#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1l6p n ALA 5 N 0.00 -3.69 -1.73 -1.67 0.00 -1.26 -4.81 120.51 107.36 1l6p n ALA 5 Ca 0.00 -0.51 -0.39 0.00 0.00 0.00 0.00 53.44 52.55 1l6p n ALA 5 Cb 0.00 -1.48 0.04 0.00 0.00 0.00 0.00 19.45 18.01 1l6p n ALA 5 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1l6p n PRO 6 N 0.62 1.60 -3.48 0.00 -0.04 -1.26 -3.39 135.00 129.06 1l6p n PRO 6 Ca 0.04 0.59 -0.25 0.00 -0.04 0.00 0.00 63.50 63.84 1l6p n PRO 6 Cb 0.53 -2.52 0.02 0.00 -0.04 0.00 0.00 33.50 31.49 1l6p n PRO 6 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1l6p n GLY 7 N 0.82 -0.75 0.00 0.55 0.00 -1.26 -4.92 105.19 99.62 1l6p n GLY 7 Ca 0.11 0.88 0.00 0.00 0.00 0.00 0.00 46.02 47.01 1l6p n GLY 7 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1l6p n ARG 8 N -1.32 2.28 -0.49 1.61 1.74 -1.22 -4.68 116.66 114.58 1l6p n ARG 8 Ca -0.14 0.00 0.11 0.00 -0.77 0.00 0.00 57.85 57.05 1l6p n ARG 8 Cb 0.64 -0.82 0.34 0.00 -1.02 0.00 0.00 32.46 31.60 1l6p n ARG 8 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 1l6p n SER 9 N -1.11 4.35 0.08 0.55 3.41 -1.26 -4.55 113.62 115.10 1l6p n SER 9 Ca 0.00 -2.23 0.13 0.00 -0.26 0.00 0.00 58.87 56.51 1l6p n SER 9 Cb 0.09 -0.53 0.45 0.00 -0.26 0.00 0.00 64.21 63.96 1l6p n SER 9 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1l6p n GLN 10 N 1.36 0.21 -2.05 4.33 1.13 -1.26 -4.33 117.38 116.77 1l6p n GLN 10 Ca 0.25 0.18 -0.42 0.00 -1.94 0.00 0.00 57.00 55.06 1l6p n GLN 10 Cb 0.76 -1.75 0.00 0.00 0.11 0.00 0.00 30.24 29.36 1l6p n GLN 10 CO 0.00 0.00 0.00 0.34 -1.44 0.00 0.00 177.06 175.96 1l6p n PHE 11 N -2.11 3.66 -2.46 1.08 7.35 -1.26 -4.95 117.46 118.77 1l6p n PHE 11 Ca 0.06 -2.94 -0.27 0.00 -0.76 0.00 0.00 57.45 53.54 1l6p n PHE 11 Cb 0.41 -2.42 0.02 0.00 0.35 0.00 0.00 39.48 37.84 1l6p n PHE 11 CO 0.00 0.00 0.00 0.14 -0.76 0.00 0.00 176.76 176.14 1l6p s VAL 12 N 2.67 3.89 0.27 -2.13 -7.23 -1.26 -5.01 120.40 111.61 1l6p s VAL 12 Ca 0.46 0.02 -0.28 0.00 -1.81 0.00 0.00 61.98 60.37 1l6p s VAL 12 Cb 0.11 -3.53 -0.15 0.00 0.56 0.00 0.00 36.38 33.37 1l6p s VAL 12 CO -0.04 -0.53 0.92 -2.65 -0.31 0.00 0.00 175.10 172.49 1l6p n PRO 13 N -2.51 1.09 -0.07 4.82 -0.02 -1.26 -4.77 135.00 132.29 1l6p n PRO 13 Ca 0.04 0.38 0.13 0.00 -2.02 0.00 0.00 63.50 62.03 1l6p n PRO 13 Cb 0.57 -1.69 0.52 0.00 -0.02 0.00 0.00 33.50 32.88 1l6p n PRO 13 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1l6p h ALA 14 N 1.84 2.06 0.00 3.55 0.00 -1.96 0.23 119.26 124.97 1l6p h ALA 14 Ca -0.37 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.52 1l6p h ALA 14 Cb 1.36 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.08 1l6p h ALA 14 CO 0.60 -0.19 0.00 -0.25 0.00 0.00 0.00 179.25 179.41 1l6p n ASP 15 N -4.46 0.41 0.08 0.00 8.00 -1.26 -1.09 116.55 118.23 1l6p n ASP 15 Ca 0.09 0.57 -0.20 0.00 0.71 0.00 0.00 54.79 55.96 1l6p n ASP 15 Cb 0.39 -0.67 -0.15 0.00 -0.02 0.00 0.00 41.12 40.67 1l6p n ASP 15 CO 0.00 0.00 0.00 1.56 -0.39 0.00 0.00 177.20 178.37 1l6p h GLN 16 N 0.00 0.35 -0.46 -1.24 4.20 -1.30 -3.18 115.11 113.48 1l6p h GLN 16 Ca 0.00 -0.60 -0.11 0.00 0.06 0.00 0.00 58.65 58.00 1l6p h GLN 16 Cb 0.46 0.22 -0.01 0.00 0.30 0.00 0.00 27.48 28.45 1l6p h GLN 16 CO 0.00 1.25 -0.14 0.00 -0.67 0.00 0.00 178.83 179.26 1l6p h ALA 17 N 0.31 0.64 -2.98 3.87 0.00 -1.00 -3.41 119.26 116.70 1l6p h ALA 17 Ca -0.28 -0.35 -0.61 0.00 0.00 0.00 0.00 54.91 53.67 1l6p h ALA 17 Cb 2.07 -0.16 -0.40 0.00 0.00 0.00 0.00 17.79 19.30 1l6p h ALA 17 CO 0.19 0.57 -0.74 -0.06 0.00 0.00 0.00 179.25 179.21 1l6p s PHE 18 N -4.75 1.97 -0.50 0.00 0.08 -0.25 -1.07 117.98 113.47 1l6p s PHE 18 Ca -0.12 -2.42 -0.26 0.00 0.12 0.00 0.00 56.93 54.25 1l6p s PHE 18 Cb 0.11 -1.88 0.03 0.00 -0.57 0.00 0.00 43.02 40.72 1l6p s PHE 18 CO 0.85 -0.78 1.00 0.00 -0.10 0.00 0.00 175.22 176.19 1l6p s ALA 19 N 0.36 3.17 -0.11 5.36 0.00 -0.12 -4.44 121.76 125.98 1l6p s ALA 19 Ca 0.18 -0.85 -0.12 0.00 0.00 0.00 0.00 51.96 51.17 1l6p s ALA 19 Cb -0.24 -3.76 -0.05 0.00 0.00 0.00 0.00 23.12 19.07 1l6p s ALA 19 CO 0.00 -2.25 0.29 0.12 0.00 0.00 0.00 175.76 173.92 1l6p s PHE 20 N 4.08 3.57 0.24 0.00 5.36 -1.26 -0.11 117.98 129.85 1l6p s PHE 20 Ca 0.38 0.69 -0.12 0.00 -0.96 0.00 0.00 56.93 56.92 1l6p s PHE 20 Cb -0.10 -2.23 -0.01 0.00 -0.34 0.00 0.00 43.02 40.34 1l6p s PHE 20 CO 0.26 0.47 0.44 0.34 -1.46 0.00 0.00 175.22 175.26 1l6p s ASP 21 N -0.32 -0.07 0.09 6.13 -1.08 -0.07 -5.01 116.67 116.34 1l6p s ASP 21 Ca 0.18 -0.95 -0.09 0.00 -0.52 0.00 0.00 52.55 51.17 1l6p s ASP 21 Cb -0.14 0.56 0.00 0.00 -1.46 0.00 0.00 42.92 41.88 1l6p s ASP 21 CO 0.07 -1.10 0.20 0.72 0.52 0.00 0.00 175.17 175.58 1l6p s PHE 22 N -4.02 0.14 -0.08 -5.34 -0.71 -1.26 -0.83 117.98 105.88 1l6p s PHE 22 Ca 0.23 -0.56 -0.04 0.00 -1.04 0.00 0.00 56.93 55.52 1l6p s PHE 22 Cb 0.00 -0.04 0.04 0.00 -1.21 0.00 0.00 43.02 41.81 1l6p s PHE 22 CO 0.08 -0.56 0.18 -0.65 -1.34 0.00 0.00 175.22 172.93 1l6p s GLN 23 N -3.86 0.13 -0.05 1.99 1.11 -0.47 -4.99 119.66 113.51 1l6p s GLN 23 Ca 0.05 0.43 0.06 0.00 0.01 0.00 0.00 55.36 55.91 1l6p s GLN 23 Cb 0.05 -0.16 -0.01 0.00 -1.01 0.00 0.00 33.01 31.87 1l6p s GLN 23 CO -0.11 -0.17 -0.24 -1.14 0.01 0.00 0.00 175.29 173.64 1l6p s GLN 24 N 1.23 2.45 -0.41 2.91 0.74 -1.26 -0.50 119.66 124.81 1l6p s GLN 24 Ca -0.09 -0.90 0.02 0.00 0.05 0.00 0.00 55.36 54.44 1l6p s GLN 24 Cb -0.11 -2.15 0.13 0.00 1.10 0.00 0.00 33.01 31.97 1l6p s GLN 24 CO -0.07 0.44 0.20 1.21 -0.55 0.00 0.00 175.29 176.52 1l6p s ASN 25 N -0.30 3.79 1.45 6.67 3.84 0.65 -5.01 114.94 126.03 1l6p s ASN 25 Ca 0.01 -2.43 0.00 0.00 0.21 0.00 0.00 52.86 50.65 1l6p s ASN 25 Cb -0.13 -1.05 0.00 0.00 -0.55 0.00 0.00 41.25 39.53 1l6p s ASN 25 CO 0.02 -0.30 0.00 0.00 -2.79 0.00 0.00 177.10 174.03 1l6p n GLN 26 N 3.81 0.00 0.00 0.43 1.13 -1.26 -1.14 117.38 120.35 1l6p n GLN 26 Ca 0.06 0.00 0.15 0.00 -1.94 0.00 0.00 57.00 55.27 1l6p n GLN 26 Cb 0.36 0.00 0.77 0.00 0.11 0.00 0.00 30.24 31.48 1l6p n GLN 26 CO 0.00 0.00 0.00 0.72 -1.44 0.00 0.00 177.06 176.34 1l6p n HIS 27 N 7.48 0.00 -3.75 1.08 8.25 -1.26 -4.74 115.22 122.28 1l6p n HIS 27 Ca 0.00 0.00 -0.37 0.00 -0.26 0.00 0.00 57.72 57.09 1l6p n HIS 27 Cb 0.00 -0.26 -0.13 0.00 1.12 0.00 0.00 29.99 30.72 1l6p n HIS 27 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1l6p s ASP 28 N -2.52 5.13 -0.10 0.41 1.01 -0.30 -0.20 116.67 120.10 1l6p s ASP 28 Ca 0.30 -0.47 0.01 0.00 0.71 0.00 0.00 52.55 53.10 1l6p s ASP 28 Cb 0.20 -1.91 -0.02 0.00 1.01 0.00 0.00 42.92 42.21 1l6p s ASP 28 CO 0.45 -0.12 -0.14 -0.22 0.21 0.00 0.00 175.17 175.34 1l6p s LEU 29 N 1.56 2.68 -0.17 1.23 2.96 0.11 -0.25 118.68 126.80 1l6p s LEU 29 Ca 0.05 -0.30 -0.01 0.00 -0.22 0.00 0.00 54.13 53.64 1l6p s LEU 29 Cb -0.16 -1.58 -0.01 0.00 0.50 0.00 0.00 46.19 44.94 1l6p s LEU 29 CO 0.03 0.22 -0.11 0.21 -1.32 0.00 0.00 176.35 175.38 1l6p s ASN 30 N 0.02 3.97 -0.11 3.68 2.47 0.34 0.41 114.94 125.73 1l6p s ASN 30 Ca -0.05 -0.40 -0.04 0.00 0.42 0.00 0.00 52.86 52.79 1l6p s ASN 30 Cb -0.14 -1.63 -0.04 0.00 -1.45 0.00 0.00 41.25 37.99 1l6p s ASN 30 CO 0.04 0.08 0.06 -0.76 -3.72 0.00 0.00 177.10 172.80 1l6p s LEU 31 N 0.86 3.87 -0.02 3.21 1.43 0.32 -1.37 118.68 126.98 1l6p s LEU 31 Ca -0.03 0.23 0.02 0.00 -1.03 0.00 0.00 54.13 53.32 1l6p s LEU 31 Cb -0.15 -1.92 -0.00 0.00 0.03 0.00 0.00 46.19 44.15 1l6p s LEU 31 CO 0.00 0.35 -0.08 -0.89 0.23 0.00 0.00 176.35 175.97 1l6p s THR 32 N -0.69 0.64 -0.13 5.49 2.01 -0.01 -0.66 115.64 122.29 1l6p s THR 32 Ca 0.12 -0.31 0.02 0.00 0.31 0.00 0.00 61.69 61.83 1l6p s THR 32 Cb -0.12 -0.56 0.01 0.00 0.01 0.00 0.00 72.50 71.84 1l6p s THR 32 CO 0.02 0.20 -0.19 0.26 -0.69 0.00 0.00 174.62 174.22 1l6p s TRP 33 N 0.05 2.43 -0.15 4.92 0.51 0.35 -0.89 118.94 126.15 1l6p s TRP 33 Ca -0.00 -1.21 -0.20 0.00 -2.12 0.00 0.00 56.10 52.56 1l6p s TRP 33 Cb -0.06 -1.68 -0.03 0.00 -0.81 0.00 0.00 33.47 30.89 1l6p s TRP 33 CO -0.00 -0.58 0.57 -0.65 -0.51 0.00 0.00 176.95 175.78 1l6p s GLN 34 N 0.91 4.29 -0.29 4.98 -0.21 0.84 -1.14 119.66 129.04 1l6p s GLN 34 Ca -0.06 0.57 -0.02 0.00 0.02 0.00 0.00 55.36 55.87 1l6p s GLN 34 Cb -0.15 -3.51 0.04 0.00 1.00 0.00 0.00 33.01 30.39 1l6p s GLN 34 CO -0.02 -0.04 -0.01 0.42 -2.12 0.00 0.00 175.29 173.51 1l6p s ILE 35 N 1.26 2.97 0.47 1.08 1.01 -0.18 -0.95 121.20 126.87 1l6p s ILE 35 Ca 0.28 -1.29 -0.22 0.00 0.00 0.00 0.00 60.65 59.42 1l6p s ILE 35 Cb -0.16 -2.66 -0.09 0.00 0.01 0.00 0.00 42.46 39.55 1l6p s ILE 35 CO 0.11 -0.03 0.90 1.17 0.00 0.00 0.00 174.94 177.09 1l6p n LYS 36 N 4.64 1.10 -1.72 2.79 4.81 -0.23 -3.49 118.16 126.06 1l6p n LYS 36 Ca -0.14 0.40 -0.43 0.00 -0.87 0.00 0.00 58.31 57.28 1l6p n LYS 36 Cb 0.44 -1.97 -0.03 0.00 0.02 0.00 0.00 35.03 33.49 1l6p n LYS 36 CO 0.00 0.00 0.00 -3.47 1.17 0.00 0.00 177.40 175.10 1l6p n ASP 37 N 0.35 3.78 0.00 3.14 2.03 -1.26 -1.84 116.55 122.75 1l6p n ASP 37 Ca 0.11 1.10 0.00 0.00 0.52 0.00 0.00 54.79 56.51 1l6p n ASP 37 Cb 0.42 -1.56 0.00 0.00 -0.72 0.00 0.00 41.12 39.26 1l6p n ASP 37 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1l6p n GLY 38 N 3.16 0.76 3.19 0.27 0.00 -1.26 -5.05 105.19 106.26 1l6p n GLY 38 Ca 0.13 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.02 1l6p n GLY 38 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1l6p s TYR 39 N -2.15 1.07 0.04 1.61 1.51 -0.76 -0.78 117.35 117.89 1l6p s TYR 39 Ca 0.00 -0.76 -0.21 0.00 -1.01 0.00 0.00 57.07 55.09 1l6p s TYR 39 Cb 0.00 -0.58 0.05 0.00 -0.11 0.00 0.00 41.96 41.32 1l6p s TYR 39 CO 0.00 -0.02 0.49 1.52 -1.11 0.00 0.00 175.55 176.43 1l6p s TYR 40 N -3.04 -0.38 -0.09 2.71 -0.85 -0.22 -4.64 117.35 110.84 1l6p s TYR 40 Ca 0.10 0.43 -0.07 0.00 -0.52 0.00 0.00 57.07 57.01 1l6p s TYR 40 Cb 0.01 0.30 -0.04 0.00 0.38 0.00 0.00 41.96 42.61 1l6p s TYR 40 CO -0.01 -0.61 0.16 -0.51 -1.52 0.00 0.00 175.55 173.06 1l6p s LEU 41 N -1.92 4.39 -0.12 -3.49 1.43 -0.38 -0.30 118.68 118.29 1l6p s LEU 41 Ca -0.06 0.48 -0.28 0.00 -1.03 0.00 0.00 54.13 53.24 1l6p s LEU 41 Cb -0.01 -2.20 -0.01 0.00 0.03 0.00 0.00 46.19 44.00 1l6p s LEU 41 CO -0.01 0.38 0.95 -0.31 0.23 0.00 0.00 176.35 177.59 1l6p s TYR 42 N -1.09 3.50 0.24 0.29 2.02 -0.72 -0.45 117.35 121.14 1l6p s TYR 42 Ca 0.18 1.50 -0.05 0.00 -0.37 0.00 0.00 57.07 58.33 1l6p s TYR 42 Cb -0.12 -3.13 0.39 0.00 -0.40 0.00 0.00 41.96 38.69 1l6p s TYR 42 CO 0.07 -0.21 1.79 -0.09 -1.57 0.00 0.00 175.55 175.53 1l6p h ARG 43 N 7.13 0.65 0.00 -0.62 2.43 -1.48 -2.43 114.38 120.06 1l6p h ARG 43 Ca -0.31 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 58.82 1l6p h ARG 43 Cb 1.15 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 30.55 1l6p h ARG 43 CO 0.85 0.43 0.00 1.63 -1.51 0.00 0.00 179.97 181.36 1l6p n LYS 44 N -4.83 0.07 -0.06 0.20 4.76 -1.26 -2.46 118.16 114.59 1l6p n LYS 44 Ca 0.13 0.35 0.12 0.00 -2.87 0.00 0.00 58.31 56.03 1l6p n LYS 44 Cb 0.30 -1.65 0.15 0.00 -1.84 0.00 0.00 35.03 32.00 1l6p n LYS 44 CO 0.00 0.00 0.00 1.04 -1.37 0.00 0.00 177.40 177.07 1l6p n GLN 45 N -1.78 2.36 -2.94 1.97 1.13 -0.91 -4.91 117.38 112.30 1l6p n GLN 45 Ca 0.03 -2.00 -0.40 0.00 -1.94 0.00 0.00 57.00 52.68 1l6p n GLN 45 Cb 0.17 -1.48 -0.04 0.00 0.11 0.00 0.00 30.24 29.00 1l6p n GLN 45 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 1l6p s ILE 46 N -1.84 4.93 -0.04 5.09 1.01 -1.03 -3.77 121.20 125.56 1l6p s ILE 46 Ca 0.32 1.65 0.01 0.00 0.00 0.00 0.00 60.65 62.63 1l6p s ILE 46 Cb 0.21 -4.13 0.02 0.00 0.01 0.00 0.00 42.46 38.56 1l6p s ILE 46 CO 0.31 0.25 -0.05 -0.13 0.00 0.00 0.00 174.94 175.32 1l6p s ARG 47 N 0.67 0.79 -0.09 2.79 0.52 -0.12 -4.99 118.95 118.52 1l6p s ARG 47 Ca 0.42 -0.14 0.02 0.00 -0.52 0.00 0.00 55.73 55.50 1l6p s ARG 47 Cb -0.19 -0.78 0.01 0.00 0.52 0.00 0.00 34.95 34.51 1l6p s ARG 47 CO 0.22 -0.03 -0.13 0.42 0.02 0.00 0.00 175.30 175.80 1l6p s ILE 48 N 0.68 1.31 -0.12 1.52 1.01 -1.26 -0.57 121.20 123.78 1l6p s ILE 48 Ca -0.09 -0.55 -0.02 0.00 0.00 0.00 0.00 60.65 59.99 1l6p s ILE 48 Cb -0.12 -1.21 0.04 0.00 0.01 0.00 0.00 42.46 41.17 1l6p s ILE 48 CO 0.00 0.40 0.02 -0.89 0.00 0.00 0.00 174.94 174.47 1l6p s THR 49 N 0.94 0.39 0.39 2.92 2.01 0.28 -4.97 115.64 117.60 1l6p s THR 49 Ca -0.09 -0.11 -0.23 0.00 0.31 0.00 0.00 61.69 61.57 1l6p s THR 49 Cb -0.15 -0.69 -0.10 0.00 0.01 0.00 0.00 72.50 71.57 1l6p s THR 49 CO -0.00 0.08 0.99 -2.16 -0.69 0.00 0.00 174.62 172.84 1l6p s PRO 50 N 1.95 4.27 -0.20 4.92 0.04 -1.26 -0.45 135.00 144.27 1l6p s PRO 50 Ca 0.03 1.35 0.01 0.00 0.04 0.00 0.00 61.00 62.43 1l6p s PRO 50 Cb -0.14 -2.48 0.04 0.00 0.04 0.00 0.00 34.50 31.95 1l6p s PRO 50 CO -0.06 -0.02 -0.13 -1.21 0.04 0.00 0.00 177.00 175.62 1l6p s GLU 51 N -2.61 2.27 -1.30 4.56 8.01 0.26 -4.72 118.70 125.17 1l6p s GLU 51 Ca 0.58 -0.87 -0.01 0.00 0.01 0.00 0.00 54.97 54.67 1l6p s GLU 51 Cb -0.17 -2.47 0.00 0.00 -4.31 0.00 0.00 34.13 27.18 1l6p s GLU 51 CO 0.22 -0.38 0.15 0.72 0.01 0.00 0.00 175.26 175.98 1l6p n HIS 52 N 4.65 -0.99 -3.86 1.61 8.25 -1.26 -1.29 115.22 122.33 1l6p n HIS 52 Ca -0.16 0.12 -0.10 0.00 -0.26 0.00 0.00 57.72 57.32 1l6p n HIS 52 Cb 0.47 -3.39 -0.08 0.00 1.12 0.00 0.00 29.99 28.11 1l6p n HIS 52 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1l6p s ALA 53 N -2.86 -0.31 -0.19 -1.41 0.00 -1.26 -1.16 121.76 114.57 1l6p s ALA 53 Ca 0.07 -0.35 -0.01 0.00 0.00 0.00 0.00 51.96 51.67 1l6p s ALA 53 Cb -0.03 0.29 0.00 0.00 0.00 0.00 0.00 23.12 23.39 1l6p s ALA 53 CO 0.09 -0.37 -0.12 0.15 0.00 0.00 0.00 175.76 175.51 1l6p s LYS 54 N -2.69 3.21 0.19 0.00 1.02 0.88 -4.80 119.74 117.55 1l6p s LYS 54 Ca -0.04 -0.72 0.11 0.00 0.02 0.00 0.00 55.97 55.33 1l6p s LYS 54 Cb -0.01 -2.77 -0.04 0.00 -0.52 0.00 0.00 37.83 34.49 1l6p s LYS 54 CO -0.05 -0.15 -0.22 0.96 -0.92 0.00 0.00 175.35 174.98 1l6p s ILE 55 N 1.24 2.20 0.74 2.17 -4.36 -1.26 0.13 121.20 122.07 1l6p s ILE 55 Ca 0.03 -2.02 -0.11 0.00 -0.26 0.00 0.00 60.65 58.29 1l6p s ILE 55 Cb -0.14 -2.05 0.04 0.00 1.25 0.00 0.00 42.46 41.56 1l6p s ILE 55 CO -0.06 -0.20 1.08 0.00 0.24 0.00 0.00 174.94 176.00 1l6p s ALA 56 N -1.84 2.43 0.34 2.27 0.00 0.03 -4.89 121.76 120.10 1l6p s ALA 56 Ca 0.20 0.10 -0.27 0.00 0.00 0.00 0.00 51.96 51.99 1l6p s ALA 56 Cb -0.07 -3.20 -0.12 0.00 0.00 0.00 0.00 23.12 19.73 1l6p s ALA 56 CO 0.09 -1.52 1.12 -0.25 0.00 0.00 0.00 175.76 175.21 1l6p n ASP 57 N -3.33 1.89 -4.53 0.00 8.00 -1.26 -4.73 116.55 112.58 1l6p n ASP 57 Ca 0.08 1.15 -0.36 0.00 0.71 0.00 0.00 54.79 56.37 1l6p n ASP 57 Cb 0.54 -1.39 -0.11 0.00 -0.02 0.00 0.00 41.12 40.14 1l6p n ASP 57 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1l6p s VAL 58 N -1.13 4.66 -0.30 2.53 1.01 -1.26 -4.92 120.40 120.99 1l6p s VAL 58 Ca 0.58 -0.06 -0.11 0.00 0.00 0.00 0.00 61.98 62.40 1l6p s VAL 58 Cb -0.61 -3.16 -0.03 0.00 0.00 0.00 0.00 36.38 32.58 1l6p s VAL 58 CO 0.60 0.36 0.18 -1.58 0.00 0.00 0.00 175.10 174.66 1l6p s GLN 59 N 1.25 3.65 0.33 2.72 2.00 -1.26 -5.08 119.66 123.27 1l6p s GLN 59 Ca 0.05 -0.52 -0.27 0.00 -2.00 0.00 0.00 55.36 52.63 1l6p s GLN 59 Cb -0.14 -3.64 -0.09 0.00 0.80 0.00 0.00 33.01 29.94 1l6p s GLN 59 CO 0.04 -0.31 1.01 -0.51 -0.50 0.00 0.00 175.29 175.02 1l6p s LEU 60 N 1.70 4.36 0.85 3.68 1.43 -1.26 -4.97 118.68 124.47 1l6p s LEU 60 Ca 0.06 2.00 -0.12 0.00 -1.03 0.00 0.00 54.13 55.03 1l6p s LEU 60 Cb -0.16 -3.94 0.10 0.00 0.03 0.00 0.00 46.19 42.21 1l6p s LEU 60 CO 0.09 -0.18 1.17 -2.16 0.23 0.00 0.00 176.35 175.49 1l6p s PRO 61 N -1.97 1.63 -0.18 1.29 0.04 -1.26 -4.99 135.00 129.56 1l6p s PRO 61 Ca 0.50 0.16 -0.29 0.00 0.04 0.00 0.00 61.00 61.41 1l6p s PRO 61 Cb -0.23 -1.91 -0.00 0.00 0.04 0.00 0.00 34.50 32.40 1l6p s PRO 61 CO 0.29 -1.84 1.10 -1.14 0.04 0.00 0.00 177.00 175.46 1l6p s GLN 62 N -5.48 4.28 0.00 4.56 2.00 -1.26 -5.02 119.66 118.74 1l6p s GLN 62 Ca 0.63 1.46 0.00 0.00 -2.00 0.00 0.00 55.36 55.45 1l6p s GLN 62 Cb -0.12 -3.65 0.00 0.00 0.80 0.00 0.00 33.01 30.04 1l6p s GLN 62 CO 0.51 -0.59 0.00 0.41 -0.50 0.00 0.00 175.29 175.12 1l6p n GLY 63 N 3.36 2.76 3.58 2.59 0.00 -1.26 -5.09 105.19 111.12 1l6p n GLY 63 Ca 0.12 -1.99 -0.24 0.00 0.00 0.00 0.00 46.02 43.91 1l6p n GLY 63 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1l6p s VAL 64 N 2.17 3.12 0.13 1.61 -7.23 -0.03 -4.86 120.40 115.32 1l6p s VAL 64 Ca 0.00 -1.96 -0.09 0.00 -1.81 0.00 0.00 61.98 58.13 1l6p s VAL 64 Cb 0.00 -2.62 -0.06 0.00 0.56 0.00 0.00 36.38 34.26 1l6p s VAL 64 CO 0.00 -0.30 0.43 0.26 -0.31 0.00 0.00 175.10 175.19 1l6p s TRP 65 N -2.17 3.52 -0.01 2.82 0.52 -1.26 0.12 118.94 122.48 1l6p s TRP 65 Ca 0.29 0.76 -0.13 0.00 0.02 0.00 0.00 56.10 57.03 1l6p s TRP 65 Cb -0.07 -2.15 0.02 0.00 -1.15 0.00 0.00 33.47 30.12 1l6p s TRP 65 CO 0.17 0.44 0.28 -1.58 0.02 0.00 0.00 176.95 176.28 1l6p s HIS 66 N -1.56 -0.13 -0.15 -1.98 2.46 -0.70 -4.91 115.29 108.32 1l6p s HIS 66 Ca 0.38 0.17 -0.05 0.00 0.47 0.00 0.00 55.06 56.04 1l6p s HIS 66 Cb -0.13 0.07 -0.03 0.00 -0.13 0.00 0.00 32.58 32.36 1l6p s HIS 66 CO 0.21 -0.38 0.01 -1.21 -2.47 0.00 0.00 174.74 170.89 1l6p s GLU 67 N -1.42 3.63 0.28 2.88 0.41 -1.26 -1.98 118.70 121.23 1l6p s GLU 67 Ca -0.13 -0.43 -0.02 0.00 -0.41 0.00 0.00 54.97 53.97 1l6p s GLU 67 Cb -0.05 -2.99 -0.02 0.00 -1.78 0.00 0.00 34.13 29.29 1l6p s GLU 67 CO 0.03 0.36 0.33 0.16 -0.49 0.00 0.00 175.26 175.65 1l6p s ASP 68 N 0.08 0.61 0.24 -0.19 3.84 -0.66 -5.02 116.67 115.57 1l6p s ASP 68 Ca 0.02 -1.39 0.25 0.00 -0.00 0.00 0.00 52.55 51.42 1l6p s ASP 68 Cb -0.13 0.54 0.53 0.00 -1.38 0.00 0.00 42.92 42.48 1l6p s ASP 68 CO 0.02 -1.08 1.57 -0.33 -0.00 0.00 0.00 175.17 175.36 1l6p h GLU 69 N 2.31 0.00 0.42 2.11 3.07 -1.99 -0.57 114.58 119.93 1l6p h GLU 69 Ca -0.30 0.00 -0.02 0.00 -0.50 0.00 0.00 59.36 58.54 1l6p h GLU 69 Cb 1.24 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.16 1l6p h GLU 69 CO 0.42 0.00 -0.20 0.74 -1.40 0.00 0.00 179.01 178.57 1l6p h PHE 70 N 0.00 -0.53 -0.03 4.33 -1.00 -2.02 -3.40 116.94 114.30 1l6p h PHE 70 Ca 0.00 -0.01 0.00 0.00 2.81 0.00 0.00 57.97 60.77 1l6p h PHE 70 Cb 0.82 0.17 0.00 0.00 3.61 0.00 0.00 35.95 40.55 1l6p h PHE 70 CO 0.00 -0.33 0.00 0.66 -1.61 0.00 0.00 178.31 177.03 1l6p n TYR 71 N -3.89 0.04 0.00 -0.55 4.02 -1.24 -5.09 117.16 110.45 1l6p n TYR 71 Ca -0.07 -0.26 0.00 0.00 -0.01 0.00 0.00 57.90 57.56 1l6p n TYR 71 Cb 0.22 -0.02 0.00 0.00 -0.02 0.00 0.00 39.34 39.52 1l6p n TYR 71 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1l6p n GLY 72 N -0.12 1.37 3.66 2.72 0.00 -0.22 -4.76 105.19 107.84 1l6p n GLY 72 Ca 0.02 -0.55 -0.39 0.00 0.00 0.00 0.00 46.02 45.09 1l6p n GLY 72 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1l6p s LYS 73 N 0.00 4.19 0.21 1.61 0.00 -1.26 -1.65 119.74 122.84 1l6p s LYS 73 Ca 0.00 0.47 -0.11 0.00 0.00 0.00 0.00 55.97 56.33 1l6p s LYS 73 Cb 0.00 -3.57 -0.01 0.00 0.00 0.00 0.00 37.83 34.26 1l6p s LYS 73 CO 0.00 -0.18 0.39 -1.54 0.00 0.00 0.00 175.35 174.02 1l6p s SER 74 N 1.17 -0.05 -0.07 0.03 1.04 -0.84 -4.97 113.70 110.02 1l6p s SER 74 Ca 0.25 -0.90 -0.22 0.00 0.48 0.00 0.00 55.95 55.57 1l6p s SER 74 Cb -0.16 0.52 -0.04 0.00 0.10 0.00 0.00 66.02 66.44 1l6p s SER 74 CO 0.10 -1.02 0.63 -0.70 0.98 0.00 0.00 173.24 173.23 1l6p s GLU 75 N -4.00 4.40 0.23 4.02 2.12 -1.26 -1.73 118.70 122.49 1l6p s GLU 75 Ca 0.21 0.76 0.04 0.00 0.36 0.00 0.00 54.97 56.34 1l6p s GLU 75 Cb 0.01 -3.43 -0.05 0.00 0.26 0.00 0.00 34.13 30.92 1l6p s GLU 75 CO 0.05 0.12 -0.03 0.96 -0.54 0.00 0.00 175.26 175.82 1l6p s ILE 76 N 0.65 1.21 -0.07 -3.70 -4.36 0.12 -1.19 121.20 113.86 1l6p s ILE 76 Ca 0.34 -2.06 0.05 0.00 -0.26 0.00 0.00 60.65 58.72 1l6p s ILE 76 Cb -0.17 -2.29 -0.01 0.00 1.25 0.00 0.00 42.46 41.24 1l6p s ILE 76 CO 0.16 -0.38 -0.24 -0.31 0.24 0.00 0.00 174.94 174.41 1l6p s TYR 77 N -3.30 2.41 0.36 1.37 2.02 0.41 -0.85 117.35 119.76 1l6p s TYR 77 Ca 0.27 -0.84 0.07 0.00 -0.37 0.00 0.00 57.07 56.20 1l6p s TYR 77 Cb 0.05 -1.60 -0.07 0.00 -0.40 0.00 0.00 41.96 39.94 1l6p s TYR 77 CO 0.08 -0.30 -0.01 1.03 -1.57 0.00 0.00 175.55 174.78 1l6p s ARG 78 N 0.08 1.82 0.00 -0.62 0.52 -1.26 -1.25 118.95 118.23 1l6p s ARG 78 Ca -0.10 -1.99 0.00 0.00 -0.52 0.00 0.00 55.73 53.12 1l6p s ARG 78 Cb -0.15 -1.45 0.00 0.00 0.52 0.00 0.00 34.95 33.87 1l6p s ARG 78 CO 0.06 -0.02 0.00 -0.25 0.02 0.00 0.00 175.30 175.11 1l6p n ASP 79 N -0.83 0.00 -3.55 0.23 8.00 -1.23 -4.64 116.55 114.54 1l6p n ASP 79 Ca -0.05 0.00 -0.15 0.00 0.71 0.00 0.00 54.79 55.30 1l6p n ASP 79 Cb 0.66 0.00 -0.06 0.00 -0.02 0.00 0.00 41.12 41.70 1l6p n ASP 79 CO 0.00 0.00 0.00 -0.60 -0.39 0.00 0.00 177.20 176.21 1l6p s ARG 80 N 0.00 0.88 -0.13 -1.24 3.52 -1.26 -1.01 118.95 119.71 1l6p s ARG 80 Ca 0.00 0.27 0.02 0.00 -0.13 0.00 0.00 55.73 55.89 1l6p s ARG 80 Cb 0.00 0.41 0.01 0.00 -1.56 0.00 0.00 34.95 33.82 1l6p s ARG 80 CO 0.00 -0.26 -0.19 -1.17 -0.81 0.00 0.00 175.30 172.87 1l6p s LEU 81 N -1.03 1.92 -0.18 -0.88 2.96 -0.29 -4.94 118.68 116.24 1l6p s LEU 81 Ca -0.07 -0.52 -0.02 0.00 -0.22 0.00 0.00 54.13 53.30 1l6p s LEU 81 Cb -0.01 -1.27 -0.01 0.00 0.50 0.00 0.00 46.19 45.40 1l6p s LEU 81 CO 0.06 0.05 -0.07 -0.89 -1.32 0.00 0.00 176.35 174.18 1l6p s THR 82 N 0.91 3.34 -0.22 3.68 2.01 -1.26 -0.49 115.64 123.61 1l6p s THR 82 Ca -0.07 -0.53 -0.03 0.00 0.31 0.00 0.00 61.69 61.38 1l6p s THR 82 Cb -0.15 -2.47 0.07 0.00 0.01 0.00 0.00 72.50 69.96 1l6p s THR 82 CO -0.02 0.47 0.05 -0.22 -0.69 0.00 0.00 174.62 174.22 1l6p s LEU 83 N 0.88 1.22 0.26 4.42 2.96 0.16 -4.89 118.68 123.69 1l6p s LEU 83 Ca -0.02 -0.95 -0.30 0.00 -0.22 0.00 0.00 54.13 52.65 1l6p s LEU 83 Cb -0.15 -0.59 -0.09 0.00 0.50 0.00 0.00 46.19 45.86 1l6p s LEU 83 CO 0.01 -0.33 1.08 -2.16 -1.32 0.00 0.00 176.35 173.63 1l6p s PRO 84 N 1.86 4.66 -0.02 0.98 0.04 -1.26 -0.52 135.00 140.74 1l6p s PRO 84 Ca 0.01 1.76 0.05 0.00 0.04 0.00 0.00 61.00 62.87 1l6p s PRO 84 Cb -0.17 -3.21 -0.01 0.00 0.04 0.00 0.00 34.50 31.15 1l6p s PRO 84 CO -0.12 0.23 -0.18 0.08 0.04 0.00 0.00 177.00 177.05 1l6p s VAL 85 N -1.06 1.40 -0.26 -0.36 1.01 0.17 -4.87 120.40 116.43 1l6p s VAL 85 Ca 0.45 -0.75 -0.08 0.00 0.00 0.00 0.00 61.98 61.59 1l6p s VAL 85 Cb -0.31 -1.17 -0.03 0.00 0.00 0.00 0.00 36.38 34.87 1l6p s VAL 85 CO 0.39 0.40 0.10 -0.89 0.00 0.00 0.00 175.10 175.10 1l6p s THR 86 N -0.36 4.51 -0.44 3.92 2.01 -1.26 -0.72 115.64 123.30 1l6p s THR 86 Ca 0.06 -0.13 -0.17 0.00 0.31 0.00 0.00 61.69 61.76 1l6p s THR 86 Cb -0.07 -3.13 0.03 0.00 0.01 0.00 0.00 72.50 69.34 1l6p s THR 86 CO -0.00 0.31 0.43 -0.63 -0.69 0.00 0.00 174.62 174.04 1l6p s ILE 87 N 1.64 5.11 0.10 1.82 1.01 0.72 -0.79 121.20 130.81 1l6p s ILE 87 Ca 0.06 -0.53 -0.02 0.00 0.00 0.00 0.00 60.65 60.17 1l6p s ILE 87 Cb -0.15 -4.07 -0.25 0.00 0.01 0.00 0.00 42.46 38.00 1l6p s ILE 87 CO 0.05 -0.48 1.21 0.78 0.00 0.00 0.00 174.94 176.50 1l6p h ASN 88 N 8.75 0.34 -4.82 3.58 2.35 -0.60 -3.41 115.58 121.78 1l6p h ASN 88 Ca -0.27 -0.34 -0.10 0.00 -0.55 0.00 0.00 56.30 55.04 1l6p h ASN 88 Cb 1.11 -0.11 -0.20 0.00 0.05 0.00 0.00 38.32 39.17 1l6p h ASN 88 CO 0.82 1.24 -0.11 -1.58 -1.65 0.00 0.00 177.43 176.15 1l6p s GLN 89 N -2.79 0.77 -0.16 0.81 -0.44 -0.76 -4.15 119.66 112.95 1l6p s GLN 89 Ca -0.03 0.09 -0.07 0.00 -2.50 0.00 0.00 55.36 52.84 1l6p s GLN 89 Cb 0.08 0.36 0.06 0.00 -1.64 0.00 0.00 33.01 31.87 1l6p s GLN 89 CO 0.86 -0.21 0.36 0.00 0.50 0.00 0.00 175.29 176.80 1l6p s ALA 90 N -1.03 -0.91 0.99 1.58 0.00 0.10 -0.09 121.76 122.41 1l6p s ALA 90 Ca -0.11 1.34 -0.13 0.00 0.00 0.00 0.00 51.96 53.06 1l6p s ALA 90 Cb -0.03 -0.97 0.18 0.00 0.00 0.00 0.00 23.12 22.30 1l6p s ALA 90 CO 0.05 -0.41 1.12 -1.12 0.00 0.00 0.00 175.76 175.41 1l6p s SER 91 N 1.76 2.79 0.03 0.00 0.01 -0.31 -1.18 113.70 116.81 1l6p s SER 91 Ca -0.06 1.00 -0.30 0.00 1.31 0.00 0.00 55.95 57.89 1l6p s SER 91 Cb -0.10 -1.57 -0.06 0.00 0.21 0.00 0.00 66.02 64.50 1l6p s SER 91 CO -0.11 -3.01 1.38 0.00 0.41 0.00 0.00 173.24 171.91 1l6p s ALA 92 N -3.13 3.57 0.00 1.44 0.00 -1.26 -1.86 121.76 120.52 1l6p s ALA 92 Ca 0.66 0.94 0.00 0.00 0.00 0.00 0.00 51.96 53.56 1l6p s ALA 92 Cb -0.16 -3.57 0.00 0.00 0.00 0.00 0.00 23.12 19.39 1l6p s ALA 92 CO 0.56 -0.80 0.00 0.41 0.00 0.00 0.00 175.76 175.92 1l6p n GLY 93 N 3.58 0.75 3.70 0.00 0.00 -1.26 -5.05 105.19 106.91 1l6p n GLY 93 Ca 0.12 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.80 1l6p n GLY 93 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1l6p s ALA 94 N -2.53 1.94 0.16 4.61 0.00 -0.78 -4.87 121.76 120.29 1l6p s ALA 94 Ca 0.00 0.90 -0.00 0.00 0.00 0.00 0.00 51.96 52.86 1l6p s ALA 94 Cb 0.00 -3.50 -0.04 0.00 0.00 0.00 0.00 23.12 19.58 1l6p s ALA 94 CO 0.00 -2.16 0.06 0.95 0.00 0.00 0.00 175.76 174.61 1l6p s THR 95 N -2.03 0.22 -0.11 0.00 -4.23 -0.41 -1.18 115.64 107.90 1l6p s THR 95 Ca 0.75 -1.94 0.02 0.00 -1.18 0.00 0.00 61.69 59.33 1l6p s THR 95 Cb -0.30 -2.17 0.01 0.00 1.34 0.00 0.00 72.50 71.39 1l6p s THR 95 CO 0.49 -0.36 -0.16 -0.22 -0.54 0.00 0.00 174.62 173.82 1l6p s LEU 96 N -3.10 1.77 -0.28 4.79 2.96 -0.20 -0.57 118.68 124.04 1l6p s LEU 96 Ca 0.27 -0.44 -0.14 0.00 -0.22 0.00 0.00 54.13 53.60 1l6p s LEU 96 Cb 0.07 -1.11 -0.03 0.00 0.50 0.00 0.00 46.19 45.61 1l6p s LEU 96 CO 0.05 0.03 0.35 -0.89 -1.32 0.00 0.00 176.35 174.57 1l6p s THR 97 N 0.90 5.19 -0.22 3.68 2.01 0.40 -0.14 115.64 127.47 1l6p s THR 97 Ca -0.08 0.43 -0.00 0.00 0.31 0.00 0.00 61.69 62.34 1l6p s THR 97 Cb -0.15 -3.70 0.02 0.00 0.01 0.00 0.00 72.50 68.68 1l6p s THR 97 CO -0.00 0.12 -0.12 -0.69 -0.69 0.00 0.00 174.62 173.23 1l6p s VAL 98 N 2.03 2.51 0.02 3.82 1.01 0.48 -0.56 120.40 129.70 1l6p s VAL 98 Ca 0.13 -1.00 0.07 0.00 0.00 0.00 0.00 61.98 61.19 1l6p s VAL 98 Cb -0.16 -2.19 -0.03 0.00 0.00 0.00 0.00 36.38 34.00 1l6p s VAL 98 CO 0.10 0.34 -0.20 -0.89 0.00 0.00 0.00 175.10 174.45 1l6p s THR 99 N 1.30 2.58 0.13 3.92 2.01 0.26 -0.14 115.64 125.71 1l6p s THR 99 Ca 0.02 -1.14 -0.24 0.00 0.31 0.00 0.00 61.69 60.64 1l6p s THR 99 Cb -0.15 -2.03 0.07 0.00 0.01 0.00 0.00 72.50 70.40 1l6p s THR 99 CO -0.08 0.43 0.66 -0.72 -0.69 0.00 0.00 174.62 174.21 1l6p s TYR 100 N -0.82 -0.49 -0.02 4.92 1.13 -0.44 -0.94 117.35 120.68 1l6p s TYR 100 Ca 0.13 0.29 -0.01 0.00 -1.41 0.00 0.00 57.07 56.06 1l6p s TYR 100 Cb -0.10 0.56 0.02 0.00 -1.10 0.00 0.00 41.96 41.33 1l6p s TYR 100 CO 0.03 -0.81 0.05 -1.14 -2.51 0.00 0.00 175.55 171.17 1l6p s GLN 101 N -3.64 0.03 0.22 -3.49 0.74 -1.26 -0.23 119.66 112.03 1l6p s GLN 101 Ca 0.02 0.14 0.02 0.00 0.05 0.00 0.00 55.36 55.59 1l6p s GLN 101 Cb -0.01 -0.08 -0.05 0.00 1.10 0.00 0.00 33.01 33.97 1l6p s GLN 101 CO -0.12 -0.07 0.04 0.20 -0.55 0.00 0.00 175.29 174.79 1l6p s GLY 102 N 0.47 1.51 0.28 2.59 0.00 -1.26 -1.76 107.32 109.15 1l6p s GLY 102 Ca -0.04 -1.75 0.02 0.00 0.00 0.00 0.00 44.72 42.95 1l6p s GLY 102 CO -0.02 -1.59 0.09 0.00 0.00 0.00 0.00 173.10 171.58 1l6p s ALA 104 N -3.63 2.99 0.57 0.00 0.00 0.44 -1.06 121.76 121.07 1l6p s ALA 104 Ca 0.38 -0.88 0.26 0.00 0.00 0.00 0.00 51.96 51.72 1l6p s ALA 104 Cb 0.08 -1.29 1.60 0.00 0.00 0.00 0.00 23.12 23.52 1l6p s ALA 104 CO 0.14 0.52 2.13 -0.44 0.00 0.00 0.00 175.76 178.11 1l6p h ASP 105 N 5.46 0.00 0.27 0.00 3.32 -1.25 -0.93 116.42 123.29 1l6p h ASP 105 Ca -0.46 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.59 1l6p h ASP 105 Cb 1.18 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.73 1l6p h ASP 105 CO 0.54 0.00 0.00 0.00 -1.72 0.00 0.00 179.24 178.06 1l6p n ALA 106 N -2.40 1.28 0.00 3.45 0.00 -1.26 -4.83 120.51 116.75 1l6p n ALA 106 Ca 0.01 0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.59 1l6p n ALA 106 Cb 0.26 -1.32 0.00 0.00 0.00 0.00 0.00 19.45 18.40 1l6p n ALA 106 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1l6p n GLY 107 N -0.81 0.94 3.30 0.00 0.00 -0.36 -5.02 105.19 103.22 1l6p n GLY 107 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.92 1l6p n GLY 107 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1l6p s PHE 108 N -1.30 -0.14 0.06 1.61 -0.12 -1.17 -5.02 117.98 111.90 1l6p s PHE 108 Ca 0.00 -0.20 0.09 0.00 -0.05 0.00 0.00 56.93 56.77 1l6p s PHE 108 Cb 0.00 0.20 -0.03 0.00 -0.63 0.00 0.00 43.02 42.56 1l6p s PHE 108 CO 0.00 -0.67 -0.23 0.00 -0.05 0.00 0.00 175.22 174.27 1l6p s TYR 110 N -0.91 3.43 0.74 0.00 1.51 -0.32 -4.99 117.35 116.82 1l6p s TYR 110 Ca 0.14 1.16 -0.11 0.00 -1.01 0.00 0.00 57.07 57.25 1l6p s TYR 110 Cb -0.10 -2.92 0.04 0.00 -0.11 0.00 0.00 41.96 38.87 1l6p s TYR 110 CO 0.04 -0.99 1.08 -1.25 -1.11 0.00 0.00 175.55 173.32 1l6p s PRO 111 N -5.27 2.53 0.52 -1.71 0.05 -1.26 -4.58 135.00 125.28 1l6p s PRO 111 Ca 0.57 1.07 -0.22 0.00 0.05 0.00 0.00 61.00 62.47 1l6p s PRO 111 Cb -0.11 -1.93 -0.06 0.00 0.05 0.00 0.00 34.50 32.44 1l6p s PRO 111 CO 0.53 -1.42 1.28 -2.30 0.05 0.00 0.00 177.00 175.13 1l6p n PRO 112 N -3.36 1.65 -4.83 0.56 -0.02 -1.26 -4.69 135.00 123.04 1l6p n PRO 112 Ca 0.08 0.60 -0.30 0.00 -2.02 0.00 0.00 63.50 61.86 1l6p n PRO 112 Cb 0.53 -2.46 -0.14 0.00 -0.02 0.00 0.00 33.50 31.41 1l6p n PRO 112 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 1l6p s GLU 113 N -2.68 1.78 -0.04 -0.52 2.02 0.68 -4.97 118.70 114.98 1l6p s GLU 113 Ca 0.69 -1.13 0.04 0.00 0.02 0.00 0.00 54.97 54.60 1l6p s GLU 113 Cb -0.44 -1.99 -0.00 0.00 0.10 0.00 0.00 34.13 31.79 1l6p s GLU 113 CO 0.51 0.51 -0.16 0.99 0.02 0.00 0.00 175.26 177.13 1l6p s THR 114 N -0.84 1.38 -0.00 3.63 2.01 -1.26 -1.33 115.64 119.22 1l6p s THR 114 Ca 0.12 -0.69 0.08 0.00 0.31 0.00 0.00 61.69 61.51 1l6p s THR 114 Cb -0.10 -1.18 -0.02 0.00 0.01 0.00 0.00 72.50 71.21 1l6p s THR 114 CO 0.03 0.40 -0.25 -0.54 -0.69 0.00 0.00 174.62 173.57 1l6p s LYS 115 N 0.04 1.90 -0.26 4.92 -0.14 0.80 -4.98 119.74 122.03 1l6p s LYS 115 Ca -0.03 -0.93 -0.06 0.00 -1.36 0.00 0.00 55.97 53.59 1l6p s LYS 115 Cb -0.11 -1.90 -0.01 0.00 -1.68 0.00 0.00 37.83 34.13 1l6p s LYS 115 CO 0.02 0.51 0.04 0.99 -0.76 0.00 0.00 175.35 176.16 1l6p s THR 116 N -0.64 3.90 -0.22 2.17 2.01 -1.26 -0.39 115.64 121.21 1l6p s THR 116 Ca 0.10 -0.49 -0.17 0.00 0.31 0.00 0.00 61.69 61.44 1l6p s THR 116 Cb -0.09 -2.90 -0.04 0.00 0.01 0.00 0.00 72.50 69.48 1l6p s THR 116 CO -0.00 0.25 0.44 -0.69 -0.69 0.00 0.00 174.62 173.92 1l6p s VAL 117 N 1.53 5.15 -0.18 3.82 1.01 0.80 -4.94 120.40 127.60 1l6p s VAL 117 Ca 0.04 0.77 -0.29 0.00 0.00 0.00 0.00 61.98 62.50 1l6p s VAL 117 Cb -0.16 -3.77 -0.01 0.00 0.00 0.00 0.00 36.38 32.45 1l6p s VAL 117 CO 0.01 0.19 1.24 -2.16 0.00 0.00 0.00 175.10 174.39 1l6p s PRO 118 N 1.67 4.22 -0.02 2.72 0.04 -1.26 -1.03 135.00 141.34 1l6p s PRO 118 Ca 0.20 1.61 -0.17 0.00 0.04 0.00 0.00 61.00 62.68 1l6p s PRO 118 Cb -0.15 -3.76 -0.05 0.00 0.04 0.00 0.00 34.50 30.57 1l6p s PRO 118 CO 0.09 -0.72 0.47 -0.51 0.04 0.00 0.00 177.00 176.37 1l6p s LEU 119 N 3.52 4.42 0.42 -3.56 1.43 -0.33 -4.96 118.68 119.63 1l6p s LEU 119 Ca 0.54 0.99 -0.23 0.00 -1.03 0.00 0.00 54.13 54.40 1l6p s LEU 119 Cb -0.21 -2.70 -0.09 0.00 0.03 0.00 0.00 46.19 43.22 1l6p s LEU 119 CO 0.14 0.20 1.05 -0.44 0.23 0.00 0.00 176.35 177.54 1l6p s SER 120 N -0.52 6.65 0.39 2.29 0.01 -1.26 -4.25 113.70 117.01 1l6p s SER 120 Ca 0.26 2.03 -0.27 0.00 1.31 0.00 0.00 55.95 59.28 1l6p s SER 120 Cb -0.17 -2.58 -0.10 0.00 0.21 0.00 0.00 66.02 63.38 1l6p s SER 120 CO 0.14 -0.57 1.44 -0.70 0.41 0.00 0.00 173.24 173.96 1l6p s GLU 121 N -2.64 4.03 -0.12 12.44 2.12 -1.26 -4.82 118.70 128.46 1l6p s GLU 121 Ca 0.60 2.47 -0.01 0.00 0.36 0.00 0.00 54.97 58.38 1l6p s GLU 121 Cb -0.21 -2.90 0.03 0.00 0.26 0.00 0.00 34.13 31.32 1l6p s GLU 121 CO 0.27 -0.55 -0.02 0.08 -0.54 0.00 0.00 175.26 174.49 1l6p s VAL 122 N -1.15 0.68 0.23 3.70 1.01 -0.33 -4.93 120.40 119.61 1l6p s VAL 122 Ca 0.54 -0.20 -0.30 0.00 0.00 0.00 0.00 61.98 62.02 1l6p s VAL 122 Cb -0.44 -0.86 -0.09 0.00 0.00 0.00 0.00 36.38 34.99 1l6p s VAL 122 CO 0.59 0.20 1.00 -0.69 0.00 0.00 0.00 175.10 176.20 1l6p s VAL 123 N 1.84 3.93 -1.56 2.92 1.01 -1.26 -0.72 120.40 126.55 1l6p s VAL 123 Ca 0.03 1.87 0.00 0.00 0.00 0.00 0.00 61.98 63.88 1l6p s VAL 123 Cb -0.14 -4.19 0.00 0.00 0.00 0.00 0.00 36.38 32.05 1l6p s VAL 123 CO -0.07 0.42 0.39 0.00 0.00 0.00 0.00 175.10 175.84