#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 6.31 0.37 3.17 4.22 -1.26 -5.02 114.94 122.73 2kz4 s ASN 2 Ca 0.00 -0.35 -0.28 0.00 -2.14 0.00 0.00 52.86 50.08 2kz4 s ASN 2 Cb 0.00 -2.49 -0.11 0.00 1.28 0.00 0.00 41.25 39.94 2kz4 s ASN 2 CO 0.00 -1.44 1.46 -0.63 -2.04 0.00 0.00 177.10 174.45 2kz4 s ILE 3 N 4.57 2.13 -0.04 0.54 1.01 -1.26 -4.91 121.20 123.24 2kz4 s ILE 3 Ca 0.33 0.13 -0.00 0.00 0.00 0.00 0.00 60.65 61.11 2kz4 s ILE 3 Cb -0.11 -3.08 0.03 0.00 0.01 0.00 0.00 42.46 39.30 2kz4 s ILE 3 CO 0.19 0.03 1.92 0.61 0.00 0.00 0.00 174.94 177.69 2kz4 n GLY 4 N 0.50 2.65 3.78 6.18 0.00 -1.26 -4.91 105.19 112.12 2kz4 n GLY 4 Ca 0.01 -0.13 -0.37 0.00 0.00 0.00 0.00 46.02 45.54 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 -0.22 4.02 -0.91 1.61 1.70 -1.26 -4.56 118.95 119.34 2kz4 s ARG 5 Ca 0.04 1.59 -0.24 0.00 -0.47 0.00 0.00 55.73 56.65 2kz4 s ARG 5 Cb 0.03 -2.48 0.05 0.00 -0.57 0.00 0.00 34.95 31.98 2kz4 s ARG 5 CO 0.00 -0.28 1.34 -0.51 -1.08 0.00 0.00 175.30 174.76 2kz4 s LEU 6 N -2.79 3.63 -0.11 -1.89 1.43 -1.26 -4.31 118.68 113.37 2kz4 s LEU 6 Ca 0.60 -1.20 0.20 0.00 -1.03 0.00 0.00 54.13 52.69 2kz4 s LEU 6 Cb -0.24 -2.54 -0.29 0.00 0.03 0.00 0.00 46.19 43.15 2kz4 s LEU 6 CO 0.30 -1.55 0.27 0.54 0.23 0.00 0.00 176.35 176.14 2kz4 n ARG 7 N 8.70 0.68 -2.17 1.70 1.74 -0.48 -4.75 116.66 122.08 2kz4 n ARG 7 Ca 0.21 -0.10 -0.08 0.00 -0.77 0.00 0.00 57.85 57.10 2kz4 n ARG 7 Cb 0.50 -1.52 0.00 0.00 -1.02 0.00 0.00 32.46 30.43 2kz4 n ARG 7 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 2kz4 n ASP 8 N -2.50 1.43 -3.73 0.55 8.00 0.32 -4.97 116.55 115.65 2kz4 n ASP 8 Ca -0.18 -1.62 -0.12 0.00 0.71 0.00 0.00 54.79 53.57 2kz4 n ASP 8 Cb 0.86 -0.04 -0.12 0.00 -0.02 0.00 0.00 41.12 41.80 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 -2.79 0.28 0.10 -1.24 3.52 -1.00 -1.74 118.95 116.09 2kz4 s ARG 9 Ca 0.12 0.57 0.06 0.00 -0.13 0.00 0.00 55.73 56.35 2kz4 s ARG 9 Cb -0.01 -0.04 -0.03 0.00 -1.56 0.00 0.00 34.95 33.30 2kz4 s ARG 9 CO 0.08 -0.14 -0.14 0.96 -0.81 0.00 0.00 175.30 175.25 2kz4 s ILE 10 N 1.09 1.24 -0.23 4.11 -0.00 -0.41 -0.88 121.20 126.12 2kz4 s ILE 10 Ca -0.08 -1.59 -0.09 0.00 -0.00 0.00 0.00 60.65 58.90 2kz4 s ILE 10 Cb -0.08 -1.39 -0.04 0.00 -0.00 0.00 0.00 42.46 40.95 2kz4 s ILE 10 CO -0.08 -0.37 0.10 -0.89 -0.00 0.00 0.00 174.94 173.71 2kz4 s THR 11 N -1.91 4.86 -0.32 8.37 2.01 -0.22 -1.68 115.64 126.75 2kz4 s THR 11 Ca 0.05 0.00 -0.27 0.00 0.31 0.00 0.00 61.69 61.79 2kz4 s THR 11 Cb -0.06 -3.25 0.01 0.00 0.01 0.00 0.00 72.50 69.21 2kz4 s THR 11 CO 0.03 0.37 0.98 -0.63 -0.69 0.00 0.00 174.62 174.68 2kz4 s ILE 12 N 1.07 4.59 -0.64 1.82 -1.09 -0.88 -1.41 121.20 124.67 2kz4 s ILE 12 Ca 0.05 1.52 -0.16 0.00 -2.23 0.00 0.00 60.65 59.83 2kz4 s ILE 12 Cb -0.14 -4.34 0.15 0.00 -1.58 0.00 0.00 42.46 36.55 2kz4 s ILE 12 CO 0.04 -0.43 0.63 -1.10 -1.23 0.00 0.00 174.94 172.85 2kz4 s GLN 13 N 3.45 3.17 0.24 2.79 -0.21 -0.06 -0.16 119.66 128.88 2kz4 s GLN 13 Ca 0.41 -1.81 -0.29 0.00 0.02 0.00 0.00 55.36 53.68 2kz4 s GLN 13 Cb -0.13 -4.35 -0.09 0.00 1.00 0.00 0.00 33.01 29.44 2kz4 s GLN 13 CO 0.15 -1.39 0.93 0.99 -2.12 0.00 0.00 175.29 173.86 2kz4 s THR 14 N 1.53 4.10 -0.69 -0.19 2.01 -0.60 -0.94 115.64 120.86 2kz4 s THR 14 Ca 0.10 2.05 -0.20 0.00 0.31 0.00 0.00 61.69 63.95 2kz4 s THR 14 Cb -0.23 -4.30 0.10 0.00 0.01 0.00 0.00 72.50 68.09 2kz4 s THR 14 CO 0.00 0.47 0.87 -0.22 -0.69 0.00 0.00 174.62 175.06 2kz4 s LEU 15 N -1.24 5.09 -0.49 4.42 2.96 -1.19 -1.38 118.68 126.85 2kz4 s LEU 15 Ca 0.41 -1.48 -0.23 0.00 -0.22 0.00 0.00 54.13 52.62 2kz4 s LEU 15 Cb -0.25 -2.35 0.03 0.00 0.50 0.00 0.00 46.19 44.12 2kz4 s LEU 15 CO 0.31 -1.18 0.81 -0.75 -1.32 0.00 0.00 176.35 174.22 2kz4 s LYS 16 N 2.98 3.34 -0.60 1.98 2.20 -0.07 -4.91 119.74 124.65 2kz4 s LYS 16 Ca 0.19 -0.25 -0.21 0.00 -0.36 0.00 0.00 55.97 55.34 2kz4 s LYS 16 Cb -0.18 -3.99 0.08 0.00 -1.51 0.00 0.00 37.83 32.23 2kz4 s LYS 16 CO 0.04 -1.23 0.81 -0.65 -0.36 0.00 0.00 175.35 173.95 2kz4 s GLN 17 N 3.38 3.10 -0.21 4.03 -0.21 -1.26 -1.63 119.66 126.86 2kz4 s GLN 17 Ca 0.28 -0.99 -0.05 0.00 0.02 0.00 0.00 55.36 54.62 2kz4 s GLN 17 Cb -0.13 -4.21 -0.02 0.00 1.00 0.00 0.00 33.01 29.65 2kz4 s GLN 17 CO 0.20 -1.59 -0.01 0.99 -2.12 0.00 0.00 175.29 172.76 2kz4 s THR 18 N 3.28 3.77 0.60 -0.19 2.01 -0.64 -4.93 115.64 119.54 2kz4 s THR 18 Ca 0.17 -0.37 -0.13 0.00 0.31 0.00 0.00 61.69 61.68 2kz4 s THR 18 Cb -0.20 -2.71 -0.04 0.00 0.01 0.00 0.00 72.50 69.55 2kz4 s THR 18 CO 0.10 0.41 1.03 -0.60 -0.69 0.00 0.00 174.62 174.86 2kz4 s ARG 19 N 1.26 3.56 0.40 4.92 3.52 -1.26 -0.85 118.95 130.50 2kz4 s ARG 19 Ca 0.04 0.89 0.08 0.00 -0.13 0.00 0.00 55.73 56.60 2kz4 s ARG 19 Cb -0.15 -2.08 -0.01 0.00 -1.56 0.00 0.00 34.95 31.16 2kz4 s ARG 19 CO 0.00 -0.60 0.45 0.34 -0.81 0.00 0.00 175.30 174.68 2kz4 s ASP 20 N -3.65 5.41 0.00 -2.12 2.15 -0.09 -4.91 116.67 113.46 2kz4 s ASP 20 Ca 0.58 -0.53 0.11 0.00 0.43 0.00 0.00 52.55 53.14 2kz4 s ASP 20 Cb -0.12 -0.74 0.60 0.00 -0.30 0.00 0.00 42.92 42.36 2kz4 s ASP 20 CO 0.46 -0.62 1.24 0.00 -0.17 0.00 0.00 175.17 176.08 2kz4 n ILE 21 N -1.64 0.57 -0.05 4.11 3.06 -1.26 -1.82 119.36 122.33 2kz4 n ILE 21 Ca 0.04 0.14 -0.05 0.00 -2.50 0.00 0.00 62.75 60.38 2kz4 n ILE 21 Cb 0.60 -0.96 -0.07 0.00 0.54 0.00 0.00 39.64 39.75 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 -1.23 0.63 0.00 9.51 -2.24 -1.26 -5.04 114.28 114.65 2kz4 n THR 22 Ca 0.06 -0.37 0.00 0.00 -2.27 0.00 0.00 64.05 61.47 2kz4 n THR 22 Cb 0.08 -0.77 0.00 0.00 -2.10 0.00 0.00 70.33 67.54 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 2.49 1.89 3.78 3.38 0.00 -0.76 -5.14 105.19 110.84 2kz4 n GLY 23 Ca -0.15 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.50 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 -0.11 4.57 -0.55 1.61 0.41 -1.26 -4.71 118.70 118.65 2kz4 s GLU 24 Ca 0.00 1.33 -0.18 0.00 -0.41 0.00 0.00 54.97 55.70 2kz4 s GLU 24 Cb 0.00 -2.78 0.09 0.00 -1.78 0.00 0.00 34.13 29.66 2kz4 s GLU 24 CO 0.00 0.26 0.63 0.42 -0.49 0.00 0.00 175.26 176.08 2kz4 s ILE 25 N -1.63 4.93 -0.97 -1.63 -1.09 -1.26 -0.92 121.20 118.63 2kz4 s ILE 25 Ca 0.51 -0.96 -0.22 0.00 -2.23 0.00 0.00 60.65 57.74 2kz4 s ILE 25 Cb -0.18 -4.39 0.07 0.00 -1.58 0.00 0.00 42.46 36.37 2kz4 s ILE 25 CO 0.24 -0.96 1.34 -0.76 -1.23 0.00 0.00 174.94 173.57 2kz4 s LEU 26 N 2.42 3.89 -0.59 2.97 1.02 -0.03 -4.92 118.68 123.43 2kz4 s LEU 26 Ca 0.10 -1.52 -0.28 0.00 0.02 0.00 0.00 54.13 52.45 2kz4 s LEU 26 Cb -0.24 -2.52 0.03 0.00 0.02 0.00 0.00 46.19 43.48 2kz4 s LEU 26 CO 0.07 -1.42 1.22 -1.61 0.02 0.00 0.00 176.35 174.63 2kz4 s GLU 27 N 4.43 3.47 0.17 1.70 2.02 -1.26 -1.61 118.70 127.62 2kz4 s GLU 27 Ca 0.41 0.23 0.09 0.00 0.02 0.00 0.00 54.97 55.72 2kz4 s GLU 27 Cb -0.02 -4.04 -0.04 0.00 0.10 0.00 0.00 34.13 30.13 2kz4 s GLU 27 CO -0.08 -1.74 -0.19 0.95 0.02 0.00 0.00 175.26 174.22 2kz4 s THR 28 N 5.12 1.94 -0.52 3.63 -4.23 -0.64 -4.99 115.64 115.94 2kz4 s THR 28 Ca 0.43 -1.95 -0.06 0.00 -1.18 0.00 0.00 61.69 58.93 2kz4 s THR 28 Cb -0.08 -1.91 0.14 0.00 1.34 0.00 0.00 72.50 71.99 2kz4 s THR 28 CO 0.25 -0.28 0.37 0.26 -0.54 0.00 0.00 174.62 174.67 2kz4 s TRP 29 N -1.98 3.49 0.02 3.99 0.52 -1.26 -0.90 118.94 122.83 2kz4 s TRP 29 Ca 0.17 -2.25 -0.30 0.00 0.02 0.00 0.00 56.10 53.74 2kz4 s TRP 29 Cb -0.06 -3.38 -0.04 0.00 -1.15 0.00 0.00 33.47 28.85 2kz4 s TRP 29 CO 0.07 -0.95 1.00 -1.83 0.02 0.00 0.00 176.95 175.26 2kz4 s GLU 30 N 0.83 4.57 0.02 4.98 -1.05 -0.48 -4.86 118.70 122.70 2kz4 s GLU 30 Ca 0.10 1.46 -0.30 0.00 -0.15 0.00 0.00 54.97 56.08 2kz4 s GLU 30 Cb -0.22 -3.44 -0.05 0.00 -0.44 0.00 0.00 34.13 29.98 2kz4 s GLU 30 CO -0.03 -0.03 1.27 0.16 0.95 0.00 0.00 175.26 177.57 2kz4 s ASP 31 N 0.88 6.99 0.00 0.83 -4.77 -1.26 -1.56 116.67 117.78 2kz4 s ASP 31 Ca 0.52 2.01 0.00 0.00 -3.30 0.00 0.00 52.55 51.78 2kz4 s ASP 31 Cb -0.22 -2.57 0.00 0.00 -1.09 0.00 0.00 42.92 39.04 2kz4 s ASP 31 CO 0.28 -0.58 0.00 0.61 0.70 0.00 0.00 175.17 176.19 2kz4 n GLY 32 N 3.39 0.71 3.62 2.12 0.00 0.78 -4.95 105.19 110.85 2kz4 n GLY 32 Ca 0.11 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.78 2kz4 n GLY 32 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2kz4 s HIS 33 N 2.04 3.20 -0.62 1.61 2.46 -1.26 -4.87 115.29 117.85 2kz4 s HIS 33 Ca 0.00 0.03 -0.11 0.00 0.47 0.00 0.00 55.06 55.45 2kz4 s HIS 33 Cb 0.00 -1.98 0.16 0.00 -0.13 0.00 0.00 32.58 30.63 2kz4 s HIS 33 CO 0.00 0.20 0.52 0.99 -2.47 0.00 0.00 174.74 173.98 2kz4 s THR 34 N 0.04 4.73 0.42 0.89 2.01 -1.26 -2.07 115.64 120.39 2kz4 s THR 34 Ca 0.04 -2.17 0.08 0.00 0.31 0.00 0.00 61.69 59.95 2kz4 s THR 34 Cb -0.13 -4.02 -0.03 0.00 0.01 0.00 0.00 72.50 68.34 2kz4 s THR 34 CO 0.01 -0.89 0.34 -1.48 -0.69 0.00 0.00 174.62 171.91 2kz4 s LEU 35 N 0.77 3.32 0.17 4.42 2.34 -0.68 -4.82 118.68 124.21 2kz4 s LEU 35 Ca 0.11 -0.83 -0.30 0.00 0.06 0.00 0.00 54.13 53.17 2kz4 s LEU 35 Cb -0.21 -1.91 -0.08 0.00 -0.56 0.00 0.00 46.19 43.43 2kz4 s LEU 35 CO -0.03 -0.64 1.32 0.26 -1.06 0.00 0.00 176.35 176.20 2kz4 s TRP 36 N -2.50 3.27 0.19 3.48 0.52 -1.26 -1.29 118.94 121.35 2kz4 s TRP 36 Ca 0.46 1.17 -0.00 0.00 0.02 0.00 0.00 56.10 57.75 2kz4 s TRP 36 Cb -0.02 -3.60 -0.04 0.00 -1.15 0.00 0.00 33.47 28.66 2kz4 s TRP 36 CO 0.27 -1.93 0.10 0.00 0.02 0.00 0.00 176.95 175.40 2kz4 s ALA 37 N 0.42 1.23 -0.44 0.98 0.00 -0.71 -3.62 121.76 119.62 2kz4 s ALA 37 Ca 0.59 -1.68 0.04 0.00 0.00 0.00 0.00 51.96 50.91 2kz4 s ALA 37 Cb -0.36 1.14 0.12 0.00 0.00 0.00 0.00 23.12 24.02 2kz4 s ALA 37 CO 0.35 -0.52 0.17 0.45 0.00 0.00 0.00 175.76 176.22 2kz4 s SER 38 N -3.17 4.43 -0.87 0.00 0.15 0.30 -0.52 113.70 114.02 2kz4 s SER 38 Ca 0.34 -2.63 -0.17 0.00 0.70 0.00 0.00 55.95 54.20 2kz4 s SER 38 Cb 0.07 -1.57 0.17 0.00 -1.71 0.00 0.00 66.02 62.98 2kz4 s SER 38 CO 0.09 -0.29 0.94 0.54 1.20 0.00 0.00 173.24 175.72 2kz4 s VAL 39 N 0.25 5.14 -0.27 4.45 0.11 -1.26 -1.86 120.40 126.97 2kz4 s VAL 39 Ca 0.15 -1.97 -0.08 0.00 -2.93 0.00 0.00 61.98 57.15 2kz4 s VAL 39 Cb -0.23 -4.62 -0.02 0.00 -1.53 0.00 0.00 36.38 29.98 2kz4 s VAL 39 CO -0.04 -1.27 0.08 0.20 -3.33 0.00 0.00 175.10 170.74 2kz4 s ASN 40 N 2.95 5.18 0.36 3.54 0.02 0.31 -4.78 114.94 122.52 2kz4 s ASN 40 Ca 0.25 -0.34 -0.27 0.00 -1.02 0.00 0.00 52.86 51.48 2kz4 s ASN 40 Cb -0.08 -1.93 -0.09 0.00 0.02 0.00 0.00 41.25 39.17 2kz4 s ASN 40 CO -0.09 -0.08 1.27 -0.04 0.02 0.00 0.00 177.10 178.18 2kz4 s MET 41 N 1.59 4.20 0.70 -0.60 -1.94 -1.26 -0.90 119.30 121.09 2kz4 s MET 41 Ca 0.06 2.11 -0.15 0.00 -1.71 0.00 0.00 55.69 56.00 2kz4 s MET 41 Cb -0.16 -2.91 0.02 0.00 2.01 0.00 0.00 34.83 33.79 2kz4 s MET 41 CO 0.04 -0.28 1.15 0.14 -0.01 0.00 0.00 175.02 176.05 2kz4 s VAL 42 N -1.22 2.85 0.75 -6.03 -7.23 -0.44 -4.86 120.40 104.21 2kz4 s VAL 42 Ca 0.52 0.39 -0.11 0.00 -1.81 0.00 0.00 61.98 60.97 2kz4 s VAL 42 Cb -0.37 -2.91 0.04 0.00 0.56 0.00 0.00 36.38 33.70 2kz4 s VAL 42 CO 0.48 -0.24 1.09 -0.44 -0.31 0.00 0.00 175.10 175.68 2kz4 s SER 43 N -2.40 4.94 0.33 4.85 0.01 -1.26 -4.75 113.70 115.42 2kz4 s SER 43 Ca 0.69 1.35 0.02 0.00 1.31 0.00 0.00 55.95 59.33 2kz4 s SER 43 Cb -0.24 -2.14 0.58 0.00 0.21 0.00 0.00 66.02 64.43 2kz4 s SER 43 CO 0.44 -1.69 1.92 0.28 0.41 0.00 0.00 173.24 174.60 2kz4 h SER 44 N -0.89 0.63 0.30 2.44 0.02 -1.96 -2.08 113.55 112.01 2kz4 h SER 44 Ca -0.46 -0.08 -0.05 0.00 -0.84 0.00 0.00 61.79 60.37 2kz4 h SER 44 Cb 1.25 -0.16 -0.01 0.00 0.14 0.00 0.00 62.40 63.62 2kz4 h SER 44 CO 0.60 0.59 -0.22 0.07 -1.14 0.00 0.00 176.83 176.72 2kz4 h LYS 45 N 0.69 0.00 -0.22 3.45 2.10 -1.99 -2.59 116.57 118.00 2kz4 h LYS 45 Ca 0.17 0.00 -0.17 0.00 -2.00 0.00 0.00 60.65 58.65 2kz4 h LYS 45 Cb 0.16 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.50 2kz4 h LYS 45 CO -0.01 0.22 -0.52 0.93 -2.00 0.00 0.00 179.45 178.07 2kz4 h GLU 46 N 0.00 0.75 0.07 0.07 4.39 -1.75 -0.38 114.58 117.73 2kz4 h GLU 46 Ca -0.00 -0.50 0.01 0.00 0.34 0.00 0.00 59.36 59.21 2kz4 h GLU 46 Cb 0.44 0.07 -0.02 0.00 -0.10 0.00 0.00 28.75 29.13 2kz4 h GLU 46 CO 0.03 1.13 -0.14 0.00 -1.16 0.00 0.00 179.01 178.86 2kz4 h ALA 47 N 0.62 -0.22 -0.29 3.43 0.00 -1.42 -1.64 119.26 119.74 2kz4 h ALA 47 Ca -0.00 -0.02 0.03 0.00 0.00 0.00 0.00 54.91 54.93 2kz4 h ALA 47 Cb 1.13 0.23 -0.03 0.00 0.00 0.00 0.00 17.79 19.12 2kz4 h ALA 47 CO 0.11 -0.66 0.09 0.82 0.00 0.00 0.00 179.25 179.61 2kz4 h ILE 48 N -0.28 0.90 -0.01 0.00 2.04 -1.40 0.11 117.51 118.87 2kz4 h ILE 48 Ca 0.03 -0.07 -0.13 0.00 1.00 0.00 0.00 64.86 65.68 2kz4 h ILE 48 Cb 0.30 0.68 -0.02 0.00 -0.74 0.00 0.00 36.82 37.04 2kz4 h ILE 48 CO -0.09 0.04 -0.62 -1.28 0.00 0.00 0.00 178.15 176.20 2kz4 h SER 49 N 0.21 0.06 0.42 1.72 0.87 -1.05 -2.55 113.55 113.23 2kz4 h SER 49 Ca 0.13 -0.04 0.00 0.00 -1.23 0.00 0.00 61.79 60.65 2kz4 h SER 49 Cb 0.11 -0.02 0.00 0.00 -0.44 0.00 0.00 62.40 62.05 2kz4 h SER 49 CO -0.15 0.66 -0.44 -0.24 -0.53 0.00 0.00 176.83 176.14 2kz4 n SER 50 N -3.82 0.65 0.00 6.23 2.88 -0.62 -5.02 113.62 113.93 2kz4 n SER 50 Ca -0.01 -0.44 0.00 0.00 -1.33 0.00 0.00 58.87 57.08 2kz4 n SER 50 Cb 0.62 0.23 0.00 0.00 -0.75 0.00 0.00 64.21 64.30 2kz4 n SER 50 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2kz4 n GLY 51 N 1.45 1.45 0.28 0.46 0.00 0.01 -2.49 105.19 106.35 2kz4 n GLY 51 Ca 0.07 0.14 0.07 0.00 0.00 0.00 0.00 46.02 46.30 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 6.14 3.20 -0.54 4.61 0.00 -1.26 -4.64 120.51 128.01 2kz4 n ALA 52 Ca 0.00 -0.49 0.00 0.00 0.00 0.00 0.00 53.44 52.95 2kz4 n ALA 52 Cb 0.00 -0.51 0.00 0.00 0.00 0.00 0.00 19.45 18.94 2kz4 n ALA 52 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 2kz4 n GLU 53 N -0.35 0.00 -2.99 0.00 4.07 -1.04 -4.86 120.64 115.48 2kz4 n GLU 53 Ca 0.05 0.23 -0.34 0.00 -0.06 0.00 0.00 57.16 57.04 2kz4 n GLU 53 Cb 0.29 -0.87 -0.06 0.00 -0.06 0.00 0.00 31.44 30.74 2kz4 n GLU 53 CO 0.00 0.00 0.00 -0.51 -0.06 0.00 0.00 177.13 176.56 2kz4 s LEU 54 N -2.37 4.15 0.18 4.31 1.43 -1.26 -5.09 118.68 120.03 2kz4 s LEU 54 Ca 0.00 1.51 0.01 0.00 -1.03 0.00 0.00 54.13 54.62 2kz4 s LEU 54 Cb 0.00 -4.07 -0.05 0.00 0.03 0.00 0.00 46.19 42.11 2kz4 s LEU 54 CO 0.00 -0.16 0.02 0.00 0.23 0.00 0.00 176.35 176.44 2kz4 s ALA 55 N -1.86 1.37 -0.19 4.21 0.00 -1.26 -4.37 121.76 119.67 2kz4 s ALA 55 Ca 0.53 -1.63 -0.29 0.00 0.00 0.00 0.00 51.96 50.56 2kz4 s ALA 55 Cb -0.13 0.67 -0.03 0.00 0.00 0.00 0.00 23.12 23.64 2kz4 s ALA 55 CO 0.18 -0.36 1.51 0.42 0.00 0.00 0.00 175.76 177.51 2kz4 s ILE 56 N -3.71 3.86 0.00 0.00 1.01 -1.26 -1.62 121.20 119.47 2kz4 s ILE 56 Ca 0.27 1.00 0.00 0.00 0.00 0.00 0.00 60.65 61.91 2kz4 s ILE 56 Cb 0.06 -3.78 0.00 0.00 0.01 0.00 0.00 42.46 38.76 2kz4 s ILE 56 CO 0.06 -0.24 0.00 0.61 0.00 0.00 0.00 174.94 175.37 2kz4 n GLY 57 N 4.28 1.39 3.76 6.18 0.00 -1.26 -5.11 105.19 114.43 2kz4 n GLY 57 Ca 0.17 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.78 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 3.54 -0.06 2.61 2.01 -0.64 -2.61 115.64 118.48 2kz4 s THR 58 Ca 0.00 1.52 0.03 0.00 0.31 0.00 0.00 61.69 63.55 2kz4 s THR 58 Cb 0.00 -3.97 0.00 0.00 0.01 0.00 0.00 72.50 68.55 2kz4 s THR 58 CO 0.00 0.35 -0.16 -0.69 -0.69 0.00 0.00 174.62 173.43 2kz4 s VAL 59 N -1.02 1.40 -0.09 3.82 1.01 -0.25 -1.32 120.40 123.94 2kz4 s VAL 59 Ca 0.45 -0.66 -0.07 0.00 0.00 0.00 0.00 61.98 61.70 2kz4 s VAL 59 Cb -0.32 -1.23 -0.04 0.00 0.00 0.00 0.00 36.38 34.80 2kz4 s VAL 59 CO 0.40 0.41 0.16 -0.13 0.00 0.00 0.00 175.10 175.94 2kz4 s ARG 60 N 0.33 3.46 -0.22 2.72 0.52 -0.08 -1.09 118.95 124.60 2kz4 s ARG 60 Ca -0.10 -0.13 -0.03 0.00 -0.52 0.00 0.00 55.73 54.95 2kz4 s ARG 60 Cb -0.14 -3.17 0.07 0.00 0.52 0.00 0.00 34.95 32.22 2kz4 s ARG 60 CO 0.04 0.76 0.05 0.42 0.02 0.00 0.00 175.30 176.59 2kz4 s ILE 61 N -1.08 0.53 -0.36 1.52 1.01 -0.23 -0.53 121.20 122.06 2kz4 s ILE 61 Ca 0.18 -0.69 -0.12 0.00 0.00 0.00 0.00 60.65 60.02 2kz4 s ILE 61 Cb -0.12 -1.12 0.01 0.00 0.01 0.00 0.00 42.46 41.23 2kz4 s ILE 61 CO 0.07 -0.31 0.21 0.26 0.00 0.00 0.00 174.94 175.17 2kz4 s TRP 62 N 1.84 3.22 0.32 3.97 0.52 -0.78 -1.34 118.94 126.70 2kz4 s TRP 62 Ca 0.01 -0.63 0.07 0.00 0.02 0.00 0.00 56.10 55.57 2kz4 s TRP 62 Cb -0.17 -2.45 -0.06 0.00 -1.15 0.00 0.00 33.47 29.64 2kz4 s TRP 62 CO -0.12 -0.52 -0.03 0.96 0.02 0.00 0.00 176.95 177.25 2kz4 s ILE 63 N 1.63 1.75 0.28 2.03 -4.36 -1.04 -0.54 121.20 120.95 2kz4 s ILE 63 Ca 0.04 -2.10 -0.29 0.00 -0.26 0.00 0.00 60.65 58.04 2kz4 s ILE 63 Cb -0.18 -2.65 -0.13 0.00 1.25 0.00 0.00 42.46 40.75 2kz4 s ILE 63 CO 0.08 -0.17 1.23 0.54 0.24 0.00 0.00 174.94 176.85 2kz4 n ARG 64 N -0.71 1.78 -1.63 0.37 5.12 -1.24 -0.74 116.66 119.61 2kz4 n ARG 64 Ca -0.05 0.63 -0.47 0.00 -1.93 0.00 0.00 57.85 56.03 2kz4 n ARG 64 Cb 0.65 -2.16 -0.05 0.00 -1.16 0.00 0.00 32.46 29.74 2kz4 n ARG 64 CO 0.00 0.00 0.00 0.98 -1.93 0.00 0.00 177.63 176.68 2kz4 n TYR 65 N 0.85 2.18 -3.68 -1.55 4.19 -1.26 -4.25 117.16 113.64 2kz4 n TYR 65 Ca 0.09 -0.03 -0.19 0.00 3.31 0.00 0.00 57.90 61.08 2kz4 n TYR 65 Cb 0.32 -2.67 -0.18 0.00 0.49 0.00 0.00 39.34 37.30 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 4.88 -0.07 0.01 2.98 3.52 -1.26 -4.95 118.95 124.05 2kz4 s ARG 66 Ca 0.96 0.36 0.14 0.00 -0.13 0.00 0.00 55.73 57.06 2kz4 s ARG 66 Cb -0.62 -0.48 0.58 0.00 -1.56 0.00 0.00 34.95 32.86 2kz4 s ARG 66 CO 0.47 -0.31 1.43 1.63 -0.81 0.00 0.00 175.30 177.71 2kz4 n LYS 67 N 5.18 0.00 0.08 5.12 4.76 -1.26 -2.95 118.16 129.09 2kz4 n LYS 67 Ca -0.06 0.27 0.11 0.00 -2.87 0.00 0.00 58.31 55.77 2kz4 n LYS 67 Cb 0.50 -1.51 -0.01 0.00 -1.84 0.00 0.00 35.03 32.17 2kz4 n LYS 67 CO 0.00 0.00 0.00 -3.47 -1.37 0.00 0.00 177.40 172.56 2kz4 n ASP 68 N -1.52 0.69 -4.66 4.39 2.03 -1.26 -4.87 116.55 111.36 2kz4 n ASP 68 Ca 0.03 0.22 -0.42 0.00 0.52 0.00 0.00 54.79 55.14 2kz4 n ASP 68 Cb 0.16 0.69 -0.03 0.00 -0.72 0.00 0.00 41.12 41.22 2kz4 n ASP 68 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 2kz4 s ILE 69 N -3.36 3.82 0.39 5.18 -1.09 -1.15 -5.00 121.20 119.98 2kz4 s ILE 69 Ca -0.01 0.99 0.08 0.00 -2.23 0.00 0.00 60.65 59.48 2kz4 s ILE 69 Cb 0.11 -3.64 -0.06 0.00 -1.58 0.00 0.00 42.46 37.28 2kz4 s ILE 69 CO 0.81 -0.09 0.07 0.21 -1.23 0.00 0.00 174.94 174.70 2kz4 s ASN 70 N 2.89 4.14 0.51 3.58 3.84 -1.26 -4.84 114.94 123.79 2kz4 s ASN 70 Ca 0.67 -1.17 0.27 0.00 0.21 0.00 0.00 52.86 52.84 2kz4 s ASN 70 Cb -0.29 -0.45 1.35 0.00 -0.55 0.00 0.00 41.25 41.31 2kz4 s ASN 70 CO 0.24 -0.42 2.03 0.00 -2.79 0.00 0.00 177.10 176.16 2kz4 h ALA 71 N 1.67 1.24 -0.37 1.71 0.00 -1.95 -1.98 119.26 119.57 2kz4 h ALA 71 Ca -0.43 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.35 2kz4 h ALA 71 Cb 1.25 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.02 2kz4 h ALA 71 CO 0.73 0.18 0.00 0.25 0.00 0.00 0.00 179.25 180.41 2kz4 n THR 72 N -3.60 0.88 -3.73 0.00 -2.24 -1.26 -4.59 114.28 99.75 2kz4 n THR 72 Ca -0.01 -0.62 -0.37 0.00 -2.27 0.00 0.00 64.05 60.78 2kz4 n THR 72 Cb 0.27 0.04 -0.11 0.00 -2.10 0.00 0.00 70.33 68.43 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 -0.80 5.36 0.86 3.42 0.01 -0.74 -3.18 113.70 118.63 2kz4 s SER 73 Ca 0.28 -1.98 -0.12 0.00 1.31 0.00 0.00 55.95 55.44 2kz4 s SER 73 Cb 0.17 -1.87 0.11 0.00 0.21 0.00 0.00 66.02 64.64 2kz4 s SER 73 CO 0.15 -0.57 1.10 -0.13 0.41 0.00 0.00 173.24 174.19 2kz4 s ARG 74 N 1.20 1.54 -0.12 12.44 0.52 -0.12 -4.72 118.95 129.69 2kz4 s ARG 74 Ca 0.07 0.70 0.01 0.00 -0.52 0.00 0.00 55.73 55.99 2kz4 s ARG 74 Cb -0.23 -1.85 -0.01 0.00 0.52 0.00 0.00 34.95 33.37 2kz4 s ARG 74 CO -0.03 -2.01 -0.16 0.42 0.02 0.00 0.00 175.30 173.54 2kz4 s ILE 75 N -3.05 2.80 -0.20 1.52 1.09 -0.56 -0.88 121.20 121.91 2kz4 s ILE 75 Ca 0.62 -0.76 0.01 0.00 -1.10 0.00 0.00 60.65 59.42 2kz4 s ILE 75 Cb -0.16 -2.15 0.05 0.00 -1.06 0.00 0.00 42.46 39.13 2kz4 s ILE 75 CO 0.56 0.54 -0.09 -0.75 -0.10 0.00 0.00 174.94 175.10 2kz4 s LYS 76 N 0.31 1.86 -0.18 2.79 2.20 -0.50 0.28 119.74 126.51 2kz4 s LYS 76 Ca -0.12 -0.82 -0.29 0.00 -0.36 0.00 0.00 55.97 54.38 2kz4 s LYS 76 Cb -0.16 -2.38 -0.04 0.00 -1.51 0.00 0.00 37.83 33.74 2kz4 s LYS 76 CO 0.06 -0.46 1.67 0.08 -0.36 0.00 0.00 175.35 176.34 2kz4 s VAL 77 N 1.43 3.62 -0.09 4.02 1.01 -1.06 -1.05 120.40 128.27 2kz4 s VAL 77 Ca -0.02 0.71 0.23 0.00 0.00 0.00 0.00 61.98 62.89 2kz4 s VAL 77 Cb -0.17 -3.60 0.23 0.00 0.00 0.00 0.00 36.38 32.85 2kz4 s VAL 77 CO -0.08 -0.22 1.69 -1.28 0.00 0.00 0.00 175.10 175.21 2kz4 h SER 78 N 10.71 0.00 -2.54 3.32 0.87 -1.32 -1.36 113.55 123.23 2kz4 h SER 78 Ca -0.36 0.00 0.09 0.00 -1.23 0.00 0.00 61.79 60.30 2kz4 h SER 78 Cb 1.17 0.00 -0.25 0.00 -0.44 0.00 0.00 62.40 62.87 2kz4 h SER 78 CO 0.99 0.22 0.26 0.28 -0.53 0.00 0.00 176.83 178.05 2kz4 s THR 79 N -3.35 -0.06 -5.00 2.23 -1.32 -0.66 -4.86 115.64 102.61 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 0.66 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.68 2kz4 n GLY 80 N 4.00 -0.28 0.14 6.08 0.00 -1.26 -2.36 105.19 111.50 2kz4 n GLY 80 Ca -0.18 -1.45 0.12 0.00 0.00 0.00 0.00 46.02 44.52 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 1.73 0.00 -0.35 1.61 0.13 -1.99 -2.98 132.00 130.15 2kz4 h PRO 81 Ca 0.00 0.00 -0.27 0.00 -0.87 0.00 0.00 66.00 64.86 2kz4 h PRO 81 Cb 0.00 0.00 -0.24 0.00 0.13 0.00 0.00 31.00 30.89 2kz4 h PRO 81 CO 0.00 0.00 -0.72 1.28 -0.23 0.00 0.00 178.00 178.33 2kz4 n LEU 82 N -2.30 3.47 -4.61 1.56 4.77 -1.26 -5.05 117.00 113.58 2kz4 n LEU 82 Ca 0.02 -4.08 -0.43 0.00 -0.03 0.00 0.00 56.01 51.49 2kz4 n LEU 82 Cb 0.24 -0.34 -0.03 0.00 -2.33 0.00 0.00 43.42 40.95 2kz4 n LEU 82 CO 0.20 1.62 1.81 0.00 -1.33 0.00 0.00 177.39 179.70 2kz4 n ALA 83 N -0.79 1.75 0.00 -1.18 0.00 -1.13 -1.34 120.51 117.82 2kz4 n ALA 83 Ca 0.28 -0.17 0.00 0.00 0.00 0.00 0.00 53.44 53.55 2kz4 n ALA 83 Cb 0.85 -2.88 0.00 0.00 0.00 0.00 0.00 19.45 17.42 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 5.57 2.49 3.73 0.00 0.00 -0.51 -5.01 105.19 111.45 2kz4 n GLY 84 Ca 0.28 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.90 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 -0.71 4.51 -0.52 1.61 1.81 -0.45 -4.88 118.95 120.31 2kz4 s ARG 85 Ca 0.00 1.11 -0.16 0.00 -1.72 0.00 0.00 55.73 54.96 2kz4 s ARG 85 Cb 0.00 -3.41 0.11 0.00 -0.45 0.00 0.00 34.95 31.20 2kz4 s ARG 85 CO 0.00 0.15 0.49 0.54 -0.68 0.00 0.00 175.30 175.80 2kz4 s VAL 86 N 0.41 5.17 -0.14 3.52 0.11 -1.26 -2.57 120.40 125.64 2kz4 s VAL 86 Ca 0.42 -1.26 -0.28 0.00 -2.93 0.00 0.00 61.98 57.92 2kz4 s VAL 86 Cb -0.20 -4.28 -0.01 0.00 -1.53 0.00 0.00 36.38 30.36 2kz4 s VAL 86 CO 0.23 -0.79 0.95 -0.76 -3.33 0.00 0.00 175.10 171.39 2kz4 s LEU 87 N 1.76 4.21 -0.09 2.54 2.01 0.14 -0.88 118.68 128.38 2kz4 s LEU 87 Ca 0.05 1.39 -0.06 0.00 0.01 0.00 0.00 54.13 55.52 2kz4 s LEU 87 Cb -0.27 -3.44 -0.04 0.00 0.01 0.00 0.00 46.19 42.45 2kz4 s LEU 87 CO 0.05 -0.45 0.16 0.20 1.01 0.00 0.00 176.35 177.33 2kz4 s ASN 88 N 1.12 6.40 -0.01 2.29 0.02 -0.12 -1.50 114.94 123.15 2kz4 s ASN 88 Ca 0.44 0.46 -0.30 0.00 -1.02 0.00 0.00 52.86 52.45 2kz4 s ASN 88 Cb -0.17 -2.06 -0.03 0.00 0.02 0.00 0.00 41.25 39.00 2kz4 s ASN 88 CO 0.15 0.37 1.06 -0.63 0.02 0.00 0.00 177.10 178.07 2kz4 s ILE 89 N -1.11 4.60 -0.87 0.60 1.01 -1.26 -1.44 121.20 122.73 2kz4 s ILE 89 Ca 0.18 1.87 0.01 0.00 0.00 0.00 0.00 60.65 62.71 2kz4 s ILE 89 Cb -0.12 -4.20 0.29 0.00 0.01 0.00 0.00 42.46 38.44 2kz4 s ILE 89 CO 0.08 0.10 1.19 2.30 0.00 0.00 0.00 174.94 178.62 2kz4 n ILE 90 N 4.11 4.11 0.00 2.92 -5.35 -1.06 -4.95 119.36 119.15 2kz4 n ILE 90 Ca 0.08 -5.65 0.00 0.00 -0.27 0.00 0.00 62.75 56.91 2kz4 n ILE 90 Cb 0.49 -1.99 0.00 0.00 -1.74 0.00 0.00 39.64 36.40 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 0.91 0.10 2.96 3.28 0.00 -1.26 -4.83 105.19 106.34 2kz4 n GLY 91 Ca 0.30 -0.37 -0.10 0.00 0.00 0.00 0.00 46.02 45.84 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 0.22 -0.49 1.61 0.00 -1.26 -4.81 119.66 114.94 2kz4 s GLN 92 Ca 0.00 -0.37 -0.27 0.00 -0.00 0.00 0.00 55.36 54.72 2kz4 s GLN 92 Cb 0.00 0.08 -0.05 0.00 0.00 0.00 0.00 33.01 33.05 2kz4 s GLN 92 CO 0.00 -0.04 2.14 -1.25 0.00 0.00 0.00 175.29 176.14 2kz4 s PRO 93 N -0.94 2.51 -0.41 9.60 0.04 -1.26 -4.65 135.00 139.89 2kz4 s PRO 93 Ca -0.10 1.20 -0.28 0.00 0.04 0.00 0.00 61.00 61.85 2kz4 s PRO 93 Cb -0.06 -4.45 0.02 0.00 0.04 0.00 0.00 34.50 30.05 2kz4 s PRO 93 CO -0.00 -2.82 1.08 -1.17 0.04 0.00 0.00 177.00 174.12 2kz4 s LEU 94 N 10.19 3.80 0.28 -3.56 1.98 -0.37 -4.92 118.68 126.07 2kz4 s LEU 94 Ca 0.86 0.66 -0.29 0.00 -2.89 0.00 0.00 54.13 52.46 2kz4 s LEU 94 Cb -0.18 -3.50 -0.10 0.00 0.66 0.00 0.00 46.19 43.08 2kz4 s LEU 94 CO 0.26 -1.07 1.35 -2.84 -1.89 0.00 0.00 176.35 172.16 2kz4 s PRO 95 N 4.03 4.33 0.49 0.98 0.02 -1.26 -0.63 135.00 142.97 2kz4 s PRO 95 Ca 0.45 2.21 -0.23 0.00 0.02 0.00 0.00 61.00 63.45 2kz4 s PRO 95 Cb -0.10 -3.11 -0.07 0.00 0.02 0.00 0.00 34.50 31.25 2kz4 s PRO 95 CO 0.24 -0.28 1.33 -3.47 -0.33 0.00 0.00 177.00 174.50 2kz4 n ASP 96 N 1.68 2.72 0.23 2.53 2.03 -1.07 -4.80 116.55 119.87 2kz4 n ASP 96 Ca 0.03 1.04 0.11 0.00 0.52 0.00 0.00 54.79 56.49 2kz4 n ASP 96 Cb 0.41 -1.55 0.51 0.00 -0.72 0.00 0.00 41.12 39.77 2kz4 n ASP 96 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2kz4 h ALA 97 N 1.78 1.06 -0.01 -1.67 0.00 -1.94 -1.66 119.26 116.82 2kz4 h ALA 97 Ca -0.50 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.22 2kz4 h ALA 97 Cb 1.30 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.05 2kz4 h ALA 97 CO 0.58 0.26 -0.38 0.00 0.00 0.00 0.00 179.25 179.71 2kz4 n ALA 98 N -2.23 3.35 -1.80 0.00 0.00 -1.26 -4.97 120.51 113.60 2kz4 n ALA 98 Ca -0.00 -0.51 -0.20 0.00 0.00 0.00 0.00 53.44 52.73 2kz4 n ALA 98 Cb 0.39 -0.98 -0.06 0.00 0.00 0.00 0.00 19.45 18.80 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 -0.43 -1.44 0.01 0.00 3.00 -0.62 -4.87 116.66 112.30 2kz4 n ARG 99 Ca 0.11 1.14 0.13 0.00 -0.01 0.00 0.00 57.85 59.21 2kz4 n ARG 99 Cb 0.40 -5.56 0.39 0.00 0.00 0.00 0.00 32.46 27.69 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 -2.86 0.04 -3.68 0.55 -2.24 -1.26 -4.71 114.28 100.11 2kz4 n THR 100 Ca -0.21 -0.03 -0.05 0.00 -2.27 0.00 0.00 64.05 61.50 2kz4 n THR 100 Cb 0.66 -0.08 0.02 0.00 -2.10 0.00 0.00 70.33 68.83 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 -1.56 0.71 -3.88 -0.78 1.85 -1.26 -4.31 116.66 107.43 2kz4 n ARG 101 Ca 0.06 -1.45 -0.28 0.00 -1.00 0.00 0.00 57.85 55.18 2kz4 n ARG 101 Cb 0.35 1.86 -0.17 0.00 -1.05 0.00 0.00 32.46 33.45 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 1.50 -0.66 2.89 1.98 0.08 -2.59 118.68 121.89 2kz4 s LEU 102 Ca 0.14 -0.60 -0.26 0.00 -2.89 0.00 0.00 54.13 50.52 2kz4 s LEU 102 Cb -0.03 -0.87 0.04 0.00 0.66 0.00 0.00 46.19 45.98 2kz4 s LEU 102 CO 0.07 -0.18 1.16 -0.70 -1.89 0.00 0.00 176.35 174.81 2kz4 s GLU 103 N 1.66 3.27 -0.22 1.98 2.56 0.20 -2.49 118.70 125.67 2kz4 s GLU 103 Ca 0.01 -0.23 -0.12 0.00 0.00 0.00 0.00 54.97 54.64 2kz4 s GLU 103 Cb -0.15 -4.13 -0.05 0.00 2.00 0.00 0.00 34.13 31.80 2kz4 s GLU 103 CO -0.08 -1.89 0.21 0.42 -0.56 0.00 0.00 175.26 173.37 2kz4 s ILE 104 N 5.01 5.33 -0.15 -3.70 -1.09 -0.45 -1.24 121.20 124.91 2kz4 s ILE 104 Ca 0.34 0.30 -0.06 0.00 -2.23 0.00 0.00 60.65 59.00 2kz4 s ILE 104 Cb -0.10 -3.55 -0.04 0.00 -1.58 0.00 0.00 42.46 37.19 2kz4 s ILE 104 CO 0.17 0.34 0.07 -1.48 -1.23 0.00 0.00 174.94 172.81 2kz4 s LEU 105 N 0.98 3.89 0.35 2.97 2.34 -1.26 -1.07 118.68 126.88 2kz4 s LEU 105 Ca 0.10 0.18 -0.08 0.00 0.06 0.00 0.00 54.13 54.39 2kz4 s LEU 105 Cb -0.13 -1.96 0.02 0.00 -0.56 0.00 0.00 46.19 43.56 2kz4 s LEU 105 CO 0.04 0.27 0.60 0.00 -1.06 0.00 0.00 176.35 176.20 2kz4 s ARG 107 N -2.86 0.88 0.05 0.00 1.70 -0.52 -1.09 118.95 117.11 2kz4 s ARG 107 Ca 0.24 -1.17 -0.31 0.00 -0.47 0.00 0.00 55.73 54.01 2kz4 s ARG 107 Cb -0.02 0.30 -0.10 0.00 -0.57 0.00 0.00 34.95 34.55 2kz4 s ARG 107 CO 0.16 -0.26 1.91 -1.91 -1.08 0.00 0.00 175.30 174.12 2kz4 n GLU 108 N -0.06 2.73 -1.11 3.89 2.13 -1.07 -0.94 120.64 126.21 2kz4 n GLU 108 Ca -0.11 1.00 -0.20 0.00 0.66 0.00 0.00 57.16 58.51 2kz4 n GLU 108 Cb 0.62 -2.91 -0.01 0.00 0.27 0.00 0.00 31.44 29.41 2kz4 n GLU 108 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2kz4 n GLY 109 N 4.40 4.08 3.87 8.31 0.00 -0.06 -4.82 105.19 120.98 2kz4 n GLY 109 Ca 0.20 -1.36 -0.30 0.00 0.00 0.00 0.00 46.02 44.55 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 0.71 -2.29 0.22 4.61 0.00 -1.26 -4.89 120.51 117.62 2kz4 n ALA 110 Ca 0.37 -0.30 0.12 0.00 0.00 0.00 0.00 53.44 53.63 2kz4 n ALA 110 Cb 0.59 -2.61 0.31 0.00 0.00 0.00 0.00 19.45 17.74 2kz4 n ALA 110 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.50 178.55 2kz4 h GLU 111 N -1.95 0.00 -0.00 0.00 -0.00 -1.88 -3.52 114.58 107.23 2kz4 h GLU 111 Ca -0.65 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 58.71 2kz4 h GLU 111 Cb 1.37 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 30.12 2kz4 h GLU 111 CO 0.56 0.09 0.00 0.36 -0.00 0.00 0.00 179.01 180.02