#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kyi s ASP 21 N 0.00 6.24 0.00 7.83 -4.77 -1.26 -4.31 116.67 120.40 2kyi s ASP 21 Ca 0.00 -0.51 0.00 0.00 -3.30 0.00 0.00 52.55 48.74 2kyi s ASP 21 Cb 0.00 -2.50 0.00 0.00 -1.09 0.00 0.00 42.92 39.33 2kyi s ASP 21 CO 0.00 -1.56 0.00 -3.20 0.70 0.00 0.00 175.17 171.11 2kyi n ASN 22 N 8.41 0.00 -4.77 2.11 5.15 -1.26 -5.11 115.26 119.79 2kyi n ASN 22 Ca 0.02 0.00 -0.40 0.00 -0.60 0.00 0.00 54.58 53.59 2kyi n ASN 22 Cb 0.48 0.00 -0.01 0.00 -0.53 0.00 0.00 39.78 39.72 2kyi n ASN 22 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2kyi s ARG 23 N -1.00 4.14 0.11 1.20 1.70 -1.26 -4.80 118.95 119.05 2kyi s ARG 23 Ca 0.00 2.23 0.11 0.00 -0.47 0.00 0.00 55.73 57.59 2kyi s ARG 23 Cb 0.00 -2.91 -0.04 0.00 -0.57 0.00 0.00 34.95 31.43 2kyi s ARG 23 CO 0.00 -0.37 -0.27 -0.65 -1.08 0.00 0.00 175.30 172.93 2kyi s GLN 24 N -2.04 1.48 -0.38 3.89 -0.21 0.12 -4.86 119.66 117.66 2kyi s GLN 24 Ca 0.53 -1.29 -0.15 0.00 0.02 0.00 0.00 55.36 54.47 2kyi s GLN 24 Cb -0.40 -1.90 0.00 0.00 1.00 0.00 0.00 33.01 31.72 2kyi s GLN 24 CO 0.52 0.46 0.33 -0.06 -2.12 0.00 0.00 175.29 174.42 2kyi s PHE 25 N -1.01 3.21 -0.36 0.91 0.40 -1.26 -1.60 117.98 118.28 2kyi s PHE 25 Ca 0.13 -0.29 -0.11 0.00 -0.60 0.00 0.00 56.93 56.07 2kyi s PHE 25 Cb -0.10 -2.65 0.02 0.00 0.51 0.00 0.00 43.02 40.80 2kyi s PHE 25 CO 0.05 -0.51 0.19 -1.17 0.70 0.00 0.00 175.22 174.48 2kyi s LEU 26 N 1.88 4.57 -0.15 -0.37 2.96 0.13 -4.96 118.68 122.75 2kyi s LEU 26 Ca 0.09 -0.90 -0.01 0.00 -0.22 0.00 0.00 54.13 53.09 2kyi s LEU 26 Cb -0.17 -2.01 -0.01 0.00 0.50 0.00 0.00 46.19 44.49 2kyi s LEU 26 CO 0.11 -0.34 -0.10 -0.55 -1.32 0.00 0.00 176.35 174.15 2kyi s SER 27 N 1.56 4.13 0.03 3.68 0.15 -1.26 -0.63 113.70 121.36 2kyi s SER 27 Ca 0.02 -0.33 -0.02 0.00 0.70 0.00 0.00 55.95 56.33 2kyi s SER 27 Cb -0.19 -1.65 -0.02 0.00 -1.71 0.00 0.00 66.02 62.45 2kyi s SER 27 CO 0.06 0.12 0.01 -0.22 1.20 0.00 0.00 173.24 174.41 2kyi s LEU 28 N 0.61 2.14 0.17 3.45 2.96 -0.27 -5.00 118.68 122.75 2kyi s LEU 28 Ca -0.06 -0.56 0.11 0.00 -0.22 0.00 0.00 54.13 53.40 2kyi s LEU 28 Cb -0.15 0.26 -0.04 0.00 0.50 0.00 0.00 46.19 46.75 2kyi s LEU 28 CO 0.03 -0.39 -0.24 0.42 -1.32 0.00 0.00 176.35 174.85 2kyi s THR 29 N -2.07 2.26 0.00 3.68 -4.23 -1.26 -1.19 115.64 112.83 2kyi s THR 29 Ca -0.10 -1.95 0.00 0.00 -1.18 0.00 0.00 61.69 58.46 2kyi s THR 29 Cb -0.05 -2.05 0.00 0.00 1.34 0.00 0.00 72.50 71.74 2kyi s THR 29 CO -0.03 -0.09 0.00 0.61 -0.54 0.00 0.00 174.62 174.57 2kyi n GLY 30 N 0.43 0.99 3.65 3.99 0.00 -0.04 -4.95 105.19 109.25 2kyi n GLY 30 Ca -0.14 -0.02 -0.42 0.00 0.00 0.00 0.00 46.02 45.44 2kyi n GLY 30 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2kyi s VAL 31 N -2.00 4.79 -0.00 1.61 1.01 0.48 -1.53 120.40 124.76 2kyi s VAL 31 Ca 0.00 1.70 -0.21 0.00 0.00 0.00 0.00 61.98 63.47 2kyi s VAL 31 Cb 0.00 -4.17 -0.22 0.00 0.00 0.00 0.00 36.38 31.99 2kyi s VAL 31 CO 0.00 -0.10 1.12 -1.28 0.00 0.00 0.00 175.10 174.84 2kyi h SER 32 N 7.60 0.44 -4.85 3.32 0.87 -0.76 -3.34 113.55 116.83 2kyi h SER 32 Ca -0.22 -0.73 0.06 0.00 -1.23 0.00 0.00 61.79 59.67 2kyi h SER 32 Cb 1.08 -0.13 -0.13 0.00 -0.44 0.00 0.00 62.40 62.78 2kyi h SER 32 CO 0.90 1.11 0.37 -1.59 -0.53 0.00 0.00 176.83 177.08 2kyi s LYS 33 N -3.34 1.08 -0.29 2.24 -2.85 -1.00 -4.93 119.74 110.65 2kyi s LYS 33 Ca -0.14 -0.42 -0.11 0.00 -1.00 0.00 0.00 55.97 54.29 2kyi s LYS 33 Cb 0.03 0.48 -0.04 0.00 -2.06 0.00 0.00 37.83 36.24 2kyi s LYS 33 CO 0.79 -0.47 0.20 0.08 0.10 0.00 0.00 175.35 176.05 2kyi s VAL 34 N -3.42 5.25 -0.06 1.79 1.01 -1.26 -0.36 120.40 123.35 2kyi s VAL 34 Ca 0.04 0.06 -0.13 0.00 0.00 0.00 0.00 61.98 61.95 2kyi s VAL 34 Cb -0.01 -3.55 -0.08 0.00 0.00 0.00 0.00 36.38 32.74 2kyi s VAL 34 CO -0.09 0.19 0.52 1.56 0.00 0.00 0.00 175.10 177.28 2kyi h GLN 35 N 8.39 -0.32 -3.57 2.72 4.20 -1.40 -3.46 115.11 121.66 2kyi h GLN 35 Ca -0.34 0.02 -0.39 0.00 0.06 0.00 0.00 58.65 58.00 2kyi h GLN 35 Cb 1.18 0.07 -0.37 0.00 0.30 0.00 0.00 27.48 28.66 2kyi h GLN 35 CO 0.57 -0.12 -0.75 -1.54 -0.67 0.00 0.00 178.83 176.32 2kyi s SER 36 N -5.22 1.09 -0.46 1.46 1.04 -1.20 -5.00 113.70 105.41 2kyi s SER 36 Ca -0.07 -0.01 -0.14 0.00 0.48 0.00 0.00 55.95 56.21 2kyi s SER 36 Cb 0.00 -0.27 0.08 0.00 0.10 0.00 0.00 66.02 65.93 2kyi s SER 36 CO 0.24 -0.19 0.37 0.12 0.98 0.00 0.00 173.24 174.76 2kyi s PHE 37 N 1.77 3.28 -0.03 5.02 2.19 -1.26 -1.05 117.98 127.88 2kyi s PHE 37 Ca 0.01 -1.16 0.02 0.00 0.33 0.00 0.00 56.93 56.13 2kyi s PHE 37 Cb -0.13 -3.18 0.01 0.00 -1.31 0.00 0.00 43.02 38.41 2kyi s PHE 37 CO -0.03 -0.84 -0.08 0.34 1.83 0.00 0.00 175.22 176.44 2kyi s ASP 38 N 2.57 1.18 0.00 6.13 -1.08 -1.14 -5.01 116.67 119.33 2kyi s ASP 38 Ca 0.04 -0.18 0.00 0.00 -0.52 0.00 0.00 52.55 51.88 2kyi s ASP 38 Cb -0.25 -0.41 0.00 0.00 -1.46 0.00 0.00 42.92 40.80 2kyi s ASP 38 CO 0.05 0.03 0.97 -0.81 0.52 0.00 0.00 175.17 175.93 2kyi n PRO 39 N 3.54 0.00 -0.00 4.34 -0.04 -1.26 -0.86 135.00 140.72 2kyi n PRO 39 Ca -0.21 0.47 0.05 0.00 -0.04 0.00 0.00 63.50 63.77 2kyi n PRO 39 Cb 0.53 -1.50 -0.07 0.00 -0.04 0.00 0.00 33.50 32.42 2kyi n PRO 39 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2kyi n LYS 40 N -1.47 1.63 -3.15 0.54 5.02 -1.26 -0.61 118.16 118.86 2kyi n LYS 40 Ca 0.00 -0.06 0.04 0.00 -2.02 0.00 0.00 58.31 56.28 2kyi n LYS 40 Cb 0.00 -1.13 -0.01 0.00 -0.02 0.00 0.00 35.03 33.88 2kyi n LYS 40 CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 2kyi s GLU 41 N -2.39 0.47 -0.23 1.97 2.12 -0.04 -0.10 118.70 120.50 2kyi s GLU 41 Ca -0.01 0.65 -0.07 0.00 0.36 0.00 0.00 54.97 55.89 2kyi s GLU 41 Cb 0.07 0.33 -0.03 0.00 0.26 0.00 0.00 34.13 34.76 2kyi s GLU 41 CO 0.40 -0.70 0.07 0.42 -0.54 0.00 0.00 175.26 174.91 2kyi s ILE 42 N 2.87 4.48 -0.51 -3.70 1.01 0.90 -2.88 121.20 123.36 2kyi s ILE 42 Ca 0.15 -0.12 -0.15 0.00 0.00 0.00 0.00 60.65 60.53 2kyi s ILE 42 Cb -0.11 -3.07 0.11 0.00 0.01 0.00 0.00 42.46 39.40 2kyi s ILE 42 CO -0.22 0.37 0.44 -0.76 0.00 0.00 0.00 174.94 174.77 2kyi s LEU 43 N 1.23 5.94 -0.37 2.97 1.43 -0.22 -0.70 118.68 128.97 2kyi s LEU 43 Ca 0.05 -1.68 -0.15 0.00 -1.03 0.00 0.00 54.13 51.33 2kyi s LEU 43 Cb -0.14 -2.17 -0.00 0.00 0.03 0.00 0.00 46.19 43.91 2kyi s LEU 43 CO 0.03 -0.77 0.31 -0.76 0.23 0.00 0.00 176.35 175.40 2kyi s LEU 44 N 1.57 4.70 -0.64 1.79 1.43 -0.05 -0.92 118.68 126.57 2kyi s LEU 44 Ca 0.04 -0.54 -0.27 0.00 -1.03 0.00 0.00 54.13 52.33 2kyi s LEU 44 Cb -0.28 -2.23 0.01 0.00 0.03 0.00 0.00 46.19 43.73 2kyi s LEU 44 CO 0.03 -0.36 1.45 -0.70 0.23 0.00 0.00 176.35 177.00 2kyi s GLU 45 N 1.84 3.13 0.46 1.70 2.12 0.51 0.17 118.70 128.64 2kyi s GLU 45 Ca 0.08 0.23 0.08 0.00 0.36 0.00 0.00 54.97 55.73 2kyi s GLU 45 Cb -0.18 -4.19 0.03 0.00 0.26 0.00 0.00 34.13 30.05 2kyi s GLU 45 CO 0.11 -2.16 0.62 0.99 -0.54 0.00 0.00 175.26 174.28 2kyi s THR 46 N 6.51 2.75 -0.29 -1.70 2.01 -0.50 -0.06 115.64 124.36 2kyi s THR 46 Ca 0.49 -1.01 -0.31 0.00 0.31 0.00 0.00 61.69 61.17 2kyi s THR 46 Cb -0.10 -2.76 -0.08 0.00 0.01 0.00 0.00 72.50 69.57 2kyi s THR 46 CO 0.21 0.00 2.23 2.30 -0.69 0.00 0.00 174.62 178.66 2kyi n ILE 47 N -1.95 0.25 -0.40 1.82 -5.35 -0.59 -2.12 119.36 111.03 2kyi n ILE 47 Ca 0.10 -0.39 0.00 0.00 -0.27 0.00 0.00 62.75 62.19 2kyi n ILE 47 Cb 0.60 -2.18 0.00 0.00 -1.74 0.00 0.00 39.64 36.32 2kyi n ILE 47 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2kyi n GLN 48 N 8.55 0.00 -3.66 6.28 6.02 -1.26 -4.89 117.38 128.42 2kyi n GLN 48 Ca 0.35 0.00 -0.12 0.00 -0.01 0.00 0.00 57.00 57.23 2kyi n GLN 48 Cb 0.36 -3.14 -0.08 0.00 1.02 0.00 0.00 30.24 28.40 2kyi n GLN 48 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 2kyi s GLY 49 N -2.00 -0.51 -0.14 1.08 0.00 -0.90 -5.01 107.32 99.85 2kyi s GLY 49 Ca 0.00 1.94 -0.21 0.00 0.00 0.00 0.00 44.72 46.45 2kyi s GLY 49 CO 0.00 1.80 0.63 0.14 0.00 0.00 0.00 173.10 175.68 2kyi s VAL 50 N 0.81 5.05 -0.27 1.40 1.01 -1.26 -1.41 120.40 125.73 2kyi s VAL 50 Ca -0.04 1.25 -0.17 0.00 0.00 0.00 0.00 61.98 63.02 2kyi s VAL 50 Cb -0.05 -3.96 -0.03 0.00 0.00 0.00 0.00 36.38 32.34 2kyi s VAL 50 CO -0.06 0.19 0.48 -0.22 0.00 0.00 0.00 175.10 175.50 2kyi s LEU 51 N 1.31 4.08 -0.40 3.92 2.96 0.13 -4.24 118.68 126.42 2kyi s LEU 51 Ca 0.32 0.41 -0.14 0.00 -0.22 0.00 0.00 54.13 54.50 2kyi s LEU 51 Cb -0.16 -2.60 0.03 0.00 0.50 0.00 0.00 46.19 43.95 2kyi s LEU 51 CO 0.13 -0.29 0.27 -0.44 -1.32 0.00 0.00 176.35 174.71 2kyi s SER 52 N 1.59 5.97 -0.38 3.68 0.01 0.41 -0.87 113.70 124.11 2kyi s SER 52 Ca 0.20 -0.97 -0.13 0.00 1.31 0.00 0.00 55.95 56.36 2kyi s SER 52 Cb -0.16 -2.11 0.02 0.00 0.21 0.00 0.00 66.02 63.98 2kyi s SER 52 CO 0.10 -0.44 0.24 -0.63 0.41 0.00 0.00 173.24 172.92 2kyi s ILE 53 N 1.63 4.92 -0.08 1.44 1.01 0.13 -0.76 121.20 129.49 2kyi s ILE 53 Ca 0.04 -0.66 -0.00 0.00 0.00 0.00 0.00 60.65 60.02 2kyi s ILE 53 Cb -0.19 -3.70 -0.03 0.00 0.01 0.00 0.00 42.46 38.55 2kyi s ILE 53 CO 0.09 -0.21 -0.05 -0.75 0.00 0.00 0.00 174.94 174.01 2kyi s LYS 54 N 1.63 2.91 0.00 2.79 2.20 -0.67 -0.07 119.74 128.53 2kyi s LYS 54 Ca 0.04 -0.52 0.00 0.00 -0.36 0.00 0.00 55.97 55.12 2kyi s LYS 54 Cb -0.19 -2.66 0.00 0.00 -1.51 0.00 0.00 37.83 33.47 2kyi s LYS 54 CO 0.08 0.61 0.00 0.41 -0.36 0.00 0.00 175.35 176.09 2kyi n GLY 55 N 2.39 -0.84 3.29 5.54 0.00 0.85 0.34 105.19 116.77 2kyi n GLY 55 Ca -0.18 -0.05 -0.13 0.00 0.00 0.00 0.00 46.02 45.65 2kyi n GLY 55 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2kyi s GLU 56 N -0.60 0.49 -1.21 1.61 2.12 0.22 -4.29 118.70 117.05 2kyi s GLU 56 Ca 0.00 0.51 -0.01 0.00 0.36 0.00 0.00 54.97 55.82 2kyi s GLU 56 Cb 0.00 0.24 0.00 0.00 0.26 0.00 0.00 34.13 34.63 2kyi s GLU 56 CO 0.00 -0.07 0.14 1.63 -0.54 0.00 0.00 175.26 176.42 2kyi n LYS 57 N 2.73 -1.93 -1.75 4.30 4.01 -0.66 0.51 118.16 125.37 2kyi n LYS 57 Ca -0.14 0.69 -0.37 0.00 -0.51 0.00 0.00 58.31 57.98 2kyi n LYS 57 Cb 0.57 -5.01 -0.05 0.00 -0.51 0.00 0.00 35.03 30.03 2kyi n LYS 57 CO 0.00 0.00 0.00 1.28 -1.11 0.00 0.00 177.40 177.57 2kyi n LEU 58 N -2.38 4.03 -4.58 -0.35 4.32 0.22 -4.00 117.00 114.27 2kyi n LEU 58 Ca -0.14 -3.25 -0.26 0.00 -0.02 0.00 0.00 56.01 52.34 2kyi n LEU 58 Cb 0.62 -1.49 -0.11 0.00 -1.62 0.00 0.00 43.42 40.82 2kyi n LEU 58 CO 0.25 -0.76 -0.29 -0.83 -1.22 0.00 0.00 177.39 174.54 2kyi s GLY 59 N 5.33 2.40 0.00 -0.72 0.00 -0.73 -4.23 107.32 109.37 2kyi s GLY 59 Ca 0.60 -2.25 0.00 0.00 0.00 0.00 0.00 44.72 43.08 2kyi s GLY 59 CO 0.10 -2.03 0.00 4.51 0.00 0.00 0.00 173.10 175.68 2kyi n ILE 60 N -0.90 0.00 -3.65 0.90 3.06 -1.26 -2.05 119.36 115.46 2kyi n ILE 60 Ca -0.04 0.00 -0.00 0.00 -2.50 0.00 0.00 62.75 60.20 2kyi n ILE 60 Cb 0.67 0.00 -0.07 0.00 0.54 0.00 0.00 39.64 40.78 2kyi n ILE 60 CO 0.00 0.00 0.00 -0.75 -2.50 0.00 0.00 176.55 173.30 2kyi s LYS 61 N -0.42 0.04 -0.74 9.51 2.20 -1.26 -5.04 119.74 124.04 2kyi s LYS 61 Ca 0.00 0.06 -0.24 0.00 -0.36 0.00 0.00 55.97 55.43 2kyi s LYS 61 Cb 0.00 0.02 0.05 0.00 -1.51 0.00 0.00 37.83 36.39 2kyi s LYS 61 CO 0.00 -0.01 1.15 -1.58 -0.36 0.00 0.00 175.35 174.55 2kyi s HIS 62 N 0.51 2.51 0.00 4.03 5.65 -1.26 -4.60 115.29 122.13 2kyi s HIS 62 Ca 0.00 -0.40 0.00 0.00 0.25 0.00 0.00 55.06 54.91 2kyi s HIS 62 Cb -0.04 -4.47 0.00 0.00 -1.18 0.00 0.00 32.58 26.89 2kyi s HIS 62 CO -0.13 -1.85 0.00 -0.11 -0.65 0.00 0.00 174.74 172.00 2kyi n LEU 63 N 8.47 0.00 0.00 8.88 0.00 -1.26 -5.19 117.00 127.91 2kyi n LEU 63 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 56.01 56.05 2kyi n LEU 63 Cb 0.48 0.00 0.02 0.00 0.00 0.00 0.00 43.42 43.91 2kyi n LEU 63 CO 0.67 0.00 0.97 -0.67 0.00 0.00 0.00 177.39 178.36 2kyi n ASP 64 N -0.94 -1.40 -0.38 1.96 2.03 -1.26 -5.01 116.55 111.54 2kyi n ASP 64 Ca 0.00 -1.51 0.14 0.00 0.52 0.00 0.00 54.79 53.94 2kyi n ASP 64 Cb 0.00 2.22 0.58 0.00 -0.72 0.00 0.00 41.12 43.20 2kyi n ASP 64 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2kyi n LEU 65 N 0.00 1.19 0.00 -2.67 -0.00 -1.26 -4.96 117.00 109.30 2kyi n LEU 65 Ca 0.02 -0.42 0.00 0.00 -0.00 0.00 0.00 56.01 55.61 2kyi n LEU 65 Cb 0.57 -0.01 0.00 0.00 -0.00 0.00 0.00 43.42 43.98 2kyi n LEU 65 CO 0.17 0.21 0.00 1.17 -0.00 0.00 0.00 177.39 178.94 2kyi n LYS 66 N -0.06 0.00 -0.35 1.47 0.00 -1.26 -1.53 118.16 116.44 2kyi n LYS 66 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.50 2kyi n LYS 66 Cb 0.30 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.33 2kyi n LYS 66 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2kyi n ALA 67 N 2.63 1.69 0.00 3.14 0.00 -1.26 -4.95 120.51 121.76 2kyi n ALA 67 Ca 0.00 -0.80 0.00 0.00 0.00 0.00 0.00 53.44 52.64 2kyi n ALA 67 Cb 0.00 -0.33 0.00 0.00 0.00 0.00 0.00 19.45 19.12 2kyi n ALA 67 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2kyi n GLY 68 N 0.00 0.75 3.40 0.00 0.00 -0.58 -4.82 105.19 103.94 2kyi n GLY 68 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 2kyi n GLY 68 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2kyi s GLN 69 N -0.91 3.56 -0.01 1.61 -2.07 -1.19 -0.38 119.66 120.26 2kyi s GLN 69 Ca 0.00 -0.53 0.03 0.00 -1.82 0.00 0.00 55.36 53.04 2kyi s GLN 69 Cb 0.00 -3.17 -0.00 0.00 -1.09 0.00 0.00 33.01 28.75 2kyi s GLN 69 CO 0.00 -0.14 -0.10 0.54 -1.32 0.00 0.00 175.29 174.27 2kyi s VAL 70 N 1.42 0.82 -0.28 3.63 0.11 -0.33 -4.68 120.40 121.09 2kyi s VAL 70 Ca 0.05 -0.42 0.01 0.00 -2.93 0.00 0.00 61.98 58.69 2kyi s VAL 70 Cb -0.15 -0.70 0.08 0.00 -1.53 0.00 0.00 36.38 34.08 2kyi s VAL 70 CO 0.01 0.24 0.01 -0.70 -3.33 0.00 0.00 175.10 171.33 2kyi s GLU 71 N -0.09 1.38 -0.08 1.54 2.12 -1.26 -1.12 118.70 121.19 2kyi s GLU 71 Ca 0.02 -1.23 0.01 0.00 0.36 0.00 0.00 54.97 54.13 2kyi s GLU 71 Cb -0.06 -2.61 -0.03 0.00 0.26 0.00 0.00 34.13 31.70 2kyi s GLU 71 CO -0.00 -0.77 -0.10 0.08 -0.54 0.00 0.00 175.26 173.92 2kyi s VAL 72 N 1.32 3.38 0.07 3.70 1.01 0.20 -4.79 120.40 125.29 2kyi s VAL 72 Ca 0.02 -0.59 0.06 0.00 0.00 0.00 0.00 61.98 61.47 2kyi s VAL 72 Cb -0.19 -2.37 -0.04 0.00 0.00 0.00 0.00 36.38 33.79 2kyi s VAL 72 CO -0.11 0.58 -0.11 -1.83 0.00 0.00 0.00 175.10 173.63 2kyi s GLU 73 N -0.53 2.20 0.00 2.72 4.04 -0.87 0.21 118.70 126.47 2kyi s GLU 73 Ca 0.07 -0.96 0.00 0.00 0.04 0.00 0.00 54.97 54.12 2kyi s GLU 73 Cb -0.12 -2.32 0.00 0.00 0.02 0.00 0.00 34.13 31.71 2kyi s GLU 73 CO 0.02 0.53 0.00 0.41 -1.84 0.00 0.00 175.26 174.38 2kyi n GLY 74 N 1.01 0.08 3.38 -3.83 0.00 -0.63 -1.77 105.19 103.43 2kyi n GLY 74 Ca -0.14 -1.11 -0.46 0.00 0.00 0.00 0.00 46.02 44.31 2kyi n GLY 74 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2kyi s LEU 75 N 0.00 6.05 0.31 0.99 1.02 0.18 0.16 118.68 127.39 2kyi s LEU 75 Ca 0.00 -2.39 -0.29 0.00 0.02 0.00 0.00 54.13 51.47 2kyi s LEU 75 Cb 0.00 -2.29 -0.10 0.00 0.02 0.00 0.00 46.19 43.82 2kyi s LEU 75 CO 0.00 -0.78 1.23 0.27 0.02 0.00 0.00 176.35 177.08 2kyi s ILE 76 N 1.24 3.01 -0.24 -0.59 -4.36 -1.26 -0.61 121.20 118.39 2kyi s ILE 76 Ca 0.23 1.02 -0.02 0.00 -0.26 0.00 0.00 60.65 61.63 2kyi s ILE 76 Cb -0.09 -3.65 -0.18 0.00 1.25 0.00 0.00 42.46 39.79 2kyi s ILE 76 CO -0.08 0.24 -0.14 -0.67 0.24 0.00 0.00 174.94 174.53 2kyi n ASP 77 N 0.96 2.00 -3.52 4.36 2.03 0.15 -4.87 116.55 117.66 2kyi n ASP 77 Ca -0.00 -0.02 -0.12 0.00 0.52 0.00 0.00 54.79 55.17 2kyi n ASP 77 Cb 0.43 -0.54 -0.04 0.00 -0.72 0.00 0.00 41.12 40.24 2kyi n ASP 77 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2kyi s ALA 78 N -2.52 -1.82 -0.13 -1.67 0.00 -0.78 -4.97 121.76 109.87 2kyi s ALA 78 Ca -0.33 1.23 0.01 0.00 0.00 0.00 0.00 51.96 52.87 2kyi s ALA 78 Cb 0.09 -0.02 -0.01 0.00 0.00 0.00 0.00 23.12 23.18 2kyi s ALA 78 CO 0.61 -0.48 -0.16 -0.51 0.00 0.00 0.00 175.76 175.22 2kyi s LEU 79 N -1.67 2.48 -0.23 0.00 1.43 -1.26 -1.67 118.68 117.76 2kyi s LEU 79 Ca -0.03 -0.44 -0.00 0.00 -1.03 0.00 0.00 54.13 52.64 2kyi s LEU 79 Cb -0.01 -1.55 0.03 0.00 0.03 0.00 0.00 46.19 44.70 2kyi s LEU 79 CO -0.00 0.13 -0.11 -0.69 0.23 0.00 0.00 176.35 175.91 2kyi s VAL 80 N 0.52 2.53 -0.23 -1.59 1.01 0.06 -5.02 120.40 117.68 2kyi s VAL 80 Ca -0.11 -1.06 -0.00 0.00 0.00 0.00 0.00 61.98 60.81 2kyi s VAL 80 Cb -0.16 -2.24 0.06 0.00 0.00 0.00 0.00 36.38 34.04 2kyi s VAL 80 CO 0.04 0.29 -0.02 -0.47 0.00 0.00 0.00 175.10 174.94 2kyi s TYR 81 N 1.29 2.05 -0.24 5.22 6.14 -1.26 -0.45 117.35 130.10 2kyi s TYR 81 Ca 0.01 -1.55 -0.29 0.00 0.64 0.00 0.00 57.07 55.88 2kyi s TYR 81 Cb -0.16 -1.46 -0.06 0.00 0.42 0.00 0.00 41.96 40.70 2kyi s TYR 81 CO -0.07 -0.74 2.22 -2.30 0.64 0.00 0.00 175.55 175.30 2kyi n PRO 82 N 4.77 1.82 -2.62 4.97 -0.02 -1.26 -4.89 135.00 137.77 2kyi n PRO 82 Ca -0.11 0.49 -0.41 0.00 -2.02 0.00 0.00 63.50 61.45 2kyi n PRO 82 Cb 0.45 -3.12 -0.03 0.00 -0.02 0.00 0.00 33.50 30.78 2kyi n PRO 82 CO 0.00 0.00 0.00 -0.48 1.98 0.00 0.00 175.50 177.00 2kyi s LEU 83 N 8.19 3.68 -0.36 2.45 2.34 -1.26 -4.85 118.68 128.87 2kyi s LEU 83 Ca 1.02 -1.38 0.01 0.00 0.06 0.00 0.00 54.13 53.84 2kyi s LEU 83 Cb -0.42 -2.54 0.15 0.00 -0.56 0.00 0.00 46.19 42.82 2kyi s LEU 83 CO 0.37 -1.49 0.25 -0.70 -1.06 0.00 0.00 176.35 173.72 2kyi s GLU 84 N 4.75 0.61 -0.31 1.48 2.12 -1.26 -5.04 118.70 121.06 2kyi s GLU 84 Ca 0.42 -1.36 -0.03 0.00 0.36 0.00 0.00 54.97 54.36 2kyi s GLU 84 Cb -0.02 -1.22 0.11 0.00 0.26 0.00 0.00 34.13 33.26 2kyi s GLU 84 CO -0.06 -1.23 0.15 -1.01 -0.54 0.00 0.00 175.26 172.57 2kyi s HIS 85 N 0.99 0.46 -0.22 5.30 3.76 -1.26 -4.96 115.29 119.36 2kyi s HIS 85 Ca 0.20 -1.10 -0.02 0.00 -0.15 0.00 0.00 55.06 53.99 2kyi s HIS 85 Cb -0.18 -0.93 0.00 0.00 1.11 0.00 0.00 32.58 32.58 2kyi s HIS 85 CO -0.02 -0.83 0.07 1.58 -0.85 0.00 0.00 174.74 174.69 2kyi n HIS 86 N 4.93 -2.60 -2.80 1.40 -0.00 -1.26 -4.96 115.22 109.92 2kyi n HIS 86 Ca -0.01 1.14 -0.42 0.00 -0.00 0.00 0.00 57.72 58.42 2kyi n HIS 86 Cb 0.41 -3.18 -0.03 0.00 -0.00 0.00 0.00 29.99 27.18 2kyi n HIS 86 CO 0.00 0.00 0.00 -1.01 -0.00 0.00 0.00 176.34 175.33 2kyi s HIS 87 N -1.25 3.21 0.00 1.57 3.76 -1.26 -4.42 115.29 116.90 2kyi s HIS 87 Ca 0.03 1.06 0.00 0.00 -0.15 0.00 0.00 55.06 56.00 2kyi s HIS 87 Cb -0.01 -3.37 0.00 0.00 1.11 0.00 0.00 32.58 30.32 2kyi s HIS 87 CO 0.52 -0.60 0.00 1.58 -0.85 0.00 0.00 174.74 175.38 2kyi n HIS 88 N 6.42 0.00 -0.92 1.40 -0.00 -1.26 -4.96 115.22 115.90 2kyi n HIS 88 Ca 0.08 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.26 2kyi n HIS 88 Cb 0.47 0.00 0.00 0.00 -0.12 0.00 0.00 29.99 30.34 2kyi n HIS 88 CO 0.00 0.00 0.00 0.72 0.46 0.00 0.00 176.34 177.52 2kyi n HIS 89 N 0.00 0.00 -1.85 1.57 8.25 -1.26 -5.30 115.22 116.63 2kyi n HIS 89 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 2kyi n HIS 89 Cb 0.00 -1.03 0.00 0.00 1.12 0.00 0.00 29.99 30.08 2kyi n HIS 89 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70