#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1c6s s ASP 2 N 0.00 2.52 0.00 0.00 -1.08 -1.26 -4.98 116.67 111.87 1c6s s ASP 2 Ca 0.00 -0.52 0.14 0.00 -0.52 0.00 0.00 52.55 51.66 1c6s s ASP 2 Cb 0.00 -0.22 0.84 0.00 -1.46 0.00 0.00 42.92 42.08 1c6s s ASP 2 CO 0.00 0.18 1.27 0.00 0.52 0.00 0.00 175.17 177.13 1c6s n LEU 3 N 1.90 0.00 -0.18 -1.34 -0.00 -1.26 -2.13 117.00 113.99 1c6s n LEU 3 Ca -0.17 0.01 -0.08 0.00 -0.00 0.00 0.00 56.01 55.77 1c6s n LEU 3 Cb 0.53 -0.01 0.01 0.00 -0.00 0.00 0.00 43.42 43.95 1c6s n LEU 3 CO 0.23 -0.01 0.95 0.00 -0.00 0.00 0.00 177.39 178.57 1c6s h ALA 4 N 2.87 0.66 -1.07 1.47 0.00 -1.94 0.23 119.26 121.48 1c6s h ALA 4 Ca 0.00 -0.16 0.31 0.00 0.00 0.00 0.00 54.91 55.07 1c6s h ALA 4 Cb 0.00 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 17.55 1c6s h ALA 4 CO 0.00 0.27 0.85 -0.97 0.00 0.00 0.00 179.25 179.41 1c6s h ASN 5 N 0.68 0.00 0.48 0.00 -0.73 -1.78 0.29 115.58 114.52 1c6s h ASN 5 Ca 0.17 0.00 -0.01 0.00 1.87 0.00 0.00 56.30 58.33 1c6s h ASN 5 Cb 0.20 0.00 -0.02 0.00 0.27 0.00 0.00 38.32 38.78 1c6s h ASN 5 CO -0.01 0.00 -0.40 1.23 -0.37 0.00 0.00 177.43 177.87 1c6s h GLY 6 N 0.00 -1.00 -0.56 1.57 0.00 -0.72 -0.51 103.07 101.86 1c6s h GLY 6 Ca 0.51 0.46 0.33 0.00 0.00 0.00 0.00 47.33 48.63 1c6s h GLY 6 CO -0.01 -0.34 0.96 0.00 0.00 0.00 0.00 176.54 177.15 1c6s h ALA 7 N -0.54 3.04 -0.19 3.60 0.00 -0.46 0.88 119.26 125.59 1c6s h ALA 7 Ca -0.05 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.77 1c6s h ALA 7 Cb 0.75 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.63 1c6s h ALA 7 CO -0.02 -1.55 -0.07 -0.22 0.00 0.00 0.00 179.25 177.39 1c6s h LYS 8 N 0.00 0.38 0.06 0.00 3.11 -1.08 0.14 116.57 119.18 1c6s h LYS 8 Ca 0.55 -0.16 -0.00 0.00 -2.81 0.00 0.00 60.65 58.22 1c6s h LYS 8 Cb 2.45 -0.01 0.00 0.00 -1.00 0.00 0.00 32.23 33.67 1c6s h LYS 8 CO -0.01 0.67 -0.03 0.28 -2.81 0.00 0.00 179.45 177.55 1c6s h VAL 9 N 0.08 1.27 0.00 2.00 2.07 0.87 -3.14 116.25 119.40 1c6s h VAL 9 Ca 0.04 -1.42 -0.02 0.00 0.82 0.00 0.00 66.70 66.12 1c6s h VAL 9 Cb 0.54 2.16 -0.00 0.00 -1.52 0.00 0.00 31.29 32.47 1c6s h VAL 9 CO 0.02 0.34 -0.11 0.15 0.02 0.00 0.00 177.57 177.99 1c6s h PHE 10 N -0.75 0.00 -0.14 1.57 3.04 -0.76 0.49 116.94 120.39 1c6s h PHE 10 Ca -0.01 0.00 0.00 0.00 3.98 0.00 0.00 57.97 61.94 1c6s h PHE 10 Cb 0.62 0.00 0.00 0.00 2.56 0.00 0.00 35.95 39.13 1c6s h PHE 10 CO 0.13 0.11 0.00 0.45 -2.02 0.00 0.00 178.31 176.98 1c6s n SER 11 N -4.24 1.42 -0.09 0.41 2.88 0.50 -0.10 113.62 114.40 1c6s n SER 11 Ca -0.03 -2.10 0.00 0.00 -1.33 0.00 0.00 58.87 55.42 1c6s n SER 11 Cb 0.19 -0.33 0.00 0.00 -0.75 0.00 0.00 64.21 63.32 1c6s n SER 11 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1c6s n GLY 12 N 0.43 0.95 2.08 0.46 0.00 -0.10 -4.93 105.19 104.09 1c6s n GLY 12 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 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 -1.52 0.17 1.61 3.02 0.15 -4.89 115.26 113.80 1c6s n ASN 13 Ca 0.00 0.36 0.04 0.00 -0.03 0.00 0.00 54.58 54.95 1c6s n ASN 13 Cb 0.48 1.66 0.25 0.00 -0.61 0.00 0.00 39.78 41.56 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 1.57 1.43 0.00 0.00 0.00 -0.75 0.19 119.26 121.70 1c6s h ALA 15 Ca -0.00 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 1c6s h ALA 15 Cb 1.04 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 18.52 1c6s h ALA 15 CO 0.06 0.43 -0.00 0.00 0.00 0.00 0.00 179.25 179.74 1c6s h ALA 16 N 1.47 1.09 0.00 0.00 0.00 -1.82 -2.36 119.26 117.64 1c6s h ALA 16 Ca 0.41 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.32 1c6s h ALA 16 Cb 0.15 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.94 1c6s h ALA 16 CO -0.16 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.10 1c6s n HIS 18 N -0.33 -2.41 -2.21 0.00 8.25 0.53 -2.94 115.22 116.10 1c6s n HIS 18 Ca 0.00 0.50 0.00 0.00 -0.26 0.00 0.00 57.72 57.96 1c6s n HIS 18 Cb 0.28 1.39 0.00 0.00 1.12 0.00 0.00 29.99 32.78 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 -2.95 -4.45 -4.08 -0.41 1.56 -0.93 -0.49 117.12 105.38 1c6s n MET 19 Ca 0.00 3.19 -0.46 0.00 -0.27 0.00 0.00 57.70 60.16 1c6s n MET 19 Cb 0.00 -3.91 0.02 0.00 2.15 0.00 0.00 33.22 31.48 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 1.89 -0.82 3.37 -5.12 0.00 -1.26 -1.85 105.19 101.40 1c6s n GLY 20 Ca 0.00 0.33 -0.17 0.00 0.00 0.00 0.00 46.02 46.18 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 -2.07 -1.03 2.73 -0.02 0.00 -1.26 -4.72 105.19 98.82 1c6s n GLY 21 Ca -0.11 0.77 -0.08 0.00 0.00 0.00 0.00 46.02 46.59 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 -2.66 -0.75 1.01 -0.02 0.00 0.36 -3.46 107.32 101.80 1c6s s GLY 22 Ca 0.11 -0.76 -0.14 0.00 0.00 0.00 0.00 44.72 43.93 1c6s s GLY 22 CO 0.83 3.33 0.52 -2.01 0.00 0.00 0.00 173.10 175.77 1c6s n ASN 23 N 3.12 -1.66 -0.36 1.64 2.85 -1.25 -3.26 115.26 116.34 1c6s n ASN 23 Ca 0.19 0.18 0.00 0.00 -0.11 0.00 0.00 54.58 54.85 1c6s n ASN 23 Cb 0.54 -1.21 0.00 0.00 1.24 0.00 0.00 39.78 40.35 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 -4.08 0.00 0.05 3.44 0.24 -1.15 -4.80 118.33 112.03 1c6s n VAL 24 Ca 0.06 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.36 1c6s n VAL 24 Cb 0.55 0.50 0.00 0.00 -1.47 0.00 0.00 33.84 33.43 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 0.00 0.50 -0.97 3.34 0.31 -1.26 -5.08 118.33 115.17 1c6s n VAL 25 Ca 0.00 0.16 -0.08 0.00 -0.01 0.00 0.00 64.34 64.42 1c6s n VAL 25 Cb 0.61 -1.21 0.06 0.00 -0.91 0.00 0.00 33.84 32.39 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 -3.23 -0.88 -2.61 5.55 2.81 -1.26 -5.02 117.12 112.48 1c6s n MET 26 Ca 0.00 -0.49 -0.11 0.00 -1.81 0.00 0.00 57.70 55.28 1c6s n MET 26 Cb 0.13 -0.38 0.03 0.00 -0.71 0.00 0.00 33.22 32.29 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 -3.34 3.66 0.00 3.04 0.00 -1.26 -4.85 120.51 117.77 1c6s n ALA 27 Ca -0.05 -3.32 0.00 0.00 0.00 0.00 0.00 53.44 50.07 1c6s n ALA 27 Cb 0.15 -0.79 0.00 0.00 0.00 0.00 0.00 19.45 18.81 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 -0.34 0.00 -4.60 0.00 0.23 -1.26 -5.09 115.26 104.20 1c6s n ASN 28 Ca 0.17 0.00 -0.43 0.00 -0.53 0.00 0.00 54.58 53.79 1c6s n ASN 28 Cb 0.80 0.00 -0.02 0.00 -2.08 0.00 0.00 39.78 38.48 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 3.58 0.05 -3.83 1.02 -1.26 -4.73 119.74 114.57 1c6s s LYS 29 Ca 0.00 1.03 0.04 0.00 0.02 0.00 0.00 55.97 57.06 1c6s s LYS 29 Cb 0.00 -4.03 -0.03 0.00 -0.52 0.00 0.00 37.83 33.25 1c6s s LYS 29 CO 0.00 -1.55 -0.11 0.99 -0.92 0.00 0.00 175.35 173.76 1c6s s THR 30 N 5.49 0.81 -0.27 2.17 2.01 -1.26 -4.52 115.64 120.06 1c6s s THR 30 Ca 0.63 -1.13 0.28 0.00 0.31 0.00 0.00 61.69 61.77 1c6s s THR 30 Cb -0.15 -0.81 0.34 0.00 0.01 0.00 0.00 72.50 71.89 1c6s s THR 30 CO 0.32 -0.27 1.79 -0.07 -0.69 0.00 0.00 174.62 175.70 1c6s h LEU 31 N 4.50 0.00 0.00 4.42 4.07 -1.92 -2.83 115.31 123.55 1c6s h LEU 31 Ca -0.38 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.58 1c6s h LEU 31 Cb 1.20 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.94 1c6s h LEU 31 CO 0.41 0.00 0.00 1.17 -1.08 0.00 0.00 178.44 178.94 1c6s n LYS 32 N -2.88 0.00 0.00 1.13 4.81 -1.22 -4.70 118.16 115.30 1c6s n LYS 32 Ca 0.03 0.34 0.00 0.00 -0.87 0.00 0.00 58.31 57.81 1c6s n LYS 32 Cb 0.39 -0.85 0.00 0.00 0.02 0.00 0.00 35.03 34.59 1c6s n LYS 32 CO 0.00 0.00 0.00 0.36 1.17 0.00 0.00 177.40 178.93 1c6s n LYS 33 N -0.70 0.00 -0.14 1.64 2.85 -1.26 -4.25 118.16 116.29 1c6s n LYS 33 Ca 0.00 0.00 0.11 0.00 -1.05 0.00 0.00 58.31 57.37 1c6s n LYS 33 Cb 0.00 0.00 0.45 0.00 -0.65 0.00 0.00 35.03 34.83 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 0.52 0.01 -1.58 4.39 -1.90 0.24 114.58 116.25 1c6s h GLU 34 Ca 0.00 -0.03 -0.39 0.00 0.34 0.00 0.00 59.36 59.28 1c6s h GLU 34 Cb 0.00 -0.12 -0.07 0.00 -0.10 0.00 0.00 28.75 28.47 1c6s h GLU 34 CO 0.00 0.34 -2.43 0.00 -1.16 0.00 0.00 179.01 175.76 1c6s n ALA 35 N -2.49 1.40 0.48 3.43 0.00 -1.26 -2.72 120.51 119.35 1c6s n ALA 35 Ca 0.12 -1.08 0.07 0.00 0.00 0.00 0.00 53.44 52.55 1c6s n ALA 35 Cb 0.37 -0.15 0.31 0.00 0.00 0.00 0.00 19.45 19.98 1c6s n ALA 35 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.50 178.97 1c6s n LEU 36 N -3.26 0.04 -0.07 0.00 -0.00 -1.07 -1.54 117.00 111.11 1c6s n LEU 36 Ca -0.44 0.51 0.01 0.00 -0.00 0.00 0.00 56.01 56.09 1c6s n LEU 36 Cb 1.00 -0.50 0.01 0.00 -0.00 0.00 0.00 43.42 43.93 1c6s n LEU 36 CO 0.28 -0.28 0.37 -0.62 -0.00 0.00 0.00 177.39 177.14 1c6s n GLU 37 N -1.54 0.63 -0.08 1.47 1.02 0.82 -1.09 120.64 121.87 1c6s n GLU 37 Ca 0.03 -0.96 -0.15 0.00 -0.02 0.00 0.00 57.16 56.06 1c6s n GLU 37 Cb 0.17 -1.03 -0.11 0.00 -0.02 0.00 0.00 31.44 30.45 1c6s n GLU 37 CO 0.00 0.00 0.00 0.37 1.18 0.00 0.00 177.13 178.68 1c6s h GLN 38 N 0.28 0.00 0.10 3.49 5.75 -1.07 -3.38 115.11 120.27 1c6s h GLN 38 Ca 0.00 0.00 -0.32 0.00 -0.15 0.00 0.00 58.65 58.18 1c6s h GLN 38 Cb 0.24 0.00 -0.02 0.00 1.07 0.00 0.00 27.48 28.77 1c6s h GLN 38 CO 0.00 0.89 -1.66 0.27 -2.65 0.00 0.00 178.83 175.67 1c6s h PHE 39 N -1.00 0.37 0.00 3.99 -5.15 -1.82 -3.49 116.94 109.85 1c6s h PHE 39 Ca -0.11 -0.27 0.00 0.00 -0.20 0.00 0.00 57.97 57.39 1c6s h PHE 39 Cb 1.00 -0.01 0.00 0.00 0.22 0.00 0.00 35.95 37.16 1c6s h PHE 39 CO 0.18 1.40 0.00 0.41 -2.00 0.00 0.00 178.31 178.30 1c6s n GLY 40 N 1.71 0.81 0.51 6.09 0.00 -1.26 -5.04 105.19 108.02 1c6s n GLY 40 Ca -0.20 -0.13 0.05 0.00 0.00 0.00 0.00 46.02 45.74 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 2.39 0.00 1.61 0.00 -0.25 -4.59 117.12 116.29 1c6s n MET 41 Ca 0.00 -1.79 0.00 0.00 0.00 0.00 0.00 57.70 55.91 1c6s n MET 41 Cb 0.00 -1.22 0.00 0.00 0.00 0.00 0.00 33.22 32.00 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 0.39 0.00 -4.20 3.17 4.19 -0.28 -3.90 117.16 116.54 1c6s n TYR 42 Ca 0.09 0.00 -0.33 0.00 3.31 0.00 0.00 57.90 60.97 1c6s n TYR 42 Cb 0.37 -0.00 -0.08 0.00 0.49 0.00 0.00 39.34 40.11 1c6s n TYR 42 CO 0.00 0.00 0.00 -1.54 0.91 0.00 0.00 176.86 176.23 1c6s s SER 43 N -1.45 5.46 0.14 2.98 1.04 -1.26 -4.90 113.70 115.71 1c6s s SER 43 Ca 0.00 0.12 -0.30 0.00 0.48 0.00 0.00 55.95 56.25 1c6s s SER 43 Cb 0.00 -1.53 -0.05 0.00 0.10 0.00 0.00 66.02 64.53 1c6s s SER 43 CO 0.00 0.30 1.56 -0.33 0.98 0.00 0.00 173.24 175.75 1c6s h GLU 44 N 4.43 -0.35 -1.06 4.02 5.08 -1.91 0.28 114.58 125.06 1c6s h GLU 44 Ca -0.50 0.02 0.28 0.00 -1.00 0.00 0.00 59.36 58.17 1c6s h GLU 44 Cb 1.18 0.08 -0.11 0.00 0.50 0.00 0.00 28.75 30.41 1c6s h GLU 44 CO 0.59 -0.23 0.67 0.22 -1.00 0.00 0.00 179.01 179.26 1c6s h ASP 45 N -0.36 0.47 0.00 1.42 1.82 -1.94 0.76 116.42 118.58 1c6s h ASP 45 Ca 0.11 0.10 0.00 0.00 -0.39 0.00 0.00 57.03 56.85 1c6s h ASP 45 Cb 0.59 0.04 0.00 0.00 0.68 0.00 0.00 39.33 40.64 1c6s h ASP 45 CO -0.59 0.05 0.00 0.00 -1.61 0.00 0.00 179.24 177.08 1c6s n ALA 46 N -2.44 -0.46 0.32 -0.78 0.00 0.95 -0.24 120.51 117.86 1c6s n ALA 46 Ca 0.27 0.00 0.04 0.00 0.00 0.00 0.00 53.44 53.76 1c6s n ALA 46 Cb 0.92 0.00 0.19 0.00 0.00 0.00 0.00 19.45 20.56 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 -1.96 1.34 0.06 0.00 3.06 -1.01 -1.10 119.36 119.75 1c6s n ILE 47 Ca 0.00 0.33 0.01 0.00 -2.50 0.00 0.00 62.75 60.59 1c6s n ILE 47 Cb 0.00 -1.18 -0.06 0.00 0.54 0.00 0.00 39.64 38.94 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 0.59 0.00 9.51 2.04 0.84 -2.14 117.51 128.35 1c6s h ILE 48 Ca 0.00 -2.05 -0.09 0.00 1.00 0.00 0.00 64.86 63.72 1c6s h ILE 48 Cb 0.15 2.12 -0.02 0.00 -0.74 0.00 0.00 36.82 38.33 1c6s h ILE 48 CO 0.00 0.34 -1.12 0.22 0.00 0.00 0.00 178.15 177.59 1c6s h TYR 49 N 0.00 0.00 0.00 1.37 3.20 0.10 -2.82 116.97 118.82 1c6s h TYR 49 Ca -0.12 0.00 -0.21 0.00 3.14 0.00 0.00 58.73 61.54 1c6s h TYR 49 Cb 1.53 0.00 -0.04 0.00 1.54 0.00 0.00 36.73 39.76 1c6s h TYR 49 CO 0.00 0.34 -1.78 0.00 -1.64 0.00 0.00 178.16 175.08 1c6s n GLN 50 N -2.85 0.65 -0.04 1.82 -0.00 -0.94 -3.77 117.38 112.24 1c6s n GLN 50 Ca -0.05 0.11 -0.14 0.00 -0.00 0.00 0.00 57.00 56.92 1c6s n GLN 50 Cb 0.71 -1.69 -0.11 0.00 -0.00 0.00 0.00 30.24 29.15 1c6s n GLN 50 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.06 177.34 1c6s h VAL 51 N 0.00 1.58 0.00 -0.39 2.07 -1.51 1.39 116.25 119.39 1c6s h VAL 51 Ca -0.25 -1.78 0.00 0.00 0.82 0.00 0.00 66.70 65.48 1c6s h VAL 51 Cb 1.72 2.77 0.00 0.00 -1.52 0.00 0.00 31.29 34.26 1c6s h VAL 51 CO 0.04 0.47 0.00 0.00 0.02 0.00 0.00 177.57 178.10 1c6s n GLN 52 N -4.69 0.09 -0.16 1.57 6.02 -1.06 0.10 117.38 119.25 1c6s n GLN 52 Ca -0.09 0.46 0.00 0.00 -0.01 0.00 0.00 57.00 57.36 1c6s n GLN 52 Cb 0.39 -1.72 0.00 0.00 1.02 0.00 0.00 30.24 29.93 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 -1.90 0.00 -2.71 1.08 -0.00 -1.21 -1.52 115.22 108.96 1c6s n HIS 53 Ca 0.01 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.73 1c6s n HIS 53 Cb 0.11 0.06 0.00 0.00 -0.00 0.00 0.00 29.99 30.16 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 0.00 1.61 0.00 -1.41 0.00 0.47 -3.77 105.19 102.10 1c6s n GLY 54 Ca 0.00 -0.59 0.00 0.00 0.00 0.00 0.00 46.02 45.43 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 12.88 0.00 0.00 1.61 4.01 -1.09 -4.05 118.16 131.52 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 -2.55 4.39 5.03 -1.26 0.28 115.26 121.15 1c6s n ASN 56 Ca 0.00 0.00 -0.18 0.00 0.87 0.00 0.00 54.58 55.27 1c6s n ASN 56 Cb 0.00 0.00 0.02 0.00 -1.02 0.00 0.00 39.78 38.78 1c6s n ASN 56 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1c6s n ALA 57 N 5.56 4.27 -2.51 5.41 0.00 -1.26 -5.06 120.51 126.92 1c6s n ALA 57 Ca 0.00 -3.74 -0.25 0.00 0.00 0.00 0.00 53.44 49.45 1c6s n ALA 57 Cb 0.00 -0.72 -0.14 0.00 0.00 0.00 0.00 19.45 18.60 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 -3.37 1.27 -0.53 0.00 0.00 0.14 -4.96 119.30 111.86 1c6s s MET 58 Ca 0.38 -0.99 -0.28 0.00 0.00 0.00 0.00 55.69 54.80 1c6s s MET 58 Cb 0.42 -1.42 0.03 0.00 0.00 0.00 0.00 34.83 33.86 1c6s s MET 58 CO -0.08 0.35 1.13 -1.25 0.00 0.00 0.00 175.02 175.18 1c6s s PRO 59 N -1.39 3.57 1.01 4.11 0.04 -1.26 -2.67 135.00 138.41 1c6s s PRO 59 Ca 0.07 0.31 -0.25 0.00 0.04 0.00 0.00 61.00 61.17 1c6s s PRO 59 Cb -0.09 -3.97 -0.17 0.00 0.04 0.00 0.00 34.50 30.31 1c6s s PRO 59 CO 0.02 -1.52 -1.29 0.00 0.04 0.00 0.00 177.00 174.25 1c6s n ALA 60 N 8.05 -5.64 -1.72 8.56 0.00 -1.25 -4.04 120.51 124.47 1c6s n ALA 60 Ca 0.09 -1.22 0.00 0.00 0.00 0.00 0.00 53.44 52.31 1c6s n ALA 60 Cb 0.49 -0.92 0.00 0.00 0.00 0.00 0.00 19.45 19.02 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 -3.32 0.00 -0.26 0.00 3.72 0.29 -4.64 117.46 113.24 1c6s n PHE 61 Ca -0.02 0.00 0.33 0.00 -0.05 0.00 0.00 57.45 57.71 1c6s n PHE 61 Cb 0.70 0.09 0.71 0.00 -0.94 0.00 0.00 39.48 40.05 1c6s n PHE 61 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1c6s h ALA 62 N 0.00 2.98 -0.02 4.37 0.00 -1.43 -2.86 119.26 122.30 1c6s h ALA 62 Ca 0.00 -0.04 -0.16 0.00 0.00 0.00 0.00 54.91 54.72 1c6s h ALA 62 Cb 1.08 0.08 -0.16 0.00 0.00 0.00 0.00 17.79 18.79 1c6s h ALA 62 CO 0.00 -1.44 -0.35 0.41 0.00 0.00 0.00 179.25 177.87 1c6s n GLY 63 N -1.72 1.30 0.14 0.00 0.00 -1.26 -4.90 105.19 98.75 1c6s n GLY 63 Ca 0.23 -0.16 -0.20 0.00 0.00 0.00 0.00 46.02 45.89 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 -0.73 0.59 0.00 1.61 0.63 -1.08 -4.93 116.66 112.76 1c6s n ARG 64 Ca -0.20 0.17 0.00 0.00 -0.92 0.00 0.00 57.85 56.90 1c6s n ARG 64 Cb 0.81 -1.47 0.00 0.00 0.45 0.00 0.00 32.46 32.25 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 -3.50 0.00 -0.09 6.15 4.77 -1.25 -5.03 117.00 118.06 1c6s n LEU 65 Ca -0.46 0.00 -0.09 0.00 -0.03 0.00 0.00 56.01 55.43 1c6s n LEU 65 Cb 0.93 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.99 1c6s n LEU 65 CO 0.18 0.00 -0.66 0.41 -1.33 0.00 0.00 177.39 175.99 1c6s n THR 66 N 0.00 1.49 0.00 -5.08 -1.04 -1.26 -5.05 114.28 103.34 1c6s n THR 66 Ca 0.00 0.13 0.00 0.00 -2.04 0.00 0.00 64.05 62.14 1c6s n THR 66 Cb 0.00 -2.33 0.00 0.00 -1.82 0.00 0.00 70.33 66.18 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 -4.48 0.00 0.00 8.00 8.00 -1.26 -4.88 116.55 121.93 1c6s n ASP 67 Ca -0.15 0.00 0.07 0.00 0.71 0.00 0.00 54.79 55.42 1c6s n ASP 67 Cb 0.49 0.00 0.40 0.00 -0.02 0.00 0.00 41.12 41.99 1c6s n ASP 67 CO 0.00 0.00 0.00 1.21 -0.39 0.00 0.00 177.20 178.02 1c6s n GLU 68 N 0.00 0.37 -0.06 -1.24 2.13 -1.26 -1.60 120.64 118.98 1c6s n GLU 68 Ca 0.00 0.04 -0.06 0.00 0.66 0.00 0.00 57.16 57.80 1c6s n GLU 68 Cb 0.00 -1.50 -0.09 0.00 0.27 0.00 0.00 31.44 30.12 1c6s n GLU 68 CO 0.00 0.00 0.00 1.04 -0.41 0.00 0.00 177.13 177.76 1c6s n GLN 69 N -1.07 1.84 0.34 5.31 1.13 -1.26 -1.10 117.38 122.56 1c6s n GLN 69 Ca 0.09 0.01 0.20 0.00 -1.94 0.00 0.00 57.00 55.36 1c6s n GLN 69 Cb 0.06 -1.30 1.07 0.00 0.11 0.00 0.00 30.24 30.18 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 0.01 0.00 5.09 1.08 -1.64 0.72 117.51 122.77 1c6s h ILE 70 Ca -0.32 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.15 1c6s h ILE 70 Cb 1.70 0.88 0.00 0.00 -3.07 0.00 0.00 36.82 36.33 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 -3.03 0.00 -0.25 2.37 3.00 -1.11 -3.83 117.38 114.53 1c6s n GLN 71 Ca -0.03 0.02 0.01 0.00 -0.01 0.00 0.00 57.00 57.00 1c6s n GLN 71 Cb 0.19 -0.47 0.09 0.00 0.00 0.00 0.00 30.24 30.04 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 -0.64 -0.26 1.08 3.32 -1.03 0.52 116.42 119.42 1c6s h ASP 72 Ca 0.00 0.21 -0.01 0.00 0.02 0.00 0.00 57.03 57.26 1c6s h ASP 72 Cb 0.00 0.44 -0.01 0.00 0.22 0.00 0.00 39.33 39.97 1c6s h ASP 72 CO 0.00 -0.23 0.15 1.62 -1.72 0.00 0.00 179.24 179.06 1c6s h VAL 73 N 0.01 1.10 0.23 -1.35 3.04 0.27 1.82 116.25 121.37 1c6s h VAL 73 Ca 0.35 -0.26 -0.01 0.00 -1.01 0.00 0.00 66.70 65.77 1c6s h VAL 73 Cb 0.54 0.72 0.00 0.00 -2.01 0.00 0.00 31.29 30.55 1c6s h VAL 73 CO -0.73 0.11 -0.11 0.00 -1.01 0.00 0.00 177.57 175.82 1c6s h ALA 74 N 1.77 -0.59 -0.11 3.17 0.00 -0.02 -1.85 119.26 121.63 1c6s h ALA 74 Ca 0.10 -0.07 0.03 0.00 0.00 0.00 0.00 54.91 54.98 1c6s h ALA 74 Cb 0.03 0.12 -0.00 0.00 0.00 0.00 0.00 17.79 17.93 1c6s h ALA 74 CO -0.02 -0.57 0.32 0.00 0.00 0.00 0.00 179.25 178.98 1c6s h ALA 75 N -1.64 1.53 -0.38 0.00 0.00 -1.05 0.12 119.26 117.85 1c6s h ALA 75 Ca -0.03 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 1c6s h ALA 75 Cb 0.24 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 1c6s h ALA 75 CO 0.05 -0.38 0.13 -0.92 0.00 0.00 0.00 179.25 178.13 1c6s h TYR 76 N 0.00 0.60 0.00 0.00 3.20 0.32 0.77 116.97 121.86 1c6s h TYR 76 Ca 0.05 -0.06 -0.05 0.00 3.14 0.00 0.00 58.73 61.82 1c6s h TYR 76 Cb 0.70 -0.17 -0.01 0.00 1.54 0.00 0.00 36.73 38.78 1c6s h TYR 76 CO 0.00 0.56 -0.23 0.28 -1.64 0.00 0.00 178.16 177.13 1c6s h VAL 77 N 0.46 0.69 -0.00 1.81 2.07 0.06 -0.45 116.25 120.88 1c6s h VAL 77 Ca 0.12 -1.01 0.00 0.00 0.82 0.00 0.00 66.70 66.63 1c6s h VAL 77 Cb 0.24 1.64 0.00 0.00 -1.52 0.00 0.00 31.29 31.65 1c6s h VAL 77 CO -0.01 0.23 -0.12 0.18 0.02 0.00 0.00 177.57 177.87 1c6s n LEU 78 N -3.57 0.16 -0.11 2.57 4.77 -0.56 -2.38 117.00 117.88 1c6s n LEU 78 Ca -0.01 0.32 -0.14 0.00 -0.03 0.00 0.00 56.01 56.16 1c6s n LEU 78 Cb 0.38 -0.39 -0.14 0.00 -2.33 0.00 0.00 43.42 40.93 1c6s n LEU 78 CO 0.33 0.04 -1.21 -0.67 -1.33 0.00 0.00 177.39 174.55 1c6s n ASP 79 N -1.42 0.93 0.09 -1.43 2.03 0.16 -4.08 116.55 112.83 1c6s n ASP 79 Ca 0.08 -0.04 -0.14 0.00 0.52 0.00 0.00 54.79 55.21 1c6s n ASP 79 Cb 0.32 0.31 -0.10 0.00 -0.72 0.00 0.00 41.12 40.93 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 0.00 0.28 -0.44 -0.67 1.08 -1.20 -2.98 115.11 111.19 1c6s h GLN 80 Ca -0.55 -0.40 -0.05 0.00 -1.45 0.00 0.00 58.65 56.20 1c6s h GLN 80 Cb 2.09 0.14 -0.02 0.00 -0.05 0.00 0.00 27.48 29.64 1c6s h GLN 80 CO -0.02 1.15 0.07 0.00 -0.95 0.00 0.00 178.83 179.08 1c6s h ALA 81 N 0.69 0.58 -0.33 3.87 0.00 -1.65 0.23 119.26 122.65 1c6s h ALA 81 Ca -0.10 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.58 1c6s h ALA 81 Cb 1.81 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 19.44 1c6s h ALA 81 CO 0.18 0.30 0.00 0.00 0.00 0.00 0.00 179.25 179.73 1c6s n ALA 82 N -2.38 2.81 -2.15 0.00 0.00 -1.24 -4.07 120.51 113.47 1c6s n ALA 82 Ca 0.00 -0.80 0.01 0.00 0.00 0.00 0.00 53.44 52.65 1c6s n ALA 82 Cb 0.24 -1.02 0.00 0.00 0.00 0.00 0.00 19.45 18.68 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 0.46 0.00 -0.95 0.00 2.85 -1.00 -5.04 118.16 114.48 1c6s n LYS 83 Ca 0.13 -1.21 0.00 0.00 -1.05 0.00 0.00 58.31 56.18 1c6s n LYS 83 Cb 0.51 -0.25 0.00 0.00 -0.65 0.00 0.00 35.03 34.64 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 0.15 0.03 3.27 2.58 0.00 -0.98 -4.79 105.19 105.45 1c6s n GLY 84 Ca 0.00 -0.37 -0.11 0.00 0.00 0.00 0.00 46.02 45.54 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 -0.55 0.04 -1.98 1.61 5.03 0.76 -1.44 117.44 120.92 1c6s n TRP 85 Ca 0.00 -0.00 -0.06 0.00 3.03 0.00 0.00 57.50 60.47 1c6s n TRP 85 Cb 0.23 -0.59 -0.01 0.00 -1.03 0.00 0.00 31.31 29.91 1c6s n TRP 85 CO 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 177.69 177.66 1c6s n ALA 86 N 5.62 -0.59 -0.10 6.99 0.00 -1.26 -4.77 120.51 126.40 1c6s n ALA 86 Ca 0.35 0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.86 1c6s n ALA 86 Cb 0.32 -0.91 0.00 0.00 0.00 0.00 0.00 19.45 18.87 1c6s n ALA 86 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91