#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 3.89 -0.13 7.82 0.00 0.85 -4.83 121.76 129.37 1zxi s ALA 4 Ca 0.00 -0.65 -0.19 0.00 0.00 0.00 0.00 51.96 51.12 1zxi s ALA 4 Cb 0.00 -1.97 -0.04 0.00 0.00 0.00 0.00 23.12 21.11 1zxi s ALA 4 CO 0.00 0.65 0.52 -1.58 0.00 0.00 0.00 175.76 175.36 1zxi s HIS 5 N -1.14 3.50 0.09 0.00 2.46 -1.26 -0.47 115.29 118.46 1zxi s HIS 5 Ca 0.20 0.93 0.06 0.00 0.47 0.00 0.00 55.06 56.72 1zxi s HIS 5 Cb -0.12 -2.62 -0.03 0.00 -0.13 0.00 0.00 32.58 29.68 1zxi s HIS 5 CO 0.10 0.10 -0.15 0.96 -2.47 0.00 0.00 174.74 173.28 1zxi s ILE 6 N 0.85 1.26 -0.03 0.89 -4.36 0.37 -4.99 121.20 115.19 1zxi s ILE 6 Ca 0.27 -1.43 0.01 0.00 -0.26 0.00 0.00 60.65 59.24 1zxi s ILE 6 Cb -0.16 -1.25 0.02 0.00 1.25 0.00 0.00 42.46 42.32 1zxi s ILE 6 CO 0.11 -0.24 -0.04 -1.61 0.24 0.00 0.00 174.94 173.41 1zxi s GLU 7 N -1.96 0.64 0.25 0.37 2.02 -1.26 -1.21 118.70 117.55 1zxi s GLU 7 Ca 0.02 -0.10 -0.08 0.00 0.02 0.00 0.00 54.97 54.83 1zxi s GLU 7 Cb -0.09 -0.67 0.03 0.00 0.10 0.00 0.00 34.13 33.50 1zxi s GLU 7 CO 0.03 -0.03 0.47 1.47 0.02 0.00 0.00 175.26 177.22 1zxi n LEU 8 N 3.75 0.00 -4.16 1.80 -0.00 -0.31 0.45 117.00 118.53 1zxi n LEU 8 Ca -0.23 -1.74 -0.30 0.00 -0.00 0.00 0.00 56.01 53.75 1zxi n LEU 8 Cb 0.53 2.30 -0.17 0.00 -0.00 0.00 0.00 43.42 46.08 1zxi n LEU 8 CO 0.24 -0.53 -0.53 -0.89 -0.00 0.00 0.00 177.39 175.68 1zxi s THR 9 N -2.48 1.76 -0.12 1.47 2.01 -0.63 0.08 115.64 117.72 1zxi s THR 9 Ca 0.13 -0.85 -0.00 0.00 0.31 0.00 0.00 61.69 61.28 1zxi s THR 9 Cb -0.03 -1.53 0.02 0.00 0.01 0.00 0.00 72.50 70.98 1zxi s THR 9 CO 0.09 0.49 -0.09 -0.63 -0.69 0.00 0.00 174.62 173.80 1zxi s ILE 10 N 0.41 1.12 -1.47 1.82 1.01 0.07 -0.44 121.20 123.71 1zxi s ILE 10 Ca -0.17 -0.35 -0.07 0.00 0.00 0.00 0.00 60.65 60.06 1zxi s ILE 10 Cb -0.17 -1.11 0.03 0.00 0.01 0.00 0.00 42.46 41.21 1zxi s ILE 10 CO 0.07 0.38 0.76 0.59 0.00 0.00 0.00 174.94 176.74 1zxi n ASN 11 N 4.86 -5.65 0.00 3.58 5.03 0.42 -1.66 115.26 121.84 1zxi n ASN 11 Ca -0.14 -0.41 0.00 0.00 0.87 0.00 0.00 54.58 54.90 1zxi n ASN 11 Cb 0.50 -4.54 0.00 0.00 -1.02 0.00 0.00 39.78 34.72 1zxi n ASN 11 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1zxi n GLY 12 N -1.59 0.90 3.54 7.41 0.00 -1.26 -4.99 105.19 109.20 1zxi n GLY 12 Ca -0.05 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.63 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 -3.58 2.88 0.32 1.61 3.76 -0.67 -5.08 115.29 114.54 1zxi s HIS 13 Ca 0.00 -0.08 -0.29 0.00 -0.15 0.00 0.00 55.06 54.54 1zxi s HIS 13 Cb 0.00 -1.72 -0.10 0.00 1.11 0.00 0.00 32.58 31.87 1zxi s HIS 13 CO 0.00 0.24 1.38 -2.14 -0.85 0.00 0.00 174.74 173.38 1zxi s PRO 14 N -0.65 4.28 -0.01 8.40 0.02 -1.26 -0.76 135.00 145.02 1zxi s PRO 14 Ca 0.10 2.32 0.02 0.00 0.02 0.00 0.00 61.00 63.45 1zxi s PRO 14 Cb -0.11 -3.06 0.00 0.00 0.02 0.00 0.00 34.50 31.35 1zxi s PRO 14 CO 0.02 -0.33 -0.05 0.08 -0.33 0.00 0.00 177.00 176.38 1zxi s VAL 15 N -0.84 0.46 0.01 3.83 1.01 0.11 -4.87 120.40 120.11 1zxi s VAL 15 Ca 0.52 -0.21 0.01 0.00 0.00 0.00 0.00 61.98 62.31 1zxi s VAL 15 Cb -0.42 -0.42 -0.01 0.00 0.00 0.00 0.00 36.38 35.53 1zxi s VAL 15 CO 0.53 0.15 -0.05 -1.83 0.00 0.00 0.00 175.10 173.90 1zxi s GLU 16 N 0.12 0.38 0.19 2.72 1.03 -1.26 -1.16 118.70 120.72 1zxi s GLU 16 Ca -0.01 -0.29 -0.24 0.00 0.03 0.00 0.00 54.97 54.46 1zxi s GLU 16 Cb -0.05 -0.31 0.05 0.00 -0.80 0.00 0.00 34.13 33.01 1zxi s GLU 16 CO -0.00 0.08 0.85 0.00 -1.33 0.00 0.00 175.26 174.86 1zxi s ALA 17 N -0.40 -1.52 -0.16 -0.84 0.00 -0.35 -4.99 121.76 113.51 1zxi s ALA 17 Ca -0.01 0.06 -0.02 0.00 0.00 0.00 0.00 51.96 52.00 1zxi s ALA 17 Cb -0.04 0.71 -0.02 0.00 0.00 0.00 0.00 23.12 23.78 1zxi s ALA 17 CO -0.00 -1.00 -0.09 -0.51 0.00 0.00 0.00 175.76 174.16 1zxi s LEU 18 N -2.89 2.86 0.06 0.00 1.02 -1.26 -0.48 118.68 117.99 1zxi s LEU 18 Ca 0.11 -0.31 0.02 0.00 0.02 0.00 0.00 54.13 53.97 1zxi s LEU 18 Cb -0.03 -1.67 -0.03 0.00 0.02 0.00 0.00 46.19 44.48 1zxi s LEU 18 CO 0.02 0.12 -0.07 0.68 0.02 0.00 0.00 176.35 177.12 1zxi s VAL 19 N 0.62 0.58 0.34 -1.59 -7.23 0.38 -4.90 120.40 108.60 1zxi s VAL 19 Ca -0.05 -1.40 -0.26 0.00 -1.81 0.00 0.00 61.98 58.45 1zxi s VAL 19 Cb -0.15 -1.01 -0.09 0.00 0.56 0.00 0.00 36.38 35.68 1zxi s VAL 19 CO 0.03 -0.58 1.03 -1.61 -0.31 0.00 0.00 175.10 173.66 1zxi s GLU 20 N -2.45 4.43 0.49 4.82 2.02 -1.26 -0.11 118.70 126.64 1zxi s GLU 20 Ca -0.02 1.55 0.17 0.00 0.02 0.00 0.00 54.97 56.69 1zxi s GLU 20 Cb -0.04 -2.82 1.21 0.00 0.10 0.00 0.00 34.13 32.59 1zxi s GLU 20 CO -0.02 0.09 2.05 -1.35 0.02 0.00 0.00 175.26 176.05 1zxi h PRO 21 N 3.10 0.15 0.00 0.39 0.11 -1.96 -2.21 132.00 131.58 1zxi h PRO 21 Ca -0.47 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1zxi h PRO 21 Cb 1.21 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1zxi h PRO 21 CO 0.64 0.10 0.00 2.89 -0.21 0.00 0.00 178.00 181.42 1zxi n ARG 22 N -4.47 0.21 -1.86 1.05 1.85 -1.26 -4.60 116.66 107.58 1zxi n ARG 22 Ca 0.05 0.07 -0.42 0.00 -1.00 0.00 0.00 57.85 56.54 1zxi n ARG 22 Cb 0.31 -1.50 -0.03 0.00 -1.05 0.00 0.00 32.46 30.19 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 -2.74 3.33 0.42 8.89 2.01 -0.83 -4.95 115.64 121.78 1zxi s THR 23 Ca 0.19 0.40 -0.24 0.00 0.31 0.00 0.00 61.69 62.35 1zxi s THR 23 Cb 0.16 -3.26 -0.08 0.00 0.01 0.00 0.00 72.50 69.33 1zxi s THR 23 CO 0.40 -0.04 1.18 -0.76 -0.69 0.00 0.00 174.62 174.71 1zxi s LEU 24 N 4.28 4.13 0.31 4.42 1.43 -1.26 -1.00 118.68 130.99 1zxi s LEU 24 Ca 0.80 2.35 0.04 0.00 -1.03 0.00 0.00 54.13 56.29 1zxi s LEU 24 Cb -0.37 -4.09 0.63 0.00 0.03 0.00 0.00 46.19 42.39 1zxi s LEU 24 CO 0.35 -0.78 1.87 0.25 0.23 0.00 0.00 176.35 178.27 1zxi h LEU 25 N 2.42 0.84 -0.93 1.79 5.85 -0.41 -1.20 115.31 123.67 1zxi h LEU 25 Ca -0.49 0.03 0.04 0.00 0.84 0.00 0.00 57.88 58.30 1zxi h LEU 25 Cb 1.24 -0.14 -0.05 0.00 0.37 0.00 0.00 40.66 42.08 1zxi h LEU 25 CO 0.62 0.47 0.60 -0.29 -0.34 0.00 0.00 178.44 179.49 1zxi h ILE 26 N 0.91 1.15 -0.10 4.05 6.09 -1.32 0.46 117.51 128.75 1zxi h ILE 26 Ca 0.45 -0.40 -0.18 0.00 -1.37 0.00 0.00 64.86 63.36 1zxi h ILE 26 Cb 0.48 -0.11 -0.00 0.00 0.47 0.00 0.00 36.82 37.65 1zxi h ILE 26 CO -0.21 0.21 -0.71 0.45 -3.07 0.00 0.00 178.15 174.82 1zxi h HIS 27 N 1.16 0.62 -0.34 2.19 3.86 -1.56 -0.38 115.15 120.70 1zxi h HIS 27 Ca 0.37 -0.27 0.00 0.00 -1.16 0.00 0.00 60.37 59.32 1zxi h HIS 27 Cb 0.01 -0.10 -0.02 0.00 1.06 0.00 0.00 27.41 28.36 1zxi h HIS 27 CO -0.01 1.02 0.23 0.35 0.86 0.00 0.00 177.93 180.38 1zxi h PHE 28 N 0.33 0.43 -0.11 2.45 3.57 -0.72 0.34 116.94 123.22 1zxi h PHE 28 Ca -0.03 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.47 1zxi h PHE 28 Cb 1.28 -0.15 -0.00 0.00 2.79 0.00 0.00 35.95 39.87 1zxi h PHE 28 CO 0.05 0.27 0.03 0.82 -2.23 0.00 0.00 178.31 177.25 1zxi h ILE 29 N 0.47 1.20 -0.03 1.41 2.04 -0.79 -1.36 117.51 120.44 1zxi h ILE 29 Ca 0.13 -0.61 -0.08 0.00 1.00 0.00 0.00 64.86 65.29 1zxi h ILE 29 Cb -0.05 1.39 0.01 0.00 -0.74 0.00 0.00 36.82 37.42 1zxi h ILE 29 CO -0.03 0.18 -0.29 0.03 0.00 0.00 0.00 178.15 178.04 1zxi h ARG 30 N -0.02 0.24 0.10 2.37 3.08 -0.96 -1.65 114.38 117.54 1zxi h ARG 30 Ca 0.04 -0.22 -0.33 0.00 0.07 0.00 0.00 59.98 59.54 1zxi h ARG 30 Cb 0.26 0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.34 1zxi h ARG 30 CO 0.00 0.91 -1.75 0.93 -1.07 0.00 0.00 179.97 178.99 1zxi h GLU 31 N -0.35 0.21 0.06 0.04 4.39 -0.44 -3.07 114.58 115.41 1zxi h GLU 31 Ca -0.03 -0.35 -0.38 0.00 0.34 0.00 0.00 59.36 58.94 1zxi h GLU 31 Cb 0.99 0.13 -0.04 0.00 -0.10 0.00 0.00 28.75 29.73 1zxi h GLU 31 CO 0.06 1.02 -2.23 1.04 -1.16 0.00 0.00 179.01 177.74 1zxi n GLN 32 N -3.38 0.71 0.00 2.33 6.02 -0.81 -4.39 117.38 117.86 1zxi n GLN 32 Ca -0.22 0.21 0.13 0.00 -0.01 0.00 0.00 57.00 57.11 1zxi n GLN 32 Cb 1.05 -1.62 0.35 0.00 1.02 0.00 0.00 30.24 31.04 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 -3.39 1.13 -2.14 -1.09 1.13 -0.58 -4.95 117.38 107.48 1zxi n GLN 33 Ca -0.39 -0.72 -0.16 0.00 -1.94 0.00 0.00 57.00 53.79 1zxi n GLN 33 Cb 1.02 -1.49 -0.03 0.00 0.11 0.00 0.00 30.24 29.85 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 -0.31 -4.65 -4.38 1.08 4.13 -1.09 -4.90 115.26 105.14 1zxi n ASN 34 Ca 0.13 0.19 -0.45 0.00 1.68 0.00 0.00 54.58 56.13 1zxi n ASN 34 Cb 0.38 -4.00 -0.01 0.00 -1.54 0.00 0.00 39.78 34.61 1zxi n ASN 34 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 1zxi s LEU 35 N -5.31 5.93 -0.01 3.41 1.43 -0.64 -4.87 118.68 118.62 1zxi s LEU 35 Ca 0.00 -3.03 0.05 0.00 -1.03 0.00 0.00 54.13 50.11 1zxi s LEU 35 Cb 0.00 -2.28 0.16 0.00 0.03 0.00 0.00 46.19 44.10 1zxi s LEU 35 CO 0.00 -0.57 1.04 0.35 0.23 0.00 0.00 176.35 177.40 1zxi n THR 36 N 3.85 0.33 -0.05 5.49 -2.24 -1.26 -3.96 114.28 116.44 1zxi n THR 36 Ca 0.25 -0.25 -0.12 0.00 -2.27 0.00 0.00 64.05 61.66 1zxi n THR 36 Cb 0.43 -0.03 -0.07 0.00 -2.10 0.00 0.00 70.33 68.57 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 5.41 0.28 -3.92 3.38 0.00 -1.96 -3.43 103.07 102.84 1zxi h GLY 37 Ca 0.00 -0.23 -0.54 0.00 0.00 0.00 0.00 47.33 46.55 1zxi h GLY 37 CO 0.03 0.21 0.75 0.00 0.00 0.00 0.00 176.54 177.53 1zxi n ALA 38 N -2.34 2.26 -2.39 3.60 0.00 -1.26 -4.71 120.51 115.67 1zxi n ALA 38 Ca -0.06 0.33 -0.20 0.00 0.00 0.00 0.00 53.44 53.51 1zxi n ALA 38 Cb 0.25 -2.41 -0.10 0.00 0.00 0.00 0.00 19.45 17.20 1zxi n ALA 38 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 1zxi s HIS 39 N -1.13 1.88 -0.20 0.00 3.76 -0.91 -4.94 115.29 113.74 1zxi s HIS 39 Ca 0.54 -0.59 -0.04 0.00 -0.15 0.00 0.00 55.06 54.83 1zxi s HIS 39 Cb -0.48 -0.94 -0.01 0.00 1.11 0.00 0.00 32.58 32.26 1zxi s HIS 39 CO 0.63 0.38 -0.05 0.42 -0.85 0.00 0.00 174.74 175.27 1zxi s ILE 40 N -2.93 3.46 0.00 0.60 1.01 -1.26 -1.69 121.20 120.39 1zxi s ILE 40 Ca 0.26 -0.48 0.00 0.00 0.00 0.00 0.00 60.65 60.43 1zxi s ILE 40 Cb 0.00 -2.55 0.00 0.00 0.01 0.00 0.00 42.46 39.92 1zxi s ILE 40 CO 0.10 0.44 0.32 0.61 0.00 0.00 0.00 174.94 176.41 1zxi n GLY 41 N 4.44 -0.61 3.84 6.18 0.00 -1.26 -5.04 105.19 112.74 1zxi n GLY 41 Ca -0.18 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.77 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 -0.82 2.11 0.00 0.00 5.68 -1.26 -4.71 116.55 117.55 1zxi n ASP 43 Ca -0.06 -2.93 0.00 0.00 -0.50 0.00 0.00 54.79 51.30 1zxi n ASP 43 Cb 0.59 -0.39 0.00 0.00 -1.14 0.00 0.00 41.12 40.19 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 -1.26 0.32 -1.23 2.12 -2.24 -1.26 -5.03 114.28 105.70 1zxi n THR 44 Ca 0.14 -0.37 -0.05 0.00 -2.27 0.00 0.00 64.05 61.50 1zxi n THR 44 Cb 0.63 0.98 -0.02 0.00 -2.10 0.00 0.00 70.33 69.82 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 -0.16 -3.44 -0.04 3.42 7.64 -1.26 -4.96 113.62 114.81 1zxi n SER 45 Ca 0.00 0.11 -0.17 0.00 1.01 0.00 0.00 58.87 59.81 1zxi n SER 45 Cb 0.33 -1.51 -0.14 0.00 -1.01 0.00 0.00 64.21 61.89 1zxi n SER 45 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 1zxi n HIS 46 N -2.97 0.77 0.14 1.43 8.25 -1.26 -4.71 115.22 116.88 1zxi n HIS 46 Ca -0.05 0.19 0.00 0.00 -0.26 0.00 0.00 57.72 57.60 1zxi n HIS 46 Cb 0.20 -1.11 0.18 0.00 1.12 0.00 0.00 29.99 30.37 1zxi n HIS 46 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1zxi n GLY 48 N 0.40 0.39 0.28 0.00 0.00 -1.16 -0.75 105.19 104.36 1zxi n GLY 48 Ca -0.01 0.00 0.18 0.00 0.00 0.00 0.00 46.02 46.20 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 -0.52 4.61 0.00 -1.87 -1.63 119.26 120.85 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 0.27 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.06 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 -1.52 2.69 0.15 0.00 2.01 -0.62 -2.49 115.64 115.87 1zxi s THR 51 Ca 0.37 0.53 0.02 0.00 0.31 0.00 0.00 61.69 62.92 1zxi s THR 51 Cb 0.22 -3.34 -0.04 0.00 0.01 0.00 0.00 72.50 69.34 1zxi s THR 51 CO 0.22 0.06 -0.03 0.68 -0.69 0.00 0.00 174.62 174.85 1zxi s VAL 52 N 0.64 0.75 -0.24 3.82 -7.23 -0.49 -4.56 120.40 113.10 1zxi s VAL 52 Ca 0.65 -1.98 -0.15 0.00 -1.81 0.00 0.00 61.98 58.69 1zxi s VAL 52 Cb -0.42 -1.95 -0.04 0.00 0.56 0.00 0.00 36.38 34.53 1zxi s VAL 52 CO 0.36 -0.64 0.39 -0.62 -0.31 0.00 0.00 175.10 174.29 1zxi s ASP 53 N -3.13 6.35 -0.11 4.85 2.15 -0.66 -1.25 116.67 124.87 1zxi s ASP 53 Ca 0.19 0.41 -0.01 0.00 0.43 0.00 0.00 52.55 53.57 1zxi s ASP 53 Cb 0.05 -2.22 0.03 0.00 -0.30 0.00 0.00 42.92 40.48 1zxi s ASP 53 CO 0.01 -0.14 -0.04 -0.22 -0.17 0.00 0.00 175.17 174.61 1zxi s LEU 54 N 1.72 1.01 -1.56 -1.34 0.20 0.52 -0.44 118.68 118.79 1zxi s LEU 54 Ca 0.17 -0.28 -0.06 0.00 0.69 0.00 0.00 54.13 54.64 1zxi s LEU 54 Cb -0.15 -0.69 0.06 0.00 -0.43 0.00 0.00 46.19 44.97 1zxi s LEU 54 CO 0.09 -0.16 0.41 0.47 -0.29 0.00 0.00 176.35 176.87 1zxi n ASP 55 N 5.01 -0.82 -0.02 3.68 8.00 -0.30 -0.69 116.55 131.41 1zxi n ASP 55 Ca -0.10 -1.10 -0.00 0.00 0.71 0.00 0.00 54.79 54.30 1zxi n ASP 55 Cb 0.50 -2.48 -0.00 0.00 -0.02 0.00 0.00 41.12 39.12 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 -1.93 0.46 3.32 0.44 0.00 -1.26 -5.04 105.19 101.18 1zxi n GLY 56 Ca -0.19 -0.11 -0.22 0.00 0.00 0.00 0.00 46.02 45.50 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 -0.42 1.23 -0.20 1.61 -1.94 0.13 -5.08 119.30 114.63 1zxi s MET 57 Ca 0.00 -1.34 -0.20 0.00 -1.71 0.00 0.00 55.69 52.44 1zxi s MET 57 Cb 0.00 -1.34 -0.03 0.00 2.01 0.00 0.00 34.83 35.47 1zxi s MET 57 CO 0.00 0.28 0.61 -1.12 -0.01 0.00 0.00 175.02 174.78 1zxi s SER 58 N -2.45 6.65 -0.03 3.03 0.01 -1.26 -0.36 113.70 119.29 1zxi s SER 58 Ca 0.13 0.79 0.03 0.00 1.31 0.00 0.00 55.95 58.21 1zxi s SER 58 Cb -0.07 -2.34 0.00 0.00 0.21 0.00 0.00 66.02 63.83 1zxi s SER 58 CO 0.06 -0.26 -0.11 -0.69 0.41 0.00 0.00 173.24 172.64 1zxi s VAL 59 N 1.91 0.96 -0.61 3.43 1.01 -0.38 -4.97 120.40 121.75 1zxi s VAL 59 Ca 0.27 -0.46 -0.26 0.00 0.00 0.00 0.00 61.98 61.53 1zxi s VAL 59 Cb -0.16 -0.84 0.04 0.00 0.00 0.00 0.00 36.38 35.43 1zxi s VAL 59 CO 0.10 0.29 1.09 -0.54 0.00 0.00 0.00 175.10 176.04 1zxi s LYS 60 N 0.10 3.33 0.04 2.72 1.02 -1.26 -1.39 119.74 124.29 1zxi s LYS 60 Ca -0.02 -0.18 0.10 0.00 0.02 0.00 0.00 55.97 55.88 1zxi s LYS 60 Cb -0.09 -4.09 0.44 0.00 -0.52 0.00 0.00 37.83 33.57 1zxi s LYS 60 CO 0.01 -1.73 1.31 -1.13 -0.92 0.00 0.00 175.35 172.89 1zxi n SER 61 N 8.20 0.10 -0.07 2.83 3.41 -1.04 -1.16 113.62 125.88 1zxi n SER 61 Ca 0.03 0.53 0.14 0.00 -0.26 0.00 0.00 58.87 59.32 1zxi n SER 61 Cb 0.48 -0.55 0.67 0.00 -0.26 0.00 0.00 64.21 64.55 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 -1.07 2.30 -3.67 0.00 -1.04 -0.31 -4.92 114.28 105.58 1zxi n THR 63 Ca 0.15 -3.71 -0.15 0.00 -2.04 0.00 0.00 64.05 58.30 1zxi n THR 63 Cb 0.26 -0.65 -0.08 0.00 -1.82 0.00 0.00 70.33 68.04 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 -3.38 0.75 0.18 -2.82 0.00 -1.24 -4.98 119.30 107.81 1zxi s MET 64 Ca 0.45 0.33 -0.11 0.00 0.00 0.00 0.00 55.69 56.36 1zxi s MET 64 Cb 0.39 0.35 -0.07 0.00 0.00 0.00 0.00 34.83 35.51 1zxi s MET 64 CO -0.01 -0.18 0.52 -0.06 0.00 0.00 0.00 175.02 175.30 1zxi s PHE 65 N -0.60 3.51 0.39 4.11 0.08 -1.26 -0.16 117.98 124.06 1zxi s PHE 65 Ca -0.07 0.91 0.12 0.00 0.12 0.00 0.00 56.93 58.01 1zxi s PHE 65 Cb -0.03 -2.27 0.93 0.00 -0.57 0.00 0.00 43.02 41.07 1zxi s PHE 65 CO 0.04 0.36 1.92 0.00 -0.10 0.00 0.00 175.22 177.44 1zxi h ALA 66 N 3.05 1.95 0.00 5.36 0.00 -1.30 -0.99 119.26 127.34 1zxi h ALA 66 Ca -0.48 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.41 1zxi h ALA 66 Cb 1.18 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.86 1zxi h ALA 66 CO 0.68 -0.15 -0.11 -0.39 0.00 0.00 0.00 179.25 179.28 1zxi h VAL 67 N 0.56 0.80 0.00 0.00 -1.51 -1.81 -0.84 116.25 113.45 1zxi h VAL 67 Ca 0.38 -0.44 -0.04 0.00 -1.23 0.00 0.00 66.70 65.38 1zxi h VAL 67 Cb 0.69 1.26 -0.01 0.00 -2.13 0.00 0.00 31.29 31.10 1zxi h VAL 67 CO -0.14 0.11 -0.17 1.56 -1.23 0.00 0.00 177.57 177.70 1zxi h GLN 68 N 0.00 0.00 -0.37 5.19 4.20 -1.55 -2.71 115.11 119.88 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 0.25 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.03 1zxi h GLN 68 CO 0.01 0.17 0.00 0.00 -0.67 0.00 0.00 178.83 178.35 1zxi n ALA 69 N -2.22 2.45 -1.71 3.87 0.00 -0.32 -4.92 120.51 117.65 1zxi n ALA 69 Ca -0.00 -0.68 -0.43 0.00 0.00 0.00 0.00 53.44 52.32 1zxi n ALA 69 Cb 0.36 -0.98 -0.03 0.00 0.00 0.00 0.00 19.45 18.80 1zxi n ALA 69 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1zxi n ASN 70 N 0.64 3.67 0.00 0.00 5.15 -1.02 -1.04 115.26 122.65 1zxi n ASN 70 Ca 0.14 1.10 0.00 0.00 -0.60 0.00 0.00 54.58 55.22 1zxi n ASN 70 Cb 0.34 -1.54 0.00 0.00 -0.53 0.00 0.00 39.78 38.06 1zxi n ASN 70 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1zxi n GLY 71 N 3.19 1.44 3.88 8.20 0.00 0.17 -4.97 105.19 117.10 1zxi n GLY 71 Ca 0.14 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.86 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 -3.64 2.64 -0.18 4.61 0.00 -0.21 -4.85 121.76 120.14 1zxi s ALA 72 Ca 0.00 -0.50 0.00 0.00 0.00 0.00 0.00 51.96 51.46 1zxi s ALA 72 Cb 0.00 -3.00 0.01 0.00 0.00 0.00 0.00 23.12 20.13 1zxi s ALA 72 CO 0.00 -1.54 -0.17 0.45 0.00 0.00 0.00 175.76 174.49 1zxi s SER 73 N -4.41 3.36 0.03 0.00 0.15 -1.26 -1.60 113.70 109.96 1zxi s SER 73 Ca 0.61 -0.59 0.08 0.00 0.70 0.00 0.00 55.95 56.75 1zxi s SER 73 Cb -0.12 -1.52 -0.03 0.00 -1.71 0.00 0.00 66.02 62.64 1zxi s SER 73 CO 0.51 0.01 -0.25 -0.63 1.20 0.00 0.00 173.24 174.08 1zxi s ILE 74 N 1.24 2.24 -0.10 6.45 1.01 0.42 -1.15 121.20 131.30 1zxi s ILE 74 Ca 0.03 -1.28 0.03 0.00 0.00 0.00 0.00 60.65 59.43 1zxi s ILE 74 Cb -0.14 -1.86 0.01 0.00 0.01 0.00 0.00 42.46 40.49 1zxi s ILE 74 CO -0.09 0.42 -0.18 -0.89 0.00 0.00 0.00 174.94 174.19 1zxi s THR 75 N -0.77 1.67 0.50 2.92 2.01 0.42 -0.43 115.64 121.95 1zxi s THR 75 Ca 0.12 -0.77 0.05 0.00 0.31 0.00 0.00 61.69 61.39 1zxi s THR 75 Cb -0.10 -1.48 0.00 0.00 0.01 0.00 0.00 72.50 70.92 1zxi s THR 75 CO 0.02 0.47 0.25 0.42 -0.69 0.00 0.00 174.62 175.09 1zxi s THR 76 N 0.67 1.76 0.41 -0.82 -4.23 -1.26 -1.66 115.64 110.50 1zxi s THR 76 Ca -0.13 -1.66 0.13 0.00 -1.18 0.00 0.00 61.69 58.86 1zxi s THR 76 Cb -0.16 -2.41 0.34 0.00 1.34 0.00 0.00 72.50 71.60 1zxi s THR 76 CO 0.03 0.00 1.93 -0.29 -0.54 0.00 0.00 174.62 175.75 1zxi h ILE 77 N 1.08 0.85 0.00 2.99 6.09 -1.90 0.87 117.51 127.49 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 1.29 0.31 0.00 0.00 0.47 0.00 0.00 36.82 38.89 1zxi h ILE 77 CO 0.65 0.09 0.00 -0.33 -3.07 0.00 0.00 178.15 175.49 1zxi h GLU 78 N 0.50 0.00 -0.30 2.19 3.07 -1.98 -2.21 114.58 115.84 1zxi h GLU 78 Ca 0.35 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.21 1zxi h GLU 78 Cb 0.69 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.60 1zxi h GLU 78 CO -0.12 0.00 0.00 0.41 -1.40 0.00 0.00 179.01 177.90 1zxi n GLY 79 N -0.62 1.03 0.11 -3.84 0.00 0.30 -4.45 105.19 97.73 1zxi n GLY 79 Ca -0.01 -0.57 -0.18 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 3.29 0.32 -7.11 1.61 2.86 -1.45 -3.46 114.93 110.99 1zxi h MET 80 Ca 0.00 -0.55 -0.52 0.00 -2.06 0.00 0.00 59.70 56.56 1zxi h MET 80 Cb 0.73 0.21 0.11 0.00 0.06 0.00 0.00 31.60 32.71 1zxi h MET 80 CO 0.00 1.25 0.45 0.00 1.06 0.00 0.00 176.91 179.67 1zxi s ALA 81 N -2.64 2.51 0.83 6.32 0.00 -1.26 -4.26 121.76 123.26 1zxi s ALA 81 Ca -0.06 0.94 -0.11 0.00 0.00 0.00 0.00 51.96 52.74 1zxi s ALA 81 Cb 0.06 -3.43 0.09 0.00 0.00 0.00 0.00 23.12 19.84 1zxi s ALA 81 CO 0.89 -1.21 1.09 0.00 0.00 0.00 0.00 175.76 176.53 1zxi s ALA 82 N -1.71 1.92 0.38 0.00 0.00 0.34 -4.88 121.76 117.81 1zxi s ALA 82 Ca 0.76 0.16 0.09 0.00 0.00 0.00 0.00 51.96 52.97 1zxi s ALA 82 Cb -0.29 -3.25 0.85 0.00 0.00 0.00 0.00 23.12 20.43 1zxi s ALA 82 CO 0.34 -2.06 1.92 -1.35 0.00 0.00 0.00 175.76 174.62 1zxi h PRO 83 N -1.34 0.62 -0.01 0.00 0.11 -1.94 0.49 132.00 129.93 1zxi h PRO 83 Ca -0.46 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1zxi h PRO 83 Cb 1.25 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 32.22 1zxi h PRO 83 CO 0.52 0.41 0.00 -0.40 -0.21 0.00 0.00 178.00 178.32 1zxi n ASP 84 N -4.50 0.05 0.00 -2.05 5.68 -1.26 -4.87 116.55 109.59 1zxi n ASP 84 Ca 0.13 -1.78 0.00 0.00 -0.50 0.00 0.00 54.79 52.65 1zxi n ASP 84 Cb 0.38 -0.01 0.00 0.00 -1.14 0.00 0.00 41.12 40.35 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 0.63 1.94 3.75 6.12 0.00 0.16 -5.04 105.19 112.75 1zxi n GLY 85 Ca 0.06 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 2.41 0.00 0.00 0.00 173.32 175.73 1zxi n THR 86 N -2.00 1.13 -2.35 2.61 -1.04 -1.26 -4.61 114.28 106.76 1zxi n THR 86 Ca 0.00 -0.28 -0.36 0.00 -2.04 0.00 0.00 64.05 61.37 1zxi n THR 86 Cb 0.00 -1.98 -0.01 0.00 -1.82 0.00 0.00 70.33 66.52 1zxi n THR 86 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 1zxi s LEU 87 N -0.66 3.89 0.85 -4.42 1.43 -1.26 -0.50 118.68 118.00 1zxi s LEU 87 Ca 0.63 2.15 -0.11 0.00 -1.03 0.00 0.00 54.13 55.77 1zxi s LEU 87 Cb -0.49 -4.43 0.10 0.00 0.03 0.00 0.00 46.19 41.40 1zxi s LEU 87 CO 0.50 -0.96 1.09 -0.94 0.23 0.00 0.00 176.35 176.27 1zxi s SER 88 N -1.67 3.88 0.31 2.29 1.04 -1.26 -4.78 113.70 113.52 1zxi s SER 88 Ca 0.67 1.66 0.03 0.00 0.48 0.00 0.00 55.95 58.79 1zxi s SER 88 Cb -0.24 -2.34 0.62 0.00 0.10 0.00 0.00 66.02 64.17 1zxi s SER 88 CO 0.28 -2.41 1.89 0.00 0.98 0.00 0.00 173.24 173.98 1zxi h ALA 89 N -1.39 1.60 -0.36 5.32 0.00 -1.94 -1.24 119.26 121.26 1zxi h ALA 89 Ca -0.47 -0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.38 1zxi h ALA 89 Cb 1.26 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.82 1zxi h ALA 89 CO 0.53 0.21 -0.02 -0.07 0.00 0.00 0.00 179.25 179.90 1zxi h LEU 90 N 0.92 0.64 -0.63 0.00 3.38 -1.91 0.15 115.31 117.87 1zxi h LEU 90 Ca 0.42 -0.32 -0.04 0.00 0.09 0.00 0.00 57.88 58.03 1zxi h LEU 90 Cb 0.39 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.94 1zxi h LEU 90 CO -0.19 0.81 0.24 1.56 0.09 0.00 0.00 178.44 180.96 1zxi h GLN 91 N 0.46 0.94 -0.43 1.13 4.20 -1.75 -0.38 115.11 119.29 1zxi h GLN 91 Ca 0.10 -0.18 -0.05 0.00 0.06 0.00 0.00 58.65 58.58 1zxi h GLN 91 Cb 0.49 -0.15 -0.02 0.00 0.30 0.00 0.00 27.48 28.11 1zxi h GLN 91 CO 0.02 0.80 0.06 1.49 -0.67 0.00 0.00 178.83 180.54 1zxi h GLU 92 N 0.88 0.72 -0.79 1.46 4.81 -1.18 -2.83 114.58 117.65 1zxi h GLU 92 Ca 0.21 -0.20 -0.02 0.00 -0.13 0.00 0.00 59.36 59.23 1zxi h GLU 92 Cb 0.22 -0.08 -0.04 0.00 0.63 0.00 0.00 28.75 29.48 1zxi h GLU 92 CO -0.02 0.76 0.44 0.78 -0.73 0.00 0.00 179.01 180.24 1zxi h GLY 93 N 0.57 1.18 1.28 1.92 0.00 -0.32 0.08 103.07 107.78 1zxi h GLY 93 Ca 0.13 -0.53 -0.02 0.00 0.00 0.00 0.00 47.33 46.91 1zxi h GLY 93 CO 0.01 0.51 0.34 0.74 0.00 0.00 0.00 176.54 178.15 1zxi h PHE 94 N 1.10 0.93 -0.02 5.60 -1.00 -1.00 -1.16 116.94 121.39 1zxi h PHE 94 Ca 0.28 -0.03 -0.02 0.00 2.81 0.00 0.00 57.97 61.01 1zxi h PHE 94 Cb 0.03 -0.30 0.00 0.00 3.61 0.00 0.00 35.95 39.29 1zxi h PHE 94 CO 0.00 0.67 -0.06 -0.09 -1.61 0.00 0.00 178.31 177.22 1zxi h ARG 95 N 0.95 0.08 -0.57 1.51 2.43 -1.19 0.21 114.38 117.79 1zxi h ARG 95 Ca 0.24 -0.06 -0.02 0.00 -0.81 0.00 0.00 59.98 59.33 1zxi h ARG 95 Cb 0.06 0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 29.60 1zxi h ARG 95 CO -0.03 0.68 0.28 0.52 -1.51 0.00 0.00 179.97 179.91 1zxi h MET 96 N -0.51 0.80 -0.32 0.20 2.86 -0.86 -2.84 114.93 114.26 1zxi h MET 96 Ca -0.00 -0.09 0.00 0.00 -2.06 0.00 0.00 59.70 57.55 1zxi h MET 96 Cb 0.68 -0.16 0.00 0.00 0.06 0.00 0.00 31.60 32.19 1zxi h MET 96 CO 0.01 0.61 0.00 -1.33 1.06 0.00 0.00 176.91 177.26 1zxi n MET 97 N -4.37 2.26 -3.48 1.72 2.81 -0.45 -4.97 117.12 110.64 1zxi n MET 97 Ca 0.05 -1.91 -0.20 0.00 -1.81 0.00 0.00 57.70 53.84 1zxi n MET 97 Cb 0.12 -1.47 0.06 0.00 -0.71 0.00 0.00 33.22 31.22 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 1.12 -2.17 0.14 2.03 -0.00 -0.91 -4.78 115.22 110.66 1zxi n HIS 98 Ca 0.18 0.82 0.05 0.00 0.46 0.00 0.00 57.72 59.23 1zxi n HIS 98 Cb 0.52 -4.35 0.22 0.00 -0.12 0.00 0.00 29.99 26.26 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 -1.36 1.92 3.36 1.57 0.00 0.70 -4.74 105.19 106.64 1zxi n GLY 99 Ca -0.19 -0.51 -0.14 0.00 0.00 0.00 0.00 46.02 45.18 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 -1.41 0.13 0.00 0.99 2.34 -1.26 -4.67 118.68 114.81 1zxi s LEU 100 Ca 0.31 0.14 0.00 0.00 0.06 0.00 0.00 54.13 54.64 1zxi s LEU 100 Cb 0.21 1.95 0.00 0.00 -0.56 0.00 0.00 46.19 47.79 1zxi s LEU 100 CO 0.13 -0.67 0.00 0.00 -1.06 0.00 0.00 176.35 174.75 1zxi n GLN 101 N 0.54 0.00 0.26 1.48 6.02 -1.26 -4.85 117.38 119.57 1zxi n GLN 101 Ca -0.19 0.00 0.16 0.00 -0.01 0.00 0.00 57.00 56.97 1zxi n GLN 101 Cb 0.60 0.00 0.63 0.00 1.02 0.00 0.00 30.24 32.49 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 0.12 0.98 0.24 0.00 0.00 -1.26 -4.93 105.19 100.34 1zxi n GLY 103 Ca 0.01 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.94 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 0.85 -0.00 1.61 3.20 -1.99 -2.92 116.97 117.71 1zxi h TYR 104 Ca 0.00 -0.24 0.00 0.00 3.14 0.00 0.00 58.73 61.63 1zxi h TYR 104 Cb 0.00 -0.18 0.00 0.00 1.54 0.00 0.00 36.73 38.09 1zxi h TYR 104 CO 0.00 0.99 -0.42 0.00 -1.64 0.00 0.00 178.16 177.08 1zxi h THR 106 N 0.01 0.88 -0.63 0.00 2.02 -1.90 0.54 112.91 113.82 1zxi h THR 106 Ca 0.00 -0.10 0.05 0.00 0.77 0.00 0.00 66.41 67.13 1zxi h THR 106 Cb 0.50 0.57 -0.05 0.00 -1.74 0.00 0.00 68.15 67.43 1zxi h THR 106 CO 0.00 0.05 0.35 -0.65 0.37 0.00 0.00 175.52 175.64 1zxi h PRO 107 N 0.28 0.65 -0.30 6.66 0.11 -1.79 0.10 132.00 137.71 1zxi h PRO 107 Ca 0.18 -0.04 -0.12 0.00 0.11 0.00 0.00 66.00 66.13 1zxi h PRO 107 Cb 0.16 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 31.11 1zxi h PRO 107 CO -0.19 0.43 -0.29 0.78 -0.21 0.00 0.00 178.00 178.52 1zxi h GLY 108 N 0.67 0.68 0.81 -0.55 0.00 -1.55 -0.13 103.07 103.00 1zxi h GLY 108 Ca 0.27 -0.61 -0.03 0.00 0.00 0.00 0.00 47.33 46.96 1zxi h GLY 108 CO -0.16 0.55 0.00 1.98 0.00 0.00 0.00 176.54 178.92 1zxi h MET 109 N 0.54 0.33 -0.53 4.80 -1.53 -0.38 -1.03 114.93 117.13 1zxi h MET 109 Ca 0.07 -0.10 -0.10 0.00 -3.44 0.00 0.00 59.70 56.12 1zxi h MET 109 Cb 0.78 -0.03 -0.02 0.00 -0.55 0.00 0.00 31.60 31.78 1zxi h MET 109 CO 0.06 0.53 -0.07 0.82 0.14 0.00 0.00 176.91 178.39 1zxi h ILE 110 N 0.09 1.27 -0.69 1.77 2.04 -0.69 -0.73 117.51 120.57 1zxi h ILE 110 Ca 0.05 -1.21 -0.05 0.00 1.00 0.00 0.00 64.86 64.66 1zxi h ILE 110 Cb 0.38 0.98 -0.03 0.00 -0.74 0.00 0.00 36.82 37.40 1zxi h ILE 110 CO 0.01 0.43 0.24 0.24 0.00 0.00 0.00 178.15 179.07 1zxi h MET 111 N 0.85 1.04 -0.42 2.37 2.86 -0.92 -0.42 114.93 120.29 1zxi h MET 111 Ca 0.14 -0.19 -0.08 0.00 -2.06 0.00 0.00 59.70 57.51 1zxi h MET 111 Cb 0.63 -0.16 -0.01 0.00 0.06 0.00 0.00 31.60 32.11 1zxi h MET 111 CO 0.04 0.87 -0.04 -0.09 1.06 0.00 0.00 176.91 178.75 1zxi h ARG 112 N 1.01 0.76 -0.35 1.72 9.65 -1.03 -3.04 114.38 123.09 1zxi h ARG 112 Ca 0.23 -0.26 -0.03 0.00 -1.10 0.00 0.00 59.98 58.82 1zxi h ARG 112 Cb 0.24 -0.06 -0.02 0.00 -1.39 0.00 0.00 29.97 28.75 1zxi h ARG 112 CO -0.01 0.86 0.10 0.77 2.80 0.00 0.00 179.97 184.49 1zxi h SER 113 N 0.59 0.45 -0.65 -3.80 0.02 -0.71 -0.17 113.55 109.27 1zxi h SER 113 Ca 0.11 -0.05 0.03 0.00 -0.84 0.00 0.00 61.79 61.05 1zxi h SER 113 Cb 0.54 -0.12 -0.04 0.00 0.14 0.00 0.00 62.40 62.92 1zxi h SER 113 CO 0.03 0.44 0.40 -0.74 -1.14 0.00 0.00 176.83 175.82 1zxi h HIS 114 N 0.49 0.74 -0.01 3.45 -0.00 -0.97 -0.69 115.15 118.17 1zxi h HIS 114 Ca 0.12 0.02 -0.24 0.00 -0.00 0.00 0.00 60.37 60.27 1zxi h HIS 114 Cb 0.16 -0.24 0.01 0.00 -0.00 0.00 0.00 27.41 27.34 1zxi h HIS 114 CO 0.01 0.41 -0.97 -0.09 -0.00 0.00 0.00 177.93 177.28 1zxi h ARG 115 N 0.77 0.56 -0.48 5.26 9.65 -1.37 -3.16 114.38 125.62 1zxi h ARG 115 Ca 0.27 -0.59 0.04 0.00 -1.10 0.00 0.00 59.98 58.60 1zxi h ARG 115 Cb 0.05 0.16 -0.04 0.00 -1.39 0.00 0.00 29.97 28.76 1zxi h ARG 115 CO -0.12 1.21 0.24 1.25 2.80 0.00 0.00 179.97 185.35 1zxi h LEU 116 N 0.32 0.33 -0.20 3.80 5.85 -0.62 0.12 115.31 124.92 1zxi h LEU 116 Ca -0.10 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.65 1zxi h LEU 116 Cb 1.61 -0.03 0.00 0.00 0.37 0.00 0.00 40.66 42.61 1zxi h LEU 116 CO 0.18 0.23 0.00 0.18 -0.34 0.00 0.00 178.44 178.69 1zxi n LEU 117 N -4.90 0.27 0.02 2.25 4.77 -0.30 -0.55 117.00 118.56 1zxi n LEU 117 Ca 0.04 0.55 -0.17 0.00 -0.03 0.00 0.00 56.01 56.41 1zxi n LEU 117 Cb 0.13 -0.50 -0.14 0.00 -2.33 0.00 0.00 43.42 40.58 1zxi n LEU 117 CO 0.29 -0.29 -0.55 1.56 -1.33 0.00 0.00 177.39 177.07 1zxi h GLN 118 N 0.00 0.20 -0.40 3.23 4.20 -1.16 -2.93 115.11 118.25 1zxi h GLN 118 Ca 0.00 -0.35 -0.11 0.00 0.06 0.00 0.00 58.65 58.25 1zxi h GLN 118 Cb 0.38 0.13 -0.01 0.00 0.30 0.00 0.00 27.48 28.27 1zxi h GLN 118 CO 0.00 1.01 -0.20 0.93 -0.67 0.00 0.00 178.83 179.90 1zxi h GLU 119 N 0.06 0.77 -2.04 1.46 5.08 -0.17 -3.41 114.58 116.32 1zxi h GLU 119 Ca -0.32 -0.30 -0.34 0.00 -1.00 0.00 0.00 59.36 57.40 1zxi h GLU 119 Cb 2.03 -0.04 -0.32 0.00 0.50 0.00 0.00 28.75 30.91 1zxi h GLU 119 CO 0.12 0.91 -0.65 1.21 -1.00 0.00 0.00 179.01 179.60 1zxi s ASN 120 N -6.74 1.41 0.59 1.42 3.84 0.29 -5.03 114.94 110.71 1zxi s ASN 120 Ca -0.09 -1.08 0.35 0.00 0.21 0.00 0.00 52.86 52.24 1zxi s ASN 120 Cb 0.13 0.56 1.88 0.00 -0.55 0.00 0.00 41.25 43.27 1zxi s ASN 120 CO 0.83 -0.33 2.21 -0.65 -2.79 0.00 0.00 177.10 176.37 1zxi h PRO 121 N 7.76 0.00 -2.21 0.43 0.11 -1.75 -3.31 132.00 133.02 1zxi h PRO 121 Ca -0.05 0.00 -0.58 0.00 0.11 0.00 0.00 66.00 65.48 1zxi h PRO 121 Cb 1.07 0.00 -0.40 0.00 0.11 0.00 0.00 31.00 31.78 1zxi h PRO 121 CO 0.28 0.04 -0.93 0.43 -0.21 0.00 0.00 178.00 177.61 1zxi n SER 122 N -3.43 1.05 -4.81 -2.05 7.64 -1.26 -4.85 113.62 105.92 1zxi n SER 122 Ca -0.02 -2.83 -0.36 0.00 1.01 0.00 0.00 58.87 56.67 1zxi n SER 122 Cb 0.15 -0.64 -0.06 0.00 -1.01 0.00 0.00 64.21 62.65 1zxi n SER 122 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 1zxi s PRO 123 N -1.23 4.34 0.87 1.43 0.04 -1.25 -5.08 135.00 134.13 1zxi s PRO 123 Ca 0.35 1.01 -0.13 0.00 0.04 0.00 0.00 61.00 62.27 1zxi s PRO 123 Cb 0.12 -2.79 0.12 0.00 0.04 0.00 0.00 34.50 31.99 1zxi s PRO 123 CO -0.11 0.32 1.21 0.95 0.04 0.00 0.00 177.00 179.41 1zxi s THR 124 N -1.61 1.99 0.22 1.26 -4.23 -1.26 -4.80 115.64 107.21 1zxi s THR 124 Ca 0.47 0.00 -0.08 0.00 -1.18 0.00 0.00 61.69 60.90 1zxi s THR 124 Cb -0.16 -2.96 0.18 0.00 1.34 0.00 0.00 72.50 70.89 1zxi s THR 124 CO 0.21 0.00 1.82 -0.08 -0.54 0.00 0.00 174.62 176.03 1zxi h GLU 125 N -1.31 1.19 -0.77 3.99 4.81 -1.99 0.25 114.58 120.75 1zxi h GLU 125 Ca -0.46 -0.17 -0.05 0.00 -0.13 0.00 0.00 59.36 58.56 1zxi h GLU 125 Cb 1.30 -0.22 -0.03 0.00 0.63 0.00 0.00 28.75 30.43 1zxi h GLU 125 CO 0.57 0.90 0.30 0.00 -0.73 0.00 0.00 179.01 180.05 1zxi h ALA 126 N 1.22 1.07 -0.25 2.92 0.00 -2.00 0.01 119.26 122.23 1zxi h ALA 126 Ca 0.29 -0.20 -0.11 0.00 0.00 0.00 0.00 54.91 54.89 1zxi h ALA 126 Cb 0.10 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 1zxi h ALA 126 CO -0.04 0.66 -0.31 0.93 0.00 0.00 0.00 179.25 180.49 1zxi h GLU 127 N 1.13 0.51 -0.03 0.00 5.08 -1.75 -1.91 114.58 117.61 1zxi h GLU 127 Ca 0.26 -0.22 -0.01 0.00 -1.00 0.00 0.00 59.36 58.39 1zxi h GLU 127 Cb 0.23 -0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.46 1zxi h GLU 127 CO -0.02 0.76 -0.01 0.82 -1.00 0.00 0.00 179.01 179.57 1zxi h ILE 128 N 0.44 1.31 -0.56 3.13 2.04 -0.36 0.12 117.51 123.63 1zxi h ILE 128 Ca 0.05 -0.94 0.02 0.00 1.00 0.00 0.00 64.86 64.99 1zxi h ILE 128 Cb 0.76 1.89 -0.03 0.00 -0.74 0.00 0.00 36.82 38.70 1zxi h ILE 128 CO 0.06 0.25 0.35 0.03 0.00 0.00 0.00 178.15 178.84 1zxi h ARG 129 N -0.32 0.68 -0.53 2.37 3.08 -0.95 -0.92 114.38 117.79 1zxi h ARG 129 Ca 0.01 -0.04 -0.11 0.00 0.07 0.00 0.00 59.98 59.90 1zxi h ARG 129 Cb 0.41 -0.15 -0.02 0.00 0.08 0.00 0.00 29.97 30.29 1zxi h ARG 129 CO 0.00 0.45 -0.12 0.35 -1.07 0.00 0.00 179.97 179.58 1zxi h PHE 130 N 0.70 1.12 0.00 3.04 3.57 -1.39 -2.89 116.94 121.10 1zxi h PHE 130 Ca 0.22 -0.23 -0.00 0.00 3.53 0.00 0.00 57.97 61.48 1zxi h PHE 130 Cb -0.02 -0.28 -0.00 0.00 2.79 0.00 0.00 35.95 38.44 1zxi h PHE 130 CO -0.05 1.04 -0.01 0.78 -2.23 0.00 0.00 178.31 177.85 1zxi h GLY 131 N 0.94 0.00 -0.99 2.40 0.00 0.34 -1.63 103.07 104.12 1zxi h GLY 131 Ca 0.14 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.45 1zxi h GLY 131 CO 0.05 0.00 -0.02 0.29 0.00 0.00 0.00 176.54 176.86 1zxi n ILE 132 N -3.15 2.15 0.25 2.60 -5.35 -0.46 -4.75 119.36 110.66 1zxi n ILE 132 Ca -0.02 -2.14 0.18 0.00 -0.27 0.00 0.00 62.75 60.50 1zxi n ILE 132 Cb 0.15 -0.25 0.88 0.00 -1.74 0.00 0.00 39.64 38.68 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 1.02 0.00 -0.74 3.28 0.00 -1.09 -0.80 103.07 104.75 1zxi h GLY 133 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.35 1zxi h GLY 133 CO 0.14 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.29 1zxi n GLY 134 N -1.31 0.14 3.10 4.60 0.00 -1.26 -4.80 105.19 105.66 1zxi n GLY 134 Ca 0.01 -0.34 -0.32 0.00 0.00 0.00 0.00 46.02 45.36 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 -1.34 3.09 -0.01 1.61 -0.87 -0.31 -2.97 114.94 114.14 1zxi s ASN 135 Ca 0.26 -0.64 -0.10 0.00 -1.57 0.00 0.00 52.86 50.82 1zxi s ASN 135 Cb 0.14 -1.43 -0.05 0.00 -0.02 0.00 0.00 41.25 39.89 1zxi s ASN 135 CO 0.20 -0.01 0.30 -0.76 -2.57 0.00 0.00 177.10 174.26 1zxi s LEU 136 N 1.32 4.40 -0.04 0.60 1.43 0.07 -5.00 118.68 121.47 1zxi s LEU 136 Ca 0.05 0.70 0.02 0.00 -1.03 0.00 0.00 54.13 53.86 1zxi s LEU 136 Cb -0.13 -2.56 0.01 0.00 0.03 0.00 0.00 46.19 43.54 1zxi s LEU 136 CO -0.12 0.30 -0.09 0.00 0.23 0.00 0.00 176.35 176.67 1zxi n ARG 138 N 3.63 0.63 -0.06 0.00 5.12 -1.26 -4.69 116.66 120.03 1zxi n ARG 138 Ca -0.22 0.03 -0.22 0.00 -1.93 0.00 0.00 57.85 55.52 1zxi n ARG 138 Cb 0.53 -1.72 -0.13 0.00 -1.16 0.00 0.00 32.46 29.98 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 -0.27 0.00 -0.08 0.00 1.35 -1.93 -3.48 112.91 108.50 1zxi h THR 140 Ca -0.46 -0.95 -0.03 0.00 -0.55 0.00 0.00 66.41 64.42 1zxi h THR 140 Cb 1.82 1.57 -0.01 0.00 -1.73 0.00 0.00 68.15 69.79 1zxi h THR 140 CO -0.06 0.00 -0.03 0.61 -0.25 0.00 0.00 175.52 175.79 1zxi n GLY 141 N 1.18 0.41 4.71 5.82 0.00 -1.26 -4.00 105.19 112.05 1zxi n GLY 141 Ca 0.01 -0.10 0.00 0.00 0.00 0.00 0.00 46.02 45.93 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 -2.57 0.00 -0.18 1.61 4.01 -1.26 -4.79 117.16 113.98 1zxi n TYR 142 Ca -0.02 0.00 -0.01 0.00 -0.16 0.00 0.00 57.90 57.72 1zxi n TYR 142 Cb 0.25 -0.21 0.08 0.00 -0.31 0.00 0.00 39.34 39.15 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 0.17 0.20 0.00 -0.72 4.15 -2.00 -0.57 115.11 116.33 1zxi h GLN 143 Ca 0.00 -0.01 -0.01 0.00 0.77 0.00 0.00 58.65 59.40 1zxi h GLN 143 Cb 0.00 -0.04 -0.00 0.00 0.21 0.00 0.00 27.48 27.64 1zxi h GLN 143 CO 0.00 0.13 -0.03 -0.91 -1.93 0.00 0.00 178.83 176.09 1zxi h ASN 144 N 0.20 0.00 -0.07 -0.69 2.35 -1.85 -2.71 115.58 112.81 1zxi h ASN 144 Ca 0.28 0.00 -0.19 0.00 -0.55 0.00 0.00 56.30 55.84 1zxi h ASN 144 Cb 0.42 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.79 1zxi h ASN 144 CO -0.40 0.03 -0.66 0.40 -1.65 0.00 0.00 177.43 175.16 1zxi h ILE 145 N 0.00 1.30 -0.46 2.81 2.04 -1.43 0.60 117.51 122.38 1zxi h ILE 145 Ca -0.00 -1.90 -0.00 0.00 1.00 0.00 0.00 64.86 63.96 1zxi h ILE 145 Cb 0.78 1.86 -0.02 0.00 -0.74 0.00 0.00 36.82 38.70 1zxi h ILE 145 CO 0.00 0.60 0.27 0.58 0.00 0.00 0.00 178.15 179.60 1zxi h VAL 146 N 0.50 1.15 -0.79 1.67 2.07 -1.03 -1.36 116.25 118.47 1zxi h VAL 146 Ca -0.02 -0.34 -0.01 0.00 0.82 0.00 0.00 66.70 67.15 1zxi h VAL 146 Cb 1.25 0.54 -0.04 0.00 -1.52 0.00 0.00 31.29 31.53 1zxi h VAL 146 CO 0.13 0.15 0.44 0.11 0.02 0.00 0.00 177.57 178.42 1zxi h LYS 147 N 0.61 1.08 -0.53 1.57 1.57 -1.22 -1.31 116.57 118.34 1zxi h LYS 147 Ca 0.16 -0.12 -0.04 0.00 -1.87 0.00 0.00 60.65 58.79 1zxi h LYS 147 Cb 0.01 -0.22 -0.02 0.00 0.08 0.00 0.00 32.23 32.07 1zxi h LYS 147 CO -0.03 0.79 0.20 0.00 -0.57 0.00 0.00 179.45 179.83 1zxi h ALA 148 N 1.39 0.69 -0.56 3.86 0.00 -0.35 -0.05 119.26 124.24 1zxi h ALA 148 Ca 0.28 -0.17 -0.11 0.00 0.00 0.00 0.00 54.91 54.91 1zxi h ALA 148 Cb 0.01 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 1zxi h ALA 148 CO -0.05 0.32 -0.09 0.82 0.00 0.00 0.00 179.25 180.26 1zxi h ILE 149 N 0.73 1.27 -0.69 0.00 2.04 -0.90 -0.77 117.51 119.18 1zxi h ILE 149 Ca 0.18 -1.25 -0.08 0.00 1.00 0.00 0.00 64.86 64.71 1zxi h ILE 149 Cb 0.23 0.92 -0.03 0.00 -0.74 0.00 0.00 36.82 37.20 1zxi h ILE 149 CO -0.01 0.45 0.13 1.56 0.00 0.00 0.00 178.15 180.28 1zxi h GLN 150 N 0.94 1.13 -0.31 2.37 4.20 -1.06 -0.89 115.11 121.47 1zxi h GLN 150 Ca 0.15 -0.29 -0.01 0.00 0.06 0.00 0.00 58.65 58.56 1zxi h GLN 150 Cb 0.66 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 28.29 1zxi h GLN 150 CO 0.05 1.01 0.17 -0.92 -0.67 0.00 0.00 178.83 178.47 1zxi h TYR 151 N 1.06 0.43 -0.73 2.96 5.03 -0.73 -1.85 116.97 123.15 1zxi h TYR 151 Ca 0.21 -0.01 -0.03 0.00 2.58 0.00 0.00 58.73 61.48 1zxi h TYR 151 Cb 0.42 -0.14 -0.03 0.00 1.55 0.00 0.00 36.73 38.52 1zxi h TYR 151 CO 0.03 0.36 0.32 0.00 -1.32 0.00 0.00 178.16 177.55 1zxi h ALA 152 N 1.03 0.94 -0.82 1.82 0.00 -0.83 -1.93 119.26 119.47 1zxi h ALA 152 Ca 0.11 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 1zxi h ALA 152 Cb 0.07 -0.29 -0.04 0.00 0.00 0.00 0.00 17.79 17.54 1zxi h ALA 152 CO -0.02 0.53 0.47 0.00 0.00 0.00 0.00 179.25 180.23 1zxi h ALA 153 N 1.16 1.04 -0.50 0.00 0.00 -0.93 0.84 119.26 120.87 1zxi h ALA 153 Ca 0.25 -0.11 -0.08 0.00 0.00 0.00 0.00 54.91 54.97 1zxi h ALA 153 Cb 0.16 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 1zxi h ALA 153 CO -0.03 0.53 -0.00 0.00 0.00 0.00 0.00 179.25 179.75 1zxi h ALA 154 N 1.25 1.06 -0.26 0.00 0.00 -1.00 0.43 119.26 120.73 1zxi h ALA 154 Ca 0.29 -0.27 -0.08 0.00 0.00 0.00 0.00 54.91 54.85 1zxi h ALA 154 Cb -0.00 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 1zxi h ALA 154 CO -0.05 0.59 -0.13 0.87 0.00 0.00 0.00 179.25 180.53 1zxi h LYS 155 N 0.78 0.56 -0.64 0.00 1.79 -0.81 -2.91 116.57 115.33 1zxi h LYS 155 Ca 0.15 -0.25 -0.04 0.00 -2.18 0.00 0.00 60.65 58.33 1zxi h LYS 155 Cb 0.47 -0.01 -0.03 0.00 -1.58 0.00 0.00 32.23 31.08 1zxi h LYS 155 CO 0.02 0.81 0.24 0.82 -1.08 0.00 0.00 179.45 180.27 1zxi h ILE 156 N 0.29 1.24 0.00 1.86 2.04 -0.68 -2.19 117.51 120.07 1zxi h ILE 156 Ca 0.06 -0.77 0.00 0.00 1.00 0.00 0.00 64.86 65.15 1zxi h ILE 156 Cb 0.65 0.53 0.00 0.00 -0.74 0.00 0.00 36.82 37.26 1zxi h ILE 156 CO 0.04 0.30 0.00 0.59 0.00 0.00 0.00 178.15 179.08 1zxi n ASN 157 N -4.41 0.00 -0.00 1.72 3.02 0.13 -2.08 115.26 113.64 1zxi n ASN 157 Ca 0.04 0.24 0.10 0.00 -0.03 0.00 0.00 54.58 54.93 1zxi n ASN 157 Cb 0.18 -0.36 -0.13 0.00 -0.61 0.00 0.00 39.78 38.86 1zxi n ASN 157 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1zxi n GLY 158 N -0.15 -0.94 0.13 7.41 0.00 -0.83 -4.60 105.19 106.21 1zxi n GLY 158 Ca 0.05 -0.55 -0.10 0.00 0.00 0.00 0.00 46.02 45.42 1zxi n GLY 158 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1zxi h VAL 159 N 0.00 1.13 0.00 1.61 2.07 -1.30 -3.51 116.25 116.25 1zxi h VAL 159 Ca 0.00 -0.38 0.00 0.00 0.82 0.00 0.00 66.70 67.14 1zxi h VAL 159 Cb 0.63 0.92 0.00 0.00 -1.52 0.00 0.00 31.29 31.32 1zxi h VAL 159 CO 0.00 0.13 0.00 -2.65 0.02 0.00 0.00 177.57 175.07