#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 2.50 0.00 0.00 9.92 -1.26 -4.69 116.55 123.03 1c6s n ASP 2 Ca 0.00 0.00 0.05 0.00 -0.53 0.00 0.00 54.79 54.31 1c6s n ASP 2 Cb 0.00 0.35 0.27 0.00 -0.64 0.00 0.00 41.12 41.11 1c6s n ASP 2 CO 0.00 0.00 0.00 0.18 0.13 0.00 0.00 177.20 177.51 1c6s n LEU 3 N -1.04 0.00 0.24 0.64 4.77 -1.26 -1.54 117.00 118.81 1c6s n LEU 3 Ca 0.00 0.25 0.16 0.00 -0.03 0.00 0.00 56.01 56.39 1c6s n LEU 3 Cb 0.15 -0.25 0.86 0.00 -2.33 0.00 0.00 43.42 41.85 1c6s n LEU 3 CO 0.00 -0.16 1.14 0.00 -1.33 0.00 0.00 177.39 177.04 1c6s h ALA 4 N 2.52 1.69 0.08 -1.18 0.00 -1.97 0.75 119.26 121.15 1c6s h ALA 4 Ca 0.00 -0.00 -0.26 0.00 0.00 0.00 0.00 54.91 54.64 1c6s h ALA 4 Cb 0.08 0.01 0.01 0.00 0.00 0.00 0.00 17.79 17.89 1c6s h ALA 4 CO 0.00 -0.18 -1.13 -0.91 0.00 0.00 0.00 179.25 177.03 1c6s h ASN 5 N 0.00 0.62 -0.14 0.00 4.21 -1.65 -2.91 115.58 115.71 1c6s h ASN 5 Ca 0.05 -0.57 0.05 0.00 1.21 0.00 0.00 56.30 57.04 1c6s h ASN 5 Cb 0.31 -0.20 -0.07 0.00 -1.12 0.00 0.00 38.32 37.25 1c6s h ASN 5 CO -0.00 1.39 -0.37 1.23 -1.29 0.00 0.00 177.43 178.40 1c6s h GLY 6 N 1.01 -0.56 2.00 2.83 0.00 0.37 0.50 103.07 109.22 1c6s h GLY 6 Ca -0.13 0.45 -0.00 0.00 0.00 0.00 0.00 47.33 47.65 1c6s h GLY 6 CO 0.20 -0.22 -0.01 0.00 0.00 0.00 0.00 176.54 176.51 1c6s h ALA 7 N 0.29 1.48 -0.01 3.60 0.00 -1.48 0.26 119.26 123.40 1c6s h ALA 7 Ca 0.09 -0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.90 1c6s h ALA 7 Cb 0.59 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 1c6s h ALA 7 CO -0.38 0.01 -0.44 -0.22 0.00 0.00 0.00 179.25 178.22 1c6s h LYS 8 N 0.00 0.03 0.00 0.00 3.11 0.15 0.11 116.57 119.97 1c6s h LYS 8 Ca -0.00 -0.01 -0.11 0.00 -2.81 0.00 0.00 60.65 57.71 1c6s h LYS 8 Cb 0.02 -0.00 -0.02 0.00 -1.00 0.00 0.00 32.23 31.23 1c6s h LYS 8 CO 0.00 0.46 -1.92 0.28 -2.81 0.00 0.00 179.45 175.46 1c6s n VAL 9 N -4.01 0.56 0.04 2.00 0.31 -0.01 -4.30 118.33 112.91 1c6s n VAL 9 Ca -0.02 -0.62 -0.00 0.00 -0.01 0.00 0.00 64.34 63.69 1c6s n VAL 9 Cb 0.47 -0.24 -0.08 0.00 -0.91 0.00 0.00 33.84 33.08 1c6s n VAL 9 CO 0.00 0.00 0.00 0.15 -1.32 0.00 0.00 176.83 175.66 1c6s h PHE 10 N 0.00 0.00 0.00 3.52 3.04 -0.49 -2.50 116.94 120.51 1c6s h PHE 10 Ca -0.16 0.00 0.00 0.00 3.98 0.00 0.00 57.97 61.79 1c6s h PHE 10 Cb 1.39 0.00 0.00 0.00 2.56 0.00 0.00 35.95 39.90 1c6s h PHE 10 CO 0.00 0.59 0.00 0.43 -2.02 0.00 0.00 178.31 177.31 1c6s n SER 11 N -2.93 0.00 -0.15 0.41 7.64 0.37 -1.49 113.62 117.47 1c6s n SER 11 Ca -0.09 -1.63 0.00 0.00 1.01 0.00 0.00 58.87 58.16 1c6s n SER 11 Cb 0.84 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 64.04 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 0.56 0.48 0.47 0.23 0.00 -1.24 -4.83 105.19 100.85 1c6s n GLY 12 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.08 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 0.15 -0.01 1.61 3.02 -0.94 -4.86 115.26 114.24 1c6s n ASN 13 Ca 0.00 0.00 0.05 0.00 -0.03 0.00 0.00 54.58 54.60 1c6s n ASN 13 Cb 0.51 0.00 -0.13 0.00 -0.61 0.00 0.00 39.78 39.55 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 1.72 0.36 -0.01 0.00 0.00 -1.58 2.31 119.26 122.07 1c6s h ALA 15 Ca -0.13 0.23 -0.03 0.00 0.00 0.00 0.00 54.91 54.98 1c6s h ALA 15 Cb 1.33 0.49 -0.00 0.00 0.00 0.00 0.00 17.79 19.61 1c6s h ALA 15 CO 0.01 -0.45 -0.12 0.00 0.00 0.00 0.00 179.25 178.69 1c6s h ALA 16 N 1.55 1.77 -0.23 0.00 0.00 -1.88 -0.29 119.26 120.18 1c6s h ALA 16 Ca 0.29 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.08 1c6s h ALA 16 Cb 0.46 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.22 1c6s h ALA 16 CO -0.63 0.17 0.00 0.00 0.00 0.00 0.00 179.25 178.79 1c6s n HIS 18 N -0.22 -3.72 -2.31 0.00 8.25 0.75 -3.28 115.22 114.69 1c6s n HIS 18 Ca 0.15 0.92 -0.01 0.00 -0.26 0.00 0.00 57.72 58.53 1c6s n HIS 18 Cb 0.62 2.49 -0.00 0.00 1.12 0.00 0.00 29.99 34.22 1c6s n HIS 18 CO 0.00 0.00 0.00 -1.33 0.64 0.00 0.00 176.34 175.65 1c6s n MET 19 N -3.05 -2.77 -3.76 -0.41 2.81 -0.16 0.73 117.12 110.51 1c6s n MET 19 Ca 0.00 2.05 -0.30 0.00 -1.81 0.00 0.00 57.70 57.64 1c6s n MET 19 Cb 0.00 -2.76 0.03 0.00 -0.71 0.00 0.00 33.22 29.77 1c6s n MET 19 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1c6s n GLY 20 N 1.97 -0.77 3.67 3.03 0.00 -1.26 -2.25 105.19 109.58 1c6s n GLY 20 Ca -0.04 0.36 -0.24 0.00 0.00 0.00 0.00 46.02 46.10 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 -1.76 -1.17 2.50 -0.02 0.00 -1.26 -4.82 105.19 98.67 1c6s n GLY 21 Ca -0.16 0.51 -0.22 0.00 0.00 0.00 0.00 46.02 46.16 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 -3.16 0.57 0.72 -0.02 0.00 0.22 -3.83 107.32 101.82 1c6s s GLY 22 Ca 0.16 -1.87 -0.16 0.00 0.00 0.00 0.00 44.72 42.85 1c6s s GLY 22 CO 0.87 2.48 0.71 -2.01 0.00 0.00 0.00 173.10 175.16 1c6s n ASN 23 N 3.09 -0.51 0.00 1.64 4.05 -1.25 -3.07 115.26 119.21 1c6s n ASN 23 Ca 0.24 0.62 0.00 0.00 0.45 0.00 0.00 54.58 55.90 1c6s n ASN 23 Cb 0.48 -1.29 0.00 0.00 1.23 0.00 0.00 39.78 40.20 1c6s n ASN 23 CO 0.00 0.00 0.00 1.33 -3.05 0.00 0.00 177.26 175.54 1c6s n VAL 24 N -2.43 0.32 -0.06 3.44 0.24 -1.20 -4.81 118.33 113.82 1c6s n VAL 24 Ca 0.11 -0.46 -0.07 0.00 -2.04 0.00 0.00 64.34 61.88 1c6s n VAL 24 Cb 0.50 1.03 -0.02 0.00 -1.47 0.00 0.00 33.84 33.87 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 -0.16 1.42 -1.85 3.34 0.31 -1.26 -5.03 118.33 115.09 1c6s n VAL 25 Ca 0.00 0.19 -0.09 0.00 -0.01 0.00 0.00 64.34 64.43 1c6s n VAL 25 Cb 0.24 -2.13 0.05 0.00 -0.91 0.00 0.00 33.84 31.09 1c6s n VAL 25 CO 0.00 0.00 0.00 0.23 -1.32 0.00 0.00 176.83 175.74 1c6s n MET 26 N -4.19 -0.02 -2.94 5.55 2.81 -1.26 -5.04 117.12 112.03 1c6s n MET 26 Ca -0.12 -0.81 -0.22 0.00 -1.81 0.00 0.00 57.70 54.74 1c6s n MET 26 Cb 0.40 -0.34 -0.02 0.00 -0.71 0.00 0.00 33.22 32.55 1c6s n MET 26 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1c6s n ALA 27 N -3.12 3.71 0.00 3.04 0.00 -1.26 -4.81 120.51 118.07 1c6s n ALA 27 Ca -0.06 -4.07 0.00 0.00 0.00 0.00 0.00 53.44 49.31 1c6s n ALA 27 Cb 0.20 -0.79 0.00 0.00 0.00 0.00 0.00 19.45 18.85 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 -0.08 0.00 -4.56 0.00 6.94 -1.26 -5.06 115.26 111.23 1c6s n ASN 28 Ca 0.28 0.00 -0.29 0.00 -0.02 0.00 0.00 54.58 54.55 1c6s n ASN 28 Cb 0.56 0.00 -0.05 0.00 -2.36 0.00 0.00 39.78 37.93 1c6s n ASN 28 CO 0.00 0.00 0.00 -0.75 -1.03 0.00 0.00 177.26 175.48 1c6s s LYS 29 N 0.00 2.73 0.40 -3.83 2.47 -1.26 -4.54 119.74 115.70 1c6s s LYS 29 Ca 0.00 -0.52 0.06 0.00 -1.56 0.00 0.00 55.97 53.95 1c6s s LYS 29 Cb 0.00 -5.13 -0.07 0.00 -1.46 0.00 0.00 37.83 31.17 1c6s s LYS 29 CO 0.00 -3.23 0.03 0.99 0.16 0.00 0.00 175.35 173.29 1c6s s THR 30 N 9.30 1.67 -0.87 3.43 2.01 -1.26 -4.44 115.64 125.48 1c6s s THR 30 Ca 0.66 -2.00 0.25 0.00 0.31 0.00 0.00 61.69 60.91 1c6s s THR 30 Cb -0.05 -2.85 0.01 0.00 0.01 0.00 0.00 72.50 69.61 1c6s s THR 30 CO -0.01 0.00 1.36 0.18 -0.69 0.00 0.00 174.62 175.46 1c6s n LEU 31 N -0.92 0.56 0.00 4.42 4.32 -1.26 -3.44 117.00 120.68 1c6s n LEU 31 Ca -0.06 0.06 0.00 0.00 -0.02 0.00 0.00 56.01 56.00 1c6s n LEU 31 Cb 0.67 -0.22 0.00 0.00 -1.62 0.00 0.00 43.42 42.25 1c6s n LEU 31 CO 0.46 0.07 0.34 0.29 -1.22 0.00 0.00 177.39 177.33 1c6s n LYS 32 N -1.70 0.00 0.00 3.23 4.01 -1.25 -4.37 118.16 118.08 1c6s n LYS 32 Ca 0.05 0.68 0.00 0.00 -0.51 0.00 0.00 58.31 58.52 1c6s n LYS 32 Cb 0.37 -1.03 0.00 0.00 -0.51 0.00 0.00 35.03 33.86 1c6s n LYS 32 CO 0.00 0.00 0.00 1.17 -1.11 0.00 0.00 177.40 177.46 1c6s n LYS 33 N -2.51 0.00 -0.04 1.97 3.00 -1.26 -4.14 118.16 115.17 1c6s n LYS 33 Ca 0.00 0.00 -0.14 0.00 -0.00 0.00 0.00 58.31 58.17 1c6s n LYS 33 Cb 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 35.03 34.94 1c6s n LYS 33 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.40 178.33 1c6s h GLU 34 N 0.00 0.32 -0.04 1.64 5.08 -1.90 -2.65 114.58 117.02 1c6s h GLU 34 Ca 0.00 -0.22 -0.03 0.00 -1.00 0.00 0.00 59.36 58.11 1c6s h GLU 34 Cb 0.00 0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.29 1c6s h GLU 34 CO 0.00 0.84 -0.09 0.00 -1.00 0.00 0.00 179.01 178.76 1c6s h ALA 35 N 0.48 0.07 0.00 3.43 0.00 -1.80 0.68 119.26 122.12 1c6s h ALA 35 Ca -0.01 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.58 1c6s h ALA 35 Cb 0.85 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.63 1c6s h ALA 35 CO 0.05 -0.07 0.00 1.47 0.00 0.00 0.00 179.25 180.70 1c6s n LEU 36 N -4.69 0.55 -0.05 0.00 -0.00 -1.22 -1.39 117.00 110.20 1c6s n LEU 36 Ca -0.08 0.68 0.00 0.00 -0.00 0.00 0.00 56.01 56.61 1c6s n LEU 36 Cb 0.34 -0.66 0.01 0.00 -0.00 0.00 0.00 43.42 43.12 1c6s n LEU 36 CO 0.36 -0.67 0.47 -0.62 -0.00 0.00 0.00 177.39 176.93 1c6s n GLU 37 N -2.16 2.37 -0.09 1.47 -0.58 -1.00 0.13 120.64 120.79 1c6s n GLU 37 Ca 0.01 -1.39 -0.15 0.00 -0.42 0.00 0.00 57.16 55.21 1c6s n GLU 37 Cb 0.15 -1.02 -0.09 0.00 -0.57 0.00 0.00 31.44 29.91 1c6s n GLU 37 CO 0.00 0.00 0.00 0.37 -0.48 0.00 0.00 177.13 177.02 1c6s h GLN 38 N 0.17 0.00 0.14 3.49 5.75 0.16 -3.40 115.11 121.43 1c6s h GLN 38 Ca 0.00 0.00 -0.35 0.00 -0.15 0.00 0.00 58.65 58.15 1c6s h GLN 38 Cb 0.44 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 28.99 1c6s h GLN 38 CO 0.00 0.69 -1.85 0.27 -2.65 0.00 0.00 178.83 175.29 1c6s h PHE 39 N -1.00 0.56 0.00 3.99 -5.15 -1.79 -3.49 116.94 110.06 1c6s h PHE 39 Ca -0.17 -0.41 0.00 0.00 -0.20 0.00 0.00 57.97 57.19 1c6s h PHE 39 Cb 0.95 -0.02 0.00 0.00 0.22 0.00 0.00 35.95 37.10 1c6s h PHE 39 CO 0.06 1.73 0.00 0.41 -2.00 0.00 0.00 178.31 178.51 1c6s n GLY 40 N 1.92 0.47 0.95 6.09 0.00 -1.25 -5.03 105.19 108.34 1c6s n GLY 40 Ca -0.29 0.00 0.09 0.00 0.00 0.00 0.00 46.02 45.82 1c6s n GLY 40 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 1c6s n MET 41 N 0.00 2.67 0.00 1.61 0.00 0.13 -4.51 117.12 117.02 1c6s n MET 41 Ca 0.00 -2.27 0.00 0.00 0.00 0.00 0.00 57.70 55.43 1c6s n MET 41 Cb 0.00 -1.40 0.00 0.00 0.00 0.00 0.00 33.22 31.82 1c6s n MET 41 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 175.97 176.95 1c6s n TYR 42 N 1.05 0.00 -4.26 3.17 4.19 0.12 -3.93 117.16 117.50 1c6s n TYR 42 Ca 0.17 0.00 -0.35 0.00 3.31 0.00 0.00 57.90 61.03 1c6s n TYR 42 Cb 0.51 -0.02 -0.10 0.00 0.49 0.00 0.00 39.34 40.22 1c6s n TYR 42 CO 0.00 0.00 0.00 -1.12 0.91 0.00 0.00 176.86 176.65 1c6s s SER 43 N -1.00 5.35 0.16 2.98 0.01 -1.26 -4.95 113.70 114.99 1c6s s SER 43 Ca 0.00 0.12 -0.27 0.00 1.31 0.00 0.00 55.95 57.10 1c6s s SER 43 Cb 0.00 -1.68 0.01 0.00 0.21 0.00 0.00 66.02 64.56 1c6s s SER 43 CO 0.00 0.30 1.56 -0.33 0.41 0.00 0.00 173.24 175.18 1c6s h GLU 44 N 5.71 -0.20 -0.99 12.44 5.08 -1.90 0.66 114.58 135.37 1c6s h GLU 44 Ca -0.45 0.01 0.19 0.00 -1.00 0.00 0.00 59.36 58.12 1c6s h GLU 44 Cb 1.19 0.05 -0.10 0.00 0.50 0.00 0.00 28.75 30.39 1c6s h GLU 44 CO 0.59 -0.14 0.61 0.22 -1.00 0.00 0.00 179.01 179.30 1c6s h ASP 45 N -0.21 0.70 0.00 1.42 1.82 -1.95 0.65 116.42 118.85 1c6s h ASP 45 Ca 0.17 0.08 0.00 0.00 -0.39 0.00 0.00 57.03 56.89 1c6s h ASP 45 Cb 0.55 -0.04 0.00 0.00 0.68 0.00 0.00 39.33 40.52 1c6s h ASP 45 CO -0.73 0.25 0.00 0.00 -1.61 0.00 0.00 179.24 177.15 1c6s n ALA 46 N -2.38 -0.28 0.23 -0.78 0.00 0.22 -0.78 120.51 116.75 1c6s n ALA 46 Ca 0.22 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.72 1c6s n ALA 46 Cb 0.61 0.04 0.25 0.00 0.00 0.00 0.00 19.45 20.34 1c6s n ALA 46 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 177.50 179.01 1c6s n ILE 47 N -1.50 1.39 0.08 0.00 3.06 -0.90 -1.02 119.36 120.47 1c6s n ILE 47 Ca 0.00 0.42 -0.09 0.00 -2.50 0.00 0.00 62.75 60.58 1c6s n ILE 47 Cb 0.00 -1.33 -0.09 0.00 0.54 0.00 0.00 39.64 38.76 1c6s n ILE 47 CO 0.00 0.00 0.00 0.40 -2.50 0.00 0.00 176.55 174.45 1c6s h ILE 48 N 0.00 1.62 0.00 9.51 2.04 0.65 0.81 117.51 132.14 1c6s h ILE 48 Ca 0.00 -3.15 0.00 0.00 1.00 0.00 0.00 64.86 62.71 1c6s h ILE 48 Cb 0.13 2.77 0.00 0.00 -0.74 0.00 0.00 36.82 38.98 1c6s h ILE 48 CO 0.00 0.91 -0.89 0.00 0.00 0.00 0.00 178.15 178.17 1c6s n TYR 49 N -3.46 0.33 0.58 1.37 4.19 0.04 -2.46 117.16 117.75 1c6s n TYR 49 Ca -0.02 0.10 0.11 0.00 3.31 0.00 0.00 57.90 61.40 1c6s n TYR 49 Cb 0.92 -0.48 0.03 0.00 0.49 0.00 0.00 39.34 40.29 1c6s n TYR 49 CO 0.00 0.00 0.00 0.94 0.91 0.00 0.00 176.86 178.71 1c6s n GLN 50 N -1.98 0.28 -0.11 2.98 -0.06 -0.20 -3.88 117.38 114.41 1c6s n GLN 50 Ca 0.02 -0.00 -0.23 0.00 -2.00 0.00 0.00 57.00 54.79 1c6s n GLN 50 Cb 0.43 -1.59 -0.12 0.00 -4.06 0.00 0.00 30.24 24.90 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 -1.95 1.55 0.25 1.69 0.31 0.27 -1.96 118.33 118.49 1c6s n VAL 51 Ca 0.02 -0.46 0.10 0.00 -0.01 0.00 0.00 64.34 63.99 1c6s n VAL 51 Cb 0.43 -1.70 0.48 0.00 -0.91 0.00 0.00 33.84 32.14 1c6s n VAL 51 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1c6s n GLN 52 N -3.77 0.14 -0.62 5.55 6.02 -1.03 0.19 117.38 123.85 1c6s n GLN 52 Ca -0.45 0.52 -0.00 0.00 -0.01 0.00 0.00 57.00 57.06 1c6s n GLN 52 Cb 0.93 -1.85 -0.00 0.00 1.02 0.00 0.00 30.24 30.33 1c6s n GLN 52 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.06 176.77 1c6s n HIS 53 N -2.12 0.00 -0.26 1.08 -0.00 -1.25 -2.12 115.22 110.55 1c6s n HIS 53 Ca 0.00 -0.08 0.00 0.00 -0.00 0.00 0.00 57.72 57.65 1c6s n HIS 53 Cb 0.11 0.07 0.00 0.00 -0.00 0.00 0.00 29.99 30.17 1c6s n HIS 53 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 1c6s n GLY 54 N 0.05 3.55 0.00 -1.41 0.00 -0.83 -4.00 105.19 102.55 1c6s n GLY 54 Ca -0.01 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 45.90 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 -1.13 -3.94 118.16 132.71 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 -2.47 4.39 3.02 -1.26 -0.50 115.26 118.44 1c6s n ASN 56 Ca 0.00 0.00 -0.12 0.00 -0.03 0.00 0.00 54.58 54.43 1c6s n ASN 56 Cb 0.00 0.00 0.03 0.00 -0.61 0.00 0.00 39.78 39.20 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 5.66 3.79 -2.51 5.41 0.00 -1.26 -5.06 120.51 126.54 1c6s n ALA 57 Ca 0.00 -3.30 -0.32 0.00 0.00 0.00 0.00 53.44 49.82 1c6s n ALA 57 Cb 0.00 -0.64 -0.12 0.00 0.00 0.00 0.00 19.45 18.69 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 -3.65 2.32 -0.51 0.00 0.00 0.35 -5.05 119.30 112.76 1c6s s MET 58 Ca 0.38 -0.84 -0.28 0.00 0.00 0.00 0.00 55.69 54.95 1c6s s MET 58 Cb 0.37 -2.33 0.02 0.00 0.00 0.00 0.00 34.83 32.89 1c6s s MET 58 CO -0.01 0.58 1.32 -1.25 0.00 0.00 0.00 175.02 175.65 1c6s s PRO 59 N -1.32 3.51 0.98 4.11 0.04 -1.26 -2.84 135.00 138.22 1c6s s PRO 59 Ca 0.15 0.58 -0.17 0.00 0.04 0.00 0.00 61.00 61.60 1c6s s PRO 59 Cb -0.11 -4.03 -0.14 0.00 0.04 0.00 0.00 34.50 30.26 1c6s s PRO 59 CO 0.05 -1.67 -0.73 0.00 0.04 0.00 0.00 177.00 174.69 1c6s n ALA 60 N 8.79 -5.31 -1.65 8.56 0.00 -1.26 -4.07 120.51 125.58 1c6s n ALA 60 Ca 0.13 -0.67 0.00 0.00 0.00 0.00 0.00 53.44 52.90 1c6s n ALA 60 Cb 0.49 -1.18 0.00 0.00 0.00 0.00 0.00 19.45 18.76 1c6s n ALA 60 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1c6s n PHE 61 N -2.52 0.00 0.53 0.00 3.72 0.13 -4.69 117.46 114.64 1c6s n PHE 61 Ca -0.01 0.00 0.05 0.00 -0.05 0.00 0.00 57.45 57.44 1c6s n PHE 61 Cb 0.56 -0.02 0.27 0.00 -0.94 0.00 0.00 39.48 39.35 1c6s n PHE 61 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1c6s n ALA 62 N 0.00 1.74 -1.88 4.37 0.00 -0.90 -2.34 120.51 121.49 1c6s n ALA 62 Ca 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 53.44 53.39 1c6s n ALA 62 Cb 0.62 -1.16 0.00 0.00 0.00 0.00 0.00 19.45 18.91 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 -0.43 0.34 0.49 0.00 0.00 -1.26 -4.92 105.19 99.41 1c6s n GLY 63 Ca 0.06 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.00 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 0.32 0.00 1.61 0.00 -0.99 -5.01 116.66 112.59 1c6s n ARG 64 Ca 0.00 0.13 0.00 0.00 -0.00 0.00 0.00 57.85 57.98 1c6s n ARG 64 Cb 0.58 -1.06 0.00 0.00 0.00 0.00 0.00 32.46 31.99 1c6s n ARG 64 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.63 178.91 1c6s n LEU 65 N -3.98 0.00 -0.08 6.15 4.77 -1.20 -5.03 117.00 117.63 1c6s n LEU 65 Ca -0.14 0.00 -0.07 0.00 -0.03 0.00 0.00 56.01 55.76 1c6s n LEU 65 Cb 0.41 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.48 1c6s n LEU 65 CO 0.10 0.00 -0.56 0.41 -1.33 0.00 0.00 177.39 176.00 1c6s n THR 66 N 0.00 1.27 0.00 -5.08 -1.04 -1.26 -5.04 114.28 103.13 1c6s n THR 66 Ca 0.00 0.20 0.00 0.00 -2.04 0.00 0.00 64.05 62.21 1c6s n THR 66 Cb 0.00 -2.22 0.00 0.00 -1.82 0.00 0.00 70.33 66.29 1c6s n THR 66 CO 0.00 0.00 0.00 -0.67 -0.64 0.00 0.00 175.07 173.76 1c6s n ASP 67 N -4.17 0.00 0.00 8.00 2.03 -1.26 -4.89 116.55 116.27 1c6s n ASP 67 Ca -0.12 0.00 0.05 0.00 0.52 0.00 0.00 54.79 55.25 1c6s n ASP 67 Cb 0.43 0.00 0.32 0.00 -0.72 0.00 0.00 41.12 41.15 1c6s n ASP 67 CO 0.00 0.00 0.00 1.21 -1.92 0.00 0.00 177.20 176.49 1c6s n GLU 68 N 0.00 0.56 -0.04 -0.67 4.07 -1.26 -1.97 120.64 121.33 1c6s n GLU 68 Ca 0.00 0.00 -0.05 0.00 -0.06 0.00 0.00 57.16 57.05 1c6s n GLU 68 Cb 0.00 -1.30 -0.06 0.00 -0.06 0.00 0.00 31.44 30.02 1c6s n GLU 68 CO 0.00 0.00 0.00 1.04 -0.06 0.00 0.00 177.13 178.11 1c6s n GLN 69 N -0.80 1.91 0.27 5.31 1.13 -1.26 -0.78 117.38 123.16 1c6s n GLN 69 Ca 0.08 0.02 0.17 0.00 -1.94 0.00 0.00 57.00 55.33 1c6s n GLN 69 Cb 0.04 -1.20 0.94 0.00 0.11 0.00 0.00 30.24 30.12 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 0.37 0.00 5.09 1.08 -1.75 0.80 117.51 123.10 1c6s h ILE 70 Ca -0.22 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.25 1c6s h ILE 70 Cb 1.44 0.91 0.00 0.00 -3.07 0.00 0.00 36.82 36.11 1c6s h ILE 70 CO -0.00 0.00 0.00 0.00 -0.69 0.00 0.00 178.15 177.46 1c6s n GLN 71 N -3.62 0.00 -0.24 2.37 1.13 -1.08 -3.40 117.38 112.54 1c6s n GLN 71 Ca -0.01 0.14 -0.04 0.00 -1.94 0.00 0.00 57.00 55.15 1c6s n GLN 71 Cb 0.19 -0.53 0.02 0.00 0.11 0.00 0.00 30.24 30.03 1c6s n GLN 71 CO 0.00 0.00 0.00 0.22 -1.44 0.00 0.00 177.06 175.84 1c6s h ASP 72 N 0.00 -1.17 -0.98 1.08 1.82 -0.86 0.79 116.42 117.11 1c6s h ASP 72 Ca 0.00 0.24 0.09 0.00 -0.39 0.00 0.00 57.03 56.97 1c6s h ASP 72 Cb 0.00 0.60 -0.07 0.00 0.68 0.00 0.00 39.33 40.54 1c6s h ASP 72 CO 0.00 -0.30 0.63 0.58 -1.61 0.00 0.00 179.24 178.54 1c6s h VAL 73 N -0.12 1.00 0.52 2.25 2.07 0.45 1.30 116.25 123.73 1c6s h VAL 73 Ca 0.27 -0.36 -0.02 0.00 0.82 0.00 0.00 66.70 67.41 1c6s h VAL 73 Cb 0.56 -0.14 -0.02 0.00 -1.52 0.00 0.00 31.29 30.17 1c6s h VAL 73 CO -0.75 0.19 -0.47 0.00 0.02 0.00 0.00 177.57 176.56 1c6s h ALA 74 N 1.51 -1.08 0.00 1.67 0.00 0.62 0.49 119.26 122.46 1c6s h ALA 74 Ca 0.45 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 55.17 1c6s h ALA 74 Cb 0.33 0.66 0.00 0.00 0.00 0.00 0.00 17.79 18.78 1c6s h ALA 74 CO -0.21 -1.14 0.00 0.00 0.00 0.00 0.00 179.25 177.90 1c6s h ALA 75 N -0.79 1.00 -0.44 0.00 0.00 0.09 0.20 119.26 119.31 1c6s h ALA 75 Ca -0.06 0.00 -0.11 0.00 0.00 0.00 0.00 54.91 54.74 1c6s h ALA 75 Cb 0.85 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.62 1c6s h ALA 75 CO -0.03 0.00 -0.16 -0.92 0.00 0.00 0.00 179.25 178.13 1c6s h TYR 76 N 0.00 0.95 0.00 0.00 3.20 0.64 0.16 116.97 121.91 1c6s h TYR 76 Ca 0.00 -0.20 -0.06 0.00 3.14 0.00 0.00 58.73 61.61 1c6s h TYR 76 Cb 0.05 -0.23 -0.01 0.00 1.54 0.00 0.00 36.73 38.07 1c6s h TYR 76 CO 0.00 0.94 -0.28 0.28 -1.64 0.00 0.00 178.16 177.47 1c6s h VAL 77 N 0.75 0.53 -0.00 1.81 2.07 0.11 -1.13 116.25 120.38 1c6s h VAL 77 Ca 0.11 -1.51 0.00 0.00 0.82 0.00 0.00 66.70 66.12 1c6s h VAL 77 Cb 0.68 2.07 0.00 0.00 -1.52 0.00 0.00 31.29 32.52 1c6s h VAL 77 CO 0.05 0.27 -0.21 0.18 0.02 0.00 0.00 177.57 177.88 1c6s n LEU 78 N -3.24 0.55 -0.12 2.57 4.77 -0.66 -2.22 117.00 118.64 1c6s n LEU 78 Ca 0.02 0.00 -0.23 0.00 -0.03 0.00 0.00 56.01 55.77 1c6s n LEU 78 Cb 0.57 -0.22 -0.08 0.00 -2.33 0.00 0.00 43.42 41.36 1c6s n LEU 78 CO 0.36 0.11 -1.12 -0.67 -1.33 0.00 0.00 177.39 174.74 1c6s n ASP 79 N -1.06 1.94 -0.08 -1.43 2.03 0.46 -3.57 116.55 114.83 1c6s n ASP 79 Ca 0.11 0.36 -0.11 0.00 0.52 0.00 0.00 54.79 55.68 1c6s n ASP 79 Cb 0.31 -0.82 -0.04 0.00 -0.72 0.00 0.00 41.12 39.85 1c6s n ASP 79 CO 0.00 0.00 0.00 1.56 -1.92 0.00 0.00 177.20 176.84 1c6s h GLN 80 N -1.00 0.41 0.00 -0.67 1.08 -1.36 -1.99 115.11 111.59 1c6s h GLN 80 Ca -0.48 -0.11 0.00 0.00 -1.45 0.00 0.00 58.65 56.61 1c6s h GLN 80 Cb 1.39 -0.05 0.00 0.00 -0.05 0.00 0.00 27.48 28.77 1c6s h GLN 80 CO -0.29 0.54 0.00 0.00 -0.95 0.00 0.00 178.83 178.13 1c6s n ALA 81 N -2.31 1.70 1.41 3.87 0.00 -0.94 -0.78 120.51 123.46 1c6s n ALA 81 Ca -0.03 0.01 0.14 0.00 0.00 0.00 0.00 53.44 53.56 1c6s n ALA 81 Cb 0.20 -1.32 0.73 0.00 0.00 0.00 0.00 19.45 19.05 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 -1.64 2.41 -2.66 0.00 0.00 -0.75 -4.46 120.51 113.41 1c6s n ALA 82 Ca 0.03 -0.14 -0.03 0.00 0.00 0.00 0.00 53.44 53.30 1c6s n ALA 82 Cb 0.21 -1.45 0.09 0.00 0.00 0.00 0.00 19.45 18.30 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 -1.22 0.09 -0.78 0.00 0.00 -1.00 -5.05 118.16 110.19 1c6s n LYS 83 Ca 0.15 -0.62 0.00 0.00 -0.00 0.00 0.00 58.31 57.84 1c6s n LYS 83 Cb 0.19 -0.07 0.00 0.00 -0.00 0.00 0.00 35.03 35.15 1c6s n LYS 83 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1c6s n GLY 84 N 0.29 0.08 3.22 2.58 0.00 -1.16 -4.79 105.19 105.41 1c6s n GLY 84 Ca -0.11 -0.40 -0.09 0.00 0.00 0.00 0.00 46.02 45.41 1c6s n GLY 84 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 173.32 175.19 1c6s n TRP 85 N -0.37 0.04 -3.67 1.61 -0.00 0.04 -0.93 117.44 114.17 1c6s n TRP 85 Ca 0.00 -0.00 -0.22 0.00 -0.00 0.00 0.00 57.50 57.28 1c6s n TRP 85 Cb 0.11 -0.57 0.04 0.00 -0.00 0.00 0.00 31.31 30.88 1c6s n TRP 85 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 177.69 177.69 1c6s n ALA 86 N 5.42 -1.91 0.00 5.87 0.00 -1.26 -4.64 120.51 123.99 1c6s n ALA 86 Ca 0.28 -0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.64 1c6s n ALA 86 Cb 0.36 -2.44 0.00 0.00 0.00 0.00 0.00 19.45 17.36 1c6s n ALA 86 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91