#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1zib s ASP 2 N 0.00 3.76 0.17 0.00 1.01 -1.26 -1.46 116.67 118.89 1zib s ASP 2 Ca 0.00 -0.33 0.06 0.00 0.71 0.00 0.00 52.55 52.99 1zib s ASP 2 Cb 0.00 -1.10 -0.05 0.00 1.01 0.00 0.00 42.92 42.78 1zib s ASP 2 CO 0.00 0.26 -0.12 -0.36 0.21 0.00 0.00 175.17 175.15 1zib s PHE 3 N -0.21 1.48 -0.04 4.23 0.40 0.37 -4.98 117.98 119.22 1zib s PHE 3 Ca -0.00 -0.67 0.05 0.00 -0.60 0.00 0.00 56.93 55.71 1zib s PHE 3 Cb -0.13 -0.72 -0.01 0.00 0.51 0.00 0.00 43.02 42.67 1zib s PHE 3 CO 0.03 0.22 -0.20 -1.21 0.70 0.00 0.00 175.22 174.76 1zib s GLU 4 N -3.68 1.91 -0.11 0.44 2.02 -1.26 -0.83 118.70 117.19 1zib s GLU 4 Ca 0.19 -0.71 0.00 0.00 0.02 0.00 0.00 54.97 54.48 1zib s GLU 4 Cb 0.01 -1.70 0.02 0.00 0.10 0.00 0.00 34.13 32.56 1zib s GLU 4 CO 0.04 0.33 -0.10 0.08 0.02 0.00 0.00 175.26 175.63 1zib s VAL 5 N -0.16 1.16 0.03 2.63 1.01 -0.62 -4.61 120.40 119.83 1zib s VAL 5 Ca -0.00 -0.41 -0.01 0.00 0.00 0.00 0.00 61.98 61.56 1zib s VAL 5 Cb -0.11 -1.13 -0.04 0.00 0.00 0.00 0.00 36.38 35.10 1zib s VAL 5 CO 0.02 0.38 0.19 -1.00 0.00 0.00 0.00 175.10 174.69 1zib s HIS 6 N 1.38 3.51 -0.25 5.22 3.76 0.01 0.21 115.29 129.13 1zib s HIS 6 Ca -0.00 0.29 -0.05 0.00 -0.15 0.00 0.00 55.06 55.15 1zib s HIS 6 Cb -0.13 -1.79 0.00 0.00 1.11 0.00 0.00 32.58 31.77 1zib s HIS 6 CO -0.05 0.61 0.01 -1.64 -0.85 0.00 0.00 174.74 172.82 1zib s MET 7 N -2.20 3.21 0.08 1.40 -1.94 -0.55 -0.57 119.30 118.73 1zib s MET 7 Ca 0.31 -0.76 0.06 0.00 -1.71 0.00 0.00 55.69 53.60 1zib s MET 7 Cb -0.13 -3.16 -0.03 0.00 2.01 0.00 0.00 34.83 33.52 1zib s MET 7 CO 0.23 -0.32 -0.17 -0.51 -0.01 0.00 0.00 175.02 174.24 1zib s LEU 8 N 1.47 2.29 0.16 -0.03 1.43 -0.78 -1.20 118.68 122.03 1zib s LEU 8 Ca 0.04 -0.65 -0.01 0.00 -1.03 0.00 0.00 54.13 52.47 1zib s LEU 8 Cb -0.16 -0.67 0.02 0.00 0.03 0.00 0.00 46.19 45.41 1zib s LEU 8 CO -0.01 -0.02 1.40 0.78 0.23 0.00 0.00 176.35 178.73 1zib h ASN 9 N 4.20 0.46 -3.53 2.29 2.35 -1.93 -0.50 115.58 118.92 1zib h ASN 9 Ca -0.43 -0.32 -0.20 0.00 -0.55 0.00 0.00 56.30 54.80 1zib h ASN 9 Cb 1.19 -0.14 -0.29 0.00 0.05 0.00 0.00 38.32 39.13 1zib h ASN 9 CO 0.40 1.08 -0.50 -0.54 -1.65 0.00 0.00 177.43 176.22 1zib s LYS 10 N -3.48 0.20 0.00 0.81 1.02 -1.26 0.38 119.74 117.41 1zib s LYS 10 Ca -0.05 0.42 0.00 0.00 0.02 0.00 0.00 55.97 56.36 1zib s LYS 10 Cb 0.10 -0.04 0.00 0.00 -0.52 0.00 0.00 37.83 37.37 1zib s LYS 10 CO 0.84 -0.11 0.00 0.41 -0.92 0.00 0.00 175.35 175.57 1zib n GLY 11 N 3.77 4.23 0.37 -3.33 0.00 0.15 -4.98 105.19 105.40 1zib n GLY 11 Ca -0.21 -1.43 0.03 0.00 0.00 0.00 0.00 46.02 44.41 1zib n GLY 11 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1zib h LYS 12 N 0.00 1.07 0.00 1.61 3.64 -2.01 -1.94 116.57 118.94 1zib h LYS 12 Ca 0.00 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.32 1zib h LYS 12 Cb 0.00 -0.24 0.00 0.00 -0.41 0.00 0.00 32.23 31.58 1zib h LYS 12 CO 0.00 0.71 0.00 -0.25 -2.27 0.00 0.00 179.45 177.64 1zib n ASP 13 N -4.47 0.00 0.00 4.20 8.00 -1.26 -5.02 116.55 118.00 1zib n ASP 13 Ca 0.13 -0.95 0.00 0.00 0.71 0.00 0.00 54.79 54.69 1zib n ASP 13 Cb 0.15 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.25 1zib n ASP 13 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1zib n GLY 14 N 0.76 -0.02 3.85 0.44 0.00 -0.73 -5.03 105.19 104.45 1zib n GLY 14 Ca 0.20 -2.05 -0.32 0.00 0.00 0.00 0.00 46.02 43.85 1zib n GLY 14 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1zib s ALA 15 N -2.00 3.27 -0.58 4.61 0.00 -1.26 0.31 121.76 126.10 1zib s ALA 15 Ca 0.00 0.01 -0.14 0.00 0.00 0.00 0.00 51.96 51.83 1zib s ALA 15 Cb 0.00 -2.83 0.02 0.00 0.00 0.00 0.00 23.12 20.31 1zib s ALA 15 CO 0.00 0.12 0.64 -1.33 0.00 0.00 0.00 175.76 175.20 1zib n MET 16 N -0.87 -1.87 -4.33 0.00 2.81 0.16 -4.86 117.12 108.17 1zib n MET 16 Ca 0.04 1.60 -0.17 0.00 -1.81 0.00 0.00 57.70 57.36 1zib n MET 16 Cb 0.54 -4.48 -0.10 0.00 -0.71 0.00 0.00 33.22 28.47 1zib n MET 16 CO 0.00 0.00 0.00 0.14 1.51 0.00 0.00 175.97 177.62 1zib s VAL 17 N -2.56 1.45 -0.10 2.03 -7.23 -0.20 -3.77 120.40 110.03 1zib s VAL 17 Ca 0.17 -2.13 -0.03 0.00 -1.81 0.00 0.00 61.98 58.18 1zib s VAL 17 Cb -0.03 -2.11 -0.04 0.00 0.56 0.00 0.00 36.38 34.77 1zib s VAL 17 CO 0.80 -0.55 0.04 -0.36 -0.31 0.00 0.00 175.10 174.73 1zib s PHE 18 N -3.15 3.29 -0.12 2.82 0.40 -1.26 -1.86 117.98 118.09 1zib s PHE 18 Ca 0.23 0.29 -0.02 0.00 -0.60 0.00 0.00 56.93 56.83 1zib s PHE 18 Cb 0.02 -1.84 0.04 0.00 0.51 0.00 0.00 43.02 41.76 1zib s PHE 18 CO 0.06 0.55 0.02 -1.21 0.70 0.00 0.00 175.22 175.34 1zib s GLU 19 N -0.92 0.59 0.59 0.44 2.02 0.26 -2.85 118.70 118.83 1zib s GLU 19 Ca 0.14 -0.10 -0.15 0.00 0.02 0.00 0.00 54.97 54.87 1zib s GLU 19 Cb -0.12 -1.46 -0.04 0.00 0.10 0.00 0.00 34.13 32.61 1zib s GLU 19 CO 0.03 -0.46 1.04 -1.25 0.02 0.00 0.00 175.26 174.64 1zib s PRO 20 N 1.94 3.45 0.26 0.39 0.04 -1.26 -0.81 135.00 139.01 1zib s PRO 20 Ca 0.03 1.07 0.24 0.00 0.04 0.00 0.00 61.00 62.38 1zib s PRO 20 Cb -0.14 -2.06 0.36 0.00 0.04 0.00 0.00 34.50 32.70 1zib s PRO 20 CO -0.07 -0.70 1.44 0.00 0.04 0.00 0.00 177.00 177.72 1zib h ALA 21 N 0.35 0.78 -3.69 8.56 0.00 -1.85 -3.45 119.26 119.96 1zib h ALA 21 Ca -0.46 0.00 -0.35 0.00 0.00 0.00 0.00 54.91 54.09 1zib h ALA 21 Cb 1.21 0.00 -0.31 0.00 0.00 0.00 0.00 17.79 18.69 1zib h ALA 21 CO 0.59 0.00 -0.76 -1.54 0.00 0.00 0.00 179.25 177.54 1zib s SER 22 N -5.18 0.67 -0.08 0.00 1.04 -1.26 0.76 113.70 109.65 1zib s SER 22 Ca 0.06 -0.09 -0.06 0.00 0.48 0.00 0.00 55.95 56.34 1zib s SER 22 Cb 0.10 -0.21 0.03 0.00 0.10 0.00 0.00 66.02 66.03 1zib s SER 22 CO 0.70 -0.00 0.20 -0.22 0.98 0.00 0.00 173.24 174.90 1zib s LEU 23 N 0.41 0.88 -0.22 2.42 2.96 -0.50 -4.97 118.68 119.66 1zib s LEU 23 Ca -0.05 0.42 -0.08 0.00 -0.22 0.00 0.00 54.13 54.20 1zib s LEU 23 Cb -0.08 0.64 -0.04 0.00 0.50 0.00 0.00 46.19 47.21 1zib s LEU 23 CO -0.00 -0.11 0.09 -0.75 -1.32 0.00 0.00 176.35 174.26 1zib s LYS 24 N 0.67 3.88 0.40 1.98 2.20 -1.26 -0.32 119.74 127.29 1zib s LYS 24 Ca -0.05 -0.37 0.05 0.00 -0.36 0.00 0.00 55.97 55.24 1zib s LYS 24 Cb -0.06 -3.35 -0.06 0.00 -1.51 0.00 0.00 37.83 32.85 1zib s LYS 24 CO -0.04 0.04 0.04 0.14 -0.36 0.00 0.00 175.35 175.17 1zib s VAL 25 N 1.03 1.44 0.28 4.02 -7.23 0.14 -4.93 120.40 115.15 1zib s VAL 25 Ca 0.05 -2.00 0.06 0.00 -1.81 0.00 0.00 61.98 58.28 1zib s VAL 25 Cb -0.14 -2.73 -0.03 0.00 0.56 0.00 0.00 36.38 34.05 1zib s VAL 25 CO 0.03 0.00 0.34 0.00 -0.31 0.00 0.00 175.10 175.16 1zib s ALA 26 N -2.99 3.91 0.12 1.32 0.00 -1.26 -0.41 121.76 122.44 1zib s ALA 26 Ca 0.30 -1.41 -0.34 0.00 0.00 0.00 0.00 51.96 50.51 1zib s ALA 26 Cb 0.07 -1.51 -0.13 0.00 0.00 0.00 0.00 23.12 21.55 1zib s ALA 26 CO 0.14 0.13 1.64 -2.30 0.00 0.00 0.00 175.76 175.38 1zib n PRO 27 N -1.41 2.20 0.00 0.00 -0.02 -1.26 -1.22 135.00 133.29 1zib n PRO 27 Ca -0.05 0.80 0.00 0.00 -2.02 0.00 0.00 63.50 62.22 1zib n PRO 27 Cb 0.58 -2.58 0.00 0.00 -0.02 0.00 0.00 33.50 31.48 1zib n PRO 27 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1zib n GLY 28 N 3.63 1.15 3.80 -1.23 0.00 -0.11 -5.05 105.19 107.38 1zib n GLY 28 Ca 0.18 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.89 1zib n GLY 28 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1zib s ASP 29 N -2.25 5.11 -0.09 1.61 1.01 -0.36 -4.66 116.67 117.05 1zib s ASP 29 Ca 0.00 1.74 0.02 0.00 0.71 0.00 0.00 52.55 55.02 1zib s ASP 29 Cb 0.00 -2.51 -0.02 0.00 1.01 0.00 0.00 42.92 41.40 1zib s ASP 29 CO 0.00 -1.62 -0.16 -0.89 0.21 0.00 0.00 175.17 172.71 1zib s THR 30 N -2.88 2.84 -0.05 -1.27 2.01 -0.54 -0.88 115.64 114.86 1zib s THR 30 Ca 0.60 -0.77 0.06 0.00 0.31 0.00 0.00 61.69 61.89 1zib s THR 30 Cb -0.16 -2.14 -0.01 0.00 0.01 0.00 0.00 72.50 70.21 1zib s THR 30 CO 0.52 0.56 -0.23 -0.69 -0.69 0.00 0.00 174.62 174.08 1zib s VAL 31 N -0.07 1.92 -0.25 3.82 1.01 0.14 -0.48 120.40 126.49 1zib s VAL 31 Ca -0.03 -0.99 -0.05 0.00 0.00 0.00 0.00 61.98 60.90 1zib s VAL 31 Cb -0.14 -1.63 -0.00 0.00 0.00 0.00 0.00 36.38 34.61 1zib s VAL 31 CO 0.04 0.54 0.00 -0.89 0.00 0.00 0.00 175.10 174.79 1zib s THR 32 N -0.13 3.62 -0.21 3.92 2.01 -0.01 0.21 115.64 125.04 1zib s THR 32 Ca -0.03 -0.55 -0.20 0.00 0.31 0.00 0.00 61.69 61.22 1zib s THR 32 Cb -0.13 -2.73 -0.02 0.00 0.01 0.00 0.00 72.50 69.62 1zib s THR 32 CO 0.03 0.30 0.61 -0.36 -0.69 0.00 0.00 174.62 174.52 1zib s PHE 33 N 1.49 3.35 -0.20 4.92 0.40 0.26 -1.59 117.98 126.60 1zib s PHE 33 Ca 0.04 0.87 0.02 0.00 -0.60 0.00 0.00 56.93 57.26 1zib s PHE 33 Cb -0.15 -2.79 0.03 0.00 0.51 0.00 0.00 43.02 40.61 1zib s PHE 33 CO -0.01 -0.21 -0.17 0.42 0.70 0.00 0.00 175.22 175.95 1zib s ILE 34 N 2.05 2.11 -0.59 0.64 1.01 0.13 0.08 121.20 126.64 1zib s ILE 34 Ca 0.27 -1.15 -0.27 0.00 0.00 0.00 0.00 60.65 59.50 1zib s ILE 34 Cb -0.16 -2.00 0.00 0.00 0.01 0.00 0.00 42.46 40.32 1zib s ILE 34 CO 0.10 0.37 1.58 -2.84 0.00 0.00 0.00 174.94 174.14 1zib s PRO 35 N 1.23 3.06 0.11 2.79 0.02 -1.26 -1.48 135.00 139.47 1zib s PRO 35 Ca 0.01 0.48 -0.12 0.00 0.02 0.00 0.00 61.00 61.39 1zib s PRO 35 Cb -0.15 -4.23 -0.12 0.00 0.02 0.00 0.00 34.50 30.02 1zib s PRO 35 CO -0.10 -2.23 1.37 1.15 -0.33 0.00 0.00 177.00 176.85 1zib h THR 36 N 6.53 1.28 -2.36 0.99 2.02 -1.52 -3.42 112.91 116.43 1zib h THR 36 Ca -0.27 -1.81 -0.52 0.00 0.77 0.00 0.00 66.41 64.58 1zib h THR 36 Cb 1.12 1.76 -0.05 0.00 -1.74 0.00 0.00 68.15 69.23 1zib h THR 36 CO 1.19 0.58 -0.53 -1.81 0.37 0.00 0.00 175.52 175.33 1zib s ASP 37 N -6.99 5.59 0.56 4.18 1.01 -0.88 -5.04 116.67 115.10 1zib s ASP 37 Ca -0.11 -0.19 -0.15 0.00 0.71 0.00 0.00 52.55 52.82 1zib s ASP 37 Cb 0.09 -1.45 -0.06 0.00 1.01 0.00 0.00 42.92 42.51 1zib s ASP 37 CO 0.89 -0.00 1.01 -0.54 0.21 0.00 0.00 175.17 176.74 1zib s LYS 38 N -3.61 3.73 0.00 8.23 3.01 -1.26 -4.36 119.74 125.48 1zib s LYS 38 Ca 0.32 0.94 0.00 0.00 -1.01 0.00 0.00 55.97 56.22 1zib s LYS 38 Cb -0.09 -2.10 0.00 0.00 -1.01 0.00 0.00 37.83 34.63 1zib s LYS 38 CO 0.25 -0.46 0.00 0.41 0.51 0.00 0.00 175.35 176.06 1zib n GLY 39 N -1.80 0.54 3.72 -3.33 0.00 -1.26 -4.99 105.19 98.07 1zib n GLY 39 Ca 0.07 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.86 1zib n GLY 39 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1zib s HIS 40 N -2.17 2.79 0.15 1.61 3.76 -1.26 -4.86 115.29 115.30 1zib s HIS 40 Ca 0.00 -0.25 -0.01 0.00 -0.15 0.00 0.00 55.06 54.64 1zib s HIS 40 Cb 0.00 -1.40 0.00 0.00 1.11 0.00 0.00 32.58 32.29 1zib s HIS 40 CO 0.00 0.49 0.21 0.27 -0.85 0.00 0.00 174.74 174.86 1zib n ASN 41 N -1.05 -0.58 -3.86 1.40 6.94 -1.26 -1.97 115.26 114.87 1zib n ASN 41 Ca -0.05 -1.77 -0.13 0.00 -0.02 0.00 0.00 54.58 52.60 1zib n ASN 41 Cb 0.59 1.08 -0.15 0.00 -2.36 0.00 0.00 39.78 38.95 1zib n ASN 41 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 1zib s VAL 42 N -2.59 0.05 -0.03 3.53 0.11 -1.26 -4.20 120.40 116.01 1zib s VAL 42 Ca 0.12 0.02 -0.09 0.00 -2.93 0.00 0.00 61.98 59.09 1zib s VAL 42 Cb -0.00 -0.08 0.01 0.00 -1.53 0.00 0.00 36.38 34.78 1zib s VAL 42 CO 0.08 0.04 0.21 -0.70 -3.33 0.00 0.00 175.10 171.41 1zib s GLU 43 N 0.26 0.45 0.40 1.54 2.12 0.16 -1.00 118.70 122.63 1zib s GLU 43 Ca -0.02 -0.08 -0.24 0.00 0.36 0.00 0.00 54.97 54.98 1zib s GLU 43 Cb -0.04 0.20 -0.09 0.00 0.26 0.00 0.00 34.13 34.46 1zib s GLU 43 CO -0.01 -0.10 1.07 0.95 -0.54 0.00 0.00 175.26 176.64 1zib s THR 44 N -0.81 3.60 0.03 -1.70 -4.23 -0.44 -0.25 115.64 111.83 1zib s THR 44 Ca -0.09 1.24 -0.26 0.00 -1.18 0.00 0.00 61.69 61.40 1zib s THR 44 Cb -0.05 -3.65 -0.05 0.00 1.34 0.00 0.00 72.50 70.09 1zib s THR 44 CO 0.02 0.03 0.80 -0.63 -0.54 0.00 0.00 174.62 174.30 1zib s ILE 45 N -1.61 4.77 0.10 2.99 1.01 0.17 -4.80 121.20 123.84 1zib s ILE 45 Ca 0.58 1.70 -0.35 0.00 0.00 0.00 0.00 60.65 62.58 1zib s ILE 45 Cb -0.24 -4.15 -0.14 0.00 0.01 0.00 0.00 42.46 37.94 1zib s ILE 45 CO 0.30 0.31 1.55 0.29 0.00 0.00 0.00 174.94 177.40 1zib n LYS 46 N 3.10 1.85 -1.00 2.79 5.02 -1.26 -1.23 118.16 127.43 1zib n LYS 46 Ca -0.01 0.67 0.00 0.00 -2.02 0.00 0.00 58.31 56.95 1zib n LYS 46 Cb 0.50 -2.41 0.00 0.00 -0.02 0.00 0.00 35.03 33.11 1zib n LYS 46 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1zib n GLY 47 N 3.32 0.83 2.07 0.72 0.00 -1.26 -4.90 105.19 105.97 1zib n GLY 47 Ca 0.18 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.01 1zib n GLY 47 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1zib n MET 48 N -2.33 3.28 -4.32 1.61 2.81 -0.36 -4.60 117.12 113.20 1zib n MET 48 Ca 0.00 -4.04 -0.19 0.00 -1.81 0.00 0.00 57.70 51.66 1zib n MET 48 Cb 0.00 -2.15 -0.13 0.00 -0.71 0.00 0.00 33.22 30.22 1zib n MET 48 CO 0.00 0.00 0.00 0.96 1.51 0.00 0.00 175.97 178.44 1zib s ILE 49 N -4.42 0.92 0.88 2.02 -4.36 -1.26 0.27 121.20 115.24 1zib s ILE 49 Ca 0.47 -0.82 -0.11 0.00 -0.26 0.00 0.00 60.65 59.93 1zib s ILE 49 Cb 0.40 -0.83 0.12 0.00 1.25 0.00 0.00 42.46 43.40 1zib s ILE 49 CO 0.02 0.02 1.09 -2.84 0.24 0.00 0.00 174.94 173.47 1zib s PRO 50 N -0.91 1.39 0.22 0.37 0.02 -1.25 -4.95 135.00 129.89 1zib s PRO 50 Ca 0.01 0.92 -0.30 0.00 0.02 0.00 0.00 61.00 61.64 1zib s PRO 50 Cb -0.07 -1.82 -0.09 0.00 0.02 0.00 0.00 34.50 32.54 1zib s PRO 50 CO 0.01 -2.18 1.34 -0.51 -0.33 0.00 0.00 177.00 175.33 1zib s ASP 51 N -3.36 6.82 0.00 2.53 1.01 -1.26 -2.38 116.67 120.03 1zib s ASP 51 Ca 0.63 2.50 0.00 0.00 0.71 0.00 0.00 52.55 56.39 1zib s ASP 51 Cb -0.18 -2.62 0.00 0.00 1.01 0.00 0.00 42.92 41.13 1zib s ASP 51 CO 0.57 -0.57 0.00 0.61 0.21 0.00 0.00 175.17 175.99 1zib n GLY 52 N 2.19 3.28 3.81 0.21 0.00 -1.26 -4.89 105.19 108.52 1zib n GLY 52 Ca 0.06 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.75 1zib n GLY 52 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1zib s ALA 53 N -2.51 2.90 -0.10 4.61 0.00 -1.00 -4.85 121.76 120.81 1zib s ALA 53 Ca 0.00 0.42 -0.06 0.00 0.00 0.00 0.00 51.96 52.32 1zib s ALA 53 Cb 0.00 -3.20 -0.04 0.00 0.00 0.00 0.00 23.12 19.88 1zib s ALA 53 CO 0.00 -0.38 0.15 -1.21 0.00 0.00 0.00 175.76 174.32 1zib s GLU 54 N -3.66 3.45 0.75 0.00 0.41 -1.26 -4.93 118.70 113.46 1zib s GLU 54 Ca 0.64 -0.15 -0.11 0.00 -0.41 0.00 0.00 54.97 54.94 1zib s GLU 54 Cb -0.14 -3.18 0.04 0.00 -1.78 0.00 0.00 34.13 29.08 1zib s GLU 54 CO 0.26 0.76 1.08 0.00 -0.49 0.00 0.00 175.26 176.87 1zib s ALA 55 N -1.08 2.40 0.06 5.21 0.00 -1.26 -5.05 121.76 122.05 1zib s ALA 55 Ca 0.17 0.07 -0.05 0.00 0.00 0.00 0.00 51.96 52.15 1zib s ALA 55 Cb -0.12 -3.19 -0.02 0.00 0.00 0.00 0.00 23.12 19.79 1zib s ALA 55 CO 0.06 -1.55 0.09 -0.59 0.00 0.00 0.00 175.76 173.77 1zib s PHE 56 N -3.02 0.30 -0.22 0.00 -0.12 -1.26 -5.00 117.98 108.66 1zib s PHE 56 Ca 0.60 -0.75 -0.06 0.00 -0.05 0.00 0.00 56.93 56.67 1zib s PHE 56 Cb -0.15 -0.20 0.11 0.00 -0.63 0.00 0.00 43.02 42.15 1zib s PHE 56 CO 0.55 -0.45 0.44 0.21 -0.05 0.00 0.00 175.22 175.93 1zib s LYS 57 N -3.62 0.36 0.55 1.99 2.20 -1.26 -1.33 119.74 118.64 1zib s LYS 57 Ca 0.04 0.95 -0.06 0.00 -0.36 0.00 0.00 55.97 56.54 1zib s LYS 57 Cb 0.05 0.20 -0.01 0.00 -1.51 0.00 0.00 37.83 36.56 1zib s LYS 57 CO -0.09 -0.36 0.86 -1.54 -0.36 0.00 0.00 175.35 173.86 1zib s SER 58 N 2.64 5.83 0.41 1.43 1.04 -0.17 -5.00 113.70 119.87 1zib s SER 58 Ca 0.03 0.79 -0.17 0.00 0.48 0.00 0.00 55.95 57.07 1zib s SER 58 Cb -0.13 -1.90 -0.09 0.00 0.10 0.00 0.00 66.02 64.00 1zib s SER 58 CO -0.14 -0.89 0.87 -0.54 0.98 0.00 0.00 173.24 173.51 1zib s LYS 59 N -4.91 4.07 0.34 4.02 -0.14 -1.26 -4.56 119.74 117.30 1zib s LYS 59 Ca 0.52 0.89 -0.29 0.00 -1.36 0.00 0.00 55.97 55.73 1zib s LYS 59 Cb -0.10 -2.27 -0.12 0.00 -1.68 0.00 0.00 37.83 33.66 1zib s LYS 59 CO 0.45 -0.01 1.49 -0.89 -0.76 0.00 0.00 175.35 175.63 1zib n ILE 60 N -0.77 1.60 -0.96 2.17 2.08 -1.26 -2.63 119.36 119.59 1zib n ILE 60 Ca 0.05 -0.40 0.00 0.00 0.56 0.00 0.00 62.75 62.96 1zib n ILE 60 Cb 0.54 -1.89 0.00 0.00 -0.75 0.00 0.00 39.64 37.54 1zib n ILE 60 CO 0.00 0.00 0.00 0.59 0.56 0.00 0.00 176.55 177.70 1zib n ASN 61 N 1.19 -0.24 -4.83 4.38 3.02 -0.83 -5.00 115.26 112.95 1zib n ASN 61 Ca 0.05 0.00 -0.38 0.00 -0.03 0.00 0.00 54.58 54.22 1zib n ASN 61 Cb 0.37 -0.27 -0.06 0.00 -0.61 0.00 0.00 39.78 39.21 1zib n ASN 61 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 1zib s GLU 62 N -0.10 4.07 -0.27 3.52 2.12 -1.08 -4.82 118.70 122.14 1zib s GLU 62 Ca 0.00 0.59 -0.29 0.00 0.36 0.00 0.00 54.97 55.63 1zib s GLU 62 Cb 0.00 -3.16 -0.00 0.00 0.26 0.00 0.00 34.13 31.23 1zib s GLU 62 CO 0.00 0.62 1.31 -0.80 -0.54 0.00 0.00 175.26 175.84 1zib s ASN 63 N -1.25 6.71 -0.27 -1.70 0.02 -1.26 -4.49 114.94 112.69 1zib s ASN 63 Ca 0.30 1.31 -0.07 0.00 -1.02 0.00 0.00 52.86 53.38 1zib s ASN 63 Cb -0.18 -2.54 -0.01 0.00 0.02 0.00 0.00 41.25 38.54 1zib s ASN 63 CO 0.18 -1.03 0.08 -0.47 0.02 0.00 0.00 177.10 175.87 1zib s TYR 64 N 4.26 3.11 -0.22 2.20 5.04 0.11 -4.91 117.35 126.93 1zib s TYR 64 Ca 0.57 -0.67 -0.10 0.00 -2.44 0.00 0.00 57.07 54.42 1zib s TYR 64 Cb -0.18 -2.25 -0.05 0.00 0.35 0.00 0.00 41.96 39.83 1zib s TYR 64 CO 0.22 -0.46 0.15 0.21 -1.34 0.00 0.00 175.55 174.33 1zib s LYS 65 N 1.57 4.13 -0.03 4.97 2.20 -1.26 0.93 119.74 132.25 1zib s LYS 65 Ca 0.05 -0.23 0.03 0.00 -0.36 0.00 0.00 55.97 55.46 1zib s LYS 65 Cb -0.16 -3.48 -0.00 0.00 -1.51 0.00 0.00 37.83 32.67 1zib s LYS 65 CO 0.03 0.17 -0.12 0.54 -0.36 0.00 0.00 175.35 175.60 1zib s VAL 66 N 0.74 1.03 -0.29 4.02 0.11 0.13 -4.98 120.40 121.16 1zib s VAL 66 Ca 0.08 -0.51 -0.10 0.00 -2.93 0.00 0.00 61.98 58.51 1zib s VAL 66 Cb -0.12 -0.88 -0.03 0.00 -1.53 0.00 0.00 36.38 33.81 1zib s VAL 66 CO 0.02 0.30 0.17 -0.89 -3.33 0.00 0.00 175.10 171.37 1zib s THR 67 N -0.01 4.96 -0.22 5.04 2.01 -1.26 0.28 115.64 126.44 1zib s THR 67 Ca -0.01 -0.11 -0.24 0.00 0.31 0.00 0.00 61.69 61.64 1zib s THR 67 Cb -0.08 -3.43 -0.01 0.00 0.01 0.00 0.00 72.50 68.99 1zib s THR 67 CO 0.01 0.17 0.81 -0.36 -0.69 0.00 0.00 174.62 174.55 1zib s PHE 68 N 1.69 3.34 -0.15 4.92 0.08 -0.06 -4.97 117.98 122.82 1zib s PHE 68 Ca 0.06 1.13 -0.14 0.00 0.12 0.00 0.00 56.93 58.10 1zib s PHE 68 Cb -0.16 -3.02 -0.05 0.00 -0.57 0.00 0.00 43.02 39.22 1zib s PHE 68 CO 0.08 -0.35 -0.27 0.25 -0.10 0.00 0.00 175.22 174.83 1zib n THR 69 N 5.10 1.34 -2.40 0.64 -2.24 -1.26 -0.93 114.28 114.53 1zib n THR 69 Ca 0.05 0.19 -0.42 0.00 -2.27 0.00 0.00 64.05 61.60 1zib n THR 69 Cb 0.48 -2.28 -0.03 0.00 -2.10 0.00 0.00 70.33 66.40 1zib n THR 69 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1zib s ALA 70 N -2.87 3.41 0.67 6.98 0.00 -1.26 -4.56 121.76 124.13 1zib s ALA 70 Ca -0.23 0.89 -0.14 0.00 0.00 0.00 0.00 51.96 52.49 1zib s ALA 70 Cb 0.03 -3.43 0.00 0.00 0.00 0.00 0.00 23.12 19.72 1zib s ALA 70 CO 0.34 -0.41 1.09 -1.25 0.00 0.00 0.00 175.76 175.53 1zib s PRO 71 N 0.57 2.84 0.00 0.00 0.04 -1.26 -4.89 135.00 132.29 1zib s PRO 71 Ca 0.57 1.24 0.00 0.00 0.04 0.00 0.00 61.00 62.84 1zib s PRO 71 Cb -0.31 -1.97 0.00 0.00 0.04 0.00 0.00 34.50 32.27 1zib s PRO 71 CO 0.32 -1.20 0.00 0.41 0.04 0.00 0.00 177.00 176.57 1zib n GLY 72 N -0.98 0.80 3.69 0.56 0.00 -0.76 -4.76 105.19 103.73 1zib n GLY 72 Ca 0.09 -2.01 -0.35 0.00 0.00 0.00 0.00 46.02 43.75 1zib n GLY 72 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1zib s VAL 73 N -1.57 4.80 -0.20 1.61 1.01 -1.26 -0.82 120.40 123.98 1zib s VAL 73 Ca 0.00 -0.04 -0.02 0.00 0.00 0.00 0.00 61.98 61.91 1zib s VAL 73 Cb 0.00 -3.12 -0.00 0.00 0.00 0.00 0.00 36.38 33.26 1zib s VAL 73 CO 0.00 0.52 -0.09 -0.31 0.00 0.00 0.00 175.10 175.22 1zib s TYR 74 N -0.18 2.90 -0.16 5.22 1.51 -0.58 -3.79 117.35 122.27 1zib s TYR 74 Ca 0.07 -1.04 -0.16 0.00 -1.01 0.00 0.00 57.07 54.94 1zib s TYR 74 Cb -0.12 -2.02 -0.04 0.00 -0.11 0.00 0.00 41.96 39.66 1zib s TYR 74 CO 0.01 -0.55 0.38 0.20 -1.11 0.00 0.00 175.55 174.48 1zib s GLY 75 N 1.26 2.22 0.11 0.71 0.00 0.14 -1.83 107.32 109.94 1zib s GLY 75 Ca 0.03 -0.40 0.10 0.00 0.00 0.00 0.00 44.72 44.45 1zib s GLY 75 CO -0.04 0.65 -0.25 -1.34 0.00 0.00 0.00 173.10 172.13 1zib s VAL 76 N 0.78 2.06 0.15 1.40 -7.23 -0.86 0.46 120.40 117.16 1zib s VAL 76 Ca 0.20 -1.65 -0.04 0.00 -1.81 0.00 0.00 61.98 58.69 1zib s VAL 76 Cb -0.14 -1.83 -0.03 0.00 0.56 0.00 0.00 36.38 34.94 1zib s VAL 76 CO 0.07 0.06 0.14 -1.59 -0.31 0.00 0.00 175.10 173.47 1zib s LYS 77 N -1.93 1.05 -0.19 4.82 -2.85 0.66 -1.32 119.74 119.98 1zib s LYS 77 Ca 0.11 -1.39 -0.12 0.00 -1.00 0.00 0.00 55.97 53.57 1zib s LYS 77 Cb -0.10 0.29 -0.05 0.00 -2.06 0.00 0.00 37.83 35.91 1zib s LYS 77 CO 0.05 -0.33 0.24 0.00 0.10 0.00 0.00 175.35 175.40 1zib h THR 79 N 4.76 0.00 -0.50 0.00 2.02 -1.91 -0.43 112.91 116.85 1zib h THR 79 Ca -0.40 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 66.76 1zib h THR 79 Cb 1.16 0.00 -0.02 0.00 -1.74 0.00 0.00 68.15 67.55 1zib h THR 79 CO 0.74 0.00 0.24 1.55 0.37 0.00 0.00 175.52 178.43 1zib h PRO 80 N -0.65 0.70 -0.48 6.66 0.13 -1.95 -3.24 132.00 133.17 1zib h PRO 80 Ca -0.02 -0.08 0.00 0.00 -0.87 0.00 0.00 66.00 65.04 1zib h PRO 80 Cb 0.63 -0.14 0.00 0.00 0.13 0.00 0.00 31.00 31.63 1zib h PRO 80 CO -0.19 0.54 0.00 0.72 -0.23 0.00 0.00 178.00 178.84 1zib n HIS 81 N -4.39 1.37 -0.21 1.56 8.25 -1.17 -4.59 115.22 116.04 1zib n HIS 81 Ca 0.04 -0.71 -0.06 0.00 -0.26 0.00 0.00 57.72 56.73 1zib n HIS 81 Cb 0.12 -0.31 0.04 0.00 1.12 0.00 0.00 29.99 30.96 1zib n HIS 81 CO 0.00 0.00 0.00 -0.92 0.64 0.00 0.00 176.34 176.06 1zib h TYR 82 N 3.14 0.74 0.00 4.41 3.20 -1.10 -1.27 116.97 126.09 1zib h TYR 82 Ca 0.00 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 61.88 1zib h TYR 82 Cb 1.51 -0.25 -0.00 0.00 1.54 0.00 0.00 36.73 39.53 1zib h TYR 82 CO 0.71 0.45 -0.06 0.78 -1.64 0.00 0.00 178.16 178.41 1zib h GLY 83 N 0.79 0.00 -0.31 1.82 0.00 -1.86 0.14 103.07 103.65 1zib h GLY 83 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.56 1zib h GLY 83 CO -0.06 0.00 0.00 1.03 0.00 0.00 0.00 176.54 177.51 1zib n MET 84 N -3.85 1.54 -0.71 4.80 2.81 -0.89 -4.56 117.12 116.26 1zib n MET 84 Ca -0.03 -0.80 0.00 0.00 -1.81 0.00 0.00 57.70 55.06 1zib n MET 84 Cb 0.15 -1.43 0.00 0.00 -0.71 0.00 0.00 33.22 31.23 1zib n MET 84 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1zib n GLY 85 N 1.10 0.56 3.53 3.03 0.00 0.04 -4.79 105.19 108.66 1zib n GLY 85 Ca 0.18 -0.76 -0.42 0.00 0.00 0.00 0.00 46.02 45.02 1zib n GLY 85 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1zib s MET 86 N -1.39 3.36 0.04 1.61 -2.45 -0.53 -4.63 119.30 115.31 1zib s MET 86 Ca 0.00 -0.81 -0.06 0.00 -1.25 0.00 0.00 55.69 53.57 1zib s MET 86 Cb 0.00 -4.68 -0.01 0.00 1.25 0.00 0.00 34.83 31.39 1zib s MET 86 CO 0.00 -2.08 0.11 0.14 1.05 0.00 0.00 175.02 174.24 1zib s VAL 87 N 4.87 0.14 0.24 10.11 -7.23 -1.26 -1.66 120.40 125.60 1zib s VAL 87 Ca 0.37 -1.12 -0.10 0.00 -1.81 0.00 0.00 61.98 59.31 1zib s VAL 87 Cb -0.06 -0.98 -0.01 0.00 0.56 0.00 0.00 36.38 35.88 1zib s VAL 87 CO 0.03 -0.62 0.39 -0.83 -0.31 0.00 0.00 175.10 173.76 1zib s GLY 88 N -2.24 0.77 -0.03 2.32 0.00 -0.43 -4.37 107.32 103.33 1zib s GLY 88 Ca -0.03 -1.09 0.02 0.00 0.00 0.00 0.00 44.72 43.62 1zib s GLY 88 CO -0.05 -0.82 -0.08 0.14 0.00 0.00 0.00 173.10 172.29 1zib s VAL 89 N -4.05 0.72 -0.23 1.40 1.01 0.23 -2.03 120.40 117.45 1zib s VAL 89 Ca 0.27 -0.29 0.01 0.00 0.00 0.00 0.00 61.98 61.97 1zib s VAL 89 Cb 0.01 -0.66 0.04 0.00 0.00 0.00 0.00 36.38 35.77 1zib s VAL 89 CO 0.10 0.24 -0.13 -0.69 0.00 0.00 0.00 175.10 174.62 1zib s VAL 90 N 0.41 2.28 -0.21 2.92 1.01 -0.76 -1.40 120.40 124.64 1zib s VAL 90 Ca -0.06 -1.28 -0.13 0.00 0.00 0.00 0.00 61.98 60.50 1zib s VAL 90 Cb -0.10 -2.18 -0.04 0.00 0.00 0.00 0.00 36.38 34.05 1zib s VAL 90 CO 0.01 0.20 0.27 -1.58 0.00 0.00 0.00 175.10 174.00 1zib s GLN 91 N 1.21 4.14 -0.41 2.72 0.74 0.56 -1.53 119.66 127.10 1zib s GLN 91 Ca -0.02 -0.03 -0.09 0.00 0.05 0.00 0.00 55.36 55.26 1zib s GLN 91 Cb -0.17 -3.52 0.07 0.00 1.10 0.00 0.00 33.01 30.50 1zib s GLN 91 CO -0.08 0.05 0.25 0.08 -0.55 0.00 0.00 175.29 175.05 1zib s VAL 92 N 1.06 4.22 0.00 1.34 1.01 0.00 0.25 120.40 128.28 1zib s VAL 92 Ca 0.13 -1.36 0.00 0.00 0.00 0.00 0.00 61.98 60.75 1zib s VAL 92 Cb -0.14 -3.57 0.00 0.00 0.00 0.00 0.00 36.38 32.67 1zib s VAL 92 CO 0.05 -0.48 0.00 0.61 0.00 0.00 0.00 175.10 175.28 1zib n GLY 93 N 4.91 -1.05 3.88 4.51 0.00 0.45 -1.83 105.19 116.06 1zib n GLY 93 Ca -0.10 -1.62 -0.30 0.00 0.00 0.00 0.00 46.02 44.00 1zib n GLY 93 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1zib s ASP 94 N -1.80 6.51 -1.08 1.61 1.01 -1.26 -4.62 116.67 117.04 1zib s ASP 94 Ca 0.00 1.10 -0.19 0.00 0.71 0.00 0.00 52.55 54.17 1zib s ASP 94 Cb 0.00 -2.31 0.00 0.00 1.01 0.00 0.00 42.92 41.62 1zib s ASP 94 CO 0.00 -0.39 0.75 0.00 0.21 0.00 0.00 175.17 175.74 1zib n ALA 95 N -1.28 -2.59 -1.68 5.23 0.00 -1.26 -4.84 120.51 114.08 1zib n ALA 95 Ca 0.02 -0.28 -0.44 0.00 0.00 0.00 0.00 53.44 52.74 1zib n ALA 95 Cb 0.54 -3.30 -0.04 0.00 0.00 0.00 0.00 19.45 16.65 1zib n ALA 95 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1zib n PRO 96 N -3.94 2.61 0.16 0.00 -0.04 -1.26 -4.84 135.00 127.68 1zib n PRO 96 Ca -0.11 0.95 0.02 0.00 -0.04 0.00 0.00 63.50 64.32 1zib n PRO 96 Cb 0.59 -2.83 0.22 0.00 -0.04 0.00 0.00 33.50 31.44 1zib n PRO 96 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1zib h ALA 97 N 8.75 0.93 -0.51 0.55 0.00 -1.88 -3.00 119.26 124.08 1zib h ALA 97 Ca -0.47 -0.47 0.00 0.00 0.00 0.00 0.00 54.91 53.97 1zib h ALA 97 Cb 1.24 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.95 1zib h ALA 97 CO 0.94 0.65 0.00 0.27 0.00 0.00 0.00 179.25 181.11 1zib n ASN 98 N -3.60 3.36 -0.22 0.00 2.04 -1.26 -4.52 115.26 111.05 1zib n ASN 98 Ca -0.00 -2.19 -0.00 0.00 -0.44 0.00 0.00 54.58 51.95 1zib n ASN 98 Cb 0.59 -0.44 0.11 0.00 -2.53 0.00 0.00 39.78 37.51 1zib n ASN 98 CO 0.00 0.00 0.00 0.25 -0.44 0.00 0.00 177.26 177.07 1zib h LEU 99 N 3.13 0.36 -0.71 -4.53 7.12 -1.90 -1.81 115.31 116.97 1zib h LEU 99 Ca 0.00 0.06 -0.13 0.00 0.13 0.00 0.00 57.88 57.94 1zib h LEU 99 Cb 0.97 0.00 -0.01 0.00 -0.53 0.00 0.00 40.66 41.09 1zib h LEU 99 CO 0.10 0.22 -0.38 -0.33 -0.13 0.00 0.00 178.44 177.91 1zib h GLU 100 N 0.52 0.54 -0.21 1.25 3.07 -1.85 -3.14 114.58 114.77 1zib h GLU 100 Ca 0.31 -0.27 -0.12 0.00 -0.50 0.00 0.00 59.36 58.78 1zib h GLU 100 Cb 0.33 -0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.23 1zib h GLU 100 CO -0.26 0.84 -0.39 0.00 -1.40 0.00 0.00 179.01 177.80 1zib h ALA 101 N 1.13 0.94 0.00 3.43 0.00 -1.77 -3.02 119.26 119.97 1zib h ALA 101 Ca 0.04 -0.42 -0.08 0.00 0.00 0.00 0.00 54.91 54.45 1zib h ALA 101 Cb 0.87 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.54 1zib h ALA 101 CO 0.07 0.62 -0.39 -0.39 0.00 0.00 0.00 179.25 179.17 1zib h VAL 102 N 0.39 0.91 -0.01 0.00 -1.51 -1.30 -2.92 116.25 111.81 1zib h VAL 102 Ca 0.04 -1.56 -0.08 0.00 -1.23 0.00 0.00 66.70 63.87 1zib h VAL 102 Cb 0.86 1.95 -0.01 0.00 -2.13 0.00 0.00 31.29 31.95 1zib h VAL 102 CO 0.07 0.38 -0.36 0.11 -1.23 0.00 0.00 177.57 176.54 1zib h LYS 103 N 0.00 0.03 0.00 5.19 1.57 -1.49 -2.64 116.57 119.23 1zib h LYS 103 Ca -0.00 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 1zib h LYS 103 Cb 0.91 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.22 1zib h LYS 103 CO 0.05 0.39 -0.63 0.41 -0.57 0.00 0.00 179.45 179.10 1zib n GLY 104 N -0.46 -1.32 3.76 3.86 0.00 -1.18 -4.93 105.19 104.93 1zib n GLY 104 Ca -0.02 -0.31 -0.39 0.00 0.00 0.00 0.00 46.02 45.30 1zib n GLY 104 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1zib s ALA 105 N -3.10 3.17 -0.10 4.61 0.00 -1.00 -4.99 121.76 120.36 1zib s ALA 105 Ca 0.08 1.38 -0.22 0.00 0.00 0.00 0.00 51.96 53.20 1zib s ALA 105 Cb 0.15 -3.56 -0.04 0.00 0.00 0.00 0.00 23.12 19.68 1zib s ALA 105 CO 0.72 -1.12 0.64 0.15 0.00 0.00 0.00 175.76 176.15 1zib s LYS 106 N -2.48 4.38 0.13 0.00 -0.14 -1.26 -5.07 119.74 115.31 1zib s LYS 106 Ca 0.62 0.75 0.02 0.00 -1.36 0.00 0.00 55.97 55.99 1zib s LYS 106 Cb -0.41 -3.46 -0.04 0.00 -1.68 0.00 0.00 37.83 32.23 1zib s LYS 106 CO 0.53 0.04 -0.02 -0.80 -0.76 0.00 0.00 175.35 174.33 1zib s ASN 107 N 0.81 1.10 0.62 2.83 0.01 -1.26 -5.06 114.94 113.99 1zib s ASN 107 Ca 0.34 -1.10 -0.18 0.00 -0.71 0.00 0.00 52.86 51.21 1zib s ASN 107 Cb -0.17 0.12 -0.04 0.00 0.41 0.00 0.00 41.25 41.58 1zib s ASN 107 CO 0.15 -0.53 1.03 -0.81 -1.51 0.00 0.00 177.10 175.43 1zib n PRO 108 N -0.14 0.92 -0.32 -0.60 -0.04 -1.26 -4.56 135.00 129.00 1zib n PRO 108 Ca -0.09 0.36 0.04 0.00 -0.04 0.00 0.00 63.50 63.77 1zib n PRO 108 Cb 0.62 -2.25 0.12 0.00 -0.04 0.00 0.00 33.50 31.95 1zib n PRO 108 CO 0.00 0.00 0.00 -0.22 -0.04 0.00 0.00 175.50 175.24 1zib h LYS 109 N 0.45 -0.00 -0.21 0.54 1.63 -1.96 0.69 116.57 117.71 1zib h LYS 109 Ca -0.49 0.00 -0.11 0.00 -0.85 0.00 0.00 60.65 59.20 1zib h LYS 109 Cb 1.36 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 32.98 1zib h LYS 109 CO 0.51 -0.00 -0.34 0.87 -3.45 0.00 0.00 179.45 177.04 1zib h LYS 110 N -0.00 0.43 -0.29 1.90 1.57 -1.91 -1.21 116.57 117.07 1zib h LYS 110 Ca 0.43 -0.19 -0.07 0.00 -1.87 0.00 0.00 60.65 58.94 1zib h LYS 110 Cb 0.65 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.94 1zib h LYS 110 CO -0.92 0.72 -0.10 0.00 -0.57 0.00 0.00 179.45 178.58 1zib h ALA 111 N 1.27 0.40 -0.81 3.86 0.00 -1.62 -2.86 119.26 119.50 1zib h ALA 111 Ca 0.04 -0.30 0.02 0.00 0.00 0.00 0.00 54.91 54.67 1zib h ALA 111 Cb 0.77 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.42 1zib h ALA 111 CO 0.06 0.25 0.53 0.37 0.00 0.00 0.00 179.25 180.46 1zib h GLN 112 N 0.33 1.03 -0.63 0.00 5.75 -0.29 -1.12 115.11 120.18 1zib h GLN 112 Ca 0.07 -0.06 0.05 0.00 -0.15 0.00 0.00 58.65 58.55 1zib h GLN 112 Cb 0.60 -0.23 -0.05 0.00 1.07 0.00 0.00 27.48 28.87 1zib h GLN 112 CO 0.03 0.68 0.35 0.93 -2.65 0.00 0.00 178.83 178.18 1zib h GLU 113 N 1.06 0.65 -0.05 1.69 5.08 -1.22 -1.04 114.58 120.75 1zib h GLU 113 Ca 0.31 -0.04 -0.21 0.00 -1.00 0.00 0.00 59.36 58.42 1zib h GLU 113 Cb -0.07 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.03 1zib h GLU 113 CO -0.08 0.43 -0.83 0.00 -1.00 0.00 0.00 179.01 177.53 1zib h ARG 114 N 0.67 0.45 -0.33 2.33 3.08 -1.27 -2.87 114.38 116.43 1zib h ARG 114 Ca 0.27 -0.42 -0.12 0.00 0.07 0.00 0.00 59.98 59.79 1zib h ARG 114 Cb 0.13 0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.27 1zib h ARG 114 CO -0.16 1.06 -0.28 -0.07 -1.07 0.00 0.00 179.97 179.46 1zib h LEU 115 N 0.29 0.70 -0.58 3.04 3.38 -1.05 -0.87 115.31 120.22 1zib h LEU 115 Ca -0.05 -0.27 -0.12 0.00 0.09 0.00 0.00 57.88 57.53 1zib h LEU 115 Cb 1.43 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.98 1zib h LEU 115 CO 0.15 0.95 -0.19 0.44 0.09 0.00 0.00 178.44 179.87 1zib h ASP 116 N 0.59 0.94 -0.15 -0.43 3.32 -1.23 -0.19 116.42 119.28 1zib h ASP 116 Ca 0.07 -0.34 -0.01 0.00 0.02 0.00 0.00 57.03 56.78 1zib h ASP 116 Cb 0.77 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 40.06 1zib h ASP 116 CO 0.06 1.11 0.07 0.00 -1.72 0.00 0.00 179.24 178.76 1zib h ALA 117 N 0.97 0.19 -0.83 3.45 0.00 -1.41 -2.11 119.26 119.52 1zib h ALA 117 Ca 0.11 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 1zib h ALA 117 Cb 0.74 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.43 1zib h ALA 117 CO 0.06 -0.25 0.43 0.00 0.00 0.00 0.00 179.25 179.49 1zib h ALA 118 N 0.94 1.19 -0.61 0.00 0.00 -0.94 -1.76 119.26 118.08 1zib h ALA 118 Ca 0.05 -0.14 -0.09 0.00 0.00 0.00 0.00 54.91 54.73 1zib h ALA 118 Cb 0.12 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 1zib h ALA 118 CO -0.01 0.64 0.04 -0.07 0.00 0.00 0.00 179.25 179.85 1zib h LEU 119 N 1.17 1.01 -0.78 0.00 3.38 -0.98 -2.95 115.31 116.17 1zib h LEU 119 Ca 0.29 -0.27 -0.05 0.00 0.09 0.00 0.00 57.88 57.95 1zib h LEU 119 Cb 0.07 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.51 1zib h LEU 119 CO -0.04 1.04 0.30 0.00 0.09 0.00 0.00 178.44 179.84 1zib h ALA 120 N 1.06 1.02 0.00 1.53 0.00 -1.09 -2.23 119.26 119.55 1zib h ALA 120 Ca 0.18 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1zib h ALA 120 Cb 0.50 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.99 1zib h ALA 120 CO 0.02 0.65 0.00 0.00 0.00 0.00 0.00 179.25 179.92 1zib h ALA 121 N 1.16 1.00 -0.00 0.00 0.00 -1.15 -0.90 119.26 119.37 1zib h ALA 121 Ca 0.26 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.17 1zib h ALA 121 Cb 0.23 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1zib h ALA 121 CO -0.02 0.00 -0.19 1.28 0.00 0.00 0.00 179.25 180.32 1zib n LEU 122 N -2.71 0.36 0.00 0.00 4.77 -0.99 -4.89 117.00 113.53 1zib n LEU 122 Ca -0.00 0.14 0.00 0.00 -0.03 0.00 0.00 56.01 56.12 1zib n LEU 122 Cb 0.17 -0.29 0.00 0.00 -2.33 0.00 0.00 43.42 40.97 1zib n LEU 122 CO 0.20 0.08 0.00 0.61 -1.33 0.00 0.00 177.39 176.94 1zib n GLY 123 N 1.41 0.75 0.68 -0.72 0.00 -0.34 -5.13 105.19 101.83 1zib n GLY 123 Ca 0.10 -0.66 0.09 0.00 0.00 0.00 0.00 46.02 45.55 1zib n GLY 123 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02