -1.08 -0.17 0.00 -0.60 0.00 0.00 54.58 52.91 1yl1 n ASN 77 Cb 0.35 -2.97 -0.06 0.00 -0.53 0.00 0.00 39.78 36.56 1yl1 n ASN 77 CO 0.00 0.00 0.00 -0.51 1.40 0.00 0.00 177.26 178.15 1yl1 s ILE 78 N -3.46 0.01 0.26 -1.44 2.07 -1.26 -5.09 121.20 112.28 1yl1 s ILE 78 Ca 0.47 -0.07 -0.30 0.00 -1.41 0.00 0.00 60.65 59.35 1yl1 s ILE 78 Cb -0.19 -0.95 -0.09 0.00 0.13 0.00 0.00 42.46 41.36 1yl1 s ILE 78 CO 0.89 -0.04 1.18 -2.84 -1.91 0.00 0.00 174.94 172.22 1yl1 s PRO 79 N -1.20 4.53 0.52 3.50 0.02 -1.26 -2.12 135.00 138.99 1yl1 s PRO 79 Ca -0.11 1.92 0.23 0.00 0.02 0.00 0.00 61.00 63.06 1yl1 s PRO 79 Cb -0.01 -3.18 1.36 0.00 0.02 0.00 0.00 34.50 32.69 1yl1 s PRO 79 CO 0.09 0.02 2.02 0.00 -0.33 0.00 0.00 177.00 178.80 1yl1 h SER 81 N 0.02 0.00 0.46 0.00 4.64 -1.90 -0.63 113.55 116.14 1yl1 h SER 81 Ca 0.22 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.53 1yl1 h SER 81 Cb 0.85 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.94 1yl1 h SER 81 CO -0.01 0.03 -0.06 0.00 -0.87 0.00 0.00 176.83 175.92 1yl1 h ALA 82 N 1.97 1.13 0.00 5.18 0.00 -1.51 -1.80 119.26 124.23 1yl1 h ALA 82 Ca -0.00 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1yl1 h ALA 82 Cb 0.06 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1yl1 h ALA 82 CO 0.00 0.07 0.00 1.28 0.00 0.00 0.00 179.25 180.61 1yl1 n LEU 83 N -3.35 0.00 -0.86 0.00 4.77 -0.24 -3.18 117.00 114.14 1yl1 n LEU 83 Ca -0.01 0.05 0.09 0.00 -0.03 0.00 0.00 56.01 56.10 1yl1 n LEU 83 Cb 0.22 -0.05 0.14 0.00 -2.33 0.00 0.00 43.42 41.40 1yl1 n LEU 83 CO 0.27 -0.00 0.61 0.18 -1.33 0.00 0.00 177.39 177.11 1yl1 n LEU 84 N -1.05 2.90 -4.75 2.23 4.77 -0.68 -3.85 117.00 116.58 1yl1 n LEU 84 Ca 0.22 -1.36 -0.33 0.00 -0.03 0.00 0.00 56.01 54.52 1yl1 n LEU 84 Cb 0.13 -0.14 0.07 0.00 -2.33 0.00 0.00 43.42 41.15 1yl1 n LEU 84 CO 0.19 0.60 0.74 -0.55 -1.33 0.00 0.00 177.39 177.04 1yl1 s SER 85 N -1.35 4.69 0.45 -1.43 0.15 -1.19 -4.29 113.70 110.73 1yl1 s SER 85 Ca 0.28 2.05 0.24 0.00 0.70 0.00 0.00 55.95 59.22 1yl1 s SER 85 Cb 0.17 -2.55 1.02 0.00 -1.71 0.00 0.00 66.02 62.95 1yl1 s SER 85 CO 0.24 -1.92 1.88 0.77 1.20 0.00 0.00 173.24 175.41 1yl1 h SER 86 N -0.35 0.00 -3.56 5.45 4.64 -1.93 -3.39 113.55 114.41 1yl1 h SER 86 Ca -0.46 0.00 -0.63 0.00 -0.47 0.00 0.00 61.79 60.23 1yl1 h SER 86 Cb 1.25 0.00 -0.13 0.00 -0.31 0.00 0.00 62.40 63.21 1yl1 h SER 86 CO 0.52 0.22 0.18 -0.62 -0.87 0.00 0.00 176.83 176.26 1yl1 s ASP 87 N -6.22 6.44 0.00 4.97 2.15 -1.26 -4.94 116.67 117.82 1yl1 s ASP 87 Ca -0.00 0.17 0.26 0.00 0.43 0.00 0.00 52.55 53.40 1yl1 s ASP 87 Cb 0.11 -2.34 1.55 0.00 -0.30 0.00 0.00 42.92 41.94 1yl1 s ASP 87 CO 0.63 -0.62 1.92 2.30 -0.17 0.00 0.00 175.17 179.23 1yl1 n ILE 88 N 5.63 0.00 -0.23 4.11 -5.35 -1.26 -4.30 119.36 117.95 1yl1 n ILE 88 Ca -0.00 0.00 -0.03 0.00 -0.27 0.00 0.00 62.75 62.45 1yl1 n ILE 88 Cb 0.48 -0.54 0.04 0.00 -1.74 0.00 0.00 39.64 37.89 1yl1 n ILE 88 CO 0.00 0.00 0.00 0.74 -1.76 0.00 0.00 176.55 175.53 1yl1 h THR 89 N 0.00 0.20 -0.58 7.28 2.02 -1.94 -0.18 112.91 119.71 1yl1 h THR 89 Ca 0.00 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.19 1yl1 h THR 89 Cb 0.00 0.20 -0.03 0.00 -1.74 0.00 0.00 68.15 66.58 1yl1 h THR 89 CO 0.00 0.00 0.39 0.00 0.37 0.00 0.00 175.52 176.28 1yl1 h ALA 90 N 1.29 0.74 -0.61 6.16 0.00 -1.87 -0.82 119.26 124.16 1yl1 h ALA 90 Ca 0.28 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 55.10 1yl1 h ALA 90 Cb 0.55 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 18.08 1yl1 h ALA 90 CO -0.72 0.17 0.15 0.77 0.00 0.00 0.00 179.25 179.62 1yl1 h SER 91 N 0.79 0.89 -0.30 0.00 0.02 -1.59 -2.05 113.55 111.31 1yl1 h SER 91 Ca 0.22 -0.17 -0.08 0.00 -0.84 0.00 0.00 61.79 60.92 1yl1 h SER 91 Cb -0.08 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.21 1yl1 h SER 91 CO -0.05 0.87 -0.11 0.58 -1.14 0.00 0.00 176.83 176.98 1yl1 h VAL 92 N 0.91 1.29 -0.84 2.27 2.07 -0.64 -0.59 116.25 120.72 1yl1 h VAL 92 Ca 0.20 -1.18 -0.02 0.00 0.82 0.00 0.00 66.70 66.52 1yl1 h VAL 92 Cb 0.32 1.43 -0.04 0.00 -1.52 0.00 0.00 31.29 31.48 1yl1 h VAL 92 CO -0.00 0.38 0.45 0.78 0.02 0.00 0.00 177.57 179.20 1yl1 h ASN 93 N 0.36 1.07 0.12 0.57 -0.26 -1.01 -1.94 115.58 114.49 1yl1 h ASN 93 Ca 0.07 -0.11 -0.18 0.00 -0.56 0.00 0.00 56.30 55.52 1yl1 h ASN 93 Cb 0.62 -0.27 -0.00 0.00 -1.06 0.00 0.00 38.32 37.60 1yl1 h ASN 93 CO 0.04 0.87 -0.67 0.00 -1.06 0.00 0.00 177.43 176.60 1yl1 h ALA 95 N 0.89 1.21 -0.26 0.00 0.00 -0.79 -1.40 119.26 118.92 1yl1 h ALA 95 Ca -0.02 -0.16 -0.05 0.00 0.00 0.00 0.00 54.91 54.68 1yl1 h ALA 95 Cb 1.24 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.74 1yl1 h ALA 95 CO 0.12 0.59 -0.04 0.87 0.00 0.00 0.00 179.25 180.79 1yl1 h LYS 96 N 1.01 0.40 -0.20 0.00 1.57 -1.30 0.34 116.57 118.39 1yl1 h LYS 96 Ca 0.24 -0.08 -0.12 0.00 -1.87 0.00 0.00 60.65 58.82 1yl1 h LYS 96 Cb 0.15 -0.06 -0.00 0.00 0.08 0.00 0.00 32.23 32.40 1yl1 h LYS 96 CO -0.03 0.47 -0.33 -0.22 -0.57 0.00 0.00 179.45 178.77 1yl1 h LYS 97 N 0.39 0.57 0.09 3.15 1.63 -1.31 -2.95 116.57 118.13 1yl1 h LYS 97 Ca 0.08 -0.35 -0.00 0.00 -0.85 0.00 0.00 60.65 59.53 1yl1 h LYS 97 Cb 0.33 0.04 0.00 0.00 -0.60 0.00 0.00 32.23 31.99 1yl1 h LYS 97 CO 0.01 0.96 -0.04 0.82 -3.45 0.00 0.00 179.45 177.75 1yl1 h ILE 98 N 0.24 1.00 0.00 2.00 2.04 -0.80 -2.60 117.51 119.40 1yl1 h ILE 98 Ca 0.02 -0.32 -0.01 0.00 1.00 0.00 0.00 64.86 65.55 1yl1 h ILE 98 Cb 0.92 1.21 -0.00 0.00 -0.74 0.00 0.00 36.82 38.21 1yl1 h ILE 98 CO 0.07 0.08 -0.03 1.62 0.00 0.00 0.00 178.15 179.90 1yl1 h VAL 99 N -0.26 0.14 0.00 1.67 3.04 -1.02 -0.31 116.25 119.51 1yl1 h VAL 99 Ca -0.01 -0.32 0.00 0.00 -1.01 0.00 0.00 66.70 65.36 1yl1 h VAL 99 Cb 0.22 1.27 0.00 0.00 -2.01 0.00 0.00 31.29 30.77 1yl1 h VAL 99 CO 0.02 0.03 -0.44 0.28 -1.01 0.00 0.00 177.57 176.45 1yl1 h SER 100 N 0.00 0.00 0.00 3.17 0.02 -1.35 -3.32 113.55 112.07 1yl1 h SER 100 Ca -0.00 -0.10 0.00 0.00 -0.84 0.00 0.00 61.79 60.85 1yl1 h SER 100 Cb 0.27 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.81 1yl1 h SER 100 CO 0.00 0.05 0.00 -0.67 -1.14 0.00 0.00 176.83 175.08 1yl1 n ASP 101 N -2.35 0.00 0.00 3.07 4.64 -0.12 -4.86 116.55 116.93 1yl1 n ASP 101 Ca 0.04 0.85 0.00 0.00 -1.38 0.00 0.00 54.79 54.30 1yl1 n ASP 101 Cb 0.46 -0.39 0.00 0.00 -1.04 0.00 0.00 41.12 40.15 1yl1 n ASP 101 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 1yl1 n GLY 102 N -0.99 0.06 1.00 0.27 0.00 -1.26 -4.97 105.19 99.29 1yl1 n GLY 102 Ca 0.00 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.10 1yl1 n GLY 102 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1yl1 n ASN 103 N 0.00 3.54 0.00 1.61 3.02 -1.26 -5.07 115.26 117.09 1yl1 n ASN 103 Ca 0.00 -2.11 0.00 0.00 -0.03 0.00 0.00 54.58 52.44 1yl1 n ASN 103 Cb 0.00 -0.38 0.00 0.00 -0.61 0.00 0.00 39.78 38.79 1yl1 n ASN 103 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1yl1 n GLY 104 N 0.89 2.03 0.00 7.41 0.00 -1.25 -2.24 105.19 112.03 1yl1 n GLY 104 Ca 0.18 -0.46 0.10 0.00 0.00 0.00 0.00 46.02 45.84 1yl1 n GLY 104 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1yl1 n MET 105 N 7.91 0.44 0.09 1.61 2.81 -1.26 -2.78 117.12 125.95 1yl1 n MET 105 Ca 0.00 0.06 0.09 0.00 -1.81 0.00 0.00 57.70 56.04 1yl1 n MET 105 Cb 0.00 -1.50 0.41 0.00 -0.71 0.00 0.00 33.22 31.42 1yl1 n MET 105 CO 0.00 0.00 0.00 0.09 1.51 0.00 0.00 175.97 177.57 1yl1 n ASN 106 N -1.16 0.41 0.27 7.83 3.02 -0.95 -1.34 115.26 123.34 1yl1 n ASN 106 Ca 0.12 0.63 0.13 0.00 -0.03 0.00 0.00 54.58 55.43 1yl1 n ASN 106 Cb 0.12 -0.71 0.77 0.00 -0.61 0.00 0.00 39.78 39.35 1yl1 n ASN 106 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1yl1 h ALA 107 N 2.20 1.44 -2.31 5.41 0.00 -1.68 -3.37 119.26 120.93 1yl1 h ALA 107 Ca 0.00 -0.07 -0.71 0.00 0.00 0.00 0.00 54.91 54.13 1yl1 h ALA 107 Cb 0.19 -0.01 -0.20 0.00 0.00 0.00 0.00 17.79 17.76 1yl1 h ALA 107 CO 0.00 0.10 -0.22 -1.58 0.00 0.00 0.00 179.25 177.55 1yl1 s TRP 108 N -4.43 3.18 0.32 0.00 0.51 -0.45 -4.97 118.94 113.10 1yl1 s TRP 108 Ca -0.04 -0.59 0.04 0.00 -2.12 0.00 0.00 56.10 53.39 1yl1 s TRP 108 Cb 0.14 -3.06 0.64 0.00 -0.81 0.00 0.00 33.47 30.38 1yl1 s TRP 108 CO 0.59 -0.78 1.88 -0.24 -0.51 0.00 0.00 176.95 177.89 1yl1 h VAL 109 N 5.75 0.95 -0.11 4.03 3.04 -1.85 -1.49 116.25 126.57 1yl1 h VAL 109 Ca -0.27 -0.31 -0.11 0.00 -1.01 0.00 0.00 66.70 65.00 1yl1 h VAL 109 Cb 1.11 -0.02 -0.01 0.00 -2.01 0.00 0.00 31.29 30.35 1yl1 h VAL 109 CO 0.84 0.16 -0.43 0.00 -1.01 0.00 0.00 177.57 177.14 1yl1 h ALA 110 N 1.55 1.07 -0.33 3.17 0.00 -1.93 -1.71 119.26 121.08 1yl1 h ALA 110 Ca 0.43 -0.43 -0.10 0.00 0.00 0.00 0.00 54.91 54.81 1yl1 h ALA 110 Cb 0.44 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 1yl1 h ALA 110 CO -0.19 0.61 -0.20 2.35 0.00 0.00 0.00 179.25 181.82 1yl1 h TRP 111 N 0.21 0.84 -0.19 0.00 7.01 -1.60 0.20 115.95 122.41 1yl1 h TRP 111 Ca 0.02 -0.22 -0.01 0.00 2.11 0.00 0.00 58.89 60.79 1yl1 h TRP 111 Cb 0.85 -0.19 -0.01 0.00 -2.10 0.00 0.00 29.16 27.71 1yl1 h TRP 111 CO 0.02 0.94 0.09 0.00 -2.79 0.00 0.00 178.44 176.70 1yl1 h ARG 112 N 0.49 0.27 0.00 2.65 3.08 -1.19 0.41 114.38 120.09 1yl1 h ARG 112 Ca 0.07 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.08 1yl1 h ARG 112 Cb 0.74 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.75 1yl1 h ARG 112 CO 0.06 0.30 -0.36 -0.91 -1.07 0.00 0.00 179.97 177.99 1yl1 h ASN 113 N 0.17 0.00 0.00 7.04 2.35 -1.31 -3.37 115.58 120.46 1yl1 h ASN 113 Ca 0.06 -0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.80 1yl1 h ASN 113 Cb 0.12 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.49 1yl1 h ASN 113 CO -0.01 0.01 -0.11 0.54 -1.65 0.00 0.00 177.43 176.21 1yl1 n ARG 114 N -2.86 4.07 -0.02 0.81 1.74 0.70 -4.91 116.66 116.19 1yl1 n ARG 114 Ca 0.03 0.00 -0.04 0.00 -0.77 0.00 0.00 57.85 57.06 1yl1 n ARG 114 Cb 0.53 -0.41 -0.02 0.00 -1.02 0.00 0.00 32.46 31.54 1yl1 n ARG 114 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1yl1 n LYS 116 N -3.09 1.08 -1.00 0.00 4.81 0.13 -1.14 118.16 118.95 1yl1 n LYS 116 Ca -0.09 0.39 0.00 0.00 -0.87 0.00 0.00 58.31 57.74 1yl1 n LYS 116 Cb 0.57 -2.03 0.00 0.00 0.02 0.00 0.00 35.03 33.58 1yl1 n LYS 116 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1yl1 n GLY 117 N 2.82 0.81 3.89 3.14 0.00 -1.26 -4.95 105.19 109.64 1yl1 n GLY 117 Ca 0.20 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 46.00 1yl1 n GLY 117 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1yl1 s THR 118 N -3.23 2.38 -1.21 2.61 -4.23 -0.29 -5.01 115.64 106.67 1yl1 s THR 118 Ca 0.00 -1.37 -0.20 0.00 -1.18 0.00 0.00 61.69 58.94 1yl1 s THR 118 Cb 0.00 -2.75 0.03 0.00 1.34 0.00 0.00 72.50 71.12 1yl1 s THR 118 CO 0.00 0.00 1.73 -0.62 -0.54 0.00 0.00 174.62 175.19 1yl1 s ASP 119 N -4.19 6.35 0.60 3.99 2.15 -1.26 -4.76 116.67 119.55 1yl1 s ASP 119 Ca 0.46 -2.03 0.38 0.00 0.43 0.00 0.00 52.55 51.79 1yl1 s ASP 119 Cb -0.03 -2.58 1.81 0.00 -0.30 0.00 0.00 42.92 41.83 1yl1 s ASP 119 CO 0.27 -1.67 2.15 -0.37 -0.17 0.00 0.00 175.17 175.38 1yl1 h VAL 120 N 6.00 0.04 0.00 1.11 -1.51 -1.90 -2.53 116.25 117.46 1yl1 h VAL 120 Ca 0.34 -0.31 -0.00 0.00 -1.23 0.00 0.00 66.70 65.50 1yl1 h VAL 120 Cb 0.92 1.29 -0.00 0.00 -2.13 0.00 0.00 31.29 31.37 1yl1 h VAL 120 CO 1.40 0.01 -0.01 1.56 -1.23 0.00 0.00 177.57 179.30 1yl1 h GLN 121 N 0.00 0.00 -0.07 5.19 4.20 -1.88 -1.48 115.11 121.07 1yl1 h GLN 121 Ca -0.00 0.00 0.02 0.00 0.06 0.00 0.00 58.65 58.73 1yl1 h GLN 121 Cb 0.29 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.07 1yl1 h GLN 121 CO 0.00 0.01 0.09 0.00 -0.67 0.00 0.00 178.83 178.26 1yl1 h ALA 122 N 1.99 1.56 0.00 3.87 0.00 -1.85 -1.99 119.26 122.83 1yl1 h ALA 122 Ca -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1yl1 h ALA 122 Cb 0.02 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.81 1yl1 h ALA 122 CO 0.00 -0.12 0.00 -1.49 0.00 0.00 0.00 179.25 177.64 1yl1 h TRP 123 N 0.00 0.00 -0.06 0.00 4.06 -1.48 -3.17 115.95 115.30 1yl1 h TRP 123 Ca 0.03 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.98 1yl1 h TRP 123 Cb 0.20 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.36 1yl1 h TRP 123 CO 0.00 0.00 0.00 0.44 -3.56 0.00 0.00 178.44 175.32 1yl1 n ILE 124 N -2.41 0.78 -2.24 1.49 -0.00 -0.76 -4.83 119.36 111.38 1yl1 n ILE 124 Ca 0.03 -0.89 -0.40 0.00 -0.00 0.00 0.00 62.75 61.50 1yl1 n ILE 124 Cb 0.33 0.62 -0.02 0.00 -0.00 0.00 0.00 39.64 40.57 1yl1 n ILE 124 CO 0.00 0.00 0.00 -0.13 -0.00 0.00 0.00 176.55 176.42 1yl1 s ARG 125 N -0.82 4.26 0.00 6.28 0.52 -1.15 -2.56 118.95 125.48 1yl1 s ARG 125 Ca 0.05 2.00 0.00 0.00 -0.52 0.00 0.00 55.73 57.25 1yl1 s ARG 125 Cb 0.02 -2.92 0.00 0.00 0.52 0.00 0.00 34.95 32.57 1yl1 s ARG 125 CO 0.03 -0.19 0.00 0.41 0.02 0.00 0.00 175.30 175.57 1yl1 n GLY 126 N 0.80 2.22 3.82 -3.53 0.00 -1.26 -5.02 105.19 102.23 1yl1 n GLY 126 Ca 0.02 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.69 1yl1 n GLY 126 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yl1 s ARG 128 N -2.55 3.84 0.00 0.00 3.52 -1.26 -5.13 118.95 117.38 1yl1 s ARG 128 Ca 0.51 -2.55 0.19 0.00 -0.13 0.00 0.00 55.73 53.75 1yl1 s ARG 128 Cb -0.13 -4.66 0.15 0.00 -1.56 0.00 0.00 34.95 28.76 1yl1 s ARG 128 CO 0.19 -1.44 1.12 1.28 -0.81 0.00 0.00 175.30 175.63