#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1zxi s ALA 4 N 0.00 3.88 -0.20 7.82 0.00 0.23 -4.84 121.76 128.65 1zxi s ALA 4 Ca 0.00 -0.79 -0.15 0.00 0.00 0.00 0.00 51.96 51.02 1zxi s ALA 4 Cb 0.00 -1.82 -0.04 0.00 0.00 0.00 0.00 23.12 21.26 1zxi s ALA 4 CO 0.00 0.74 0.35 -1.58 0.00 0.00 0.00 175.76 175.27 1zxi s HIS 5 N -1.30 3.38 0.10 0.00 2.46 -1.26 -0.95 115.29 117.73 1zxi s HIS 5 Ca 0.26 0.57 0.09 0.00 0.47 0.00 0.00 55.06 56.44 1zxi s HIS 5 Cb -0.12 -2.46 -0.04 0.00 -0.13 0.00 0.00 32.58 29.83 1zxi s HIS 5 CO 0.18 0.04 -0.22 0.96 -2.47 0.00 0.00 174.74 173.23 1zxi s ILE 6 N 1.13 1.79 -0.03 0.89 -4.36 -0.13 -5.00 121.20 115.50 1zxi s ILE 6 Ca 0.17 -1.56 0.01 0.00 -0.26 0.00 0.00 60.65 59.01 1zxi s ILE 6 Cb -0.14 -1.62 0.01 0.00 1.25 0.00 0.00 42.46 41.96 1zxi s ILE 6 CO 0.07 -0.03 -0.05 -1.61 0.24 0.00 0.00 174.94 173.56 1zxi s GLU 7 N -1.90 0.67 0.05 0.37 2.02 -1.26 -1.19 118.70 117.45 1zxi s GLU 7 Ca 0.08 -0.13 -0.01 0.00 0.02 0.00 0.00 54.97 54.93 1zxi s GLU 7 Cb -0.10 -0.68 0.00 0.00 0.10 0.00 0.00 34.13 33.45 1zxi s GLU 7 CO 0.04 -0.01 0.08 1.47 0.02 0.00 0.00 175.26 176.86 1zxi n LEU 8 N 3.67 0.00 -4.06 1.80 -0.00 -0.08 -0.21 117.00 118.12 1zxi n LEU 8 Ca -0.22 -0.33 -0.29 0.00 -0.00 0.00 0.00 56.01 55.17 1zxi n LEU 8 Cb 0.53 0.41 -0.17 0.00 -0.00 0.00 0.00 43.42 44.19 1zxi n LEU 8 CO 0.24 -0.10 -0.50 -0.89 -0.00 0.00 0.00 177.39 176.15 1zxi s THR 9 N -2.73 1.55 -0.13 1.47 2.01 -0.45 -0.35 115.64 117.02 1zxi s THR 9 Ca 0.03 -0.67 0.01 0.00 0.31 0.00 0.00 61.69 61.37 1zxi s THR 9 Cb -0.00 -1.42 0.02 0.00 0.01 0.00 0.00 72.50 71.11 1zxi s THR 9 CO 0.02 0.45 -0.15 -0.63 -0.69 0.00 0.00 174.62 173.62 1zxi s ILE 10 N 1.04 1.53 -1.54 1.82 1.01 -0.24 -0.17 121.20 124.64 1zxi s ILE 10 Ca -0.05 -0.63 -0.14 0.00 0.00 0.00 0.00 60.65 59.82 1zxi s ILE 10 Cb -0.15 -1.41 0.09 0.00 0.01 0.00 0.00 42.46 41.00 1zxi s ILE 10 CO -0.03 0.45 0.98 0.59 0.00 0.00 0.00 174.94 176.93 1zxi n ASN 11 N 4.46 -4.78 0.00 3.58 3.02 0.64 -1.62 115.26 120.56 1zxi n ASN 11 Ca -0.18 -0.79 0.00 0.00 -0.03 0.00 0.00 54.58 53.58 1zxi n ASN 11 Cb 0.51 -3.83 0.00 0.00 -0.61 0.00 0.00 39.78 35.84 1zxi n ASN 11 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1zxi n GLY 12 N -1.68 1.21 3.52 7.41 0.00 -1.26 -4.98 105.19 109.41 1zxi n GLY 12 Ca 0.05 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.73 1zxi n GLY 12 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1zxi s HIS 13 N -3.65 2.80 0.40 1.61 3.76 -0.64 -5.09 115.29 114.48 1zxi s HIS 13 Ca 0.00 -0.09 -0.26 0.00 -0.15 0.00 0.00 55.06 54.56 1zxi s HIS 13 Cb 0.00 -1.66 -0.09 0.00 1.11 0.00 0.00 32.58 31.94 1zxi s HIS 13 CO 0.00 0.24 1.32 -2.14 -0.85 0.00 0.00 174.74 173.31 1zxi s PRO 14 N -0.75 3.97 -0.02 8.40 0.02 -1.26 -1.08 135.00 144.28 1zxi s PRO 14 Ca 0.12 2.19 0.02 0.00 0.02 0.00 0.00 61.00 63.34 1zxi s PRO 14 Cb -0.11 -2.77 0.00 0.00 0.02 0.00 0.00 34.50 31.65 1zxi s PRO 14 CO 0.01 -0.50 -0.06 0.08 -0.33 0.00 0.00 177.00 176.19 1zxi s VAL 15 N -1.25 0.54 -0.04 3.83 1.01 0.53 -4.87 120.40 120.15 1zxi s VAL 15 Ca 0.57 -0.24 0.02 0.00 0.00 0.00 0.00 61.98 62.33 1zxi s VAL 15 Cb -0.39 -0.49 0.01 0.00 0.00 0.00 0.00 36.38 35.52 1zxi s VAL 15 CO 0.50 0.18 -0.08 -0.70 0.00 0.00 0.00 175.10 174.99 1zxi s GLU 16 N 0.18 1.08 0.26 2.72 2.12 -1.26 -0.90 118.70 122.90 1zxi s GLU 16 Ca -0.02 -0.26 -0.17 0.00 0.36 0.00 0.00 54.97 54.89 1zxi s GLU 16 Cb -0.06 -0.99 0.01 0.00 0.26 0.00 0.00 34.13 33.35 1zxi s GLU 16 CO -0.00 0.02 0.59 0.00 -0.54 0.00 0.00 175.26 175.33 1zxi s ALA 17 N 0.56 -0.73 -0.13 6.30 0.00 -0.34 -5.01 121.76 122.41 1zxi s ALA 17 Ca -0.09 -0.58 0.01 0.00 0.00 0.00 0.00 51.96 51.30 1zxi s ALA 17 Cb -0.12 0.96 -0.01 0.00 0.00 0.00 0.00 23.12 23.94 1zxi s ALA 17 CO 0.01 -0.93 -0.15 -0.51 0.00 0.00 0.00 175.76 174.18 1zxi s LEU 18 N -2.96 2.57 0.05 0.00 1.43 -1.26 -0.95 118.68 117.56 1zxi s LEU 18 Ca 0.16 -0.39 0.00 0.00 -1.03 0.00 0.00 54.13 52.88 1zxi s LEU 18 Cb -0.03 -1.57 -0.03 0.00 0.03 0.00 0.00 46.19 44.59 1zxi s LEU 18 CO 0.07 0.15 -0.04 0.68 0.23 0.00 0.00 176.35 177.44 1zxi s VAL 19 N 0.41 0.33 0.39 -1.59 -7.23 -0.12 -4.92 120.40 107.67 1zxi s VAL 19 Ca -0.12 -1.58 -0.18 0.00 -1.81 0.00 0.00 61.98 58.29 1zxi s VAL 19 Cb -0.16 -1.20 -0.10 0.00 0.56 0.00 0.00 36.38 35.48 1zxi s VAL 19 CO 0.06 -0.81 0.86 -1.61 -0.31 0.00 0.00 175.10 173.29 1zxi s GLU 20 N -3.15 4.13 0.33 4.82 0.41 -1.26 0.78 118.70 124.75 1zxi s GLU 20 Ca 0.02 0.93 0.03 0.00 -0.41 0.00 0.00 54.97 55.54 1zxi s GLU 20 Cb 0.02 -2.28 0.63 0.00 -1.78 0.00 0.00 34.13 30.72 1zxi s GLU 20 CO -0.06 0.04 1.93 -1.35 -0.49 0.00 0.00 175.26 175.33 1zxi h PRO 21 N 2.02 0.88 0.00 0.39 0.11 -1.96 -2.17 132.00 131.26 1zxi h PRO 21 Ca -0.48 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.57 1zxi h PRO 21 Cb 1.18 -0.20 0.00 0.00 0.11 0.00 0.00 31.00 32.09 1zxi h PRO 21 CO 0.63 0.58 0.00 2.89 -0.21 0.00 0.00 178.00 181.89 1zxi n ARG 22 N -4.49 0.33 -1.99 1.05 1.85 -1.26 -4.61 116.66 107.54 1zxi n ARG 22 Ca 0.13 0.07 -0.42 0.00 -1.00 0.00 0.00 57.85 56.62 1zxi n ARG 22 Cb 0.23 -1.50 -0.03 0.00 -1.05 0.00 0.00 32.46 30.11 1zxi n ARG 22 CO 0.00 0.00 0.00 0.99 -0.01 0.00 0.00 177.63 178.61 1zxi s THR 23 N -2.57 3.56 0.45 8.89 2.01 -0.82 -4.96 115.64 122.20 1zxi s THR 23 Ca 0.22 0.68 -0.23 0.00 0.31 0.00 0.00 61.69 62.66 1zxi s THR 23 Cb 0.16 -3.44 -0.07 0.00 0.01 0.00 0.00 72.50 69.15 1zxi s THR 23 CO 0.35 -0.06 1.19 -0.76 -0.69 0.00 0.00 174.62 174.65 1zxi s LEU 24 N 4.07 4.05 0.31 4.42 1.43 -1.26 -1.34 118.68 130.36 1zxi s LEU 24 Ca 0.74 2.37 0.03 0.00 -1.03 0.00 0.00 54.13 56.23 1zxi s LEU 24 Cb -0.34 -4.18 0.60 0.00 0.03 0.00 0.00 46.19 42.30 1zxi s LEU 24 CO 0.30 -0.91 1.89 0.25 0.23 0.00 0.00 176.35 178.11 1zxi h LEU 25 N 2.17 0.85 -1.20 1.79 5.85 -0.70 -1.13 115.31 122.95 1zxi h LEU 25 Ca -0.49 0.02 0.04 0.00 0.84 0.00 0.00 57.88 58.29 1zxi h LEU 25 Cb 1.25 -0.16 -0.05 0.00 0.37 0.00 0.00 40.66 42.07 1zxi h LEU 25 CO 0.61 0.51 0.55 -0.29 -0.34 0.00 0.00 178.44 179.48 1zxi h ILE 26 N 0.95 1.12 0.03 4.05 6.09 -1.36 -0.06 117.51 128.33 1zxi h ILE 26 Ca 0.42 -0.35 -0.22 0.00 -1.37 0.00 0.00 64.86 63.34 1zxi h ILE 26 Cb 0.36 0.01 -0.01 0.00 0.47 0.00 0.00 36.82 37.65 1zxi h ILE 26 CO -0.18 0.19 -0.97 0.45 -3.07 0.00 0.00 178.15 174.57 1zxi h HIS 27 N 1.02 0.31 -0.39 2.19 3.86 -1.54 -1.32 115.15 119.28 1zxi h HIS 27 Ca 0.34 -0.19 -0.01 0.00 -1.16 0.00 0.00 60.37 59.35 1zxi h HIS 27 Cb 0.07 -0.03 -0.02 0.00 1.06 0.00 0.00 27.41 28.49 1zxi h HIS 27 CO -0.00 1.05 0.21 0.35 0.86 0.00 0.00 177.93 180.40 1zxi h PHE 28 N 0.09 0.54 -0.23 2.45 3.57 -0.70 0.33 116.94 122.99 1zxi h PHE 28 Ca -0.06 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.40 1zxi h PHE 28 Cb 1.63 -0.17 -0.01 0.00 2.79 0.00 0.00 35.95 40.19 1zxi h PHE 28 CO 0.03 0.42 0.04 0.82 -2.23 0.00 0.00 178.31 177.40 1zxi h ILE 29 N 0.50 1.22 0.07 1.41 2.04 -0.98 -1.45 117.51 120.32 1zxi h ILE 29 Ca 0.14 -0.73 -0.11 0.00 1.00 0.00 0.00 64.86 65.16 1zxi h ILE 29 Cb 0.06 1.27 0.01 0.00 -0.74 0.00 0.00 36.82 37.42 1zxi h ILE 29 CO -0.02 0.23 -0.48 0.03 0.00 0.00 0.00 178.15 177.91 1zxi h ARG 30 N 0.18 0.21 0.15 2.37 3.08 -1.16 -0.93 114.38 118.28 1zxi h ARG 30 Ca 0.07 -0.31 -0.32 0.00 0.07 0.00 0.00 59.98 59.48 1zxi h ARG 30 Cb 0.30 0.11 0.00 0.00 0.08 0.00 0.00 29.97 30.46 1zxi h ARG 30 CO 0.00 1.11 -1.61 0.93 -1.07 0.00 0.00 179.97 179.33 1zxi h GLU 31 N -0.54 0.31 0.05 0.04 4.39 -0.46 -3.11 114.58 115.26 1zxi h GLU 31 Ca -0.08 -0.54 -0.37 0.00 0.34 0.00 0.00 59.36 58.71 1zxi h GLU 31 Cb 1.33 0.20 -0.05 0.00 -0.10 0.00 0.00 28.75 30.13 1zxi h GLU 31 CO 0.09 1.20 -2.25 1.04 -1.16 0.00 0.00 179.01 177.93 1zxi n GLN 32 N -3.51 0.69 0.00 2.33 6.02 -0.84 -4.42 117.38 117.65 1zxi n GLN 32 Ca -0.20 0.19 0.12 0.00 -0.01 0.00 0.00 57.00 57.11 1zxi n GLN 32 Cb 1.06 -1.61 0.23 0.00 1.02 0.00 0.00 30.24 30.94 1zxi n GLN 32 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 1zxi n GLN 33 N -3.30 1.41 -2.67 -1.09 1.13 -0.61 -4.96 117.38 107.29 1zxi n GLN 33 Ca -0.38 -1.03 -0.17 0.00 -1.94 0.00 0.00 57.00 53.47 1zxi n GLN 33 Cb 1.03 -1.48 -0.00 0.00 0.11 0.00 0.00 30.24 29.90 1zxi n GLN 33 CO 0.00 0.00 0.00 0.09 -1.44 0.00 0.00 177.06 175.71 1zxi n ASN 34 N 0.10 -4.58 -4.37 1.08 5.03 -1.09 -4.89 115.26 106.54 1zxi n ASN 34 Ca 0.13 -0.01 -0.45 0.00 0.87 0.00 0.00 54.58 55.12 1zxi n ASN 34 Cb 0.44 -3.82 -0.00 0.00 -1.02 0.00 0.00 39.78 35.37 1zxi n ASN 34 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 1zxi s LEU 35 N -6.00 6.07 -0.01 3.41 1.43 -0.37 -4.88 118.68 118.33 1zxi s LEU 35 Ca 0.11 -3.26 0.04 0.00 -1.03 0.00 0.00 54.13 49.99 1zxi s LEU 35 Cb -0.05 -2.26 0.13 0.00 0.03 0.00 0.00 46.19 44.04 1zxi s LEU 35 CO 0.14 -0.46 1.05 0.35 0.23 0.00 0.00 176.35 177.65 1zxi n THR 36 N 3.43 0.25 -0.10 5.49 -2.24 -1.26 -3.98 114.28 115.87 1zxi n THR 36 Ca 0.25 -0.21 -0.12 0.00 -2.27 0.00 0.00 64.05 61.70 1zxi n THR 36 Cb 0.42 0.01 -0.04 0.00 -2.10 0.00 0.00 70.33 68.61 1zxi n THR 36 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 1zxi h GLY 37 N 5.54 0.68 -4.02 3.38 0.00 -1.96 -3.43 103.07 103.27 1zxi h GLY 37 Ca 0.00 -0.64 -0.53 0.00 0.00 0.00 0.00 47.33 46.16 1zxi h GLY 37 CO 0.02 0.58 0.75 0.00 0.00 0.00 0.00 176.54 177.88 1zxi s ALA 38 N -4.51 3.58 0.29 3.60 0.00 -1.26 -4.67 121.76 118.79 1zxi s ALA 38 Ca -0.13 1.44 0.07 0.00 0.00 0.00 0.00 51.96 53.34 1zxi s ALA 38 Cb 0.08 -3.57 -0.06 0.00 0.00 0.00 0.00 23.12 19.58 1zxi s ALA 38 CO 0.80 -0.87 -0.07 -1.01 0.00 0.00 0.00 175.76 174.62 1zxi s HIS 39 N -0.81 2.06 -0.22 0.00 3.76 -0.84 -4.95 115.29 114.30 1zxi s HIS 39 Ca 0.54 -0.65 -0.04 0.00 -0.15 0.00 0.00 55.06 54.76 1zxi s HIS 39 Cb -0.44 -1.18 -0.01 0.00 1.11 0.00 0.00 32.58 32.06 1zxi s HIS 39 CO 0.55 0.35 -0.03 0.42 -0.85 0.00 0.00 174.74 175.18 1zxi s ILE 40 N -2.92 3.57 -0.18 0.60 1.01 -1.26 -1.89 121.20 120.13 1zxi s ILE 40 Ca 0.30 -0.43 0.02 0.00 0.00 0.00 0.00 60.65 60.54 1zxi s ILE 40 Cb 0.03 -2.62 0.01 0.00 0.01 0.00 0.00 42.46 39.89 1zxi s ILE 40 CO 0.13 0.42 0.41 0.61 0.00 0.00 0.00 174.94 176.51 1zxi n GLY 41 N 4.65 -0.69 3.83 6.18 0.00 -1.26 -5.05 105.19 112.84 1zxi n GLY 41 Ca -0.18 -0.05 -0.05 0.00 0.00 0.00 0.00 46.02 45.74 1zxi n GLY 41 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1zxi n ASP 43 N -0.97 1.91 0.00 0.00 5.68 -1.26 -4.72 116.55 117.19 1zxi n ASP 43 Ca -0.05 -2.20 0.00 0.00 -0.50 0.00 0.00 54.79 52.04 1zxi n ASP 43 Cb 0.60 -0.11 0.00 0.00 -1.14 0.00 0.00 41.12 40.47 1zxi n ASP 43 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 1zxi n THR 44 N -0.68 0.73 -1.19 2.12 -2.24 -1.26 -5.01 114.28 106.75 1zxi n THR 44 Ca 0.04 -0.76 -0.07 0.00 -2.27 0.00 0.00 64.05 61.00 1zxi n THR 44 Cb 0.37 0.65 -0.03 0.00 -2.10 0.00 0.00 70.33 69.22 1zxi n THR 44 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1zxi n SER 45 N -0.37 -3.89 0.01 3.42 7.64 -1.26 -4.95 113.62 114.22 1zxi n SER 45 Ca 0.00 0.16 -0.18 0.00 1.01 0.00 0.00 58.87 59.86 1zxi n SER 45 Cb 0.29 -1.96 -0.14 0.00 -1.01 0.00 0.00 64.21 61.39 1zxi n SER 45 CO 0.00 0.00 0.00 0.45 -3.01 0.00 0.00 175.04 172.48 1zxi h HIS 46 N 0.00 0.38 0.00 1.43 3.86 -1.94 -3.42 115.15 115.46 1zxi h HIS 46 Ca -0.13 -0.28 -0.11 0.00 -1.16 0.00 0.00 60.37 58.69 1zxi h HIS 46 Cb 0.46 -0.02 -0.02 0.00 1.06 0.00 0.00 27.41 28.90 1zxi h HIS 46 CO 0.20 1.57 -0.51 0.00 0.86 0.00 0.00 177.93 180.06 1zxi n GLY 48 N 0.50 0.43 0.23 0.00 0.00 -1.14 -0.50 105.19 104.71 1zxi n GLY 48 Ca -0.00 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.18 1zxi n GLY 48 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1zxi h ALA 49 N 0.00 1.00 -0.57 4.61 0.00 -1.87 -1.93 119.26 120.49 1zxi h ALA 49 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1zxi h ALA 49 Cb 0.23 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1zxi h ALA 49 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.25 1zxi s THR 51 N -1.43 2.69 0.18 0.00 2.01 -0.73 -2.49 115.64 115.86 1zxi s THR 51 Ca 0.41 0.45 0.05 0.00 0.31 0.00 0.00 61.69 62.91 1zxi s THR 51 Cb 0.23 -3.29 -0.05 0.00 0.01 0.00 0.00 72.50 69.40 1zxi s THR 51 CO 0.24 0.03 -0.08 0.68 -0.69 0.00 0.00 174.62 174.80 1zxi s VAL 52 N 1.36 1.25 -0.26 3.82 -7.23 -0.55 -4.51 120.40 114.29 1zxi s VAL 52 Ca 0.71 -2.08 -0.14 0.00 -1.81 0.00 0.00 61.98 58.66 1zxi s VAL 52 Cb -0.43 -2.04 -0.04 0.00 0.56 0.00 0.00 36.38 34.43 1zxi s VAL 52 CO 0.31 -0.59 0.32 -0.62 -0.31 0.00 0.00 175.10 174.21 1zxi s ASP 53 N -3.24 6.22 -0.09 4.85 2.15 -0.88 -1.01 116.67 124.67 1zxi s ASP 53 Ca 0.21 0.25 -0.01 0.00 0.43 0.00 0.00 52.55 53.43 1zxi s ASP 53 Cb 0.03 -2.18 0.03 0.00 -0.30 0.00 0.00 42.92 40.49 1zxi s ASP 53 CO 0.04 -0.11 -0.05 -0.22 -0.17 0.00 0.00 175.17 174.67 1zxi s LEU 54 N 1.75 0.97 -1.59 -1.34 0.20 0.73 -0.59 118.68 118.82 1zxi s LEU 54 Ca 0.13 -0.21 -0.08 0.00 0.69 0.00 0.00 54.13 54.67 1zxi s LEU 54 Cb -0.15 -0.66 0.07 0.00 -0.43 0.00 0.00 46.19 45.02 1zxi s LEU 54 CO 0.09 -0.14 0.40 0.47 -0.29 0.00 0.00 176.35 176.88 1zxi n ASP 55 N 4.94 -0.81 -0.29 3.68 8.00 -0.38 -0.62 116.55 131.08 1zxi n ASP 55 Ca -0.11 -1.13 -0.04 0.00 0.71 0.00 0.00 54.79 54.22 1zxi n ASP 55 Cb 0.50 -2.32 -0.02 0.00 -0.02 0.00 0.00 41.12 39.26 1zxi n ASP 55 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1zxi n GLY 56 N -1.91 0.67 3.24 0.44 0.00 -1.26 -5.02 105.19 101.34 1zxi n GLY 56 Ca -0.17 -0.53 -0.22 0.00 0.00 0.00 0.00 46.02 45.09 1zxi n GLY 56 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1zxi s MET 57 N -1.84 1.06 -0.24 1.61 -1.94 0.21 -5.08 119.30 113.09 1zxi s MET 57 Ca 0.00 -1.05 -0.21 0.00 -1.71 0.00 0.00 55.69 52.72 1zxi s MET 57 Cb 0.00 -1.23 -0.02 0.00 2.01 0.00 0.00 34.83 35.59 1zxi s MET 57 CO 0.00 0.29 0.66 -1.12 -0.01 0.00 0.00 175.02 174.84 1zxi s SER 58 N -1.72 6.65 -0.03 3.03 0.01 -1.26 -0.19 113.70 120.18 1zxi s SER 58 Ca 0.04 0.79 0.04 0.00 1.31 0.00 0.00 55.95 58.14 1zxi s SER 58 Cb -0.10 -2.35 -0.01 0.00 0.21 0.00 0.00 66.02 63.77 1zxi s SER 58 CO 0.03 -0.36 -0.16 -0.69 0.41 0.00 0.00 173.24 172.47 1zxi s VAL 59 N 2.37 1.27 -0.68 3.43 1.01 -0.18 -4.97 120.40 122.65 1zxi s VAL 59 Ca 0.28 -0.66 -0.25 0.00 0.00 0.00 0.00 61.98 61.35 1zxi s VAL 59 Cb -0.16 -1.08 0.04 0.00 0.00 0.00 0.00 36.38 35.19 1zxi s VAL 59 CO 0.09 0.37 1.14 -0.54 0.00 0.00 0.00 175.10 176.15 1zxi s LYS 60 N -0.16 3.21 0.08 2.72 1.02 -1.26 -1.48 119.74 123.87 1zxi s LYS 60 Ca 0.01 -0.38 0.07 0.00 0.02 0.00 0.00 55.97 55.69 1zxi s LYS 60 Cb -0.08 -4.17 0.36 0.00 -0.52 0.00 0.00 37.83 33.42 1zxi s LYS 60 CO 0.01 -1.93 1.22 -1.13 -0.92 0.00 0.00 175.35 172.59 1zxi n SER 61 N 8.57 0.15 -0.10 2.83 3.41 -1.04 -0.82 113.62 126.62 1zxi n SER 61 Ca 0.01 0.56 0.15 0.00 -0.26 0.00 0.00 58.87 59.33 1zxi n SER 61 Cb 0.48 -0.59 0.72 0.00 -0.26 0.00 0.00 64.21 64.57 1zxi n SER 61 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1zxi n THR 63 N -0.91 2.06 -3.66 0.00 -1.04 0.00 -4.92 114.28 105.80 1zxi n THR 63 Ca 0.18 -3.50 -0.15 0.00 -2.04 0.00 0.00 64.05 58.54 1zxi n THR 63 Cb 0.23 -0.37 -0.08 0.00 -1.82 0.00 0.00 70.33 68.30 1zxi n THR 63 CO 0.00 0.00 0.00 -0.32 -0.64 0.00 0.00 175.07 174.11 1zxi s MET 64 N -3.24 0.76 0.11 -2.82 0.00 -1.24 -4.97 119.30 107.89 1zxi s MET 64 Ca 0.43 0.30 -0.09 0.00 0.00 0.00 0.00 55.69 56.32 1zxi s MET 64 Cb 0.38 0.36 -0.06 0.00 0.00 0.00 0.00 34.83 35.51 1zxi s MET 64 CO -0.02 -0.18 0.42 -0.06 0.00 0.00 0.00 175.02 175.18 1zxi s PHE 65 N -0.66 3.55 0.35 4.11 0.08 -1.26 -0.57 117.98 123.58 1zxi s PHE 65 Ca -0.08 0.77 0.09 0.00 0.12 0.00 0.00 56.93 57.84 1zxi s PHE 65 Cb -0.03 -2.16 0.84 0.00 -0.57 0.00 0.00 43.02 41.10 1zxi s PHE 65 CO 0.05 0.47 1.83 0.00 -0.10 0.00 0.00 175.22 177.47 1zxi h ALA 66 N 3.42 1.85 0.00 5.36 0.00 -1.44 0.89 119.26 129.34 1zxi h ALA 66 Ca -0.48 0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.46 1zxi h ALA 66 Cb 1.19 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.88 1zxi h ALA 66 CO 0.68 -0.15 -0.02 -0.39 0.00 0.00 0.00 179.25 179.38 1zxi h VAL 67 N 0.67 0.76 0.00 0.00 -1.51 -1.81 -1.18 116.25 113.18 1zxi h VAL 67 Ca 0.50 -0.06 -0.03 0.00 -1.23 0.00 0.00 66.70 65.88 1zxi h VAL 67 Cb 0.87 1.04 -0.00 0.00 -2.13 0.00 0.00 31.29 31.07 1zxi h VAL 67 CO -0.26 0.02 -0.12 1.56 -1.23 0.00 0.00 177.57 177.54 1zxi h GLN 68 N 0.00 0.00 -0.58 5.19 4.20 -1.19 -2.78 115.11 119.95 1zxi h GLN 68 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1zxi h GLN 68 Cb 0.04 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.82 1zxi h GLN 68 CO 0.00 0.12 0.00 0.00 -0.67 0.00 0.00 178.83 178.28 1zxi n ALA 69 N -2.19 2.66 -1.77 3.87 0.00 -0.45 -4.94 120.51 117.69 1zxi n ALA 69 Ca -0.00 -1.05 -0.42 0.00 0.00 0.00 0.00 53.44 51.97 1zxi n ALA 69 Cb 0.33 -0.99 -0.02 0.00 0.00 0.00 0.00 19.45 18.77 1zxi n ALA 69 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 1zxi s ASN 70 N -0.91 6.40 0.00 0.00 2.47 -1.05 -1.43 114.94 120.43 1zxi s ASN 70 Ca 0.37 2.90 0.00 0.00 0.42 0.00 0.00 52.86 56.55 1zxi s ASN 70 Cb 0.22 -2.63 0.00 0.00 -1.45 0.00 0.00 41.25 37.39 1zxi s ASN 70 CO 0.22 -0.91 0.00 0.61 -3.72 0.00 0.00 177.10 173.30 1zxi n GLY 71 N 2.56 2.21 3.86 1.21 0.00 0.70 -4.99 105.19 110.75 1zxi n GLY 71 Ca 0.10 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.82 1zxi n GLY 71 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1zxi s ALA 72 N -3.21 2.50 -0.21 4.61 0.00 -0.51 -4.81 121.76 120.14 1zxi s ALA 72 Ca 0.00 -0.49 -0.00 0.00 0.00 0.00 0.00 51.96 51.46 1zxi s ALA 72 Cb 0.00 -3.01 0.02 0.00 0.00 0.00 0.00 23.12 20.13 1zxi s ALA 72 CO 0.00 -1.66 -0.13 -1.12 0.00 0.00 0.00 175.76 172.85 1zxi s SER 73 N -4.34 3.71 -0.03 0.00 0.01 -1.26 -1.34 113.70 110.45 1zxi s SER 73 Ca 0.61 -0.69 0.06 0.00 1.31 0.00 0.00 55.95 57.24 1zxi s SER 73 Cb -0.12 -1.58 -0.02 0.00 0.21 0.00 0.00 66.02 64.51 1zxi s SER 73 CO 0.51 -0.04 -0.21 -0.63 0.41 0.00 0.00 173.24 173.28 1zxi s ILE 74 N 1.32 2.46 -0.12 1.44 1.01 0.76 -1.25 121.20 126.83 1zxi s ILE 74 Ca 0.03 -0.95 0.03 0.00 0.00 0.00 0.00 60.65 59.76 1zxi s ILE 74 Cb -0.14 -1.90 0.00 0.00 0.01 0.00 0.00 42.46 40.43 1zxi s ILE 74 CO -0.09 0.58 -0.22 -0.89 0.00 0.00 0.00 174.94 174.33 1zxi s THR 75 N -0.65 2.17 0.51 2.92 2.01 0.25 -0.26 115.64 122.59 1zxi s THR 75 Ca 0.10 -0.97 0.05 0.00 0.31 0.00 0.00 61.69 61.18 1zxi s THR 75 Cb -0.10 -1.85 0.01 0.00 0.01 0.00 0.00 72.50 70.56 1zxi s THR 75 CO -0.00 0.55 0.24 0.42 -0.69 0.00 0.00 174.62 175.14 1zxi s THR 76 N 0.49 1.64 0.42 -0.82 -4.23 -1.26 -2.07 115.64 109.81 1zxi s THR 76 Ca -0.15 -1.68 0.11 0.00 -1.18 0.00 0.00 61.69 58.80 1zxi s THR 76 Cb -0.17 -2.32 0.31 0.00 1.34 0.00 0.00 72.50 71.66 1zxi s THR 76 CO 0.05 0.00 1.99 -0.29 -0.54 0.00 0.00 174.62 175.84 1zxi h ILE 77 N 1.05 0.96 0.00 2.99 6.09 -1.90 0.03 117.51 126.72 1zxi h ILE 77 Ca -0.40 -0.17 -0.00 0.00 -1.37 0.00 0.00 64.86 62.92 1zxi h ILE 77 Cb 1.30 0.42 -0.00 0.00 0.47 0.00 0.00 36.82 39.01 1zxi h ILE 77 CO 0.65 0.09 -0.00 -0.33 -3.07 0.00 0.00 178.15 175.48 1zxi h GLU 78 N 0.49 0.00 -0.30 2.19 3.07 -1.98 -2.01 114.58 116.04 1zxi h GLU 78 Ca 0.26 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.12 1zxi h GLU 78 Cb 0.38 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.29 1zxi h GLU 78 CO -0.07 0.00 0.00 0.41 -1.40 0.00 0.00 179.01 177.95 1zxi n GLY 79 N -0.82 0.95 0.13 -3.84 0.00 -0.01 -4.43 105.19 97.17 1zxi n GLY 79 Ca -0.02 -0.55 -0.20 0.00 0.00 0.00 0.00 46.02 45.25 1zxi n GLY 79 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 1zxi h MET 80 N 3.11 0.37 -7.09 1.61 2.86 -1.44 -3.47 114.93 110.89 1zxi h MET 80 Ca 0.00 -0.64 -0.50 0.00 -2.06 0.00 0.00 59.70 56.50 1zxi h MET 80 Cb 0.69 0.24 0.07 0.00 0.06 0.00 0.00 31.60 32.66 1zxi h MET 80 CO 0.00 1.28 0.43 0.00 1.06 0.00 0.00 176.91 179.68 1zxi s ALA 81 N -2.62 2.70 0.58 6.32 0.00 -1.26 -4.25 121.76 123.24 1zxi s ALA 81 Ca -0.09 0.80 -0.15 0.00 0.00 0.00 0.00 51.96 52.52 1zxi s ALA 81 Cb 0.06 -3.35 -0.04 0.00 0.00 0.00 0.00 23.12 19.78 1zxi s ALA 81 CO 0.89 -0.75 1.04 0.00 0.00 0.00 0.00 175.76 176.94 1zxi s ALA 82 N -1.80 2.83 0.42 0.00 0.00 0.56 -4.93 121.76 118.84 1zxi s ALA 82 Ca 0.72 0.30 0.12 0.00 0.00 0.00 0.00 51.96 53.11 1zxi s ALA 82 Cb -0.23 -3.19 0.97 0.00 0.00 0.00 0.00 23.12 20.66 1zxi s ALA 82 CO 0.27 -0.69 1.99 -1.00 0.00 0.00 0.00 175.76 176.32 1zxi h PRO 83 N 0.46 0.46 0.00 0.00 0.13 -1.95 0.24 132.00 131.33 1zxi h PRO 83 Ca -0.47 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 1zxi h PRO 83 Cb 1.21 -0.10 0.00 0.00 0.13 0.00 0.00 31.00 32.24 1zxi h PRO 83 CO 0.58 0.30 0.00 -0.40 -0.23 0.00 0.00 178.00 178.26 1zxi n ASP 84 N -4.47 0.00 0.00 1.44 5.68 -1.26 -4.80 116.55 113.13 1zxi n ASP 84 Ca 0.09 -0.96 0.00 0.00 -0.50 0.00 0.00 54.79 53.41 1zxi n ASP 84 Cb 0.31 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.29 1zxi n ASP 84 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1zxi n GLY 85 N 0.13 2.95 3.73 6.12 0.00 0.83 -5.02 105.19 113.94 1zxi n GLY 85 Ca 0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.66 1zxi n GLY 85 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1zxi s THR 86 N -1.95 2.16 0.59 2.61 -1.32 -1.25 -4.66 115.64 111.83 1zxi s THR 86 Ca 0.00 0.12 -0.16 0.00 -1.21 0.00 0.00 61.69 60.44 1zxi s THR 86 Cb 0.00 -3.08 -0.03 0.00 -1.51 0.00 0.00 72.50 67.88 1zxi s THR 86 CO 0.00 0.01 1.07 -0.76 -2.21 0.00 0.00 174.62 172.73 1zxi s LEU 87 N 0.32 3.51 0.97 9.08 1.43 -1.26 -0.32 118.68 132.41 1zxi s LEU 87 Ca 0.68 1.86 -0.12 0.00 -1.03 0.00 0.00 54.13 55.52 1zxi s LEU 87 Cb -0.48 -4.54 0.17 0.00 0.03 0.00 0.00 46.19 41.38 1zxi s LEU 87 CO 0.40 -1.21 1.09 -0.94 0.23 0.00 0.00 176.35 175.91 1zxi s SER 88 N -2.68 2.82 0.21 2.29 1.04 -1.26 -4.76 113.70 111.38 1zxi s SER 88 Ca 0.65 1.32 -0.09 0.00 0.48 0.00 0.00 55.95 58.31 1zxi s SER 88 Cb -0.17 -2.00 0.25 0.00 0.10 0.00 0.00 66.02 64.21 1zxi s SER 88 CO 0.36 -3.02 1.81 0.00 0.98 0.00 0.00 173.24 173.37 1zxi h ALA 89 N -1.82 0.92 -0.31 5.32 0.00 -1.93 -1.00 119.26 120.44 1zxi h ALA 89 Ca -0.53 0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.35 1zxi h ALA 89 Cb 1.31 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.97 1zxi h ALA 89 CO 0.56 0.05 0.02 -0.07 0.00 0.00 0.00 179.25 179.82 1zxi h LEU 90 N 0.70 0.51 -0.73 0.00 3.38 -1.91 -0.07 115.31 117.19 1zxi h LEU 90 Ca 0.31 -0.29 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 1zxi h LEU 90 Cb 0.20 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 40.78 1zxi h LEU 90 CO -0.19 0.67 0.41 1.56 0.09 0.00 0.00 178.44 180.99 1zxi h GLN 91 N 0.33 1.01 -0.40 1.13 4.20 -1.79 -0.38 115.11 119.22 1zxi h GLN 91 Ca 0.09 -0.11 -0.04 0.00 0.06 0.00 0.00 58.65 58.65 1zxi h GLN 91 Cb 0.40 -0.20 -0.02 0.00 0.30 0.00 0.00 27.48 27.96 1zxi h GLN 91 CO 0.01 0.74 0.10 1.49 -0.67 0.00 0.00 178.83 180.50 1zxi h GLU 92 N 1.00 0.63 -0.87 1.46 4.81 -1.14 -2.78 114.58 117.70 1zxi h GLU 92 Ca 0.26 -0.15 0.00 0.00 -0.13 0.00 0.00 59.36 59.34 1zxi h GLU 92 Cb 0.01 -0.08 -0.04 0.00 0.63 0.00 0.00 28.75 29.27 1zxi h GLU 92 CO -0.04 0.66 0.56 0.78 -0.73 0.00 0.00 179.01 180.24 1zxi h GLY 93 N 0.50 1.24 1.42 1.92 0.00 -0.50 0.93 103.07 108.57 1zxi h GLY 93 Ca 0.12 -0.48 -0.08 0.00 0.00 0.00 0.00 47.33 46.90 1zxi h GLY 93 CO 0.00 0.46 -0.08 0.74 0.00 0.00 0.00 176.54 177.67 1zxi h PHE 94 N 1.19 0.76 -0.03 5.60 -1.00 -0.93 -1.35 116.94 121.17 1zxi h PHE 94 Ca 0.32 -0.12 -0.05 0.00 2.81 0.00 0.00 57.97 60.93 1zxi h PHE 94 Cb -0.11 -0.20 0.00 0.00 3.61 0.00 0.00 35.95 39.25 1zxi h PHE 94 CO 0.00 0.76 -0.18 -0.09 -1.61 0.00 0.00 178.31 177.19 1zxi h ARG 95 N 0.65 0.18 -0.79 1.51 2.43 -1.12 0.12 114.38 117.36 1zxi h ARG 95 Ca 0.12 -0.15 -0.01 0.00 -0.81 0.00 0.00 59.98 59.13 1zxi h ARG 95 Cb 0.51 0.03 -0.04 0.00 -0.42 0.00 0.00 29.97 30.06 1zxi h ARG 95 CO 0.03 0.81 0.46 0.52 -1.51 0.00 0.00 179.97 180.28 1zxi h MET 96 N -0.41 1.08 -0.24 0.20 2.86 -0.78 -2.85 114.93 114.79 1zxi h MET 96 Ca -0.01 -0.10 0.00 0.00 -2.06 0.00 0.00 59.70 57.52 1zxi h MET 96 Cb 0.85 -0.22 0.00 0.00 0.06 0.00 0.00 31.60 32.28 1zxi h MET 96 CO 0.04 0.77 0.00 -1.33 1.06 0.00 0.00 176.91 177.45 1zxi n MET 97 N -4.37 2.19 -3.48 1.72 2.81 -0.51 -4.97 117.12 110.51 1zxi n MET 97 Ca 0.08 -1.77 -0.19 0.00 -1.81 0.00 0.00 57.70 54.01 1zxi n MET 97 Cb 0.08 -1.47 0.07 0.00 -0.71 0.00 0.00 33.22 31.19 1zxi n MET 97 CO 0.00 0.00 0.00 1.58 1.51 0.00 0.00 175.97 179.06 1zxi n HIS 98 N 1.02 -2.16 0.69 2.03 -0.00 -0.94 -4.77 115.22 111.10 1zxi n HIS 98 Ca 0.17 0.86 0.04 0.00 0.46 0.00 0.00 57.72 59.26 1zxi n HIS 98 Cb 0.50 -4.59 0.15 0.00 -0.12 0.00 0.00 29.99 25.94 1zxi n HIS 98 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 1zxi n GLY 99 N -1.30 1.08 3.33 1.57 0.00 0.39 -4.75 105.19 105.50 1zxi n GLY 99 Ca -0.23 -0.37 -0.13 0.00 0.00 0.00 0.00 46.02 45.29 1zxi n GLY 99 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1zxi s LEU 100 N -1.07 0.34 0.00 0.99 2.34 -1.26 -4.61 118.68 115.40 1zxi s LEU 100 Ca 0.22 0.04 0.00 0.00 0.06 0.00 0.00 54.13 54.45 1zxi s LEU 100 Cb 0.14 1.78 0.00 0.00 -0.56 0.00 0.00 46.19 47.55 1zxi s LEU 100 CO 0.12 -0.66 0.00 0.00 -1.06 0.00 0.00 176.35 174.75 1zxi n GLN 101 N 0.53 0.00 0.25 1.48 6.02 -1.26 -4.86 117.38 119.54 1zxi n GLN 101 Ca -0.19 0.00 0.14 0.00 -0.01 0.00 0.00 57.00 56.94 1zxi n GLN 101 Cb 0.60 0.00 0.48 0.00 1.02 0.00 0.00 30.24 32.33 1zxi n GLN 101 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1zxi n GLY 103 N 0.40 1.16 0.25 0.00 0.00 -1.26 -4.94 105.19 100.79 1zxi n GLY 103 Ca 0.01 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.97 1zxi n GLY 103 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1zxi h TYR 104 N 0.00 0.73 -0.00 1.61 3.20 -1.99 -2.89 116.97 117.63 1zxi h TYR 104 Ca 0.00 -0.18 0.00 0.00 3.14 0.00 0.00 58.73 61.69 1zxi h TYR 104 Cb 0.00 -0.17 0.00 0.00 1.54 0.00 0.00 36.73 38.10 1zxi h TYR 104 CO 0.00 0.85 -0.44 0.00 -1.64 0.00 0.00 178.16 176.93 1zxi h THR 106 N 0.17 0.79 -0.58 0.00 2.02 -1.89 -0.41 112.91 113.01 1zxi h THR 106 Ca 0.00 0.00 0.06 0.00 0.77 0.00 0.00 66.41 67.24 1zxi h THR 106 Cb 0.50 0.79 -0.05 0.00 -1.74 0.00 0.00 68.15 67.65 1zxi h THR 106 CO 0.00 0.00 0.29 -0.65 0.37 0.00 0.00 175.52 175.53 1zxi h PRO 107 N -0.12 0.53 -0.15 6.66 0.11 -1.79 0.04 132.00 137.28 1zxi h PRO 107 Ca 0.04 -0.03 -0.09 0.00 0.11 0.00 0.00 66.00 66.03 1zxi h PRO 107 Cb 0.18 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 31.15 1zxi h PRO 107 CO -0.11 0.35 -0.32 0.78 -0.21 0.00 0.00 178.00 178.50 1zxi h GLY 108 N 0.55 0.31 1.00 -0.55 0.00 -1.60 -0.47 103.07 102.30 1zxi h GLY 108 Ca 0.26 -0.26 -0.12 0.00 0.00 0.00 0.00 47.33 47.21 1zxi h GLY 108 CO -0.19 0.24 -0.27 1.98 0.00 0.00 0.00 176.54 178.30 1zxi h MET 109 N 0.25 0.75 -0.20 4.80 -1.53 -0.54 -0.71 114.93 117.75 1zxi h MET 109 Ca 0.03 -0.38 -0.19 0.00 -3.44 0.00 0.00 59.70 55.72 1zxi h MET 109 Cb 0.69 0.01 0.00 0.00 -0.55 0.00 0.00 31.60 31.74 1zxi h MET 109 CO 0.05 1.00 -0.63 0.82 0.14 0.00 0.00 176.91 178.29 1zxi h ILE 110 N 0.52 1.30 -0.50 1.77 2.04 -0.85 -0.82 117.51 120.97 1zxi h ILE 110 Ca 0.06 -1.86 -0.12 0.00 1.00 0.00 0.00 64.86 63.93 1zxi h ILE 110 Cb 0.84 1.82 -0.02 0.00 -0.74 0.00 0.00 36.82 38.72 1zxi h ILE 110 CO 0.07 0.59 -0.16 0.24 0.00 0.00 0.00 178.15 178.89 1zxi h MET 111 N 0.53 0.98 -0.45 2.37 2.86 -1.02 0.51 114.93 120.70 1zxi h MET 111 Ca -0.01 -0.38 -0.03 0.00 -2.06 0.00 0.00 59.70 57.22 1zxi h MET 111 Cb 1.23 -0.05 -0.02 0.00 0.06 0.00 0.00 31.60 32.82 1zxi h MET 111 CO 0.13 1.06 0.17 -0.09 1.06 0.00 0.00 176.91 179.23 1zxi h ARG 112 N 0.86 0.69 -0.37 1.72 9.65 -1.05 -2.88 114.38 123.00 1zxi h ARG 112 Ca 0.12 -0.13 -0.02 0.00 -1.10 0.00 0.00 59.98 58.85 1zxi h ARG 112 Cb 0.72 -0.11 -0.02 0.00 -1.39 0.00 0.00 29.97 29.18 1zxi h ARG 112 CO 0.06 0.64 0.12 0.77 2.80 0.00 0.00 179.97 184.36 1zxi h SER 113 N 0.59 0.47 -0.67 -3.80 0.02 -0.86 0.19 113.55 109.48 1zxi h SER 113 Ca 0.15 -0.05 0.02 0.00 -0.84 0.00 0.00 61.79 61.06 1zxi h SER 113 Cb 0.22 -0.12 -0.04 0.00 0.14 0.00 0.00 62.40 62.60 1zxi h SER 113 CO -0.01 0.45 0.44 -0.74 -1.14 0.00 0.00 176.83 175.83 1zxi h HIS 114 N 0.52 0.82 0.01 3.45 -0.00 -0.68 -1.06 115.15 118.21 1zxi h HIS 114 Ca 0.13 0.02 -0.26 0.00 -0.00 0.00 0.00 60.37 60.26 1zxi h HIS 114 Cb 0.15 -0.27 0.02 0.00 -0.00 0.00 0.00 27.41 27.30 1zxi h HIS 114 CO 0.01 0.49 -1.03 -0.09 -0.00 0.00 0.00 177.93 177.31 1zxi h ARG 115 N 0.87 0.59 -0.70 5.26 9.65 -1.31 -3.23 114.38 125.51 1zxi h ARG 115 Ca 0.26 -0.65 0.08 0.00 -1.10 0.00 0.00 59.98 58.56 1zxi h ARG 115 Cb -0.05 0.19 -0.06 0.00 -1.39 0.00 0.00 29.97 28.66 1zxi h ARG 115 CO -0.08 1.26 0.37 1.25 2.80 0.00 0.00 179.97 185.57 1zxi h LEU 116 N 0.33 0.53 -0.12 3.80 5.85 -0.63 -0.06 115.31 125.00 1zxi h LEU 116 Ca -0.12 0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.65 1zxi h LEU 116 Cb 1.68 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 42.66 1zxi h LEU 116 CO 0.19 0.32 0.00 0.18 -0.34 0.00 0.00 178.44 178.80 1zxi n LEU 117 N -4.81 0.21 -0.01 2.25 4.77 -0.43 -0.79 117.00 118.19 1zxi n LEU 117 Ca 0.10 0.54 -0.11 0.00 -0.03 0.00 0.00 56.01 56.51 1zxi n LEU 117 Cb 0.22 -0.49 -0.14 0.00 -2.33 0.00 0.00 43.42 40.68 1zxi n LEU 117 CO 0.27 -0.23 -0.50 1.56 -1.33 0.00 0.00 177.39 177.16 1zxi h GLN 118 N 0.00 0.06 -0.27 3.23 4.20 -1.16 -2.92 115.11 118.25 1zxi h GLN 118 Ca 0.00 -0.10 -0.17 0.00 0.06 0.00 0.00 58.65 58.45 1zxi h GLN 118 Cb 0.39 0.04 -0.00 0.00 0.30 0.00 0.00 27.48 28.21 1zxi h GLN 118 CO 0.00 0.68 -0.49 0.93 -0.67 0.00 0.00 178.83 179.28 1zxi h GLU 119 N 0.02 0.75 -2.05 1.46 5.08 -0.53 -3.41 114.58 115.89 1zxi h GLU 119 Ca -0.28 -0.44 -0.33 0.00 -1.00 0.00 0.00 59.36 57.30 1zxi h GLU 119 Cb 2.00 0.04 -0.32 0.00 0.50 0.00 0.00 28.75 30.97 1zxi h GLU 119 CO 0.09 1.07 -0.64 1.21 -1.00 0.00 0.00 179.01 179.73 1zxi s ASN 120 N -6.91 1.42 0.57 1.42 3.84 0.03 -5.03 114.94 110.28 1zxi s ASN 120 Ca -0.09 -0.99 0.34 0.00 0.21 0.00 0.00 52.86 52.33 1zxi s ASN 120 Cb 0.11 0.57 1.72 0.00 -0.55 0.00 0.00 41.25 43.10 1zxi s ASN 120 CO 0.86 -0.35 2.15 -0.65 -2.79 0.00 0.00 177.10 176.32 1zxi h PRO 121 N 7.88 0.00 -2.14 0.43 0.11 -1.75 -3.33 132.00 133.21 1zxi h PRO 121 Ca -0.07 0.00 -0.57 0.00 0.11 0.00 0.00 66.00 65.46 1zxi h PRO 121 Cb 1.07 0.00 -0.39 0.00 0.11 0.00 0.00 31.00 31.79 1zxi h PRO 121 CO 0.29 0.06 -0.98 0.45 -0.21 0.00 0.00 178.00 177.61 1zxi n SER 122 N -3.38 0.80 -4.81 -2.05 2.88 -1.26 -4.84 113.62 100.95 1zxi n SER 122 Ca -0.02 -2.79 -0.34 0.00 -1.33 0.00 0.00 58.87 54.40 1zxi n SER 122 Cb 0.20 -0.64 -0.06 0.00 -0.75 0.00 0.00 64.21 62.96 1zxi n SER 122 CO 0.00 0.00 0.00 -2.16 -1.23 0.00 0.00 175.04 171.65 1zxi s PRO 123 N -1.22 4.15 0.79 -1.46 0.04 -1.25 -5.07 135.00 130.98 1zxi s PRO 123 Ca 0.35 1.21 -0.11 0.00 0.04 0.00 0.00 61.00 62.49 1zxi s PRO 123 Cb 0.14 -2.23 0.08 0.00 0.04 0.00 0.00 34.50 32.53 1zxi s PRO 123 CO -0.11 -0.11 1.15 0.95 0.04 0.00 0.00 177.00 178.92 1zxi s THR 124 N -2.06 2.07 0.22 1.26 -4.23 -1.26 -4.83 115.64 106.81 1zxi s THR 124 Ca 0.62 -0.04 -0.08 0.00 -1.18 0.00 0.00 61.69 61.01 1zxi s THR 124 Cb -0.12 -3.01 0.18 0.00 1.34 0.00 0.00 72.50 70.89 1zxi s THR 124 CO 0.16 -0.01 1.86 -0.08 -0.54 0.00 0.00 174.62 176.01 1zxi h GLU 125 N -0.98 0.93 -0.75 3.99 4.81 -1.99 -0.12 114.58 120.48 1zxi h GLU 125 Ca -0.46 -0.06 -0.03 0.00 -0.13 0.00 0.00 59.36 58.69 1zxi h GLU 125 Cb 1.33 -0.21 -0.03 0.00 0.63 0.00 0.00 28.75 30.46 1zxi h GLU 125 CO 0.65 0.62 0.36 0.00 -0.73 0.00 0.00 179.01 179.91 1zxi h ALA 126 N 1.34 0.97 -0.18 2.92 0.00 -2.00 -0.89 119.26 121.43 1zxi h ALA 126 Ca 0.32 -0.15 -0.09 0.00 0.00 0.00 0.00 54.91 55.00 1zxi h ALA 126 Cb 0.04 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 1zxi h ALA 126 CO -0.12 0.53 -0.28 0.93 0.00 0.00 0.00 179.25 180.30 1zxi h GLU 127 N 1.05 0.33 -0.09 0.00 5.08 -1.76 -1.90 114.58 117.30 1zxi h GLU 127 Ca 0.26 -0.12 -0.02 0.00 -1.00 0.00 0.00 59.36 58.47 1zxi h GLU 127 Cb 0.11 -0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.34 1zxi h GLU 127 CO -0.03 0.59 -0.04 0.82 -1.00 0.00 0.00 179.01 179.35 1zxi h ILE 128 N 0.30 1.32 -0.41 3.13 2.04 -0.56 0.14 117.51 123.46 1zxi h ILE 128 Ca 0.04 -1.04 0.00 0.00 1.00 0.00 0.00 64.86 64.87 1zxi h ILE 128 Cb 0.65 1.83 -0.02 0.00 -0.74 0.00 0.00 36.82 38.54 1zxi h ILE 128 CO 0.05 0.29 0.27 0.03 0.00 0.00 0.00 178.15 178.79 1zxi h ARG 129 N -0.18 0.54 -0.59 2.37 3.08 -1.05 -1.76 114.38 116.79 1zxi h ARG 129 Ca 0.02 -0.03 -0.07 0.00 0.07 0.00 0.00 59.98 59.96 1zxi h ARG 129 Cb 0.48 -0.12 -0.02 0.00 0.08 0.00 0.00 29.97 30.39 1zxi h ARG 129 CO 0.01 0.36 0.08 0.35 -1.07 0.00 0.00 179.97 179.70 1zxi h PHE 130 N 0.55 1.05 0.00 3.04 3.57 -1.37 -2.90 116.94 120.89 1zxi h PHE 130 Ca 0.15 -0.15 -0.00 0.00 3.53 0.00 0.00 57.97 61.50 1zxi h PHE 130 Cb -0.06 -0.29 -0.00 0.00 2.79 0.00 0.00 35.95 38.39 1zxi h PHE 130 CO -0.05 0.92 -0.00 0.78 -2.23 0.00 0.00 178.31 177.73 1zxi h GLY 131 N 0.89 0.00 -0.96 2.40 0.00 -0.04 -1.43 103.07 103.93 1zxi h GLY 131 Ca 0.18 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.48 1zxi h GLY 131 CO 0.01 0.00 -0.07 0.29 0.00 0.00 0.00 176.54 176.78 1zxi n ILE 132 N -3.20 2.16 0.33 2.60 -5.35 -0.73 -4.74 119.36 110.44 1zxi n ILE 132 Ca -0.03 -2.31 0.21 0.00 -0.27 0.00 0.00 62.75 60.35 1zxi n ILE 132 Cb 0.10 -0.26 1.14 0.00 -1.74 0.00 0.00 39.64 38.88 1zxi n ILE 132 CO 0.00 0.00 0.00 1.23 -1.76 0.00 0.00 176.55 176.02 1zxi h GLY 133 N 0.87 0.00 -0.79 3.28 0.00 -1.06 -1.20 103.07 104.18 1zxi h GLY 133 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.36 1zxi h GLY 133 CO 0.13 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.28 1zxi n GLY 134 N -1.13 0.23 3.11 4.60 0.00 -1.26 -4.80 105.19 105.93 1zxi n GLY 134 Ca -0.03 -0.37 -0.33 0.00 0.00 0.00 0.00 46.02 45.29 1zxi n GLY 134 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1zxi s ASN 135 N -1.41 3.42 0.09 1.61 0.01 -0.45 -2.88 114.94 115.32 1zxi s ASN 135 Ca 0.29 -0.81 -0.10 0.00 -0.71 0.00 0.00 52.86 51.52 1zxi s ASN 135 Cb 0.15 -1.49 -0.06 0.00 0.41 0.00 0.00 41.25 40.26 1zxi s ASN 135 CO 0.22 -0.04 0.42 -0.76 -1.51 0.00 0.00 177.10 175.43 1zxi s LEU 136 N 1.25 4.35 -0.02 0.60 1.43 0.35 -4.99 118.68 121.64 1zxi s LEU 136 Ca 0.02 0.82 0.02 0.00 -1.03 0.00 0.00 54.13 53.96 1zxi s LEU 136 Cb -0.15 -3.01 0.00 0.00 0.03 0.00 0.00 46.19 43.07 1zxi s LEU 136 CO -0.11 0.16 -0.07 0.00 0.23 0.00 0.00 176.35 176.56 1zxi n ARG 138 N 3.26 0.60 -0.03 0.00 5.12 -1.26 -4.70 116.66 119.64 1zxi n ARG 138 Ca -0.17 -0.15 -0.21 0.00 -1.93 0.00 0.00 57.85 55.38 1zxi n ARG 138 Cb 0.55 -1.55 -0.13 0.00 -1.16 0.00 0.00 32.46 30.17 1zxi n ARG 138 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1zxi h THR 140 N -0.03 0.00 -0.17 0.00 1.35 -1.93 -3.48 112.91 108.64 1zxi h THR 140 Ca -0.46 -0.87 -0.07 0.00 -0.55 0.00 0.00 66.41 64.46 1zxi h THR 140 Cb 1.95 1.41 -0.03 0.00 -1.73 0.00 0.00 68.15 69.75 1zxi h THR 140 CO 0.02 0.00 -0.07 0.61 -0.25 0.00 0.00 175.52 175.83 1zxi n GLY 141 N 1.22 0.56 4.75 5.82 0.00 -1.26 -4.04 105.19 112.23 1zxi n GLY 141 Ca 0.01 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.86 1zxi n GLY 141 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1zxi n TYR 142 N -2.54 0.00 -0.25 1.61 4.01 -1.26 -4.79 117.16 113.93 1zxi n TYR 142 Ca -0.04 0.00 0.03 0.00 -0.16 0.00 0.00 57.90 57.74 1zxi n TYR 142 Cb 0.30 -0.24 0.17 0.00 -0.31 0.00 0.00 39.34 39.25 1zxi n TYR 142 CO 0.00 0.00 0.00 0.37 -0.46 0.00 0.00 176.86 176.77 1zxi h GLN 143 N 0.16 0.51 0.00 -0.72 4.15 -2.00 -0.43 115.11 116.77 1zxi h GLN 143 Ca 0.00 -0.03 -0.02 0.00 0.77 0.00 0.00 58.65 59.37 1zxi h GLN 143 Cb 0.00 -0.12 -0.00 0.00 0.21 0.00 0.00 27.48 27.57 1zxi h GLN 143 CO 0.00 0.34 -0.11 -0.91 -1.93 0.00 0.00 178.83 176.22 1zxi h ASN 144 N 0.53 0.00 -0.37 -0.69 2.35 -1.85 -2.59 115.58 112.96 1zxi h ASN 144 Ca 0.39 0.00 -0.13 0.00 -0.55 0.00 0.00 56.30 56.00 1zxi h ASN 144 Cb 0.51 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.87 1zxi h ASN 144 CO -0.34 0.11 -0.29 0.40 -1.65 0.00 0.00 177.43 175.66 1zxi h ILE 145 N 0.00 1.28 -0.52 2.81 2.04 -1.40 0.12 117.51 121.83 1zxi h ILE 145 Ca -0.00 -1.46 -0.01 0.00 1.00 0.00 0.00 64.86 64.40 1zxi h ILE 145 Cb 1.04 1.39 -0.02 0.00 -0.74 0.00 0.00 36.82 38.49 1zxi h ILE 145 CO 0.01 0.48 0.29 0.58 0.00 0.00 0.00 178.15 179.52 1zxi h VAL 146 N 0.65 1.17 -0.88 1.67 2.07 -0.98 -1.44 116.25 118.52 1zxi h VAL 146 Ca 0.07 -0.43 -0.03 0.00 0.82 0.00 0.00 66.70 67.13 1zxi h VAL 146 Cb 0.87 0.50 -0.04 0.00 -1.52 0.00 0.00 31.29 31.10 1zxi h VAL 146 CO 0.08 0.18 0.45 0.11 0.02 0.00 0.00 177.57 178.41 1zxi h LYS 147 N 0.70 1.25 -0.74 1.57 1.57 -1.24 -1.21 116.57 118.46 1zxi h LYS 147 Ca 0.19 -0.17 -0.01 0.00 -1.87 0.00 0.00 60.65 58.79 1zxi h LYS 147 Cb 0.03 -0.23 -0.04 0.00 0.08 0.00 0.00 32.23 32.08 1zxi h LYS 147 CO -0.03 0.94 0.42 0.00 -0.57 0.00 0.00 179.45 180.21 1zxi h ALA 148 N 1.25 0.95 -0.29 3.86 0.00 -0.23 -0.31 119.26 124.48 1zxi h ALA 148 Ca 0.30 -0.10 -0.13 0.00 0.00 0.00 0.00 54.91 54.98 1zxi h ALA 148 Cb 0.08 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 1zxi h ALA 148 CO -0.04 0.44 -0.36 0.82 0.00 0.00 0.00 179.25 180.11 1zxi h ILE 149 N 1.02 1.29 -0.55 0.00 2.04 -0.89 -1.35 117.51 119.06 1zxi h ILE 149 Ca 0.26 -1.50 -0.07 0.00 1.00 0.00 0.00 64.86 64.55 1zxi h ILE 149 Cb 0.00 1.45 -0.02 0.00 -0.74 0.00 0.00 36.82 37.51 1zxi h ILE 149 CO -0.05 0.48 0.07 1.56 0.00 0.00 0.00 178.15 180.22 1zxi h GLN 150 N 0.55 0.93 -0.08 2.37 4.20 -0.89 -1.34 115.11 120.85 1zxi h GLN 150 Ca 0.06 -0.26 0.02 0.00 0.06 0.00 0.00 58.65 58.52 1zxi h GLN 150 Cb 0.87 -0.10 -0.02 0.00 0.30 0.00 0.00 27.48 28.53 1zxi h GLN 150 CO 0.08 0.90 -0.02 -0.92 -0.67 0.00 0.00 178.83 178.19 1zxi h TYR 151 N 0.81 -0.05 -0.59 2.96 5.03 -0.78 -1.18 116.97 123.16 1zxi h TYR 151 Ca 0.17 0.01 0.00 0.00 2.58 0.00 0.00 58.73 61.49 1zxi h TYR 151 Cb 0.44 0.04 -0.03 0.00 1.55 0.00 0.00 36.73 38.72 1zxi h TYR 151 CO 0.03 -0.04 0.38 0.00 -1.32 0.00 0.00 178.16 177.21 1zxi h ALA 152 N 1.07 0.75 -0.48 1.82 0.00 -1.14 0.14 119.26 121.43 1zxi h ALA 152 Ca 0.04 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 1zxi h ALA 152 Cb 0.07 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 1zxi h ALA 152 CO -0.08 0.20 0.28 0.00 0.00 0.00 0.00 179.25 179.65 1zxi h ALA 153 N 1.21 0.61 -0.63 0.00 0.00 -1.02 0.51 119.26 119.93 1zxi h ALA 153 Ca 0.22 -0.07 -0.06 0.00 0.00 0.00 0.00 54.91 55.00 1zxi h ALA 153 Cb -0.07 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.50 1zxi h ALA 153 CO -0.04 0.10 0.14 0.00 0.00 0.00 0.00 179.25 179.45 1zxi h ALA 154 N 1.13 1.06 -0.19 0.00 0.00 -0.88 0.16 119.26 120.55 1zxi h ALA 154 Ca 0.17 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 1zxi h ALA 154 Cb -0.00 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.53 1zxi h ALA 154 CO -0.03 0.62 0.07 0.87 0.00 0.00 0.00 179.25 180.77 1zxi h LYS 155 N 0.95 0.28 -0.47 0.00 1.79 -0.48 0.18 116.57 118.82 1zxi h LYS 155 Ca 0.20 -0.06 -0.05 0.00 -2.18 0.00 0.00 60.65 58.57 1zxi h LYS 155 Cb 0.35 -0.04 -0.02 0.00 -1.58 0.00 0.00 32.23 30.94 1zxi h LYS 155 CO 0.00 0.37 0.11 0.82 -1.08 0.00 0.00 179.45 179.67 1zxi h ILE 156 N 0.14 1.24 0.00 1.86 2.04 -0.67 -3.10 117.51 119.02 1zxi h ILE 156 Ca 0.06 -0.84 0.00 0.00 1.00 0.00 0.00 64.86 65.08 1zxi h ILE 156 Cb 0.20 0.88 0.00 0.00 -0.74 0.00 0.00 36.82 37.16 1zxi h ILE 156 CO -0.00 0.30 0.00 0.78 0.00 0.00 0.00 178.15 179.23 1zxi h ASN 157 N 0.64 0.00 -0.16 1.72 2.35 -0.62 -3.47 115.58 116.04 1zxi h ASN 157 Ca 0.15 0.00 -0.07 0.00 -0.55 0.00 0.00 56.30 55.83 1zxi h ASN 157 Cb 0.33 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.68 1zxi h ASN 157 CO 0.00 0.00 -0.06 0.61 -1.65 0.00 0.00 177.43 176.33 1zxi n GLY 158 N 0.93 0.63 3.63 2.83 0.00 0.59 -4.99 105.19 108.81 1zxi n GLY 158 Ca 0.04 -0.44 -0.13 0.00 0.00 0.00 0.00 46.02 45.48 1zxi n GLY 158 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1zxi s VAL 159 N -2.00 0.00 0.79 1.61 0.11 -1.03 -5.04 120.40 114.84 1zxi s VAL 159 Ca 0.00 0.00 -0.12 0.00 -2.93 0.00 0.00 61.98 58.93 1zxi s VAL 159 Cb 0.00 -1.00 0.07 0.00 -1.53 0.00 0.00 36.38 33.92 1zxi s VAL 159 CO 0.00 0.00 1.17 -2.16 -3.33 0.00 0.00 175.10 170.78 1zxi s PRO 160 N 0.33 2.07 0.00 1.54 0.04 -1.26 -4.38 135.00 133.35 1zxi s PRO 160 Ca 0.01 0.14 0.00 0.00 0.04 0.00 0.00 61.00 61.19 1zxi s PRO 160 Cb -0.05 -1.96 0.00 0.00 0.04 0.00 0.00 34.50 32.53 1zxi s PRO 160 CO -0.00 -1.52 0.00 0.34 0.04 0.00 0.00 177.00 175.85 1zxi n PHE 161 N -3.27 0.00 -3.74 0.56 7.35 -1.26 -5.04 117.46 112.05 1zxi n PHE 161 Ca 0.08 0.00 -0.31 0.00 -0.76 0.00 0.00 57.45 56.46 1zxi n PHE 161 Cb 0.61 0.00 -0.04 0.00 0.35 0.00 0.00 39.48 40.39 1zxi n PHE 161 CO 0.00 0.00 0.00 -1.21 -0.76 0.00 0.00 176.76 174.79 1zxi s GLU 162 N 0.00 3.57 0.00 -4.13 2.02 -1.26 -5.22 118.70 113.68 1zxi s GLU 162 Ca 0.00 -0.20 0.00 0.00 0.02 0.00 0.00 54.97 54.79 1zxi s GLU 162 Cb 0.00 -2.90 0.00 0.00 0.10 0.00 0.00 34.13 31.33 1zxi s GLU 162 CO 0.00 0.50 0.48 0.39 0.02 0.00 0.00 175.26 176.65