#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1zab s GLU 11 N 0.00 3.54 0.79 1.45 0.41 -1.26 -5.06 118.70 118.57 1zab s GLU 11 Ca 0.00 -0.23 -0.14 0.00 -0.41 0.00 0.00 54.97 54.19 1zab s GLU 11 Cb 0.00 -2.71 0.04 0.00 -1.78 0.00 0.00 34.13 29.69 1zab s GLU 11 CO 0.00 0.24 1.00 -2.30 -0.49 0.00 0.00 175.26 173.70 1zab n PRO 12 N -1.21 0.26 -0.36 0.39 -0.02 -1.26 -4.74 135.00 128.06 1zab n PRO 12 Ca -0.04 0.15 0.04 0.00 -2.02 0.00 0.00 63.50 61.63 1zab n PRO 12 Cb 0.55 -2.26 0.20 0.00 -0.02 0.00 0.00 33.50 31.96 1zab n PRO 12 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1zab h GLU 13 N -0.71 1.08 0.00 -0.52 4.22 -2.00 -1.92 114.58 114.74 1zab h GLU 13 Ca -0.46 -0.07 -0.07 0.00 0.08 0.00 0.00 59.36 58.84 1zab h GLU 13 Cb 1.31 -0.24 -0.01 0.00 0.50 0.00 0.00 28.75 30.31 1zab h GLU 13 CO 0.45 0.72 -0.32 1.12 -2.18 0.00 0.00 179.01 178.79 1zab h HIS 14 N 1.12 0.00 -0.12 0.92 2.07 -2.00 -1.46 115.15 115.68 1zab h HIS 14 Ca 0.45 0.00 -0.21 0.00 -2.85 0.00 0.00 60.37 57.76 1zab h HIS 14 Cb 0.26 0.00 0.01 0.00 2.57 0.00 0.00 27.41 30.25 1zab h HIS 14 CO -0.00 0.32 -0.73 0.28 -3.07 0.00 0.00 177.93 174.74 1zab h VAL 15 N 0.00 1.30 -0.33 6.12 2.07 -1.71 -1.50 116.25 122.21 1zab h VAL 15 Ca -0.00 -1.96 0.03 0.00 0.82 0.00 0.00 66.70 65.58 1zab h VAL 15 Cb 0.70 2.10 -0.03 0.00 -1.52 0.00 0.00 31.29 32.54 1zab h VAL 15 CO 0.04 0.61 0.15 1.56 0.02 0.00 0.00 177.57 179.95 1zab h GLN 16 N 0.39 0.30 -0.38 1.57 4.20 -1.05 -0.79 115.11 119.36 1zab h GLN 16 Ca -0.06 -0.02 0.03 0.00 0.06 0.00 0.00 58.65 58.67 1zab h GLN 16 Cb 1.37 -0.07 -0.04 0.00 0.30 0.00 0.00 27.48 29.04 1zab h GLN 16 CO 0.15 0.20 0.17 0.00 -0.67 0.00 0.00 178.83 178.67 1zab h ARG 17 N 0.31 0.34 -0.07 1.46 3.08 -1.22 -1.66 114.38 116.62 1zab h ARG 17 Ca 0.14 -0.02 0.03 0.00 0.07 0.00 0.00 59.98 60.20 1zab h ARG 17 Cb 0.07 -0.08 -0.03 0.00 0.08 0.00 0.00 29.97 30.02 1zab h ARG 17 CO -0.11 0.22 -0.11 -0.07 -1.07 0.00 0.00 179.97 178.83 1zab h LEU 18 N 0.35 -0.32 -0.50 3.04 3.38 -0.62 -0.45 115.31 120.19 1zab h LEU 18 Ca 0.16 0.06 -0.02 0.00 0.09 0.00 0.00 57.88 58.17 1zab h LEU 18 Cb 0.10 0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.98 1zab h LEU 18 CO -0.14 -0.15 0.24 -0.07 0.09 0.00 0.00 178.44 178.41 1zab h LEU 19 N -0.15 0.65 -0.37 1.67 3.38 -1.01 -1.86 115.31 117.63 1zab h LEU 19 Ca 0.06 -0.13 -0.05 0.00 0.09 0.00 0.00 57.88 57.86 1zab h LEU 19 Cb 0.24 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.80 1zab h LEU 19 CO -0.16 0.60 0.05 -0.07 0.09 0.00 0.00 178.44 178.95 1zab h LEU 20 N 0.66 0.60 -0.70 1.67 4.07 -1.15 -2.30 115.31 118.15 1zab h LEU 20 Ca 0.17 -0.27 -0.09 0.00 0.08 0.00 0.00 57.88 57.77 1zab h LEU 20 Cb 0.12 -0.16 -0.02 0.00 1.08 0.00 0.00 40.66 41.68 1zab h LEU 20 CO -0.02 0.72 0.04 0.28 -1.08 0.00 0.00 178.44 178.37 1zab h SER 21 N 0.46 1.00 -0.40 -0.43 0.02 -0.99 -1.16 113.55 112.05 1zab h SER 21 Ca 0.11 -0.26 -0.11 0.00 -0.84 0.00 0.00 61.79 60.69 1zab h SER 21 Cb 0.38 -0.27 -0.02 0.00 0.14 0.00 0.00 62.40 62.63 1zab h SER 21 CO 0.01 1.04 -0.16 0.77 -1.14 0.00 0.00 176.83 177.34 1zab h SER 22 N 0.96 0.89 -0.34 3.07 4.64 -1.30 0.21 113.55 121.68 1zab h SER 22 Ca 0.18 -0.30 -0.09 0.00 -0.47 0.00 0.00 61.79 61.11 1zab h SER 22 Cb 0.50 -0.24 -0.02 0.00 -0.31 0.00 0.00 62.40 62.33 1zab h SER 22 CO 0.02 1.04 -0.09 0.03 -0.87 0.00 0.00 176.83 176.97 1zab h ARG 23 N 0.78 0.77 -0.13 4.77 3.08 -1.22 -2.26 114.38 120.17 1zab h ARG 23 Ca 0.12 -0.24 -0.13 0.00 0.07 0.00 0.00 59.98 59.79 1zab h ARG 23 Cb 0.69 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 30.68 1zab h ARG 23 CO 0.05 0.83 -0.44 1.49 -1.07 0.00 0.00 179.97 180.84 1zab h GLU 24 N 0.70 0.53 -0.51 0.04 4.57 -0.94 -3.20 114.58 115.78 1zab h GLU 24 Ca 0.12 -0.39 0.08 0.00 -1.18 0.00 0.00 59.36 57.99 1zab h GLU 24 Cb 0.55 0.07 -0.03 0.00 -0.16 0.00 0.00 28.75 29.18 1zab h GLU 24 CO 0.03 1.01 0.34 0.00 -1.18 0.00 0.00 179.01 179.22 1zab h ALA 25 N 0.52 2.04 -0.06 2.92 0.00 -0.42 -1.64 119.26 122.62 1zab h ALA 25 Ca -0.02 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 54.90 1zab h ALA 25 Cb 1.06 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.78 1zab h ALA 25 CO 0.09 -0.15 0.06 -0.22 0.00 0.00 0.00 179.25 179.04 1zab h LYS 26 N 0.34 0.00 0.00 0.00 3.64 -1.40 -2.07 116.57 117.07 1zab h LYS 26 Ca 0.23 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.59 1zab h LYS 26 Cb 0.47 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.29 1zab h LYS 26 CO -0.05 0.00 -0.10 0.87 -2.27 0.00 0.00 179.45 177.90 1zab h LYS 27 N 0.00 0.00 -0.01 1.90 1.57 -1.44 -2.23 116.57 116.36 1zab h LYS 27 Ca 0.03 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.81 1zab h LYS 27 Cb 0.15 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.46 1zab h LYS 27 CO -0.00 0.10 -0.15 0.43 -0.57 0.00 0.00 179.45 179.25 1zab n SER 28 N -3.54 1.00 -4.54 0.86 7.64 -0.78 -4.95 113.62 109.31 1zab n SER 28 Ca -0.02 -0.98 -0.47 0.00 1.01 0.00 0.00 58.87 58.41 1zab n SER 28 Cb 0.23 0.05 -0.03 0.00 -1.01 0.00 0.00 64.21 63.46 1zab n SER 28 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1zab n ALA 29 N -0.51 -1.05 -3.82 -0.43 0.00 -0.84 -4.93 120.51 108.93 1zab n ALA 29 Ca 0.15 0.43 -0.34 0.00 0.00 0.00 0.00 53.44 53.67 1zab n ALA 29 Cb 0.33 -1.92 -0.11 0.00 0.00 0.00 0.00 19.45 17.74 1zab n ALA 29 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 1zab s TYR 30 N -0.79 3.38 -0.38 0.00 5.04 -0.47 -4.95 117.35 119.19 1zab s TYR 30 Ca 0.64 -2.84 0.12 0.00 -2.44 0.00 0.00 57.07 52.55 1zab s TYR 30 Cb -0.81 -3.07 0.35 0.00 0.35 0.00 0.00 41.96 38.79 1zab s TYR 30 CO 0.57 -0.83 0.75 0.00 -1.34 0.00 0.00 175.55 174.70 1zab h PRO 32 N 3.00 0.00 0.06 0.00 0.13 -1.96 0.78 132.00 134.01 1zab h PRO 32 Ca 0.09 0.00 -0.28 0.00 -0.87 0.00 0.00 66.00 64.94 1zab h PRO 32 Cb 0.96 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.06 1zab h PRO 32 CO 0.52 0.00 -1.52 1.88 -0.23 0.00 0.00 178.00 178.64 1zab h TYR 33 N 0.00 0.21 0.00 1.56 -1.99 -1.96 -3.40 116.97 111.40 1zab h TYR 33 Ca 0.00 -0.16 -0.02 0.00 2.00 0.00 0.00 58.73 60.56 1zab h TYR 33 Cb 0.35 -0.01 -0.00 0.00 2.00 0.00 0.00 36.73 39.07 1zab h TYR 33 CO 0.00 1.60 -1.44 -1.13 -0.00 0.00 0.00 178.16 177.19 1zab n SER 34 N -4.06 0.51 -3.09 3.88 3.41 -1.22 -4.95 113.62 108.10 1zab n SER 34 Ca -0.31 0.20 -0.22 0.00 -0.26 0.00 0.00 58.87 58.28 1zab n SER 34 Cb 0.83 1.03 0.01 0.00 -0.26 0.00 0.00 64.21 65.82 1zab n SER 34 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1zab n ARG 35 N -2.53 -3.77 -3.91 4.33 5.12 0.27 -4.91 116.66 111.25 1zab n ARG 35 Ca -0.03 0.67 -0.28 0.00 -1.93 0.00 0.00 57.85 56.28 1zab n ARG 35 Cb 0.59 -5.42 -0.12 0.00 -1.16 0.00 0.00 32.46 26.34 1zab n ARG 35 CO 0.00 0.00 0.00 0.12 -1.93 0.00 0.00 177.63 175.82 1zab s PHE 36 N -2.99 3.47 0.23 -1.55 5.36 -1.26 -5.09 117.98 116.15 1zab s PHE 36 Ca 0.30 -3.30 -0.30 0.00 -0.96 0.00 0.00 56.93 52.67 1zab s PHE 36 Cb -0.15 -2.73 -0.09 0.00 -0.34 0.00 0.00 43.02 39.71 1zab s PHE 36 CO 0.37 -0.59 1.28 -1.25 -1.46 0.00 0.00 175.22 173.57 1zab s PRO 37 N -1.19 4.41 -0.01 10.12 0.04 -1.26 -4.95 135.00 142.17 1zab s PRO 37 Ca 0.23 2.05 0.02 0.00 0.04 0.00 0.00 61.00 63.33 1zab s PRO 37 Cb -0.09 -3.18 -0.00 0.00 0.04 0.00 0.00 34.50 31.27 1zab s PRO 37 CO -0.13 -0.18 -0.05 0.08 0.04 0.00 0.00 177.00 176.76 1zab s VAL 38 N -0.24 0.43 0.18 -0.36 1.01 -1.26 -3.95 120.40 116.21 1zab s VAL 38 Ca 0.54 -0.21 0.08 0.00 0.00 0.00 0.00 61.98 62.39 1zab s VAL 38 Cb -0.36 -0.38 -0.04 0.00 0.00 0.00 0.00 36.38 35.59 1zab s VAL 38 CO 0.41 0.13 -0.15 -0.83 0.00 0.00 0.00 175.10 174.66 1zab s GLY 39 N 0.02 1.37 0.00 4.51 0.00 0.09 -2.69 107.32 110.63 1zab s GLY 39 Ca 0.00 -1.56 -0.11 0.00 0.00 0.00 0.00 44.72 43.05 1zab s GLY 39 CO -0.00 -1.64 0.22 0.00 0.00 0.00 0.00 173.10 171.68 1zab s ALA 40 N -2.60 -0.53 -0.07 3.20 0.00 0.60 -0.47 121.76 121.89 1zab s ALA 40 Ca 0.19 0.03 -0.00 0.00 0.00 0.00 0.00 51.96 52.17 1zab s ALA 40 Cb -0.03 0.13 0.03 0.00 0.00 0.00 0.00 23.12 23.25 1zab s ALA 40 CO 0.06 -0.26 -0.03 0.00 0.00 0.00 0.00 175.76 175.54 1zab s ALA 41 N -1.60 0.79 -0.20 0.00 0.00 -0.55 -0.58 121.76 119.63 1zab s ALA 41 Ca -0.12 -0.17 -0.07 0.00 0.00 0.00 0.00 51.96 51.60 1zab s ALA 41 Cb -0.05 -0.67 -0.03 0.00 0.00 0.00 0.00 23.12 22.36 1zab s ALA 41 CO 0.02 -0.31 0.04 -1.17 0.00 0.00 0.00 175.76 174.34 1zab s LEU 42 N 1.60 3.57 -0.25 0.00 2.96 0.18 -0.86 118.68 125.88 1zab s LEU 42 Ca -0.00 -0.06 -0.09 0.00 -0.22 0.00 0.00 54.13 53.77 1zab s LEU 42 Cb -0.13 -1.91 -0.04 0.00 0.50 0.00 0.00 46.19 44.61 1zab s LEU 42 CO -0.04 0.11 0.11 -0.22 -1.32 0.00 0.00 176.35 174.99 1zab s LEU 43 N 0.76 3.67 0.72 -0.68 2.96 0.20 -0.79 118.68 125.52 1zab s LEU 43 Ca 0.02 -0.11 -0.07 0.00 -0.22 0.00 0.00 54.13 53.75 1zab s LEU 43 Cb -0.14 -1.99 0.07 0.00 0.50 0.00 0.00 46.19 44.63 1zab s LEU 43 CO 0.02 -0.02 1.03 0.42 -1.32 0.00 0.00 176.35 176.48 1zab s THR 44 N 1.54 2.25 0.35 3.68 -4.23 0.21 0.08 115.64 119.52 1zab s THR 44 Ca 0.06 -0.27 0.04 0.00 -1.18 0.00 0.00 61.69 60.34 1zab s THR 44 Cb -0.15 -2.98 0.21 0.00 1.34 0.00 0.00 72.50 70.92 1zab s THR 44 CO 0.06 0.00 1.95 1.23 -0.54 0.00 0.00 174.62 177.32 1zab h GLY 45 N -0.66 0.71 0.13 3.99 0.00 -1.47 -2.39 103.07 103.38 1zab h GLY 45 Ca -0.44 -0.33 0.00 0.00 0.00 0.00 0.00 47.33 46.56 1zab h GLY 45 CO 0.58 0.32 0.00 2.09 0.00 0.00 0.00 176.54 179.53 1zab n ASP 46 N -4.37 0.58 0.00 0.19 5.75 -1.26 -4.90 116.55 112.53 1zab n ASP 46 Ca 0.04 -1.49 0.00 0.00 -0.01 0.00 0.00 54.79 53.33 1zab n ASP 46 Cb 0.14 -0.03 0.00 0.00 -1.03 0.00 0.00 41.12 40.20 1zab n ASP 46 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1zab n GLY 47 N 0.92 0.37 3.80 6.12 0.00 -0.90 -5.08 105.19 110.42 1zab n GLY 47 Ca 0.15 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.82 1zab n GLY 47 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1zab s ARG 48 N -0.93 4.42 -0.11 1.61 3.52 -1.26 -4.78 118.95 121.42 1zab s ARG 48 Ca 0.00 1.22 0.02 0.00 -0.13 0.00 0.00 55.73 56.84 1zab s ARG 48 Cb 0.00 -2.54 -0.01 0.00 -1.56 0.00 0.00 34.95 30.84 1zab s ARG 48 CO 0.00 0.15 -0.19 0.42 -0.81 0.00 0.00 175.30 174.87 1zab s ILE 49 N -1.85 2.48 -0.13 4.11 1.01 -1.26 -0.61 121.20 124.95 1zab s ILE 49 Ca 0.55 -0.87 -0.01 0.00 0.00 0.00 0.00 60.65 60.33 1zab s ILE 49 Cb -0.14 -1.99 -0.02 0.00 0.01 0.00 0.00 42.46 40.32 1zab s ILE 49 CO 0.19 0.54 -0.11 -0.36 0.00 0.00 0.00 174.94 175.20 1zab s PHE 50 N 0.35 2.84 0.32 3.97 0.40 0.03 -4.92 117.98 120.98 1zab s PHE 50 Ca -0.15 -0.55 0.07 0.00 -0.60 0.00 0.00 56.93 55.70 1zab s PHE 50 Cb -0.17 -1.85 -0.02 0.00 0.51 0.00 0.00 43.02 41.49 1zab s PHE 50 CO 0.07 -0.15 0.38 -1.54 0.70 0.00 0.00 175.22 174.68 1zab s SER 51 N 0.27 5.69 0.23 1.36 1.04 -1.26 0.51 113.70 121.54 1zab s SER 51 Ca -0.08 -0.30 -0.21 0.00 0.48 0.00 0.00 55.95 55.84 1zab s SER 51 Cb -0.15 -1.18 0.04 0.00 0.10 0.00 0.00 66.02 64.83 1zab s SER 51 CO 0.05 -0.36 0.64 -0.83 0.98 0.00 0.00 173.24 173.72 1zab s GLY 52 N -4.07 -0.24 0.14 7.32 0.00 0.26 -4.22 107.32 106.51 1zab s GLY 52 Ca 0.42 -0.05 -0.14 0.00 0.00 0.00 0.00 44.72 44.95 1zab s GLY 52 CO 0.29 -0.06 0.37 0.00 0.00 0.00 0.00 173.10 173.70 1zab s ASN 54 N -2.86 6.73 -0.31 0.00 4.22 -1.09 -3.76 114.94 117.86 1zab s ASN 54 Ca 0.08 2.02 -0.02 0.00 -2.14 0.00 0.00 52.86 52.79 1zab s ASN 54 Cb 0.02 -2.58 0.10 0.00 1.28 0.00 0.00 41.25 40.07 1zab s ASN 54 CO -0.07 -0.51 0.12 -0.63 -2.04 0.00 0.00 177.10 173.97 1zab s ILE 55 N -1.70 0.40 0.93 0.54 1.01 -0.40 -1.37 121.20 120.61 1zab s ILE 55 Ca 0.59 -1.14 -0.15 0.00 0.00 0.00 0.00 60.65 59.95 1zab s ILE 55 Cb -0.21 -1.32 0.17 0.00 0.01 0.00 0.00 42.46 41.11 1zab s ILE 55 CO 0.27 -0.72 1.27 -1.61 0.00 0.00 0.00 174.94 174.14 1zab s GLU 56 N 1.79 0.93 0.02 2.79 2.02 0.19 -1.23 118.70 125.22 1zab s GLU 56 Ca 0.10 -0.23 -0.02 0.00 0.02 0.00 0.00 54.97 54.84 1zab s GLU 56 Cb -0.17 -1.86 -0.02 0.00 0.10 0.00 0.00 34.13 32.18 1zab s GLU 56 CO -0.29 -2.24 0.02 1.21 0.02 0.00 0.00 175.26 173.97 1zab s ASN 57 N -4.73 0.21 0.29 -0.19 3.84 -1.26 -4.78 114.94 108.32 1zab s ASN 57 Ca 0.70 -0.49 0.03 0.00 0.21 0.00 0.00 52.86 53.32 1zab s ASN 57 Cb -0.06 0.14 0.69 0.00 -0.55 0.00 0.00 41.25 41.47 1zab s ASN 57 CO 0.52 -0.36 1.71 0.00 -2.79 0.00 0.00 177.10 176.18 1zab h ALA 58 N 4.33 1.41 -1.95 1.71 0.00 -1.99 -2.94 119.26 119.83 1zab h ALA 58 Ca -0.32 0.15 -0.70 0.00 0.00 0.00 0.00 54.91 54.04 1zab h ALA 58 Cb 1.20 0.12 -0.19 0.00 0.00 0.00 0.00 17.79 18.91 1zab h ALA 58 CO 0.44 -0.29 0.34 0.00 0.00 0.00 0.00 179.25 179.73 1zab n TYR 60 N 6.39 0.15 0.30 0.00 0.53 -1.11 -0.85 117.16 122.57 1zab n TYR 60 Ca 0.01 0.64 0.15 0.00 -1.02 0.00 0.00 57.90 57.67 1zab n TYR 60 Cb 0.45 -0.78 0.83 0.00 -1.03 0.00 0.00 39.34 38.81 1zab n TYR 60 CO 0.00 0.00 0.00 -1.35 -1.02 0.00 0.00 176.86 174.49 1zab h PRO 61 N 0.00 0.00 -0.27 -0.72 0.11 -1.92 -2.01 132.00 127.19 1zab h PRO 61 Ca 0.23 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.34 1zab h PRO 61 Cb 0.36 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.47 1zab h PRO 61 CO -0.53 0.00 0.00 1.28 -0.21 0.00 0.00 178.00 178.54 1zab n LEU 62 N -2.76 2.04 -4.84 2.35 4.32 -0.03 -4.92 117.00 113.15 1zab n LEU 62 Ca -0.02 -0.91 -0.30 0.00 -0.02 0.00 0.00 56.01 54.76 1zab n LEU 62 Cb 0.28 -0.17 0.17 0.00 -1.62 0.00 0.00 43.42 42.07 1zab n LEU 62 CO 0.13 0.46 0.79 -0.83 -1.22 0.00 0.00 177.39 176.72 1zab s GLY 63 N -1.39 1.68 0.03 -0.72 0.00 -0.76 -4.65 107.32 101.51 1zab s GLY 63 Ca 0.32 -0.94 0.01 0.00 0.00 0.00 0.00 44.72 44.10 1zab s GLY 63 CO 0.25 -0.24 -0.05 0.54 0.00 0.00 0.00 173.10 173.60 1zab s VAL 64 N -3.58 0.27 0.46 1.40 0.11 -0.37 -4.96 120.40 113.73 1zab s VAL 64 Ca 0.70 -1.06 -0.04 0.00 -2.93 0.00 0.00 61.98 58.65 1zab s VAL 64 Cb -0.08 -0.50 -0.03 0.00 -1.53 0.00 0.00 36.38 34.24 1zab s VAL 64 CO 0.53 -0.51 0.74 0.00 -3.33 0.00 0.00 175.10 172.53 1zab h ALA 66 N 0.32 0.93 -0.14 0.00 0.00 -1.83 -2.04 119.26 116.50 1zab h ALA 66 Ca -0.47 0.05 0.01 0.00 0.00 0.00 0.00 54.91 54.49 1zab h ALA 66 Cb 1.21 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.94 1zab h ALA 66 CO 0.61 -0.05 0.07 0.93 0.00 0.00 0.00 179.25 180.81 1zab h GLU 67 N 0.59 0.14 -0.14 0.00 3.07 -1.88 -1.86 114.58 114.50 1zab h GLU 67 Ca 0.33 -0.01 -0.09 0.00 -0.50 0.00 0.00 59.36 59.09 1zab h GLU 67 Cb 0.33 -0.03 -0.01 0.00 -0.84 0.00 0.00 28.75 28.19 1zab h GLU 67 CO -0.25 0.09 -0.33 0.00 -1.40 0.00 0.00 179.01 177.12 1zab h ARG 68 N 0.14 0.28 -0.64 2.33 3.08 -1.89 0.67 114.38 118.35 1zab h ARG 68 Ca 0.06 -0.11 -0.02 0.00 0.07 0.00 0.00 59.98 59.97 1zab h ARG 68 Cb 0.01 -0.01 -0.03 0.00 0.08 0.00 0.00 29.97 30.02 1zab h ARG 68 CO -0.04 0.58 0.32 1.15 -1.07 0.00 0.00 179.97 180.91 1zab h THR 69 N 0.24 1.22 -0.18 2.04 2.02 -1.06 0.19 112.91 117.37 1zab h THR 69 Ca 0.03 -0.59 -0.05 0.00 0.77 0.00 0.00 66.41 66.57 1zab h THR 69 Cb 0.70 0.43 -0.00 0.00 -1.74 0.00 0.00 68.15 67.53 1zab h THR 69 CO 0.05 0.25 -0.08 0.00 0.37 0.00 0.00 175.52 176.11 1zab h ALA 70 N 1.15 0.25 -0.64 6.16 0.00 -0.85 -2.24 119.26 123.09 1zab h ALA 70 Ca 0.22 -0.28 -0.07 0.00 0.00 0.00 0.00 54.91 54.78 1zab h ALA 70 Cb 0.10 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 1zab h ALA 70 CO -0.03 0.07 0.11 0.82 0.00 0.00 0.00 179.25 180.23 1zab h ILE 71 N 0.06 1.26 -0.68 0.00 2.04 -0.72 -2.14 117.51 117.33 1zab h ILE 71 Ca 0.04 -1.01 -0.06 0.00 1.00 0.00 0.00 64.86 64.83 1zab h ILE 71 Cb 0.56 0.67 -0.03 0.00 -0.74 0.00 0.00 36.82 37.28 1zab h ILE 71 CO 0.03 0.38 0.19 1.56 0.00 0.00 0.00 178.15 180.30 1zab h GLN 72 N 0.98 1.06 0.20 2.37 4.20 -0.63 -2.04 115.11 121.24 1zab h GLN 72 Ca 0.20 -0.23 -0.01 0.00 0.06 0.00 0.00 58.65 58.66 1zab h GLN 72 Cb 0.42 -0.15 0.00 0.00 0.30 0.00 0.00 27.48 28.05 1zab h GLN 72 CO 0.01 0.93 -0.10 -0.22 -0.67 0.00 0.00 178.83 178.78 1zab h LYS 73 N 1.02 -0.26 -0.06 1.46 3.64 -1.23 -1.88 116.57 119.26 1zab h LYS 73 Ca 0.22 0.02 0.04 0.00 -1.27 0.00 0.00 60.65 59.66 1zab h LYS 73 Cb 0.33 0.06 -0.05 0.00 -0.41 0.00 0.00 32.23 32.15 1zab h LYS 73 CO -0.00 -0.09 -0.30 0.00 -2.27 0.00 0.00 179.45 176.79 1zab h ALA 74 N 0.40 -0.37 -0.98 5.00 0.00 -1.20 -2.15 119.26 119.95 1zab h ALA 74 Ca -0.03 0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.90 1zab h ALA 74 Cb 0.29 0.54 -0.05 0.00 0.00 0.00 0.00 17.79 18.58 1zab h ALA 74 CO 0.05 -0.79 0.65 0.82 0.00 0.00 0.00 179.25 179.98 1zab h ILE 75 N -0.41 1.24 0.00 0.00 2.04 -1.28 -0.17 117.51 118.93 1zab h ILE 75 Ca 0.08 -0.45 -0.00 0.00 1.00 0.00 0.00 64.86 65.48 1zab h ILE 75 Cb 0.53 -0.19 -0.00 0.00 -0.74 0.00 0.00 36.82 36.41 1zab h ILE 75 CO -0.29 0.24 -0.02 0.77 0.00 0.00 0.00 178.15 178.84 1zab h SER 76 N 1.31 0.00 -0.08 1.72 4.64 -0.92 -0.64 113.55 119.58 1zab h SER 76 Ca 0.37 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.69 1zab h SER 76 Cb -0.12 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 61.97 1zab h SER 76 CO -0.09 0.02 0.00 -0.62 -0.87 0.00 0.00 176.83 175.28 1zab n GLU 77 N -3.18 2.06 -0.18 4.77 -0.58 -0.18 -4.95 120.64 118.40 1zab n GLU 77 Ca -0.01 -1.54 0.00 0.00 -0.42 0.00 0.00 57.16 55.18 1zab n GLU 77 Cb 0.21 -1.47 0.00 0.00 -0.57 0.00 0.00 31.44 29.61 1zab n GLU 77 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1zab n GLY 78 N 1.28 0.83 3.56 0.62 0.00 -0.25 -5.07 105.19 106.16 1zab n GLY 78 Ca 0.17 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.82 1zab n GLY 78 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1zab s TYR 79 N -2.09 3.19 0.00 1.61 1.51 -0.58 -4.92 117.35 116.06 1zab s TYR 79 Ca 0.00 -0.07 0.00 0.00 -1.01 0.00 0.00 57.07 55.99 1zab s TYR 79 Cb 0.00 -2.26 0.00 0.00 -0.11 0.00 0.00 41.96 39.59 1zab s TYR 79 CO 0.00 -0.15 0.01 1.63 -1.11 0.00 0.00 175.55 175.93 1zab n LYS 80 N 4.63 5.45 -3.20 -0.62 5.02 -1.26 -3.01 118.16 125.16 1zab n LYS 80 Ca -0.15 -0.01 -0.44 0.00 -2.02 0.00 0.00 58.31 55.68 1zab n LYS 80 Cb 0.52 -0.41 -0.06 0.00 -0.02 0.00 0.00 35.03 35.06 1zab n LYS 80 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1zab s ASP 81 N -0.78 6.19 -0.09 4.39 2.15 -1.26 -4.94 116.67 122.34 1zab s ASP 81 Ca 0.00 -1.29 -0.02 0.00 0.43 0.00 0.00 52.55 51.67 1zab s ASP 81 Cb 0.00 -2.26 -0.03 0.00 -0.30 0.00 0.00 42.92 40.32 1zab s ASP 81 CO 0.00 -0.92 0.00 -0.36 -0.17 0.00 0.00 175.17 173.72 1zab s PHE 82 N 2.33 3.17 -0.25 -5.34 0.08 -1.26 -1.20 117.98 115.51 1zab s PHE 82 Ca 0.10 0.20 0.01 0.00 0.12 0.00 0.00 56.93 57.36 1zab s PHE 82 Cb -0.23 -1.79 -0.17 0.00 -0.57 0.00 0.00 43.02 40.25 1zab s PHE 82 CO 0.08 0.47 -0.19 -2.13 -0.10 0.00 0.00 175.22 173.35 1zab n ARG 83 N 2.15 0.66 -3.56 0.44 0.63 0.11 -4.77 116.66 112.32 1zab n ARG 83 Ca -0.19 0.16 -0.07 0.00 -0.92 0.00 0.00 57.85 56.84 1zab n ARG 83 Cb 0.54 -1.53 -0.02 0.00 0.45 0.00 0.00 32.46 31.89 1zab n ARG 83 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1zab s ALA 84 N -2.52 -1.84 -0.05 5.13 0.00 -1.06 -2.09 121.76 119.33 1zab s ALA 84 Ca -0.34 0.92 -0.03 0.00 0.00 0.00 0.00 51.96 52.50 1zab s ALA 84 Cb 0.09 0.39 0.03 0.00 0.00 0.00 0.00 23.12 23.63 1zab s ALA 84 CO 0.61 -0.75 0.13 -1.50 0.00 0.00 0.00 175.76 174.25 1zab s ILE 85 N -3.05 -0.03 0.12 0.00 2.07 -0.04 0.61 121.20 120.89 1zab s ILE 85 Ca 0.07 0.10 0.07 0.00 -1.41 0.00 0.00 60.65 59.48 1zab s ILE 85 Cb -0.01 -0.20 -0.04 0.00 0.13 0.00 0.00 42.46 42.34 1zab s ILE 85 CO -0.07 0.04 -0.09 0.00 -1.91 0.00 0.00 174.94 172.91 1zab s ALA 86 N 0.67 2.97 0.02 1.50 0.00 -0.04 -0.57 121.76 126.30 1zab s ALA 86 Ca -0.05 -1.30 0.05 0.00 0.00 0.00 0.00 51.96 50.67 1zab s ALA 86 Cb -0.07 -0.87 -0.02 0.00 0.00 0.00 0.00 23.12 22.17 1zab s ALA 86 CO -0.03 0.60 -0.16 0.42 0.00 0.00 0.00 175.76 176.58 1zab s ILE 87 N -1.34 1.31 -0.00 0.00 1.01 -0.74 -1.48 121.20 119.95 1zab s ILE 87 Ca 0.22 -0.89 0.02 0.00 0.00 0.00 0.00 60.65 60.01 1zab s ILE 87 Cb -0.10 -1.13 -0.01 0.00 0.01 0.00 0.00 42.46 41.23 1zab s ILE 87 CO 0.14 0.22 -0.08 -0.44 0.00 0.00 0.00 174.94 174.78 1zab s SER 88 N -0.78 0.92 0.23 3.58 0.01 0.37 -3.21 113.70 114.82 1zab s SER 88 Ca 0.05 -0.18 0.04 0.00 1.31 0.00 0.00 55.95 57.17 1zab s SER 88 Cb -0.07 -0.09 -0.01 0.00 0.21 0.00 0.00 66.02 66.05 1zab s SER 88 CO 0.00 0.07 0.22 -1.54 0.41 0.00 0.00 173.24 172.41 1zab n SER 89 N 2.76 -0.58 -0.73 2.44 3.41 -1.26 -0.73 113.62 118.93 1zab n SER 89 Ca -0.14 -2.44 0.13 0.00 -0.26 0.00 0.00 58.87 56.16 1zab n SER 89 Cb 0.57 1.26 0.32 0.00 -0.26 0.00 0.00 64.21 66.11 1zab n SER 89 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1zab n ASP 90 N -2.04 2.25 -4.58 4.04 8.00 -1.25 -4.53 116.55 118.42 1zab n ASP 90 Ca 0.04 -1.75 -0.42 0.00 0.71 0.00 0.00 54.79 53.37 1zab n ASP 90 Cb 0.41 -0.04 -0.03 0.00 -0.02 0.00 0.00 41.12 41.44 1zab n ASP 90 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1zab s LEU 91 N -1.90 3.45 0.30 0.64 1.43 -1.26 -4.85 118.68 116.49 1zab s LEU 91 Ca 0.34 0.77 0.14 0.00 -1.03 0.00 0.00 54.13 54.35 1zab s LEU 91 Cb 0.20 -3.19 0.39 0.00 0.03 0.00 0.00 46.19 43.63 1zab s LEU 91 CO 0.31 -1.82 1.60 1.56 0.23 0.00 0.00 176.35 178.24 1zab h GLN 92 N 12.60 0.00 -0.47 1.70 4.20 -1.98 -3.32 115.11 127.85 1zab h GLN 92 Ca -0.29 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.42 1zab h GLN 92 Cb 1.14 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.92 1zab h GLN 92 CO 1.12 0.54 0.00 0.39 -0.67 0.00 0.00 178.83 180.21 1zab n GLU 93 N -3.56 3.06 -3.78 1.46 -0.58 -1.26 -4.64 120.64 111.34 1zab n GLU 93 Ca -0.00 -2.47 -0.13 0.00 -0.42 0.00 0.00 57.16 54.14 1zab n GLU 93 Cb 0.62 -1.55 -0.12 0.00 -0.57 0.00 0.00 31.44 29.82 1zab n GLU 93 CO 0.00 0.00 0.00 -2.00 -0.48 0.00 0.00 177.13 174.65 1zab s GLU 94 N -1.49 0.23 0.01 3.49 2.56 -1.25 -5.12 118.70 117.14 1zab s GLU 94 Ca 0.37 0.35 -0.30 0.00 0.00 0.00 0.00 54.97 55.39 1zab s GLU 94 Cb 0.23 0.05 -0.06 0.00 2.00 0.00 0.00 34.13 36.35 1zab s GLU 94 CO 0.20 -0.07 1.35 -0.06 -0.56 0.00 0.00 175.26 176.12 1zab s PHE 95 N 0.44 3.01 -0.05 5.30 0.40 -1.26 -4.66 117.98 121.16 1zab s PHE 95 Ca -0.03 0.94 -0.30 0.00 -0.60 0.00 0.00 56.93 56.94 1zab s PHE 95 Cb -0.04 -3.61 -0.05 0.00 0.51 0.00 0.00 43.02 39.83 1zab s PHE 95 CO -0.02 -2.16 1.53 -1.50 0.70 0.00 0.00 175.22 173.76 1zab s ILE 96 N 2.06 3.70 -0.00 0.64 1.10 -0.47 -4.86 121.20 123.36 1zab s ILE 96 Ca 0.62 0.93 0.01 0.00 -0.51 0.00 0.00 60.65 61.70 1zab s ILE 96 Cb -0.31 -3.60 -0.04 0.00 0.15 0.00 0.00 42.46 38.67 1zab s ILE 96 CO 0.27 -0.06 0.02 -0.55 -2.11 0.00 0.00 174.94 172.51 1zab s SER 97 N 2.70 5.28 0.37 4.50 0.15 -1.26 -4.14 113.70 121.29 1zab s SER 97 Ca 0.68 0.03 -0.25 0.00 0.70 0.00 0.00 55.95 57.12 1zab s SER 97 Cb -0.31 -1.42 -0.10 0.00 -1.71 0.00 0.00 66.02 62.48 1zab s SER 97 CO 0.26 0.28 0.99 -2.16 1.20 0.00 0.00 173.24 173.81 1zab s PRO 98 N -1.62 4.38 0.79 5.44 0.04 -1.26 -5.04 135.00 137.73 1zab s PRO 98 Ca 0.21 1.37 -0.11 0.00 0.04 0.00 0.00 61.00 62.50 1zab s PRO 98 Cb -0.12 -2.62 0.07 0.00 0.04 0.00 0.00 34.50 31.87 1zab s PRO 98 CO 0.11 0.08 1.09 0.00 0.04 0.00 0.00 177.00 178.33 1zab h GLY 100 N -1.07 0.88 1.00 0.00 0.00 -1.97 -2.28 103.07 99.63 1zab h GLY 100 Ca -0.47 -0.28 -0.00 0.00 0.00 0.00 0.00 47.33 46.58 1zab h GLY 100 CO 0.59 0.22 0.36 0.00 0.00 0.00 0.00 176.54 177.71 1zab h ALA 101 N 1.63 0.74 -0.26 3.60 0.00 -2.00 -0.79 119.26 122.18 1zab h ALA 101 Ca 0.29 -0.06 -0.12 0.00 0.00 0.00 0.00 54.91 55.02 1zab h ALA 101 Cb 0.22 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1zab h ALA 101 CO -0.09 0.21 -0.33 0.00 0.00 0.00 0.00 179.25 179.04 1zab h ARG 103 N 0.48 1.03 -0.47 0.00 3.08 -0.88 0.23 114.38 117.85 1zab h ARG 103 Ca 0.06 -0.08 -0.04 0.00 0.07 0.00 0.00 59.98 59.99 1zab h ARG 103 Cb 0.80 -0.22 -0.02 0.00 0.08 0.00 0.00 29.97 30.61 1zab h ARG 103 CO 0.07 0.70 0.15 0.37 -1.07 0.00 0.00 179.97 180.19 1zab h GLN 104 N 1.04 0.72 -0.59 0.04 5.75 -0.82 0.88 115.11 122.14 1zab h GLN 104 Ca 0.28 -0.15 -0.10 0.00 -0.15 0.00 0.00 58.65 58.52 1zab h GLN 104 Cb -0.08 -0.11 -0.02 0.00 1.07 0.00 0.00 27.48 28.34 1zab h GLN 104 CO -0.06 0.68 -0.03 0.28 -2.65 0.00 0.00 178.83 177.05 1zab h VAL 105 N 0.62 1.27 -0.39 2.39 2.07 -0.96 -1.98 116.25 119.26 1zab h VAL 105 Ca 0.15 -1.19 0.02 0.00 0.82 0.00 0.00 66.70 66.50 1zab h VAL 105 Cb 0.26 0.84 -0.03 0.00 -1.52 0.00 0.00 31.29 30.84 1zab h VAL 105 CO -0.01 0.43 0.23 0.24 0.02 0.00 0.00 177.57 178.48 1zab h MET 106 N 0.96 0.45 0.00 1.57 2.86 -0.21 -2.31 114.93 118.25 1zab h MET 106 Ca 0.16 -0.03 -0.01 0.00 -2.06 0.00 0.00 59.70 57.77 1zab h MET 106 Cb 0.59 -0.10 -0.00 0.00 0.06 0.00 0.00 31.60 32.15 1zab h MET 106 CO 0.04 0.30 -0.04 -0.09 1.06 0.00 0.00 176.91 178.17 1zab h ARG 107 N 0.46 0.00 -0.10 1.72 1.12 -0.45 -1.48 114.38 115.66 1zab h ARG 107 Ca 0.16 0.00 0.03 0.00 -1.11 0.00 0.00 59.98 59.05 1zab h ARG 107 Cb 0.01 0.00 -0.00 0.00 -0.01 0.00 0.00 29.97 29.97 1zab h ARG 107 CO -0.07 0.04 0.07 1.49 -3.11 0.00 0.00 179.97 178.38 1zab h GLU 108 N 0.00 0.00 -0.41 0.20 4.57 -0.77 -2.22 114.58 115.95 1zab h GLU 108 Ca -0.00 0.00 -0.13 0.00 -1.18 0.00 0.00 59.36 58.05 1zab h GLU 108 Cb 0.08 0.00 -0.08 0.00 -0.16 0.00 0.00 28.75 28.59 1zab h GLU 108 CO 0.00 0.00 0.05 1.19 -1.18 0.00 0.00 179.01 179.08 1zab n PHE 109 N -4.45 1.36 0.00 0.92 3.01 -0.56 -5.00 117.46 112.75 1zab n PHE 109 Ca -0.01 -1.25 0.00 0.00 1.01 0.00 0.00 57.45 57.21 1zab n PHE 109 Cb 0.18 -0.48 0.00 0.00 -0.01 0.00 0.00 39.48 39.18 1zab n PHE 109 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1zab n GLY 110 N -0.72 3.79 0.01 1.37 0.00 -0.84 -4.74 105.19 104.06 1zab n GLY 110 Ca 0.31 -1.57 0.08 0.00 0.00 0.00 0.00 46.02 44.85 1zab n GLY 110 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1zab n THR 111 N -1.18 0.00 -1.65 2.61 -2.24 -1.26 -4.06 114.28 106.49 1zab n THR 111 Ca 0.00 -0.36 -0.32 0.00 -2.27 0.00 0.00 64.05 61.11 1zab n THR 111 Cb 0.00 0.21 -0.02 0.00 -2.10 0.00 0.00 70.33 68.42 1zab n THR 111 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1zab n ASP 112 N -2.01 6.86 -4.13 3.42 10.43 -1.26 -2.10 116.55 127.76 1zab n ASP 112 Ca -0.02 -3.41 -0.09 0.00 2.57 0.00 0.00 54.79 53.83 1zab n ASP 112 Cb 0.42 -1.18 -0.10 0.00 1.84 0.00 0.00 41.12 42.10 1zab n ASP 112 CO 0.00 0.00 0.00 -1.66 -1.07 0.00 0.00 177.20 174.47 1zab s TRP 113 N -2.49 0.71 0.05 1.24 1.48 -1.26 -5.02 118.94 113.64 1zab s TRP 113 Ca 0.56 -0.98 -0.13 0.00 -1.06 0.00 0.00 56.10 54.50 1zab s TRP 113 Cb 0.40 -0.45 -0.06 0.00 -1.16 0.00 0.00 33.47 32.20 1zab s TRP 113 CO -0.28 -0.26 0.42 0.00 -4.06 0.00 0.00 176.95 172.77 1zab s ALA 114 N -3.71 3.69 -0.25 2.67 0.00 -0.89 -2.08 121.76 121.20 1zab s ALA 114 Ca 0.09 -0.26 0.00 0.00 0.00 0.00 0.00 51.96 51.79 1zab s ALA 114 Cb 0.06 -2.36 0.04 0.00 0.00 0.00 0.00 23.12 20.86 1zab s ALA 114 CO -0.07 0.51 -0.09 0.08 0.00 0.00 0.00 175.76 176.18 1zab s VAL 115 N -1.24 2.52 -0.40 0.00 1.01 -0.12 -0.86 120.40 121.30 1zab s VAL 115 Ca 0.29 -1.24 -0.20 0.00 0.00 0.00 0.00 61.98 60.83 1zab s VAL 115 Cb -0.15 -2.32 0.01 0.00 0.00 0.00 0.00 36.38 33.92 1zab s VAL 115 CO 0.16 0.16 0.60 -0.31 0.00 0.00 0.00 175.10 175.70 1zab s TYR 116 N 1.24 3.11 -0.43 5.22 2.02 0.26 -2.45 117.35 126.33 1zab s TYR 116 Ca -0.02 0.03 -0.17 0.00 -0.37 0.00 0.00 57.07 56.53 1zab s TYR 116 Cb -0.17 -3.19 0.03 0.00 -0.40 0.00 0.00 41.96 38.23 1zab s TYR 116 CO -0.06 -0.75 0.43 -1.64 -1.57 0.00 0.00 175.55 171.97 1zab s MET 117 N 2.65 3.08 0.57 -0.62 -1.94 0.21 -1.79 119.30 121.47 1zab s MET 117 Ca 0.21 -0.82 0.07 0.00 -1.71 0.00 0.00 55.69 53.44 1zab s MET 117 Cb -0.15 -3.98 0.07 0.00 2.01 0.00 0.00 34.83 32.78 1zab s MET 117 CO 0.17 -0.87 0.60 0.95 -0.01 0.00 0.00 175.02 175.85 1zab s THR 118 N 2.09 1.78 0.08 2.05 -4.23 -1.20 -1.08 115.64 115.13 1zab s THR 118 Ca 0.11 -1.27 0.03 0.00 -1.18 0.00 0.00 61.69 59.38 1zab s THR 118 Cb -0.18 -2.05 -0.03 0.00 1.34 0.00 0.00 72.50 71.58 1zab s THR 118 CO 0.13 0.00 -0.09 -0.54 -0.54 0.00 0.00 174.62 173.58 1zab s LYS 119 N -4.49 0.74 0.52 3.99 1.02 -0.77 -1.37 119.74 119.37 1zab s LYS 119 Ca 0.46 -1.05 0.28 0.00 0.02 0.00 0.00 55.97 55.69 1zab s LYS 119 Cb -0.04 -0.41 1.40 0.00 -0.52 0.00 0.00 37.83 38.27 1zab s LYS 119 CO 0.29 0.06 1.90 -1.35 -0.92 0.00 0.00 175.35 175.33 1zab h PRO 120 N 3.80 0.07 0.00 -1.68 0.11 -1.80 -0.79 132.00 131.71 1zab h PRO 120 Ca -0.37 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.74 1zab h PRO 120 Cb 1.19 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1zab h PRO 120 CO 0.50 0.04 0.00 -0.40 -0.21 0.00 0.00 178.00 177.94 1zab n ASP 121 N -4.33 0.00 0.00 -2.05 3.85 -1.26 -4.86 116.55 107.89 1zab n ASP 121 Ca 0.17 -0.46 0.00 0.00 -0.71 0.00 0.00 54.79 53.79 1zab n ASP 121 Cb 0.85 -0.10 0.00 0.00 -1.35 0.00 0.00 41.12 40.52 1zab n ASP 121 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1zab n GLY 122 N 0.46 0.56 3.83 6.12 0.00 -0.30 -5.07 105.19 110.79 1zab n GLY 122 Ca 0.15 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.86 1zab n GLY 122 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1zab s THR 123 N -2.16 4.17 0.17 2.61 -4.23 -1.26 -4.86 115.64 110.08 1zab s THR 123 Ca 0.00 0.70 -0.24 0.00 -1.18 0.00 0.00 61.69 60.97 1zab s THR 123 Cb 0.00 -3.52 0.06 0.00 1.34 0.00 0.00 72.50 70.37 1zab s THR 123 CO 0.00 -0.92 0.84 0.72 -0.54 0.00 0.00 174.62 174.72 1zab s PHE 124 N -3.10 -0.22 0.01 3.99 -0.12 -1.26 -1.85 117.98 115.44 1zab s PHE 124 Ca 0.57 -0.10 0.07 0.00 -0.05 0.00 0.00 56.93 57.42 1zab s PHE 124 Cb -0.13 0.64 -0.02 0.00 -0.63 0.00 0.00 43.02 42.88 1zab s PHE 124 CO 0.55 -0.91 -0.20 0.08 -0.05 0.00 0.00 175.22 174.68 1zab s VAL 125 N -3.49 1.62 -0.09 -2.49 1.01 -0.24 -4.97 120.40 111.75 1zab s VAL 125 Ca 0.10 -1.00 0.04 0.00 0.00 0.00 0.00 61.98 61.12 1zab s VAL 125 Cb -0.03 -1.37 -0.00 0.00 0.00 0.00 0.00 36.38 34.98 1zab s VAL 125 CO 0.01 0.35 -0.24 -0.69 0.00 0.00 0.00 175.10 174.52 1zab s VAL 126 N -0.61 2.06 0.02 2.92 1.01 -1.26 -0.61 120.40 123.92 1zab s VAL 126 Ca 0.08 -1.03 0.00 0.00 0.00 0.00 0.00 61.98 61.03 1zab s VAL 126 Cb -0.08 -1.77 -0.02 0.00 0.00 0.00 0.00 36.38 34.51 1zab s VAL 126 CO 0.00 0.56 -0.03 -0.13 0.00 0.00 0.00 175.10 175.51 1zab s ARG 127 N 0.25 0.26 0.63 2.72 1.81 -1.03 -4.98 118.95 118.61 1zab s ARG 127 Ca -0.16 -0.49 -0.09 0.00 -1.72 0.00 0.00 55.73 53.27 1zab s ARG 127 Cb -0.17 0.07 0.00 0.00 -0.45 0.00 0.00 34.95 34.39 1zab s ARG 127 CO 0.08 -0.03 0.98 0.95 -0.68 0.00 0.00 175.30 176.60 1zab s THR 128 N -1.14 3.85 0.33 0.02 -4.23 -1.26 -0.94 115.64 112.26 1zab s THR 128 Ca -0.12 0.32 0.02 0.00 -1.18 0.00 0.00 61.69 60.73 1zab s THR 128 Cb -0.08 -3.56 0.19 0.00 1.34 0.00 0.00 72.50 70.40 1zab s THR 128 CO -0.01 -0.66 1.91 0.58 -0.54 0.00 0.00 174.62 175.91 1zab h VAL 129 N -0.34 1.19 -0.54 2.29 2.07 -1.38 -1.31 116.25 118.23 1zab h VAL 129 Ca -0.45 -0.61 -0.00 0.00 0.82 0.00 0.00 66.70 66.45 1zab h VAL 129 Cb 1.24 0.64 -0.03 0.00 -1.52 0.00 0.00 31.29 31.62 1zab h VAL 129 CO 0.62 0.24 0.33 -0.61 0.02 0.00 0.00 177.57 178.17 1zab h GLN 130 N 0.69 0.73 -0.23 1.57 4.15 -1.72 -0.15 115.11 120.15 1zab h GLN 130 Ca 0.16 -0.06 -0.11 0.00 0.77 0.00 0.00 58.65 59.41 1zab h GLN 130 Cb 0.17 -0.16 -0.01 0.00 0.21 0.00 0.00 27.48 27.69 1zab h GLN 130 CO -0.01 0.52 -0.32 0.93 -1.93 0.00 0.00 178.83 178.02 1zab h GLU 131 N 0.73 0.48 0.00 1.69 5.08 -1.75 -2.62 114.58 118.19 1zab h GLU 131 Ca 0.20 -0.20 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1zab h GLU 131 Cb -0.03 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.21 1zab h GLU 131 CO -0.04 0.74 0.00 -0.07 -1.00 0.00 0.00 179.01 178.64 1zab h LEU 132 N 0.41 0.00 -5.84 1.33 4.07 -0.78 -3.37 115.31 111.12 1zab h LEU 132 Ca 0.05 0.00 -0.49 0.00 0.08 0.00 0.00 57.88 57.52 1zab h LEU 132 Cb 0.76 0.00 -0.35 0.00 1.08 0.00 0.00 40.66 42.15 1zab h LEU 132 CO 0.06 0.00 -1.02 -0.11 -1.08 0.00 0.00 178.44 176.29 1zab n LEU 133 N -2.50 -0.22 -4.65 1.67 7.94 -0.11 -5.05 117.00 114.09 1zab n LEU 133 Ca 0.04 -4.52 -0.40 0.00 -1.11 0.00 0.00 56.01 50.02 1zab n LEU 133 Cb 0.39 0.69 0.03 0.00 0.53 0.00 0.00 43.42 45.05 1zab n LEU 133 CO 0.28 2.09 0.68 -2.65 -1.11 0.00 0.00 177.39 176.68 1zab n PRO 134 N 1.26 1.35 -4.20 1.96 -0.02 -1.07 -2.90 135.00 131.38 1zab n PRO 134 Ca 0.20 0.50 -0.30 0.00 -2.02 0.00 0.00 63.50 61.87 1zab n PRO 134 Cb 0.57 -2.22 -0.07 0.00 -0.02 0.00 0.00 33.50 31.76 1zab n PRO 134 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1zab n ALA 135 N -0.93 -2.06 -1.76 3.55 0.00 -1.26 -4.82 120.51 113.23 1zab n ALA 135 Ca 0.10 -0.39 -0.39 0.00 0.00 0.00 0.00 53.44 52.76 1zab n ALA 135 Cb 0.43 -1.13 0.01 0.00 0.00 0.00 0.00 19.45 18.76 1zab n ALA 135 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1zab s SER 136 N -4.32 6.00 0.44 0.00 1.04 -1.14 -5.01 113.70 110.71 1zab s SER 136 Ca 0.04 2.69 -0.21 0.00 0.48 0.00 0.00 55.95 58.95 1zab s SER 136 Cb -0.02 -2.64 -0.10 0.00 0.10 0.00 0.00 66.02 63.36 1zab s SER 136 CO 0.97 -1.06 0.98 0.12 0.98 0.00 0.00 173.24 175.22 1zab s PHE 137 N -1.29 3.25 0.00 5.02 5.36 -1.26 -5.02 117.98 124.04 1zab s PHE 137 Ca 0.61 1.61 0.00 0.00 -0.96 0.00 0.00 56.93 58.20 1zab s PHE 137 Cb -0.39 -2.92 0.00 0.00 -0.34 0.00 0.00 43.02 39.37 1zab s PHE 137 CO 0.49 -0.30 0.00 0.41 -1.46 0.00 0.00 175.22 174.36 1zab n GLY 138 N -0.42 1.35 0.41 13.12 0.00 -1.26 -4.99 105.19 113.40 1zab n GLY 138 Ca 0.07 -0.87 0.23 0.00 0.00 0.00 0.00 46.02 45.45 1zab n GLY 138 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1zab h PRO 139 N 0.00 0.38 -0.23 1.61 0.11 -1.94 -0.24 132.00 131.70 1zab h PRO 139 Ca 0.00 -0.02 0.07 0.00 0.11 0.00 0.00 66.00 66.15 1zab h PRO 139 Cb 0.00 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 31.01 1zab h PRO 139 CO 0.00 0.25 0.18 1.05 -0.21 0.00 0.00 178.00 179.27 1zab h GLU 140 N 0.39 0.00 -0.04 1.05 4.11 -1.95 -1.16 114.58 116.99 1zab h GLU 140 Ca 0.58 0.00 -0.07 0.00 0.07 0.00 0.00 59.36 59.95 1zab h GLU 140 Cb 1.48 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.72 1zab h GLU 140 CO -0.28 0.00 -0.28 -0.44 0.07 0.00 0.00 179.01 178.07 1zab h ASP 141 N 0.00 0.06 -0.55 3.06 3.32 -1.44 -1.65 116.42 119.22 1zab h ASP 141 Ca 0.11 -0.02 -0.00 0.00 0.02 0.00 0.00 57.03 57.14 1zab h ASP 141 Cb 0.47 -0.02 -0.00 0.00 0.22 0.00 0.00 39.33 40.00 1zab h ASP 141 CO -0.00 0.35 0.00 0.18 -1.72 0.00 0.00 179.24 178.05 1zab n LEU 142 N -4.18 5.59 -3.95 1.55 4.77 -0.51 -4.92 117.00 115.36 1zab n LEU 142 Ca -0.02 -2.95 -0.26 0.00 -0.03 0.00 0.00 56.01 52.75 1zab n LEU 142 Cb 0.35 -0.68 -0.02 0.00 -2.33 0.00 0.00 43.42 40.74 1zab n LEU 142 CO 0.38 0.64 -0.24 0.00 -1.33 0.00 0.00 177.39 176.85 1zab n GLN 143 N 0.50 -3.21 0.00 3.23 6.02 -0.62 -4.86 117.38 118.43 1zab n GLN 143 Ca 0.27 0.40 0.11 0.00 -0.01 0.00 0.00 57.00 57.78 1zab n GLN 143 Cb 1.18 -4.50 0.05 0.00 1.02 0.00 0.00 30.24 27.99 1zab n GLN 143 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 177.06 177.22 1zab n LYS 144 N -4.40 0.78 -3.56 -1.09 3.00 -0.79 -4.80 118.16 107.30 1zab n LYS 144 Ca -0.31 -0.61 -0.41 0.00 -0.00 0.00 0.00 58.31 56.98 1zab n LYS 144 Cb 0.69 -1.49 -0.10 0.00 0.00 0.00 0.00 35.03 34.13 1zab n LYS 144 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.40 177.82 1zab s ILE 145 N -2.64 4.51 0.00 3.15 1.01 -1.26 -4.97 121.20 120.99 1zab s ILE 145 Ca 0.16 -1.21 0.00 0.00 0.00 0.00 0.00 60.65 59.60 1zab s ILE 145 Cb 0.18 -3.69 0.00 0.00 0.01 0.00 0.00 42.46 38.96 1zab s ILE 145 CO 0.64 -0.46 0.00 0.00 0.00 0.00 0.00 174.94 175.12