#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dzk s GLU 11 N 0.00 3.71 0.23 -4.13 2.56 -1.26 -4.95 118.70 114.87 1dzk s GLU 11 Ca 0.00 -0.50 0.23 0.00 0.00 0.00 0.00 54.97 54.70 1dzk s GLU 11 Cb 0.00 -2.96 0.18 0.00 2.00 0.00 0.00 34.13 33.36 1dzk s GLU 11 CO 0.00 0.24 1.25 -0.07 -0.56 0.00 0.00 175.26 176.13 1dzk h LEU 12 N 6.71 0.00 -9.90 2.70 4.07 -1.97 -3.47 115.31 113.45 1dzk h LEU 12 Ca -0.32 -0.05 -0.47 0.00 0.08 0.00 0.00 57.88 57.12 1dzk h LEU 12 Cb 1.19 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 42.91 1dzk h LEU 12 CO 0.64 0.02 0.34 -0.44 -1.08 0.00 0.00 178.44 177.92 1dzk s SER 13 N -5.24 7.30 0.00 -0.43 0.01 -1.26 -4.88 113.70 109.20 1dzk s SER 13 Ca 0.03 1.82 0.00 0.00 1.31 0.00 0.00 55.95 59.11 1dzk s SER 13 Cb 0.10 -2.57 0.00 0.00 0.21 0.00 0.00 66.02 63.75 1dzk s SER 13 CO 0.74 -0.09 0.00 0.61 0.41 0.00 0.00 173.24 174.91 1dzk n GLY 14 N 0.46 0.78 3.71 3.44 0.00 -0.00 -5.01 105.19 108.57 1dzk n GLY 14 Ca 0.02 -1.75 -0.42 0.00 0.00 0.00 0.00 46.02 43.88 1dzk n GLY 14 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1dzk s LYS 15 N -2.00 4.46 -0.08 1.61 2.20 -1.26 -1.68 119.74 122.99 1dzk s LYS 15 Ca 0.00 1.71 -0.03 0.00 -0.36 0.00 0.00 55.97 57.28 1dzk s LYS 15 Cb 0.00 -3.36 0.04 0.00 -1.51 0.00 0.00 37.83 33.00 1dzk s LYS 15 CO 0.00 -0.20 0.17 -1.58 -0.36 0.00 0.00 175.35 173.38 1dzk s TRP 16 N 0.96 -0.21 -0.06 4.03 0.52 -0.79 -4.62 118.94 118.77 1dzk s TRP 16 Ca 0.57 0.59 0.05 0.00 0.02 0.00 0.00 56.10 57.33 1dzk s TRP 16 Cb -0.28 -0.10 -0.02 0.00 -1.15 0.00 0.00 33.47 31.93 1dzk s TRP 16 CO 0.29 -0.21 -0.21 0.42 0.02 0.00 0.00 176.95 177.26 1dzk s ILE 17 N 1.50 2.42 0.10 2.03 -1.09 0.91 -1.86 121.20 125.21 1dzk s ILE 17 Ca -0.06 -0.94 -0.30 0.00 -2.23 0.00 0.00 60.65 57.12 1dzk s ILE 17 Cb -0.11 -1.91 -0.06 0.00 -1.58 0.00 0.00 42.46 38.79 1dzk s ILE 17 CO -0.07 0.57 1.10 -0.89 -1.23 0.00 0.00 174.94 174.42 1dzk s THR 18 N -0.28 4.18 -0.14 2.92 2.01 -1.25 -0.75 115.64 122.32 1dzk s THR 18 Ca 0.01 1.70 0.01 0.00 0.31 0.00 0.00 61.69 63.71 1dzk s THR 18 Cb -0.13 -4.08 -0.09 0.00 0.01 0.00 0.00 72.50 68.20 1dzk s THR 18 CO 0.03 0.20 -0.13 -1.20 -0.69 0.00 0.00 174.62 172.83 1dzk n SER 19 N 3.24 2.87 -3.87 3.53 7.64 -0.08 -3.97 113.62 122.97 1dzk n SER 19 Ca 0.05 -0.07 -0.11 0.00 1.01 0.00 0.00 58.87 59.75 1dzk n SER 19 Cb 0.47 -0.23 -0.10 0.00 -1.01 0.00 0.00 64.21 63.35 1dzk n SER 19 CO 0.00 0.00 0.00 -0.31 -3.01 0.00 0.00 175.04 171.72 1dzk s TYR 20 N -2.29 0.05 -0.00 1.43 1.51 -1.21 -0.62 117.35 116.22 1dzk s TYR 20 Ca -0.19 -0.16 0.01 0.00 -1.01 0.00 0.00 57.07 55.72 1dzk s TYR 20 Cb 0.05 -0.05 -0.00 0.00 -0.11 0.00 0.00 41.96 41.84 1dzk s TYR 20 CO 0.33 -0.29 -0.03 0.42 -1.11 0.00 0.00 175.55 174.87 1dzk s ILE 21 N -1.46 0.23 0.08 2.71 1.01 -0.93 -1.15 121.20 121.69 1dzk s ILE 21 Ca -0.14 -0.16 0.10 0.00 0.00 0.00 0.00 60.65 60.44 1dzk s ILE 21 Cb -0.07 -0.21 -0.03 0.00 0.01 0.00 0.00 42.46 42.15 1dzk s ILE 21 CO 0.01 0.04 -0.25 -0.83 0.00 0.00 0.00 174.94 173.91 1dzk s GLY 22 N -0.13 1.41 -0.07 6.18 0.00 -0.03 -0.77 107.32 113.91 1dzk s GLY 22 Ca 0.00 -1.31 -0.08 0.00 0.00 0.00 0.00 44.72 43.33 1dzk s GLY 22 CO -0.00 -1.25 0.22 -0.45 0.00 0.00 0.00 173.10 171.61 1dzk s SER 23 N -1.62 -0.19 0.37 1.64 0.15 -1.06 -1.24 113.70 111.76 1dzk s SER 23 Ca 0.11 0.32 0.27 0.00 0.70 0.00 0.00 55.95 57.35 1dzk s SER 23 Cb -0.10 0.41 0.86 0.00 -1.71 0.00 0.00 66.02 65.48 1dzk s SER 23 CO 0.04 -0.15 1.77 0.77 1.20 0.00 0.00 173.24 176.87 1dzk h SER 24 N 5.41 0.00 -3.63 5.45 4.64 -1.54 -3.40 113.55 120.47 1dzk h SER 24 Ca -0.27 0.00 -0.62 0.00 -0.47 0.00 0.00 61.79 60.43 1dzk h SER 24 Cb 1.19 0.00 -0.38 0.00 -0.31 0.00 0.00 62.40 62.90 1dzk h SER 24 CO 0.38 0.00 -0.78 -0.62 -0.87 0.00 0.00 176.83 174.94 1dzk s ASP 25 N -5.24 4.03 0.61 4.97 -1.08 -1.26 -4.98 116.67 113.71 1dzk s ASP 25 Ca 0.06 -1.34 0.35 0.00 -0.52 0.00 0.00 52.55 51.09 1dzk s ASP 25 Cb 0.09 -1.24 1.98 0.00 -1.46 0.00 0.00 42.92 42.28 1dzk s ASP 25 CO 0.56 -0.26 2.27 -0.07 0.52 0.00 0.00 175.17 178.19 1dzk h LEU 26 N 7.91 0.00 -2.04 -1.34 3.38 -1.96 -2.13 115.31 119.12 1dzk h LEU 26 Ca -0.16 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.81 1dzk h LEU 26 Cb 1.06 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.81 1dzk h LEU 26 CO 0.43 0.02 -0.01 -0.08 0.09 0.00 0.00 178.44 178.89 1dzk h GLU 27 N 0.00 0.00 -0.00 1.13 4.22 -1.97 -2.92 114.58 115.04 1dzk h GLU 27 Ca -0.00 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.44 1dzk h GLU 27 Cb 0.06 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.31 1dzk h GLU 27 CO 0.00 0.01 -0.42 1.63 -2.18 0.00 0.00 179.01 178.06 1dzk n LYS 28 N -3.13 0.19 0.00 1.92 4.76 -0.80 -4.53 118.16 116.57 1dzk n LYS 28 Ca -0.01 -0.11 0.00 0.00 -2.87 0.00 0.00 58.31 55.33 1dzk n LYS 28 Cb 0.22 -1.50 0.00 0.00 -1.84 0.00 0.00 35.03 31.91 1dzk n LYS 28 CO 0.00 0.00 0.00 0.44 -1.37 0.00 0.00 177.40 176.47 1dzk n ILE 29 N -1.31 0.71 -0.98 -0.18 -5.35 -1.10 -1.07 119.36 110.07 1dzk n ILE 29 Ca 0.07 -0.72 0.00 0.00 -0.27 0.00 0.00 62.75 61.83 1dzk n ILE 29 Cb 0.34 0.65 0.00 0.00 -1.74 0.00 0.00 39.64 38.89 1dzk n ILE 29 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1dzk n GLY 30 N -0.35 0.31 3.66 3.28 0.00 -1.25 -4.52 105.19 106.33 1dzk n GLY 30 Ca 0.00 -1.81 -0.50 0.00 0.00 0.00 0.00 46.02 43.72 1dzk n GLY 30 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1dzk n GLU 31 N -0.15 1.82 -1.41 1.61 4.71 -1.26 -1.60 120.64 124.36 1dzk n GLU 31 Ca 0.00 0.66 -0.14 0.00 -0.01 0.00 0.00 57.16 57.67 1dzk n GLU 31 Cb 0.00 -2.42 -0.06 0.00 -1.01 0.00 0.00 31.44 27.95 1dzk n GLU 31 CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 177.13 177.31 1dzk n ASN 32 N 4.54 -5.09 -4.89 1.62 5.03 -1.26 -4.99 115.26 110.22 1dzk n ASN 32 Ca 0.20 0.35 -0.29 0.00 0.87 0.00 0.00 54.58 55.71 1dzk n ASN 32 Cb 0.25 -3.84 -0.01 0.00 -1.02 0.00 0.00 39.78 35.16 1dzk n ASN 32 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1dzk s ALA 33 N -2.40 3.31 0.49 5.41 0.00 -0.63 -4.73 121.76 123.21 1dzk s ALA 33 Ca 0.00 -0.30 0.16 0.00 0.00 0.00 0.00 51.96 51.82 1dzk s ALA 33 Cb 0.00 -2.74 1.18 0.00 0.00 0.00 0.00 23.12 21.56 1dzk s ALA 33 CO 0.00 -0.31 2.08 -1.00 0.00 0.00 0.00 175.76 176.53 1dzk h PRO 34 N 0.45 0.00 -0.61 0.00 0.13 -1.87 -2.94 132.00 127.16 1dzk h PRO 34 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1dzk h PRO 34 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 1dzk h PRO 34 CO 0.62 0.09 0.00 1.19 -0.23 0.00 0.00 178.00 179.67 1dzk n PHE 35 N -4.38 1.78 -2.96 1.56 3.72 -0.24 -4.54 117.46 112.40 1dzk n PHE 35 Ca -0.03 -0.68 -0.44 0.00 -0.05 0.00 0.00 57.45 56.26 1dzk n PHE 35 Cb 0.16 -0.38 -0.02 0.00 -0.94 0.00 0.00 39.48 38.31 1dzk n PHE 35 CO 0.00 0.00 0.00 -1.14 -0.05 0.00 0.00 176.76 175.57 1dzk s GLN 36 N -2.33 3.78 -0.24 -1.08 0.74 -1.11 -4.80 119.66 114.62 1dzk s GLN 36 Ca 0.53 -2.12 -0.10 0.00 0.05 0.00 0.00 55.36 53.72 1dzk s GLN 36 Cb 0.38 -4.93 -0.05 0.00 1.10 0.00 0.00 33.01 29.50 1dzk s GLN 36 CO 0.20 -1.73 0.15 0.08 -0.55 0.00 0.00 175.29 173.44 1dzk s VAL 37 N 2.07 5.23 -0.78 1.34 1.01 -1.26 -4.51 120.40 123.51 1dzk s VAL 37 Ca 0.35 0.13 -0.10 0.00 0.00 0.00 0.00 61.98 62.36 1dzk s VAL 37 Cb -0.04 -3.44 0.20 0.00 0.00 0.00 0.00 36.38 33.10 1dzk s VAL 37 CO -0.06 0.35 0.68 -0.36 0.00 0.00 0.00 175.10 175.71 1dzk s PHE 38 N 1.09 3.67 0.68 5.22 0.08 0.06 -4.71 117.98 124.06 1dzk s PHE 38 Ca 0.07 -2.25 -0.16 0.00 0.12 0.00 0.00 56.93 54.71 1dzk s PHE 38 Cb -0.14 -3.62 0.01 0.00 -0.57 0.00 0.00 43.02 38.70 1dzk s PHE 38 CO 0.05 -0.94 1.18 -1.64 -0.10 0.00 0.00 175.22 173.77 1dzk s MET 39 N 0.02 2.50 0.00 0.44 -1.94 -1.26 -0.86 119.30 118.19 1dzk s MET 39 Ca 0.18 1.69 0.00 0.00 -1.71 0.00 0.00 55.69 55.85 1dzk s MET 39 Cb -0.13 -1.88 0.00 0.00 2.01 0.00 0.00 34.83 34.83 1dzk s MET 39 CO -0.07 -1.54 0.00 0.54 -0.01 0.00 0.00 175.02 173.93 1dzk n ARG 40 N -2.37 0.00 -3.48 2.03 5.12 -0.15 -3.95 116.66 113.86 1dzk n ARG 40 Ca 0.13 0.00 -0.12 0.00 -1.93 0.00 0.00 57.85 55.93 1dzk n ARG 40 Cb 0.50 -0.77 -0.03 0.00 -1.16 0.00 0.00 32.46 31.00 1dzk n ARG 40 CO 0.00 0.00 0.00 -1.54 -1.93 0.00 0.00 177.63 174.16 1dzk s SER 41 N -3.65 -0.51 -0.02 0.55 1.04 -0.92 -1.88 113.70 108.31 1dzk s SER 41 Ca 0.00 0.20 0.00 0.00 0.48 0.00 0.00 55.95 56.63 1dzk s SER 41 Cb 0.00 0.49 0.03 0.00 0.10 0.00 0.00 66.02 66.64 1dzk s SER 41 CO 0.00 -0.72 0.02 -0.63 0.98 0.00 0.00 173.24 172.89 1dzk s ILE 42 N -2.71 0.01 -0.17 -1.02 1.01 -0.68 -1.52 121.20 116.12 1dzk s ILE 42 Ca -0.01 0.16 0.01 0.00 0.00 0.00 0.00 60.65 60.81 1dzk s ILE 42 Cb -0.01 -0.12 0.03 0.00 0.01 0.00 0.00 42.46 42.37 1dzk s ILE 42 CO -0.05 0.10 -0.15 -1.61 0.00 0.00 0.00 174.94 173.23 1dzk s GLU 43 N 0.95 2.41 -0.39 2.79 0.41 -0.00 -0.82 118.70 124.05 1dzk s GLU 43 Ca -0.08 -0.73 -0.17 0.00 -0.41 0.00 0.00 54.97 53.57 1dzk s GLU 43 Cb -0.12 -2.34 0.01 0.00 -1.78 0.00 0.00 34.13 29.90 1dzk s GLU 43 CO -0.02 -0.29 0.44 -0.06 -0.49 0.00 0.00 175.26 174.83 1dzk s PHE 44 N 1.40 3.18 -0.97 1.61 0.08 -1.26 -0.50 117.98 121.52 1dzk s PHE 44 Ca 0.03 -0.16 -0.09 0.00 0.12 0.00 0.00 56.93 56.82 1dzk s PHE 44 Cb -0.14 -2.85 0.25 0.00 -0.57 0.00 0.00 43.02 39.71 1dzk s PHE 44 CO -0.10 -0.60 0.93 0.34 -0.10 0.00 0.00 175.22 175.68 1dzk s ASP 45 N 1.79 6.86 0.48 1.36 -1.08 0.26 -4.91 116.67 121.43 1dzk s ASP 45 Ca 0.13 -3.31 0.23 0.00 -0.52 0.00 0.00 52.55 49.08 1dzk s ASP 45 Cb -0.16 -2.15 1.23 0.00 -1.46 0.00 0.00 42.92 40.38 1dzk s ASP 45 CO 0.13 -0.36 2.01 0.44 0.52 0.00 0.00 175.17 177.91 1dzk h ASP 46 N 6.93 0.00 -0.22 -0.34 3.32 -1.95 -0.50 116.42 123.66 1dzk h ASP 46 Ca 0.14 0.00 -0.11 0.00 0.02 0.00 0.00 57.03 57.09 1dzk h ASP 46 Cb 0.92 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.46 1dzk h ASP 46 CO 0.90 0.17 -0.23 0.50 -1.72 0.00 0.00 179.24 178.86 1dzk h LYS 47 N 0.00 0.68 -0.43 3.56 3.64 -1.94 -2.94 116.57 119.14 1dzk h LYS 47 Ca -0.00 -0.27 0.00 0.00 -1.27 0.00 0.00 60.65 59.11 1dzk h LYS 47 Cb 0.40 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.19 1dzk h LYS 47 CO 0.02 0.85 0.00 0.39 -2.27 0.00 0.00 179.45 178.44 1dzk n GLU 48 N -4.12 2.45 -3.74 1.90 -0.58 -1.07 -4.98 120.64 110.51 1dzk n GLU 48 Ca 0.00 -2.24 -0.22 0.00 -0.42 0.00 0.00 57.16 54.28 1dzk n GLU 48 Cb 0.42 -1.46 0.02 0.00 -0.57 0.00 0.00 31.44 29.86 1dzk n GLU 48 CO 0.00 0.00 0.00 0.43 -0.48 0.00 0.00 177.13 177.08 1dzk n SER 49 N 1.28 -1.28 -4.17 1.62 7.64 -0.31 -4.93 113.62 113.47 1dzk n SER 49 Ca 0.18 -0.86 -0.11 0.00 1.01 0.00 0.00 58.87 59.09 1dzk n SER 49 Cb 0.55 -3.87 -0.10 0.00 -1.01 0.00 0.00 64.21 59.78 1dzk n SER 49 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 1dzk s LYS 50 N -6.05 0.95 -0.01 1.43 1.02 -0.53 -1.03 119.74 115.53 1dzk s LYS 50 Ca 0.03 -1.45 0.02 0.00 0.02 0.00 0.00 55.97 54.59 1dzk s LYS 50 Cb -0.01 0.07 -0.00 0.00 -0.52 0.00 0.00 37.83 37.37 1dzk s LYS 50 CO 0.83 -0.20 -0.05 0.54 -0.92 0.00 0.00 175.35 175.54 1dzk s VAL 51 N -3.90 0.44 -0.18 3.17 0.11 -0.66 -0.58 120.40 118.81 1dzk s VAL 51 Ca 0.22 -0.23 -0.01 0.00 -2.93 0.00 0.00 61.98 59.03 1dzk s VAL 51 Cb 0.07 -0.38 -0.00 0.00 -1.53 0.00 0.00 36.38 34.53 1dzk s VAL 51 CO 0.01 0.13 -0.11 -0.31 -3.33 0.00 0.00 175.10 171.49 1dzk s TYR 52 N -0.06 2.85 -0.12 1.54 1.51 0.35 -0.62 117.35 122.80 1dzk s TYR 52 Ca 0.01 -0.99 0.02 0.00 -1.01 0.00 0.00 57.07 55.10 1dzk s TYR 52 Cb -0.03 -1.96 -0.00 0.00 -0.11 0.00 0.00 41.96 39.86 1dzk s TYR 52 CO -0.00 -0.48 -0.20 -0.51 -1.11 0.00 0.00 175.55 173.25 1dzk s LEU 53 N 1.00 2.31 -0.11 -1.29 1.43 -0.25 -0.82 118.68 120.96 1dzk s LEU 53 Ca -0.01 -0.49 0.02 0.00 -1.03 0.00 0.00 54.13 52.62 1dzk s LEU 53 Cb -0.15 -1.49 0.01 0.00 0.03 0.00 0.00 46.19 44.59 1dzk s LEU 53 CO -0.02 0.14 -0.17 0.21 0.23 0.00 0.00 176.35 176.74 1dzk s ASN 54 N 0.49 2.56 0.25 2.29 2.47 -0.58 -0.60 114.94 121.83 1dzk s ASN 54 Ca -0.13 -0.46 -0.19 0.00 0.42 0.00 0.00 52.86 52.50 1dzk s ASN 54 Cb -0.17 -1.16 0.02 0.00 -1.45 0.00 0.00 41.25 38.49 1dzk s ASN 54 CO 0.05 0.05 0.62 0.72 -3.72 0.00 0.00 177.10 174.82 1dzk s PHE 55 N 0.81 -0.09 0.17 0.43 -0.12 -0.65 -0.98 117.98 117.55 1dzk s PHE 55 Ca -0.10 -0.31 0.08 0.00 -0.05 0.00 0.00 56.93 56.55 1dzk s PHE 55 Cb -0.16 0.52 -0.04 0.00 -0.63 0.00 0.00 43.02 42.72 1dzk s PHE 55 CO 0.01 -1.09 -0.05 -0.06 -0.05 0.00 0.00 175.22 173.97 1dzk s PHE 56 N -3.92 2.74 0.25 3.49 0.40 -0.04 -0.62 117.98 120.28 1dzk s PHE 56 Ca 0.12 -0.18 -0.05 0.00 -0.60 0.00 0.00 56.93 56.23 1dzk s PHE 56 Cb -0.03 -1.34 -0.02 0.00 0.51 0.00 0.00 43.02 42.13 1dzk s PHE 56 CO 0.04 0.51 0.31 0.45 0.70 0.00 0.00 175.22 177.23 1dzk s SER 57 N -2.82 0.31 0.01 1.36 0.15 -0.40 -0.76 113.70 111.54 1dzk s SER 57 Ca 0.26 -1.28 0.06 0.00 0.70 0.00 0.00 55.95 55.69 1dzk s SER 57 Cb -0.09 0.51 -0.02 0.00 -1.71 0.00 0.00 66.02 64.71 1dzk s SER 57 CO 0.17 -1.03 -0.19 -0.54 1.20 0.00 0.00 173.24 172.84 1dzk s LYS 58 N -3.88 1.41 -0.03 5.44 1.02 -1.26 -0.76 119.74 121.68 1dzk s LYS 58 Ca 0.32 -0.76 0.01 0.00 0.02 0.00 0.00 55.97 55.56 1dzk s LYS 58 Cb 0.03 -1.43 0.01 0.00 -0.52 0.00 0.00 37.83 35.93 1dzk s LYS 58 CO 0.13 0.38 -0.04 -1.21 -0.92 0.00 0.00 175.35 173.69 1dzk s GLU 59 N -0.75 0.64 -1.89 1.68 2.02 -0.98 -4.28 118.70 115.14 1dzk s GLU 59 Ca 0.07 -0.12 0.00 0.00 0.02 0.00 0.00 54.97 54.94 1dzk s GLU 59 Cb -0.08 -0.66 0.00 0.00 0.10 0.00 0.00 34.13 33.49 1dzk s GLU 59 CO 0.00 -0.02 0.00 0.09 0.02 0.00 0.00 175.26 175.36 1dzk n ASN 60 N 3.68 -5.44 0.00 -0.19 3.02 -1.26 -1.23 115.26 113.84 1dzk n ASN 60 Ca -0.22 0.25 0.00 0.00 -0.03 0.00 0.00 54.58 54.58 1dzk n ASN 60 Cb 0.53 -4.68 0.00 0.00 -0.61 0.00 0.00 39.78 35.02 1dzk n ASN 60 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1dzk n GLY 61 N -0.68 0.53 3.59 7.41 0.00 -1.26 -5.02 105.19 109.76 1dzk n GLY 61 Ca -0.22 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.46 1dzk n GLY 61 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1dzk s ILE 62 N -2.35 3.87 0.28 -0.61 1.01 -0.37 -5.04 121.20 117.99 1dzk s ILE 62 Ca 0.00 -0.41 -0.29 0.00 0.00 0.00 0.00 60.65 59.95 1dzk s ILE 62 Cb 0.00 -2.61 -0.10 0.00 0.01 0.00 0.00 42.46 39.76 1dzk s ILE 62 CO 0.00 0.59 1.26 0.00 0.00 0.00 0.00 174.94 176.78 1dzk s GLU 64 N -1.15 0.76 -0.08 0.00 2.02 0.06 -4.96 118.70 115.34 1dzk s GLU 64 Ca 0.50 -0.48 -0.03 0.00 0.02 0.00 0.00 54.97 54.99 1dzk s GLU 64 Cb -0.37 -0.72 -0.03 0.00 0.10 0.00 0.00 34.13 33.10 1dzk s GLU 64 CO 0.45 0.19 0.03 -2.00 0.02 0.00 0.00 175.26 173.95 1dzk s GLU 65 N -0.59 3.06 0.01 1.61 2.12 -1.26 -1.28 118.70 122.38 1dzk s GLU 65 Ca 0.02 -0.37 0.05 0.00 0.36 0.00 0.00 54.97 55.03 1dzk s GLU 65 Cb -0.05 -2.87 -0.02 0.00 0.26 0.00 0.00 34.13 31.45 1dzk s GLU 65 CO 0.00 0.71 -0.16 -0.06 -0.54 0.00 0.00 175.26 175.21 1dzk s PHE 66 N -0.94 1.46 -0.26 5.30 0.40 0.21 -5.01 117.98 119.13 1dzk s PHE 66 Ca 0.15 -0.31 -0.01 0.00 -0.60 0.00 0.00 56.93 56.15 1dzk s PHE 66 Cb -0.11 -0.90 0.08 0.00 0.51 0.00 0.00 43.02 42.59 1dzk s PHE 66 CO 0.04 0.01 0.06 -1.12 0.70 0.00 0.00 175.22 174.91 1dzk s SER 67 N -0.73 3.57 0.17 1.36 0.01 -1.26 -1.64 113.70 115.17 1dzk s SER 67 Ca 0.05 -1.26 0.06 0.00 1.31 0.00 0.00 55.95 56.11 1dzk s SER 67 Cb -0.07 -0.78 -0.04 0.00 0.21 0.00 0.00 66.02 65.34 1dzk s SER 67 CO 0.00 -0.35 0.08 -0.76 0.41 0.00 0.00 173.24 172.62 1dzk s LEU 68 N 1.70 3.61 -0.16 2.44 1.43 0.24 -4.95 118.68 122.98 1dzk s LEU 68 Ca 0.04 -0.24 0.00 0.00 -1.03 0.00 0.00 54.13 52.91 1dzk s LEU 68 Cb -0.17 -2.23 0.03 0.00 0.03 0.00 0.00 46.19 43.84 1dzk s LEU 68 CO -0.17 0.08 -0.13 -0.63 0.23 0.00 0.00 176.35 175.73 1dzk s ILE 69 N -1.74 1.54 0.41 -0.59 1.01 -1.26 -1.09 121.20 119.48 1dzk s ILE 69 Ca 0.30 -0.68 0.08 0.00 0.00 0.00 0.00 60.65 60.34 1dzk s ILE 69 Cb -0.10 -1.49 -0.02 0.00 0.01 0.00 0.00 42.46 40.86 1dzk s ILE 69 CO 0.21 0.39 0.35 -0.83 0.00 0.00 0.00 174.94 175.07 1dzk s GLY 70 N 1.49 2.14 -0.05 6.18 0.00 0.20 -4.77 107.32 112.51 1dzk s GLY 70 Ca 0.04 -1.89 0.06 0.00 0.00 0.00 0.00 44.72 42.93 1dzk s GLY 70 CO -0.10 -1.71 -0.24 -0.51 0.00 0.00 0.00 173.10 170.53 1dzk s THR 71 N -2.47 2.13 0.18 0.90 -4.23 -0.07 -1.65 115.64 110.42 1dzk s THR 71 Ca 0.47 -1.05 -0.30 0.00 -1.18 0.00 0.00 61.69 59.63 1dzk s THR 71 Cb -0.03 -1.76 -0.08 0.00 1.34 0.00 0.00 72.50 71.97 1dzk s THR 71 CO 0.27 0.57 1.24 -0.75 -0.54 0.00 0.00 174.62 175.42 1dzk s LYS 72 N -0.33 4.45 0.22 3.99 2.20 -0.19 -1.19 119.74 128.88 1dzk s LYS 72 Ca 0.02 1.94 0.01 0.00 -0.36 0.00 0.00 55.97 57.57 1dzk s LYS 72 Cb -0.12 -3.23 -0.00 0.00 -1.51 0.00 0.00 37.83 32.96 1dzk s LYS 72 CO 0.02 -0.17 0.03 1.04 -0.36 0.00 0.00 175.35 175.91 1dzk n GLN 73 N 2.68 1.14 -1.68 4.03 1.13 0.63 -4.93 117.38 120.38 1dzk n GLN 73 Ca 0.05 -1.71 -0.37 0.00 -1.94 0.00 0.00 57.00 53.04 1dzk n GLN 73 Cb 0.44 0.65 0.06 0.00 0.11 0.00 0.00 30.24 31.50 1dzk n GLN 73 CO 0.00 0.00 0.00 0.39 -1.44 0.00 0.00 177.06 176.01 1dzk n GLU 74 N -0.53 1.06 -2.85 -1.09 -0.58 -1.26 -3.53 120.64 111.85 1dzk n GLU 74 Ca -0.07 0.41 -0.18 0.00 -0.42 0.00 0.00 57.16 56.90 1dzk n GLU 74 Cb 0.30 -2.37 0.03 0.00 -0.57 0.00 0.00 31.44 28.82 1dzk n GLU 74 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1dzk n GLY 75 N 1.08 -0.31 2.82 0.62 0.00 -1.26 -2.96 105.19 105.18 1dzk n GLY 75 Ca 0.15 -0.04 -0.22 0.00 0.00 0.00 0.00 46.02 45.91 1dzk n GLY 75 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1dzk n ASN 76 N -1.73 -6.05 -4.84 1.61 3.02 -1.24 -5.00 115.26 101.02 1dzk n ASN 76 Ca -0.10 -0.20 -0.22 0.00 -0.03 0.00 0.00 54.58 54.03 1dzk n ASN 76 Cb 0.60 -4.94 -0.04 0.00 -0.61 0.00 0.00 39.78 34.79 1dzk n ASN 76 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1dzk s THR 77 N -3.13 4.22 0.00 3.41 -4.23 -1.15 -4.45 115.64 110.31 1dzk s THR 77 Ca 0.21 -1.38 0.03 0.00 -1.18 0.00 0.00 61.69 59.37 1dzk s THR 77 Cb -0.09 -3.36 -0.01 0.00 1.34 0.00 0.00 72.50 70.38 1dzk s THR 77 CO 0.26 -0.30 -0.10 -0.31 -0.54 0.00 0.00 174.62 173.63 1dzk s TYR 78 N -2.18 0.88 -0.12 3.99 1.51 0.15 -0.27 117.35 121.32 1dzk s TYR 78 Ca 0.35 -0.21 -0.03 0.00 -1.01 0.00 0.00 57.07 56.17 1dzk s TYR 78 Cb -0.07 -0.55 -0.03 0.00 -0.11 0.00 0.00 41.96 41.19 1dzk s TYR 78 CO 0.26 -0.01 -0.02 -0.51 -1.11 0.00 0.00 175.55 174.15 1dzk s ASP 79 N -0.47 4.98 -0.15 2.29 1.11 -0.33 -1.02 116.67 123.08 1dzk s ASP 79 Ca 0.02 -0.01 -0.14 0.00 0.18 0.00 0.00 52.55 52.61 1dzk s ASP 79 Cb -0.05 -1.60 0.04 0.00 1.07 0.00 0.00 42.92 42.38 1dzk s ASP 79 CO -0.00 0.27 0.40 0.54 1.18 0.00 0.00 175.17 177.56 1dzk s VAL 80 N -0.22 -0.00 -0.12 -1.27 0.11 -0.77 -0.90 120.40 117.23 1dzk s VAL 80 Ca 0.05 0.00 -0.20 0.00 -2.93 0.00 0.00 61.98 58.90 1dzk s VAL 80 Cb -0.13 -0.56 -0.04 0.00 -1.53 0.00 0.00 36.38 34.13 1dzk s VAL 80 CO 0.02 0.00 0.56 0.20 -3.33 0.00 0.00 175.10 172.55 1dzk s ASN 81 N 0.22 6.74 -0.30 3.54 0.01 -1.26 -1.65 114.94 122.24 1dzk s ASN 81 Ca -0.00 0.89 -0.17 0.00 -0.71 0.00 0.00 52.86 52.87 1dzk s ASN 81 Cb -0.03 -2.33 0.18 0.00 0.41 0.00 0.00 41.25 39.49 1dzk s ASN 81 CO 0.01 -0.08 1.19 -0.47 -1.51 0.00 0.00 177.10 176.23 1dzk s TYR 82 N 0.94 -0.27 -1.51 2.20 5.04 -1.26 -4.95 117.35 117.55 1dzk s TYR 82 Ca 0.29 0.40 -0.10 0.00 -2.44 0.00 0.00 57.07 55.21 1dzk s TYR 82 Cb -0.16 0.14 0.07 0.00 0.35 0.00 0.00 41.96 42.36 1dzk s TYR 82 CO 0.12 -0.14 0.82 0.00 -1.34 0.00 0.00 175.55 175.02 1dzk n ALA 83 N 4.94 -1.51 0.00 3.97 0.00 -1.26 -4.48 120.51 122.16 1dzk n ALA 83 Ca -0.08 0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.40 1dzk n ALA 83 Cb 0.55 -3.45 0.00 0.00 0.00 0.00 0.00 19.45 16.55 1dzk n ALA 83 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1dzk n GLY 84 N -1.66 -0.10 3.68 0.00 0.00 -1.26 -4.42 105.19 101.43 1dzk n GLY 84 Ca -0.06 -2.06 -0.34 0.00 0.00 0.00 0.00 46.02 43.57 1dzk n GLY 84 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1dzk s ASN 85 N -4.00 5.16 0.03 1.61 0.01 -0.34 -4.52 114.94 112.89 1dzk s ASN 85 Ca 0.00 0.06 0.04 0.00 -0.71 0.00 0.00 52.86 52.25 1dzk s ASN 85 Cb 0.00 -1.39 -0.02 0.00 0.41 0.00 0.00 41.25 40.25 1dzk s ASN 85 CO 0.00 0.32 -0.12 0.20 -1.51 0.00 0.00 177.10 175.99 1dzk s ASN 86 N -1.25 1.39 -0.13 -1.22 0.01 -0.66 -1.01 114.94 112.08 1dzk s ASN 86 Ca 0.17 -0.43 -0.02 0.00 -0.71 0.00 0.00 52.86 51.87 1dzk s ASN 86 Cb -0.11 -0.08 0.04 0.00 0.41 0.00 0.00 41.25 41.51 1dzk s ASN 86 CO 0.07 -0.01 0.00 -0.75 -1.51 0.00 0.00 177.10 174.90 1dzk s LYS 87 N -1.10 0.81 0.29 -0.60 2.20 -0.76 -1.85 119.74 118.73 1dzk s LYS 87 Ca -0.01 -0.19 0.05 0.00 -0.36 0.00 0.00 55.97 55.46 1dzk s LYS 87 Cb -0.08 -1.57 -0.06 0.00 -1.51 0.00 0.00 37.83 34.61 1dzk s LYS 87 CO 0.01 -0.44 -0.01 -0.59 -0.36 0.00 0.00 175.35 173.96 1dzk s PHE 88 N 1.87 1.91 -0.02 4.03 -0.71 -0.18 -1.48 117.98 123.39 1dzk s PHE 88 Ca 0.02 -0.82 -0.08 0.00 -1.04 0.00 0.00 56.93 55.01 1dzk s PHE 88 Cb -0.14 -1.16 0.01 0.00 -1.21 0.00 0.00 43.02 40.51 1dzk s PHE 88 CO -0.07 0.14 0.17 0.54 -1.34 0.00 0.00 175.22 174.66 1dzk s VAL 89 N -3.16 0.05 -0.79 -2.49 0.11 -0.42 -0.67 120.40 113.03 1dzk s VAL 89 Ca 0.32 -0.45 -0.21 0.00 -2.93 0.00 0.00 61.98 58.70 1dzk s VAL 89 Cb 0.06 -0.40 0.09 0.00 -1.53 0.00 0.00 36.38 34.60 1dzk s VAL 89 CO 0.13 -0.25 1.08 -0.69 -3.33 0.00 0.00 175.10 172.04 1dzk s VAL 90 N -0.91 4.42 0.31 2.04 1.01 -1.26 -1.63 120.40 124.37 1dzk s VAL 90 Ca -0.10 -0.82 0.02 0.00 0.00 0.00 0.00 61.98 61.08 1dzk s VAL 90 Cb -0.05 -4.76 0.13 0.00 0.00 0.00 0.00 36.38 31.69 1dzk s VAL 90 CO 0.01 -1.53 1.81 0.28 0.00 0.00 0.00 175.10 175.67 1dzk h SER 91 N 9.33 0.55 -4.34 3.32 0.02 -1.53 -3.45 113.55 117.45 1dzk h SER 91 Ca -0.08 -0.13 -0.17 0.00 -0.84 0.00 0.00 61.79 60.57 1dzk h SER 91 Cb 1.05 -0.15 -0.24 0.00 0.14 0.00 0.00 62.40 63.20 1dzk h SER 91 CO 1.18 0.66 -0.55 -0.47 -1.14 0.00 0.00 176.83 176.51 1dzk s TYR 92 N -4.87 -0.04 -0.09 3.45 6.14 -1.12 -4.99 117.35 115.83 1dzk s TYR 92 Ca -0.08 0.09 -0.04 0.00 0.64 0.00 0.00 57.07 57.68 1dzk s TYR 92 Cb 0.15 -0.01 0.04 0.00 0.42 0.00 0.00 41.96 42.56 1dzk s TYR 92 CO 0.78 -0.16 0.21 0.00 0.64 0.00 0.00 175.55 177.02 1dzk s ALA 93 N -0.62 -0.45 0.44 3.97 0.00 -1.26 -1.24 121.76 122.60 1dzk s ALA 93 Ca -0.07 0.88 0.03 0.00 0.00 0.00 0.00 51.96 52.80 1dzk s ALA 93 Cb -0.04 -0.61 -0.02 0.00 0.00 0.00 0.00 23.12 22.45 1dzk s ALA 93 CO 0.01 -0.22 0.11 -1.54 0.00 0.00 0.00 175.76 174.11 1dzk s SER 94 N 1.34 3.12 0.45 0.00 1.04 0.06 -4.99 113.70 114.73 1dzk s SER 94 Ca -0.08 -1.70 0.31 0.00 0.48 0.00 0.00 55.95 54.96 1dzk s SER 94 Cb -0.11 0.55 1.36 0.00 0.10 0.00 0.00 66.02 67.93 1dzk s SER 94 CO -0.08 -0.94 1.92 1.05 0.98 0.00 0.00 173.24 176.17 1dzk h GLU 95 N 1.67 0.00 -0.00 4.02 4.11 -2.01 -3.17 114.58 119.19 1dzk h GLU 95 Ca -0.37 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.06 1dzk h GLU 95 Cb 1.28 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.53 1dzk h GLU 95 CO 0.59 0.00 -0.24 0.25 0.07 0.00 0.00 179.01 179.68 1dzk n THR 96 N -2.75 0.00 -3.62 -1.06 -2.24 -1.26 -5.02 114.28 98.33 1dzk n THR 96 Ca 0.00 -0.38 -0.10 0.00 -2.27 0.00 0.00 64.05 61.30 1dzk n THR 96 Cb 0.23 1.03 -0.03 0.00 -2.10 0.00 0.00 70.33 69.46 1dzk n THR 96 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1dzk s ALA 97 N -1.41 -1.20 0.02 6.98 0.00 -1.20 -4.10 121.76 120.84 1dzk s ALA 97 Ca 0.04 0.05 0.05 0.00 0.00 0.00 0.00 51.96 52.10 1dzk s ALA 97 Cb 0.05 0.84 -0.02 0.00 0.00 0.00 0.00 23.12 23.99 1dzk s ALA 97 CO 0.23 -0.79 -0.15 -0.51 0.00 0.00 0.00 175.76 174.54 1dzk s LEU 98 N -2.82 2.10 -0.16 0.00 1.43 -0.77 -0.76 118.68 117.70 1dzk s LEU 98 Ca 0.05 -0.37 0.01 0.00 -1.03 0.00 0.00 54.13 52.79 1dzk s LEU 98 Cb -0.01 -0.71 0.02 0.00 0.03 0.00 0.00 46.19 45.52 1dzk s LEU 98 CO -0.07 0.11 -0.20 -0.63 0.23 0.00 0.00 176.35 175.80 1dzk s ILE 99 N -0.61 1.97 -0.10 -0.59 1.01 -0.37 -0.93 121.20 121.58 1dzk s ILE 99 Ca 0.04 -0.90 -0.01 0.00 0.00 0.00 0.00 60.65 59.78 1dzk s ILE 99 Cb -0.07 -1.78 -0.03 0.00 0.01 0.00 0.00 42.46 40.59 1dzk s ILE 99 CO 0.00 0.53 -0.04 -0.63 0.00 0.00 0.00 174.94 174.80 1dzk s ILE 100 N 1.18 3.93 -0.14 2.92 1.01 -0.18 -1.25 121.20 128.65 1dzk s ILE 100 Ca 0.01 -0.38 -0.01 0.00 0.00 0.00 0.00 60.65 60.27 1dzk s ILE 100 Cb -0.14 -2.65 -0.02 0.00 0.01 0.00 0.00 42.46 39.66 1dzk s ILE 100 CO -0.09 0.57 -0.10 -0.44 0.00 0.00 0.00 174.94 174.87 1dzk s SER 101 N -0.46 4.21 -0.00 3.58 0.01 -0.65 -0.96 113.70 119.43 1dzk s SER 101 Ca 0.07 -0.29 0.03 0.00 1.31 0.00 0.00 55.95 57.07 1dzk s SER 101 Cb -0.12 -1.66 -0.01 0.00 0.21 0.00 0.00 66.02 64.44 1dzk s SER 101 CO 0.02 0.15 -0.10 0.21 0.41 0.00 0.00 173.24 173.93 1dzk s ASN 102 N 0.46 1.12 -0.18 2.44 3.04 -0.20 -1.30 114.94 120.31 1dzk s ASN 102 Ca -0.08 -0.21 -0.01 0.00 0.04 0.00 0.00 52.86 52.61 1dzk s ASN 102 Cb -0.15 -0.11 0.01 0.00 -1.54 0.00 0.00 41.25 39.45 1dzk s ASN 102 CO 0.04 0.09 -0.14 -0.63 -3.04 0.00 0.00 177.10 173.42 1dzk s ILE 103 N -0.32 2.61 -0.09 -5.21 1.01 -0.55 -0.92 121.20 117.74 1dzk s ILE 103 Ca 0.03 -0.76 -0.00 0.00 0.00 0.00 0.00 60.65 59.91 1dzk s ILE 103 Cb -0.04 -2.13 -0.03 0.00 0.01 0.00 0.00 42.46 40.27 1dzk s ILE 103 CO -0.00 0.50 -0.07 0.21 0.00 0.00 0.00 174.94 175.58 1dzk s ASN 104 N 1.21 4.64 -0.24 3.58 3.84 -0.06 -1.82 114.94 126.09 1dzk s ASN 104 Ca 0.02 -0.06 0.02 0.00 0.21 0.00 0.00 52.86 53.05 1dzk s ASN 104 Cb -0.14 -1.34 0.04 0.00 -0.55 0.00 0.00 41.25 39.27 1dzk s ASN 104 CO -0.07 0.31 -0.12 -0.69 -2.79 0.00 0.00 177.10 173.74 1dzk s VAL 105 N -0.48 2.28 0.99 -5.21 1.01 -0.18 -0.79 120.40 118.02 1dzk s VAL 105 Ca 0.07 -1.37 -0.16 0.00 0.00 0.00 0.00 61.98 60.52 1dzk s VAL 105 Cb -0.12 -2.22 0.22 0.00 0.00 0.00 0.00 36.38 34.26 1dzk s VAL 105 CO 0.02 0.14 1.35 1.51 0.00 0.00 0.00 175.10 178.11 1dzk s ASP 106 N 1.19 2.89 0.52 3.32 1.47 -0.60 -1.20 116.67 124.26 1dzk s ASP 106 Ca -0.04 0.17 0.19 0.00 1.18 0.00 0.00 52.55 54.05 1dzk s ASP 106 Cb -0.18 -0.14 1.32 0.00 -0.34 0.00 0.00 42.92 43.59 1dzk s ASP 106 CO -0.07 -2.87 2.11 -0.33 0.68 0.00 0.00 175.17 174.69 1dzk h GLU 107 N -1.73 0.00 -0.00 2.11 5.08 -1.91 -0.20 114.58 117.92 1dzk h GLU 107 Ca -0.44 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.92 1dzk h GLU 107 Cb 1.22 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.47 1dzk h GLU 107 CO 0.33 0.00 -0.08 0.39 -1.00 0.00 0.00 179.01 178.65 1dzk n GLU 108 N -4.47 0.62 -0.31 2.33 -0.58 -1.26 -4.93 120.64 112.04 1dzk n GLU 108 Ca 0.01 -0.17 0.00 0.00 -0.42 0.00 0.00 57.16 56.58 1dzk n GLU 108 Cb 0.24 -1.50 0.00 0.00 -0.57 0.00 0.00 31.44 29.61 1dzk n GLU 108 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1dzk n GLY 109 N 1.28 0.67 3.74 0.62 0.00 -0.09 -5.06 105.19 106.35 1dzk n GLY 109 Ca 0.15 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.76 1dzk n GLY 109 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1dzk s ASP 110 N -2.94 7.56 -0.16 1.61 1.01 -1.26 -4.75 116.67 117.73 1dzk s ASP 110 Ca 0.00 1.91 -0.08 0.00 0.71 0.00 0.00 52.55 55.10 1dzk s ASP 110 Cb 0.00 -2.60 -0.04 0.00 1.01 0.00 0.00 42.92 41.28 1dzk s ASP 110 CO 0.00 0.04 0.11 -0.75 0.21 0.00 0.00 175.17 174.78 1dzk s LYS 111 N -0.70 3.79 -0.03 8.23 2.20 -1.26 -1.55 119.74 130.42 1dzk s LYS 111 Ca 0.44 -0.23 0.02 0.00 -0.36 0.00 0.00 55.97 55.84 1dzk s LYS 111 Cb -0.25 -3.24 0.01 0.00 -1.51 0.00 0.00 37.83 32.83 1dzk s LYS 111 CO 0.32 0.49 -0.08 0.99 -0.36 0.00 0.00 175.35 176.71 1dzk s THR 112 N -0.21 0.68 -0.11 3.43 2.01 0.03 -4.95 115.64 116.52 1dzk s THR 112 Ca 0.10 -0.30 -0.03 0.00 0.31 0.00 0.00 61.69 61.76 1dzk s THR 112 Cb -0.12 -0.62 -0.03 0.00 0.01 0.00 0.00 72.50 71.74 1dzk s THR 112 CO 0.01 0.22 0.02 -0.51 -0.69 0.00 0.00 174.62 173.67 1dzk s ILE 113 N 0.26 4.45 0.04 1.82 1.10 -1.26 -0.88 121.20 126.73 1dzk s ILE 113 Ca -0.04 -0.18 -0.01 0.00 -0.51 0.00 0.00 60.65 59.91 1dzk s ILE 113 Cb -0.08 -2.90 -0.03 0.00 0.15 0.00 0.00 42.46 39.59 1dzk s ILE 113 CO 0.00 0.58 -0.02 -0.04 -2.11 0.00 0.00 174.94 173.35 1dzk s MET 114 N -0.64 0.55 0.06 3.50 -1.94 -0.10 -1.30 119.30 119.44 1dzk s MET 114 Ca 0.11 -1.06 0.04 0.00 -1.71 0.00 0.00 55.69 53.07 1dzk s MET 114 Cb -0.12 0.19 -0.03 0.00 2.01 0.00 0.00 34.83 36.89 1dzk s MET 114 CO 0.02 -0.10 -0.13 0.95 -0.01 0.00 0.00 175.02 175.75 1dzk s THR 115 N -3.33 0.98 -0.04 2.05 -4.23 -0.37 -1.04 115.64 109.65 1dzk s THR 115 Ca 0.01 -1.25 -0.04 0.00 -1.18 0.00 0.00 61.69 59.23 1dzk s THR 115 Cb 0.04 -0.96 0.01 0.00 1.34 0.00 0.00 72.50 72.93 1dzk s THR 115 CO -0.08 -0.26 0.12 -0.83 -0.54 0.00 0.00 174.62 173.03 1dzk s GLY 116 N -1.70 -0.08 -0.21 3.99 0.00 -0.14 -0.85 107.32 108.34 1dzk s GLY 116 Ca -0.04 0.36 -0.06 0.00 0.00 0.00 0.00 44.72 44.97 1dzk s GLY 116 CO 0.02 0.35 0.04 -2.27 0.00 0.00 0.00 173.10 171.24 1dzk s LEU 117 N 0.18 3.50 0.09 0.66 2.96 -0.30 -1.01 118.68 124.75 1dzk s LEU 117 Ca -0.01 -0.10 0.09 0.00 -0.22 0.00 0.00 54.13 53.89 1dzk s LEU 117 Cb -0.02 -1.90 -0.04 0.00 0.50 0.00 0.00 46.19 44.73 1dzk s LEU 117 CO -0.00 0.08 -0.21 -0.76 -1.32 0.00 0.00 176.35 174.13 1dzk s LEU 118 N 0.94 2.51 0.00 -0.68 1.43 -0.11 -0.90 118.68 121.87 1dzk s LEU 118 Ca 0.03 -0.57 0.03 0.00 -1.03 0.00 0.00 54.13 52.58 1dzk s LEU 118 Cb -0.14 -1.43 -0.01 0.00 0.03 0.00 0.00 46.19 44.64 1dzk s LEU 118 CO 0.02 0.21 0.27 0.61 0.23 0.00 0.00 176.35 177.70 1dzk n GLY 119 N 1.17 2.86 0.28 -3.19 0.00 0.07 -1.85 105.19 104.53 1dzk n GLY 119 Ca -0.16 -1.72 0.13 0.00 0.00 0.00 0.00 46.02 44.27 1dzk n GLY 119 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1dzk n LYS 120 N -0.45 0.96 0.00 1.61 4.76 -1.26 -0.06 118.16 123.72 1dzk n LYS 120 Ca 0.04 -0.56 0.00 0.00 -2.87 0.00 0.00 58.31 54.92 1dzk n LYS 120 Cb 0.44 -1.49 0.00 0.00 -1.84 0.00 0.00 35.03 32.14 1dzk n LYS 120 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1dzk n GLY 121 N 1.32 2.38 0.01 0.72 0.00 -1.26 -4.86 105.19 103.50 1dzk n GLY 121 Ca 0.13 -0.22 0.11 0.00 0.00 0.00 0.00 46.02 46.04 1dzk n GLY 121 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1dzk n THR 122 N 0.00 0.03 -2.98 2.61 -2.24 -1.26 -4.84 114.28 105.60 1dzk n THR 122 Ca 0.00 -0.17 -0.44 0.00 -2.27 0.00 0.00 64.05 61.16 1dzk n THR 122 Cb 0.00 0.57 -0.01 0.00 -2.10 0.00 0.00 70.33 68.78 1dzk n THR 122 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1dzk s ASP 123 N -3.56 6.88 0.24 3.42 -1.08 -1.26 -5.03 116.67 116.27 1dzk s ASP 123 Ca 0.03 -2.60 -0.31 0.00 -0.52 0.00 0.00 52.55 49.14 1dzk s ASP 123 Cb 0.15 -2.38 -0.12 0.00 -1.46 0.00 0.00 42.92 39.11 1dzk s ASP 123 CO 0.86 -0.85 1.62 -0.38 0.52 0.00 0.00 175.17 176.94 1dzk n ILE 124 N 4.85 0.50 -3.24 4.11 2.08 -1.26 -5.00 119.36 121.39 1dzk n ILE 124 Ca 0.29 -0.12 -0.39 0.00 0.56 0.00 0.00 62.75 63.09 1dzk n ILE 124 Cb 0.46 -1.86 -0.07 0.00 -0.75 0.00 0.00 39.64 37.42 1dzk n ILE 124 CO 0.00 0.00 0.00 -1.61 0.56 0.00 0.00 176.55 175.50 1dzk s GLU 125 N 0.32 4.18 0.44 0.38 0.41 -1.26 -4.97 118.70 118.20 1dzk s GLU 125 Ca 0.71 0.41 0.12 0.00 -0.41 0.00 0.00 54.97 55.80 1dzk s GLU 125 Cb -0.54 -3.57 1.01 0.00 -1.78 0.00 0.00 34.13 29.25 1dzk s GLU 125 CO 0.41 -0.16 2.02 0.22 -0.49 0.00 0.00 175.26 177.27 1dzk h ASP 126 N 7.49 0.35 -0.87 -0.19 3.58 -1.99 -1.59 116.42 123.20 1dzk h ASP 126 Ca -0.33 0.00 0.05 0.00 0.42 0.00 0.00 57.03 57.17 1dzk h ASP 126 Cb 1.15 -0.08 -0.06 0.00 1.72 0.00 0.00 39.33 42.07 1dzk h ASP 126 CO 0.74 0.23 0.55 -0.61 -2.88 0.00 0.00 179.24 177.27 1dzk h GLN 127 N 0.40 0.99 -0.29 0.28 4.15 -2.00 0.82 115.11 119.46 1dzk h GLN 127 Ca 0.21 -0.06 -0.18 0.00 0.77 0.00 0.00 58.65 59.38 1dzk h GLN 127 Cb 0.30 -0.22 -0.00 0.00 0.21 0.00 0.00 27.48 27.77 1dzk h GLN 127 CO -0.05 0.65 -0.54 -0.44 -1.93 0.00 0.00 178.83 176.52 1dzk h ASP 128 N 1.02 0.95 -0.72 -0.69 3.32 -1.73 -2.98 116.42 115.59 1dzk h ASP 128 Ca 0.37 -0.51 -0.06 0.00 0.02 0.00 0.00 57.03 56.86 1dzk h ASP 128 Cb 0.12 -0.27 -0.03 0.00 0.22 0.00 0.00 39.33 39.37 1dzk h ASP 128 CO -0.16 1.30 0.23 0.25 -1.72 0.00 0.00 179.24 179.15 1dzk h LEU 129 N 0.66 1.05 -0.90 1.55 5.85 -0.75 -1.38 115.31 121.39 1dzk h LEU 129 Ca 0.02 -0.20 -0.06 0.00 0.84 0.00 0.00 57.88 58.47 1dzk h LEU 129 Cb 1.14 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 41.87 1dzk h LEU 129 CO 0.12 0.97 0.15 -0.33 -0.34 0.00 0.00 178.44 179.02 1dzk h GLU 130 N 1.07 0.97 -0.51 1.25 4.39 -0.86 -1.10 114.58 119.78 1dzk h GLU 130 Ca 0.23 -0.21 -0.09 0.00 0.34 0.00 0.00 59.36 59.63 1dzk h GLU 130 Cb 0.29 -0.14 -0.02 0.00 -0.10 0.00 0.00 28.75 28.79 1dzk h GLU 130 CO -0.01 0.86 -0.06 0.87 -1.16 0.00 0.00 179.01 179.51 1dzk h LYS 131 N 0.93 0.90 -0.56 2.33 1.79 -1.31 -1.95 116.57 118.71 1dzk h LYS 131 Ca 0.20 -0.29 -0.03 0.00 -2.18 0.00 0.00 60.65 58.35 1dzk h LYS 131 Cb 0.33 -0.08 -0.02 0.00 -1.58 0.00 0.00 32.23 30.87 1dzk h LYS 131 CO -0.00 0.94 0.24 0.35 -1.08 0.00 0.00 179.45 179.89 1dzk h PHE 132 N 0.82 0.83 -0.33 -1.35 3.57 -0.75 -0.53 116.94 119.20 1dzk h PHE 132 Ca 0.14 -0.05 -0.07 0.00 3.53 0.00 0.00 57.97 61.52 1dzk h PHE 132 Cb 0.58 -0.25 -0.02 0.00 2.79 0.00 0.00 35.95 39.05 1dzk h PHE 132 CO 0.03 0.66 -0.08 0.87 -2.23 0.00 0.00 178.31 177.57 1dzk h LYS 133 N 0.76 0.54 -0.22 1.11 1.57 -0.98 -0.81 116.57 118.54 1dzk h LYS 133 Ca 0.19 -0.14 -0.09 0.00 -1.87 0.00 0.00 60.65 58.73 1dzk h LYS 133 Cb 0.17 -0.06 -0.00 0.00 0.08 0.00 0.00 32.23 32.41 1dzk h LYS 133 CO -0.02 0.63 -0.23 0.93 -0.57 0.00 0.00 179.45 180.18 1dzk h GLU 134 N 0.51 0.54 -0.77 3.15 5.08 -0.97 -0.92 114.58 121.20 1dzk h GLU 134 Ca 0.10 -0.29 -0.04 0.00 -1.00 0.00 0.00 59.36 58.13 1dzk h GLU 134 Cb 0.45 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.68 1dzk h GLU 134 CO 0.02 0.88 0.34 0.28 -1.00 0.00 0.00 179.01 179.53 1dzk h VAL 135 N 0.22 1.25 -0.27 3.13 2.07 -0.94 -0.94 116.25 120.77 1dzk h VAL 135 Ca 0.03 -0.75 0.00 0.00 0.82 0.00 0.00 66.70 66.80 1dzk h VAL 135 Cb 0.79 0.31 -0.01 0.00 -1.52 0.00 0.00 31.29 30.86 1dzk h VAL 135 CO 0.06 0.31 0.17 0.74 0.02 0.00 0.00 177.57 178.87 1dzk h THR 136 N 1.10 1.09 -0.58 2.57 2.02 -1.06 -2.20 112.91 115.85 1dzk h THR 136 Ca 0.26 -0.19 0.00 0.00 0.77 0.00 0.00 66.41 67.25 1dzk h THR 136 Cb 0.17 0.73 -0.03 0.00 -1.74 0.00 0.00 68.15 67.28 1dzk h THR 136 CO -0.03 0.08 0.36 -0.09 0.37 0.00 0.00 175.52 176.22 1dzk h ARG 137 N 0.35 0.77 0.00 6.66 2.43 -0.83 -2.28 114.38 121.48 1dzk h ARG 137 Ca 0.10 -0.06 -0.02 0.00 -0.81 0.00 0.00 59.98 59.18 1dzk h ARG 137 Cb -0.01 -0.17 -0.00 0.00 -0.42 0.00 0.00 29.97 29.37 1dzk h ARG 137 CO -0.02 0.54 -0.10 0.93 -1.51 0.00 0.00 179.97 179.81 1dzk h GLU 138 N 0.78 0.00 -0.14 0.20 5.08 -0.94 -0.24 114.58 119.31 1dzk h GLU 138 Ca 0.21 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.57 1dzk h GLU 138 Cb -0.05 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.20 1dzk h GLU 138 CO -0.04 0.10 0.00 0.09 -1.00 0.00 0.00 179.01 178.16 1dzk n ASN 139 N -4.09 0.90 -0.11 1.42 5.03 -0.85 -4.89 115.26 112.67 1dzk n ASN 139 Ca -0.02 -1.86 -0.01 0.00 0.87 0.00 0.00 54.58 53.55 1dzk n ASN 139 Cb 0.18 -0.10 -0.01 0.00 -1.02 0.00 0.00 39.78 38.84 1dzk n ASN 139 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1dzk n GLY 140 N 0.84 0.51 3.62 7.41 0.00 -0.10 -5.01 105.19 112.45 1dzk n GLY 140 Ca 0.09 -0.45 -0.39 0.00 0.00 0.00 0.00 46.02 45.27 1dzk n GLY 140 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1dzk s ILE 141 N -1.98 5.17 0.65 -0.61 1.01 -0.91 -5.00 121.20 119.53 1dzk s ILE 141 Ca 0.00 0.62 -0.15 0.00 0.00 0.00 0.00 60.65 61.12 1dzk s ILE 141 Cb 0.00 -3.71 -0.00 0.00 0.01 0.00 0.00 42.46 38.75 1dzk s ILE 141 CO 0.00 0.17 1.11 -2.16 0.00 0.00 0.00 174.94 174.06 1dzk s PRO 142 N 1.97 2.83 0.34 2.79 0.04 -1.26 -3.96 135.00 137.75 1dzk s PRO 142 Ca 0.16 1.40 0.06 0.00 0.04 0.00 0.00 61.00 62.66 1dzk s PRO 142 Cb -0.16 -1.95 0.74 0.00 0.04 0.00 0.00 34.50 33.17 1dzk s PRO 142 CO 0.09 -1.23 1.90 1.49 0.04 0.00 0.00 177.00 179.29 1dzk h GLU 143 N 0.08 0.76 0.00 4.56 4.22 -1.97 -0.59 114.58 121.64 1dzk h GLU 143 Ca -0.47 -0.05 0.00 0.00 0.08 0.00 0.00 59.36 58.93 1dzk h GLU 143 Cb 1.25 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 30.33 1dzk h GLU 143 CO 0.54 0.50 0.00 -0.85 -2.18 0.00 0.00 179.01 177.02 1dzk n GLU 144 N -4.53 0.16 -0.59 1.92 0.28 -1.26 -2.06 120.64 114.56 1dzk n GLU 144 Ca 0.15 0.55 0.06 0.00 -0.16 0.00 0.00 57.16 57.77 1dzk n GLU 144 Cb 0.36 -1.92 0.30 0.00 1.43 0.00 0.00 31.44 31.61 1dzk n GLU 144 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 1dzk n ASN 145 N -2.23 4.25 -4.65 -1.84 5.03 -0.23 -4.89 115.26 110.70 1dzk n ASN 145 Ca -0.00 -2.53 -0.35 0.00 0.87 0.00 0.00 54.58 52.57 1dzk n ASN 145 Cb 0.11 -0.58 -0.09 0.00 -1.02 0.00 0.00 39.78 38.19 1dzk n ASN 145 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 1dzk s ILE 146 N -2.07 4.87 -0.04 2.41 1.01 -0.87 -2.55 121.20 123.96 1dzk s ILE 146 Ca 0.41 -0.01 0.01 0.00 0.00 0.00 0.00 60.65 61.07 1dzk s ILE 146 Cb 0.29 -3.19 -0.03 0.00 0.01 0.00 0.00 42.46 39.53 1dzk s ILE 146 CO 0.16 0.47 -0.05 0.68 0.00 0.00 0.00 174.94 176.19 1dzk s VAL 147 N 0.31 3.81 -0.50 2.92 -7.23 0.05 -4.98 120.40 114.77 1dzk s VAL 147 Ca 0.04 -0.56 -0.22 0.00 -1.81 0.00 0.00 61.98 59.43 1dzk s VAL 147 Cb -0.12 -2.61 0.04 0.00 0.56 0.00 0.00 36.38 34.25 1dzk s VAL 147 CO -0.00 0.51 0.79 0.21 -0.31 0.00 0.00 175.10 176.29 1dzk s ASN 148 N -1.10 6.32 0.09 4.85 3.04 -1.26 -2.18 114.94 124.69 1dzk s ASN 148 Ca 0.15 -0.45 -0.02 0.00 0.04 0.00 0.00 52.86 52.57 1dzk s ASN 148 Cb -0.11 -2.37 -0.27 0.00 -1.54 0.00 0.00 41.25 36.96 1dzk s ASN 148 CO 0.04 -1.02 1.17 0.40 -3.04 0.00 0.00 177.10 174.66 1dzk h ILE 149 N 5.95 1.54 -0.98 -5.21 1.08 -1.17 -3.26 117.51 115.46 1dzk h ILE 149 Ca -0.26 -3.13 0.03 0.00 -0.39 0.00 0.00 64.86 61.10 1dzk h ILE 149 Cb 1.08 2.92 -0.05 0.00 -3.07 0.00 0.00 36.82 37.70 1dzk h ILE 149 CO 1.00 0.91 0.64 0.16 -0.69 0.00 0.00 178.15 180.18 1dzk h ILE 150 N 0.06 1.20 0.00 -0.67 3.07 -1.59 0.46 117.51 120.04 1dzk h ILE 150 Ca -0.11 -0.44 -0.01 0.00 1.55 0.00 0.00 64.86 65.86 1dzk h ILE 150 Cb 1.93 -0.18 -0.00 0.00 -0.27 0.00 0.00 36.82 38.30 1dzk h ILE 150 CO 0.19 0.23 -0.03 -0.33 -1.05 0.00 0.00 178.15 177.16 1dzk h GLU 151 N 1.27 0.00 -0.00 0.16 5.08 -1.86 -2.88 114.58 116.35 1dzk h GLU 151 Ca 0.38 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.74 1dzk h GLU 151 Cb -0.06 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.19 1dzk h GLU 151 CO -0.10 0.03 -0.64 0.54 -1.00 0.00 0.00 179.01 177.84 1dzk n ARG 152 N -3.83 1.44 -2.74 2.33 1.74 -0.08 -4.90 116.66 110.62 1dzk n ARG 152 Ca -0.03 -0.33 -0.42 0.00 -0.77 0.00 0.00 57.85 56.30 1dzk n ARG 152 Cb 0.12 -1.32 -0.03 0.00 -1.02 0.00 0.00 32.46 30.22 1dzk n ARG 152 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1dzk s ASP 153 N -2.40 6.47 -0.25 0.55 -1.08 -0.04 -4.77 116.67 115.14 1dzk s ASP 153 Ca 0.10 -1.52 0.12 0.00 -0.52 0.00 0.00 52.55 50.73 1dzk s ASP 153 Cb 0.13 -2.48 0.50 0.00 -1.46 0.00 0.00 42.92 39.61 1dzk s ASP 153 CO 0.61 -1.36 1.43 -0.90 0.52 0.00 0.00 175.17 175.46 1dzk n ASP 154 N 7.88 2.84 -4.90 -0.34 5.75 -1.26 -5.01 116.55 121.51 1dzk n ASP 154 Ca 0.22 -3.52 -0.28 0.00 -0.01 0.00 0.00 54.79 51.19 1dzk n ASP 154 Cb 0.49 -0.59 0.02 0.00 -1.03 0.00 0.00 41.12 40.01 1dzk n ASP 154 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1dzk n PRO 156 N -2.60 1.05 0.00 0.00 -0.02 -1.26 -5.17 135.00 127.00 1dzk n PRO 156 Ca 0.04 0.41 0.06 0.00 -2.02 0.00 0.00 63.50 61.98 1dzk n PRO 156 Cb 0.56 -2.32 0.34 0.00 -0.02 0.00 0.00 33.50 32.07 1dzk n PRO 156 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48