#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k8s n ALA 2 N 0.00 2.93 -2.63 2.33 0.00 -1.19 -4.93 120.51 117.02 2k8s n ALA 2 Ca 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 53.44 53.24 2k8s n ALA 2 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.44 2k8s n ALA 2 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2k8s s SER 3 N -3.68 6.09 -0.15 0.00 1.04 -0.73 -4.93 113.70 111.34 2k8s s SER 3 Ca 0.00 -0.08 -0.14 0.00 0.48 0.00 0.00 55.95 56.22 2k8s s SER 3 Cb 0.00 -1.46 -0.05 0.00 0.10 0.00 0.00 66.02 64.61 2k8s s SER 3 CO 0.00 -0.32 0.29 -0.75 0.98 0.00 0.00 173.24 173.44 2k8s s LYS 4 N -4.13 4.21 -0.30 4.02 2.20 -1.26 -0.56 119.74 123.92 2k8s s LYS 4 Ca 0.41 0.10 -0.02 0.00 -0.36 0.00 0.00 55.97 56.11 2k8s s LYS 4 Cb -0.09 -3.41 0.10 0.00 -1.51 0.00 0.00 37.83 32.92 2k8s s LYS 4 CO 0.31 0.28 0.10 0.00 -0.36 0.00 0.00 175.35 175.68 2k8s s ALA 5 N 0.33 1.22 -0.20 3.13 0.00 -0.48 -0.84 121.76 124.91 2k8s s ALA 5 Ca 0.17 -1.43 -0.15 0.00 0.00 0.00 0.00 51.96 50.55 2k8s s ALA 5 Cb -0.13 -1.52 -0.04 0.00 0.00 0.00 0.00 23.12 21.42 2k8s s ALA 5 CO 0.04 -1.63 0.35 0.96 0.00 0.00 0.00 175.76 175.48 2k8s s ILE 6 N 1.78 5.24 -0.33 0.00 -4.36 -0.08 -0.24 121.20 123.20 2k8s s ILE 6 Ca 0.09 0.60 -0.06 0.00 -0.26 0.00 0.00 60.65 61.02 2k8s s ILE 6 Cb -0.17 -3.68 0.04 0.00 1.25 0.00 0.00 42.46 39.90 2k8s s ILE 6 CO -0.28 0.29 0.09 0.12 0.24 0.00 0.00 174.94 175.40 2k8s s PHE 7 N 1.15 3.24 -0.11 1.37 5.36 0.14 0.26 117.98 129.39 2k8s s PHE 7 Ca 0.17 -1.42 -0.06 0.00 -0.96 0.00 0.00 56.93 54.66 2k8s s PHE 7 Cb -0.14 -2.26 -0.04 0.00 -0.34 0.00 0.00 43.02 40.24 2k8s s PHE 7 CO 0.07 -0.72 0.12 0.71 -1.46 0.00 0.00 175.22 173.94 2k8s s TYR 8 N 1.40 3.54 0.34 10.12 1.51 0.76 0.24 117.35 135.27 2k8s s TYR 8 Ca -0.02 0.48 -0.17 0.00 -1.01 0.00 0.00 57.07 56.36 2k8s s TYR 8 Cb -0.19 -1.92 0.06 0.00 -0.11 0.00 0.00 41.96 39.80 2k8s s TYR 8 CO 0.02 0.70 0.86 -3.38 -1.11 0.00 0.00 175.55 172.64 2k8s s HIS 9 N -1.01 0.12 -0.09 2.71 -3.43 -0.93 -0.26 115.29 112.39 2k8s s HIS 9 Ca 0.15 -0.74 0.13 0.00 -0.80 0.00 0.00 55.06 53.80 2k8s s HIS 9 Cb -0.12 0.81 0.20 0.00 -1.43 0.00 0.00 32.58 32.04 2k8s s HIS 9 CO 0.04 -1.43 1.09 0.00 -2.00 0.00 0.00 174.74 172.45 2k8s n ALA 10 N -0.58 2.16 -2.00 -1.38 0.00 -1.26 -0.83 120.51 116.62 2k8s n ALA 10 Ca -0.07 -2.11 -0.03 0.00 0.00 0.00 0.00 53.44 51.23 2k8s n ALA 10 Cb 0.60 -0.30 0.01 0.00 0.00 0.00 0.00 19.45 19.76 2k8s n ALA 10 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2k8s n GLY 11 N -1.10 0.45 3.78 0.00 0.00 -1.26 -4.85 105.19 102.21 2k8s n GLY 11 Ca 0.11 -0.26 -0.26 0.00 0.00 0.00 0.00 46.02 45.60 2k8s n GLY 11 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k8s h PRO 13 N 2.45 0.86 -0.37 0.00 0.11 -2.01 -0.13 132.00 132.91 2k8s h PRO 13 Ca -0.48 -0.05 -0.02 0.00 0.11 0.00 0.00 66.00 65.57 2k8s h PRO 13 Cb 1.20 -0.19 -0.02 0.00 0.11 0.00 0.00 31.00 32.10 2k8s h PRO 13 CO 0.62 0.57 0.16 0.28 -0.21 0.00 0.00 178.00 179.42 2k8s h VAL 14 N 0.88 1.14 -0.14 3.15 2.07 -1.98 -1.98 116.25 119.40 2k8s h VAL 14 Ca 0.54 -0.42 -0.06 0.00 0.82 0.00 0.00 66.70 67.57 2k8s h VAL 14 Cb 0.69 0.69 -0.01 0.00 -1.52 0.00 0.00 31.29 31.14 2k8s h VAL 14 CO -0.32 0.16 -0.20 0.00 0.02 0.00 0.00 177.57 177.23 2k8s h VAL 16 N 0.21 1.26 -0.67 0.00 2.07 -1.27 0.01 116.25 117.87 2k8s h VAL 16 Ca 0.04 -0.99 -0.08 0.00 0.82 0.00 0.00 66.70 66.50 2k8s h VAL 16 Cb 0.48 1.30 -0.03 0.00 -1.52 0.00 0.00 31.29 31.52 2k8s h VAL 16 CO 0.03 0.32 0.12 0.28 0.02 0.00 0.00 177.57 178.34 2k8s h SER 17 N 0.34 1.06 -0.25 0.57 0.02 -1.37 -1.61 113.55 112.31 2k8s h SER 17 Ca 0.08 -0.25 -0.04 0.00 -0.84 0.00 0.00 61.79 60.74 2k8s h SER 17 Cb 0.47 -0.28 -0.02 0.00 0.14 0.00 0.00 62.40 62.71 2k8s h SER 17 CO 0.02 1.04 0.03 0.00 -1.14 0.00 0.00 176.83 176.78 2k8s h ALA 18 N 1.05 1.42 -0.11 3.77 0.00 -0.92 -0.52 119.26 123.95 2k8s h ALA 18 Ca 0.21 -0.18 -0.04 0.00 0.00 0.00 0.00 54.91 54.89 2k8s h ALA 18 Cb 0.43 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.07 2k8s h ALA 18 CO 0.01 0.42 -0.10 1.49 0.00 0.00 0.00 179.25 181.07 2k8s h GLU 19 N 0.50 0.26 0.00 0.00 4.81 -0.62 0.60 114.58 120.13 2k8s h GLU 19 Ca 0.11 -0.13 0.00 0.00 -0.13 0.00 0.00 59.36 59.21 2k8s h GLU 19 Cb 0.28 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.66 2k8s h GLU 19 CO 0.01 0.66 0.00 0.37 -0.73 0.00 0.00 179.01 179.32 2k8s h GLN 20 N -0.13 0.00 0.00 1.92 4.15 -1.09 -3.00 115.11 116.96 2k8s h GLN 20 Ca 0.02 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.44 2k8s h GLN 20 Cb 0.61 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.30 2k8s h GLN 20 CO 0.03 0.00 -0.06 0.00 -1.93 0.00 0.00 178.83 176.87 2k8s n ALA 21 N -1.81 1.60 0.10 3.38 0.00 -0.22 -4.54 120.51 119.02 2k8s n ALA 21 Ca 0.05 -0.15 -0.13 0.00 0.00 0.00 0.00 53.44 53.21 2k8s n ALA 21 Cb 0.42 0.02 -0.08 0.00 0.00 0.00 0.00 19.45 19.81 2k8s n ALA 21 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2k8s h VAL 22 N -0.06 0.88 0.00 0.00 2.07 -1.13 0.07 116.25 118.09 2k8s h VAL 22 Ca 0.00 -0.68 0.00 0.00 0.82 0.00 0.00 66.70 66.84 2k8s h VAL 22 Cb 0.06 1.27 0.00 0.00 -1.52 0.00 0.00 31.29 31.10 2k8s h VAL 22 CO 0.00 0.15 0.00 0.00 0.02 0.00 0.00 177.57 177.74 2k8s n ALA 23 N -2.41 2.39 -0.03 1.67 0.00 -0.13 -2.31 120.51 119.68 2k8s n ALA 23 Ca -0.09 -0.10 -0.01 0.00 0.00 0.00 0.00 53.44 53.24 2k8s n ALA 23 Cb 0.24 -1.27 -0.08 0.00 0.00 0.00 0.00 19.45 18.35 2k8s n ALA 23 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 2k8s n ASN 24 N -0.82 2.66 0.10 0.00 5.15 -1.06 -4.48 115.26 116.79 2k8s n ASN 24 Ca 0.12 0.00 -0.04 0.00 -0.60 0.00 0.00 54.58 54.06 2k8s n ASN 24 Cb 0.06 0.99 0.02 0.00 -0.53 0.00 0.00 39.78 40.32 2k8s n ASN 24 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2k8s h ALA 25 N 0.63 0.66 -2.77 5.20 0.00 -0.57 -3.44 119.26 118.97 2k8s h ALA 25 Ca -0.17 -0.74 -0.52 0.00 0.00 0.00 0.00 54.91 53.48 2k8s h ALA 25 Cb 1.20 -0.13 0.05 0.00 0.00 0.00 0.00 17.79 18.91 2k8s h ALA 25 CO 0.01 1.01 0.70 0.42 0.00 0.00 0.00 179.25 181.39 2k8s s ILE 26 N -3.14 2.81 -0.08 0.00 1.01 -1.07 -5.00 121.20 115.72 2k8s s ILE 26 Ca -0.00 0.71 -0.17 0.00 0.00 0.00 0.00 60.65 61.19 2k8s s ILE 26 Cb 0.11 -3.46 -0.05 0.00 0.01 0.00 0.00 42.46 39.08 2k8s s ILE 26 CO 0.79 0.13 0.46 -0.62 0.00 0.00 0.00 174.94 175.70 2k8s s ASP 27 N 0.11 6.72 0.53 3.58 -1.08 -1.26 -4.97 116.67 120.30 2k8s s ASP 27 Ca 0.56 0.86 0.24 0.00 -0.52 0.00 0.00 52.55 53.68 2k8s s ASP 27 Cb -0.40 -2.28 1.39 0.00 -1.46 0.00 0.00 42.92 40.17 2k8s s ASP 27 CO 0.45 0.10 2.02 -0.65 0.52 0.00 0.00 175.17 177.60 2k8s h PRO 28 N 6.14 0.00 0.00 4.34 0.11 -1.95 0.28 132.00 140.91 2k8s h PRO 28 Ca -0.44 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 65.59 2k8s h PRO 28 Cb 1.19 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.29 2k8s h PRO 28 CO 0.72 0.00 -0.37 0.66 -0.21 0.00 0.00 178.00 178.80 2k8s h SER 29 N 0.00 0.00 0.00 -2.05 4.64 -1.93 -3.17 113.55 111.04 2k8s h SER 29 Ca 0.21 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.53 2k8s h SER 29 Cb 0.86 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.95 2k8s h SER 29 CO -0.00 0.37 0.00 0.29 -0.87 0.00 0.00 176.83 176.62 2k8s n LYS 30 N -4.08 0.00 -5.16 4.77 5.02 0.02 -3.17 118.16 115.56 2k8s n LYS 30 Ca -0.02 0.31 -0.29 0.00 -2.02 0.00 0.00 58.31 56.29 2k8s n LYS 30 Cb 0.41 -0.82 -0.16 0.00 -0.02 0.00 0.00 35.03 34.44 2k8s n LYS 30 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 2k8s s TYR 31 N -0.65 2.12 -0.35 2.13 1.51 -0.82 -1.77 117.35 119.51 2k8s s TYR 31 Ca 0.00 -0.43 -0.19 0.00 -1.01 0.00 0.00 57.07 55.44 2k8s s TYR 31 Cb 0.00 -1.37 -0.00 0.00 -0.11 0.00 0.00 41.96 40.48 2k8s s TYR 31 CO 0.00 -0.06 0.57 -0.08 -1.11 0.00 0.00 175.55 174.88 2k8s s THR 32 N -0.49 4.95 -0.60 -0.71 -1.32 0.27 -4.09 115.64 113.65 2k8s s THR 32 Ca 0.07 0.45 -0.28 0.00 -1.21 0.00 0.00 61.69 60.73 2k8s s THR 32 Cb -0.10 -4.02 0.03 0.00 -1.51 0.00 0.00 72.50 66.91 2k8s s THR 32 CO -0.00 -0.27 1.17 -0.69 -2.21 0.00 0.00 174.62 172.62 2k8s s VAL 33 N 2.55 4.03 -0.47 5.08 1.01 -1.25 -1.39 120.40 129.95 2k8s s VAL 33 Ca 0.21 0.77 -0.13 0.00 0.00 0.00 0.00 61.98 62.83 2k8s s VAL 33 Cb -0.15 -4.73 0.10 0.00 0.00 0.00 0.00 36.38 31.60 2k8s s VAL 33 CO 0.14 -1.37 0.37 -1.61 0.00 0.00 0.00 175.10 172.63 2k8s s GLU 34 N 4.92 2.77 -0.09 2.72 2.02 0.66 -4.95 118.70 126.75 2k8s s GLU 34 Ca 0.40 -1.56 -0.25 0.00 0.02 0.00 0.00 54.97 53.58 2k8s s GLU 34 Cb -0.08 -4.03 -0.03 0.00 0.10 0.00 0.00 34.13 30.08 2k8s s GLU 34 CO 0.23 -1.12 0.79 0.42 0.02 0.00 0.00 175.26 175.60 2k8s s ILE 35 N 1.51 4.96 -0.14 -1.63 1.01 -1.26 0.24 121.20 125.89 2k8s s ILE 35 Ca 0.04 1.61 0.00 0.00 0.00 0.00 0.00 60.65 62.31 2k8s s ILE 35 Cb -0.26 -4.12 0.02 0.00 0.01 0.00 0.00 42.46 38.11 2k8s s ILE 35 CO 0.03 0.17 -0.13 -0.69 0.00 0.00 0.00 174.94 174.32 2k8s s VAL 36 N 1.26 1.46 -0.19 2.92 1.01 0.14 -4.91 120.40 122.08 2k8s s VAL 36 Ca 0.40 -0.56 -0.24 0.00 0.00 0.00 0.00 61.98 61.58 2k8s s VAL 36 Cb -0.18 -1.38 -0.01 0.00 0.00 0.00 0.00 36.38 34.80 2k8s s VAL 36 CO 0.18 0.44 0.78 -2.28 0.00 0.00 0.00 175.10 174.22 2k8s s HIS 37 N 1.52 3.38 -1.41 5.22 2.46 -1.26 -2.20 115.29 123.00 2k8s s HIS 37 Ca 0.05 1.15 0.30 0.00 0.47 0.00 0.00 55.06 57.02 2k8s s HIS 37 Cb -0.13 -2.97 1.37 0.00 -0.13 0.00 0.00 32.58 30.73 2k8s s HIS 37 CO -0.10 -0.26 1.97 1.28 -2.47 0.00 0.00 174.74 175.16 2k8s n LEU 38 N 5.36 0.13 -2.13 8.88 4.77 -0.01 -3.81 117.00 130.19 2k8s n LEU 38 Ca 0.03 0.23 -0.26 0.00 -0.03 0.00 0.00 56.01 55.99 2k8s n LEU 38 Cb 0.49 -0.29 0.05 0.00 -2.33 0.00 0.00 43.42 41.34 2k8s n LEU 38 CO 0.47 0.03 1.35 0.61 -1.33 0.00 0.00 177.39 178.51 2k8s n GLY 39 N 1.32 4.94 1.64 -0.72 0.00 -1.26 -4.31 105.19 106.80 2k8s n GLY 39 Ca 0.13 -1.70 0.00 0.00 0.00 0.00 0.00 46.02 44.45 2k8s n GLY 39 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2k8s n THR 40 N -0.22 0.43 -5.25 2.61 -1.04 -1.25 -5.11 114.28 104.45 2k8s n THR 40 Ca 0.46 0.14 -0.31 0.00 -2.04 0.00 0.00 64.05 62.30 2k8s n THR 40 Cb 0.60 -0.87 -0.16 0.00 -1.82 0.00 0.00 70.33 68.08 2k8s n THR 40 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 2k8s s ASP 41 N -5.29 3.04 0.23 8.00 2.15 -1.26 -5.02 116.67 118.52 2k8s s ASP 41 Ca 0.00 -0.51 0.12 0.00 0.43 0.00 0.00 52.55 52.59 2k8s s ASP 41 Cb 0.00 -0.86 0.12 0.00 -0.30 0.00 0.00 42.92 41.88 2k8s s ASP 41 CO 0.00 0.24 1.46 0.11 -0.17 0.00 0.00 175.17 176.81 2k8s h LYS 42 N 6.09 0.00 -0.07 4.34 1.57 -1.99 -3.15 116.57 123.35 2k8s h LYS 42 Ca -0.31 0.00 -0.20 0.00 -1.87 0.00 0.00 60.65 58.27 2k8s h LYS 42 Cb 1.18 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.49 2k8s h LYS 42 CO 0.47 0.69 -0.78 0.00 -0.57 0.00 0.00 179.45 179.26 2k8s h ALA 43 N 1.31 0.50 0.00 3.86 0.00 -1.99 -2.83 119.26 120.11 2k8s h ALA 43 Ca -0.01 -0.63 0.00 0.00 0.00 0.00 0.00 54.91 54.28 2k8s h ALA 43 Cb 1.40 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.14 2k8s h ALA 43 CO 0.09 0.76 0.00 0.54 0.00 0.00 0.00 179.25 180.64 2k8s n ARG 44 N -3.84 0.06 -0.12 0.00 1.74 -1.22 -1.64 116.66 111.64 2k8s n ARG 44 Ca -0.05 0.23 -0.06 0.00 -0.77 0.00 0.00 57.85 57.19 2k8s n ARG 44 Cb 0.74 -1.59 0.11 0.00 -1.02 0.00 0.00 32.46 30.70 2k8s n ARG 44 CO 0.00 0.00 0.00 0.82 -1.52 0.00 0.00 177.63 176.93 2k8s h ILE 45 N 0.00 1.26 0.00 0.55 2.04 -1.46 -1.77 117.51 118.13 2k8s h ILE 45 Ca 0.00 -1.14 -0.09 0.00 1.00 0.00 0.00 64.86 64.63 2k8s h ILE 45 Cb 0.36 0.98 -0.01 0.00 -0.74 0.00 0.00 36.82 37.40 2k8s h ILE 45 CO 0.00 0.40 -0.42 0.00 0.00 0.00 0.00 178.15 178.13 2k8s h ALA 46 N 1.15 1.23 -0.54 1.87 0.00 -1.40 -2.33 119.26 119.26 2k8s h ALA 46 Ca 0.13 -0.38 -0.03 0.00 0.00 0.00 0.00 54.91 54.63 2k8s h ALA 46 Cb 0.56 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.26 2k8s h ALA 46 CO 0.03 0.52 0.22 1.49 0.00 0.00 0.00 179.25 181.51 2k8s h GLU 47 N 0.00 0.80 -0.81 0.00 4.81 -1.29 -1.40 114.58 116.69 2k8s h GLU 47 Ca -0.00 -0.14 -0.01 0.00 -0.13 0.00 0.00 59.36 59.07 2k8s h GLU 47 Cb 0.78 -0.13 -0.04 0.00 0.63 0.00 0.00 28.75 29.99 2k8s h GLU 47 CO 0.05 0.70 0.47 0.00 -0.73 0.00 0.00 179.01 179.50 2k8s h ALA 48 N 1.06 1.30 -0.64 2.92 0.00 -0.92 -0.34 119.26 122.64 2k8s h ALA 48 Ca 0.18 -0.10 -0.04 0.00 0.00 0.00 0.00 54.91 54.94 2k8s h ALA 48 Cb 0.19 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 17.63 2k8s h ALA 48 CO -0.02 0.59 0.22 0.93 0.00 0.00 0.00 179.25 180.98 2k8s h GLU 49 N 1.13 0.96 -0.54 0.00 5.08 -1.02 0.97 114.58 121.15 2k8s h GLU 49 Ca 0.29 -0.17 -0.10 0.00 -1.00 0.00 0.00 59.36 58.37 2k8s h GLU 49 Cb -0.02 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.06 2k8s h GLU 49 CO -0.05 0.80 -0.07 0.87 -1.00 0.00 0.00 179.01 179.56 2k8s h LYS 50 N 0.93 0.99 -0.33 2.33 1.57 -0.37 -2.86 116.57 118.83 2k8s h LYS 50 Ca 0.21 -0.34 -0.08 0.00 -1.87 0.00 0.00 60.65 58.57 2k8s h LYS 50 Cb 0.23 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.45 2k8s h LYS 50 CO -0.01 1.02 -0.15 0.00 -0.57 0.00 0.00 179.45 179.74 2k8s h ALA 51 N 1.01 1.13 0.00 3.86 0.00 -0.56 -3.47 119.26 121.24 2k8s h ALA 51 Ca 0.15 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.76 2k8s h ALA 51 Cb 0.62 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.27 2k8s h ALA 51 CO 0.04 0.54 0.00 0.41 0.00 0.00 0.00 179.25 180.24 2k8s n GLY 52 N -0.52 1.33 3.68 0.00 0.00 -0.09 -4.24 105.19 105.35 2k8s n GLY 52 Ca 0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 2k8s n GLY 52 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2k8s s VAL 53 N -2.00 3.21 0.00 1.61 1.01 0.14 -4.75 120.40 119.61 2k8s s VAL 53 Ca 0.00 0.56 0.00 0.00 0.00 0.00 0.00 61.98 62.54 2k8s s VAL 53 Cb 0.00 -3.36 0.00 0.00 0.00 0.00 0.00 36.38 33.02 2k8s s VAL 53 CO 0.00 -0.01 0.00 0.29 0.00 0.00 0.00 175.10 175.38 2k8s n LYS 54 N 5.97 4.65 -3.90 2.72 5.02 -1.26 -4.46 118.16 126.88 2k8s n LYS 54 Ca 0.16 0.00 -0.08 0.00 -2.02 0.00 0.00 58.31 56.37 2k8s n LYS 54 Cb 0.41 -0.58 -0.03 0.00 -0.02 0.00 0.00 35.03 34.81 2k8s n LYS 54 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 2k8s s SER 55 N -1.12 -0.20 0.03 4.39 1.04 -1.26 -0.79 113.70 115.80 2k8s s SER 55 Ca 0.00 -0.72 0.07 0.00 0.48 0.00 0.00 55.95 55.78 2k8s s SER 55 Cb 0.00 0.66 -0.02 0.00 0.10 0.00 0.00 66.02 66.76 2k8s s SER 55 CO 0.00 -1.25 -0.21 0.68 0.98 0.00 0.00 173.24 173.45 2k8s s VAL 56 N -3.95 1.66 0.44 5.02 -7.23 0.13 -3.82 120.40 112.64 2k8s s VAL 56 Ca 0.15 -1.15 -0.13 0.00 -1.81 0.00 0.00 61.98 59.05 2k8s s VAL 56 Cb -0.04 -1.43 -0.07 0.00 0.56 0.00 0.00 36.38 35.40 2k8s s VAL 56 CO 0.07 0.25 0.84 -2.16 -0.31 0.00 0.00 175.10 173.79 2k8s s PRO 57 N -1.07 3.86 -0.06 4.82 0.04 -1.26 -2.11 135.00 139.23 2k8s s PRO 57 Ca 0.08 0.66 0.02 0.00 0.04 0.00 0.00 61.00 61.79 2k8s s PRO 57 Cb -0.09 -2.30 0.01 0.00 0.04 0.00 0.00 34.50 32.16 2k8s s PRO 57 CO 0.01 -0.10 -0.10 0.00 0.04 0.00 0.00 177.00 176.85 2k8s s ALA 58 N -2.42 1.08 -0.43 8.56 0.00 0.64 -0.74 121.76 128.45 2k8s s ALA 58 Ca 0.54 -0.32 -0.10 0.00 0.00 0.00 0.00 51.96 52.08 2k8s s ALA 58 Cb -0.10 -0.50 0.08 0.00 0.00 0.00 0.00 23.12 22.59 2k8s s ALA 58 CO 0.30 0.09 0.29 -1.17 0.00 0.00 0.00 175.76 175.27 2k8s s LEU 59 N 0.67 5.29 -0.59 0.00 2.96 1.00 -0.17 118.68 127.84 2k8s s LEU 59 Ca -0.13 -1.49 -0.20 0.00 -0.22 0.00 0.00 54.13 52.08 2k8s s LEU 59 Cb -0.15 -2.03 0.08 0.00 0.50 0.00 0.00 46.19 44.59 2k8s s LEU 59 CO 0.03 -0.57 0.78 -0.69 -1.32 0.00 0.00 176.35 174.57 2k8s s VAL 60 N 1.47 4.66 -0.36 1.68 1.01 0.14 -0.11 120.40 128.88 2k8s s VAL 60 Ca 0.03 -0.63 -0.19 0.00 0.00 0.00 0.00 61.98 61.20 2k8s s VAL 60 Cb -0.23 -4.51 0.00 0.00 0.00 0.00 0.00 36.38 31.63 2k8s s VAL 60 CO 0.03 -1.16 0.54 -0.63 0.00 0.00 0.00 175.10 173.88 2k8s s ILE 61 N 3.15 4.99 0.00 2.22 1.01 0.03 -0.90 121.20 131.69 2k8s s ILE 61 Ca 0.16 0.31 0.00 0.00 0.00 0.00 0.00 60.65 61.12 2k8s s ILE 61 Cb -0.20 -4.01 0.00 0.00 0.01 0.00 0.00 42.46 38.26 2k8s s ILE 61 CO 0.09 -0.28 0.00 -0.67 0.00 0.00 0.00 174.94 174.09 2k8s n ASP 62 N 5.82 0.00 0.00 3.58 2.03 -0.02 -2.11 116.55 125.85 2k8s n ASP 62 Ca -0.04 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.27 2k8s n ASP 62 Cb 0.49 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.89 2k8s n ASP 62 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2k8s n GLY 63 N 0.00 0.01 3.80 0.27 0.00 -1.26 -4.97 105.19 103.05 2k8s n GLY 63 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 2k8s n GLY 63 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k8s s ALA 64 N 0.00 3.58 -0.32 4.61 0.00 -0.90 -4.71 121.76 124.03 2k8s s ALA 64 Ca 0.00 0.01 -0.14 0.00 0.00 0.00 0.00 51.96 51.83 2k8s s ALA 64 Cb 0.00 -2.63 -0.02 0.00 0.00 0.00 0.00 23.12 20.47 2k8s s ALA 64 CO 0.00 0.37 0.32 0.00 0.00 0.00 0.00 175.76 176.46 2k8s s ALA 65 N -0.97 3.52 -0.38 0.00 0.00 -1.26 -0.79 121.76 121.87 2k8s s ALA 65 Ca 0.29 -1.14 -0.05 0.00 0.00 0.00 0.00 51.96 51.06 2k8s s ALA 65 Cb -0.19 -2.73 0.08 0.00 0.00 0.00 0.00 23.12 20.28 2k8s s ALA 65 CO 0.18 -0.90 0.17 -0.06 0.00 0.00 0.00 175.76 175.15 2k8s s PHE 66 N 1.96 3.39 0.38 0.00 0.08 0.84 -4.93 117.98 119.69 2k8s s PHE 66 Ca 0.11 -1.85 -0.26 0.00 0.12 0.00 0.00 56.93 55.06 2k8s s PHE 66 Cb -0.16 -2.78 -0.09 0.00 -0.57 0.00 0.00 43.02 39.42 2k8s s PHE 66 CO 0.11 -0.86 1.12 -1.01 -0.10 0.00 0.00 175.22 174.48 2k8s s HIS 67 N 1.30 3.22 -0.45 0.36 3.76 -1.26 -0.00 115.29 122.22 2k8s s HIS 67 Ca 0.02 1.60 0.02 0.00 -0.15 0.00 0.00 55.06 56.56 2k8s s HIS 67 Cb -0.22 -3.30 0.12 0.00 1.11 0.00 0.00 32.58 30.29 2k8s s HIS 67 CO -0.00 -0.99 0.20 0.42 -0.85 0.00 0.00 174.74 173.52 2k8s s ILE 68 N -1.43 2.76 -0.08 0.60 1.01 0.08 -4.86 121.20 119.28 2k8s s ILE 68 Ca 0.55 -2.72 -0.06 0.00 0.00 0.00 0.00 60.65 58.42 2k8s s ILE 68 Cb -0.29 -2.93 0.02 0.00 0.01 0.00 0.00 42.46 39.28 2k8s s ILE 68 CO 0.36 -0.72 0.12 0.59 0.00 0.00 0.00 174.94 175.28 2k8s n ASN 69 N 3.81 -3.17 -4.59 3.58 3.02 -1.26 -4.19 115.26 112.46 2k8s n ASN 69 Ca 0.04 1.09 -0.42 0.00 -0.03 0.00 0.00 54.58 55.26 2k8s n ASN 69 Cb 0.38 -4.02 -0.03 0.00 -0.61 0.00 0.00 39.78 35.50 2k8s n ASN 69 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 2k8s s PHE 70 N -0.45 1.39 -0.18 3.10 5.36 -1.26 -4.05 117.98 121.89 2k8s s PHE 70 Ca -0.13 0.72 -0.14 0.00 -0.96 0.00 0.00 56.93 56.42 2k8s s PHE 70 Cb 0.01 -3.96 -0.07 0.00 -0.34 0.00 0.00 43.02 38.66 2k8s s PHE 70 CO 0.36 -3.41 -0.29 0.41 -1.46 0.00 0.00 175.22 170.83 2k8s n GLY 71 N 5.68 -0.42 3.16 13.12 0.00 -0.90 -5.03 105.19 120.80 2k8s n GLY 71 Ca 0.28 -0.21 -0.10 0.00 0.00 0.00 0.00 46.02 45.99 2k8s n GLY 71 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k8s s ALA 72 N -2.61 0.92 0.35 4.61 0.00 -1.06 -5.01 121.76 118.96 2k8s s ALA 72 Ca -0.28 -1.48 0.07 0.00 0.00 0.00 0.00 51.96 50.27 2k8s s ALA 72 Cb 0.07 0.82 -0.02 0.00 0.00 0.00 0.00 23.12 23.99 2k8s s ALA 72 CO 0.38 -0.46 0.38 0.20 0.00 0.00 0.00 175.76 176.26 2k8s s GLY 73 N -3.06 1.79 0.42 0.00 0.00 -1.26 0.18 107.32 105.39 2k8s s GLY 73 Ca 0.24 -1.63 0.18 0.00 0.00 0.00 0.00 44.72 43.51 2k8s s GLY 73 CO 0.02 -1.53 1.88 1.19 0.00 0.00 0.00 173.10 174.67 2k8s h ILE 74 N 1.05 0.96 0.00 0.90 2.10 -1.27 -2.46 117.51 118.80 2k8s h ILE 74 Ca -0.44 -1.08 -0.03 0.00 1.08 0.00 0.00 64.86 64.39 2k8s h ILE 74 Cb 1.26 1.63 -0.00 0.00 -1.09 0.00 0.00 36.82 38.61 2k8s h ILE 74 CO 0.55 0.28 -0.14 0.44 -1.08 0.00 0.00 178.15 178.21 2k8s h ASP 75 N 0.00 0.00 -0.47 2.19 5.19 -1.95 0.19 116.42 121.57 2k8s h ASP 75 Ca -0.00 0.00 -0.04 0.00 -0.62 0.00 0.00 57.03 56.36 2k8s h ASP 75 Cb 0.60 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 40.09 2k8s h ASP 75 CO 0.04 0.14 0.16 0.44 -3.12 0.00 0.00 179.24 176.89 2k8s h ASP 76 N 0.00 0.73 0.56 6.45 3.32 -1.80 0.22 116.42 125.89 2k8s h ASP 76 Ca -0.00 -0.11 -0.08 0.00 0.02 0.00 0.00 57.03 56.85 2k8s h ASP 76 Cb 0.33 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 39.67 2k8s h ASP 76 CO 0.02 0.70 -1.51 0.18 -1.72 0.00 0.00 179.24 176.91 2k8s n LEU 77 N -4.30 0.55 0.10 1.55 4.77 -0.72 -4.09 117.00 114.86 2k8s n LEU 77 Ca 0.04 0.23 -0.03 0.00 -0.03 0.00 0.00 56.01 56.21 2k8s n LEU 77 Cb 0.20 0.04 -0.00 0.00 -2.33 0.00 0.00 43.42 41.33 2k8s n LEU 77 CO 0.39 0.02 0.31 0.50 -1.33 0.00 0.00 177.39 177.28 2k8s h LYS 78 N 0.00 0.00 0.00 3.23 3.64 -0.34 -3.47 116.57 119.63 2k8s h LYS 78 Ca -0.09 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.29 2k8s h LYS 78 Cb 1.27 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.09 2k8s h LYS 78 CO 0.02 0.79 0.00 0.41 -2.27 0.00 0.00 179.45 178.40 2k8s n GLY 79 N 1.03 1.72 0.00 5.01 0.00 0.73 -5.03 105.19 108.64 2k8s n GLY 79 Ca 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 45.90 2k8s n GLY 79 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18