#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 6.25 -1.31 7.83 3.84 -1.26 -4.99 114.94 125.30 2kz4 s ASN 2 Ca 0.00 -0.78 -0.11 0.00 0.21 0.00 0.00 52.86 52.18 2kz4 s ASN 2 Cb 0.00 -2.31 0.14 0.00 -0.55 0.00 0.00 41.25 38.53 2kz4 s ASN 2 CO 0.00 -0.90 1.87 -0.38 -2.79 0.00 0.00 177.10 174.90 2kz4 n ILE 3 N 5.70 4.13 -2.51 -5.21 5.41 -1.26 -4.68 119.36 120.94 2kz4 n ILE 3 Ca -0.05 -4.15 -0.30 0.00 1.00 0.00 0.00 62.75 59.24 2kz4 n ILE 3 Cb 0.46 -2.42 -0.00 0.00 -0.71 0.00 0.00 39.64 36.96 2kz4 n ILE 3 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2kz4 n GLY 4 N 3.41 5.84 3.62 7.39 0.00 -1.26 -5.10 105.19 119.09 2kz4 n GLY 4 Ca 0.42 -2.71 -0.48 0.00 0.00 0.00 0.00 46.02 43.25 2kz4 n GLY 4 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2kz4 n ARG 5 N -0.39 1.55 -2.36 1.61 3.00 -1.26 -4.81 116.66 113.99 2kz4 n ARG 5 Ca 0.40 0.56 -0.35 0.00 -0.01 0.00 0.00 57.85 58.44 2kz4 n ARG 5 Cb 0.48 -2.19 -0.04 0.00 0.00 0.00 0.00 32.46 30.71 2kz4 n ARG 5 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 2kz4 s LEU 6 N 0.55 3.37 -0.03 0.55 2.01 -1.26 -4.58 118.68 119.29 2kz4 s LEU 6 Ca 0.77 -1.17 -0.21 0.00 0.01 0.00 0.00 54.13 53.54 2kz4 s LEU 6 Cb -0.80 -2.57 -0.32 0.00 0.01 0.00 0.00 46.19 42.51 2kz4 s LEU 6 CO 0.47 -1.99 0.92 0.03 1.01 0.00 0.00 176.35 176.79 2kz4 h ARG 7 N 10.34 0.35 0.00 1.70 3.08 -1.44 -3.44 114.38 124.97 2kz4 h ARG 7 Ca 0.16 -0.60 0.00 0.00 0.07 0.00 0.00 59.98 59.61 2kz4 h ARG 7 Cb 1.01 0.22 0.00 0.00 0.08 0.00 0.00 29.97 31.28 2kz4 h ARG 7 CO 1.34 1.29 0.00 -0.25 -1.07 0.00 0.00 179.97 181.28 2kz4 n ASP 8 N -4.04 0.44 -3.64 7.04 8.00 0.11 -4.96 116.55 119.50 2kz4 n ASP 8 Ca -0.14 -0.11 -0.12 0.00 0.71 0.00 0.00 54.79 55.12 2kz4 n ASP 8 Cb 0.88 0.00 -0.07 0.00 -0.02 0.00 0.00 41.12 41.91 2kz4 n ASP 8 CO 0.00 0.00 0.00 -0.60 -0.39 0.00 0.00 177.20 176.21 2kz4 s ARG 9 N 2.03 0.76 0.25 -1.24 3.52 -0.66 -1.96 118.95 121.66 2kz4 s ARG 9 Ca 0.00 1.02 0.02 0.00 -0.13 0.00 0.00 55.73 56.64 2kz4 s ARG 9 Cb 0.00 0.31 -0.05 0.00 -1.56 0.00 0.00 34.95 33.65 2kz4 s ARG 9 CO 0.00 -0.11 0.05 0.96 -0.81 0.00 0.00 175.30 175.39 2kz4 s ILE 10 N 0.73 0.81 -0.05 4.11 -0.00 -0.47 -1.26 121.20 125.07 2kz4 s ILE 10 Ca -0.03 -2.01 0.05 0.00 -0.00 0.00 0.00 60.65 58.66 2kz4 s ILE 10 Cb -0.05 -2.54 -0.02 0.00 -0.00 0.00 0.00 42.46 39.85 2kz4 s ILE 10 CO -0.05 -0.13 -0.18 -0.89 -0.00 0.00 0.00 174.94 173.69 2kz4 s THR 11 N -3.57 2.75 -0.55 8.37 2.01 0.14 -1.26 115.64 123.54 2kz4 s THR 11 Ca 0.34 -0.83 -0.17 0.00 0.31 0.00 0.00 61.69 61.33 2kz4 s THR 11 Cb 0.07 -2.06 0.10 0.00 0.01 0.00 0.00 72.50 70.63 2kz4 s THR 11 CO 0.12 0.58 0.58 -0.63 -0.69 0.00 0.00 174.62 174.58 2kz4 s ILE 12 N -0.58 5.01 -0.66 1.82 -1.09 -1.01 -1.84 121.20 122.85 2kz4 s ILE 12 Ca 0.08 -1.09 -0.27 0.00 -2.23 0.00 0.00 60.65 57.14 2kz4 s ILE 12 Cb -0.11 -4.36 0.01 0.00 -1.58 0.00 0.00 42.46 36.42 2kz4 s ILE 12 CO 0.01 -0.92 1.52 -1.10 -1.23 0.00 0.00 174.94 173.22 2kz4 s GLN 13 N 2.18 3.00 0.40 2.79 1.11 -0.26 -0.80 119.66 128.08 2kz4 s GLN 13 Ca 0.08 0.21 -0.23 0.00 0.01 0.00 0.00 55.36 55.43 2kz4 s GLN 13 Cb -0.25 -4.25 -0.10 0.00 -1.01 0.00 0.00 33.01 27.40 2kz4 s GLN 13 CO 0.06 -2.33 0.97 0.95 0.01 0.00 0.00 175.29 174.95 2kz4 s THR 14 N 7.03 4.21 -0.45 -0.19 -4.23 0.18 -1.36 115.64 120.84 2kz4 s THR 14 Ca 0.50 1.54 -0.17 0.00 -1.18 0.00 0.00 61.69 62.38 2kz4 s THR 14 Cb -0.10 -3.71 0.04 0.00 1.34 0.00 0.00 72.50 70.07 2kz4 s THR 14 CO 0.19 -0.15 0.43 -0.22 -0.54 0.00 0.00 174.62 174.33 2kz4 s LEU 15 N -2.83 5.18 -0.27 4.79 2.96 -1.15 -1.17 118.68 126.19 2kz4 s LEU 15 Ca 0.59 -0.98 -0.12 0.00 -0.22 0.00 0.00 54.13 53.40 2kz4 s LEU 15 Cb -0.14 -2.28 -0.05 0.00 0.50 0.00 0.00 46.19 44.22 2kz4 s LEU 15 CO 0.18 -0.63 0.23 -0.75 -1.32 0.00 0.00 176.35 174.06 2kz4 s LYS 16 N 1.97 3.98 -0.89 1.98 2.20 -0.37 -4.95 119.74 123.66 2kz4 s LYS 16 Ca 0.09 -0.24 -0.23 0.00 -0.36 0.00 0.00 55.97 55.23 2kz4 s LYS 16 Cb -0.20 -3.65 0.06 0.00 -1.51 0.00 0.00 37.83 32.53 2kz4 s LYS 16 CO 0.10 -0.17 1.29 -0.65 -0.36 0.00 0.00 175.35 175.56 2kz4 s GLN 17 N 1.75 3.43 -0.36 4.03 -0.21 -1.26 -1.75 119.66 125.29 2kz4 s GLN 17 Ca 0.09 -0.97 -0.20 0.00 0.02 0.00 0.00 55.36 54.30 2kz4 s GLN 17 Cb -0.16 -4.85 0.00 0.00 1.00 0.00 0.00 33.01 29.00 2kz4 s GLN 17 CO 0.10 -2.07 0.59 0.99 -2.12 0.00 0.00 175.29 172.77 2kz4 s THR 18 N 4.67 4.94 0.69 -0.19 2.01 -0.12 -4.82 115.64 122.82 2kz4 s THR 18 Ca 0.38 0.45 -0.12 0.00 0.31 0.00 0.00 61.69 62.70 2kz4 s THR 18 Cb -0.05 -4.04 0.01 0.00 0.01 0.00 0.00 72.50 68.43 2kz4 s THR 18 CO -0.01 -0.30 1.07 -0.60 -0.69 0.00 0.00 174.62 174.09 2kz4 s ARG 19 N 2.59 2.80 0.41 4.92 3.52 -1.26 -1.02 118.95 130.92 2kz4 s ARG 19 Ca 0.22 1.12 0.07 0.00 -0.13 0.00 0.00 55.73 57.01 2kz4 s ARG 19 Cb -0.15 -1.97 -0.04 0.00 -1.56 0.00 0.00 34.95 31.24 2kz4 s ARG 19 CO 0.14 -1.21 0.27 0.34 -0.81 0.00 0.00 175.30 174.03 2kz4 s ASP 20 N -3.32 4.71 0.00 -2.12 2.15 -0.12 -4.88 116.67 113.08 2kz4 s ASP 20 Ca 0.61 -0.92 0.10 0.00 0.43 0.00 0.00 52.55 52.77 2kz4 s ASP 20 Cb -0.16 -0.53 0.44 0.00 -0.30 0.00 0.00 42.92 42.37 2kz4 s ASP 20 CO 0.50 -0.58 1.27 0.00 -0.17 0.00 0.00 175.17 176.18 2kz4 n ILE 21 N -1.37 1.13 1.00 4.11 3.06 -1.26 -1.17 119.36 124.86 2kz4 n ILE 21 Ca 0.01 0.28 0.10 0.00 -2.50 0.00 0.00 62.75 60.64 2kz4 n ILE 21 Cb 0.63 -1.12 -0.08 0.00 0.54 0.00 0.00 39.64 39.62 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 -1.42 0.00 -1.14 9.51 -2.24 -1.26 -4.98 114.28 112.75 2kz4 n THR 22 Ca 0.03 -0.04 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 2kz4 n THR 22 Cb 0.10 0.98 0.00 0.00 -2.10 0.00 0.00 70.33 69.31 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 1.49 1.02 3.86 3.38 0.00 -0.31 -5.08 105.19 109.55 2kz4 n GLY 23 Ca 0.05 -0.53 -0.37 0.00 0.00 0.00 0.00 46.02 45.17 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 -2.66 3.63 -0.62 1.61 2.02 -1.26 -4.79 118.70 116.64 2kz4 s GLU 24 Ca 0.00 0.07 -0.22 0.00 0.02 0.00 0.00 54.97 54.84 2kz4 s GLU 24 Cb 0.00 -3.19 0.07 0.00 0.10 0.00 0.00 34.13 31.11 2kz4 s GLU 24 CO 0.00 0.73 0.89 0.42 0.02 0.00 0.00 175.26 177.32 2kz4 s ILE 25 N -1.08 4.45 -0.55 -1.63 -1.09 -1.26 -0.94 121.20 119.10 2kz4 s ILE 25 Ca 0.20 -0.36 -0.22 0.00 -2.23 0.00 0.00 60.65 58.03 2kz4 s ILE 25 Cb -0.14 -4.60 0.05 0.00 -1.58 0.00 0.00 42.46 36.19 2kz4 s ILE 25 CO 0.09 -1.30 0.83 -0.76 -1.23 0.00 0.00 174.94 172.57 2kz4 s LEU 26 N 3.72 4.46 -0.42 2.97 2.01 -0.19 -4.90 118.68 126.33 2kz4 s LEU 26 Ca 0.21 -0.64 -0.29 0.00 0.01 0.00 0.00 54.13 53.43 2kz4 s LEU 26 Cb -0.17 -2.64 0.03 0.00 0.01 0.00 0.00 46.19 43.41 2kz4 s LEU 26 CO 0.11 -1.13 1.11 -1.61 1.01 0.00 0.00 176.35 175.84 2kz4 s GLU 27 N 3.47 3.84 0.03 1.70 2.02 -1.26 -0.95 118.70 127.56 2kz4 s GLU 27 Ca 0.24 0.74 0.05 0.00 0.02 0.00 0.00 54.97 56.02 2kz4 s GLU 27 Cb -0.16 -3.85 -0.02 0.00 0.10 0.00 0.00 34.13 30.21 2kz4 s GLU 27 CO 0.15 -1.20 -0.16 0.95 0.02 0.00 0.00 175.26 175.03 2kz4 s THR 28 N 4.14 1.25 -0.50 3.63 -4.23 -0.72 -5.01 115.64 114.20 2kz4 s THR 28 Ca 0.47 -0.98 -0.13 0.00 -1.18 0.00 0.00 61.69 59.87 2kz4 s THR 28 Cb -0.09 -1.10 0.12 0.00 1.34 0.00 0.00 72.50 72.77 2kz4 s THR 28 CO 0.26 0.11 0.42 0.26 -0.54 0.00 0.00 174.62 175.13 2kz4 s TRP 29 N -0.75 3.33 -0.13 3.99 0.52 -1.26 -1.23 118.94 123.41 2kz4 s TRP 29 Ca 0.04 -1.56 -0.11 0.00 0.02 0.00 0.00 56.10 54.49 2kz4 s TRP 29 Cb -0.08 -3.63 -0.05 0.00 -1.15 0.00 0.00 33.47 28.57 2kz4 s TRP 29 CO 0.01 -1.00 0.22 -1.83 0.02 0.00 0.00 176.95 174.37 2kz4 s GLU 30 N 1.49 3.89 0.39 4.98 -1.05 -0.32 -4.90 118.70 123.17 2kz4 s GLU 30 Ca 0.04 -0.01 -0.26 0.00 -0.15 0.00 0.00 54.97 54.59 2kz4 s GLU 30 Cb -0.28 -3.30 -0.09 0.00 -0.44 0.00 0.00 34.13 30.02 2kz4 s GLU 30 CO 0.01 0.52 1.24 0.16 0.95 0.00 0.00 175.26 178.15 2kz4 s ASP 31 N -0.35 6.45 0.00 0.83 -4.77 -1.26 -0.64 116.67 116.93 2kz4 s ASP 31 Ca 0.15 2.52 0.00 0.00 -3.30 0.00 0.00 52.55 51.92 2kz4 s ASP 31 Cb -0.13 -2.63 0.00 0.00 -1.09 0.00 0.00 42.92 39.07 2kz4 s ASP 31 CO 0.04 -0.74 0.00 0.61 0.70 0.00 0.00 175.17 175.78 2kz4 n GLY 32 N 0.69 0.87 3.39 2.12 0.00 0.02 -4.83 105.19 107.45 2kz4 n GLY 32 Ca 0.04 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.74 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 2.02 2.48 -0.49 1.61 3.76 -1.26 -4.86 115.29 118.55 2kz4 s HIS 33 Ca 0.00 -0.32 -0.14 0.00 -0.15 0.00 0.00 55.06 54.45 2kz4 s HIS 33 Cb 0.00 -1.51 0.10 0.00 1.11 0.00 0.00 32.58 32.28 2kz4 s HIS 33 CO 0.00 0.11 0.41 0.99 -0.85 0.00 0.00 174.74 175.40 2kz4 s THR 34 N -0.74 4.96 0.43 1.30 2.01 -1.26 -2.39 115.64 119.93 2kz4 s THR 34 Ca 0.12 -1.37 0.07 0.00 0.31 0.00 0.00 61.69 60.82 2kz4 s THR 34 Cb -0.10 -4.09 -0.05 0.00 0.01 0.00 0.00 72.50 68.27 2kz4 s THR 34 CO 0.01 -0.71 0.18 -1.48 -0.69 0.00 0.00 174.62 171.94 2kz4 s LEU 35 N 1.56 3.04 0.15 4.42 2.34 -0.39 -4.89 118.68 124.91 2kz4 s LEU 35 Ca 0.04 -1.13 -0.30 0.00 0.06 0.00 0.00 54.13 52.79 2kz4 s LEU 35 Cb -0.27 -1.36 -0.08 0.00 -0.56 0.00 0.00 46.19 43.92 2kz4 s LEU 35 CO 0.04 -0.60 1.29 0.26 -1.06 0.00 0.00 176.35 176.28 2kz4 s TRP 36 N -2.63 3.32 0.36 3.48 0.23 -1.26 -1.37 118.94 121.06 2kz4 s TRP 36 Ca 0.39 1.21 0.06 0.00 -2.03 0.00 0.00 56.10 55.72 2kz4 s TRP 36 Cb 0.04 -3.56 -0.02 0.00 0.03 0.00 0.00 33.47 29.95 2kz4 s TRP 36 CO 0.21 -1.78 0.22 0.00 0.96 0.00 0.00 176.95 176.56 2kz4 n ALA 37 N 3.13 0.64 -3.58 0.98 0.00 -0.83 -4.13 120.51 116.73 2kz4 n ALA 37 Ca 0.07 -1.97 -0.28 0.00 0.00 0.00 0.00 53.44 51.26 2kz4 n ALA 37 Cb 0.44 1.47 -0.15 0.00 0.00 0.00 0.00 19.45 21.20 2kz4 n ALA 37 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2kz4 s SER 38 N -3.37 3.33 -0.51 0.00 0.15 0.48 0.09 113.70 113.88 2kz4 s SER 38 Ca 0.31 -1.17 -0.21 0.00 0.70 0.00 0.00 55.95 55.58 2kz4 s SER 38 Cb 0.01 -0.39 0.05 0.00 -1.71 0.00 0.00 66.02 63.99 2kz4 s SER 38 CO 0.22 -0.42 0.70 -0.69 1.20 0.00 0.00 173.24 174.26 2kz4 s VAL 39 N 2.05 4.75 -0.30 4.45 1.01 -1.26 -1.71 120.40 129.40 2kz4 s VAL 39 Ca 0.07 -0.21 -0.00 0.00 0.00 0.00 0.00 61.98 61.84 2kz4 s VAL 39 Cb -0.16 -4.34 0.06 0.00 0.00 0.00 0.00 36.38 31.93 2kz4 s VAL 39 CO -0.29 -0.85 -0.02 0.20 0.00 0.00 0.00 175.10 174.14 2kz4 s ASN 40 N 2.62 4.77 0.03 3.32 0.02 0.47 -4.74 114.94 121.43 2kz4 s ASN 40 Ca 0.20 -1.40 -0.30 0.00 -1.02 0.00 0.00 52.86 50.33 2kz4 s ASN 40 Cb -0.17 -1.66 -0.07 0.00 0.02 0.00 0.00 41.25 39.37 2kz4 s ASN 40 CO 0.15 -0.26 1.48 -0.04 0.02 0.00 0.00 177.10 178.45 2kz4 s MET 41 N 1.18 4.26 0.33 -0.60 -1.94 -1.26 -0.80 119.30 120.46 2kz4 s MET 41 Ca -0.05 2.09 -0.29 0.00 -1.71 0.00 0.00 55.69 55.74 2kz4 s MET 41 Cb -0.20 -3.55 -0.12 0.00 2.01 0.00 0.00 34.83 32.97 2kz4 s MET 41 CO -0.03 -0.62 1.46 1.33 -0.01 0.00 0.00 175.02 177.16 2kz4 n VAL 42 N 4.62 1.61 -2.85 -6.03 0.24 0.67 -4.89 118.33 111.71 2kz4 n VAL 42 Ca 0.14 -0.40 -0.17 0.00 -2.04 0.00 0.00 64.34 61.87 2kz4 n VAL 42 Cb 0.42 -1.82 0.07 0.00 -1.47 0.00 0.00 33.84 31.04 2kz4 n VAL 42 CO 0.00 0.00 0.00 -0.24 -2.14 0.00 0.00 176.83 174.45 2kz4 n SER 43 N 1.19 1.48 -0.13 -1.34 2.88 -1.26 -3.37 113.62 113.08 2kz4 n SER 43 Ca 0.05 -2.13 0.05 0.00 -1.33 0.00 0.00 58.87 55.51 2kz4 n SER 43 Cb 0.37 -0.41 0.36 0.00 -0.75 0.00 0.00 64.21 63.78 2kz4 n SER 43 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 2kz4 h SER 44 N -0.13 0.63 0.24 -3.46 0.02 -1.97 -2.89 113.55 105.98 2kz4 h SER 44 Ca -0.24 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.71 2kz4 h SER 44 Cb 1.00 -0.14 -0.03 0.00 0.14 0.00 0.00 62.40 63.37 2kz4 h SER 44 CO 0.30 0.43 -0.46 0.50 -1.14 0.00 0.00 176.83 176.46 2kz4 h LYS 45 N 0.73 -0.73 0.00 3.45 3.64 -1.99 -0.89 116.57 120.77 2kz4 h LYS 45 Ca 0.26 0.05 -0.08 0.00 -1.27 0.00 0.00 60.65 59.60 2kz4 h LYS 45 Cb 0.11 0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 32.08 2kz4 h LYS 45 CO -0.07 -0.49 -0.39 1.05 -2.27 0.00 0.00 179.45 177.28 2kz4 h GLU 46 N -0.76 0.00 0.40 1.90 4.11 -1.97 -2.07 114.58 116.19 2kz4 h GLU 46 Ca -0.03 0.00 -0.02 0.00 0.07 0.00 0.00 59.36 59.38 2kz4 h GLU 46 Cb 0.72 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.97 2kz4 h GLU 46 CO -0.18 0.39 -0.19 0.00 0.07 0.00 0.00 179.01 179.10 2kz4 h ALA 47 N 1.61 -0.53 -0.73 1.06 0.00 -1.38 -2.39 119.26 116.90 2kz4 h ALA 47 Ca -0.00 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.73 2kz4 h ALA 47 Cb 1.27 0.21 -0.04 0.00 0.00 0.00 0.00 17.79 19.23 2kz4 h ALA 47 CO 0.05 -0.66 0.47 0.82 0.00 0.00 0.00 179.25 179.93 2kz4 h ILE 48 N -0.81 1.19 -0.36 0.00 2.04 -1.22 -1.23 117.51 117.13 2kz4 h ILE 48 Ca -0.05 -0.38 0.02 0.00 1.00 0.00 0.00 64.86 65.44 2kz4 h ILE 48 Cb 0.54 0.13 -0.02 0.00 -0.74 0.00 0.00 36.82 36.73 2kz4 h ILE 48 CO 0.09 0.19 0.21 -1.28 0.00 0.00 0.00 178.15 177.36 2kz4 h SER 49 N 1.00 0.33 1.20 1.72 0.87 -1.36 -2.10 113.55 115.20 2kz4 h SER 49 Ca 0.27 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.83 2kz4 h SER 49 Cb -0.09 -0.06 0.00 0.00 -0.44 0.00 0.00 62.40 61.81 2kz4 h SER 49 CO -0.05 0.24 -0.16 -1.54 -0.53 0.00 0.00 176.83 174.78 2kz4 n SER 50 N -4.89 0.62 0.00 6.23 3.41 -0.90 -5.00 113.62 113.09 2kz4 n SER 50 Ca 0.00 0.42 0.00 0.00 -0.26 0.00 0.00 58.87 59.03 2kz4 n SER 50 Cb 0.06 -0.48 0.00 0.00 -0.26 0.00 0.00 64.21 63.53 2kz4 n SER 50 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2kz4 n GLY 51 N 1.36 1.39 0.00 5.00 0.00 -0.48 -3.59 105.19 108.88 2kz4 n GLY 51 Ca 0.05 -0.45 0.00 0.00 0.00 0.00 0.00 46.02 45.62 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 0.92 1.43 0.26 4.61 0.00 -1.26 -4.49 120.51 121.98 2kz4 n ALA 52 Ca 0.00 -0.25 -0.10 0.00 0.00 0.00 0.00 53.44 53.09 2kz4 n ALA 52 Cb 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.40 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 -0.66 -6.17 0.00 4.81 -1.84 -3.41 114.58 107.32 2kz4 h GLU 53 Ca 0.00 0.04 -0.57 0.00 -0.13 0.00 0.00 59.36 58.70 2kz4 h GLU 53 Cb 0.17 0.15 -0.05 0.00 0.63 0.00 0.00 28.75 29.66 2kz4 h GLU 53 CO 0.00 -0.44 -0.03 -0.51 -0.73 0.00 0.00 179.01 177.30 2kz4 s LEU 54 N -7.87 4.49 0.03 1.64 1.43 -1.26 -5.10 118.68 112.04 2kz4 s LEU 54 Ca -0.10 1.21 0.06 0.00 -1.03 0.00 0.00 54.13 54.27 2kz4 s LEU 54 Cb 0.01 -2.89 -0.02 0.00 0.03 0.00 0.00 46.19 43.32 2kz4 s LEU 54 CO 0.30 0.21 -0.16 0.00 0.23 0.00 0.00 176.35 176.93 2kz4 s ALA 55 N -0.77 1.36 -0.16 4.21 0.00 -1.26 -4.47 121.76 120.66 2kz4 s ALA 55 Ca 0.29 -0.87 -0.29 0.00 0.00 0.00 0.00 51.96 51.10 2kz4 s ALA 55 Cb -0.19 -0.25 -0.05 0.00 0.00 0.00 0.00 23.12 22.63 2kz4 s ALA 55 CO 0.18 0.28 2.00 0.42 0.00 0.00 0.00 175.76 178.64 2kz4 s ILE 56 N -0.77 3.19 0.00 0.00 1.01 -1.26 -1.11 121.20 122.27 2kz4 s ILE 56 Ca 0.04 0.21 0.00 0.00 0.00 0.00 0.00 60.65 60.90 2kz4 s ILE 56 Cb -0.08 -3.21 0.00 0.00 0.01 0.00 0.00 42.46 39.18 2kz4 s ILE 56 CO 0.01 -0.10 0.00 0.61 0.00 0.00 0.00 174.94 175.46 2kz4 n GLY 57 N 5.20 1.37 3.76 6.18 0.00 -1.22 -5.08 105.19 115.40 2kz4 n GLY 57 Ca 0.24 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.89 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 -2.01 2.44 -0.15 2.61 2.01 -0.27 -4.05 115.64 116.22 2kz4 s THR 58 Ca 0.00 0.32 0.02 0.00 0.31 0.00 0.00 61.69 62.34 2kz4 s THR 58 Cb 0.00 -3.16 0.01 0.00 0.01 0.00 0.00 72.50 69.36 2kz4 s THR 58 CO 0.00 -0.01 -0.21 -0.69 -0.69 0.00 0.00 174.62 173.02 2kz4 s VAL 59 N -1.41 2.12 -0.18 3.82 1.01 -0.20 -0.24 120.40 125.32 2kz4 s VAL 59 Ca 0.70 -0.95 -0.07 0.00 0.00 0.00 0.00 61.98 61.66 2kz4 s VAL 59 Cb -0.36 -1.86 -0.04 0.00 0.00 0.00 0.00 36.38 34.12 2kz4 s VAL 59 CO 0.42 0.54 0.06 -0.60 0.00 0.00 0.00 175.10 175.52 2kz4 s ARG 60 N 0.95 3.94 -0.16 2.72 3.52 0.02 -0.96 118.95 128.97 2kz4 s ARG 60 Ca -0.04 -0.34 -0.02 0.00 -0.13 0.00 0.00 55.73 55.20 2kz4 s ARG 60 Cb -0.15 -3.20 0.05 0.00 -1.56 0.00 0.00 34.95 30.09 2kz4 s ARG 60 CO -0.05 0.30 0.02 0.42 -0.81 0.00 0.00 175.30 175.18 2kz4 s ILE 61 N 0.30 0.55 -0.33 4.11 1.01 0.02 -0.40 121.20 126.47 2kz4 s ILE 61 Ca 0.03 -0.40 -0.11 0.00 0.00 0.00 0.00 60.65 60.17 2kz4 s ILE 61 Cb -0.12 -0.94 -0.01 0.00 0.01 0.00 0.00 42.46 41.40 2kz4 s ILE 61 CO 0.00 -0.06 0.20 0.26 0.00 0.00 0.00 174.94 175.35 2kz4 s TRP 62 N 1.86 3.21 0.31 3.97 0.52 -0.69 -0.65 118.94 127.47 2kz4 s TRP 62 Ca 0.01 -0.40 0.09 0.00 0.02 0.00 0.00 56.10 55.83 2kz4 s TRP 62 Cb -0.16 -2.42 -0.06 0.00 -1.15 0.00 0.00 33.47 29.68 2kz4 s TRP 62 CO -0.07 -0.41 -0.11 0.96 0.02 0.00 0.00 176.95 177.33 2kz4 s ILE 63 N 1.67 2.16 0.83 2.03 -4.36 -0.85 -0.39 121.20 122.30 2kz4 s ILE 63 Ca 0.05 -2.24 -0.12 0.00 -0.26 0.00 0.00 60.65 58.08 2kz4 s ILE 63 Cb -0.17 -2.51 0.10 0.00 1.25 0.00 0.00 42.46 41.13 2kz4 s ILE 63 CO 0.09 -0.28 1.19 -0.13 0.24 0.00 0.00 174.94 176.04 2kz4 s ARG 64 N -3.61 1.48 -0.50 0.37 1.81 -1.26 -1.01 118.95 116.23 2kz4 s ARG 64 Ca 0.31 1.70 -0.26 0.00 -1.72 0.00 0.00 55.73 55.75 2kz4 s ARG 64 Cb 0.01 -1.76 -0.05 0.00 -0.45 0.00 0.00 34.95 32.70 2kz4 s ARG 64 CO 0.15 -2.32 2.16 -0.47 -0.68 0.00 0.00 175.30 174.14 2kz4 s TYR 65 N -2.29 1.34 -0.19 -0.53 5.04 -1.21 -3.74 117.35 115.76 2kz4 s TYR 65 Ca 0.71 1.15 0.01 0.00 -2.44 0.00 0.00 57.07 56.51 2kz4 s TYR 65 Cb -0.27 -3.82 0.02 0.00 0.35 0.00 0.00 41.96 38.24 2kz4 s TYR 65 CO 0.52 -2.59 -0.19 0.50 -1.34 0.00 0.00 175.55 172.46 2kz4 s ARG 66 N 7.52 2.91 0.00 4.97 3.52 -1.26 -4.91 118.95 131.69 2kz4 s ARG 66 Ca 0.86 -0.89 0.29 0.00 -0.13 0.00 0.00 55.73 55.86 2kz4 s ARG 66 Cb -0.17 -2.61 1.63 0.00 -1.56 0.00 0.00 34.95 32.23 2kz4 s ARG 66 CO 0.25 -0.25 2.06 1.63 -0.81 0.00 0.00 175.30 178.18 2kz4 n LYS 67 N 4.60 0.69 0.06 5.12 4.01 -1.26 -3.45 118.16 127.93 2kz4 n LYS 67 Ca -0.20 0.01 0.09 0.00 -0.51 0.00 0.00 58.31 57.70 2kz4 n LYS 67 Cb 0.49 -1.50 -0.06 0.00 -0.51 0.00 0.00 35.03 33.45 2kz4 n LYS 67 CO 0.00 0.00 0.00 -3.47 -1.11 0.00 0.00 177.40 172.82 2kz4 n ASP 68 N -1.13 0.63 -4.74 4.39 -0.08 -1.26 -4.94 116.55 109.42 2kz4 n ASP 68 Ca 0.18 0.25 -0.41 0.00 -1.51 0.00 0.00 54.79 53.30 2kz4 n ASP 68 Cb 0.16 0.78 -0.03 0.00 2.34 0.00 0.00 41.12 44.38 2kz4 n ASP 68 CO 0.00 0.00 0.00 -0.63 0.12 0.00 0.00 177.20 176.69 2kz4 s ILE 69 N -3.31 3.01 0.32 5.18 -1.09 -1.22 -5.04 121.20 119.04 2kz4 s ILE 69 Ca -0.03 0.83 0.03 0.00 -2.23 0.00 0.00 60.65 59.25 2kz4 s ILE 69 Cb 0.10 -3.53 -0.05 0.00 -1.58 0.00 0.00 42.46 37.40 2kz4 s ILE 69 CO 0.82 0.13 0.09 0.21 -1.23 0.00 0.00 174.94 174.96 2kz4 s ASN 70 N 0.37 2.00 0.53 3.58 3.84 -1.26 -4.88 114.94 119.12 2kz4 s ASN 70 Ca 0.58 -1.44 0.29 0.00 0.21 0.00 0.00 52.86 52.49 2kz4 s ASN 70 Cb -0.38 0.13 1.50 0.00 -0.55 0.00 0.00 41.25 41.95 2kz4 s ASN 70 CO 0.40 -0.72 2.08 0.00 -2.79 0.00 0.00 177.10 176.07 2kz4 h ALA 71 N 2.15 1.25 -0.32 1.71 0.00 -1.96 -3.01 119.26 119.09 2kz4 h ALA 71 Ca -0.38 -0.09 -0.30 0.00 0.00 0.00 0.00 54.91 54.13 2kz4 h ALA 71 Cb 1.25 -0.02 -0.11 0.00 0.00 0.00 0.00 17.79 18.91 2kz4 h ALA 71 CO 0.63 0.13 0.17 0.25 0.00 0.00 0.00 179.25 180.43 2kz4 n THR 72 N -3.57 2.89 -3.69 0.00 -2.24 -1.26 -4.68 114.28 101.72 2kz4 n THR 72 Ca -0.02 -1.88 -0.17 0.00 -2.27 0.00 0.00 64.05 59.70 2kz4 n THR 72 Cb 0.23 -1.59 -0.17 0.00 -2.10 0.00 0.00 70.33 66.70 2kz4 n THR 72 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 2kz4 s SER 73 N 0.91 0.71 -0.11 3.42 0.01 -1.14 -2.95 113.70 114.56 2kz4 s SER 73 Ca 0.43 0.18 -0.15 0.00 1.31 0.00 0.00 55.95 57.73 2kz4 s SER 73 Cb 0.27 0.04 -0.05 0.00 0.21 0.00 0.00 66.02 66.49 2kz4 s SER 73 CO -0.07 -0.22 0.36 -0.13 0.41 0.00 0.00 173.24 173.59 2kz4 s ARG 74 N 1.93 4.15 -0.75 12.44 0.52 -0.47 -4.35 118.95 132.42 2kz4 s ARG 74 Ca 0.01 0.25 -0.17 0.00 -0.52 0.00 0.00 55.73 55.30 2kz4 s ARG 74 Cb -0.12 -3.36 0.16 0.00 0.52 0.00 0.00 34.95 32.14 2kz4 s ARG 74 CO -0.04 0.36 0.81 0.42 0.02 0.00 0.00 175.30 176.86 2kz4 s ILE 75 N 0.04 5.13 -0.40 1.52 -1.09 0.59 -1.11 121.20 125.88 2kz4 s ILE 75 Ca 0.21 -1.73 -0.18 0.00 -2.23 0.00 0.00 60.65 56.72 2kz4 s ILE 75 Cb -0.14 -4.54 0.01 0.00 -1.58 0.00 0.00 42.46 36.21 2kz4 s ILE 75 CO 0.08 -1.15 0.51 -0.75 -1.23 0.00 0.00 174.94 172.39 2kz4 s LYS 76 N 1.64 3.31 0.07 2.79 2.20 -0.77 -1.09 119.74 127.90 2kz4 s LYS 76 Ca 0.18 -0.48 -0.31 0.00 -0.36 0.00 0.00 55.97 55.01 2kz4 s LYS 76 Cb -0.15 -3.91 -0.07 0.00 -1.51 0.00 0.00 37.83 32.19 2kz4 s LYS 76 CO -0.03 -0.82 1.35 0.08 -0.36 0.00 0.00 175.35 175.56 2kz4 s VAL 77 N 2.39 3.57 -0.09 4.02 1.01 -0.75 -0.68 120.40 129.87 2kz4 s VAL 77 Ca 0.17 1.09 0.15 0.00 0.00 0.00 0.00 61.98 63.39 2kz4 s VAL 77 Cb -0.16 -3.70 -0.23 0.00 0.00 0.00 0.00 36.38 32.29 2kz4 s VAL 77 CO 0.15 0.06 0.49 -1.20 0.00 0.00 0.00 175.10 174.61 2kz4 n SER 78 N 4.31 0.60 -3.35 3.32 7.64 -0.39 -0.87 113.62 124.88 2kz4 n SER 78 Ca 0.11 0.29 -0.08 0.00 1.01 0.00 0.00 58.87 60.20 2kz4 n SER 78 Cb 0.44 0.29 -0.08 0.00 -1.01 0.00 0.00 64.21 63.85 2kz4 n SER 78 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 2kz4 s THR 79 N -2.60 -0.63 -5.00 0.44 2.01 -0.65 -4.68 115.64 104.54 2kz4 s THR 79 Ca -0.06 -0.05 0.00 0.00 0.31 0.00 0.00 61.69 61.89 2kz4 s THR 79 Cb 0.07 -0.82 0.00 0.00 0.01 0.00 0.00 72.50 71.77 2kz4 s THR 79 CO 0.83 -0.10 0.00 0.61 -0.69 0.00 0.00 174.62 175.26 2kz4 n GLY 80 N 5.37 -0.01 0.18 4.40 0.00 -1.26 -1.66 105.19 112.21 2kz4 n GLY 80 Ca -0.04 -1.46 0.14 0.00 0.00 0.00 0.00 46.02 44.66 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 0.92 0.00 -0.27 1.61 0.13 -2.00 -2.81 132.00 129.59 2kz4 h PRO 81 Ca 0.00 0.00 -0.23 0.00 -0.87 0.00 0.00 66.00 64.90 2kz4 h PRO 81 Cb 0.00 0.00 -0.26 0.00 0.13 0.00 0.00 31.00 30.87 2kz4 h PRO 81 CO 0.00 0.00 -0.80 1.28 -0.23 0.00 0.00 178.00 178.25 2kz4 n LEU 82 N -2.48 2.78 -4.56 1.56 4.77 -1.26 -5.04 117.00 112.77 2kz4 n LEU 82 Ca 0.01 -3.60 -0.26 0.00 -0.03 0.00 0.00 56.01 52.13 2kz4 n LEU 82 Cb 0.20 -0.21 -0.05 0.00 -2.33 0.00 0.00 43.42 41.04 2kz4 n LEU 82 CO 0.20 1.35 1.47 0.00 -1.33 0.00 0.00 177.39 179.07 2kz4 s ALA 83 N -2.75 1.40 0.00 -1.18 0.00 -1.06 -1.29 121.76 116.87 2kz4 s ALA 83 Ca 0.39 -0.85 0.00 0.00 0.00 0.00 0.00 51.96 51.50 2kz4 s ALA 83 Cb 0.38 -4.48 0.00 0.00 0.00 0.00 0.00 23.12 19.01 2kz4 s ALA 83 CO -0.06 -4.99 0.00 0.41 0.00 0.00 0.00 175.76 171.12 2kz4 n GLY 84 N 6.50 1.02 3.89 0.00 0.00 -0.05 -4.93 105.19 111.63 2kz4 n GLY 84 Ca 0.39 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 46.09 2kz4 n GLY 84 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2kz4 s ARG 85 N 0.00 3.62 -0.45 1.61 3.52 -0.41 -4.94 118.95 121.90 2kz4 s ARG 85 Ca 0.00 -0.07 -0.08 0.00 -0.13 0.00 0.00 55.73 55.45 2kz4 s ARG 85 Cb 0.00 -2.87 0.11 0.00 -1.56 0.00 0.00 34.95 30.63 2kz4 s ARG 85 CO 0.00 0.48 0.30 0.54 -0.81 0.00 0.00 175.30 175.81 2kz4 s VAL 86 N -1.62 4.01 -0.04 7.11 0.11 -1.26 -1.81 120.40 126.90 2kz4 s VAL 86 Ca 0.40 -1.76 -0.23 0.00 -2.93 0.00 0.00 61.98 57.45 2kz4 s VAL 86 Cb -0.12 -3.62 -0.04 0.00 -1.53 0.00 0.00 36.38 31.07 2kz4 s VAL 86 CO 0.24 -0.70 0.70 -0.76 -3.33 0.00 0.00 175.10 171.25 2kz4 s LEU 87 N 1.33 4.35 -0.04 2.54 2.01 -0.25 -2.69 118.68 125.93 2kz4 s LEU 87 Ca 0.06 1.23 -0.02 0.00 0.01 0.00 0.00 54.13 55.40 2kz4 s LEU 87 Cb -0.25 -3.09 -0.04 0.00 0.01 0.00 0.00 46.19 42.82 2kz4 s LEU 87 CO -0.01 -0.07 0.08 0.20 1.01 0.00 0.00 176.35 177.56 2kz4 s ASN 88 N 0.57 5.77 -0.52 2.29 0.02 -0.35 -0.30 114.94 122.43 2kz4 s ASN 88 Ca 0.37 0.21 -0.29 0.00 -1.02 0.00 0.00 52.86 52.14 2kz4 s ASN 88 Cb -0.18 -1.70 0.03 0.00 0.02 0.00 0.00 41.25 39.41 2kz4 s ASN 88 CO 0.19 0.31 1.19 -0.63 0.02 0.00 0.00 177.10 178.18 2kz4 s ILE 89 N -1.12 4.09 -1.38 0.60 1.01 -1.26 -1.16 121.20 121.97 2kz4 s ILE 89 Ca 0.20 1.06 -0.07 0.00 0.00 0.00 0.00 60.65 61.85 2kz4 s ILE 89 Cb -0.12 -4.62 0.05 0.00 0.01 0.00 0.00 42.46 37.78 2kz4 s ILE 89 CO 0.11 -1.13 2.57 2.30 0.00 0.00 0.00 174.94 178.79 2kz4 n ILE 90 N 6.81 4.93 0.00 2.92 -5.35 -1.23 -4.82 119.36 122.61 2kz4 n ILE 90 Ca 0.11 -3.77 0.00 0.00 -0.27 0.00 0.00 62.75 58.82 2kz4 n ILE 90 Cb 0.49 -2.22 0.00 0.00 -1.74 0.00 0.00 39.64 36.17 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 2.25 -0.28 3.22 3.28 0.00 -1.26 -4.90 105.19 107.51 2kz4 n GLY 91 Ca 0.67 -0.89 -0.26 0.00 0.00 0.00 0.00 46.02 45.53 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 -2.00 1.57 0.25 1.61 -2.07 -1.26 -4.66 119.66 113.10 2kz4 s GLN 92 Ca 0.00 -0.79 -0.31 0.00 -1.82 0.00 0.00 55.36 52.44 2kz4 s GLN 92 Cb 0.00 -1.57 -0.13 0.00 -1.09 0.00 0.00 33.01 30.22 2kz4 s GLN 92 CO 0.00 0.42 1.48 -0.35 -1.32 0.00 0.00 175.29 175.52 2kz4 n PRO 93 N 2.37 2.28 -3.91 9.60 -0.04 -1.26 -4.83 135.00 139.20 2kz4 n PRO 93 Ca -0.16 0.81 -0.34 0.00 -0.04 0.00 0.00 63.50 63.77 2kz4 n PRO 93 Cb 0.53 -2.52 -0.14 0.00 -0.04 0.00 0.00 33.50 31.34 2kz4 n PRO 93 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 2kz4 s LEU 94 N -0.05 4.18 0.60 1.53 1.98 -0.67 -5.01 118.68 121.24 2kz4 s LEU 94 Ca 0.67 -1.51 -0.18 0.00 -2.89 0.00 0.00 54.13 50.22 2kz4 s LEU 94 Cb -0.60 -1.71 -0.03 0.00 0.66 0.00 0.00 46.19 44.51 2kz4 s LEU 94 CO 0.49 -0.32 1.13 -2.16 -1.89 0.00 0.00 176.35 173.60 2kz4 s PRO 95 N 1.18 3.09 0.94 0.98 0.04 -1.26 -0.35 135.00 139.62 2kz4 s PRO 95 Ca -0.02 1.55 -0.15 0.00 0.04 0.00 0.00 61.00 62.43 2kz4 s PRO 95 Cb -0.20 -1.97 0.20 0.00 0.04 0.00 0.00 34.50 32.56 2kz4 s PRO 95 CO -0.03 -1.05 1.30 0.16 0.04 0.00 0.00 177.00 177.42 2kz4 s ASP 96 N -2.07 3.19 0.37 6.66 -4.77 -1.07 -4.82 116.67 114.16 2kz4 s ASP 96 Ca 0.71 0.20 0.12 0.00 -3.30 0.00 0.00 52.55 50.28 2kz4 s ASP 96 Cb -0.23 -0.26 0.71 0.00 -1.09 0.00 0.00 42.92 42.05 2kz4 s ASP 96 CO 0.33 -2.67 1.83 0.00 0.70 0.00 0.00 175.17 175.35 2kz4 h ALA 97 N -1.56 1.38 0.00 2.11 0.00 -1.97 -2.53 119.26 116.69 2kz4 h ALA 97 Ca -0.44 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.14 2kz4 h ALA 97 Cb 1.23 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.96 2kz4 h ALA 97 CO 0.38 0.46 -0.64 0.00 0.00 0.00 0.00 179.25 179.44 2kz4 n ALA 98 N -2.47 3.20 -2.83 0.00 0.00 -1.26 -4.96 120.51 112.19 2kz4 n ALA 98 Ca -0.02 -0.31 -0.21 0.00 0.00 0.00 0.00 53.44 52.91 2kz4 n ALA 98 Cb 0.40 -1.13 0.01 0.00 0.00 0.00 0.00 19.45 18.74 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 -1.88 -3.56 0.00 0.00 3.00 -0.95 -4.89 116.66 108.38 2kz4 n ARG 99 Ca 0.04 0.85 0.12 0.00 -0.01 0.00 0.00 57.85 58.85 2kz4 n ARG 99 Cb 0.40 -5.62 0.23 0.00 0.00 0.00 0.00 32.46 27.48 2kz4 n ARG 99 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.63 175.26 2kz4 n THR 100 N -4.19 0.00 -3.75 0.55 5.66 -1.26 -4.80 114.28 106.49 2kz4 n THR 100 Ca -0.14 -0.07 -0.07 0.00 -3.05 0.00 0.00 64.05 60.71 2kz4 n THR 100 Cb 0.63 0.48 -0.02 0.00 -1.55 0.00 0.00 70.33 69.87 2kz4 n THR 100 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2kz4 s ARG 101 N -2.76 1.57 -0.28 1.09 1.70 -1.26 -3.36 118.95 115.65 2kz4 s ARG 101 Ca 0.16 -0.82 0.01 0.00 -0.47 0.00 0.00 55.73 54.62 2kz4 s ARG 101 Cb 0.18 0.57 0.06 0.00 -0.57 0.00 0.00 34.95 35.18 2kz4 s ARG 101 CO 0.64 -0.71 -0.06 -1.17 -1.08 0.00 0.00 175.30 172.92 2kz4 s LEU 102 N -2.88 3.70 -0.54 -1.89 1.98 -0.18 -2.59 118.68 116.28 2kz4 s LEU 102 Ca 0.09 -1.40 -0.29 0.00 -2.89 0.00 0.00 54.13 49.65 2kz4 s LEU 102 Cb -0.04 -1.61 0.03 0.00 0.66 0.00 0.00 46.19 45.22 2kz4 s LEU 102 CO 0.02 -0.23 1.18 -0.70 -1.89 0.00 0.00 176.35 174.73 2kz4 s GLU 103 N 1.14 3.59 -0.38 1.98 2.12 0.52 -2.01 118.70 125.67 2kz4 s GLU 103 Ca -0.06 0.37 -0.16 0.00 0.36 0.00 0.00 54.97 55.48 2kz4 s GLU 103 Cb -0.20 -3.98 0.01 0.00 0.26 0.00 0.00 34.13 30.22 2kz4 s GLU 103 CO -0.04 -1.58 0.37 0.42 -0.54 0.00 0.00 175.26 173.90 2kz4 s ILE 104 N 4.79 5.16 0.09 -3.70 -1.09 0.18 -1.67 121.20 124.96 2kz4 s ILE 104 Ca 0.45 -0.24 -0.27 0.00 -2.23 0.00 0.00 60.65 58.36 2kz4 s ILE 104 Cb -0.07 -3.91 -0.06 0.00 -1.58 0.00 0.00 42.46 36.83 2kz4 s ILE 104 CO 0.28 -0.25 0.86 -1.48 -1.23 0.00 0.00 174.94 173.12 2kz4 s LEU 105 N 1.99 4.49 0.31 2.97 2.34 -1.26 -0.80 118.68 128.71 2kz4 s LEU 105 Ca 0.10 1.63 -0.06 0.00 0.06 0.00 0.00 54.13 55.87 2kz4 s LEU 105 Cb -0.17 -3.41 -0.00 0.00 -0.56 0.00 0.00 46.19 42.05 2kz4 s LEU 105 CO 0.12 -0.01 0.46 0.00 -1.06 0.00 0.00 176.35 175.87 2kz4 s ARG 107 N -3.38 1.03 -0.12 0.00 3.52 -0.31 -1.04 118.95 118.65 2kz4 s ARG 107 Ca 0.28 -0.92 -0.40 0.00 -0.13 0.00 0.00 55.73 54.57 2kz4 s ARG 107 Cb -0.00 0.41 -0.17 0.00 -1.56 0.00 0.00 34.95 33.62 2kz4 s ARG 107 CO 0.16 -0.37 1.44 -1.91 -0.81 0.00 0.00 175.30 173.81 2kz4 n GLU 108 N -0.17 0.77 -0.78 5.12 0.00 -1.26 -1.21 120.64 123.12 2kz4 n GLU 108 Ca -0.13 0.28 -0.15 0.00 0.00 0.00 0.00 57.16 57.16 2kz4 n GLU 108 Cb 0.63 -1.89 0.05 0.00 0.00 0.00 0.00 31.44 30.23 2kz4 n GLU 108 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2kz4 n GLY 109 N 3.02 3.78 2.88 8.31 0.00 -1.09 -4.73 105.19 117.35 2kz4 n GLY 109 Ca 0.23 -0.89 -0.16 0.00 0.00 0.00 0.00 46.02 45.20 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 0.16 -0.85 -2.42 4.61 0.00 -1.26 -4.92 120.51 115.82 2kz4 n ALA 110 Ca 0.29 0.27 -0.37 0.00 0.00 0.00 0.00 53.44 53.62 2kz4 n ALA 110 Cb 0.73 -3.75 -0.03 0.00 0.00 0.00 0.00 19.45 16.39 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 -5.80 3.33 0.00 0.00 2.02 -1.26 -5.21 118.70 111.78 2kz4 s GLU 111 Ca 0.37 -0.96 0.00 0.00 0.02 0.00 0.00 54.97 54.40 2kz4 s GLU 111 Cb -0.16 -5.29 0.00 0.00 0.10 0.00 0.00 34.13 28.78 2kz4 s GLU 111 CO 0.46 -2.54 0.05 0.36 0.02 0.00 0.00 175.26 173.60