#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 4.38 0.00 0.00 9.92 -1.26 -4.60 116.55 125.00 1c6s n ASP 2 Ca 0.00 0.00 0.07 0.00 -0.53 0.00 0.00 54.79 54.33 1c6s n ASP 2 Cb 0.00 0.68 0.37 0.00 -0.64 0.00 0.00 41.12 41.53 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 -1.54 0.00 0.27 0.64 4.77 -1.26 -1.65 117.00 118.23 1c6s n LEU 3 Ca 0.00 0.26 0.11 0.00 -0.03 0.00 0.00 56.01 56.36 1c6s n LEU 3 Cb 0.20 -0.26 0.75 0.00 -2.33 0.00 0.00 43.42 41.77 1c6s n LEU 3 CO 0.00 -0.14 1.07 0.00 -1.33 0.00 0.00 177.39 176.99 1c6s h ALA 4 N 2.71 1.71 -0.05 -1.18 0.00 -1.94 0.54 119.26 121.04 1c6s h ALA 4 Ca 0.00 -0.03 -0.18 0.00 0.00 0.00 0.00 54.91 54.70 1c6s h ALA 4 Cb 0.13 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1c6s h ALA 4 CO 0.00 0.04 -0.74 -0.91 0.00 0.00 0.00 179.25 177.64 1c6s h ASN 5 N 0.00 0.38 0.33 0.00 -0.26 -1.66 -3.12 115.58 111.24 1c6s h ASN 5 Ca -0.00 -0.25 -0.01 0.00 -0.56 0.00 0.00 56.30 55.48 1c6s h ASN 5 Cb 0.06 -0.11 -0.02 0.00 -1.06 0.00 0.00 38.32 37.19 1c6s h ASN 5 CO 0.00 0.99 -0.43 1.23 -1.06 0.00 0.00 177.43 178.17 1c6s h GLY 6 N 1.46 -1.18 -0.20 2.83 0.00 -0.05 -0.45 103.07 105.48 1c6s h GLY 6 Ca -0.03 0.57 0.28 0.00 0.00 0.00 0.00 47.33 48.14 1c6s h GLY 6 CO 0.12 -0.34 0.67 0.00 0.00 0.00 0.00 176.54 176.99 1c6s h ALA 7 N -0.96 2.23 -0.44 3.60 0.00 -1.51 0.54 119.26 122.72 1c6s h ALA 7 Ca -0.04 0.07 0.02 0.00 0.00 0.00 0.00 54.91 54.97 1c6s h ALA 7 Cb 0.70 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.50 1c6s h ALA 7 CO -0.11 -0.65 0.25 -0.22 0.00 0.00 0.00 179.25 178.52 1c6s h LYS 8 N 0.39 0.48 0.16 0.00 3.11 -1.05 0.13 116.57 119.78 1c6s h LYS 8 Ca 0.61 -0.03 -0.01 0.00 -2.81 0.00 0.00 60.65 58.42 1c6s h LYS 8 Cb 1.55 -0.11 0.00 0.00 -1.00 0.00 0.00 32.23 32.68 1c6s h LYS 8 CO -0.32 0.32 -0.08 0.28 -2.81 0.00 0.00 179.45 176.84 1c6s h VAL 9 N 0.49 0.00 -0.47 2.00 2.07 0.88 -3.23 116.25 117.99 1c6s h VAL 9 Ca 0.18 -0.54 0.14 0.00 0.82 0.00 0.00 66.70 67.30 1c6s h VAL 9 Cb 0.04 0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 29.79 1c6s h VAL 9 CO -0.10 0.00 0.79 0.15 0.02 0.00 0.00 177.57 178.43 1c6s h PHE 10 N -0.76 0.00 -0.57 1.57 3.04 -0.61 0.74 116.94 120.35 1c6s h PHE 10 Ca -0.02 0.00 -0.32 0.00 3.98 0.00 0.00 57.97 61.61 1c6s h PHE 10 Cb 0.16 0.00 -0.18 0.00 2.56 0.00 0.00 35.95 38.50 1c6s h PHE 10 CO 0.02 0.00 0.40 0.43 -2.02 0.00 0.00 178.31 177.14 1c6s n SER 11 N -3.18 4.05 0.00 0.41 7.64 0.44 0.44 113.62 123.42 1c6s n SER 11 Ca 0.10 -2.98 0.00 0.00 1.01 0.00 0.00 58.87 57.00 1c6s n SER 11 Cb 0.96 -0.76 0.00 0.00 -1.01 0.00 0.00 64.21 63.39 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 -0.34 0.08 0.92 0.23 0.00 0.25 -4.90 105.19 101.43 1c6s n GLY 12 Ca 0.35 -0.04 -0.03 0.00 0.00 0.00 0.00 46.02 46.30 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 -0.70 0.21 0.16 1.61 3.02 -0.55 -4.55 115.26 114.46 1c6s n ASN 13 Ca 0.00 0.04 0.01 0.00 -0.03 0.00 0.00 54.58 54.59 1c6s n ASN 13 Cb 0.00 -0.09 0.26 0.00 -0.61 0.00 0.00 39.78 39.35 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 1.50 1.33 0.00 0.00 0.00 -0.27 0.23 119.26 122.05 1c6s h ALA 15 Ca -0.00 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1c6s h ALA 15 Cb 0.89 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.38 1c6s h ALA 15 CO 0.06 0.56 0.00 0.00 0.00 0.00 0.00 179.25 179.88 1c6s n ALA 16 N -2.42 1.04 -2.17 0.00 0.00 -1.11 -2.39 120.51 113.47 1c6s n ALA 16 Ca 0.08 0.07 0.01 0.00 0.00 0.00 0.00 53.44 53.60 1c6s n ALA 16 Cb 0.08 -1.13 0.00 0.00 0.00 0.00 0.00 19.45 18.41 1c6s n ALA 16 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1c6s n HIS 18 N 0.17 -2.54 -2.24 0.00 8.25 -0.03 -3.10 115.22 115.73 1c6s n HIS 18 Ca 0.00 0.20 0.00 0.00 -0.26 0.00 0.00 57.72 57.66 1c6s n HIS 18 Cb 0.83 0.93 0.00 0.00 1.12 0.00 0.00 29.99 32.87 1c6s n HIS 18 CO 0.00 0.00 0.00 -0.12 0.64 0.00 0.00 176.34 176.86 1c6s n MET 19 N -2.63 -3.66 -3.79 -0.41 1.56 -1.15 -0.76 117.12 106.28 1c6s n MET 19 Ca 0.00 2.65 -0.33 0.00 -0.27 0.00 0.00 57.70 59.75 1c6s n MET 19 Cb 0.00 -3.45 0.03 0.00 2.15 0.00 0.00 33.22 31.94 1c6s n MET 19 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65 1c6s n GLY 20 N 1.90 -1.02 3.78 -5.12 0.00 -1.26 -2.28 105.19 101.20 1c6s n GLY 20 Ca 0.00 0.45 -0.26 0.00 0.00 0.00 0.00 46.02 46.21 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 -1.82 -1.26 2.75 -0.02 0.00 -1.26 -4.84 105.19 98.75 1c6s n GLY 21 Ca -0.13 0.57 -0.15 0.00 0.00 0.00 0.00 46.02 46.31 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 -3.05 -0.14 0.52 -0.02 0.00 0.06 -3.94 107.32 100.75 1c6s s GLY 22 Ca 0.06 -1.02 -0.22 0.00 0.00 0.00 0.00 44.72 43.54 1c6s s GLY 22 CO 0.90 2.87 1.25 0.70 0.00 0.00 0.00 173.10 178.81 1c6s n ASN 23 N 3.85 2.24 -0.10 1.64 4.13 -1.26 -3.13 115.26 122.64 1c6s n ASN 23 Ca 0.15 0.98 -0.20 0.00 1.68 0.00 0.00 54.58 57.19 1c6s n ASN 23 Cb 0.48 -1.51 -0.12 0.00 -1.54 0.00 0.00 39.78 37.09 1c6s n ASN 23 CO 0.00 0.00 0.00 1.33 0.28 0.00 0.00 177.26 178.87 1c6s n VAL 24 N -0.94 1.56 -0.05 2.41 0.24 -1.18 -4.52 118.33 115.85 1c6s n VAL 24 Ca 0.10 -0.55 -0.01 0.00 -2.04 0.00 0.00 64.34 61.83 1c6s n VAL 24 Cb 0.44 -1.56 -0.00 0.00 -1.47 0.00 0.00 33.84 31.24 1c6s n VAL 24 CO 0.00 0.00 0.00 0.58 -2.14 0.00 0.00 176.83 175.27 1c6s h VAL 25 N -0.12 0.00 -2.03 3.34 2.07 -1.92 -3.41 116.25 114.18 1c6s h VAL 25 Ca -0.55 -0.93 -0.66 0.00 0.82 0.00 0.00 66.70 65.38 1c6s h VAL 25 Cb 1.88 0.00 -0.15 0.00 -1.52 0.00 0.00 31.29 31.50 1c6s h VAL 25 CO -0.09 0.00 1.02 -0.04 0.02 0.00 0.00 177.57 178.49 1c6s s MET 26 N -1.74 3.59 0.46 1.57 1.00 -1.26 -4.82 119.30 118.10 1c6s s MET 26 Ca -0.05 -1.56 0.15 0.00 0.00 0.00 0.00 55.69 54.24 1c6s s MET 26 Cb 0.01 -5.03 1.08 0.00 0.00 0.00 0.00 34.83 30.88 1c6s s MET 26 CO 0.07 -1.90 2.03 0.00 0.00 0.00 0.00 175.02 175.22 1c6s h ALA 27 N 9.13 1.74 -0.11 3.03 0.00 -1.80 -2.38 119.26 128.87 1c6s h ALA 27 Ca 0.16 -0.13 -0.23 0.00 0.00 0.00 0.00 54.91 54.71 1c6s h ALA 27 Cb 1.02 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 18.80 1c6s h ALA 27 CO 1.20 0.18 -0.85 -2.95 0.00 0.00 0.00 179.25 176.83 1c6s h ASN 28 N 0.00 0.90 -3.33 0.00 7.08 -1.94 -3.41 115.58 114.89 1c6s h ASN 28 Ca -0.00 -0.63 -0.65 0.00 -3.08 0.00 0.00 56.30 51.94 1c6s h ASN 28 Cb 0.26 -0.27 -0.15 0.00 -2.08 0.00 0.00 38.32 36.08 1c6s h ASN 28 CO 0.02 1.43 0.26 -0.75 -2.08 0.00 0.00 177.43 176.30 1c6s s LYS 29 N -3.62 3.24 0.40 4.14 2.20 -0.90 -4.84 119.74 120.38 1c6s s LYS 29 Ca -0.10 -0.52 0.04 0.00 -0.36 0.00 0.00 55.97 55.02 1c6s s LYS 29 Cb 0.08 -4.04 -0.04 0.00 -1.51 0.00 0.00 37.83 32.32 1c6s s LYS 29 CO 0.91 -1.26 0.07 0.99 -0.36 0.00 0.00 175.35 175.70 1c6s s THR 30 N 3.15 1.03 -1.21 3.43 2.01 -1.26 -4.33 115.64 118.46 1c6s s THR 30 Ca 0.23 -2.00 0.23 0.00 0.31 0.00 0.00 61.69 60.46 1c6s s THR 30 Cb -0.15 -2.51 -0.08 0.00 0.01 0.00 0.00 72.50 69.77 1c6s s THR 30 CO 0.16 0.00 1.16 0.18 -0.69 0.00 0.00 174.62 175.43 1c6s n LEU 31 N -0.92 0.97 0.00 4.42 4.77 -1.26 -3.91 117.00 121.07 1c6s n LEU 31 Ca -0.07 -0.35 0.00 0.00 -0.03 0.00 0.00 56.01 55.56 1c6s n LEU 31 Cb 0.66 -0.09 0.00 0.00 -2.33 0.00 0.00 43.42 41.66 1c6s n LEU 31 CO 0.39 0.22 0.00 2.29 -1.33 0.00 0.00 177.39 178.96 1c6s n LYS 32 N -1.23 0.00 0.00 3.23 2.85 -1.25 -4.60 118.16 117.16 1c6s n LYS 32 Ca 0.06 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.32 1c6s n LYS 32 Cb 0.35 -0.33 0.00 0.00 -0.65 0.00 0.00 35.03 34.40 1c6s n LYS 32 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 177.40 178.52 1c6s n LYS 33 N 0.00 0.00 -0.06 -1.58 4.81 -1.26 -3.80 118.16 116.26 1c6s n LYS 33 Ca 0.00 0.00 -0.09 0.00 -0.87 0.00 0.00 58.31 57.35 1c6s n LYS 33 Cb 0.00 0.00 -0.09 0.00 0.02 0.00 0.00 35.03 34.96 1c6s n LYS 33 CO 0.00 0.00 0.00 1.05 1.17 0.00 0.00 177.40 179.62 1c6s h GLU 34 N 0.00 0.00 0.24 1.64 4.11 -1.94 -3.31 114.58 115.32 1c6s h GLU 34 Ca 0.00 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.42 1c6s h GLU 34 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1c6s h GLU 34 CO 0.00 0.67 -0.12 0.00 0.07 0.00 0.00 179.01 179.63 1c6s h ALA 35 N -0.34 -0.32 -0.57 1.06 0.00 -1.89 -1.32 119.26 115.88 1c6s h ALA 35 Ca -0.00 -0.19 0.17 0.00 0.00 0.00 0.00 54.91 54.88 1c6s h ALA 35 Cb 0.68 0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.57 1c6s h ALA 35 CO -0.00 -0.49 0.88 1.37 0.00 0.00 0.00 179.25 181.01 1c6s h LEU 36 N -0.71 0.00 0.02 0.00 -0.00 -1.76 0.71 115.31 113.57 1c6s h LEU 36 Ca -0.03 0.00 -0.34 0.00 -0.00 0.00 0.00 57.88 57.50 1c6s h LEU 36 Cb 0.49 0.00 -0.06 0.00 -0.00 0.00 0.00 40.66 41.09 1c6s h LEU 36 CO 0.05 0.00 -2.11 -0.62 -0.00 0.00 0.00 178.44 175.77 1c6s n GLU 37 N -3.18 0.67 -0.35 0.17 1.02 -1.02 0.12 120.64 118.08 1c6s n GLU 37 Ca 0.12 0.16 0.12 0.00 -0.02 0.00 0.00 57.16 57.54 1c6s n GLU 37 Cb 1.07 -1.64 0.32 0.00 -0.02 0.00 0.00 31.44 31.17 1c6s n GLU 37 CO 0.00 0.00 0.00 1.96 1.18 0.00 0.00 177.13 180.27 1c6s h GLN 38 N 0.01 0.77 0.04 3.49 1.08 0.16 -2.00 115.11 118.66 1c6s h GLN 38 Ca -0.44 -0.05 -0.20 0.00 -1.45 0.00 0.00 58.65 56.51 1c6s h GLN 38 Cb 2.09 -0.17 -0.02 0.00 -0.05 0.00 0.00 27.48 29.33 1c6s h GLN 38 CO 0.04 0.51 -1.08 0.74 -0.95 0.00 0.00 178.83 178.09 1c6s h PHE 39 N 0.79 0.14 0.00 2.96 0.04 -1.60 -3.49 116.94 115.79 1c6s h PHE 39 Ca 0.55 -0.10 0.00 0.00 2.80 0.00 0.00 57.97 61.22 1c6s h PHE 39 Cb 0.82 -0.01 0.00 0.00 2.20 0.00 0.00 35.95 38.96 1c6s h PHE 39 CO -0.00 1.42 0.00 0.41 -0.60 0.00 0.00 178.31 179.54 1c6s n GLY 40 N 1.57 0.77 0.15 -1.45 0.00 -0.52 -4.99 105.19 100.73 1c6s n GLY 40 Ca -0.26 0.00 0.01 0.00 0.00 0.00 0.00 46.02 45.77 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 1.10 -0.13 1.61 0.00 0.33 -3.69 117.12 116.35 1c6s n MET 41 Ca 0.00 -0.13 0.03 0.00 0.00 0.00 0.00 57.70 57.60 1c6s n MET 41 Cb 0.00 -1.12 0.09 0.00 0.00 0.00 0.00 33.22 32.19 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 -0.32 0.32 -4.06 3.17 9.36 -0.14 -3.97 117.16 121.52 1c6s n TYR 42 Ca 0.01 -0.14 -0.31 0.00 3.32 0.00 0.00 57.90 60.78 1c6s n TYR 42 Cb 0.08 -0.05 -0.06 0.00 -0.63 0.00 0.00 39.34 38.68 1c6s n TYR 42 CO 0.00 0.00 0.00 -1.54 0.22 0.00 0.00 176.86 175.54 1c6s s SER 43 N -0.82 5.57 0.10 2.98 1.04 -1.24 -4.86 113.70 116.47 1c6s s SER 43 Ca 0.13 0.02 -0.32 0.00 0.48 0.00 0.00 55.95 56.27 1c6s s SER 43 Cb 0.08 -1.52 -0.12 0.00 0.10 0.00 0.00 66.02 64.55 1c6s s SER 43 CO 0.08 0.19 1.59 -0.08 0.98 0.00 0.00 173.24 176.00 1c6s h GLU 44 N 3.42 -0.70 -0.26 4.02 4.81 -1.89 0.91 114.58 124.88 1c6s h GLU 44 Ca -0.47 0.05 0.07 0.00 -0.13 0.00 0.00 59.36 58.88 1c6s h GLU 44 Cb 1.17 0.16 -0.01 0.00 0.63 0.00 0.00 28.75 30.69 1c6s h GLU 44 CO 0.66 -0.47 0.47 0.22 -0.73 0.00 0.00 179.01 179.16 1c6s h ASP 45 N -0.73 0.00 0.00 1.04 1.82 -1.97 0.29 116.42 116.88 1c6s h ASP 45 Ca -0.01 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.63 1c6s h ASP 45 Cb 0.70 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.71 1c6s h ASP 45 CO -0.15 0.00 0.00 0.00 -1.61 0.00 0.00 179.24 177.48 1c6s n ALA 46 N -2.11 -0.03 0.23 -0.78 0.00 0.26 -2.90 120.51 115.18 1c6s n ALA 46 Ca 0.04 0.00 0.14 0.00 0.00 0.00 0.00 53.44 53.62 1c6s n ALA 46 Cb 0.59 0.00 0.75 0.00 0.00 0.00 0.00 19.45 20.79 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 0.00 -0.23 0.00 2.10 -1.31 0.83 117.51 118.89 1c6s h ILE 47 Ca 0.00 0.00 -0.19 0.00 1.08 0.00 0.00 64.86 65.75 1c6s h ILE 47 Cb 0.00 0.61 0.00 0.00 -1.09 0.00 0.00 36.82 36.34 1c6s h ILE 47 CO 0.00 0.00 -0.61 0.40 -1.08 0.00 0.00 178.15 176.86 1c6s h ILE 48 N 0.00 1.28 0.00 2.19 2.04 -0.52 0.00 117.51 122.51 1c6s h ILE 48 Ca 0.00 -1.82 0.00 0.00 1.00 0.00 0.00 64.86 64.04 1c6s h ILE 48 Cb 0.18 1.75 0.00 0.00 -0.74 0.00 0.00 36.82 38.01 1c6s h ILE 48 CO 0.00 0.58 -0.54 0.22 0.00 0.00 0.00 178.15 178.42 1c6s h TYR 49 N 0.59 0.00 0.00 1.37 5.03 -0.76 -2.42 116.97 120.78 1c6s h TYR 49 Ca -0.00 0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.31 1c6s h TYR 49 Cb 1.22 0.00 0.00 0.00 1.55 0.00 0.00 36.73 39.50 1c6s h TYR 49 CO 0.07 0.00 -0.66 0.37 -1.32 0.00 0.00 178.16 176.62 1c6s h GLN 50 N 0.00 0.00 0.03 1.82 5.75 -1.02 -3.29 115.11 118.40 1c6s h GLN 50 Ca 0.00 0.00 -0.36 0.00 -0.15 0.00 0.00 58.65 58.14 1c6s h GLN 50 Cb 0.84 0.00 -0.05 0.00 1.07 0.00 0.00 27.48 29.34 1c6s h GLN 50 CO 0.00 0.00 -2.22 0.28 -2.65 0.00 0.00 178.83 174.24 1c6s n VAL 51 N -2.82 1.55 0.53 2.39 0.31 -0.03 -2.77 118.33 117.50 1c6s n VAL 51 Ca 0.01 -0.70 0.10 0.00 -0.01 0.00 0.00 64.34 63.74 1c6s n VAL 51 Cb 0.54 -1.18 0.41 0.00 -0.91 0.00 0.00 33.84 32.70 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 -3.14 0.08 -0.75 5.55 6.02 -0.91 -2.80 117.38 121.42 1c6s n GLN 52 Ca -0.35 0.27 -0.01 0.00 -0.01 0.00 0.00 57.00 56.90 1c6s n GLN 52 Cb 1.06 -1.63 -0.02 0.00 1.02 0.00 0.00 30.24 30.67 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 -1.78 0.00 -4.43 1.08 -0.00 -1.24 -1.15 115.22 107.71 1c6s n HIS 53 Ca 0.04 -0.19 0.00 0.00 -0.00 0.00 0.00 57.72 57.56 1c6s n HIS 53 Cb 0.22 0.22 0.00 0.00 -0.00 0.00 0.00 29.99 30.43 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 0.06 0.35 0.00 -1.41 0.00 -1.11 -3.70 105.19 99.38 1c6s n GLY 54 Ca -0.07 -0.87 0.00 0.00 0.00 0.00 0.00 46.02 45.08 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 1.47 0.00 0.00 1.61 4.01 -0.77 -4.24 118.16 120.24 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 -0.77 4.39 3.02 -1.26 -0.76 115.26 119.88 1c6s n ASN 56 Ca 0.00 0.00 0.06 0.00 -0.03 0.00 0.00 54.58 54.61 1c6s n ASN 56 Cb 0.00 0.00 0.14 0.00 -0.61 0.00 0.00 39.78 39.31 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 3.97 3.08 -2.74 5.41 0.00 -1.26 -5.04 120.51 123.93 1c6s n ALA 57 Ca 0.00 -2.86 -0.35 0.00 0.00 0.00 0.00 53.44 50.24 1c6s n ALA 57 Cb 0.00 -0.46 -0.08 0.00 0.00 0.00 0.00 19.45 18.90 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 -2.18 3.05 -0.54 0.00 0.00 0.06 -5.04 119.30 114.65 1c6s s MET 58 Ca 0.34 -0.40 -0.28 0.00 0.00 0.00 0.00 55.69 55.35 1c6s s MET 58 Cb 0.35 -2.86 0.01 0.00 0.00 0.00 0.00 34.83 32.33 1c6s s MET 58 CO -0.08 0.69 1.44 -1.25 0.00 0.00 0.00 175.02 175.82 1c6s s PRO 59 N -1.19 3.30 -0.09 4.11 0.04 -1.26 -1.84 135.00 138.08 1c6s s PRO 59 Ca 0.17 0.53 -0.32 0.00 0.04 0.00 0.00 61.00 61.42 1c6s s PRO 59 Cb -0.12 -4.13 -0.10 0.00 0.04 0.00 0.00 34.50 30.20 1c6s s PRO 59 CO 0.06 -1.93 2.00 0.00 0.04 0.00 0.00 177.00 177.17 1c6s n ALA 60 N 9.64 1.29 -0.04 8.56 0.00 -1.24 -3.64 120.51 135.09 1c6s n ALA 60 Ca 0.13 0.14 -0.21 0.00 0.00 0.00 0.00 53.44 53.50 1c6s n ALA 60 Cb 0.49 -2.64 -0.13 0.00 0.00 0.00 0.00 19.45 17.17 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 11.00 0.27 -1.49 0.00 0.04 -1.55 -3.44 116.94 121.76 1c6s h PHE 61 Ca -0.46 -0.19 -0.13 0.00 2.80 0.00 0.00 57.97 59.98 1c6s h PHE 61 Cb 1.26 -0.01 -0.05 0.00 2.20 0.00 0.00 35.95 39.35 1c6s h PHE 61 CO 0.92 1.55 -0.12 0.00 -0.60 0.00 0.00 178.31 180.06 1c6s n ALA 62 N -3.12 -0.10 0.00 2.45 0.00 -0.30 -2.36 120.51 117.09 1c6s n ALA 62 Ca -0.28 0.11 0.00 0.00 0.00 0.00 0.00 53.44 53.27 1c6s n ALA 62 Cb 0.83 -0.85 0.00 0.00 0.00 0.00 0.00 19.45 19.43 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 -0.09 0.57 0.20 0.00 0.00 -1.26 -5.05 105.19 99.56 1c6s n GLY 63 Ca -0.07 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.71 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 0.53 0.00 1.61 0.63 -0.99 -4.92 116.66 113.52 1c6s n ARG 64 Ca 0.00 0.23 0.00 0.00 -0.92 0.00 0.00 57.85 57.16 1c6s n ARG 64 Cb 0.00 -1.40 0.00 0.00 0.45 0.00 0.00 32.46 31.51 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 -4.19 0.00 -0.10 6.15 7.99 -1.26 -4.98 117.00 120.61 1c6s n LEU 65 Ca -0.45 0.00 -0.15 0.00 -0.01 0.00 0.00 56.01 55.41 1c6s n LEU 65 Cb 0.80 0.00 -0.05 0.00 -0.11 0.00 0.00 43.42 44.06 1c6s n LEU 65 CO 0.05 0.00 -0.86 0.41 -1.51 0.00 0.00 177.39 175.48 1c6s n THR 66 N 0.00 1.50 0.00 -5.08 -1.04 -1.26 -5.04 114.28 103.37 1c6s n THR 66 Ca 0.00 -0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 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 -4.41 0.00 0.00 8.00 -0.08 -1.26 -4.88 116.55 113.92 1c6s n ASP 67 Ca -0.25 0.00 0.08 0.00 -1.51 0.00 0.00 54.79 53.10 1c6s n ASP 67 Cb 0.61 0.00 0.44 0.00 2.34 0.00 0.00 41.12 44.50 1c6s n ASP 67 CO 0.00 0.00 0.00 -0.62 0.12 0.00 0.00 177.20 176.70 1c6s n GLU 68 N 0.00 0.40 -0.04 -0.67 1.02 -1.26 -1.52 120.64 118.57 1c6s n GLU 68 Ca 0.00 0.04 -0.03 0.00 -0.02 0.00 0.00 57.16 57.15 1c6s n GLU 68 Cb 0.00 -1.50 -0.08 0.00 -0.02 0.00 0.00 31.44 29.84 1c6s n GLU 68 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 1c6s n GLN 69 N -1.09 1.94 0.26 3.49 1.13 -1.26 -1.26 117.38 120.58 1c6s n GLN 69 Ca 0.10 -0.02 0.18 0.00 -1.94 0.00 0.00 57.00 55.32 1c6s n GLN 69 Cb 0.07 -1.27 0.90 0.00 0.11 0.00 0.00 30.24 30.05 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 0.25 0.00 5.09 1.08 -1.64 0.52 117.51 122.81 1c6s h ILE 70 Ca -0.24 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.23 1c6s h ILE 70 Cb 1.45 0.81 0.00 0.00 -3.07 0.00 0.00 36.82 36.02 1c6s h ILE 70 CO 0.01 0.00 0.00 0.00 -0.69 0.00 0.00 178.15 177.47 1c6s n GLN 71 N -3.42 0.00 -0.28 2.37 3.00 -1.14 -3.90 117.38 114.02 1c6s n GLN 71 Ca 0.00 0.11 0.07 0.00 -0.01 0.00 0.00 57.00 57.17 1c6s n GLN 71 Cb 0.31 -0.60 0.19 0.00 0.00 0.00 0.00 30.24 30.14 1c6s n GLN 71 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.06 176.62 1c6s h ASP 72 N 0.00 -0.36 -0.61 1.08 3.32 -1.05 0.39 116.42 119.20 1c6s h ASP 72 Ca 0.00 0.21 -0.00 0.00 0.02 0.00 0.00 57.03 57.26 1c6s h ASP 72 Cb 0.00 0.37 -0.03 0.00 0.22 0.00 0.00 39.33 39.89 1c6s h ASP 72 CO 0.00 -0.21 0.38 1.62 -1.72 0.00 0.00 179.24 179.31 1c6s h VAL 73 N 0.10 1.17 0.43 -1.35 3.04 -0.18 2.40 116.25 121.86 1c6s h VAL 73 Ca 0.46 -0.35 -0.02 0.00 -1.01 0.00 0.00 66.70 65.77 1c6s h VAL 73 Cb 0.83 0.29 0.00 0.00 -2.01 0.00 0.00 31.29 30.41 1c6s h VAL 73 CO -0.72 0.17 -0.21 0.00 -1.01 0.00 0.00 177.57 175.81 1c6s h ALA 74 N 1.58 -0.74 0.00 3.17 0.00 -0.35 -1.49 119.26 121.42 1c6s h ALA 74 Ca 0.22 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1c6s h ALA 74 Cb -0.05 0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.96 1c6s h ALA 74 CO -0.04 -0.70 0.13 0.00 0.00 0.00 0.00 179.25 178.64 1c6s h ALA 75 N -1.43 1.13 -0.33 0.00 0.00 -1.08 0.93 119.26 118.48 1c6s h ALA 75 Ca -0.06 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.81 1c6s h ALA 75 Cb 0.45 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 1c6s h ALA 75 CO 0.10 -0.13 0.06 -0.92 0.00 0.00 0.00 179.25 178.36 1c6s h TYR 76 N 0.00 0.57 0.00 0.00 3.20 0.48 -0.04 116.97 121.18 1c6s h TYR 76 Ca 0.00 -0.08 -0.05 0.00 3.14 0.00 0.00 58.73 61.75 1c6s h TYR 76 Cb 0.27 -0.16 -0.01 0.00 1.54 0.00 0.00 36.73 38.38 1c6s h TYR 76 CO 0.00 0.60 -0.22 0.28 -1.64 0.00 0.00 178.16 177.18 1c6s h VAL 77 N 0.37 0.66 -0.00 1.81 2.07 0.19 -0.64 116.25 120.70 1c6s h VAL 77 Ca 0.10 -0.98 0.00 0.00 0.82 0.00 0.00 66.70 66.64 1c6s h VAL 77 Cb 0.33 1.63 0.00 0.00 -1.52 0.00 0.00 31.29 31.73 1c6s h VAL 77 CO 0.00 0.22 -0.08 0.18 0.02 0.00 0.00 177.57 177.91 1c6s n LEU 78 N -3.55 0.36 -0.11 2.57 4.77 -0.60 -2.35 117.00 118.09 1c6s n LEU 78 Ca -0.01 0.06 -0.24 0.00 -0.03 0.00 0.00 56.01 55.80 1c6s n LEU 78 Cb 0.37 -0.20 -0.11 0.00 -2.33 0.00 0.00 43.42 41.15 1c6s n LEU 78 CO 0.33 0.07 -1.21 -0.67 -1.33 0.00 0.00 177.39 174.57 1c6s n ASP 79 N -1.02 1.97 0.10 -1.43 -0.08 -0.13 -4.15 116.55 111.82 1c6s n ASP 79 Ca 0.15 0.17 -0.04 0.00 -1.51 0.00 0.00 54.79 53.56 1c6s n ASP 79 Cb 0.26 -0.71 0.14 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 -0.53 0.15 0.18 -0.67 7.50 -1.44 -1.94 115.11 118.36 1c6s h GLN 80 Ca -0.58 -0.10 0.00 0.00 0.50 0.00 0.00 58.65 58.46 1c6s h GLN 80 Cb 1.72 0.02 -0.01 0.00 0.05 0.00 0.00 27.48 29.26 1c6s h GLN 80 CO -0.22 0.71 -0.15 0.00 -1.50 0.00 0.00 178.83 177.67 1c6s h ALA 81 N 1.26 -0.32 -0.26 3.87 0.00 -1.56 -0.63 119.26 121.62 1c6s h ALA 81 Ca -0.01 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1c6s h ALA 81 Cb 1.10 0.21 0.00 0.00 0.00 0.00 0.00 17.79 19.10 1c6s h ALA 81 CO 0.09 -0.70 0.00 0.00 0.00 0.00 0.00 179.25 178.64 1c6s n ALA 82 N -2.35 3.08 -0.60 0.00 0.00 -1.21 -3.79 120.51 115.64 1c6s n ALA 82 Ca -0.08 -0.83 0.00 0.00 0.00 0.00 0.00 53.44 52.53 1c6s n ALA 82 Cb 0.19 -1.05 0.00 0.00 0.00 0.00 0.00 19.45 18.59 1c6s n ALA 82 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1c6s n LYS 83 N 0.29 0.49 -1.46 0.00 4.81 -0.38 -5.04 118.16 116.86 1c6s n LYS 83 Ca 0.12 -0.59 0.00 0.00 -0.87 0.00 0.00 58.31 56.97 1c6s n LYS 83 Cb 0.65 -0.70 0.00 0.00 0.02 0.00 0.00 35.03 34.99 1c6s n LYS 83 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1c6s n GLY 84 N -0.11 -0.51 2.92 3.14 0.00 -0.39 -4.70 105.19 105.54 1c6s n GLY 84 Ca 0.00 -0.16 -0.08 0.00 0.00 0.00 0.00 46.02 45.78 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 -0.68 0.00 -1.79 1.61 7.02 -0.67 -1.36 117.44 121.58 1c6s n TRP 85 Ca 0.00 0.00 -0.05 0.00 -1.02 0.00 0.00 57.50 56.43 1c6s n TRP 85 Cb 0.19 -0.46 -0.01 0.00 -2.42 0.00 0.00 31.31 28.61 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 4.47 -0.48 0.00 6.99 0.00 -1.26 -4.86 120.51 125.36 1c6s n ALA 86 Ca 0.24 0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.74 1c6s n ALA 86 Cb 0.33 -0.79 0.00 0.00 0.00 0.00 0.00 19.45 18.99 1c6s n ALA 86 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91