#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1zki n ALA 6 N 0.00 1.26 -0.32 0.55 0.00 -1.26 -4.89 120.51 115.85 1zki n ALA 6 Ca 0.00 0.04 0.08 0.00 0.00 0.00 0.00 53.44 53.55 1zki n ALA 6 Cb 0.00 -2.33 0.24 0.00 0.00 0.00 0.00 19.45 17.36 1zki n ALA 6 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 1zki h ARG 7 N 0.78 0.74 0.00 0.00 2.43 -2.03 -0.92 114.38 115.38 1zki h ARG 7 Ca -0.51 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 58.62 1zki h ARG 7 Cb 1.33 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 30.71 1zki h ARG 7 CO 0.54 0.49 0.01 0.39 -1.51 0.00 0.00 179.97 179.89 1zki n GLU 8 N -4.77 0.13 -0.79 0.20 4.71 -1.26 -2.96 120.64 115.89 1zki n GLU 8 Ca 0.18 0.63 -0.16 0.00 -0.01 0.00 0.00 57.16 57.80 1zki n GLU 8 Cb 0.42 -1.93 0.09 0.00 -1.01 0.00 0.00 31.44 29.01 1zki n GLU 8 CO 0.00 0.00 0.00 0.94 0.09 0.00 0.00 177.13 178.16 1zki n GLN 9 N -2.19 1.79 -0.13 3.49 -0.06 -0.35 -4.95 117.38 114.98 1zki n GLN 9 Ca -0.01 -1.79 0.00 0.00 -2.00 0.00 0.00 57.00 53.20 1zki n GLN 9 Cb 0.04 -1.70 0.00 0.00 -4.06 0.00 0.00 30.24 24.52 1zki n GLN 9 CO 0.00 0.00 0.00 0.44 -0.20 0.00 0.00 177.06 177.30 1zki n ILE 11 N -0.30 0.00 -4.37 1.69 -5.35 -1.16 -5.04 119.36 104.83 1zki n ILE 11 Ca 0.35 0.00 -0.19 0.00 -0.27 0.00 0.00 62.75 62.64 1zki n ILE 11 Cb 1.02 0.00 -0.10 0.00 -1.74 0.00 0.00 39.64 38.81 1zki n ILE 11 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 1zki s SER 12 N -1.23 1.67 0.25 7.28 1.04 -1.26 -5.01 113.70 116.45 1zki s SER 12 Ca 0.00 -1.42 -0.04 0.00 0.48 0.00 0.00 55.95 54.98 1zki s SER 12 Cb 0.00 0.13 0.39 0.00 0.10 0.00 0.00 66.02 66.64 1zki s SER 12 CO 0.00 -0.72 1.84 0.00 0.98 0.00 0.00 173.24 175.34 1zki h ALA 13 N 2.25 1.25 -0.35 5.32 0.00 -2.02 -1.50 119.26 124.21 1zki h ALA 13 Ca -0.38 0.01 -0.17 0.00 0.00 0.00 0.00 54.91 54.36 1zki h ALA 13 Cb 1.25 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.82 1zki h ALA 13 CO 0.62 0.24 -0.44 -0.92 0.00 0.00 0.00 179.25 178.76 1zki h TYR 14 N 0.95 1.11 -0.51 0.00 3.20 -1.99 -1.45 116.97 118.27 1zki h TYR 14 Ca 0.40 -0.35 -0.05 0.00 3.14 0.00 0.00 58.73 61.87 1zki h TYR 14 Cb 0.27 -0.22 -0.02 0.00 1.54 0.00 0.00 36.73 38.29 1zki h TYR 14 CO -0.03 1.18 0.13 0.66 -1.64 0.00 0.00 178.16 178.46 1zki h SER 15 N 0.71 0.73 -0.71 -2.11 4.64 -1.87 -1.78 113.55 113.16 1zki h SER 15 Ca 0.04 -0.12 -0.06 0.00 -0.47 0.00 0.00 61.79 61.18 1zki h SER 15 Cb 1.04 -0.19 -0.03 0.00 -0.31 0.00 0.00 62.40 62.91 1zki h SER 15 CO 0.10 0.72 0.22 -0.33 -0.87 0.00 0.00 176.83 176.67 1zki h GLU 16 N 0.76 1.11 -0.15 4.77 4.39 -1.08 -0.71 114.58 123.66 1zki h GLU 16 Ca 0.17 -0.24 0.00 0.00 0.34 0.00 0.00 59.36 59.63 1zki h GLU 16 Cb 0.28 -0.16 -0.01 0.00 -0.10 0.00 0.00 28.75 28.76 1zki h GLU 16 CO -0.00 0.95 0.10 1.25 -1.16 0.00 0.00 179.01 180.15 1zki h LEU 17 N 1.05 0.17 -1.11 1.33 5.85 -0.69 -2.57 115.31 119.34 1zki h LEU 17 Ca 0.23 -0.01 -0.09 0.00 0.84 0.00 0.00 57.88 58.85 1zki h LEU 17 Cb 0.31 -0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.28 1zki h LEU 17 CO -0.01 0.13 -0.44 0.58 -0.34 0.00 0.00 178.44 178.37 1zki h VAL 18 N 0.20 1.28 0.00 1.05 2.07 -1.25 -3.47 116.25 116.13 1zki h VAL 18 Ca 0.06 -1.52 0.00 0.00 0.82 0.00 0.00 66.70 66.06 1zki h VAL 18 Cb -0.02 1.82 0.00 0.00 -1.52 0.00 0.00 31.29 31.58 1zki h VAL 18 CO -0.01 0.43 0.00 0.61 0.02 0.00 0.00 177.57 178.62 1zki n GLY 19 N -0.23 1.49 3.72 2.17 0.00 -0.69 -4.95 105.19 106.69 1zki n GLY 19 Ca -0.02 -0.05 -0.42 0.00 0.00 0.00 0.00 46.02 45.54 1zki n GLY 19 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1zki s LEU 20 N 0.00 4.39 -0.20 0.99 1.43 -0.36 -4.45 118.68 120.48 1zki s LEU 20 Ca 0.00 2.13 0.01 0.00 -1.03 0.00 0.00 54.13 55.25 1zki s LEU 20 Cb 0.00 -3.59 0.04 0.00 0.03 0.00 0.00 46.19 42.67 1zki s LEU 20 CO 0.00 -0.49 -0.15 -1.81 0.23 0.00 0.00 176.35 174.13 1zki s ASP 21 N 0.88 3.46 0.37 2.29 1.01 -0.26 -4.68 116.67 119.74 1zki s ASP 21 Ca 0.59 -0.87 -0.28 0.00 0.71 0.00 0.00 52.55 52.70 1zki s ASP 21 Cb -0.32 -1.39 -0.11 0.00 1.01 0.00 0.00 42.92 42.11 1zki s ASP 21 CO 0.31 -0.09 1.47 -2.84 0.21 0.00 0.00 175.17 174.23 1zki s PRO 22 N 1.30 4.13 -0.13 8.23 0.02 -1.26 -0.30 135.00 146.99 1zki s PRO 22 Ca 0.00 2.54 -0.06 0.00 0.02 0.00 0.00 61.00 63.50 1zki s PRO 22 Cb -0.15 -2.98 -0.05 0.00 0.02 0.00 0.00 34.50 31.33 1zki s PRO 22 CO -0.10 -0.50 -0.16 0.28 -0.33 0.00 0.00 177.00 176.19 1zki n VAL 23 N 0.53 0.69 -3.64 3.83 0.31 0.48 -4.84 118.33 115.69 1zki n VAL 23 Ca 0.01 -0.18 -0.10 0.00 -0.01 0.00 0.00 64.34 64.06 1zki n VAL 23 Cb 0.39 -1.64 -0.03 0.00 -0.91 0.00 0.00 33.84 31.65 1zki n VAL 23 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 1zki s SER 24 N -6.09 -0.37 0.00 4.52 1.04 -1.01 -4.99 113.70 106.80 1zki s SER 24 Ca -0.17 -0.32 0.01 0.00 0.48 0.00 0.00 55.95 55.95 1zki s SER 24 Cb 0.07 0.61 -0.01 0.00 0.10 0.00 0.00 66.02 66.79 1zki s SER 24 CO 0.22 -1.06 -0.04 -0.76 0.98 0.00 0.00 173.24 172.58 1zki s LEU 25 N -2.83 2.04 0.00 2.42 1.43 -1.26 -1.23 118.68 119.25 1zki s LEU 25 Ca 0.06 -0.13 0.00 0.00 -1.03 0.00 0.00 54.13 53.03 1zki s LEU 25 Cb -0.02 -0.15 0.00 0.00 0.03 0.00 0.00 46.19 46.05 1zki s LEU 25 CO -0.05 -0.00 0.00 0.61 0.23 0.00 0.00 176.35 177.13 1zki n GLY 26 N 2.77 6.21 3.48 -3.19 0.00 0.16 -4.99 105.19 109.64 1zki n GLY 26 Ca -0.14 -1.69 -0.43 0.00 0.00 0.00 0.00 46.02 43.75 1zki n GLY 26 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1zki s ASP 27 N 1.00 6.49 -0.29 1.61 2.15 -1.26 -3.72 116.67 122.65 1zki s ASP 27 Ca 0.00 -1.62 0.00 0.00 0.43 0.00 0.00 52.55 51.36 1zki s ASP 27 Cb 0.00 -2.45 0.00 0.00 -0.30 0.00 0.00 42.92 40.17 1zki s ASP 27 CO 0.00 -1.28 0.00 0.61 -0.17 0.00 0.00 175.17 174.33 1zki n GLY 28 N 5.79 0.38 2.96 2.66 0.00 -1.25 -4.93 105.19 110.80 1zki n GLY 28 Ca 0.20 -0.83 -0.12 0.00 0.00 0.00 0.00 46.02 45.27 1zki n GLY 28 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1zki s VAL 29 N -2.14 0.22 0.03 1.61 1.01 -1.24 -0.37 120.40 119.53 1zki s VAL 29 Ca 0.00 -0.54 -0.11 0.00 0.00 0.00 0.00 61.98 61.33 1zki s VAL 29 Cb 0.00 -0.27 0.01 0.00 0.00 0.00 0.00 36.38 36.12 1zki s VAL 29 CO 0.00 -0.21 0.23 0.00 0.00 0.00 0.00 175.10 175.12 1zki s ALA 30 N -0.75 -0.48 -0.03 5.51 0.00 -0.64 -0.66 121.76 124.72 1zki s ALA 30 Ca -0.07 -0.14 0.03 0.00 0.00 0.00 0.00 51.96 51.78 1zki s ALA 30 Cb -0.05 0.26 0.00 0.00 0.00 0.00 0.00 23.12 23.32 1zki s ALA 30 CO -0.00 -0.35 -0.11 -2.00 0.00 0.00 0.00 175.76 173.29 1zki s GLU 31 N -2.36 1.17 0.01 0.00 2.12 -0.37 -1.24 118.70 118.04 1zki s GLU 31 Ca -0.07 -0.39 0.03 0.00 0.36 0.00 0.00 54.97 54.91 1zki s GLU 31 Cb -0.02 -1.07 -0.01 0.00 0.26 0.00 0.00 34.13 33.29 1zki s GLU 31 CO -0.03 0.15 -0.10 0.08 -0.54 0.00 0.00 175.26 174.82 1zki s VAL 32 N 0.14 0.80 0.17 3.70 1.01 -0.36 -0.39 120.40 125.47 1zki s VAL 32 Ca -0.03 -0.62 0.07 0.00 0.00 0.00 0.00 61.98 61.40 1zki s VAL 32 Cb -0.09 -0.71 -0.04 0.00 0.00 0.00 0.00 36.38 35.54 1zki s VAL 32 CO 0.01 0.09 0.02 0.00 0.00 0.00 0.00 175.10 175.22 1zki s ARG 33 N -0.59 2.49 -0.23 2.72 1.70 0.59 -0.73 118.95 124.89 1zki s ARG 33 Ca 0.02 -1.07 -0.04 0.00 -0.47 0.00 0.00 55.73 54.17 1zki s ARG 33 Cb -0.05 -2.40 0.10 0.00 -0.57 0.00 0.00 34.95 32.02 1zki s ARG 33 CO 0.00 0.46 0.18 -1.17 -1.08 0.00 0.00 175.30 173.69 1zki s LEU 34 N -2.98 0.12 0.00 -1.89 2.96 -0.23 -1.11 118.68 115.55 1zki s LEU 34 Ca 0.28 -0.67 0.00 0.00 -0.22 0.00 0.00 54.13 53.53 1zki s LEU 34 Cb -0.09 0.09 0.00 0.00 0.50 0.00 0.00 46.19 46.69 1zki s LEU 34 CO 0.19 -0.37 0.00 -0.81 -1.32 0.00 0.00 176.35 174.04 1zki n PRO 35 N 5.29 0.38 0.00 0.98 -0.04 -1.26 -1.27 135.00 139.08 1zki n PRO 35 Ca -0.05 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.41 1zki n PRO 35 Cb 0.47 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.93 1zki n PRO 35 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1zki n ALA 37 N -3.00 0.00 -0.28 0.55 0.00 -1.26 -4.97 120.51 111.55 1zki n ALA 37 Ca 0.00 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.49 1zki n ALA 37 Cb 0.00 0.00 0.18 0.00 0.00 0.00 0.00 19.45 19.63 1zki n ALA 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1zki h ALA 38 N 0.00 1.15 0.00 0.00 0.00 -2.01 -1.25 119.26 117.15 1zki h ALA 38 Ca 0.00 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1zki h ALA 38 Cb 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1zki h ALA 38 CO 0.00 -0.06 0.00 -2.39 0.00 0.00 0.00 179.25 176.80 1zki n HIS 39 N -4.87 0.00 1.09 0.00 -0.00 -1.26 -2.20 115.22 107.98 1zki n HIS 39 Ca 0.14 0.00 0.12 0.00 -0.00 0.00 0.00 57.72 57.98 1zki n HIS 39 Cb 0.36 0.00 0.13 0.00 -0.00 0.00 0.00 29.99 30.48 1zki n HIS 39 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 176.34 177.62 1zki n LEU 40 N -0.90 1.89 -4.75 2.39 4.77 -0.47 -4.99 117.00 114.95 1zki n LEU 40 Ca 0.16 -0.66 -0.41 0.00 -0.03 0.00 0.00 56.01 55.07 1zki n LEU 40 Cb 0.07 -0.03 -0.03 0.00 -2.33 0.00 0.00 43.42 41.10 1zki n LEU 40 CO 0.12 0.34 0.90 -0.13 -1.33 0.00 0.00 177.39 177.29 1zki s ARG 41 N -2.39 4.48 0.01 3.23 0.52 -0.93 -0.52 118.95 123.34 1zki s ARG 41 Ca 0.22 1.94 -0.00 0.00 -0.52 0.00 0.00 55.73 57.37 1zki s ARG 41 Cb 0.19 -3.20 0.00 0.00 0.52 0.00 0.00 34.95 32.46 1zki s ARG 41 CO 0.51 -0.07 0.01 0.27 0.02 0.00 0.00 175.30 176.04 1zki n ASN 42 N 2.03 0.01 0.25 0.23 0.23 0.07 -4.77 115.26 113.31 1zki n ASN 42 Ca 0.03 -1.01 0.12 0.00 -0.53 0.00 0.00 54.58 53.19 1zki n ASN 42 Cb 0.44 -0.01 0.65 0.00 -2.08 0.00 0.00 39.78 38.78 1zki n ASN 42 CO 0.00 0.00 0.00 0.03 -0.93 0.00 0.00 177.26 176.36 1zki h ARG 43 N 0.00 0.00 -0.02 -3.83 3.08 -1.97 -1.53 114.38 110.12 1zki h ARG 43 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1zki h ARG 43 Cb 0.01 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.06 1zki h ARG 43 CO 0.00 0.16 0.00 0.41 -1.07 0.00 0.00 179.97 179.47 1zki n GLY 44 N -0.46 -0.51 2.06 0.04 0.00 -1.26 -4.92 105.19 100.14 1zki n GLY 44 Ca -0.01 -0.31 -0.01 0.00 0.00 0.00 0.00 46.02 45.69 1zki n GLY 44 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1zki n GLY 45 N 1.06 0.48 0.37 -0.02 0.00 -0.57 -5.15 105.19 101.35 1zki n GLY 45 Ca 0.21 -0.43 0.00 0.00 0.00 0.00 0.00 46.02 45.80 1zki n GLY 45 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1zki n VAL 46 N -2.94 0.00 -5.02 1.61 0.24 -1.26 -4.78 118.33 106.18 1zki n VAL 46 Ca -0.01 0.12 -0.28 0.00 -2.04 0.00 0.00 64.34 62.14 1zki n VAL 46 Cb 0.04 -1.00 -0.15 0.00 -1.47 0.00 0.00 33.84 31.26 1zki n VAL 46 CO 0.00 0.00 0.00 -2.28 -2.14 0.00 0.00 176.83 172.41 1zki s HIS 48 N -0.61 1.92 0.45 6.34 2.46 0.32 -0.75 115.29 125.43 1zki s HIS 48 Ca 0.00 -0.37 0.18 0.00 0.47 0.00 0.00 55.06 55.35 1zki s HIS 48 Cb 0.00 -1.23 1.13 0.00 -0.13 0.00 0.00 32.58 32.36 1zki s HIS 48 CO 0.00 -0.02 1.92 0.78 -2.47 0.00 0.00 174.74 174.96 1zki h GLY 49 N 5.52 0.57 1.34 1.59 0.00 -2.00 -0.71 103.07 109.38 1zki h GLY 49 Ca -0.40 -0.14 -0.08 0.00 0.00 0.00 0.00 47.33 46.70 1zki h GLY 49 CO 0.47 0.04 -0.06 -1.33 0.00 0.00 0.00 176.54 175.67 1zki h GLY 50 N 0.33 0.86 1.04 4.60 0.00 -1.99 -0.68 103.07 107.23 1zki h GLY 50 Ca 0.36 -0.61 -0.12 0.00 0.00 0.00 0.00 47.33 46.96 1zki h GLY 50 CO -0.10 0.56 -0.22 0.00 0.00 0.00 0.00 176.54 176.79 1zki h ALA 51 N 1.20 0.56 -0.60 3.60 0.00 -1.51 -0.38 119.26 122.14 1zki h ALA 51 Ca 0.13 -0.38 -0.01 0.00 0.00 0.00 0.00 54.91 54.65 1zki h ALA 51 Cb 0.53 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.15 1zki h ALA 51 CO 0.03 0.53 0.32 -0.07 0.00 0.00 0.00 179.25 180.07 1zki h LEU 52 N 0.66 0.75 -0.64 0.00 3.38 -1.26 -0.83 115.31 117.38 1zki h LEU 52 Ca 0.08 -0.10 -0.05 0.00 0.09 0.00 0.00 57.88 57.91 1zki h LEU 52 Cb 0.78 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 41.31 1zki h LEU 52 CO 0.06 0.64 0.20 0.15 0.09 0.00 0.00 178.44 179.58 1zki h PHE 53 N 0.81 1.02 -0.48 1.13 3.57 -0.99 -2.96 116.94 119.05 1zki h PHE 53 Ca 0.21 -0.10 0.01 0.00 3.53 0.00 0.00 57.97 61.62 1zki h PHE 53 Cb 0.05 -0.30 -0.03 0.00 2.79 0.00 0.00 35.95 38.47 1zki h PHE 53 CO -0.01 0.83 0.31 0.77 -2.23 0.00 0.00 178.31 177.98 1zki h SER 54 N 0.91 0.52 0.00 0.41 0.02 -0.74 0.15 113.55 114.83 1zki h SER 54 Ca 0.21 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 61.15 1zki h SER 54 Cb 0.29 -0.12 0.00 0.00 0.14 0.00 0.00 62.40 62.70 1zki h SER 54 CO -0.01 0.37 0.00 -0.11 -1.14 0.00 0.00 176.83 175.95 1zki n LEU 55 N -4.78 0.00 0.00 5.07 7.94 -0.34 -1.54 117.00 123.35 1zki n LEU 55 Ca 0.02 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.92 1zki n LEU 55 Cb 0.04 0.00 0.00 0.00 0.53 0.00 0.00 43.42 43.99 1zki n LEU 55 CO 0.34 0.00 0.00 -0.67 -1.11 0.00 0.00 177.39 175.95 1zki n ASP 57 N 0.24 0.00 -0.10 1.96 2.03 0.53 -1.38 116.55 119.84 1zki n ASP 57 Ca 0.00 0.00 -0.10 0.00 0.52 0.00 0.00 54.79 55.21 1zki n ASP 57 Cb 0.00 0.00 -0.02 0.00 -0.72 0.00 0.00 41.12 40.38 1zki n ASP 57 CO 0.00 0.00 0.00 0.58 -1.92 0.00 0.00 177.20 175.86 1zki h VAL 58 N 0.00 1.19 0.00 5.18 2.07 -1.53 -0.84 116.25 122.33 1zki h VAL 58 Ca 0.00 -0.61 0.00 0.00 0.82 0.00 0.00 66.70 66.91 1zki h VAL 58 Cb 0.00 1.01 0.00 0.00 -1.52 0.00 0.00 31.29 30.78 1zki h VAL 58 CO 0.00 0.21 0.00 0.41 0.02 0.00 0.00 177.57 178.21 1zki n THR 59 N -4.71 0.04 0.00 2.57 -1.04 -0.48 -1.70 114.28 108.97 1zki n THR 59 Ca -0.02 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.99 1zki n THR 59 Cb 0.15 -0.34 0.00 0.00 -1.82 0.00 0.00 70.33 68.33 1zki n THR 59 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1zki n GLY 61 N 0.77 0.00 0.27 3.41 0.00 -0.32 -1.10 105.19 108.22 1zki n GLY 61 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.93 1zki n GLY 61 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1zki h LEU 62 N 0.00 0.90 -0.64 0.99 3.38 -1.60 -0.41 115.31 117.93 1zki h LEU 62 Ca 0.00 -0.34 0.00 0.00 0.09 0.00 0.00 57.88 57.64 1zki h LEU 62 Cb 0.00 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.47 1zki h LEU 62 CO 0.00 1.09 0.41 0.00 0.09 0.00 0.00 178.44 180.03 1zki h ALA 63 N 0.98 0.82 -0.36 1.53 0.00 -1.37 -0.34 119.26 120.52 1zki h ALA 63 Ca 0.10 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1zki h ALA 63 Cb 0.77 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 1zki h ALA 63 CO 0.06 0.27 0.23 0.00 0.00 0.00 0.00 179.25 179.81 1zki h SER 65 N 0.48 0.33 1.34 0.00 0.02 -0.76 -0.55 113.55 114.41 1zki h SER 65 Ca 0.13 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 61.07 1zki h SER 65 Cb -0.03 -0.08 0.00 0.00 0.14 0.00 0.00 62.40 62.43 1zki h SER 65 CO -0.03 0.26 0.00 0.77 -1.14 0.00 0.00 176.83 176.70 1zki h SER 66 N 0.39 0.00 0.00 3.07 4.64 -0.45 0.22 113.55 121.42 1zki h SER 66 Ca 0.10 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.33 1zki h SER 66 Cb -0.00 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.07 1zki h SER 66 CO -0.02 0.00 -0.58 -1.28 -0.87 0.00 0.00 176.83 174.08 1zki h SER 67 N 0.00 0.00 0.44 4.97 0.87 -0.70 -3.33 113.55 115.81 1zki h SER 67 Ca 0.00 -0.48 0.00 0.00 -1.23 0.00 0.00 61.79 60.08 1zki h SER 67 Cb 0.67 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.63 1zki h SER 67 CO 0.00 1.07 -0.37 0.00 -0.53 0.00 0.00 176.83 176.99 1zki n HIS 68 N -4.57 0.00 0.00 2.24 1.44 -0.36 -4.94 115.22 109.04 1zki n HIS 68 Ca -0.17 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.54 1zki n HIS 68 Cb 0.45 -0.22 0.00 0.00 0.12 0.00 0.00 29.99 30.33 1zki n HIS 68 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1zki n GLY 69 N 1.44 -0.02 0.00 -1.39 0.00 0.78 -4.45 105.19 101.55 1zki n GLY 69 Ca 0.08 -1.56 0.12 0.00 0.00 0.00 0.00 46.02 44.67 1zki n GLY 69 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1zki n PHE 70 N 0.42 0.00 1.46 1.61 3.72 -1.23 -1.95 117.46 121.49 1zki n PHE 70 Ca 0.00 0.00 0.14 0.00 -0.05 0.00 0.00 57.45 57.54 1zki n PHE 70 Cb 0.00 -0.32 0.65 0.00 -0.94 0.00 0.00 39.48 38.87 1zki n PHE 70 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 176.76 176.31 1zki n ASP 71 N -1.32 0.43 -4.45 4.37 5.75 -1.26 -4.83 116.55 115.24 1zki n ASP 71 Ca 0.11 -0.61 -0.22 0.00 -0.01 0.00 0.00 54.79 54.06 1zki n ASP 71 Cb 0.21 -0.08 -0.10 0.00 -1.03 0.00 0.00 41.12 40.12 1zki n ASP 71 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 1zki s ARG 72 N -2.42 1.60 0.13 0.11 0.52 -0.82 -5.16 118.95 112.89 1zki s ARG 72 Ca 0.31 -1.78 0.09 0.00 -0.52 0.00 0.00 55.73 53.83 1zki s ARG 72 Cb 0.20 -1.41 -0.04 0.00 0.52 0.00 0.00 34.95 34.23 1zki s ARG 72 CO 0.46 0.15 -0.22 -0.65 0.02 0.00 0.00 175.30 175.06 1zki s GLN 73 N -3.64 1.25 0.05 3.54 -1.52 -1.26 -4.82 119.66 113.25 1zki s GLN 73 Ca 0.29 -1.28 -0.00 0.00 -1.95 0.00 0.00 55.36 52.41 1zki s GLN 73 Cb 0.01 -1.53 -0.03 0.00 -0.22 0.00 0.00 33.01 31.23 1zki s GLN 73 CO 0.13 0.35 -0.03 -1.54 -0.25 0.00 0.00 175.29 173.94 1zki s SER 74 N -2.16 0.49 0.05 5.90 1.04 -1.26 -0.96 113.70 116.79 1zki s SER 74 Ca 0.11 -0.87 0.03 0.00 0.48 0.00 0.00 55.95 55.70 1zki s SER 74 Cb -0.09 0.16 -0.02 0.00 0.10 0.00 0.00 66.02 66.17 1zki s SER 74 CO 0.06 -0.51 -0.10 0.68 0.98 0.00 0.00 173.24 174.35 1zki s VAL 75 N -3.24 0.71 0.04 5.02 -7.23 -0.92 -4.95 120.40 109.83 1zki s VAL 75 Ca 0.01 -1.06 -0.30 0.00 -1.81 0.00 0.00 61.98 58.82 1zki s VAL 75 Cb 0.03 -0.73 -0.08 0.00 0.56 0.00 0.00 36.38 36.16 1zki s VAL 75 CO -0.07 -0.27 1.63 -0.89 -0.31 0.00 0.00 175.10 175.18 1zki s THR 76 N -1.21 3.21 -0.11 5.32 2.01 -1.26 -0.64 115.64 122.95 1zki s THR 76 Ca -0.06 0.59 -0.20 0.00 0.31 0.00 0.00 61.69 62.32 1zki s THR 76 Cb -0.09 -3.38 -0.27 0.00 0.01 0.00 0.00 72.50 68.77 1zki s THR 76 CO 0.01 -0.01 0.63 -0.07 -0.69 0.00 0.00 174.62 174.49 1zki h LEU 77 N 8.83 0.29 -7.09 4.42 3.38 -1.09 -3.46 115.31 120.59 1zki h LEU 77 Ca -0.42 -0.86 0.02 0.00 0.09 0.00 0.00 57.88 56.72 1zki h LEU 77 Cb 1.20 -0.09 -0.12 0.00 0.09 0.00 0.00 40.66 41.73 1zki h LEU 77 CO 0.93 1.44 0.29 -1.83 0.09 0.00 0.00 178.44 179.36 1zki s GLU 78 N -2.41 1.21 0.01 1.13 4.04 -1.05 -5.00 118.70 116.62 1zki s GLU 78 Ca -0.19 -0.47 -0.21 0.00 0.04 0.00 0.00 54.97 54.13 1zki s GLU 78 Cb 0.02 0.54 0.04 0.00 0.02 0.00 0.00 34.13 34.76 1zki s GLU 78 CO 0.75 -0.53 0.47 0.00 -1.84 0.00 0.00 175.26 174.11 1zki s LYS 80 N -1.85 0.75 0.02 0.00 2.36 -0.16 -4.99 119.74 115.88 1zki s LYS 80 Ca -0.09 -0.17 0.05 0.00 -2.55 0.00 0.00 55.97 53.21 1zki s LYS 80 Cb -0.02 -0.74 -0.02 0.00 -1.05 0.00 0.00 37.83 36.00 1zki s LYS 80 CO 0.03 0.01 -0.14 -1.50 1.55 0.00 0.00 175.35 175.30 1zki s ILE 81 N 0.49 1.10 -0.08 5.43 2.07 -1.26 -1.40 121.20 127.55 1zki s ILE 81 Ca -0.07 -0.87 0.01 0.00 -1.41 0.00 0.00 60.65 58.32 1zki s ILE 81 Cb -0.10 -0.97 -0.02 0.00 0.13 0.00 0.00 42.46 41.49 1zki s ILE 81 CO 0.00 0.10 -0.12 0.20 -1.91 0.00 0.00 174.94 173.21 1zki s ASN 82 N -0.88 4.22 -0.24 4.50 0.01 0.76 -4.99 114.94 118.31 1zki s ASN 82 Ca 0.03 -0.19 -0.10 0.00 -0.71 0.00 0.00 52.86 51.89 1zki s ASN 82 Cb -0.07 -1.19 -0.05 0.00 0.41 0.00 0.00 41.25 40.35 1zki s ASN 82 CO 0.01 0.29 0.16 -0.31 -1.51 0.00 0.00 177.10 175.73 1zki s TYR 83 N -0.38 3.30 -0.21 2.20 2.02 -1.26 -1.77 117.35 121.25 1zki s TYR 83 Ca 0.05 0.20 -0.09 0.00 -0.37 0.00 0.00 57.07 56.85 1zki s TYR 83 Cb -0.12 -2.27 -0.10 0.00 -0.40 0.00 0.00 41.96 39.07 1zki s TYR 83 CO 0.02 0.05 -0.27 -0.89 -1.57 0.00 0.00 175.55 172.90 1zki n ILE 84 N 4.31 1.17 -3.89 2.71 5.41 0.85 -5.00 119.36 124.93 1zki n ILE 84 Ca -0.15 -0.31 -0.09 0.00 1.00 0.00 0.00 62.75 63.19 1zki n ILE 84 Cb 0.52 -1.73 -0.07 0.00 -0.71 0.00 0.00 39.64 37.66 1zki n ILE 84 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1zki s ARG 85 N -2.39 1.10 0.38 0.38 1.70 -1.11 -5.03 118.95 113.98 1zki s ARG 85 Ca -0.30 -1.06 -0.21 0.00 -0.47 0.00 0.00 55.73 53.70 1zki s ARG 85 Cb 0.11 0.39 -0.10 0.00 -0.57 0.00 0.00 34.95 34.78 1zki s ARG 85 CO 0.38 -0.40 0.89 0.00 -1.08 0.00 0.00 175.30 175.09 1zki s ALA 86 N -3.92 3.15 -0.19 7.88 0.00 -1.26 -4.75 121.76 122.67 1zki s ALA 86 Ca 0.13 0.33 -0.02 0.00 0.00 0.00 0.00 51.96 52.40 1zki s ALA 86 Cb 0.03 -3.06 -0.01 0.00 0.00 0.00 0.00 23.12 20.08 1zki s ALA 86 CO -0.04 0.19 -0.08 0.08 0.00 0.00 0.00 175.76 175.91 1zki s VAL 87 N -2.00 3.17 -0.03 0.00 1.01 -1.26 -5.00 120.40 116.29 1zki s VAL 87 Ca 0.57 -0.58 0.16 0.00 0.00 0.00 0.00 61.98 62.13 1zki s VAL 87 Cb -0.11 -2.40 -0.25 0.00 0.00 0.00 0.00 36.38 33.62 1zki s VAL 87 CO 0.16 0.47 0.34 0.00 0.00 0.00 0.00 175.10 176.07 1zki n ALA 88 N 4.34 2.55 -3.84 5.51 0.00 -1.26 -4.54 120.51 123.27 1zki n ALA 88 Ca -0.18 -0.41 -0.05 0.00 0.00 0.00 0.00 53.44 52.80 1zki n ALA 88 Cb 0.51 -0.53 0.02 0.00 0.00 0.00 0.00 19.45 19.45 1zki n ALA 88 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 1zki s ASP 89 N -3.89 -0.03 0.20 0.00 1.47 -1.26 -4.94 116.67 108.23 1zki s ASP 89 Ca -0.06 -0.81 0.00 0.00 1.18 0.00 0.00 52.55 52.86 1zki s ASP 89 Cb 0.10 0.63 0.00 0.00 -0.34 0.00 0.00 42.92 43.31 1zki s ASP 89 CO 0.66 -1.25 0.00 0.61 0.68 0.00 0.00 175.17 175.88 1zki n GLY 90 N -0.61 0.12 3.26 2.12 0.00 -1.26 -4.90 105.19 103.92 1zki n GLY 90 Ca -0.05 -0.97 -0.14 0.00 0.00 0.00 0.00 46.02 44.86 1zki n GLY 90 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1zki s GLU 91 N 0.00 1.10 0.21 1.61 -1.05 -1.26 -4.60 118.70 114.71 1zki s GLU 91 Ca 0.00 -1.49 0.11 0.00 -0.15 0.00 0.00 54.97 53.44 1zki s GLU 91 Cb 0.00 -0.57 -0.04 0.00 -0.44 0.00 0.00 34.13 33.08 1zki s GLU 91 CO 0.00 0.02 -0.18 0.14 0.95 0.00 0.00 175.26 176.19 1zki s VAL 92 N -3.39 2.66 -0.06 1.83 -7.23 -0.40 -4.69 120.40 109.12 1zki s VAL 92 Ca 0.19 -2.00 0.06 0.00 -1.81 0.00 0.00 61.98 58.41 1zki s VAL 92 Cb 0.04 -2.32 -0.01 0.00 0.56 0.00 0.00 36.38 34.65 1zki s VAL 92 CO 0.02 -0.18 -0.25 -0.13 -0.31 0.00 0.00 175.10 174.25 1zki s ARG 93 N -2.93 2.62 -0.14 4.82 1.81 -0.21 -1.07 118.95 123.84 1zki s ARG 93 Ca 0.24 -0.90 -0.02 0.00 -1.72 0.00 0.00 55.73 53.34 1zki s ARG 93 Cb -0.07 -2.19 -0.02 0.00 -0.45 0.00 0.00 34.95 32.22 1zki s ARG 93 CO 0.13 0.36 -0.08 0.00 -0.68 0.00 0.00 175.30 175.03 1zki s VAL 95 N 0.35 2.56 0.07 0.00 1.01 -0.53 -1.23 120.40 122.64 1zki s VAL 95 Ca -0.07 -0.81 0.09 0.00 0.00 0.00 0.00 61.98 61.18 1zki s VAL 95 Cb -0.15 -2.07 -0.03 0.00 0.00 0.00 0.00 36.38 34.13 1zki s VAL 95 CO 0.04 0.52 -0.22 0.00 0.00 0.00 0.00 175.10 175.45 1zki s ALA 96 N 0.72 2.49 -0.04 5.51 0.00 -0.37 -1.56 121.76 128.51 1zki s ALA 96 Ca -0.07 -1.29 -0.01 0.00 0.00 0.00 0.00 51.96 50.59 1zki s ALA 96 Cb -0.16 -0.60 0.03 0.00 0.00 0.00 0.00 23.12 22.40 1zki s ALA 96 CO 0.01 0.56 0.03 0.50 0.00 0.00 0.00 175.76 176.86 1zki s ARG 97 N -1.64 0.16 -0.00 0.00 3.52 -0.09 -1.61 118.95 119.28 1zki s ARG 97 Ca 0.14 0.21 -0.30 0.00 -0.13 0.00 0.00 55.73 55.65 1zki s ARG 97 Cb -0.10 -0.54 -0.06 0.00 -1.56 0.00 0.00 34.95 32.69 1zki s ARG 97 CO 0.06 -0.24 1.54 0.08 -0.81 0.00 0.00 175.30 175.93 1zki s VAL 98 N 1.61 3.50 -0.12 7.11 1.01 0.51 -1.56 120.40 132.46 1zki s VAL 98 Ca -0.02 0.82 0.17 0.00 0.00 0.00 0.00 61.98 62.95 1zki s VAL 98 Cb -0.13 -3.53 -0.20 0.00 0.00 0.00 0.00 36.38 32.52 1zki s VAL 98 CO -0.03 -0.03 0.57 0.18 0.00 0.00 0.00 175.10 175.79 1zki n LEU 99 N 6.00 0.56 -3.70 3.92 4.77 0.13 -4.92 117.00 123.76 1zki n LEU 99 Ca 0.15 0.26 -0.11 0.00 -0.03 0.00 0.00 56.01 56.28 1zki n LEU 99 Cb 0.42 0.19 -0.11 0.00 -2.33 0.00 0.00 43.42 41.60 1zki n LEU 99 CO 0.61 0.27 0.06 -2.28 -1.33 0.00 0.00 177.39 174.72 1zki s HIS 100 N -2.80 -0.60 -0.36 -1.77 5.04 -1.04 -4.97 115.29 108.79 1zki s HIS 100 Ca -0.06 1.28 0.03 0.00 -1.54 0.00 0.00 55.06 54.78 1zki s HIS 100 Cb 0.08 0.26 0.11 0.00 0.04 0.00 0.00 32.58 33.07 1zki s HIS 100 CO 0.83 -0.34 0.09 0.00 -2.34 0.00 0.00 174.74 172.98 1zki s ALA 101 N 1.30 2.79 0.66 1.58 0.00 -1.26 -1.29 121.76 125.55 1zki s ALA 101 Ca -0.09 -2.55 0.02 0.00 0.00 0.00 0.00 51.96 49.34 1zki s ALA 101 Cb -0.08 -1.96 0.10 0.00 0.00 0.00 0.00 23.12 21.19 1zki s ALA 101 CO -0.12 -1.74 0.92 0.20 0.00 0.00 0.00 175.76 175.02 1zki s GLY 102 N 0.80 1.77 0.42 0.00 0.00 0.55 -5.00 107.32 105.85 1zki s GLY 102 Ca 0.12 -1.76 0.17 0.00 0.00 0.00 0.00 44.72 43.25 1zki s GLY 102 CO -0.09 -1.26 1.90 0.07 0.00 0.00 0.00 173.10 173.73 1zki h ARG 103 N -0.29 0.00 0.00 2.90 0.11 -2.00 -3.34 114.38 111.77 1zki h ARG 103 Ca -0.36 0.00 -0.03 0.00 0.10 0.00 0.00 59.98 59.69 1zki h ARG 103 Cb 1.28 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 32.35 1zki h ARG 103 CO 0.42 0.28 -1.23 0.54 0.10 0.00 0.00 179.97 180.08 1zki n ARG 104 N -3.97 1.54 -3.97 0.08 1.74 -1.26 -4.74 116.66 106.09 1zki n ARG 104 Ca -0.02 -0.02 -0.09 0.00 -0.77 0.00 0.00 57.85 56.95 1zki n ARG 104 Cb 0.35 -1.10 -0.09 0.00 -1.02 0.00 0.00 32.46 30.60 1zki n ARG 104 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1zki s SER 105 N -2.93 0.26 0.01 0.55 1.04 -1.25 -0.66 113.70 110.72 1zki s SER 105 Ca -0.02 -0.69 0.06 0.00 0.48 0.00 0.00 55.95 55.79 1zki s SER 105 Cb 0.02 0.23 -0.02 0.00 0.10 0.00 0.00 66.02 66.35 1zki s SER 105 CO 0.17 -0.56 -0.19 -0.76 0.98 0.00 0.00 173.24 172.89 1zki s LEU 106 N -2.43 2.09 -0.11 2.42 1.02 -0.25 -0.33 118.68 121.10 1zki s LEU 106 Ca -0.01 -0.40 -0.01 0.00 0.02 0.00 0.00 54.13 53.73 1zki s LEU 106 Cb 0.02 -0.91 -0.03 0.00 0.02 0.00 0.00 46.19 45.29 1zki s LEU 106 CO -0.07 0.18 -0.06 -0.69 0.02 0.00 0.00 176.35 175.73 1zki s VAL 107 N -0.59 3.73 0.00 -1.59 1.01 -0.41 -0.51 120.40 122.04 1zki s VAL 107 Ca 0.07 -0.44 0.02 0.00 0.00 0.00 0.00 61.98 61.62 1zki s VAL 107 Cb -0.08 -2.58 -0.01 0.00 0.00 0.00 0.00 36.38 33.72 1zki s VAL 107 CO 0.00 0.55 -0.06 -0.69 0.00 0.00 0.00 175.10 174.90 1zki s VAL 108 N -0.21 0.43 0.30 2.92 1.01 -0.53 0.19 120.40 124.51 1zki s VAL 108 Ca 0.03 -0.38 0.10 0.00 0.00 0.00 0.00 61.98 61.73 1zki s VAL 108 Cb -0.13 -0.39 -0.05 0.00 0.00 0.00 0.00 36.38 35.81 1zki s VAL 108 CO 0.03 0.02 -0.08 -1.83 0.00 0.00 0.00 175.10 173.23 1zki s GLU 109 N -0.39 1.96 0.01 2.72 -1.05 -0.60 -0.90 118.70 120.44 1zki s GLU 109 Ca -0.00 -1.68 -0.20 0.00 -0.15 0.00 0.00 54.97 52.94 1zki s GLU 109 Cb -0.03 -1.92 0.04 0.00 -0.44 0.00 0.00 34.13 31.78 1zki s GLU 109 CO -0.00 0.28 0.44 0.00 0.95 0.00 0.00 175.26 176.93 1zki s ALA 110 N -2.47 -1.11 0.03 -0.84 0.00 -0.31 -0.92 121.76 116.14 1zki s ALA 110 Ca 0.32 0.54 0.04 0.00 0.00 0.00 0.00 51.96 52.86 1zki s ALA 110 Cb -0.04 0.19 -0.02 0.00 0.00 0.00 0.00 23.12 23.26 1zki s ALA 110 CO 0.18 -0.38 -0.11 -1.83 0.00 0.00 0.00 175.76 173.61 1zki s GLU 111 N -1.85 0.78 -0.11 0.00 -1.05 -0.60 -1.06 118.70 114.80 1zki s GLU 111 Ca -0.09 -0.67 0.00 0.00 -0.15 0.00 0.00 54.97 54.06 1zki s GLU 111 Cb -0.02 -0.73 -0.02 0.00 -0.44 0.00 0.00 34.13 32.92 1zki s GLU 111 CO 0.02 0.18 -0.12 0.08 0.95 0.00 0.00 175.26 176.37 1zki s VAL 112 N -0.85 3.21 0.10 1.83 1.01 -0.09 -1.45 120.40 124.16 1zki s VAL 112 Ca -0.01 -0.62 0.02 0.00 0.00 0.00 0.00 61.98 61.37 1zki s VAL 112 Cb -0.07 -2.34 -0.04 0.00 0.00 0.00 0.00 36.38 33.93 1zki s VAL 112 CO 0.01 0.54 -0.07 -0.13 0.00 0.00 0.00 175.10 175.44 1zki s ARG 113 N 0.08 0.83 -0.32 2.72 0.52 0.15 -0.56 118.95 122.37 1zki s ARG 113 Ca -0.05 -1.28 0.02 0.00 -0.52 0.00 0.00 55.73 53.89 1zki s ARG 113 Cb -0.14 -0.29 0.10 0.00 0.52 0.00 0.00 34.95 35.14 1zki s ARG 113 CO 0.04 0.01 0.07 -1.14 0.02 0.00 0.00 175.30 174.30 1zki s GLN 114 N -3.55 1.09 6.67 3.54 0.74 -0.31 -1.04 119.66 126.80 1zki s GLN 114 Ca 0.10 -1.46 0.00 0.00 0.05 0.00 0.00 55.36 54.05 1zki s GLN 114 Cb 0.03 -2.58 0.00 0.00 1.10 0.00 0.00 33.01 31.56 1zki s GLN 114 CO -0.03 -0.96 0.00 0.41 -0.55 0.00 0.00 175.29 174.16 1zki n GLY 115 N 4.56 3.69 0.00 2.59 0.00 -1.26 -1.41 105.19 113.36 1zki n GLY 115 Ca 0.01 0.03 0.12 0.00 0.00 0.00 0.00 46.02 46.18 1zki n GLY 115 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1zki n ASP 116 N 5.83 0.01 -4.64 1.61 8.00 -1.26 -4.78 116.55 121.31 1zki n ASP 116 Ca 0.00 0.50 -0.43 0.00 0.71 0.00 0.00 54.79 55.57 1zki n ASP 116 Cb 0.00 -0.50 -0.02 0.00 -0.02 0.00 0.00 41.12 40.57 1zki n ASP 116 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 1zki s LYS 117 N -3.00 4.13 -0.24 -1.24 1.02 -0.50 -4.99 119.74 114.91 1zki s LYS 117 Ca 0.12 1.12 -0.29 0.00 0.02 0.00 0.00 55.97 56.94 1zki s LYS 117 Cb 0.16 -3.70 0.01 0.00 -0.52 0.00 0.00 37.83 33.78 1zki s LYS 117 CO 0.46 -0.78 1.05 -1.17 -0.92 0.00 0.00 175.35 173.99 1zki s LEU 118 N 3.42 4.08 -0.25 3.17 2.96 -1.26 -1.16 118.68 129.64 1zki s LEU 118 Ca 0.44 1.34 -0.08 0.00 -0.22 0.00 0.00 54.13 55.60 1zki s LEU 118 Cb -0.13 -3.54 -0.16 0.00 0.50 0.00 0.00 46.19 42.85 1zki s LEU 118 CO 0.12 -0.71 -0.16 0.52 -1.32 0.00 0.00 176.35 174.80 1zki n VAL 119 N 5.41 1.55 -3.61 1.68 0.31 0.27 -4.07 118.33 119.87 1zki n VAL 119 Ca 0.12 -0.45 -0.11 0.00 -0.01 0.00 0.00 64.34 63.89 1zki n VAL 119 Cb 0.46 -1.70 -0.04 0.00 -0.91 0.00 0.00 33.84 31.64 1zki n VAL 119 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1zki s ALA 120 N -2.50 -1.04 -0.05 3.52 0.00 -1.03 -0.10 121.76 120.55 1zki s ALA 120 Ca -0.34 0.09 -0.05 0.00 0.00 0.00 0.00 51.96 51.66 1zki s ALA 120 Cb 0.11 0.66 0.01 0.00 0.00 0.00 0.00 23.12 23.90 1zki s ALA 120 CO 0.58 -0.63 0.14 0.21 0.00 0.00 0.00 175.76 176.06 1zki s LYS 121 N -3.58 0.20 0.30 0.00 2.47 -0.73 -0.91 119.74 117.49 1zki s LYS 121 Ca 0.01 0.14 -0.11 0.00 -1.56 0.00 0.00 55.97 54.46 1zki s LYS 121 Cb 0.01 0.09 0.01 0.00 -1.46 0.00 0.00 37.83 36.48 1zki s LYS 121 CO -0.11 -0.03 0.54 0.20 0.16 0.00 0.00 175.35 176.12 1zki s GLY 122 N -0.07 0.77 -0.15 5.54 0.00 -0.22 -0.17 107.32 113.03 1zki s GLY 122 Ca -0.01 -1.03 -0.12 0.00 0.00 0.00 0.00 44.72 43.56 1zki s GLY 122 CO 0.00 -0.66 0.38 1.62 0.00 0.00 0.00 173.10 174.44 1zki s GLN 123 N -3.43 0.41 0.29 2.90 0.74 -0.49 -1.16 119.66 118.92 1zki s GLN 123 Ca 0.23 0.60 -0.06 0.00 0.05 0.00 0.00 55.36 56.18 1zki s GLN 123 Cb -0.02 0.13 -0.00 0.00 1.10 0.00 0.00 33.01 34.22 1zki s GLN 123 CO 0.13 -0.09 0.43 0.20 -0.55 0.00 0.00 175.29 175.41 1zki s GLY 124 N 0.59 1.15 -0.05 2.59 0.00 -0.08 -0.98 107.32 110.54 1zki s GLY 124 Ca -0.03 -1.32 0.03 0.00 0.00 0.00 0.00 44.72 43.39 1zki s GLY 124 CO -0.04 -0.92 -0.11 -1.59 0.00 0.00 0.00 173.10 170.44 1zki s THR 125 N -3.51 1.00 0.10 0.90 2.01 -0.44 -1.45 115.64 114.25 1zki s THR 125 Ca 0.29 -0.44 0.08 0.00 0.31 0.00 0.00 61.69 61.93 1zki s THR 125 Cb 0.00 -0.91 -0.04 0.00 0.01 0.00 0.00 72.50 71.57 1zki s THR 125 CO 0.15 0.32 -0.15 -0.36 -0.69 0.00 0.00 174.62 173.89 1zki s PHE 126 N 0.45 2.62 -0.21 4.92 0.08 0.33 -0.46 117.98 125.71 1zki s PHE 126 Ca -0.09 -0.22 -0.11 0.00 0.12 0.00 0.00 56.93 56.63 1zki s PHE 126 Cb -0.13 -1.40 -0.05 0.00 -0.57 0.00 0.00 43.02 40.88 1zki s PHE 126 CO 0.02 0.39 0.19 0.00 -0.10 0.00 0.00 175.22 175.71 1zki s ALA 127 N -1.14 3.64 -0.24 5.36 0.00 0.18 -1.08 121.76 128.47 1zki s ALA 127 Ca 0.19 -0.72 -0.29 0.00 0.00 0.00 0.00 51.96 51.14 1zki s ALA 127 Cb -0.11 -2.30 -0.00 0.00 0.00 0.00 0.00 23.12 20.71 1zki s ALA 127 CO 0.11 -0.02 1.26 -1.14 0.00 0.00 0.00 175.76 175.97 1zki s GLN 128 N 0.71 4.07 0.00 0.00 2.00 0.17 -2.18 119.66 124.43 1zki s GLN 128 Ca 0.10 1.42 0.27 0.00 -2.00 0.00 0.00 55.36 55.15 1zki s GLN 128 Cb -0.12 -3.81 0.75 0.00 0.80 0.00 0.00 33.01 30.63 1zki s GLN 128 CO 0.02 -0.91 1.58 1.28 -0.50 0.00 0.00 175.29 176.76