#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1c6s n ASP 2 N 0.00 4.09 0.12 0.00 8.00 -1.26 -4.54 116.55 122.95 1c6s n ASP 2 Ca 0.00 0.00 0.13 0.00 0.71 0.00 0.00 54.79 55.63 1c6s n ASP 2 Cb 0.00 0.68 0.44 0.00 -0.02 0.00 0.00 41.12 42.22 1c6s n ASP 2 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1c6s n LEU 3 N -2.06 0.76 0.27 0.64 4.32 -1.26 -2.12 117.00 117.54 1c6s n LEU 3 Ca -0.05 0.62 0.11 0.00 -0.02 0.00 0.00 56.01 56.66 1c6s n LEU 3 Cb 0.54 -0.43 0.73 0.00 -1.62 0.00 0.00 43.42 42.65 1c6s n LEU 3 CO 0.08 -0.35 1.04 0.00 -1.22 0.00 0.00 177.39 176.94 1c6s h ALA 4 N 2.41 1.62 0.01 -1.18 0.00 -1.95 0.45 119.26 120.62 1c6s h ALA 4 Ca 0.00 -0.05 -0.22 0.00 0.00 0.00 0.00 54.91 54.64 1c6s h ALA 4 Cb 0.58 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.33 1c6s h ALA 4 CO 0.00 0.08 -1.04 -0.91 0.00 0.00 0.00 179.25 177.38 1c6s h ASN 5 N 0.00 0.03 -0.42 0.00 4.21 -1.72 -3.25 115.58 114.42 1c6s h ASN 5 Ca -0.00 -0.03 0.07 0.00 1.21 0.00 0.00 56.30 57.55 1c6s h ASN 5 Cb 0.13 -0.01 -0.06 0.00 -1.12 0.00 0.00 38.32 37.26 1c6s h ASN 5 CO 0.01 1.03 0.04 1.23 -1.29 0.00 0.00 177.43 178.44 1c6s h GLY 6 N 2.92 0.47 1.81 2.83 0.00 -0.09 0.27 103.07 111.28 1c6s h GLY 6 Ca -0.03 0.02 0.03 0.00 0.00 0.00 0.00 47.33 47.34 1c6s h GLY 6 CO 0.13 -0.08 0.07 0.00 0.00 0.00 0.00 176.54 176.67 1c6s h ALA 7 N 1.35 1.92 0.00 3.60 0.00 -1.49 0.28 119.26 124.92 1c6s h ALA 7 Ca 0.21 -0.00 -0.07 0.00 0.00 0.00 0.00 54.91 55.04 1c6s h ALA 7 Cb 0.28 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1c6s h ALA 7 CO -0.31 -0.12 -0.35 -0.22 0.00 0.00 0.00 179.25 178.25 1c6s h LYS 8 N 0.00 0.00 0.00 0.00 3.11 -0.53 0.16 116.57 119.31 1c6s h LYS 8 Ca 0.04 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.88 1c6s h LYS 8 Cb 0.19 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 31.42 1c6s h LYS 8 CO -0.00 0.35 -1.85 0.28 -2.81 0.00 0.00 179.45 175.42 1c6s n VAL 9 N -3.85 0.00 0.03 2.00 0.31 0.13 -3.90 118.33 113.05 1c6s n VAL 9 Ca -0.01 -0.43 0.11 0.00 -0.01 0.00 0.00 64.34 64.00 1c6s n VAL 9 Cb 0.42 0.15 -0.12 0.00 -0.91 0.00 0.00 33.84 33.38 1c6s n VAL 9 CO 0.00 0.00 0.00 0.33 -1.32 0.00 0.00 176.83 175.84 1c6s n PHE 10 N -2.15 0.29 0.03 3.52 -0.00 0.76 -2.33 117.46 117.59 1c6s n PHE 10 Ca -0.03 0.08 0.12 0.00 -0.00 0.00 0.00 57.45 57.62 1c6s n PHE 10 Cb 0.53 -0.63 0.27 0.00 -0.00 0.00 0.00 39.48 39.65 1c6s n PHE 10 CO 0.00 0.00 0.00 0.43 -0.00 0.00 0.00 176.76 177.19 1c6s n SER 11 N -2.38 3.63 0.00 -2.13 7.64 0.53 0.34 113.62 121.25 1c6s n SER 11 Ca -0.03 -1.99 0.00 0.00 1.01 0.00 0.00 58.87 57.86 1c6s n SER 11 Cb 0.56 -0.36 0.00 0.00 -1.01 0.00 0.00 64.21 63.40 1c6s n SER 11 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1c6s n GLY 12 N 1.57 0.07 2.10 0.23 0.00 -1.25 -4.84 105.19 103.07 1c6s n GLY 12 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.24 1c6s n GLY 12 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1c6s n ASN 13 N -0.00 -1.94 -0.02 1.61 3.02 -1.17 -4.89 115.26 111.87 1c6s n ASN 13 Ca 0.00 0.57 0.03 0.00 -0.03 0.00 0.00 54.58 55.15 1c6s n ASN 13 Cb 0.30 1.94 0.38 0.00 -0.61 0.00 0.00 39.78 41.78 1c6s n ASN 13 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1c6s h ALA 15 N 1.67 1.88 -0.65 0.00 0.00 -0.29 2.05 119.26 123.92 1c6s h ALA 15 Ca 0.15 0.00 0.08 0.00 0.00 0.00 0.00 54.91 55.15 1c6s h ALA 15 Cb 0.02 -0.12 -0.07 0.00 0.00 0.00 0.00 17.79 17.62 1c6s h ALA 15 CO -0.03 -0.08 0.31 0.00 0.00 0.00 0.00 179.25 179.45 1c6s h ALA 16 N 1.61 0.87 -0.38 0.00 0.00 -1.61 1.95 119.26 121.69 1c6s h ALA 16 Ca 0.40 0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.36 1c6s h ALA 16 Cb 0.65 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.41 1c6s h ALA 16 CO -0.16 -0.08 0.00 0.00 0.00 0.00 0.00 179.25 179.01 1c6s n HIS 18 N 0.35 -1.77 -1.92 0.00 8.25 0.68 -3.16 115.22 117.65 1c6s n HIS 18 Ca 0.17 -1.52 -0.40 0.00 -0.26 0.00 0.00 57.72 55.71 1c6s n HIS 18 Cb 0.63 1.41 -0.00 0.00 1.12 0.00 0.00 29.99 33.15 1c6s n HIS 18 CO 0.00 0.00 0.00 -1.64 0.64 0.00 0.00 176.34 175.34 1c6s s MET 19 N 0.11 4.05 -1.59 -0.41 -1.94 0.65 -2.26 119.30 117.91 1c6s s MET 19 Ca 0.08 2.38 -0.09 0.00 -1.71 0.00 0.00 55.69 56.35 1c6s s MET 19 Cb 0.38 -2.89 0.08 0.00 2.01 0.00 0.00 34.83 34.42 1c6s s MET 19 CO -0.11 -0.51 0.44 0.41 -0.01 0.00 0.00 175.02 175.25 1c6s n GLY 20 N 0.60 -0.28 3.78 -0.03 0.00 -1.26 -1.32 105.19 106.67 1c6s n GLY 20 Ca 0.02 0.14 -0.26 0.00 0.00 0.00 0.00 46.02 45.92 1c6s n GLY 20 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1c6s n GLY 21 N -1.84 -1.22 2.76 -0.02 0.00 -0.96 -4.95 105.19 98.96 1c6s n GLY 21 Ca -0.15 0.55 -0.17 0.00 0.00 0.00 0.00 46.02 46.25 1c6s n GLY 21 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1c6s s GLY 22 N -3.09 -0.10 0.23 -0.02 0.00 -0.43 -4.26 107.32 99.64 1c6s s GLY 22 Ca 0.10 -0.55 -0.28 0.00 0.00 0.00 0.00 44.72 43.99 1c6s s GLY 22 CO 0.90 2.69 0.72 -2.01 0.00 0.00 0.00 173.10 175.39 1c6s n ASN 23 N 4.92 -0.24 -0.01 1.64 2.85 -1.26 -4.10 115.26 119.07 1c6s n ASN 23 Ca 0.03 1.15 0.08 0.00 -0.11 0.00 0.00 54.58 55.73 1c6s n ASN 23 Cb 0.46 -1.08 -0.11 0.00 1.24 0.00 0.00 39.78 40.28 1c6s n ASN 23 CO 0.00 0.00 0.00 1.33 -2.11 0.00 0.00 177.26 176.48 1c6s n VAL 24 N 0.10 0.00 -0.01 3.44 0.24 -1.19 -4.77 118.33 116.15 1c6s n VAL 24 Ca 0.15 -0.31 -0.01 0.00 -2.04 0.00 0.00 64.34 62.13 1c6s n VAL 24 Cb 0.28 0.33 -0.00 0.00 -1.47 0.00 0.00 33.84 32.97 1c6s n VAL 24 CO 0.00 0.00 0.00 0.52 -2.14 0.00 0.00 176.83 175.21 1c6s n VAL 25 N -1.89 0.13 -3.05 3.34 0.31 -1.26 -4.97 118.33 110.93 1c6s n VAL 25 Ca -0.02 0.47 -0.33 0.00 -0.01 0.00 0.00 64.34 64.46 1c6s n VAL 25 Cb 0.37 -1.57 -0.06 0.00 -0.91 0.00 0.00 33.84 31.66 1c6s n VAL 25 CO 0.00 0.00 0.00 -0.04 -1.32 0.00 0.00 176.83 175.47 1c6s s MET 26 N -1.16 4.07 -0.93 5.55 -1.94 -1.26 -5.00 119.30 118.63 1c6s s MET 26 Ca -0.02 0.80 -0.01 0.00 -1.71 0.00 0.00 55.69 54.74 1c6s s MET 26 Cb 0.00 -2.38 0.28 0.00 2.01 0.00 0.00 34.83 34.74 1c6s s MET 26 CO 0.04 0.12 1.16 0.00 -0.01 0.00 0.00 175.02 176.32 1c6s n ALA 27 N -0.40 4.64 0.00 3.03 0.00 -1.26 -4.47 120.51 122.05 1c6s n ALA 27 Ca 0.04 -4.77 0.00 0.00 0.00 0.00 0.00 53.44 48.72 1c6s n ALA 27 Cb 0.53 -1.85 0.00 0.00 0.00 0.00 0.00 19.45 18.13 1c6s n ALA 27 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1c6s n ASN 28 N 1.38 0.00 -4.45 0.00 0.23 -1.26 -5.06 115.26 106.10 1c6s n ASN 28 Ca 0.27 0.00 -0.44 0.00 -0.53 0.00 0.00 54.58 53.88 1c6s n ASN 28 Cb 0.36 0.00 -0.03 0.00 -2.08 0.00 0.00 39.78 38.03 1c6s n ASN 28 CO 0.00 0.00 0.00 -0.54 -0.93 0.00 0.00 177.26 175.79 1c6s s LYS 29 N 0.00 3.53 0.00 -3.83 3.01 -1.26 -4.49 119.74 116.70 1c6s s LYS 29 Ca 0.00 -1.67 0.00 0.00 -1.01 0.00 0.00 55.97 53.29 1c6s s LYS 29 Cb 0.00 -4.82 0.00 0.00 -1.01 0.00 0.00 37.83 32.00 1c6s s LYS 29 CO 0.00 -1.76 0.00 2.41 0.51 0.00 0.00 175.35 176.51 1c6s n THR 30 N 5.52 0.00 0.72 2.17 -1.04 -1.26 -4.31 114.28 116.07 1c6s n THR 30 Ca 0.20 0.00 0.08 0.00 -2.04 0.00 0.00 64.05 62.29 1c6s n THR 30 Cb 0.48 -1.06 -0.03 0.00 -1.82 0.00 0.00 70.33 67.90 1c6s n THR 30 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 1c6s n LEU 31 N 0.00 1.31 0.00 -4.42 4.77 -1.26 -4.37 117.00 113.03 1c6s n LEU 31 Ca 0.00 -0.67 0.00 0.00 -0.03 0.00 0.00 56.01 55.31 1c6s n LEU 31 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 1c6s n LEU 31 CO 0.00 0.27 0.04 0.29 -1.33 0.00 0.00 177.39 176.65 1c6s n LYS 32 N -0.55 0.00 0.00 3.23 5.02 -1.26 -4.69 118.16 119.91 1c6s n LYS 32 Ca 0.05 0.02 0.00 0.00 -2.02 0.00 0.00 58.31 56.37 1c6s n LYS 32 Cb 0.30 -0.58 0.00 0.00 -0.02 0.00 0.00 35.03 34.74 1c6s n LYS 32 CO 0.00 0.00 0.00 0.36 -0.52 0.00 0.00 177.40 177.24 1c6s n LYS 33 N -0.10 0.00 0.05 1.97 2.85 -1.26 -4.55 118.16 117.12 1c6s n LYS 33 Ca 0.00 0.00 0.20 0.00 -1.05 0.00 0.00 58.31 57.46 1c6s n LYS 33 Cb 0.00 0.00 0.73 0.00 -0.65 0.00 0.00 35.03 35.11 1c6s n LYS 33 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 177.40 178.28 1c6s h GLU 34 N 0.00 0.00 0.00 -1.58 5.08 -1.97 -0.24 114.58 115.88 1c6s h GLU 34 Ca 0.00 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.29 1c6s h GLU 34 Cb 0.00 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 1c6s h GLU 34 CO 0.00 0.00 -0.93 0.00 -1.00 0.00 0.00 179.01 177.08 1c6s n ALA 35 N -2.52 1.71 -0.20 3.43 0.00 -1.26 -4.36 120.51 117.31 1c6s n ALA 35 Ca 0.08 -0.56 -0.07 0.00 0.00 0.00 0.00 53.44 52.90 1c6s n ALA 35 Cb 0.58 0.15 0.03 0.00 0.00 0.00 0.00 19.45 20.21 1c6s n ALA 35 CO 0.00 0.00 0.00 1.37 0.00 0.00 0.00 177.50 178.87 1c6s h LEU 36 N -0.63 0.73 -1.56 0.00 -0.00 -1.76 -1.48 115.31 110.62 1c6s h LEU 36 Ca -0.10 -0.11 0.00 0.00 -0.00 0.00 0.00 57.88 57.66 1c6s h LEU 36 Cb 0.80 -0.19 0.00 0.00 -0.00 0.00 0.00 40.66 41.27 1c6s h LEU 36 CO -0.06 0.64 0.00 -0.08 -0.00 0.00 0.00 178.44 178.94 1c6s h GLU 37 N 0.77 0.00 0.00 0.17 4.81 -1.32 1.41 114.58 120.43 1c6s h GLU 37 Ca 0.20 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.43 1c6s h GLU 37 Cb 0.09 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.47 1c6s h GLU 37 CO -0.03 0.00 0.00 0.94 -0.73 0.00 0.00 179.01 179.19 1c6s n GLN 38 N -3.01 0.00 -0.11 1.92 -0.06 -0.62 -3.68 117.38 111.83 1c6s n GLN 38 Ca 0.00 0.00 0.10 0.00 -2.00 0.00 0.00 57.00 55.11 1c6s n GLN 38 Cb 0.27 -0.36 0.32 0.00 -4.06 0.00 0.00 30.24 26.41 1c6s n GLN 38 CO 0.00 0.00 0.00 1.97 -0.20 0.00 0.00 177.06 178.83 1c6s n PHE 39 N -0.31 0.29 -0.01 3.69 -1.74 -0.83 -3.96 117.46 114.59 1c6s n PHE 39 Ca 0.00 -0.15 0.05 0.00 -0.56 0.00 0.00 57.45 56.79 1c6s n PHE 39 Cb 0.00 0.00 -0.10 0.00 1.52 0.00 0.00 39.48 40.90 1c6s n PHE 39 CO 0.00 0.00 0.00 0.41 -0.56 0.00 0.00 176.76 176.61 1c6s n GLY 40 N 1.19 -0.57 3.39 4.97 0.00 0.26 -5.00 105.19 109.43 1c6s n GLY 40 Ca 0.16 -0.28 -0.12 0.00 0.00 0.00 0.00 46.02 45.78 1c6s n GLY 40 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1c6s n MET 41 N -1.99 -1.41 0.00 1.61 2.81 0.42 -4.77 117.12 113.78 1c6s n MET 41 Ca -0.04 1.14 0.14 0.00 -1.81 0.00 0.00 57.70 57.13 1c6s n MET 41 Cb 0.39 -4.29 0.57 0.00 -0.71 0.00 0.00 33.22 29.18 1c6s n MET 41 CO 0.00 0.00 0.00 2.48 1.51 0.00 0.00 175.97 179.96 1c6s n TYR 42 N -2.27 0.00 -0.90 2.03 4.11 -1.14 -2.50 117.16 116.50 1c6s n TYR 42 Ca -0.13 0.00 -0.35 0.00 -0.00 0.00 0.00 57.90 57.42 1c6s n TYR 42 Cb 0.58 -0.13 0.08 0.00 -0.00 0.00 0.00 39.34 39.88 1c6s n TYR 42 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.86 177.31 1c6s n SER 43 N -0.72 -3.95 0.00 9.48 2.88 -1.26 -3.38 113.62 116.67 1c6s n SER 43 Ca 0.15 0.17 0.00 0.00 -1.33 0.00 0.00 58.87 57.86 1c6s n SER 43 Cb 0.29 -0.89 0.00 0.00 -0.75 0.00 0.00 64.21 62.86 1c6s n SER 43 CO 0.00 0.00 0.00 -1.84 -1.23 0.00 0.00 175.04 171.97 1c6s n GLU 44 N 0.63 0.00 0.24 -1.46 0.28 -1.26 -0.02 120.64 119.05 1c6s n GLU 44 Ca 0.01 0.62 0.12 0.00 -0.16 0.00 0.00 57.16 57.75 1c6s n GLU 44 Cb 0.59 -1.30 0.63 0.00 1.43 0.00 0.00 31.44 32.79 1c6s n GLU 44 CO 0.00 0.00 0.00 0.22 -0.16 0.00 0.00 177.13 177.19 1c6s h ASP 45 N 0.00 0.00 0.00 -1.84 3.58 -1.97 0.12 116.42 116.31 1c6s h ASP 45 Ca 0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 1c6s h ASP 45 Cb 0.00 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.05 1c6s h ASP 45 CO 0.00 0.00 0.00 0.00 -2.88 0.00 0.00 179.24 176.36 1c6s n ALA 46 N -1.76 0.00 0.31 -0.78 0.00 0.98 -3.57 120.51 115.69 1c6s n ALA 46 Ca -0.02 -0.00 0.17 0.00 0.00 0.00 0.00 53.44 53.59 1c6s n ALA 46 Cb 0.26 0.00 0.86 0.00 0.00 0.00 0.00 19.45 20.58 1c6s n ALA 46 CO 0.00 0.00 0.00 0.97 0.00 0.00 0.00 177.50 178.47 1c6s h ILE 47 N 0.00 0.05 -0.70 0.00 2.10 -0.23 0.36 117.51 119.10 1c6s h ILE 47 Ca 0.00 0.00 0.01 0.00 1.08 0.00 0.00 64.86 65.95 1c6s h ILE 47 Cb 0.00 0.71 -0.03 0.00 -1.09 0.00 0.00 36.82 36.41 1c6s h ILE 47 CO 0.00 0.00 0.46 0.40 -1.08 0.00 0.00 178.15 177.93 1c6s h ILE 48 N 0.00 1.17 0.00 2.19 2.04 -0.88 0.32 117.51 122.36 1c6s h ILE 48 Ca 0.02 -0.32 0.00 0.00 1.00 0.00 0.00 64.86 65.56 1c6s h ILE 48 Cb 0.61 0.15 0.00 0.00 -0.74 0.00 0.00 36.82 36.85 1c6s h ILE 48 CO -0.00 0.17 -0.04 0.22 0.00 0.00 0.00 178.15 178.50 1c6s h TYR 49 N 0.94 0.00 -0.00 1.37 5.03 -0.98 -1.17 116.97 122.15 1c6s h TYR 49 Ca 0.26 0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.57 1c6s h TYR 49 Cb -0.10 0.00 0.00 0.00 1.55 0.00 0.00 36.73 38.18 1c6s h TYR 49 CO -0.03 0.00 -0.26 0.94 -1.32 0.00 0.00 178.16 177.49 1c6s n GLN 50 N -2.59 0.26 -0.06 1.82 -0.06 -0.14 -3.74 117.38 112.88 1c6s n GLN 50 Ca 0.05 -0.12 -0.07 0.00 -2.00 0.00 0.00 57.00 54.86 1c6s n GLN 50 Cb 0.47 -1.50 -0.08 0.00 -4.06 0.00 0.00 30.24 25.07 1c6s n GLN 50 CO 0.00 0.00 0.00 0.28 -0.20 0.00 0.00 177.06 177.14 1c6s n VAL 51 N -1.27 0.82 0.64 1.69 0.31 0.95 -2.51 118.33 118.96 1c6s n VAL 51 Ca 0.09 -0.44 0.07 0.00 -0.01 0.00 0.00 64.34 64.05 1c6s n VAL 51 Cb 0.32 -0.81 0.36 0.00 -0.91 0.00 0.00 33.84 32.80 1c6s n VAL 51 CO 0.00 0.00 0.00 1.67 -1.32 0.00 0.00 176.83 177.18 1c6s n GLN 52 N -2.61 0.13 -2.06 5.55 7.27 -0.47 -2.70 117.38 122.49 1c6s n GLN 52 Ca -0.22 0.18 -0.02 0.00 0.07 0.00 0.00 57.00 57.02 1c6s n GLN 52 Cb 0.85 -1.50 0.07 0.00 2.41 0.00 0.00 30.24 32.06 1c6s n GLN 52 CO 0.00 0.00 0.00 -2.39 0.07 0.00 0.00 177.06 174.74 1c6s n HIS 53 N -1.38 -1.20 -0.69 3.69 1.44 -1.24 0.74 115.22 116.58 1c6s n HIS 53 Ca 0.06 -1.06 0.00 0.00 -2.01 0.00 0.00 57.72 54.71 1c6s n HIS 53 Cb 0.14 1.12 0.00 0.00 0.12 0.00 0.00 29.99 31.37 1c6s n HIS 53 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1c6s n GLY 54 N -0.90 2.56 0.00 -1.39 0.00 -1.04 -4.20 105.19 100.22 1c6s n GLY 54 Ca -0.14 -0.13 0.00 0.00 0.00 0.00 0.00 46.02 45.75 1c6s n GLY 54 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1c6s n LYS 55 N 14.00 0.00 0.00 1.61 4.01 -1.21 -3.99 118.16 132.58 1c6s n LYS 55 Ca 0.00 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.80 1c6s n LYS 55 Cb 0.00 0.00 0.00 0.00 -0.51 0.00 0.00 35.03 34.52 1c6s n LYS 55 CO 0.00 0.00 0.00 0.09 -1.11 0.00 0.00 177.40 176.38 1c6s n ASN 56 N 0.00 0.00 -2.62 4.39 3.02 -1.26 -2.05 115.26 116.74 1c6s n ASN 56 Ca 0.00 0.00 -0.18 0.00 -0.03 0.00 0.00 54.58 54.37 1c6s n ASN 56 Cb 0.00 0.00 0.01 0.00 -0.61 0.00 0.00 39.78 39.18 1c6s n ASN 56 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1c6s n ALA 57 N 4.74 4.09 -2.45 5.41 0.00 -1.26 -5.06 120.51 125.97 1c6s n ALA 57 Ca 0.00 -3.70 -0.26 0.00 0.00 0.00 0.00 53.44 49.47 1c6s n ALA 57 Cb 0.00 -0.77 -0.15 0.00 0.00 0.00 0.00 19.45 18.54 1c6s n ALA 57 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 177.50 178.91 1c6s s MET 58 N -3.28 1.54 -0.48 0.00 0.00 -0.87 -5.05 119.30 111.16 1c6s s MET 58 Ca 0.37 -0.82 -0.27 0.00 0.00 0.00 0.00 55.69 54.97 1c6s s MET 58 Cb 0.42 -1.56 -0.02 0.00 0.00 0.00 0.00 34.83 33.67 1c6s s MET 58 CO -0.07 0.42 1.87 -1.25 0.00 0.00 0.00 175.02 175.99 1c6s s PRO 59 N -0.78 2.89 -0.02 4.11 0.04 -1.26 -3.32 135.00 136.65 1c6s s PRO 59 Ca 0.08 1.02 -0.30 0.00 0.04 0.00 0.00 61.00 61.83 1c6s s PRO 59 Cb -0.08 -4.32 -0.09 0.00 0.04 0.00 0.00 34.50 30.05 1c6s s PRO 59 CO 0.00 -2.40 2.01 0.00 0.04 0.00 0.00 177.00 176.65 1c6s n ALA 60 N 11.95 1.53 -0.08 8.56 0.00 -1.26 -3.75 120.51 137.46 1c6s n ALA 60 Ca 0.23 0.14 -0.19 0.00 0.00 0.00 0.00 53.44 53.62 1c6s n ALA 60 Cb 0.50 -2.70 -0.12 0.00 0.00 0.00 0.00 19.45 17.13 1c6s n ALA 60 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.50 178.24 1c6s h PHE 61 N 11.18 0.04 -3.80 0.00 -1.00 -1.53 -3.45 116.94 118.38 1c6s h PHE 61 Ca -0.48 -0.03 0.00 0.00 2.81 0.00 0.00 57.97 60.27 1c6s h PHE 61 Cb 1.25 -0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.80 1c6s h PHE 61 CO 0.95 1.34 0.00 0.00 -1.61 0.00 0.00 178.31 178.98 1c6s n ALA 62 N -3.11 -0.61 0.00 2.45 0.00 0.23 -1.41 120.51 118.05 1c6s n ALA 62 Ca -0.24 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.20 1c6s n ALA 62 Cb 0.64 -0.40 0.00 0.00 0.00 0.00 0.00 19.45 19.69 1c6s n ALA 62 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1c6s n GLY 63 N -0.30 1.09 0.21 0.00 0.00 -1.26 -5.04 105.19 99.88 1c6s n GLY 63 Ca 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.76 1c6s n GLY 63 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1c6s n ARG 64 N 0.00 0.54 0.00 1.61 0.63 -0.50 -4.92 116.66 114.02 1c6s n ARG 64 Ca 0.00 0.22 0.00 0.00 -0.92 0.00 0.00 57.85 57.15 1c6s n ARG 64 Cb 0.00 -1.41 0.00 0.00 0.45 0.00 0.00 32.46 31.50 1c6s n ARG 64 CO 0.00 0.00 0.00 1.28 -2.51 0.00 0.00 177.63 176.40 1c6s n LEU 65 N -4.01 0.00 -0.11 6.15 4.77 -1.26 -4.97 117.00 117.57 1c6s n LEU 65 Ca -0.49 0.00 -0.19 0.00 -0.03 0.00 0.00 56.01 55.31 1c6s n LEU 65 Cb 0.87 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.89 1c6s n LEU 65 CO 0.05 0.00 -0.97 0.41 -1.33 0.00 0.00 177.39 175.56 1c6s n THR 66 N 0.00 1.51 0.00 -5.08 -1.04 -1.26 -5.03 114.28 103.38 1c6s n THR 66 Ca 0.00 -0.09 0.00 0.00 -2.04 0.00 0.00 64.05 61.92 1c6s n THR 66 Cb 0.00 -2.13 0.00 0.00 -1.82 0.00 0.00 70.33 66.38 1c6s n THR 66 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 1c6s n ASP 67 N -4.38 0.00 0.00 8.00 9.92 -1.26 -4.88 116.55 123.95 1c6s n ASP 67 Ca -0.32 0.00 0.06 0.00 -0.53 0.00 0.00 54.79 53.99 1c6s n ASP 67 Cb 0.67 0.00 0.31 0.00 -0.64 0.00 0.00 41.12 41.46 1c6s n ASP 67 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 1c6s n GLU 68 N 0.00 0.29 -0.04 -1.24 -0.58 -1.26 -1.65 120.64 116.16 1c6s n GLU 68 Ca 0.00 0.06 -0.04 0.00 -0.42 0.00 0.00 57.16 56.76 1c6s n GLU 68 Cb 0.00 -1.50 -0.06 0.00 -0.57 0.00 0.00 31.44 29.31 1c6s n GLU 68 CO 0.00 0.00 0.00 1.04 -0.48 0.00 0.00 177.13 177.69 1c6s n GLN 69 N -1.09 2.63 0.33 3.49 1.13 -1.26 -1.08 117.38 121.52 1c6s n GLN 69 Ca 0.07 -0.01 0.19 0.00 -1.94 0.00 0.00 57.00 55.32 1c6s n GLN 69 Cb 0.05 -1.21 1.03 0.00 0.11 0.00 0.00 30.24 30.22 1c6s n GLN 69 CO 0.00 0.00 0.00 0.82 -1.44 0.00 0.00 177.06 176.44 1c6s h ILE 70 N 0.00 0.05 0.00 5.09 1.08 -1.68 0.46 117.51 122.51 1c6s h ILE 70 Ca -0.21 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.26 1c6s h ILE 70 Cb 1.47 0.85 0.00 0.00 -3.07 0.00 0.00 36.82 36.07 1c6s h ILE 70 CO 0.01 0.00 -0.58 0.00 -0.69 0.00 0.00 178.15 176.90 1c6s n GLN 71 N -3.08 0.31 -0.15 2.37 6.02 -1.12 -4.33 117.38 117.40 1c6s n GLN 71 Ca -0.02 0.12 -0.03 0.00 -0.01 0.00 0.00 57.00 57.06 1c6s n GLN 71 Cb 0.22 -1.03 0.05 0.00 1.02 0.00 0.00 30.24 30.49 1c6s n GLN 71 CO 0.00 0.00 0.00 -0.44 -1.01 0.00 0.00 177.06 175.61 1c6s h ASP 72 N -0.58 -0.20 -0.39 1.08 3.32 -0.91 0.11 116.42 118.84 1c6s h ASP 72 Ca 0.00 0.11 0.11 0.00 0.02 0.00 0.00 57.03 57.28 1c6s h ASP 72 Cb 0.58 0.20 -0.02 0.00 0.22 0.00 0.00 39.33 40.31 1c6s h ASP 72 CO 0.00 -0.07 0.36 1.62 -1.72 0.00 0.00 179.24 179.43 1c6s h VAL 73 N 0.11 0.52 0.00 -1.35 3.04 -0.28 2.08 116.25 120.37 1c6s h VAL 73 Ca 0.24 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.93 1c6s h VAL 73 Cb 0.35 0.73 0.00 0.00 -2.01 0.00 0.00 31.29 30.36 1c6s h VAL 73 CO -0.40 0.00 -0.02 0.00 -1.01 0.00 0.00 177.57 176.14 1c6s h ALA 74 N 1.65 0.00 -0.37 3.17 0.00 -0.92 -2.51 119.26 120.28 1c6s h ALA 74 Ca 0.19 -0.04 0.11 0.00 0.00 0.00 0.00 54.91 55.16 1c6s h ALA 74 Cb 0.91 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.70 1c6s h ALA 74 CO -0.00 0.02 0.58 0.00 0.00 0.00 0.00 179.25 179.85 1c6s h ALA 75 N -1.64 2.04 -0.19 0.00 0.00 -1.05 0.29 119.26 118.72 1c6s h ALA 75 Ca 0.00 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 1c6s h ALA 75 Cb 0.02 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 1c6s h ALA 75 CO 0.00 -0.77 0.07 -0.92 0.00 0.00 0.00 179.25 177.63 1c6s h TYR 76 N 0.00 0.29 0.00 0.00 3.20 0.34 -1.93 116.97 118.87 1c6s h TYR 76 Ca 0.18 -0.03 -0.03 0.00 3.14 0.00 0.00 58.73 61.99 1c6s h TYR 76 Cb 1.33 -0.09 -0.00 0.00 1.54 0.00 0.00 36.73 39.51 1c6s h TYR 76 CO 0.00 0.36 -0.15 -0.24 -1.64 0.00 0.00 178.16 176.49 1c6s h VAL 77 N 0.14 0.67 0.00 1.81 3.04 0.05 0.43 116.25 122.39 1c6s h VAL 77 Ca 0.06 -0.64 0.00 0.00 -1.01 0.00 0.00 66.70 65.12 1c6s h VAL 77 Cb 0.20 1.40 0.00 0.00 -2.01 0.00 0.00 31.29 30.87 1c6s h VAL 77 CO -0.00 0.15 0.00 0.18 -1.01 0.00 0.00 177.57 176.88 1c6s n LEU 78 N -3.72 0.00 -0.13 3.16 4.77 -0.77 -2.41 117.00 117.90 1c6s n LEU 78 Ca -0.02 0.49 -0.22 0.00 -0.03 0.00 0.00 56.01 56.23 1c6s n LEU 78 Cb 0.26 -0.49 -0.11 0.00 -2.33 0.00 0.00 43.42 40.75 1c6s n LEU 78 CO 0.31 -0.07 -1.39 -0.67 -1.33 0.00 0.00 177.39 174.25 1c6s n ASP 79 N -1.49 1.97 -0.11 -1.43 -0.08 0.01 -4.13 116.55 111.30 1c6s n ASP 79 Ca 0.06 0.04 -0.11 0.00 -1.51 0.00 0.00 54.79 53.28 1c6s n ASP 79 Cb 0.29 -0.56 -0.03 0.00 2.34 0.00 0.00 41.12 43.16 1c6s n ASP 79 CO 0.00 0.00 0.00 1.56 0.12 0.00 0.00 177.20 178.88 1c6s h GLN 80 N -0.37 0.57 0.00 -0.67 1.08 -1.24 -2.20 115.11 112.28 1c6s h GLN 80 Ca -0.63 -0.17 0.00 0.00 -1.45 0.00 0.00 58.65 56.40 1c6s h GLN 80 Cb 1.80 -0.06 0.00 0.00 -0.05 0.00 0.00 27.48 29.17 1c6s h GLN 80 CO -0.22 0.69 0.00 0.00 -0.95 0.00 0.00 178.83 178.35 1c6s n ALA 81 N -2.37 1.58 1.09 3.87 0.00 -1.01 -1.80 120.51 121.87 1c6s n ALA 81 Ca -0.02 -0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.50 1c6s n ALA 81 Cb 0.25 -1.26 0.27 0.00 0.00 0.00 0.00 19.45 18.72 1c6s n ALA 81 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1c6s n ALA 82 N -1.58 2.49 -2.62 0.00 0.00 -0.83 -4.53 120.51 113.44 1c6s n ALA 82 Ca 0.03 -0.55 -0.03 0.00 0.00 0.00 0.00 53.44 52.88 1c6s n ALA 82 Cb 0.17 -1.04 0.01 0.00 0.00 0.00 0.00 19.45 18.59 1c6s n ALA 82 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 1c6s n LYS 83 N 0.39 0.31 -0.86 0.00 2.85 -0.87 -5.06 118.16 114.92 1c6s n LYS 83 Ca 0.14 -0.65 0.00 0.00 -1.05 0.00 0.00 58.31 56.75 1c6s n LYS 83 Cb 0.31 0.03 0.00 0.00 -0.65 0.00 0.00 35.03 34.71 1c6s n LYS 83 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1c6s n GLY 84 N -0.48 -0.01 3.17 2.58 0.00 -1.16 -4.79 105.19 104.51 1c6s n GLY 84 Ca -0.18 -0.37 -0.08 0.00 0.00 0.00 0.00 46.02 45.39 1c6s n GLY 84 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1c6s n TRP 85 N -0.38 0.00 -1.80 1.61 7.02 -0.75 -1.47 117.44 121.67 1c6s n TRP 85 Ca 0.00 0.00 -0.06 0.00 -1.02 0.00 0.00 57.50 56.42 1c6s n TRP 85 Cb 0.09 -0.50 -0.02 0.00 -2.42 0.00 0.00 31.31 28.47 1c6s n TRP 85 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1c6s n ALA 86 N 4.85 -0.48 0.00 6.99 0.00 -1.26 -4.68 120.51 125.92 1c6s n ALA 86 Ca 0.25 0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.76 1c6s n ALA 86 Cb 0.37 -0.89 0.00 0.00 0.00 0.00 0.00 19.45 18.93 1c6s n ALA 86 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91