#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 4.68 -0.03 7.83 3.84 -1.26 -4.92 114.94 125.08 2kz4 s ASN 2 Ca 0.00 2.57 0.00 0.00 0.21 0.00 0.00 52.86 55.64 2kz4 s ASN 2 Cb 0.00 -2.61 0.03 0.00 -0.55 0.00 0.00 41.25 38.12 2kz4 s ASN 2 CO 0.00 -1.95 1.44 2.30 -2.79 0.00 0.00 177.10 176.09 2kz4 n ILE 3 N -1.90 1.52 -1.20 -5.21 -5.35 -1.26 -4.70 119.36 101.25 2kz4 n ILE 3 Ca 0.15 -0.32 -0.18 0.00 -0.27 0.00 0.00 62.75 62.13 2kz4 n ILE 3 Cb 0.49 -1.18 -0.12 0.00 -1.74 0.00 0.00 39.64 37.08 2kz4 n ILE 3 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2kz4 n GLY 4 N 0.79 3.54 3.41 3.28 0.00 -1.26 -4.81 105.19 110.14 2kz4 n GLY 4 Ca 0.03 -1.47 -0.11 0.00 0.00 0.00 0.00 46.02 44.47 2kz4 n GLY 4 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2kz4 s ARG 5 N -0.00 1.44 -0.22 1.61 1.70 -1.26 -5.10 118.95 117.11 2kz4 s ARG 5 Ca 0.64 -1.47 -0.01 0.00 -0.47 0.00 0.00 55.73 54.41 2kz4 s ARG 5 Cb 0.34 0.38 0.01 0.00 -0.57 0.00 0.00 34.95 35.11 2kz4 s ARG 5 CO -0.08 -0.55 -0.10 -0.51 -1.08 0.00 0.00 175.30 172.98 2kz4 s LEU 6 N -3.11 2.81 0.00 -1.89 1.43 -1.26 -4.53 118.68 112.13 2kz4 s LEU 6 Ca 0.31 -0.68 0.00 0.00 -1.03 0.00 0.00 54.13 52.73 2kz4 s LEU 6 Cb 0.03 -1.63 0.00 0.00 0.03 0.00 0.00 46.19 44.62 2kz4 s LEU 6 CO 0.12 -0.06 0.00 -2.11 0.23 0.00 0.00 176.35 174.53 2kz4 n ARG 7 N 4.69 3.05 -1.97 1.70 1.85 -0.37 -4.86 116.66 120.74 2kz4 n ARG 7 Ca -0.18 0.00 -0.09 0.00 -1.00 0.00 0.00 57.85 56.58 2kz4 n ARG 7 Cb 0.49 -0.92 0.02 0.00 -1.05 0.00 0.00 32.46 31.00 2kz4 n ARG 7 CO 0.00 0.00 0.00 -0.25 -0.01 0.00 0.00 177.63 177.37 2kz4 n ASP 8 N -1.70 1.07 -3.97 2.89 8.00 0.78 -4.98 116.55 118.64 2kz4 n ASP 8 Ca 0.00 -1.69 -0.15 0.00 0.71 0.00 0.00 54.79 53.66 2kz4 n ASP 8 Cb 0.37 -0.15 -0.14 0.00 -0.02 0.00 0.00 41.12 41.18 2kz4 n ASP 8 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 2kz4 s ARG 9 N -3.11 0.41 0.21 -1.24 0.52 -1.22 -1.97 118.95 112.56 2kz4 s ARG 9 Ca 0.24 -0.30 0.02 0.00 -0.52 0.00 0.00 55.73 55.17 2kz4 s ARG 9 Cb -0.02 -0.34 -0.05 0.00 0.52 0.00 0.00 34.95 35.06 2kz4 s ARG 9 CO 0.15 0.09 0.02 0.96 0.02 0.00 0.00 175.30 176.54 2kz4 s ILE 10 N -0.39 0.75 -0.03 1.52 -4.36 -0.78 -1.49 121.20 116.41 2kz4 s ILE 10 Ca -0.01 -2.00 0.02 0.00 -0.26 0.00 0.00 60.65 58.40 2kz4 s ILE 10 Cb -0.04 -2.30 0.01 0.00 1.25 0.00 0.00 42.46 41.38 2kz4 s ILE 10 CO -0.00 -0.32 -0.08 -0.89 0.24 0.00 0.00 174.94 173.89 2kz4 s THR 11 N -3.61 0.72 -0.32 8.37 2.01 0.87 -0.75 115.64 122.93 2kz4 s THR 11 Ca 0.28 -0.31 -0.27 0.00 0.31 0.00 0.00 61.69 61.70 2kz4 s THR 11 Cb 0.06 -0.65 0.01 0.00 0.01 0.00 0.00 72.50 71.93 2kz4 s THR 11 CO 0.07 0.23 0.99 -0.63 -0.69 0.00 0.00 174.62 174.60 2kz4 s ILE 12 N 0.30 4.58 -0.56 1.82 -1.09 -1.06 -1.45 121.20 123.76 2kz4 s ILE 12 Ca -0.05 1.57 -0.22 0.00 -2.23 0.00 0.00 60.65 59.72 2kz4 s ILE 12 Cb -0.09 -4.35 0.06 0.00 -1.58 0.00 0.00 42.46 36.50 2kz4 s ILE 12 CO 0.00 -0.43 0.82 -1.10 -1.23 0.00 0.00 174.94 173.01 2kz4 s GLN 13 N 3.47 3.20 0.18 2.79 -0.21 -0.28 -1.06 119.66 127.75 2kz4 s GLN 13 Ca 0.42 -0.66 -0.27 0.00 0.02 0.00 0.00 55.36 54.87 2kz4 s GLN 13 Cb -0.13 -4.11 -0.08 0.00 1.00 0.00 0.00 33.01 29.69 2kz4 s GLN 13 CO 0.15 -1.46 0.85 0.99 -2.12 0.00 0.00 175.29 173.70 2kz4 s THR 14 N 3.42 4.29 -0.68 -0.19 2.01 -0.68 -2.20 115.64 121.61 2kz4 s THR 14 Ca 0.22 1.86 -0.21 0.00 0.31 0.00 0.00 61.69 63.87 2kz4 s THR 14 Cb -0.16 -4.22 0.08 0.00 0.01 0.00 0.00 72.50 68.21 2kz4 s THR 14 CO 0.14 0.49 0.94 -0.22 -0.69 0.00 0.00 174.62 175.28 2kz4 s LEU 15 N -1.03 4.66 -0.75 4.42 2.96 -1.26 -1.42 118.68 126.26 2kz4 s LEU 15 Ca 0.38 -1.22 -0.27 0.00 -0.22 0.00 0.00 54.13 52.81 2kz4 s LEU 15 Cb -0.24 -2.39 0.03 0.00 0.50 0.00 0.00 46.19 44.08 2kz4 s LEU 15 CO 0.28 -1.33 1.34 -0.75 -1.32 0.00 0.00 176.35 174.57 2kz4 s LYS 16 N 3.62 3.17 -1.15 1.98 2.20 0.57 -4.86 119.74 125.27 2kz4 s LYS 16 Ca 0.22 -0.23 -0.10 0.00 -0.36 0.00 0.00 55.97 55.49 2kz4 s LYS 16 Cb -0.17 -4.28 0.25 0.00 -1.51 0.00 0.00 37.83 32.12 2kz4 s LYS 16 CO 0.07 -2.20 1.25 1.04 -0.36 0.00 0.00 175.35 175.14 2kz4 n GLN 17 N 9.33 3.54 -3.61 4.03 6.02 -1.26 -1.34 117.38 134.09 2kz4 n GLN 17 Ca 0.06 -4.25 -0.37 0.00 -0.01 0.00 0.00 57.00 52.43 2kz4 n GLN 17 Cb 0.49 -2.71 -0.09 0.00 1.02 0.00 0.00 30.24 28.96 2kz4 n GLN 17 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 2kz4 s THR 18 N -0.44 5.33 0.72 5.09 2.01 -0.92 -4.81 115.64 122.61 2kz4 s THR 18 Ca 0.35 0.31 -0.11 0.00 0.31 0.00 0.00 61.69 62.55 2kz4 s THR 18 Cb -0.07 -3.55 0.02 0.00 0.01 0.00 0.00 72.50 68.91 2kz4 s THR 18 CO -0.04 0.34 1.07 -0.60 -0.69 0.00 0.00 174.62 174.70 2kz4 s ARG 19 N 0.98 2.75 0.33 4.92 3.52 -1.26 -1.12 118.95 129.07 2kz4 s ARG 19 Ca 0.11 0.74 0.09 0.00 -0.13 0.00 0.00 55.73 56.53 2kz4 s ARG 19 Cb -0.13 -1.99 -0.05 0.00 -1.56 0.00 0.00 34.95 31.22 2kz4 s ARG 19 CO 0.04 -1.17 0.07 0.34 -0.81 0.00 0.00 175.30 173.77 2kz4 s ASP 20 N -3.99 4.45 0.29 -2.12 -1.08 -0.09 -4.88 116.67 109.25 2kz4 s ASP 20 Ca 0.58 -0.85 0.22 0.00 -0.52 0.00 0.00 52.55 51.98 2kz4 s ASP 20 Cb -0.13 -0.66 1.08 0.00 -1.46 0.00 0.00 42.92 41.75 2kz4 s ASP 20 CO 0.54 -0.24 1.66 0.00 0.52 0.00 0.00 175.17 177.66 2kz4 n ILE 21 N -1.04 0.99 -0.01 4.11 3.06 -1.26 -1.86 119.36 123.35 2kz4 n ILE 21 Ca -0.04 0.56 0.10 0.00 -2.50 0.00 0.00 62.75 60.87 2kz4 n ILE 21 Cb 0.61 -1.53 -0.17 0.00 0.54 0.00 0.00 39.64 39.10 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 -2.23 0.02 -0.01 9.51 -2.24 -1.26 -5.00 114.28 113.07 2kz4 n THR 22 Ca -0.00 -0.49 0.00 0.00 -2.27 0.00 0.00 64.05 61.29 2kz4 n THR 22 Cb 0.10 0.01 0.00 0.00 -2.10 0.00 0.00 70.33 68.34 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 1.30 1.00 3.89 3.38 0.00 -0.78 -5.12 105.19 108.87 2kz4 n GLY 23 Ca -0.04 -0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.64 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 -0.03 3.57 -0.55 1.61 0.41 -1.26 -4.83 118.70 117.63 2kz4 s GLU 24 Ca 0.00 -0.14 -0.17 0.00 -0.41 0.00 0.00 54.97 54.26 2kz4 s GLU 24 Cb 0.00 -3.02 0.12 0.00 -1.78 0.00 0.00 34.13 29.45 2kz4 s GLU 24 CO 0.00 0.60 0.54 0.42 -0.49 0.00 0.00 175.26 176.33 2kz4 s ILE 25 N -1.42 5.12 -0.93 -1.63 -1.09 -1.26 -0.91 121.20 119.09 2kz4 s ILE 25 Ca 0.32 -1.36 -0.22 0.00 -2.23 0.00 0.00 60.65 57.16 2kz4 s ILE 25 Cb -0.13 -4.36 0.07 0.00 -1.58 0.00 0.00 42.46 36.46 2kz4 s ILE 25 CO 0.20 -0.91 1.30 -0.76 -1.23 0.00 0.00 174.94 173.53 2kz4 s LEU 26 N 1.85 3.97 -0.56 2.97 2.01 -0.28 -4.89 118.68 123.75 2kz4 s LEU 26 Ca 0.05 -1.45 -0.27 0.00 0.01 0.00 0.00 54.13 52.47 2kz4 s LEU 26 Cb -0.28 -2.51 0.03 0.00 0.01 0.00 0.00 46.19 43.44 2kz4 s LEU 26 CO 0.04 -1.42 1.08 -1.61 1.01 0.00 0.00 176.35 175.45 2kz4 s GLU 27 N 4.35 3.45 0.28 1.70 2.02 -1.26 -2.17 118.70 127.08 2kz4 s GLU 27 Ca 0.39 0.06 0.06 0.00 0.02 0.00 0.00 54.97 55.50 2kz4 s GLU 27 Cb -0.04 -4.02 -0.06 0.00 0.10 0.00 0.00 34.13 30.11 2kz4 s GLU 27 CO -0.05 -1.58 -0.04 0.95 0.02 0.00 0.00 175.26 174.56 2kz4 s THR 28 N 4.51 1.58 -0.37 3.63 -4.23 -0.45 -4.96 115.64 115.35 2kz4 s THR 28 Ca 0.38 -2.10 -0.01 0.00 -1.18 0.00 0.00 61.69 58.77 2kz4 s THR 28 Cb -0.09 -2.49 0.09 0.00 1.34 0.00 0.00 72.50 71.34 2kz4 s THR 28 CO 0.23 -0.26 0.12 0.26 -0.54 0.00 0.00 174.62 174.43 2kz4 s TRP 29 N -3.05 3.53 -0.22 3.99 0.52 -1.26 -0.32 118.94 122.13 2kz4 s TRP 29 Ca 0.30 -2.37 -0.22 0.00 0.02 0.00 0.00 56.10 53.83 2kz4 s TRP 29 Cb 0.04 -2.87 -0.02 0.00 -1.15 0.00 0.00 33.47 29.48 2kz4 s TRP 29 CO 0.12 -0.92 0.72 -1.83 0.02 0.00 0.00 176.95 175.06 2kz4 s GLU 30 N 1.13 4.19 0.12 4.98 -1.05 -0.51 -4.91 118.70 122.66 2kz4 s GLU 30 Ca 0.05 0.76 -0.32 0.00 -0.15 0.00 0.00 54.97 55.31 2kz4 s GLU 30 Cb -0.21 -3.62 -0.12 0.00 -0.44 0.00 0.00 34.13 29.75 2kz4 s GLU 30 CO -0.04 -0.38 1.78 -3.47 0.95 0.00 0.00 175.26 174.10 2kz4 n ASP 31 N 5.53 3.82 0.00 0.83 2.03 -1.26 -1.68 116.55 125.81 2kz4 n ASP 31 Ca 0.02 1.01 0.00 0.00 0.52 0.00 0.00 54.79 56.34 2kz4 n ASP 31 Cb 0.49 -1.51 0.00 0.00 -0.72 0.00 0.00 41.12 39.37 2kz4 n ASP 31 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2kz4 n GLY 32 N 4.07 0.78 3.24 0.27 0.00 -0.22 -4.94 105.19 108.39 2kz4 n GLY 32 Ca 0.18 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.89 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 2.28 2.41 -0.52 1.61 3.76 -1.26 -4.90 115.29 118.67 2kz4 s HIS 33 Ca 0.00 -0.80 -0.25 0.00 -0.15 0.00 0.00 55.06 53.86 2kz4 s HIS 33 Cb 0.00 -1.59 0.03 0.00 1.11 0.00 0.00 32.58 32.13 2kz4 s HIS 33 CO 0.00 -0.27 0.96 0.99 -0.85 0.00 0.00 174.74 175.56 2kz4 s THR 34 N 0.01 4.39 0.33 1.30 2.01 -1.26 -2.56 115.64 119.85 2kz4 s THR 34 Ca -0.08 0.51 0.08 0.00 0.31 0.00 0.00 61.69 62.51 2kz4 s THR 34 Cb -0.15 -4.52 -0.03 0.00 0.01 0.00 0.00 72.50 67.81 2kz4 s THR 34 CO 0.05 -1.03 0.23 -1.48 -0.69 0.00 0.00 174.62 171.70 2kz4 s LEU 35 N 3.96 3.50 0.05 4.42 2.34 0.07 -4.91 118.68 128.12 2kz4 s LEU 35 Ca 0.34 -0.57 -0.30 0.00 0.06 0.00 0.00 54.13 53.66 2kz4 s LEU 35 Cb -0.11 -2.06 -0.05 0.00 -0.56 0.00 0.00 46.19 43.41 2kz4 s LEU 35 CO 0.22 -0.30 1.13 0.26 -1.06 0.00 0.00 176.35 176.61 2kz4 s TRP 36 N -2.33 3.51 0.24 3.48 0.23 -1.26 -1.87 118.94 120.93 2kz4 s TRP 36 Ca 0.39 1.43 -0.00 0.00 -2.03 0.00 0.00 56.10 55.89 2kz4 s TRP 36 Cb -0.05 -3.33 0.00 0.00 0.03 0.00 0.00 33.47 30.12 2kz4 s TRP 36 CO 0.25 -0.89 0.31 0.00 0.96 0.00 0.00 176.95 177.58 2kz4 n ALA 37 N 3.81 -0.12 -3.71 0.98 0.00 -0.83 -4.66 120.51 115.99 2kz4 n ALA 37 Ca 0.08 -1.13 -0.29 0.00 0.00 0.00 0.00 53.44 52.10 2kz4 n ALA 37 Cb 0.48 0.91 -0.16 0.00 0.00 0.00 0.00 19.45 20.68 2kz4 n ALA 37 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2kz4 s SER 38 N -2.49 3.48 -0.32 0.00 0.01 -0.11 -0.16 113.70 114.12 2kz4 s SER 38 Ca 0.21 -1.23 -0.09 0.00 1.31 0.00 0.00 55.95 56.14 2kz4 s SER 38 Cb -0.00 -0.67 0.00 0.00 0.21 0.00 0.00 66.02 65.56 2kz4 s SER 38 CO 0.15 -0.37 0.14 0.54 0.41 0.00 0.00 173.24 174.11 2kz4 s VAL 39 N 1.79 4.40 0.06 3.43 0.11 -1.26 -1.72 120.40 127.20 2kz4 s VAL 39 Ca 0.05 -0.58 0.02 0.00 -2.93 0.00 0.00 61.98 58.53 2kz4 s VAL 39 Cb -0.17 -3.29 -0.03 0.00 -1.53 0.00 0.00 36.38 31.36 2kz4 s VAL 39 CO -0.20 0.02 -0.07 0.20 -3.33 0.00 0.00 175.10 171.72 2kz4 s ASN 40 N 1.57 0.93 0.07 3.54 0.01 -0.22 -4.40 114.94 116.43 2kz4 s ASN 40 Ca 0.03 -0.71 -0.24 0.00 -0.71 0.00 0.00 52.86 51.23 2kz4 s ASN 40 Cb -0.17 0.06 -0.06 0.00 0.41 0.00 0.00 41.25 41.49 2kz4 s ASN 40 CO 0.05 -0.30 0.74 -0.04 -1.51 0.00 0.00 177.10 176.04 2kz4 s MET 41 N -2.40 4.48 0.27 -0.60 -1.94 -1.26 -0.17 119.30 117.68 2kz4 s MET 41 Ca -0.02 1.04 -0.29 0.00 -1.71 0.00 0.00 55.69 54.71 2kz4 s MET 41 Cb -0.04 -3.33 -0.10 0.00 2.01 0.00 0.00 34.83 33.37 2kz4 s MET 41 CO -0.02 0.39 1.30 0.14 -0.01 0.00 0.00 175.02 176.82 2kz4 s VAL 42 N -0.41 2.96 0.26 -6.03 -7.23 -0.01 -4.83 120.40 105.10 2kz4 s VAL 42 Ca 0.37 0.88 0.02 0.00 -1.81 0.00 0.00 61.98 61.44 2kz4 s VAL 42 Cb -0.21 -3.56 0.05 0.00 0.56 0.00 0.00 36.38 33.22 2kz4 s VAL 42 CO 0.23 0.17 0.36 -1.20 -0.31 0.00 0.00 175.10 174.35 2kz4 n SER 43 N 1.66 0.75 -0.17 4.85 7.64 -1.26 -4.07 113.62 123.02 2kz4 n SER 43 Ca 0.03 -1.57 0.15 0.00 1.01 0.00 0.00 58.87 58.49 2kz4 n SER 43 Cb 0.42 -0.21 0.49 0.00 -1.01 0.00 0.00 64.21 63.91 2kz4 n SER 43 CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 2kz4 h SER 44 N -0.06 0.41 -0.25 6.43 4.64 -1.96 -2.15 113.55 120.60 2kz4 h SER 44 Ca -0.12 0.02 0.06 0.00 -0.47 0.00 0.00 61.79 61.29 2kz4 h SER 44 Cb 0.50 -0.06 -0.07 0.00 -0.31 0.00 0.00 62.40 62.46 2kz4 h SER 44 CO 0.15 0.22 -0.22 0.50 -0.87 0.00 0.00 176.83 176.61 2kz4 h LYS 45 N 0.44 -0.20 -0.35 4.77 3.64 -1.95 -0.54 116.57 122.38 2kz4 h LYS 45 Ca 0.37 0.01 -0.13 0.00 -1.27 0.00 0.00 60.65 59.63 2kz4 h LYS 45 Cb 0.81 0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.67 2kz4 h LYS 45 CO -0.12 -0.14 -0.29 0.93 -2.27 0.00 0.00 179.45 177.56 2kz4 h GLU 46 N -0.21 0.81 -0.45 1.90 4.39 -1.66 -1.70 114.58 117.65 2kz4 h GLU 46 Ca 0.14 -0.41 0.06 0.00 0.34 0.00 0.00 59.36 59.49 2kz4 h GLU 46 Cb 0.43 0.01 -0.05 0.00 -0.10 0.00 0.00 28.75 29.03 2kz4 h GLU 46 CO -0.38 1.04 0.16 0.00 -1.16 0.00 0.00 179.01 178.67 2kz4 h ALA 47 N 0.75 0.54 -0.16 3.43 0.00 -0.74 -1.11 119.26 121.97 2kz4 h ALA 47 Ca 0.06 0.06 -0.12 0.00 0.00 0.00 0.00 54.91 54.91 2kz4 h ALA 47 Cb 0.87 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.68 2kz4 h ALA 47 CO 0.08 -0.23 -0.41 0.82 0.00 0.00 0.00 179.25 179.51 2kz4 h ILE 48 N 0.33 1.31 -0.14 0.00 2.04 -1.04 -0.78 117.51 119.23 2kz4 h ILE 48 Ca 0.21 -1.55 -0.11 0.00 1.00 0.00 0.00 64.86 64.41 2kz4 h ILE 48 Cb 0.21 1.64 0.00 0.00 -0.74 0.00 0.00 36.82 37.93 2kz4 h ILE 48 CO -0.22 0.47 -0.35 -1.28 0.00 0.00 0.00 178.15 176.78 2kz4 h SER 49 N 0.30 0.56 -0.04 1.72 0.87 -0.93 -3.32 113.55 112.71 2kz4 h SER 49 Ca 0.03 -0.58 0.00 0.00 -1.23 0.00 0.00 61.79 60.01 2kz4 h SER 49 Cb 0.86 -0.16 0.00 0.00 -0.44 0.00 0.00 62.40 62.65 2kz4 h SER 49 CO 0.07 1.03 0.00 -1.54 -0.53 0.00 0.00 176.83 175.86 2kz4 n SER 50 N -4.34 2.60 0.00 6.23 3.41 -0.45 -5.02 113.62 116.04 2kz4 n SER 50 Ca -0.07 -1.79 0.00 0.00 -0.26 0.00 0.00 58.87 56.75 2kz4 n SER 50 Cb 0.51 -0.01 0.00 0.00 -0.26 0.00 0.00 64.21 64.44 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 1.06 2.10 0.00 5.00 0.00 -0.30 -3.37 105.19 109.69 2kz4 n GLY 51 Ca 0.11 -0.22 0.00 0.00 0.00 0.00 0.00 46.02 45.92 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 0.00 0.05 4.61 0.00 -1.26 -4.66 120.51 119.25 2kz4 n ALA 52 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.31 2kz4 n ALA 52 Cb 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.37 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 -0.09 -2.29 0.00 4.81 -1.87 -3.23 114.58 111.90 2kz4 h GLU 53 Ca 0.00 0.01 -0.69 0.00 -0.13 0.00 0.00 59.36 58.55 2kz4 h GLU 53 Cb 0.37 0.02 -0.35 0.00 0.63 0.00 0.00 28.75 29.42 2kz4 h GLU 53 CO 0.00 0.17 0.10 1.28 -0.73 0.00 0.00 179.01 179.83 2kz4 n LEU 54 N -5.01 5.72 -4.86 1.64 4.77 -1.26 -4.99 117.00 113.01 2kz4 n LEU 54 Ca -0.08 -5.54 -0.32 0.00 -0.03 0.00 0.00 56.01 50.04 2kz4 n LEU 54 Cb 0.17 -0.84 -0.02 0.00 -2.33 0.00 0.00 43.42 40.40 2kz4 n LEU 54 CO 0.33 2.20 0.68 0.00 -1.33 0.00 0.00 177.39 179.26 2kz4 s ALA 55 N -3.77 3.10 0.05 -1.18 0.00 -1.22 -1.25 121.76 117.49 2kz4 s ALA 55 Ca 0.44 0.05 -0.30 0.00 0.00 0.00 0.00 51.96 52.14 2kz4 s ALA 55 Cb 0.23 -3.07 -0.08 0.00 0.00 0.00 0.00 23.12 20.19 2kz4 s ALA 55 CO -0.12 -0.39 1.78 0.42 0.00 0.00 0.00 175.76 177.45 2kz4 s ILE 56 N -2.82 3.00 0.00 0.00 1.01 -1.26 -1.41 121.20 119.72 2kz4 s ILE 56 Ca 0.57 0.29 0.00 0.00 0.00 0.00 0.00 60.65 61.51 2kz4 s ILE 56 Cb -0.10 -3.18 0.00 0.00 0.01 0.00 0.00 42.46 39.18 2kz4 s ILE 56 CO 0.40 -0.01 0.00 0.61 0.00 0.00 0.00 174.94 175.94 2kz4 n GLY 57 N 4.23 1.60 3.75 6.18 0.00 -1.26 -5.09 105.19 114.60 2kz4 n GLY 57 Ca 0.18 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.80 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 -2.05 4.08 -0.26 2.61 2.01 -0.50 -2.61 115.64 118.91 2kz4 s THR 58 Ca 0.00 2.05 -0.05 0.00 0.31 0.00 0.00 61.69 64.00 2kz4 s THR 58 Cb 0.00 -4.31 0.01 0.00 0.01 0.00 0.00 72.50 68.21 2kz4 s THR 58 CO 0.00 0.47 0.02 -0.69 -0.69 0.00 0.00 174.62 173.73 2kz4 s VAL 59 N -1.06 3.59 -0.07 3.82 1.01 0.24 -0.83 120.40 127.10 2kz4 s VAL 59 Ca 0.42 -0.69 -0.26 0.00 0.00 0.00 0.00 61.98 61.45 2kz4 s VAL 59 Cb -0.26 -2.78 -0.03 0.00 0.00 0.00 0.00 36.38 33.31 2kz4 s VAL 59 CO 0.32 0.21 0.83 -0.60 0.00 0.00 0.00 175.10 175.86 2kz4 s ARG 60 N 1.46 4.45 -0.19 2.72 3.52 0.76 -1.23 118.95 130.43 2kz4 s ARG 60 Ca 0.03 1.11 -0.03 0.00 -0.13 0.00 0.00 55.73 56.71 2kz4 s ARG 60 Cb -0.16 -3.48 0.06 0.00 -1.56 0.00 0.00 34.95 29.81 2kz4 s ARG 60 CO -0.00 -0.07 0.04 0.42 -0.81 0.00 0.00 175.30 174.87 2kz4 s ILE 61 N 1.21 0.45 -0.17 4.11 1.01 -0.71 -1.06 121.20 126.05 2kz4 s ILE 61 Ca 0.43 -0.51 -0.11 0.00 0.00 0.00 0.00 60.65 60.46 2kz4 s ILE 61 Cb -0.19 -0.98 -0.05 0.00 0.01 0.00 0.00 42.46 41.26 2kz4 s ILE 61 CO 0.20 -0.22 0.17 0.26 0.00 0.00 0.00 174.94 175.36 2kz4 s TRP 62 N 1.89 3.46 0.18 3.97 0.52 -0.70 -0.89 118.94 127.36 2kz4 s TRP 62 Ca -0.01 0.43 0.05 0.00 0.02 0.00 0.00 56.10 56.60 2kz4 s TRP 62 Cb -0.17 -2.17 -0.05 0.00 -1.15 0.00 0.00 33.47 29.93 2kz4 s TRP 62 CO -0.08 0.35 -0.09 0.96 0.02 0.00 0.00 176.95 178.11 2kz4 s ILE 63 N 0.15 1.28 0.64 2.03 -4.36 -1.06 -0.94 121.20 118.94 2kz4 s ILE 63 Ca 0.11 -2.09 -0.18 0.00 -0.26 0.00 0.00 60.65 58.23 2kz4 s ILE 63 Cb -0.12 -1.99 -0.01 0.00 1.25 0.00 0.00 42.46 41.59 2kz4 s ILE 63 CO 0.01 -0.64 1.22 -0.13 0.24 0.00 0.00 174.94 175.64 2kz4 s ARG 64 N -3.74 2.70 -0.16 0.37 0.52 -1.26 -0.86 118.95 116.52 2kz4 s ARG 64 Ca 0.20 1.85 -0.35 0.00 -0.52 0.00 0.00 55.73 56.91 2kz4 s ARG 64 Cb 0.02 -1.89 -0.12 0.00 0.52 0.00 0.00 34.95 33.48 2kz4 s ARG 64 CO 0.03 -1.42 1.90 0.98 0.02 0.00 0.00 175.30 176.82 2kz4 n TYR 65 N -1.92 2.20 -3.95 -0.53 4.19 -1.25 -4.34 117.16 111.55 2kz4 n TYR 65 Ca 0.14 0.12 -0.19 0.00 3.31 0.00 0.00 57.90 61.28 2kz4 n TYR 65 Cb 0.49 -2.62 -0.16 0.00 0.49 0.00 0.00 39.34 37.54 2kz4 n TYR 65 CO 0.00 0.00 0.00 0.50 0.91 0.00 0.00 176.86 178.27 2kz4 s ARG 66 N 4.31 0.44 0.00 2.98 3.52 -1.26 -4.95 118.95 123.98 2kz4 s ARG 66 Ca 0.96 0.05 0.26 0.00 -0.13 0.00 0.00 55.73 56.87 2kz4 s ARG 66 Cb -0.77 -0.62 1.32 0.00 -1.56 0.00 0.00 34.95 33.32 2kz4 s ARG 66 CO 0.54 -0.15 1.87 1.63 -0.81 0.00 0.00 175.30 178.38 2kz4 n LYS 67 N 4.30 1.26 0.05 5.12 5.02 -1.26 -3.69 118.16 128.96 2kz4 n LYS 67 Ca -0.23 -0.39 0.08 0.00 -2.02 0.00 0.00 58.31 55.75 2kz4 n LYS 67 Cb 0.50 -1.42 -0.07 0.00 -0.02 0.00 0.00 35.03 34.03 2kz4 n LYS 67 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 2kz4 n ASP 68 N -0.47 0.61 -4.72 4.39 9.92 -1.26 -4.94 116.55 120.08 2kz4 n ASP 68 Ca 0.19 0.25 -0.41 0.00 -0.53 0.00 0.00 54.79 54.28 2kz4 n ASP 68 Cb 0.19 0.77 -0.04 0.00 -0.64 0.00 0.00 41.12 41.40 2kz4 n ASP 68 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 2kz4 s ILE 69 N -3.26 4.79 0.14 0.53 -1.09 -1.24 -5.04 121.20 116.02 2kz4 s ILE 69 Ca -0.03 1.97 0.04 0.00 -2.23 0.00 0.00 60.65 60.40 2kz4 s ILE 69 Cb 0.10 -4.28 -0.04 0.00 -1.58 0.00 0.00 42.46 36.66 2kz4 s ILE 69 CO 0.82 0.22 -0.10 0.21 -1.23 0.00 0.00 174.94 174.86 2kz4 s ASN 70 N 0.69 1.75 0.47 3.58 3.84 -1.26 -4.88 114.94 119.12 2kz4 s ASN 70 Ca 0.48 -0.96 0.23 0.00 0.21 0.00 0.00 52.86 52.83 2kz4 s ASN 70 Cb -0.21 -0.01 1.15 0.00 -0.55 0.00 0.00 41.25 41.63 2kz4 s ASN 70 CO 0.27 -0.30 1.96 0.00 -2.79 0.00 0.00 177.10 176.24 2kz4 h ALA 71 N 2.99 1.25 -0.14 1.71 0.00 -1.94 -2.49 119.26 120.63 2kz4 h ALA 71 Ca -0.37 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.36 2kz4 h ALA 71 Cb 1.19 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.95 2kz4 h ALA 71 CO 0.60 0.25 0.00 2.41 0.00 0.00 0.00 179.25 182.52 2kz4 n THR 72 N -3.69 0.18 -3.90 0.00 -1.04 -1.26 -4.52 114.28 100.06 2kz4 n THR 72 Ca -0.01 -0.19 -0.35 0.00 -2.04 0.00 0.00 64.05 61.45 2kz4 n THR 72 Cb 0.32 0.08 -0.14 0.00 -1.82 0.00 0.00 70.33 68.78 2kz4 n THR 72 CO 0.00 0.00 0.00 -0.44 -0.64 0.00 0.00 175.07 173.99 2kz4 s SER 73 N -1.11 4.36 0.12 8.00 0.01 -0.94 -4.40 113.70 119.73 2kz4 s SER 73 Ca 0.14 -0.38 -0.27 0.00 1.31 0.00 0.00 55.95 56.76 2kz4 s SER 73 Cb 0.07 -1.75 -0.07 0.00 0.21 0.00 0.00 66.02 64.48 2kz4 s SER 73 CO 0.10 -0.02 0.83 -0.13 0.41 0.00 0.00 173.24 174.43 2kz4 s ARG 74 N 1.49 4.60 -0.55 12.44 0.52 -0.93 -4.50 118.95 132.01 2kz4 s ARG 74 Ca 0.06 1.22 -0.18 0.00 -0.52 0.00 0.00 55.73 56.31 2kz4 s ARG 74 Cb -0.14 -3.32 0.10 0.00 0.52 0.00 0.00 34.95 32.10 2kz4 s ARG 74 CO -0.03 0.39 0.61 0.42 0.02 0.00 0.00 175.30 176.71 2kz4 s ILE 75 N -0.51 4.96 -0.26 1.52 -1.09 0.07 -1.12 121.20 124.77 2kz4 s ILE 75 Ca 0.40 -1.00 -0.20 0.00 -2.23 0.00 0.00 60.65 57.62 2kz4 s ILE 75 Cb -0.22 -4.38 -0.02 0.00 -1.58 0.00 0.00 42.46 36.26 2kz4 s ILE 75 CO 0.26 -0.94 0.60 -0.75 -1.23 0.00 0.00 174.94 172.88 2kz4 s LYS 76 N 2.32 4.10 -0.25 2.79 2.20 -0.53 -0.75 119.74 129.63 2kz4 s LYS 76 Ca 0.10 0.49 -0.29 0.00 -0.36 0.00 0.00 55.97 55.91 2kz4 s LYS 76 Cb -0.24 -3.65 -0.01 0.00 -1.51 0.00 0.00 37.83 32.42 2kz4 s LYS 76 CO 0.07 -0.40 1.41 0.54 -0.36 0.00 0.00 175.35 176.61 2kz4 s VAL 77 N 2.46 4.00 -0.17 4.02 0.11 -0.81 -0.09 120.40 129.91 2kz4 s VAL 77 Ca 0.25 1.14 0.16 0.00 -2.93 0.00 0.00 61.98 60.59 2kz4 s VAL 77 Cb -0.16 -3.98 0.05 0.00 -1.53 0.00 0.00 36.38 30.77 2kz4 s VAL 77 CO 0.09 -0.37 1.38 0.28 -3.33 0.00 0.00 175.10 173.14 2kz4 h SER 78 N 9.65 0.00 -3.05 3.54 0.02 -1.57 -1.59 113.55 120.55 2kz4 h SER 78 Ca -0.29 0.00 0.07 0.00 -0.84 0.00 0.00 61.79 60.73 2kz4 h SER 78 Cb 1.12 0.00 -0.26 0.00 0.14 0.00 0.00 62.40 63.39 2kz4 h SER 78 CO 1.01 0.48 0.44 0.28 -1.14 0.00 0.00 176.83 177.90 2kz4 s THR 79 N -2.97 0.00 -5.00 -2.27 -1.32 -1.11 -4.69 115.64 98.28 2kz4 s THR 79 Ca 0.03 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 60.51 2kz4 s THR 79 Cb 0.08 -1.00 0.00 0.00 -1.51 0.00 0.00 72.50 70.07 2kz4 s THR 79 CO 0.75 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.77 2kz4 n GLY 80 N 2.54 0.05 0.00 6.08 0.00 -1.26 -3.38 105.19 109.21 2kz4 n GLY 80 Ca -0.14 -1.56 0.09 0.00 0.00 0.00 0.00 46.02 44.41 2kz4 n GLY 80 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2kz4 n PRO 81 N 0.00 0.06 -0.01 1.61 -0.04 -1.26 -2.47 135.00 132.89 2kz4 n PRO 81 Ca 0.00 0.15 0.01 0.00 -0.04 0.00 0.00 63.50 63.62 2kz4 n PRO 81 Cb 0.00 -1.50 0.01 0.00 -0.04 0.00 0.00 33.50 31.97 2kz4 n PRO 81 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2kz4 n LEU 82 N -1.45 1.76 -4.52 1.53 4.77 -1.26 -5.09 117.00 112.74 2kz4 n LEU 82 Ca 0.06 -1.67 -0.61 0.00 -0.03 0.00 0.00 56.01 53.76 2kz4 n LEU 82 Cb 0.21 -0.02 -0.10 0.00 -2.33 0.00 0.00 43.42 41.18 2kz4 n LEU 82 CO 0.17 0.44 1.47 0.00 -1.33 0.00 0.00 177.39 178.14 2kz4 n ALA 83 N -0.25 -0.29 0.00 -1.18 0.00 -1.03 -1.86 120.51 115.90 2kz4 n ALA 83 Ca 0.01 0.30 0.00 0.00 0.00 0.00 0.00 53.44 53.75 2kz4 n ALA 83 Cb 0.19 -2.10 0.00 0.00 0.00 0.00 0.00 19.45 17.54 2kz4 n ALA 83 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2kz4 n GLY 84 N 5.66 1.14 3.99 0.00 0.00 -0.60 -4.97 105.19 110.42 2kz4 n GLY 84 Ca 0.41 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.22 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 -0.36 2.37 -0.20 1.61 0.52 -0.78 -4.95 118.95 117.17 2kz4 s ARG 85 Ca 0.00 -1.02 0.01 0.00 -0.52 0.00 0.00 55.73 54.20 2kz4 s ARG 85 Cb 0.00 -2.51 0.04 0.00 0.52 0.00 0.00 34.95 33.00 2kz4 s ARG 85 CO 0.00 -0.82 -0.10 0.08 0.02 0.00 0.00 175.30 174.48 2kz4 s VAL 86 N -2.77 1.67 0.07 3.52 1.01 -1.26 -1.92 120.40 120.72 2kz4 s VAL 86 Ca 0.59 -1.06 -0.18 0.00 0.00 0.00 0.00 61.98 61.34 2kz4 s VAL 86 Cb -0.09 -1.76 -0.07 0.00 0.00 0.00 0.00 36.38 34.47 2kz4 s VAL 86 CO 0.39 0.14 0.53 -0.76 0.00 0.00 0.00 175.10 175.40 2kz4 s LEU 87 N 1.38 4.49 -0.04 3.92 2.01 0.08 -2.63 118.68 127.88 2kz4 s LEU 87 Ca -0.02 1.17 -0.02 0.00 0.01 0.00 0.00 54.13 55.27 2kz4 s LEU 87 Cb -0.17 -2.90 -0.04 0.00 0.01 0.00 0.00 46.19 43.10 2kz4 s LEU 87 CO -0.08 0.26 0.10 0.20 1.01 0.00 0.00 176.35 177.84 2kz4 s ASN 88 N -1.21 5.90 0.04 2.29 0.02 -1.00 -0.75 114.94 120.23 2kz4 s ASN 88 Ca 0.29 0.25 -0.30 0.00 -1.02 0.00 0.00 52.86 52.08 2kz4 s ASN 88 Cb -0.18 -1.77 -0.04 0.00 0.02 0.00 0.00 41.25 39.27 2kz4 s ASN 88 CO 0.18 0.31 1.07 -0.63 0.02 0.00 0.00 177.10 178.05 2kz4 s ILE 89 N -1.14 4.47 -0.20 0.60 1.01 -1.26 -1.46 121.20 123.21 2kz4 s ILE 89 Ca 0.21 1.81 -0.08 0.00 0.00 0.00 0.00 60.65 62.58 2kz4 s ILE 89 Cb -0.12 -4.16 -0.04 0.00 0.01 0.00 0.00 42.46 38.15 2kz4 s ILE 89 CO 0.11 0.16 0.09 0.27 0.00 0.00 0.00 174.94 175.57 2kz4 s ILE 90 N 0.90 4.98 0.00 2.92 -4.36 -1.09 -4.84 121.20 119.69 2kz4 s ILE 90 Ca 0.54 0.04 0.00 0.00 -0.26 0.00 0.00 60.65 60.97 2kz4 s ILE 90 Cb -0.25 -3.27 0.00 0.00 1.25 0.00 0.00 42.46 40.19 2kz4 s ILE 90 CO 0.29 0.43 0.00 0.61 0.24 0.00 0.00 174.94 176.50 2kz4 n GLY 91 N 3.78 2.02 3.47 6.27 0.00 -1.26 -4.71 105.19 114.76 2kz4 n GLY 91 Ca -0.16 0.01 -0.13 0.00 0.00 0.00 0.00 46.02 45.74 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 0.00 1.11 -0.34 1.61 -2.07 -1.26 -4.87 119.66 113.84 2kz4 s GLN 92 Ca 0.00 -0.19 -0.28 0.00 -1.82 0.00 0.00 55.36 53.07 2kz4 s GLN 92 Cb 0.00 0.52 -0.01 0.00 -1.09 0.00 0.00 33.01 32.42 2kz4 s GLN 92 CO 0.00 -0.44 1.74 -1.25 -1.32 0.00 0.00 175.29 174.02 2kz4 s PRO 93 N -2.73 3.38 -0.40 9.60 0.04 -1.26 -4.59 135.00 139.04 2kz4 s PRO 93 Ca -0.02 1.35 -0.29 0.00 0.04 0.00 0.00 61.00 62.08 2kz4 s PRO 93 Cb -0.01 -4.17 0.02 0.00 0.04 0.00 0.00 34.50 30.39 2kz4 s PRO 93 CO -0.05 -1.81 1.09 -1.17 0.04 0.00 0.00 177.00 175.11 2kz4 s LEU 94 N 6.64 3.80 0.37 -3.56 1.98 0.01 -4.91 118.68 123.01 2kz4 s LEU 94 Ca 0.77 0.74 -0.25 0.00 -2.89 0.00 0.00 54.13 52.49 2kz4 s LEU 94 Cb -0.21 -3.52 -0.09 0.00 0.66 0.00 0.00 46.19 43.03 2kz4 s LEU 94 CO 0.33 -1.05 1.07 -2.16 -1.89 0.00 0.00 176.35 172.66 2kz4 s PRO 95 N 4.00 4.25 0.63 0.98 0.04 -1.26 -0.63 135.00 143.01 2kz4 s PRO 95 Ca 0.46 1.60 -0.19 0.00 0.04 0.00 0.00 61.00 62.92 2kz4 s PRO 95 Cb -0.10 -2.69 -0.02 0.00 0.04 0.00 0.00 34.50 31.73 2kz4 s PRO 95 CO 0.23 -0.09 1.29 0.34 0.04 0.00 0.00 177.00 178.82 2kz4 s ASP 96 N -1.38 4.73 0.35 6.66 2.15 -1.07 -4.87 116.67 123.24 2kz4 s ASP 96 Ca 0.55 2.62 0.14 0.00 0.43 0.00 0.00 52.55 56.29 2kz4 s ASP 96 Cb -0.25 -2.62 0.63 0.00 -0.30 0.00 0.00 42.92 40.38 2kz4 s ASP 96 CO 0.31 -1.92 1.75 0.00 -0.17 0.00 0.00 175.17 175.14 2kz4 h ALA 97 N 0.69 1.15 -0.01 3.66 0.00 -1.95 -2.41 119.26 120.38 2kz4 h ALA 97 Ca -0.51 -0.40 0.00 0.00 0.00 0.00 0.00 54.91 54.00 2kz4 h ALA 97 Cb 1.33 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.05 2kz4 h ALA 97 CO 0.54 0.55 -0.40 0.00 0.00 0.00 0.00 179.25 179.94 2kz4 n ALA 98 N -2.40 3.39 -1.50 0.00 0.00 -1.26 -4.98 120.51 113.76 2kz4 n ALA 98 Ca -0.01 -0.51 -0.17 0.00 0.00 0.00 0.00 53.44 52.75 2kz4 n ALA 98 Cb 0.49 -0.98 -0.07 0.00 0.00 0.00 0.00 19.45 18.89 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 -0.49 -1.43 0.01 0.00 3.00 -0.91 -4.87 116.66 111.97 2kz4 n ARG 99 Ca 0.10 1.10 0.14 0.00 -0.01 0.00 0.00 57.85 59.18 2kz4 n ARG 99 Cb 0.39 -5.44 0.55 0.00 0.00 0.00 0.00 32.46 27.97 2kz4 n ARG 99 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.63 177.88 2kz4 n THR 100 N -2.38 0.06 -3.85 0.55 -2.24 -1.26 -4.60 114.28 100.55 2kz4 n THR 100 Ca -0.17 -0.03 -0.10 0.00 -2.27 0.00 0.00 64.05 61.48 2kz4 n THR 100 Cb 0.62 -0.42 0.01 0.00 -2.10 0.00 0.00 70.33 68.44 2kz4 n THR 100 CO 0.00 0.00 0.00 -2.11 -0.57 0.00 0.00 175.07 172.39 2kz4 n ARG 101 N -1.58 0.90 -3.68 -0.78 1.85 -1.26 -3.92 116.66 108.20 2kz4 n ARG 101 Ca 0.07 -2.29 -0.26 0.00 -1.00 0.00 0.00 57.85 54.37 2kz4 n ARG 101 Cb 0.35 2.57 -0.17 0.00 -1.05 0.00 0.00 32.46 34.15 2kz4 n ARG 101 CO 0.00 0.00 0.00 -1.17 -0.01 0.00 0.00 177.63 176.45 2kz4 s LEU 102 N 0.00 0.63 -0.73 2.89 1.98 -0.04 -2.61 118.68 120.81 2kz4 s LEU 102 Ca 0.20 -0.55 -0.26 0.00 -2.89 0.00 0.00 54.13 50.63 2kz4 s LEU 102 Cb -0.03 -0.37 -0.00 0.00 0.66 0.00 0.00 46.19 46.44 2kz4 s LEU 102 CO 0.14 -0.31 1.65 -0.70 -1.89 0.00 0.00 176.35 175.25 2kz4 s GLU 103 N 2.03 2.89 -1.06 1.98 2.56 0.20 -2.58 118.70 124.72 2kz4 s GLU 103 Ca 0.02 0.06 -0.19 0.00 0.00 0.00 0.00 54.97 54.86 2kz4 s GLU 103 Cb -0.16 -4.50 0.10 0.00 2.00 0.00 0.00 34.13 31.58 2kz4 s GLU 103 CO -0.08 -2.58 1.36 0.42 -0.56 0.00 0.00 175.26 173.82 2kz4 s ILE 104 N 7.77 4.45 0.15 -3.70 -1.09 -0.07 -0.81 121.20 127.89 2kz4 s ILE 104 Ca 0.55 -1.55 -0.30 0.00 -2.23 0.00 0.00 60.65 57.12 2kz4 s ILE 104 Cb -0.09 -4.95 -0.07 0.00 -1.58 0.00 0.00 42.46 35.77 2kz4 s ILE 104 CO 0.13 -1.73 0.98 -1.48 -1.23 0.00 0.00 174.94 171.61 2kz4 s LEU 105 N 3.41 4.53 0.23 2.97 2.34 -1.26 -1.73 118.68 129.17 2kz4 s LEU 105 Ca 0.41 1.89 -0.07 0.00 0.06 0.00 0.00 54.13 56.42 2kz4 s LEU 105 Cb -0.02 -3.60 -0.02 0.00 -0.56 0.00 0.00 46.19 42.00 2kz4 s LEU 105 CO -0.06 -0.05 0.32 0.00 -1.06 0.00 0.00 176.35 175.51 2kz4 s ARG 107 N -4.05 0.23 -0.46 0.00 3.52 -0.54 -0.59 118.95 117.06 2kz4 s ARG 107 Ca 0.30 -0.17 -0.45 0.00 -0.13 0.00 0.00 55.73 55.28 2kz4 s ARG 107 Cb 0.03 0.09 -0.19 0.00 -1.56 0.00 0.00 34.95 33.32 2kz4 s ARG 107 CO 0.11 -0.04 1.68 -1.91 -0.81 0.00 0.00 175.30 174.33 2kz4 n GLU 108 N 2.36 0.22 -1.53 5.12 0.00 -1.07 -2.36 120.64 123.37 2kz4 n GLU 108 Ca -0.17 0.08 -0.28 0.00 0.00 0.00 0.00 57.16 56.79 2kz4 n GLU 108 Cb 0.58 -1.62 -0.05 0.00 0.00 0.00 0.00 31.44 30.34 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 4.39 4.41 3.56 8.31 0.00 -1.08 -4.77 105.19 120.01 2kz4 n GLY 109 Ca 0.33 -1.89 -0.26 0.00 0.00 0.00 0.00 46.02 44.19 2kz4 n GLY 109 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2kz4 s ALA 110 N -1.61 1.63 0.26 4.61 0.00 -1.26 -4.79 121.76 120.60 2kz4 s ALA 110 Ca 0.59 -1.49 0.07 0.00 0.00 0.00 0.00 51.96 51.12 2kz4 s ALA 110 Cb 0.36 -4.56 0.31 0.00 0.00 0.00 0.00 23.12 19.24 2kz4 s ALA 110 CO -0.21 -4.86 1.59 1.05 0.00 0.00 0.00 175.76 173.34 2kz4 h GLU 111 N 11.31 0.14 0.00 0.00 4.11 -1.93 -3.53 114.58 124.69 2kz4 h GLU 111 Ca 0.10 -0.10 0.00 0.00 0.07 0.00 0.00 59.36 59.43 2kz4 h GLU 111 Cb 1.00 0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.27 2kz4 h GLU 111 CO 1.20 0.70 0.00 0.36 0.07 0.00 0.00 179.01 181.34