#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kz4 s ASN 2 N 0.00 5.91 0.16 7.83 -0.87 -1.26 -4.86 114.94 121.85 2kz4 s ASN 2 Ca 0.00 1.24 0.25 0.00 -1.57 0.00 0.00 52.86 52.78 2kz4 s ASN 2 Cb 0.00 -2.53 0.47 0.00 -0.02 0.00 0.00 41.25 39.17 2kz4 s ASN 2 CO 0.00 -1.70 1.45 0.16 -2.57 0.00 0.00 177.10 174.44 2kz4 h ILE 3 N 6.78 0.00 -0.98 0.60 -2.65 -2.03 -3.34 117.51 115.88 2kz4 h ILE 3 Ca -0.33 -0.52 -0.63 0.00 1.03 0.00 0.00 64.86 64.42 2kz4 h ILE 3 Cb 1.16 1.23 -0.29 0.00 -2.05 0.00 0.00 36.82 36.87 2kz4 h ILE 3 CO 1.04 0.00 0.81 0.61 0.03 0.00 0.00 178.15 180.64 2kz4 n GLY 4 N 1.32 5.48 0.16 0.16 0.00 -1.26 -4.37 105.19 106.68 2kz4 n GLY 4 Ca 0.04 -1.98 0.13 0.00 0.00 0.00 0.00 46.02 44.21 2kz4 n GLY 4 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2kz4 h ARG 5 N 1.74 0.00 -5.20 1.61 3.08 -1.99 -3.44 114.38 110.18 2kz4 h ARG 5 Ca 0.61 0.00 -0.66 0.00 0.07 0.00 0.00 59.98 59.99 2kz4 h ARG 5 Cb 1.30 0.00 -0.16 0.00 0.08 0.00 0.00 29.97 31.19 2kz4 h ARG 5 CO 1.45 0.00 0.24 -0.51 -1.07 0.00 0.00 179.97 180.08 2kz4 s LEU 6 N -5.11 4.75 -0.01 3.04 2.01 -1.26 -4.76 118.68 117.33 2kz4 s LEU 6 Ca 0.07 -0.85 -0.12 0.00 0.01 0.00 0.00 54.13 53.24 2kz4 s LEU 6 Cb 0.10 -2.52 -0.32 0.00 0.01 0.00 0.00 46.19 43.45 2kz4 s LEU 6 CO 0.56 -1.06 0.81 0.08 1.01 0.00 0.00 176.35 177.75 2kz4 h ARG 7 N 9.16 0.44 0.00 1.70 0.11 -1.59 -3.44 114.38 120.75 2kz4 h ARG 7 Ca -0.28 -0.75 -0.08 0.00 0.10 0.00 0.00 59.98 58.97 2kz4 h ARG 7 Cb 1.09 0.28 -0.01 0.00 1.11 0.00 0.00 29.97 32.44 2kz4 h ARG 7 CO 1.04 1.35 -0.04 -3.47 0.10 0.00 0.00 179.97 178.95 2kz4 n ASP 8 N -3.63 1.21 -3.87 0.08 2.03 0.68 -4.97 116.55 108.08 2kz4 n ASP 8 Ca -0.21 -1.26 -0.11 0.00 0.52 0.00 0.00 54.79 53.73 2kz4 n ASP 8 Cb 1.09 -0.01 -0.11 0.00 -0.72 0.00 0.00 41.12 41.37 2kz4 n ASP 8 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 2kz4 s ARG 9 N -2.31 0.38 0.09 -0.67 0.52 -1.26 -1.40 118.95 114.30 2kz4 s ARG 9 Ca 0.04 -0.27 0.04 0.00 -0.52 0.00 0.00 55.73 55.02 2kz4 s ARG 9 Cb -0.00 0.16 -0.03 0.00 0.52 0.00 0.00 34.95 35.59 2kz4 s ARG 9 CO 0.03 -0.08 -0.10 0.96 0.02 0.00 0.00 175.30 176.12 2kz4 s ILE 10 N -1.02 0.93 -0.19 1.52 -0.00 -0.54 -1.61 121.20 120.29 2kz4 s ILE 10 Ca -0.11 -1.59 -0.05 0.00 -0.00 0.00 0.00 60.65 58.90 2kz4 s ILE 10 Cb -0.06 -1.30 -0.02 0.00 -0.00 0.00 0.00 42.46 41.07 2kz4 s ILE 10 CO 0.01 -0.53 -0.00 -0.89 -0.00 0.00 0.00 174.94 173.53 2kz4 s THR 11 N -2.31 3.95 -0.11 8.37 2.01 -0.02 -1.22 115.64 126.31 2kz4 s THR 11 Ca 0.04 -0.32 -0.27 0.00 0.31 0.00 0.00 61.69 61.45 2kz4 s THR 11 Cb -0.04 -2.78 -0.02 0.00 0.01 0.00 0.00 72.50 69.68 2kz4 s THR 11 CO 0.00 0.44 0.90 -0.63 -0.69 0.00 0.00 174.62 174.64 2kz4 s ILE 12 N 0.91 4.87 -0.65 1.82 -1.09 -0.97 -1.70 121.20 124.38 2kz4 s ILE 12 Ca 0.01 1.81 -0.23 0.00 -2.23 0.00 0.00 60.65 60.01 2kz4 s ILE 12 Cb -0.14 -4.21 0.07 0.00 -1.58 0.00 0.00 42.46 36.59 2kz4 s ILE 12 CO 0.02 0.06 0.96 -1.10 -1.23 0.00 0.00 174.94 173.65 2kz4 s GLN 13 N 1.78 3.12 0.25 2.79 1.11 0.02 -0.15 119.66 128.58 2kz4 s GLN 13 Ca 0.44 -0.81 -0.23 0.00 0.01 0.00 0.00 55.36 54.77 2kz4 s GLN 13 Cb -0.18 -4.22 -0.09 0.00 -1.01 0.00 0.00 33.01 27.51 2kz4 s GLN 13 CO 0.17 -1.80 0.80 0.95 0.01 0.00 0.00 175.29 175.42 2kz4 s THR 14 N 4.05 4.42 -0.49 -0.19 -4.23 -0.33 -1.74 115.64 117.14 2kz4 s THR 14 Ca 0.22 1.52 -0.21 0.00 -1.18 0.00 0.00 61.69 62.04 2kz4 s THR 14 Cb -0.17 -3.95 0.04 0.00 1.34 0.00 0.00 72.50 69.76 2kz4 s THR 14 CO 0.11 0.23 0.73 -0.22 -0.54 0.00 0.00 174.62 174.93 2kz4 s LEU 15 N -1.88 4.50 -0.79 4.79 2.96 -1.26 -0.62 118.68 126.38 2kz4 s LEU 15 Ca 0.44 -0.47 -0.24 0.00 -0.22 0.00 0.00 54.13 53.64 2kz4 s LEU 15 Cb -0.18 -2.71 0.06 0.00 0.50 0.00 0.00 46.19 43.86 2kz4 s LEU 15 CO 0.23 -0.94 1.20 -0.75 -1.32 0.00 0.00 176.35 174.76 2kz4 s LYS 16 N 3.10 3.28 -0.94 1.98 2.20 0.12 -4.94 119.74 124.54 2kz4 s LYS 16 Ca 0.23 -0.75 -0.24 0.00 -0.36 0.00 0.00 55.97 54.85 2kz4 s LYS 16 Cb -0.15 -4.49 0.00 0.00 -1.51 0.00 0.00 37.83 31.68 2kz4 s LYS 16 CO 0.18 -2.02 1.67 -0.65 -0.36 0.00 0.00 175.35 174.17 2kz4 s GLN 17 N 4.75 3.09 0.45 4.03 -0.21 -1.26 -1.56 119.66 128.95 2kz4 s GLN 17 Ca 0.33 -0.67 -0.03 0.00 0.02 0.00 0.00 55.36 55.01 2kz4 s GLN 17 Cb -0.09 -5.15 -0.03 0.00 1.00 0.00 0.00 33.01 28.74 2kz4 s GLN 17 CO 0.06 -2.73 0.72 0.99 -2.12 0.00 0.00 175.29 172.21 2kz4 s THR 18 N 7.35 4.70 0.15 -0.19 2.01 -0.25 -4.91 115.64 124.50 2kz4 s THR 18 Ca 0.57 -0.10 0.08 0.00 0.31 0.00 0.00 61.69 62.55 2kz4 s THR 18 Cb -0.04 -3.77 -0.04 0.00 0.01 0.00 0.00 72.50 68.67 2kz4 s THR 18 CO -0.04 -0.66 -0.18 -0.60 -0.69 0.00 0.00 174.62 172.46 2kz4 s ARG 19 N -4.63 1.20 0.25 4.92 3.52 -1.26 -0.84 118.95 122.12 2kz4 s ARG 19 Ca 0.46 -1.35 0.07 0.00 -0.13 0.00 0.00 55.73 54.78 2kz4 s ARG 19 Cb -0.10 -1.24 -0.03 0.00 -1.56 0.00 0.00 34.95 32.01 2kz4 s ARG 19 CO 0.42 0.25 0.23 0.34 -0.81 0.00 0.00 175.30 175.73 2kz4 s ASP 20 N -2.54 5.68 0.09 -2.12 -1.08 0.41 -4.92 116.67 112.19 2kz4 s ASP 20 Ca 0.13 -0.19 0.09 0.00 -0.52 0.00 0.00 52.55 52.06 2kz4 s ASP 20 Cb -0.06 -1.49 0.43 0.00 -1.46 0.00 0.00 42.92 40.33 2kz4 s ASP 20 CO 0.06 -0.05 1.27 0.00 0.52 0.00 0.00 175.17 176.97 2kz4 n ILE 21 N -1.23 1.55 0.56 4.11 3.06 -1.26 -0.79 119.36 125.36 2kz4 n ILE 21 Ca -0.08 0.49 0.07 0.00 -2.50 0.00 0.00 62.75 60.73 2kz4 n ILE 21 Cb 0.58 -1.45 0.05 0.00 0.54 0.00 0.00 39.64 39.36 2kz4 n ILE 21 CO 0.00 0.00 0.00 0.35 -2.50 0.00 0.00 176.55 174.40 2kz4 n THR 22 N -1.72 0.00 -0.35 9.51 -2.24 -1.26 -4.99 114.28 113.23 2kz4 n THR 22 Ca 0.00 -0.49 0.00 0.00 -2.27 0.00 0.00 64.05 61.30 2kz4 n THR 22 Cb 0.05 1.27 0.00 0.00 -2.10 0.00 0.00 70.33 69.55 2kz4 n THR 22 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2kz4 n GLY 23 N 0.79 1.58 3.78 3.38 0.00 0.03 -5.09 105.19 109.65 2kz4 n GLY 23 Ca 0.08 -0.17 -0.38 0.00 0.00 0.00 0.00 46.02 45.54 2kz4 n GLY 23 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2kz4 s GLU 24 N -1.40 4.15 -0.29 1.61 0.41 -1.25 -4.78 118.70 117.14 2kz4 s GLU 24 Ca 0.00 0.41 -0.19 0.00 -0.41 0.00 0.00 54.97 54.78 2kz4 s GLU 24 Cb 0.00 -3.33 -0.01 0.00 -1.78 0.00 0.00 34.13 29.00 2kz4 s GLU 24 CO 0.00 0.42 0.59 0.42 -0.49 0.00 0.00 175.26 176.20 2kz4 s ILE 25 N -0.21 4.98 -0.39 -1.63 -1.09 -1.26 -0.44 121.20 121.16 2kz4 s ILE 25 Ca 0.24 0.85 -0.09 0.00 -2.23 0.00 0.00 60.65 59.42 2kz4 s ILE 25 Cb -0.16 -3.94 0.06 0.00 -1.58 0.00 0.00 42.46 36.84 2kz4 s ILE 25 CO 0.11 -0.07 0.21 -0.76 -1.23 0.00 0.00 174.94 173.21 2kz4 s LEU 26 N 2.50 4.89 -0.34 2.97 2.01 -0.02 -4.96 118.68 125.73 2kz4 s LEU 26 Ca 0.24 -1.35 -0.29 0.00 0.01 0.00 0.00 54.13 52.74 2kz4 s LEU 26 Cb -0.15 -1.96 0.01 0.00 0.01 0.00 0.00 46.19 44.10 2kz4 s LEU 26 CO 0.11 -0.46 1.15 -1.61 1.01 0.00 0.00 176.35 176.55 2kz4 s GLU 27 N 1.43 3.96 0.10 1.70 8.01 -1.26 -1.09 118.70 131.55 2kz4 s GLU 27 Ca 0.02 1.04 0.05 0.00 0.01 0.00 0.00 54.97 56.09 2kz4 s GLU 27 Cb -0.21 -3.81 -0.03 0.00 -4.31 0.00 0.00 34.13 25.76 2kz4 s GLU 27 CO 0.03 -1.05 -0.14 0.95 0.01 0.00 0.00 175.26 175.06 2kz4 s THR 28 N 4.00 1.20 -0.43 3.63 -4.23 -0.60 -5.00 115.64 114.21 2kz4 s THR 28 Ca 0.49 -1.52 -0.09 0.00 -1.18 0.00 0.00 61.69 59.39 2kz4 s THR 28 Cb -0.13 -1.31 0.09 0.00 1.34 0.00 0.00 72.50 72.49 2kz4 s THR 28 CO 0.20 -0.33 0.28 0.26 -0.54 0.00 0.00 174.62 174.49 2kz4 s TRP 29 N -1.75 3.36 -0.10 3.99 0.52 -1.26 0.14 118.94 123.83 2kz4 s TRP 29 Ca 0.04 -1.59 -0.23 0.00 0.02 0.00 0.00 56.10 54.34 2kz4 s TRP 29 Cb -0.07 -3.07 -0.03 0.00 -1.15 0.00 0.00 33.47 29.14 2kz4 s TRP 29 CO 0.02 -0.88 0.68 -1.83 0.02 0.00 0.00 176.95 174.96 2kz4 s GLU 30 N 1.42 4.39 0.46 4.98 -1.05 0.20 -4.91 118.70 124.20 2kz4 s GLU 30 Ca 0.04 0.81 -0.23 0.00 -0.15 0.00 0.00 54.97 55.43 2kz4 s GLU 30 Cb -0.24 -3.47 -0.07 0.00 -0.44 0.00 0.00 34.13 29.91 2kz4 s GLU 30 CO 0.02 0.01 1.23 0.16 0.95 0.00 0.00 175.26 177.63 2kz4 s ASP 31 N 0.85 6.02 0.00 0.83 -4.77 -1.26 -1.19 116.67 117.15 2kz4 s ASP 31 Ca 0.35 2.47 0.00 0.00 -3.30 0.00 0.00 52.55 52.07 2kz4 s ASP 31 Cb -0.17 -2.62 0.00 0.00 -1.09 0.00 0.00 42.92 39.04 2kz4 s ASP 31 CO 0.16 -1.03 0.00 0.61 0.70 0.00 0.00 175.17 175.61 2kz4 n GLY 32 N 0.56 1.04 3.40 2.12 0.00 0.79 -4.85 105.19 108.26 2kz4 n GLY 32 Ca 0.07 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.77 2kz4 n GLY 32 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2kz4 s HIS 33 N 1.69 2.70 -0.72 1.61 3.76 -1.26 -4.88 115.29 118.19 2kz4 s HIS 33 Ca 0.00 -0.45 -0.18 0.00 -0.15 0.00 0.00 55.06 54.28 2kz4 s HIS 33 Cb 0.00 -1.71 0.13 0.00 1.11 0.00 0.00 32.58 32.11 2kz4 s HIS 33 CO 0.00 -0.04 0.83 0.99 -0.85 0.00 0.00 174.74 175.66 2kz4 s THR 34 N -0.21 4.93 0.41 1.30 2.01 -1.26 -2.30 115.64 120.52 2kz4 s THR 34 Ca -0.00 -1.39 0.08 0.00 0.31 0.00 0.00 61.69 60.69 2kz4 s THR 34 Cb -0.13 -4.56 -0.04 0.00 0.01 0.00 0.00 72.50 67.77 2kz4 s THR 34 CO 0.03 -1.21 0.24 -1.48 -0.69 0.00 0.00 174.62 171.51 2kz4 s LEU 35 N 2.26 3.22 0.10 4.42 2.34 -0.36 -4.87 118.68 125.80 2kz4 s LEU 35 Ca 0.18 -0.94 -0.31 0.00 0.06 0.00 0.00 54.13 53.12 2kz4 s LEU 35 Cb -0.17 -1.67 -0.07 0.00 -0.56 0.00 0.00 46.19 43.72 2kz4 s LEU 35 CO -0.00 -0.55 1.31 0.26 -1.06 0.00 0.00 176.35 176.30 2kz4 s TRP 36 N -2.54 3.32 0.33 3.48 0.23 -1.26 -1.47 118.94 121.02 2kz4 s TRP 36 Ca 0.43 1.11 0.05 0.00 -2.03 0.00 0.00 56.10 55.66 2kz4 s TRP 36 Cb 0.01 -3.57 -0.03 0.00 0.03 0.00 0.00 33.47 29.90 2kz4 s TRP 36 CO 0.24 -1.91 0.20 0.00 0.96 0.00 0.00 176.95 176.44 2kz4 s ALA 37 N 1.00 2.03 -0.33 0.98 0.00 -0.49 -4.34 121.76 120.61 2kz4 s ALA 37 Ca 0.62 -1.78 -0.00 0.00 0.00 0.00 0.00 51.96 50.79 2kz4 s ALA 37 Cb -0.34 1.24 0.10 0.00 0.00 0.00 0.00 23.12 24.12 2kz4 s ALA 37 CO 0.30 -0.55 0.11 -1.12 0.00 0.00 0.00 175.76 174.50 2kz4 s SER 38 N -3.40 4.07 -0.58 0.00 0.01 0.49 -0.23 113.70 114.06 2kz4 s SER 38 Ca 0.36 -1.79 -0.21 0.00 1.31 0.00 0.00 55.95 55.62 2kz4 s SER 38 Cb 0.04 -0.96 0.07 0.00 0.21 0.00 0.00 66.02 65.38 2kz4 s SER 38 CO 0.21 -0.40 0.78 -0.69 0.41 0.00 0.00 173.24 173.55 2kz4 s VAL 39 N 1.42 4.65 -0.33 3.43 1.01 -1.26 -1.69 120.40 127.62 2kz4 s VAL 39 Ca 0.11 -0.48 -0.01 0.00 0.00 0.00 0.00 61.98 61.59 2kz4 s VAL 39 Cb -0.18 -4.49 0.07 0.00 0.00 0.00 0.00 36.38 31.78 2kz4 s VAL 39 CO -0.21 -1.11 0.05 0.20 0.00 0.00 0.00 175.10 174.03 2kz4 s ASN 40 N 3.23 4.95 -0.02 3.32 0.01 0.18 -4.92 114.94 121.68 2kz4 s ASN 40 Ca 0.18 -1.56 -0.30 0.00 -0.71 0.00 0.00 52.86 50.47 2kz4 s ASN 40 Cb -0.19 -1.72 -0.08 0.00 0.41 0.00 0.00 41.25 39.67 2kz4 s ASN 40 CO 0.11 -0.34 2.02 -0.04 -1.51 0.00 0.00 177.10 177.34 2kz4 s MET 41 N 1.18 3.93 0.66 -0.60 -1.94 -1.26 -1.92 119.30 119.35 2kz4 s MET 41 Ca -0.00 2.49 -0.15 0.00 -1.71 0.00 0.00 55.69 56.32 2kz4 s MET 41 Cb -0.20 -4.21 -0.00 0.00 2.01 0.00 0.00 34.83 32.43 2kz4 s MET 41 CO -0.03 -1.20 1.10 0.14 -0.01 0.00 0.00 175.02 175.02 2kz4 s VAL 42 N 5.27 3.36 0.84 -6.03 -7.23 -0.61 -4.96 120.40 111.05 2kz4 s VAL 42 Ca 0.91 0.61 -0.09 0.00 -1.81 0.00 0.00 61.98 61.60 2kz4 s VAL 42 Cb -0.41 -3.14 0.16 0.00 0.56 0.00 0.00 36.38 33.55 2kz4 s VAL 42 CO 0.40 -0.42 1.16 -0.55 -0.31 0.00 0.00 175.10 175.39 2kz4 s SER 43 N -2.73 3.79 0.54 4.85 0.15 -1.26 -4.02 113.70 115.02 2kz4 s SER 43 Ca 0.66 0.05 0.21 0.00 0.70 0.00 0.00 55.95 57.56 2kz4 s SER 43 Cb -0.19 -0.29 1.43 0.00 -1.71 0.00 0.00 66.02 65.26 2kz4 s SER 43 CO 0.43 -2.26 2.14 0.28 1.20 0.00 0.00 173.24 175.02 2kz4 h SER 44 N -1.09 0.00 -0.87 5.45 0.02 -1.97 -3.10 113.55 111.99 2kz4 h SER 44 Ca -0.41 0.00 0.20 0.00 -0.84 0.00 0.00 61.79 60.73 2kz4 h SER 44 Cb 1.26 0.00 -0.11 0.00 0.14 0.00 0.00 62.40 63.68 2kz4 h SER 44 CO 0.42 0.00 0.40 0.07 -1.14 0.00 0.00 176.83 176.57 2kz4 h LYS 45 N 0.00 0.45 -0.58 3.45 2.10 -1.98 -1.34 116.57 118.67 2kz4 h LYS 45 Ca 0.05 -0.03 -0.08 0.00 -2.00 0.00 0.00 60.65 58.60 2kz4 h LYS 45 Cb 0.23 -0.10 -0.02 0.00 -0.90 0.00 0.00 32.23 31.43 2kz4 h LYS 45 CO -0.00 0.30 0.07 0.93 -2.00 0.00 0.00 179.45 178.74 2kz4 h GLU 46 N 0.46 0.99 -0.24 0.07 4.39 -1.91 -1.24 114.58 117.09 2kz4 h GLU 46 Ca 0.52 -0.28 -0.06 0.00 0.34 0.00 0.00 59.36 59.88 2kz4 h GLU 46 Cb 0.92 -0.11 -0.01 0.00 -0.10 0.00 0.00 28.75 29.46 2kz4 h GLU 46 CO -0.48 0.95 -0.10 0.00 -1.16 0.00 0.00 179.01 178.22 2kz4 h ALA 47 N 1.00 0.33 -0.65 3.43 0.00 -1.54 -2.60 119.26 119.23 2kz4 h ALA 47 Ca 0.17 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.79 2kz4 h ALA 47 Cb 0.46 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.14 2kz4 h ALA 47 CO 0.02 0.17 0.41 0.82 0.00 0.00 0.00 179.25 180.67 2kz4 h ILE 48 N 0.21 1.18 -0.15 0.00 2.04 -1.14 0.09 117.51 119.74 2kz4 h ILE 48 Ca 0.05 -0.37 -0.12 0.00 1.00 0.00 0.00 64.86 65.42 2kz4 h ILE 48 Cb 0.59 0.25 -0.01 0.00 -0.74 0.00 0.00 36.82 36.92 2kz4 h ILE 48 CO 0.03 0.18 -0.45 0.28 0.00 0.00 0.00 178.15 178.20 2kz4 h SER 49 N 0.89 0.38 0.88 1.72 0.02 -1.23 -2.97 113.55 113.24 2kz4 h SER 49 Ca 0.24 -0.18 -0.23 0.00 -0.84 0.00 0.00 61.79 60.78 2kz4 h SER 49 Cb -0.06 -0.11 -0.03 0.00 0.14 0.00 0.00 62.40 62.34 2kz4 h SER 49 CO -0.05 0.78 -1.16 0.77 -1.14 0.00 0.00 176.83 176.04 2kz4 h SER 50 N 0.29 0.02 0.00 3.07 4.64 -1.35 -3.49 113.55 116.74 2kz4 h SER 50 Ca 0.02 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2kz4 h SER 50 Cb 0.91 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 62.99 2kz4 h SER 50 CO 0.08 1.02 0.00 0.61 -0.87 0.00 0.00 176.83 177.66 2kz4 n GLY 51 N 1.40 2.30 0.25 -0.77 0.00 0.01 -4.34 105.19 104.04 2kz4 n GLY 51 Ca -0.04 -0.70 0.00 0.00 0.00 0.00 0.00 46.02 45.29 2kz4 n GLY 51 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2kz4 n ALA 52 N 0.00 1.50 -0.08 4.61 0.00 -1.25 -4.72 120.51 120.57 2kz4 n ALA 52 Ca 0.00 -0.04 -0.13 0.00 0.00 0.00 0.00 53.44 53.27 2kz4 n ALA 52 Cb 0.00 -0.01 -0.08 0.00 0.00 0.00 0.00 19.45 19.36 2kz4 n ALA 52 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 2kz4 h GLU 53 N 0.00 0.00 -7.12 0.00 4.81 -1.83 -3.46 114.58 106.99 2kz4 h GLU 53 Ca 0.00 0.00 -0.50 0.00 -0.13 0.00 0.00 59.36 58.73 2kz4 h GLU 53 Cb 1.01 0.00 0.05 0.00 0.63 0.00 0.00 28.75 30.44 2kz4 h GLU 53 CO 0.00 0.62 0.23 -0.51 -0.73 0.00 0.00 179.01 178.62 2kz4 s LEU 54 N -8.13 3.42 0.16 1.64 1.43 -1.26 -5.12 118.68 110.82 2kz4 s LEU 54 Ca -0.19 1.07 0.09 0.00 -1.03 0.00 0.00 54.13 54.06 2kz4 s LEU 54 Cb 0.02 -4.03 -0.04 0.00 0.03 0.00 0.00 46.19 42.17 2kz4 s LEU 54 CO 0.44 -0.77 -0.19 0.00 0.23 0.00 0.00 176.35 176.07 2kz4 s ALA 55 N -2.94 2.01 -0.42 4.21 0.00 -1.26 -4.50 121.76 118.86 2kz4 s ALA 55 Ca 0.51 -1.48 -0.28 0.00 0.00 0.00 0.00 51.96 50.71 2kz4 s ALA 55 Cb -0.11 -0.19 -0.00 0.00 0.00 0.00 0.00 23.12 22.82 2kz4 s ALA 55 CO 0.48 0.25 1.61 0.42 0.00 0.00 0.00 175.76 178.52 2kz4 s ILE 56 N -1.98 3.66 0.00 0.00 1.01 -1.26 -1.96 121.20 120.67 2kz4 s ILE 56 Ca 0.15 0.64 0.00 0.00 0.00 0.00 0.00 60.65 61.44 2kz4 s ILE 56 Cb -0.06 -3.98 0.00 0.00 0.01 0.00 0.00 42.46 38.43 2kz4 s ILE 56 CO 0.07 -0.69 0.00 0.61 0.00 0.00 0.00 174.94 174.93 2kz4 n GLY 57 N 5.30 1.29 3.67 6.18 0.00 -1.26 -5.06 105.19 115.31 2kz4 n GLY 57 Ca 0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.79 2kz4 n GLY 57 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2kz4 s THR 58 N -2.00 3.24 -0.55 2.61 2.01 -0.83 -4.47 115.64 115.65 2kz4 s THR 58 Ca 0.00 0.48 -0.24 0.00 0.31 0.00 0.00 61.69 62.24 2kz4 s THR 58 Cb 0.00 -3.31 0.04 0.00 0.01 0.00 0.00 72.50 69.24 2kz4 s THR 58 CO 0.00 -0.02 0.92 -0.69 -0.69 0.00 0.00 174.62 174.13 2kz4 s VAL 59 N 3.52 4.42 -0.06 3.82 1.01 0.98 -1.57 120.40 132.52 2kz4 s VAL 59 Ca 0.76 0.21 -0.19 0.00 0.00 0.00 0.00 61.98 62.76 2kz4 s VAL 59 Cb -0.38 -4.53 -0.05 0.00 0.00 0.00 0.00 36.38 31.43 2kz4 s VAL 59 CO 0.33 -1.10 0.52 -0.60 0.00 0.00 0.00 175.10 174.25 2kz4 s ARG 60 N 3.85 4.27 -0.10 2.72 3.52 -0.81 -0.49 118.95 131.92 2kz4 s ARG 60 Ca 0.29 0.57 -0.02 0.00 -0.13 0.00 0.00 55.73 56.44 2kz4 s ARG 60 Cb -0.13 -3.37 0.04 0.00 -1.56 0.00 0.00 34.95 29.93 2kz4 s ARG 60 CO 0.18 0.31 0.02 0.42 -0.81 0.00 0.00 175.30 175.42 2kz4 s ILE 61 N 0.07 0.36 -0.28 4.11 1.01 -0.17 -0.65 121.20 125.65 2kz4 s ILE 61 Ca 0.28 -0.01 -0.10 0.00 0.00 0.00 0.00 60.65 60.82 2kz4 s ILE 61 Cb -0.17 -0.62 -0.03 0.00 0.01 0.00 0.00 42.46 41.65 2kz4 s ILE 61 CO 0.14 0.13 0.15 0.26 0.00 0.00 0.00 174.94 175.62 2kz4 s TRP 62 N 1.97 3.17 0.18 3.97 0.52 -0.68 -0.74 118.94 127.32 2kz4 s TRP 62 Ca 0.04 -0.18 0.09 0.00 0.02 0.00 0.00 56.10 56.06 2kz4 s TRP 62 Cb -0.13 -2.33 -0.04 0.00 -1.15 0.00 0.00 33.47 29.81 2kz4 s TRP 62 CO -0.06 -0.28 -0.19 0.96 0.02 0.00 0.00 176.95 177.40 2kz4 s ILE 63 N 1.69 1.92 1.02 2.03 -4.36 -0.93 -0.38 121.20 122.19 2kz4 s ILE 63 Ca 0.06 -1.99 -0.12 0.00 -0.26 0.00 0.00 60.65 58.35 2kz4 s ILE 63 Cb -0.16 -1.92 0.19 0.00 1.25 0.00 0.00 42.46 41.82 2kz4 s ILE 63 CO 0.08 -0.32 1.01 0.54 0.24 0.00 0.00 174.94 176.49 2kz4 n ARG 64 N 0.18 -1.24 -1.54 0.37 1.74 -1.26 -0.45 116.66 114.46 2kz4 n ARG 64 Ca -0.12 -0.31 -0.38 0.00 -0.77 0.00 0.00 57.85 56.27 2kz4 n ARG 64 Cb 0.57 -2.24 -0.05 0.00 -1.02 0.00 0.00 32.46 29.72 2kz4 n ARG 64 CO 0.00 0.00 0.00 0.98 -1.52 0.00 0.00 177.63 177.09 2kz4 n TYR 65 N -4.50 1.28 -4.02 -1.55 9.36 -1.17 -4.21 117.16 112.36 2kz4 n TYR 65 Ca 0.08 0.17 -0.32 0.00 3.32 0.00 0.00 57.90 61.14 2kz4 n TYR 65 Cb 0.53 -2.59 -0.15 0.00 -0.63 0.00 0.00 39.34 36.51 2kz4 n TYR 65 CO 0.00 0.00 0.00 0.50 0.22 0.00 0.00 176.86 177.58 2kz4 s ARG 66 N 8.33 2.01 0.49 2.98 6.06 -1.26 -5.00 118.95 132.56 2kz4 s ARG 66 Ca 1.06 -1.53 0.26 0.00 -2.50 0.00 0.00 55.73 53.02 2kz4 s ARG 66 Cb -0.41 -3.07 1.22 0.00 0.06 0.00 0.00 34.95 32.76 2kz4 s ARG 66 CO 0.31 -0.72 1.96 0.87 -2.50 0.00 0.00 175.30 175.22 2kz4 h LYS 67 N 7.76 0.00 0.00 5.12 1.57 -2.03 -3.18 116.57 125.81 2kz4 h LYS 67 Ca -0.14 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.64 2kz4 h LYS 67 Cb 1.04 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.35 2kz4 h LYS 67 CO 0.50 0.16 -1.14 -0.40 -0.57 0.00 0.00 179.45 178.00 2kz4 n ASP 68 N -3.49 0.66 -4.73 0.86 5.68 -1.26 -4.88 116.55 109.39 2kz4 n ASP 68 Ca -0.01 0.16 -0.42 0.00 -0.50 0.00 0.00 54.79 54.03 2kz4 n ASP 68 Cb 0.33 0.74 -0.03 0.00 -1.14 0.00 0.00 41.12 41.02 2kz4 n ASP 68 CO 0.00 0.00 0.00 -0.63 -1.33 0.00 0.00 177.20 175.24 2kz4 s ILE 69 N -3.35 2.95 0.30 2.12 -1.09 -1.21 -4.98 121.20 115.95 2kz4 s ILE 69 Ca -0.00 0.74 -0.13 0.00 -2.23 0.00 0.00 60.65 59.03 2kz4 s ILE 69 Cb 0.11 -3.47 0.01 0.00 -1.58 0.00 0.00 42.46 37.53 2kz4 s ILE 69 CO 0.81 0.09 0.59 0.21 -1.23 0.00 0.00 174.94 175.40 2kz4 s ASN 70 N 0.69 0.11 0.58 3.58 3.84 -1.26 -4.80 114.94 117.69 2kz4 s ASN 70 Ca 0.62 -1.04 0.28 0.00 0.21 0.00 0.00 52.86 52.94 2kz4 s ASN 70 Cb -0.40 0.68 1.52 0.00 -0.55 0.00 0.00 41.25 42.51 2kz4 s ASN 70 CO 0.36 -1.33 1.97 0.00 -2.79 0.00 0.00 177.10 175.31 2kz4 h ALA 71 N 2.13 2.12 -0.00 1.71 0.00 -1.90 -1.74 119.26 121.58 2kz4 h ALA 71 Ca -0.27 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.63 2kz4 h ALA 71 Cb 1.25 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.07 2kz4 h ALA 71 CO 0.35 -0.59 0.00 0.25 0.00 0.00 0.00 179.25 179.25 2kz4 n THR 72 N -3.83 0.00 -4.39 0.00 -2.24 -1.26 -4.62 114.28 97.95 2kz4 n THR 72 Ca 0.07 -0.00 -0.25 0.00 -2.27 0.00 0.00 64.05 61.59 2kz4 n THR 72 Cb 0.57 -0.00 -0.10 0.00 -2.10 0.00 0.00 70.33 68.70 2kz4 n THR 72 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2kz4 s SER 73 N -1.01 3.85 0.19 3.42 1.04 -0.66 -4.33 113.70 116.20 2kz4 s SER 73 Ca 0.01 -0.81 0.08 0.00 0.48 0.00 0.00 55.95 55.71 2kz4 s SER 73 Cb 0.00 -0.47 -0.04 0.00 0.10 0.00 0.00 66.02 65.61 2kz4 s SER 73 CO 0.00 0.07 -0.05 -0.13 0.98 0.00 0.00 173.24 174.12 2kz4 s ARG 74 N -3.12 2.21 -0.34 4.02 0.52 -0.71 -4.17 118.95 117.36 2kz4 s ARG 74 Ca 0.26 -1.22 0.01 0.00 -0.52 0.00 0.00 55.73 54.26 2kz4 s ARG 74 Cb -0.07 -2.23 0.09 0.00 0.52 0.00 0.00 34.95 33.26 2kz4 s ARG 74 CO 0.14 0.44 0.07 0.42 0.02 0.00 0.00 175.30 176.39 2kz4 s ILE 75 N -1.77 2.72 -0.44 1.52 -1.09 0.01 -0.80 121.20 121.35 2kz4 s ILE 75 Ca 0.26 -1.98 -0.19 0.00 -2.23 0.00 0.00 60.65 56.51 2kz4 s ILE 75 Cb -0.09 -2.82 0.03 0.00 -1.58 0.00 0.00 42.46 38.00 2kz4 s ILE 75 CO 0.17 -0.46 0.55 -0.75 -1.23 0.00 0.00 174.94 173.22 2kz4 s LYS 76 N 1.07 3.18 0.01 2.79 2.20 -0.69 -0.53 119.74 127.77 2kz4 s LYS 76 Ca 0.04 -0.59 -0.30 0.00 -0.36 0.00 0.00 55.97 54.76 2kz4 s LYS 76 Cb -0.20 -3.97 -0.05 0.00 -1.51 0.00 0.00 37.83 32.09 2kz4 s LYS 76 CO -0.05 -0.97 1.27 0.08 -0.36 0.00 0.00 175.35 175.32 2kz4 s VAL 77 N 2.51 3.97 -0.14 4.02 1.01 -0.88 -0.84 120.40 130.05 2kz4 s VAL 77 Ca 0.17 1.36 0.15 0.00 0.00 0.00 0.00 61.98 63.66 2kz4 s VAL 77 Cb -0.16 -3.87 0.06 0.00 0.00 0.00 0.00 36.38 32.41 2kz4 s VAL 77 CO 0.16 0.04 1.45 0.28 0.00 0.00 0.00 175.10 177.03 2kz4 h SER 78 N 7.34 0.00 -5.33 3.32 0.02 -1.56 -1.61 113.55 115.74 2kz4 h SER 78 Ca -0.38 0.00 -0.18 0.00 -0.84 0.00 0.00 61.79 60.39 2kz4 h SER 78 Cb 1.18 0.00 -0.05 0.00 0.14 0.00 0.00 62.40 63.68 2kz4 h SER 78 CO 0.87 0.51 -0.02 0.28 -1.14 0.00 0.00 176.83 177.33 2kz4 s THR 79 N -2.98 0.00 0.00 -2.27 -1.32 -1.22 -4.67 115.64 103.18 2kz4 s THR 79 Ca 0.04 -1.37 0.00 0.00 -1.21 0.00 0.00 61.69 59.14 2kz4 s THR 79 Cb 0.08 -2.72 0.00 0.00 -1.51 0.00 0.00 72.50 68.35 2kz4 s THR 79 CO 0.74 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.76 2kz4 n GLY 80 N -0.55 -0.05 0.21 6.08 0.00 -1.26 -3.63 105.19 106.00 2kz4 n GLY 80 Ca -0.03 -1.02 0.10 0.00 0.00 0.00 0.00 46.02 45.07 2kz4 n GLY 80 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2kz4 h PRO 81 N 0.00 0.00 -0.29 1.61 0.13 -1.99 -3.26 132.00 128.20 2kz4 h PRO 81 Ca 0.00 0.00 -0.17 0.00 -0.87 0.00 0.00 66.00 64.96 2kz4 h PRO 81 Cb 0.00 0.00 -0.11 0.00 0.13 0.00 0.00 31.00 31.02 2kz4 h PRO 81 CO 0.00 0.19 -0.28 1.28 -0.23 0.00 0.00 178.00 178.97 2kz4 n LEU 82 N -3.22 3.83 -4.56 1.56 4.77 -1.26 -4.99 117.00 113.14 2kz4 n LEU 82 Ca 0.02 -3.95 -0.30 0.00 -0.03 0.00 0.00 56.01 51.75 2kz4 n LEU 82 Cb 0.51 -0.58 -0.04 0.00 -2.33 0.00 0.00 43.42 40.98 2kz4 n LEU 82 CO 0.34 1.42 1.51 0.00 -1.33 0.00 0.00 177.39 179.33 2kz4 s ALA 83 N -3.30 1.65 0.00 -1.18 0.00 -1.23 -1.46 121.76 116.24 2kz4 s ALA 83 Ca 0.44 -0.89 0.00 0.00 0.00 0.00 0.00 51.96 51.51 2kz4 s ALA 83 Cb 0.40 -4.45 0.00 0.00 0.00 0.00 0.00 23.12 19.07 2kz4 s ALA 83 CO -0.02 -4.66 0.00 0.41 0.00 0.00 0.00 175.76 171.48 2kz4 n GLY 84 N 6.35 1.95 3.71 0.00 0.00 -0.61 -4.92 105.19 111.66 2kz4 n GLY 84 Ca 0.34 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.94 2kz4 n GLY 84 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2kz4 s ARG 85 N 0.00 4.53 -1.06 1.61 1.81 -0.54 -4.92 118.95 120.39 2kz4 s ARG 85 Ca 0.00 1.46 -0.08 0.00 -1.72 0.00 0.00 55.73 55.40 2kz4 s ARG 85 Cb 0.00 -3.45 0.26 0.00 -0.45 0.00 0.00 34.95 31.31 2kz4 s ARG 85 CO 0.00 -0.10 1.03 0.54 -0.68 0.00 0.00 175.30 176.09 2kz4 s VAL 86 N 1.11 5.63 0.67 3.52 0.11 -1.26 -2.07 120.40 128.11 2kz4 s VAL 86 Ca 0.53 -3.51 -0.16 0.00 -2.93 0.00 0.00 61.98 55.91 2kz4 s VAL 86 Cb -0.22 -4.40 0.01 0.00 -1.53 0.00 0.00 36.38 30.24 2kz4 s VAL 86 CO 0.27 -1.16 1.17 -0.76 -3.33 0.00 0.00 175.10 171.29 2kz4 s LEU 87 N -1.26 3.42 -0.03 2.54 2.01 0.31 -4.71 118.68 120.97 2kz4 s LEU 87 Ca 0.30 2.23 0.07 0.00 0.01 0.00 0.00 54.13 56.74 2kz4 s LEU 87 Cb -0.09 -4.58 -0.02 0.00 0.01 0.00 0.00 46.19 41.51 2kz4 s LEU 87 CO -0.09 -1.88 -0.25 0.20 1.01 0.00 0.00 176.35 175.34 2kz4 s ASN 88 N -2.13 2.99 -0.63 2.29 0.01 -0.55 -0.81 114.94 116.11 2kz4 s ASN 88 Ca 0.72 -0.47 -0.27 0.00 -0.71 0.00 0.00 52.86 52.13 2kz4 s ASN 88 Cb -0.26 -0.43 0.03 0.00 0.41 0.00 0.00 41.25 41.00 2kz4 s ASN 88 CO 0.41 0.30 1.19 -0.63 -1.51 0.00 0.00 177.10 176.86 2kz4 s ILE 89 N -0.51 3.97 -1.28 0.60 1.01 -1.26 -1.24 121.20 122.48 2kz4 s ILE 89 Ca 0.07 0.67 0.03 0.00 0.00 0.00 0.00 60.65 61.41 2kz4 s ILE 89 Cb -0.11 -4.77 0.12 0.00 0.01 0.00 0.00 42.46 37.71 2kz4 s ILE 89 CO -0.00 -1.48 0.84 2.30 0.00 0.00 0.00 174.94 176.59 2kz4 n ILE 90 N 6.52 0.33 -0.20 2.92 -5.35 -1.18 -4.84 119.36 117.57 2kz4 n ILE 90 Ca 0.06 -0.20 0.00 0.00 -0.27 0.00 0.00 62.75 62.34 2kz4 n ILE 90 Cb 0.49 -0.27 0.00 0.00 -1.74 0.00 0.00 39.64 38.12 2kz4 n ILE 90 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2kz4 n GLY 91 N 0.31 3.45 3.07 3.28 0.00 -1.26 -4.99 105.19 109.05 2kz4 n GLY 91 Ca 0.04 -0.19 -0.24 0.00 0.00 0.00 0.00 46.02 45.64 2kz4 n GLY 91 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2kz4 s GLN 92 N 4.45 1.43 0.47 1.61 -2.07 -1.26 -4.28 119.66 120.01 2kz4 s GLN 92 Ca 0.00 -0.46 -0.23 0.00 -1.82 0.00 0.00 55.36 52.85 2kz4 s GLN 92 Cb 0.00 -1.27 -0.07 0.00 -1.09 0.00 0.00 33.01 30.58 2kz4 s GLN 92 CO 0.00 0.16 1.20 -1.25 -1.32 0.00 0.00 175.29 174.08 2kz4 s PRO 93 N 0.18 3.69 -0.13 9.60 0.04 -1.26 -4.75 135.00 142.38 2kz4 s PRO 93 Ca -0.05 1.86 -0.05 0.00 0.04 0.00 0.00 61.00 62.80 2kz4 s PRO 93 Cb -0.11 -2.41 0.06 0.00 0.04 0.00 0.00 34.50 32.08 2kz4 s PRO 93 CO 0.02 -0.63 0.26 -1.17 0.04 0.00 0.00 177.00 175.52 2kz4 s LEU 94 N -3.05 -0.28 0.76 -3.56 1.98 -0.90 -5.01 118.68 108.63 2kz4 s LEU 94 Ca 0.64 0.60 -0.13 0.00 -2.89 0.00 0.00 54.13 52.35 2kz4 s LEU 94 Cb -0.31 0.71 0.05 0.00 0.66 0.00 0.00 46.19 47.30 2kz4 s LEU 94 CO 0.37 -0.24 1.13 -2.16 -1.89 0.00 0.00 176.35 173.56 2kz4 s PRO 95 N 2.37 2.16 1.16 0.98 0.04 -1.26 -1.64 135.00 138.81 2kz4 s PRO 95 Ca 0.01 1.42 -0.19 0.00 0.04 0.00 0.00 61.00 62.27 2kz4 s PRO 95 Cb -0.12 -1.87 0.28 0.00 0.04 0.00 0.00 34.50 32.83 2kz4 s PRO 95 CO -0.09 -1.75 1.20 0.16 0.04 0.00 0.00 177.00 176.57 2kz4 s ASP 96 N -2.77 1.38 0.46 6.66 -4.77 -0.62 -4.86 116.67 112.15 2kz4 s ASP 96 Ca 0.66 0.37 0.12 0.00 -3.30 0.00 0.00 52.55 50.41 2kz4 s ASP 96 Cb -0.21 -0.44 1.07 0.00 -1.09 0.00 0.00 42.92 42.24 2kz4 s ASP 96 CO 0.50 -3.82 2.08 0.00 0.70 0.00 0.00 175.17 174.63 2kz4 h ALA 97 N -2.38 1.90 0.00 2.11 0.00 -1.97 -1.76 119.26 117.16 2kz4 h ALA 97 Ca -0.43 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.47 2kz4 h ALA 97 Cb 1.26 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.97 2kz4 h ALA 97 CO 0.30 0.06 -0.82 0.00 0.00 0.00 0.00 179.25 178.79 2kz4 n ALA 98 N -2.51 3.93 -1.36 0.00 0.00 -1.26 -4.98 120.51 114.32 2kz4 n ALA 98 Ca 0.02 -0.45 -0.12 0.00 0.00 0.00 0.00 53.44 52.88 2kz4 n ALA 98 Cb 0.14 -0.96 -0.05 0.00 0.00 0.00 0.00 19.45 18.58 2kz4 n ALA 98 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2kz4 n ARG 99 N -1.62 -0.86 0.20 0.00 3.00 -0.66 -4.90 116.66 111.81 2kz4 n ARG 99 Ca 0.04 0.94 0.14 0.00 -0.01 0.00 0.00 57.85 58.96 2kz4 n ARG 99 Cb 0.36 -4.96 0.45 0.00 0.00 0.00 0.00 32.46 28.31 2kz4 n ARG 99 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.63 179.42 2kz4 h THR 100 N 0.00 0.00 -1.72 0.55 1.35 -1.94 -3.42 112.91 107.73 2kz4 h THR 100 Ca -0.25 -0.59 0.11 0.00 -0.55 0.00 0.00 66.41 65.12 2kz4 h THR 100 Cb 0.81 1.54 -0.21 0.00 -1.73 0.00 0.00 68.15 68.56 2kz4 h THR 100 CO 0.37 0.00 0.57 0.00 -0.25 0.00 0.00 175.52 176.21 2kz4 s ARG 101 N -3.36 0.61 -0.15 4.72 1.04 -1.26 -3.02 118.95 117.53 2kz4 s ARG 101 Ca 0.05 0.01 -0.07 0.00 -1.04 0.00 0.00 55.73 54.69 2kz4 s ARG 101 Cb 0.08 0.29 -0.04 0.00 -2.04 0.00 0.00 34.95 33.24 2kz4 s ARG 101 CO 0.56 -0.22 0.08 -0.51 -0.04 0.00 0.00 175.30 175.17 2kz4 s LEU 102 N -1.53 3.97 -0.32 -1.89 1.02 0.41 -1.59 118.68 118.75 2kz4 s LEU 102 Ca 0.01 0.20 -0.25 0.00 0.02 0.00 0.00 54.13 54.12 2kz4 s LEU 102 Cb -0.01 -1.98 0.01 0.00 0.02 0.00 0.00 46.19 44.23 2kz4 s LEU 102 CO -0.02 0.26 0.85 -0.70 0.02 0.00 0.00 176.35 176.76 2kz4 s GLU 103 N -0.17 3.95 -0.17 1.70 2.12 -0.65 -2.20 118.70 123.28 2kz4 s GLU 103 Ca 0.08 0.64 -0.11 0.00 0.36 0.00 0.00 54.97 55.95 2kz4 s GLU 103 Cb -0.12 -3.74 -0.05 0.00 0.26 0.00 0.00 34.13 30.48 2kz4 s GLU 103 CO 0.01 -0.75 0.18 0.42 -0.54 0.00 0.00 175.26 174.57 2kz4 s ILE 104 N 3.13 5.39 -0.11 -3.70 -1.09 0.08 -2.11 121.20 122.79 2kz4 s ILE 104 Ca 0.35 0.29 -0.03 0.00 -2.23 0.00 0.00 60.65 59.03 2kz4 s ILE 104 Cb -0.14 -3.50 -0.03 0.00 -1.58 0.00 0.00 42.46 37.21 2kz4 s ILE 104 CO 0.14 0.46 0.00 -1.48 -1.23 0.00 0.00 174.94 172.83 2kz4 s LEU 105 N 0.14 3.56 0.27 2.97 2.34 -1.26 -1.00 118.68 125.70 2kz4 s LEU 105 Ca 0.11 0.09 -0.07 0.00 0.06 0.00 0.00 54.13 54.32 2kz4 s LEU 105 Cb -0.12 -1.83 -0.01 0.00 -0.56 0.00 0.00 46.19 43.67 2kz4 s LEU 105 CO 0.01 0.31 0.42 0.00 -1.06 0.00 0.00 176.35 176.03 2kz4 s ARG 107 N -3.69 0.95 0.09 0.00 3.52 -0.37 -0.02 118.95 119.42 2kz4 s ARG 107 Ca 0.28 -0.05 -0.30 0.00 -0.13 0.00 0.00 55.73 55.52 2kz4 s ARG 107 Cb 0.01 0.44 -0.06 0.00 -1.56 0.00 0.00 34.95 33.78 2kz4 s ARG 107 CO 0.13 -0.35 1.19 -2.00 -0.81 0.00 0.00 175.30 173.46 2kz4 s GLU 108 N -2.15 4.46 -0.21 5.12 2.12 -1.26 -1.48 118.70 125.29 2kz4 s GLU 108 Ca -0.03 1.77 0.03 0.00 0.36 0.00 0.00 54.97 57.10 2kz4 s GLU 108 Cb -0.01 -3.33 0.35 0.00 0.26 0.00 0.00 34.13 31.40 2kz4 s GLU 108 CO -0.01 -0.20 1.40 0.41 -0.54 0.00 0.00 175.26 176.32 2kz4 n GLY 109 N 2.98 3.07 2.32 -1.50 0.00 -1.26 -4.96 105.19 105.85 2kz4 n GLY 109 Ca 0.08 -0.53 0.00 0.00 0.00 0.00 0.00 46.02 45.57 2kz4 n GLY 109 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2kz4 n ALA 110 N -0.21 -2.01 -1.86 4.61 0.00 -1.26 -4.75 120.51 115.02 2kz4 n ALA 110 Ca 0.27 0.49 -0.22 0.00 0.00 0.00 0.00 53.44 53.99 2kz4 n ALA 110 Cb 1.02 -1.48 -0.08 0.00 0.00 0.00 0.00 19.45 18.92 2kz4 n ALA 110 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2kz4 s GLU 111 N -0.62 2.00 0.00 0.00 2.02 -1.26 -5.20 118.70 115.63 2kz4 s GLU 111 Ca 0.00 -0.53 0.29 0.00 0.02 0.00 0.00 54.97 54.74 2kz4 s GLU 111 Cb 0.00 -5.06 1.18 0.00 0.10 0.00 0.00 34.13 30.34 2kz4 s GLU 111 CO 0.00 -4.37 1.82 1.17 0.02 0.00 0.00 175.26 173.90