#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1zdi n SER 2 N 0.00 0.00 -0.62 0.00 2.88 -1.26 -5.03 113.62 109.58 1zdi n SER 2 Ca 0.00 0.00 0.10 0.00 -1.33 0.00 0.00 58.87 57.64 1zdi n SER 2 Cb 0.00 0.00 0.34 0.00 -0.75 0.00 0.00 64.21 63.80 1zdi n SER 2 CO 0.00 0.00 0.00 -0.46 -1.23 0.00 0.00 175.04 173.35 1zdi n ASN 3 N 0.00 1.87 -3.99 -3.46 0.23 -1.26 -4.60 115.26 104.04 1zdi n ASN 3 Ca 0.00 -1.77 -0.43 0.00 -0.53 0.00 0.00 54.58 51.86 1zdi n ASN 3 Cb 0.00 -0.13 0.00 0.00 -2.08 0.00 0.00 39.78 37.57 1zdi n ASN 3 CO 0.00 0.00 0.00 0.33 -0.93 0.00 0.00 177.26 176.66 1zdi n PHE 4 N 0.46 3.65 -4.56 -2.53 -0.00 -1.26 -4.91 117.46 108.31 1zdi n PHE 4 Ca 0.16 -2.94 -0.26 0.00 -0.00 0.00 0.00 57.45 54.41 1zdi n PHE 4 Cb 0.35 -2.28 -0.11 0.00 -0.00 0.00 0.00 39.48 37.44 1zdi n PHE 4 CO 0.00 0.00 0.00 0.95 -0.00 0.00 0.00 176.76 177.71 1zdi s THR 5 N 2.03 1.86 0.42 -2.13 -4.23 -1.26 -4.82 115.64 107.51 1zdi s THR 5 Ca 0.44 -2.04 -0.18 0.00 -1.18 0.00 0.00 61.69 58.74 1zdi s THR 5 Cb 0.09 -2.87 -0.09 0.00 1.34 0.00 0.00 72.50 70.96 1zdi s THR 5 CO -0.02 -0.05 0.89 0.00 -0.54 0.00 0.00 174.62 174.90 1zdi s GLN 6 N -3.73 4.08 0.22 3.99 -2.07 -1.26 -4.59 119.66 116.29 1zdi s GLN 6 Ca 0.35 0.92 -0.07 0.00 -1.82 0.00 0.00 55.36 54.74 1zdi s GLN 6 Cb 0.08 -2.25 -0.02 0.00 -1.09 0.00 0.00 33.01 29.73 1zdi s GLN 6 CO 0.17 -0.03 0.30 -0.59 -1.32 0.00 0.00 175.29 173.81 1zdi s PHE 7 N -2.24 0.73 -0.28 9.60 -0.71 -0.78 -4.99 117.98 119.32 1zdi s PHE 7 Ca 0.59 -1.03 -0.14 0.00 -1.04 0.00 0.00 56.93 55.30 1zdi s PHE 7 Cb -0.10 -0.18 -0.04 0.00 -1.21 0.00 0.00 43.02 41.50 1zdi s PHE 7 CO 0.19 -0.81 0.34 0.14 -1.34 0.00 0.00 175.22 173.75 1zdi s VAL 8 N -4.08 5.20 -0.06 -2.49 -7.23 -1.26 -0.66 120.40 109.83 1zdi s VAL 8 Ca 0.29 0.47 -0.24 0.00 -1.81 0.00 0.00 61.98 60.69 1zdi s VAL 8 Cb 0.03 -3.67 -0.26 0.00 0.56 0.00 0.00 36.38 33.04 1zdi s VAL 8 CO 0.10 0.16 0.96 0.25 -0.31 0.00 0.00 175.10 176.26 1zdi h LEU 9 N 8.57 0.30 -7.89 1.32 5.85 -0.24 -3.43 115.31 119.80 1zdi h LEU 9 Ca -0.32 -0.86 -0.67 0.00 0.84 0.00 0.00 57.88 56.87 1zdi h LEU 9 Cb 1.17 -0.10 -0.37 0.00 0.37 0.00 0.00 40.66 41.73 1zdi h LEU 9 CO 0.63 1.13 -0.80 -0.69 -0.34 0.00 0.00 178.44 178.37 1zdi s VAL 10 N -2.80 2.21 -0.60 1.05 1.01 -0.83 -4.97 120.40 115.47 1zdi s VAL 10 Ca -0.15 -1.60 -0.23 0.00 0.00 0.00 0.00 61.98 60.00 1zdi s VAL 10 Cb 0.01 -2.28 0.06 0.00 0.00 0.00 0.00 36.38 34.16 1zdi s VAL 10 CO 0.77 -0.01 0.91 -0.62 0.00 0.00 0.00 175.10 176.15 1zdi s ASP 11 N 1.12 6.24 -0.53 3.32 2.15 -1.26 -0.05 116.67 127.66 1zdi s ASP 11 Ca -0.08 -0.75 0.02 0.00 0.43 0.00 0.00 52.55 52.17 1zdi s ASP 11 Cb -0.20 -2.41 0.57 0.00 -0.30 0.00 0.00 42.92 40.59 1zdi s ASP 11 CO -0.05 -1.29 1.93 0.59 -0.17 0.00 0.00 175.17 176.18 1zdi n ASN 12 N 7.41 5.29 -2.96 -0.34 3.02 -1.26 -4.91 115.26 121.50 1zdi n ASN 12 Ca -0.02 -3.69 -0.02 0.00 -0.03 0.00 0.00 54.58 50.81 1zdi n ASN 12 Cb 0.46 -0.87 0.00 0.00 -0.61 0.00 0.00 39.78 38.76 1zdi n ASN 12 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1zdi n GLY 13 N -1.05 -1.24 4.72 7.41 0.00 -1.26 -3.30 105.19 110.48 1zdi n GLY 13 Ca 0.60 0.65 0.00 0.00 0.00 0.00 0.00 46.02 47.27 1zdi n GLY 13 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1zdi n GLY 14 N -1.37 0.00 2.96 -0.02 0.00 -1.26 -4.83 105.19 100.66 1zdi n GLY 14 Ca 0.03 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.74 1zdi n GLY 14 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1zdi s THR 15 N 0.00 1.87 0.00 2.61 -4.23 -1.21 -4.59 115.64 110.09 1zdi s THR 15 Ca 0.00 -1.90 0.00 0.00 -1.18 0.00 0.00 61.69 58.61 1zdi s THR 15 Cb 0.00 -2.30 0.00 0.00 1.34 0.00 0.00 72.50 71.54 1zdi s THR 15 CO 0.00 -0.47 0.00 0.61 -0.54 0.00 0.00 174.62 174.22 1zdi n GLY 16 N 4.46 1.22 3.78 3.99 0.00 -1.26 -4.81 105.19 112.56 1zdi n GLY 16 Ca -0.02 -0.35 -0.37 0.00 0.00 0.00 0.00 46.02 45.28 1zdi n GLY 16 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1zdi s ASP 17 N -2.37 6.49 -0.37 1.61 1.11 -1.26 -4.49 116.67 117.39 1zdi s ASP 17 Ca 0.00 2.14 -0.12 0.00 0.18 0.00 0.00 52.55 54.75 1zdi s ASP 17 Cb 0.00 -2.59 0.01 0.00 1.07 0.00 0.00 42.92 41.41 1zdi s ASP 17 CO 0.00 -0.69 0.23 -0.69 1.18 0.00 0.00 175.17 175.20 1zdi s VAL 18 N -1.64 4.88 0.01 -1.27 1.01 0.93 -4.94 120.40 119.38 1zdi s VAL 18 Ca 0.61 -0.61 0.01 0.00 0.00 0.00 0.00 61.98 61.98 1zdi s VAL 18 Cb -0.24 -3.64 -0.04 0.00 0.00 0.00 0.00 36.38 32.46 1zdi s VAL 18 CO 0.30 -0.16 0.05 0.42 0.00 0.00 0.00 175.10 175.71 1zdi s THR 19 N 1.63 4.49 -0.02 3.92 -4.23 -1.26 0.54 115.64 120.70 1zdi s THR 19 Ca 0.04 -0.53 0.07 0.00 -1.18 0.00 0.00 61.69 60.09 1zdi s THR 19 Cb -0.18 -3.05 -0.02 0.00 1.34 0.00 0.00 72.50 70.59 1zdi s THR 19 CO 0.08 0.33 -0.23 0.54 -0.54 0.00 0.00 174.62 174.80 1zdi s VAL 20 N -1.18 1.79 0.12 2.29 0.11 0.17 -4.41 120.40 119.28 1zdi s VAL 20 Ca 0.22 -0.97 0.07 0.00 -2.93 0.00 0.00 61.98 58.38 1zdi s VAL 20 Cb -0.12 -1.48 -0.04 0.00 -1.53 0.00 0.00 36.38 33.21 1zdi s VAL 20 CO 0.14 0.51 -0.17 0.00 -3.33 0.00 0.00 175.10 172.24 1zdi s ALA 21 N -0.52 1.68 0.15 1.54 0.00 -0.63 -1.86 121.76 122.12 1zdi s ALA 21 Ca 0.08 -1.31 -0.34 0.00 0.00 0.00 0.00 51.96 50.39 1zdi s ALA 21 Cb -0.09 -0.15 -0.15 0.00 0.00 0.00 0.00 23.12 22.74 1zdi s ALA 21 CO -0.01 0.20 1.50 -2.30 0.00 0.00 0.00 175.76 175.15 1zdi n PRO 22 N 0.66 1.87 0.00 0.00 -0.02 -1.26 -1.80 135.00 134.44 1zdi n PRO 22 Ca -0.16 0.67 0.00 0.00 -2.02 0.00 0.00 63.50 61.99 1zdi n PRO 22 Cb 0.56 -2.40 0.00 0.00 -0.02 0.00 0.00 33.50 31.64 1zdi n PRO 22 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1zdi n SER 23 N 3.08 0.08 -3.63 2.55 3.41 -0.27 -4.85 113.62 113.99 1zdi n SER 23 Ca 0.17 -0.37 -0.05 0.00 -0.26 0.00 0.00 58.87 58.37 1zdi n SER 23 Cb 0.26 0.26 -0.05 0.00 -0.26 0.00 0.00 64.21 64.42 1zdi n SER 23 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 1zdi s ASN 24 N -0.26 -0.14 -0.01 4.04 3.84 -1.24 -4.98 114.94 116.20 1zdi s ASN 24 Ca 0.00 0.17 0.04 0.00 0.21 0.00 0.00 52.86 53.28 1zdi s ASN 24 Cb 0.00 0.13 0.07 0.00 -0.55 0.00 0.00 41.25 40.90 1zdi s ASN 24 CO 0.00 -0.12 1.03 0.33 -2.79 0.00 0.00 177.10 175.55 1zdi n PHE 25 N 0.70 0.00 -2.03 0.43 -0.00 -1.26 -1.50 117.46 113.80 1zdi n PHE 25 Ca -0.04 -0.11 -0.41 0.00 -0.00 0.00 0.00 57.45 56.89 1zdi n PHE 25 Cb 0.58 -0.07 -0.02 0.00 -0.00 0.00 0.00 39.48 39.97 1zdi n PHE 25 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 1zdi s ALA 26 N -0.11 3.58 -1.61 3.13 0.00 -1.26 -2.77 121.76 122.73 1zdi s ALA 26 Ca 0.06 1.32 0.00 0.00 0.00 0.00 0.00 51.96 53.34 1zdi s ALA 26 Cb 0.07 -3.54 0.00 0.00 0.00 0.00 0.00 23.12 19.65 1zdi s ALA 26 CO -0.02 -0.73 0.00 0.09 0.00 0.00 0.00 175.76 175.10 1zdi n ASN 27 N 1.77 -5.05 -0.59 0.00 3.02 -1.26 -2.83 115.26 110.31 1zdi n ASN 27 Ca 0.04 0.16 -0.08 0.00 -0.03 0.00 0.00 54.58 54.67 1zdi n ASN 27 Cb 0.41 -4.11 -0.03 0.00 -0.61 0.00 0.00 39.78 35.43 1zdi n ASN 27 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1zdi n GLY 28 N -0.96 0.94 3.20 7.41 0.00 -1.11 -4.98 105.19 109.69 1zdi n GLY 28 Ca -0.19 -0.39 -0.36 0.00 0.00 0.00 0.00 46.02 45.07 1zdi n GLY 28 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1zdi s VAL 29 N -2.15 3.39 0.17 1.61 1.01 -1.13 -4.65 120.40 118.65 1zdi s VAL 29 Ca 0.00 -1.43 -0.30 0.00 0.00 0.00 0.00 61.98 60.25 1zdi s VAL 29 Cb 0.00 -3.02 -0.08 0.00 0.00 0.00 0.00 36.38 33.28 1zdi s VAL 29 CO 0.00 -0.27 1.23 0.00 0.00 0.00 0.00 175.10 176.06 1zdi s ALA 30 N 1.29 3.46 0.08 5.51 0.00 -0.35 -4.09 121.76 127.66 1zdi s ALA 30 Ca -0.01 0.98 0.06 0.00 0.00 0.00 0.00 51.96 52.99 1zdi s ALA 30 Cb -0.20 -3.44 -0.03 0.00 0.00 0.00 0.00 23.12 19.45 1zdi s ALA 30 CO -0.00 -0.42 -0.16 -2.00 0.00 0.00 0.00 175.76 173.18 1zdi s GLU 31 N -0.04 0.91 -0.02 0.00 2.12 -0.56 -1.14 118.70 119.97 1zdi s GLU 31 Ca 0.55 -1.00 0.00 0.00 0.36 0.00 0.00 54.97 54.87 1zdi s GLU 31 Cb -0.33 -1.00 0.02 0.00 0.26 0.00 0.00 34.13 33.09 1zdi s GLU 31 CO 0.36 0.23 0.02 -1.58 -0.54 0.00 0.00 175.26 173.75 1zdi s TRP 32 N -1.22 0.04 0.14 5.30 0.51 0.17 -1.11 118.94 122.77 1zdi s TRP 32 Ca 0.01 0.10 0.05 0.00 -2.12 0.00 0.00 56.10 54.13 1zdi s TRP 32 Cb -0.10 -0.21 -0.04 0.00 -0.81 0.00 0.00 33.47 32.31 1zdi s TRP 32 CO 0.03 -0.08 -0.11 0.96 -0.51 0.00 0.00 176.95 177.24 1zdi s ILE 33 N 0.88 1.21 0.61 2.03 -0.00 -0.75 -1.09 121.20 124.10 1zdi s ILE 33 Ca -0.07 -1.90 -0.09 0.00 -0.00 0.00 0.00 60.65 58.59 1zdi s ILE 33 Cb -0.11 -1.68 -0.01 0.00 -0.00 0.00 0.00 42.46 40.65 1zdi s ILE 33 CO -0.02 -0.61 0.97 -0.94 -0.00 0.00 0.00 174.94 174.33 1zdi s SER 34 N -2.85 5.89 -1.14 4.36 1.04 -0.90 -1.61 113.70 118.49 1zdi s SER 34 Ca 0.13 1.09 -0.22 0.00 0.48 0.00 0.00 55.95 57.42 1zdi s SER 34 Cb -0.01 -2.11 -0.09 0.00 0.10 0.00 0.00 66.02 63.91 1zdi s SER 34 CO 0.02 -0.98 1.93 -1.20 0.98 0.00 0.00 173.24 173.98 1zdi n SER 35 N -2.68 3.08 -3.59 7.02 7.64 -1.26 -4.70 113.62 119.12 1zdi n SER 35 Ca 0.05 -2.70 -0.13 0.00 1.01 0.00 0.00 58.87 57.09 1zdi n SER 35 Cb 0.56 -1.67 -0.06 0.00 -1.01 0.00 0.00 64.21 62.04 1zdi n SER 35 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 1zdi s ASN 36 N 6.20 0.62 0.47 6.43 -0.87 -1.26 -5.05 114.94 121.48 1zdi s ASN 36 Ca 0.67 -1.36 -0.23 0.00 -1.57 0.00 0.00 52.86 50.37 1zdi s ASN 36 Cb 0.01 0.59 -0.07 0.00 -0.02 0.00 0.00 41.25 41.76 1zdi s ASN 36 CO 0.13 -1.17 1.19 -0.94 -2.57 0.00 0.00 177.10 173.74 1zdi s SER 37 N -3.18 6.06 0.61 -1.22 1.04 -1.26 -4.72 113.70 111.02 1zdi s SER 37 Ca 0.31 2.36 0.28 0.00 0.48 0.00 0.00 55.95 59.38 1zdi s SER 37 Cb 0.01 -2.61 1.47 0.00 0.10 0.00 0.00 66.02 65.00 1zdi s SER 37 CO 0.17 -1.00 1.87 -0.09 0.98 0.00 0.00 173.24 175.17 1zdi h ARG 38 N 1.97 0.00 0.00 4.02 9.65 -1.96 0.72 114.38 128.78 1zdi h ARG 38 Ca -0.50 0.00 -0.01 0.00 -1.10 0.00 0.00 59.98 58.37 1zdi h ARG 38 Cb 1.25 0.00 -0.00 0.00 -1.39 0.00 0.00 29.97 29.83 1zdi h ARG 38 CO 0.60 0.00 -0.05 0.66 2.80 0.00 0.00 179.97 183.98 1zdi h SER 39 N 0.00 0.00 -0.00 -3.80 4.64 -1.88 -3.31 113.55 109.20 1zdi h SER 39 Ca 0.16 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.48 1zdi h SER 39 Cb 1.09 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.18 1zdi h SER 39 CO -0.00 0.05 0.00 0.00 -0.87 0.00 0.00 176.83 176.01 1zdi n GLN 40 N -3.13 -0.19 -2.54 4.77 6.02 0.13 -3.75 117.38 118.68 1zdi n GLN 40 Ca 0.02 -0.71 -0.36 0.00 -0.01 0.00 0.00 57.00 55.94 1zdi n GLN 40 Cb 0.45 -1.01 -0.04 0.00 1.02 0.00 0.00 30.24 30.66 1zdi n GLN 40 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1zdi s ALA 41 N -0.21 3.04 0.57 -1.58 0.00 -0.49 -4.79 121.76 118.29 1zdi s ALA 41 Ca 0.00 0.68 -0.16 0.00 0.00 0.00 0.00 51.96 52.49 1zdi s ALA 41 Cb 0.00 -3.27 -0.05 0.00 0.00 0.00 0.00 23.12 19.80 1zdi s ALA 41 CO 0.00 -0.23 1.03 0.71 0.00 0.00 0.00 175.76 177.27 1zdi s TYR 42 N -1.74 3.20 -0.11 0.00 1.51 -1.26 -4.70 117.35 114.25 1zdi s TYR 42 Ca 0.60 1.48 -0.08 0.00 -1.01 0.00 0.00 57.07 58.06 1zdi s TYR 42 Cb -0.21 -2.91 0.03 0.00 -0.11 0.00 0.00 41.96 38.77 1zdi s TYR 42 CO 0.26 -0.81 0.28 0.21 -1.11 0.00 0.00 175.55 174.38 1zdi s LYS 43 N -4.15 0.30 -0.05 -0.62 2.20 -1.04 -2.11 119.74 114.28 1zdi s LYS 43 Ca 0.61 0.45 0.03 0.00 -0.36 0.00 0.00 55.97 56.70 1zdi s LYS 43 Cb -0.13 0.07 0.01 0.00 -1.51 0.00 0.00 37.83 36.27 1zdi s LYS 43 CO 0.36 -0.08 -0.13 0.08 -0.36 0.00 0.00 175.35 175.22 1zdi s VAL 44 N 0.51 1.13 0.06 4.02 1.01 -0.25 -0.94 120.40 125.94 1zdi s VAL 44 Ca -0.03 -0.51 0.04 0.00 0.00 0.00 0.00 61.98 61.48 1zdi s VAL 44 Cb -0.04 -1.00 -0.03 0.00 0.00 0.00 0.00 36.38 35.30 1zdi s VAL 44 CO -0.03 0.34 -0.11 0.42 0.00 0.00 0.00 175.10 175.72 1zdi s THR 45 N 0.38 0.85 -0.07 3.92 -4.23 -0.17 -0.66 115.64 115.67 1zdi s THR 45 Ca -0.09 -1.20 -0.14 0.00 -1.18 0.00 0.00 61.69 59.07 1zdi s THR 45 Cb -0.13 -0.86 0.03 0.00 1.34 0.00 0.00 72.50 72.88 1zdi s THR 45 CO 0.02 -0.30 0.34 0.00 -0.54 0.00 0.00 174.62 174.15 1zdi s SER 47 N -0.69 -0.32 0.06 0.00 1.04 -0.62 -1.21 113.70 111.96 1zdi s SER 47 Ca -0.08 0.12 0.07 0.00 0.48 0.00 0.00 55.95 56.54 1zdi s SER 47 Cb -0.04 0.42 -0.03 0.00 0.10 0.00 0.00 66.02 66.47 1zdi s SER 47 CO 0.03 -0.62 -0.19 -0.69 0.98 0.00 0.00 173.24 172.75 1zdi s VAL 48 N -2.09 1.54 -0.06 5.02 1.01 -1.26 -1.10 120.40 123.46 1zdi s VAL 48 Ca -0.08 -1.25 -0.18 0.00 0.00 0.00 0.00 61.98 60.48 1zdi s VAL 48 Cb -0.02 -1.37 0.04 0.00 0.00 0.00 0.00 36.38 35.03 1zdi s VAL 48 CO 0.01 0.08 0.41 0.00 0.00 0.00 0.00 175.10 175.60 1zdi s ARG 49 N -1.38 0.69 -1.19 2.72 1.70 -0.46 -4.96 118.95 116.08 1zdi s ARG 49 Ca 0.06 0.12 -0.18 0.00 -0.47 0.00 0.00 55.73 55.25 1zdi s ARG 49 Cb -0.09 0.32 0.09 0.00 -0.57 0.00 0.00 34.95 34.70 1zdi s ARG 49 CO 0.02 -0.17 1.56 -1.14 -1.08 0.00 0.00 175.30 174.48 1zdi s GLN 50 N -0.85 3.90 0.54 3.89 0.74 -1.26 -0.05 119.66 126.56 1zdi s GLN 50 Ca -0.09 -1.93 0.31 0.00 0.05 0.00 0.00 55.36 53.69 1zdi s GLN 50 Cb -0.04 -5.34 1.69 0.00 1.10 0.00 0.00 33.01 30.42 1zdi s GLN 50 CO 0.04 -2.09 1.94 0.66 -0.55 0.00 0.00 175.29 175.29 1zdi h SER 51 N 8.04 0.00 -5.15 6.67 4.64 -1.81 -3.44 113.55 122.50 1zdi h SER 51 Ca 0.34 0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 61.56 1zdi h SER 51 Cb 0.91 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.98 1zdi h SER 51 CO 1.37 0.00 0.14 -0.55 -0.87 0.00 0.00 176.83 176.93 1zdi s SER 52 N -4.45 0.30 0.36 4.97 0.15 -1.18 -4.98 113.70 108.87 1zdi s SER 52 Ca -0.03 -1.27 0.10 0.00 0.70 0.00 0.00 55.95 55.44 1zdi s SER 52 Cb 0.09 0.81 0.70 0.00 -1.71 0.00 0.00 66.02 65.91 1zdi s SER 52 CO 0.28 -1.60 1.85 0.00 1.20 0.00 0.00 173.24 174.97 1zdi h ALA 53 N 2.02 1.40 -0.20 5.45 0.00 -2.03 -3.26 119.26 122.64 1zdi h ALA 53 Ca -0.31 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.31 1zdi h ALA 53 Cb 1.25 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.96 1zdi h ALA 53 CO 0.40 0.43 0.00 1.04 0.00 0.00 0.00 179.25 181.12 1zdi n GLN 54 N -4.18 2.69 -4.14 0.00 6.02 -1.26 -4.95 117.38 111.56 1zdi n GLN 54 Ca -0.01 -2.24 -0.09 0.00 -0.01 0.00 0.00 57.00 54.64 1zdi n GLN 54 Cb 0.35 -1.41 -0.10 0.00 1.02 0.00 0.00 30.24 30.09 1zdi n GLN 54 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 177.06 175.25 1zdi s ASN 55 N -1.54 0.88 0.05 1.08 0.02 -1.23 -0.71 114.94 113.50 1zdi s ASN 55 Ca 0.25 -1.01 0.06 0.00 -1.02 0.00 0.00 52.86 51.14 1zdi s ASN 55 Cb 0.18 0.14 -0.03 0.00 0.02 0.00 0.00 41.25 41.56 1zdi s ASN 55 CO 0.09 -0.52 -0.16 -0.13 0.02 0.00 0.00 177.10 176.39 1zdi s ARG 56 N -3.87 1.03 -0.05 -0.60 0.52 -0.48 -2.59 118.95 112.90 1zdi s ARG 56 Ca 0.10 -0.88 0.00 0.00 -0.52 0.00 0.00 55.73 54.43 1zdi s ARG 56 Cb 0.06 -1.09 0.02 0.00 0.52 0.00 0.00 34.95 34.47 1zdi s ARG 56 CO -0.07 0.26 -0.02 0.21 0.02 0.00 0.00 175.30 175.71 1zdi s LYS 57 N -1.36 0.70 -0.14 3.54 2.20 0.93 -1.14 119.74 124.47 1zdi s LYS 57 Ca 0.03 -0.01 -0.11 0.00 -0.36 0.00 0.00 55.97 55.52 1zdi s LYS 57 Cb -0.09 -0.86 -0.05 0.00 -1.51 0.00 0.00 37.83 35.32 1zdi s LYS 57 CO 0.02 -0.18 0.23 0.71 -0.36 0.00 0.00 175.35 175.77 1zdi s TYR 58 N 1.34 3.52 -0.19 4.03 1.51 -0.18 -1.36 117.35 126.03 1zdi s TYR 58 Ca -0.05 0.56 0.01 0.00 -1.01 0.00 0.00 57.07 56.58 1zdi s TYR 58 Cb -0.13 -2.19 0.02 0.00 -0.11 0.00 0.00 41.96 39.55 1zdi s TYR 58 CO -0.02 0.43 -0.18 0.99 -1.11 0.00 0.00 175.55 175.66 1zdi s THR 59 N -0.13 2.21 -0.05 -0.71 2.01 -0.26 -1.25 115.64 117.46 1zdi s THR 59 Ca 0.15 -0.91 0.04 0.00 0.31 0.00 0.00 61.69 61.28 1zdi s THR 59 Cb -0.13 -1.95 -0.00 0.00 0.01 0.00 0.00 72.50 70.43 1zdi s THR 59 CO 0.04 0.51 -0.17 -0.63 -0.69 0.00 0.00 174.62 173.67 1zdi s ILE 60 N 1.31 1.47 -0.02 1.82 1.01 0.18 -1.59 121.20 125.37 1zdi s ILE 60 Ca 0.05 -0.73 0.03 0.00 0.00 0.00 0.00 60.65 59.99 1zdi s ILE 60 Cb -0.13 -1.27 -0.00 0.00 0.01 0.00 0.00 42.46 41.07 1zdi s ILE 60 CO -0.12 0.42 -0.09 -0.54 0.00 0.00 0.00 174.94 174.62 1zdi s LYS 61 N 0.10 0.84 -0.05 2.79 1.02 -0.55 -0.16 119.74 123.72 1zdi s LYS 61 Ca -0.06 -0.32 0.02 0.00 0.02 0.00 0.00 55.97 55.64 1zdi s LYS 61 Cb -0.12 -0.80 0.01 0.00 -0.52 0.00 0.00 37.83 36.40 1zdi s LYS 61 CO 0.03 0.16 -0.12 0.08 -0.92 0.00 0.00 175.35 174.58 1zdi s VAL 62 N -0.03 1.08 -0.16 3.17 1.01 -0.66 -1.00 120.40 123.81 1zdi s VAL 62 Ca 0.01 -0.47 0.01 0.00 0.00 0.00 0.00 61.98 61.52 1zdi s VAL 62 Cb -0.06 -0.98 0.00 0.00 0.00 0.00 0.00 36.38 35.35 1zdi s VAL 62 CO -0.00 0.34 -0.17 -1.61 0.00 0.00 0.00 175.10 173.66 1zdi s GLU 63 N 0.52 3.14 -0.28 2.72 2.02 -0.12 -1.09 118.70 125.61 1zdi s GLU 63 Ca -0.11 -0.78 -0.05 0.00 0.02 0.00 0.00 54.97 54.05 1zdi s GLU 63 Cb -0.14 -2.60 0.02 0.00 0.10 0.00 0.00 34.13 31.50 1zdi s GLU 63 CO 0.03 -0.05 0.03 0.08 0.02 0.00 0.00 175.26 175.37 1zdi s VAL 64 N 0.95 3.52 0.37 2.63 1.01 -0.41 -2.49 120.40 125.98 1zdi s VAL 64 Ca -0.03 -0.86 -0.03 0.00 0.00 0.00 0.00 61.98 61.06 1zdi s VAL 64 Cb -0.15 -2.82 -0.04 0.00 0.00 0.00 0.00 36.38 33.37 1zdi s VAL 64 CO -0.03 0.11 0.63 -2.16 0.00 0.00 0.00 175.10 173.65 1zdi s PRO 65 N 1.42 3.56 -0.41 2.72 0.04 -1.26 -0.86 135.00 140.21 1zdi s PRO 65 Ca 0.01 -0.05 -0.05 0.00 0.04 0.00 0.00 61.00 60.96 1zdi s PRO 65 Cb -0.17 -2.56 0.10 0.00 0.04 0.00 0.00 34.50 31.91 1zdi s PRO 65 CO -0.00 0.05 0.21 0.21 0.04 0.00 0.00 177.00 177.51 1zdi s LYS 66 N -4.21 2.23 0.47 4.56 2.47 0.31 -4.97 119.74 120.60 1zdi s LYS 66 Ca 0.44 -1.68 -0.21 0.00 -1.56 0.00 0.00 55.97 52.96 1zdi s LYS 66 Cb -0.10 -3.62 -0.09 0.00 -1.46 0.00 0.00 37.83 32.57 1zdi s LYS 66 CO 0.37 -1.01 1.04 0.14 0.16 0.00 0.00 175.35 176.05 1zdi s VAL 67 N 1.24 3.75 0.19 4.02 -7.23 -1.26 0.17 120.40 121.28 1zdi s VAL 67 Ca 0.05 1.14 -0.23 0.00 -1.81 0.00 0.00 61.98 61.14 1zdi s VAL 67 Cb -0.23 -3.49 0.05 0.00 0.56 0.00 0.00 36.38 33.27 1zdi s VAL 67 CO -0.02 -0.19 0.70 0.00 -0.31 0.00 0.00 175.10 175.28 1zdi s ALA 68 N -1.90 -1.47 -0.22 1.32 0.00 0.02 -4.65 121.76 114.85 1zdi s ALA 68 Ca 0.65 0.20 -0.05 0.00 0.00 0.00 0.00 51.96 52.76 1zdi s ALA 68 Cb -0.18 0.82 -0.02 0.00 0.00 0.00 0.00 23.12 23.74 1zdi s ALA 68 CO 0.22 -0.89 -0.00 0.99 0.00 0.00 0.00 175.76 176.08 1zdi s THR 69 N -3.73 3.81 -0.07 0.00 2.01 -1.26 -0.05 115.64 116.34 1zdi s THR 69 Ca 0.06 -0.35 0.04 0.00 0.31 0.00 0.00 61.69 61.75 1zdi s THR 69 Cb -0.03 -2.74 -0.02 0.00 0.01 0.00 0.00 72.50 69.72 1zdi s THR 69 CO -0.04 0.41 -0.19 -1.58 -0.69 0.00 0.00 174.62 172.53 1zdi s GLN 70 N 1.32 2.70 -0.61 4.92 0.74 0.00 -4.90 119.66 123.83 1zdi s GLN 70 Ca 0.04 -0.78 -0.22 0.00 0.05 0.00 0.00 55.36 54.45 1zdi s GLN 70 Cb -0.15 -2.34 0.07 0.00 1.10 0.00 0.00 33.01 31.69 1zdi s GLN 70 CO 0.00 0.44 0.89 0.99 -0.55 0.00 0.00 175.29 177.06 1zdi s THR 71 N -0.27 4.46 -0.21 -0.34 2.01 -1.26 -0.39 115.64 119.64 1zdi s THR 71 Ca 0.01 -0.35 -0.04 0.00 0.31 0.00 0.00 61.69 61.62 1zdi s THR 71 Cb -0.13 -4.59 -0.01 0.00 0.01 0.00 0.00 72.50 67.78 1zdi s THR 71 CO 0.03 -1.28 -0.04 -0.69 -0.69 0.00 0.00 174.62 171.95 1zdi s VAL 72 N 3.70 3.44 -1.51 3.82 1.01 0.98 -4.58 120.40 127.27 1zdi s VAL 72 Ca 0.21 -0.47 -0.05 0.00 0.00 0.00 0.00 61.98 61.67 1zdi s VAL 72 Cb -0.17 -2.56 0.01 0.00 0.00 0.00 0.00 36.38 33.65 1zdi s VAL 72 CO 0.11 0.43 0.61 0.61 0.00 0.00 0.00 175.10 176.87 1zdi n GLY 73 N 4.63 -0.48 2.89 4.51 0.00 -1.26 -1.72 105.19 113.76 1zdi n GLY 73 Ca -0.18 0.10 0.00 0.00 0.00 0.00 0.00 46.02 45.95 1zdi n GLY 73 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1zdi n GLY 74 N -1.52 2.57 3.64 -0.02 0.00 -1.26 -5.00 105.19 103.59 1zdi n GLY 74 Ca -0.11 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.60 1zdi n GLY 74 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1zdi s VAL 75 N -3.13 3.85 -0.19 1.61 1.01 -0.70 -5.06 120.40 117.79 1zdi s VAL 75 Ca 0.00 -0.79 -0.17 0.00 0.00 0.00 0.00 61.98 61.02 1zdi s VAL 75 Cb 0.00 -2.72 -0.04 0.00 0.00 0.00 0.00 36.38 33.62 1zdi s VAL 75 CO 0.00 0.33 0.47 -1.61 0.00 0.00 0.00 175.10 174.28 1zdi s GLU 76 N -1.66 4.20 -0.00 2.72 2.02 -1.26 -0.01 118.70 124.71 1zdi s GLU 76 Ca 0.19 0.34 0.08 0.00 0.02 0.00 0.00 54.97 55.60 1zdi s GLU 76 Cb -0.11 -3.53 -0.02 0.00 0.10 0.00 0.00 34.13 30.56 1zdi s GLU 76 CO 0.10 -0.06 -0.25 -0.51 0.02 0.00 0.00 175.26 174.57 1zdi s LEU 77 N 1.37 2.08 -0.01 1.80 1.43 0.48 -4.93 118.68 120.91 1zdi s LEU 77 Ca 0.22 -0.48 -0.30 0.00 -1.03 0.00 0.00 54.13 52.54 1zdi s LEU 77 Cb -0.15 -1.24 -0.05 0.00 0.03 0.00 0.00 46.19 44.77 1zdi s LEU 77 CO 0.09 0.28 1.38 -2.16 0.23 0.00 0.00 176.35 176.17 1zdi s PRO 78 N -0.75 4.29 0.30 1.29 0.04 -1.26 -0.82 135.00 138.09 1zdi s PRO 78 Ca 0.10 1.93 0.01 0.00 0.04 0.00 0.00 61.00 63.08 1zdi s PRO 78 Cb -0.09 -3.57 -0.02 0.00 0.04 0.00 0.00 34.50 30.85 1zdi s PRO 78 CO -0.00 -0.56 0.31 0.54 0.04 0.00 0.00 177.00 177.33 1zdi s VAL 79 N 2.37 0.00 -0.21 -0.36 0.11 0.92 -4.73 120.40 118.50 1zdi s VAL 79 Ca 0.63 -1.84 0.01 0.00 -2.93 0.00 0.00 61.98 57.84 1zdi s VAL 79 Cb -0.31 -2.52 0.03 0.00 -1.53 0.00 0.00 36.38 32.05 1zdi s VAL 79 CO 0.26 0.00 -0.15 0.00 -3.33 0.00 0.00 175.10 171.88 1zdi s ALA 80 N -3.54 2.47 0.31 1.54 0.00 -1.25 -0.80 121.76 120.49 1zdi s ALA 80 Ca 0.36 -1.35 0.03 0.00 0.00 0.00 0.00 51.96 51.01 1zdi s ALA 80 Cb 0.02 -1.37 0.63 0.00 0.00 0.00 0.00 23.12 22.40 1zdi s ALA 80 CO 0.21 -0.58 1.88 0.00 0.00 0.00 0.00 175.76 177.27 1zdi h ALA 81 N 7.93 1.62 -2.30 0.00 0.00 0.15 -3.46 119.26 123.20 1zdi h ALA 81 Ca -0.39 0.00 0.18 0.00 0.00 0.00 0.00 54.91 54.70 1zdi h ALA 81 Cb 1.12 -0.20 -0.09 0.00 0.00 0.00 0.00 17.79 18.61 1zdi h ALA 81 CO 0.59 0.18 0.50 1.67 0.00 0.00 0.00 179.25 182.20 1zdi s TRP 82 N -5.85 -0.15 0.01 0.00 1.48 -1.22 -5.00 118.94 108.21 1zdi s TRP 82 Ca -0.11 -0.13 0.02 0.00 -1.06 0.00 0.00 56.10 54.83 1zdi s TRP 82 Cb 0.21 0.62 -0.01 0.00 -1.16 0.00 0.00 33.47 33.14 1zdi s TRP 82 CO 0.80 -0.77 -0.08 1.03 -4.06 0.00 0.00 176.95 173.87 1zdi s ARG 83 N -3.23 0.57 -0.13 3.25 0.52 -1.26 -0.53 118.95 118.13 1zdi s ARG 83 Ca 0.11 -0.39 -0.05 0.00 -0.52 0.00 0.00 55.73 54.88 1zdi s ARG 83 Cb -0.01 -0.51 -0.04 0.00 0.52 0.00 0.00 34.95 34.91 1zdi s ARG 83 CO 0.01 0.13 0.07 0.45 0.02 0.00 0.00 175.30 175.98 1zdi s SER 84 N -0.52 5.74 -0.11 0.23 0.15 -0.04 -4.94 113.70 114.20 1zdi s SER 84 Ca 0.00 0.23 0.03 0.00 0.70 0.00 0.00 55.95 56.91 1zdi s SER 84 Cb -0.04 -1.83 0.00 0.00 -1.71 0.00 0.00 66.02 62.44 1zdi s SER 84 CO 0.00 0.32 -0.23 -0.31 1.20 0.00 0.00 173.24 174.22 1zdi s TYR 85 N -0.49 2.60 -0.18 3.44 1.51 -1.26 -1.29 117.35 121.67 1zdi s TYR 85 Ca 0.10 -1.09 -0.02 0.00 -1.01 0.00 0.00 57.07 55.05 1zdi s TYR 85 Cb -0.12 -1.74 -0.01 0.00 -0.11 0.00 0.00 41.96 39.98 1zdi s TYR 85 CO 0.02 -0.45 -0.08 -1.17 -1.11 0.00 0.00 175.55 172.76 1zdi s LEU 86 N 0.44 2.86 -0.15 -1.29 2.96 -0.25 -4.98 118.68 118.27 1zdi s LEU 86 Ca -0.16 -0.34 0.00 0.00 -0.22 0.00 0.00 54.13 53.41 1zdi s LEU 86 Cb -0.17 -1.69 0.02 0.00 0.50 0.00 0.00 46.19 44.84 1zdi s LEU 86 CO 0.07 0.07 -0.15 0.20 -1.32 0.00 0.00 176.35 175.21 1zdi s ASN 87 N 0.94 2.72 0.00 3.68 0.01 -1.26 -1.65 114.94 119.39 1zdi s ASN 87 Ca -0.01 -0.50 0.04 0.00 -0.71 0.00 0.00 52.86 51.68 1zdi s ASN 87 Cb -0.15 -1.21 -0.01 0.00 0.41 0.00 0.00 41.25 40.29 1zdi s ASN 87 CO 0.00 -0.05 -0.13 0.00 -1.51 0.00 0.00 177.10 175.42 1zdi s MET 88 N 1.44 1.01 -0.05 -0.60 0.23 0.78 -5.00 119.30 117.12 1zdi s MET 88 Ca 0.04 -0.52 0.04 0.00 -1.03 0.00 0.00 55.69 54.23 1zdi s MET 88 Cb -0.13 -0.98 -0.00 0.00 -1.53 0.00 0.00 34.83 32.18 1zdi s MET 88 CO -0.11 0.26 -0.18 -1.21 -2.03 0.00 0.00 175.02 171.76 1zdi s GLU 89 N -0.48 1.96 -0.16 3.16 2.02 -1.26 -0.65 118.70 123.29 1zdi s GLU 89 Ca 0.04 -0.65 -0.00 0.00 0.02 0.00 0.00 54.97 54.38 1zdi s GLU 89 Cb -0.06 -1.67 0.04 0.00 0.10 0.00 0.00 34.13 32.54 1zdi s GLU 89 CO -0.00 0.25 -0.08 -1.17 0.02 0.00 0.00 175.26 174.28 1zdi s LEU 90 N 0.06 1.68 -0.26 1.80 2.96 -0.38 -4.96 118.68 119.57 1zdi s LEU 90 Ca -0.05 -0.62 -0.10 0.00 -0.22 0.00 0.00 54.13 53.13 1zdi s LEU 90 Cb -0.12 -0.99 -0.05 0.00 0.50 0.00 0.00 46.19 45.53 1zdi s LEU 90 CO 0.03 -0.15 0.15 -0.89 -1.32 0.00 0.00 176.35 174.17 1zdi s THR 91 N 1.58 5.10 -0.10 3.68 2.01 -1.26 -1.01 115.64 125.64 1zdi s THR 91 Ca 0.02 0.09 0.04 0.00 0.31 0.00 0.00 61.69 62.15 1zdi s THR 91 Cb -0.15 -3.40 0.00 0.00 0.01 0.00 0.00 72.50 68.96 1zdi s THR 91 CO -0.08 0.30 -0.23 -0.63 -0.69 0.00 0.00 174.62 173.29 1zdi s ILE 92 N 1.51 1.97 0.65 1.82 1.01 -0.29 -4.96 121.20 122.90 1zdi s ILE 92 Ca 0.07 -0.97 -0.17 0.00 0.00 0.00 0.00 60.65 59.58 1zdi s ILE 92 Cb -0.15 -1.71 -0.01 0.00 0.01 0.00 0.00 42.46 40.61 1zdi s ILE 92 CO 0.08 0.54 1.18 -2.16 0.00 0.00 0.00 174.94 174.58 1zdi s PRO 93 N 0.38 2.70 0.42 2.79 0.04 -1.26 -1.38 135.00 138.68 1zdi s PRO 93 Ca -0.18 1.69 0.30 0.00 0.04 0.00 0.00 61.00 62.84 1zdi s PRO 93 Cb -0.18 -1.91 1.35 0.00 0.04 0.00 0.00 34.50 33.81 1zdi s PRO 93 CO 0.08 -1.39 1.89 -0.84 0.04 0.00 0.00 177.00 176.78 1zdi h ILE 94 N 0.35 0.00 0.00 0.56 3.07 -1.26 -2.82 117.51 117.40 1zdi h ILE 94 Ca -0.49 -0.24 0.00 0.00 1.55 0.00 0.00 64.86 65.68 1zdi h ILE 94 Cb 1.28 1.05 0.00 0.00 -0.27 0.00 0.00 36.82 38.88 1zdi h ILE 94 CO 0.53 0.00 0.00 0.49 -1.05 0.00 0.00 178.15 178.12 1zdi n PHE 95 N -2.63 0.00 -2.35 0.16 3.72 -1.26 -4.84 117.46 110.27 1zdi n PHE 95 Ca 0.00 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 56.98 1zdi n PHE 95 Cb 0.19 -0.29 -0.03 0.00 -0.94 0.00 0.00 39.48 38.42 1zdi n PHE 95 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1zdi s ALA 96 N -2.58 3.57 1.00 4.37 0.00 -1.07 -5.03 121.76 122.03 1zdi s ALA 96 Ca 0.28 0.69 -0.13 0.00 0.00 0.00 0.00 51.96 52.80 1zdi s ALA 96 Cb 0.20 -3.58 0.19 0.00 0.00 0.00 0.00 23.12 19.93 1zdi s ALA 96 CO 0.45 -0.94 1.12 0.99 0.00 0.00 0.00 175.76 177.38 1zdi s THR 97 N 2.66 1.96 0.26 0.00 2.01 -1.26 -4.83 115.64 116.44 1zdi s THR 97 Ca 0.59 0.00 0.02 0.00 0.31 0.00 0.00 61.69 62.62 1zdi s THR 97 Cb -0.27 -2.59 0.03 0.00 0.01 0.00 0.00 72.50 69.67 1zdi s THR 97 CO 0.22 0.00 1.66 0.78 -0.69 0.00 0.00 174.62 176.59 1zdi h ASN 98 N -1.85 0.44 0.96 3.53 2.35 -1.99 -1.72 115.58 117.30 1zdi h ASN 98 Ca -0.52 -0.18 -0.06 0.00 -0.55 0.00 0.00 56.30 54.98 1zdi h ASN 98 Cb 1.33 -0.12 -0.01 0.00 0.05 0.00 0.00 38.32 39.56 1zdi h ASN 98 CO 0.56 0.78 -0.31 0.77 -1.65 0.00 0.00 177.43 177.59 1zdi h SER 99 N 0.36 0.00 -0.30 5.81 4.64 -1.99 -0.65 113.55 121.42 1zdi h SER 99 Ca 0.04 0.00 -0.18 0.00 -0.47 0.00 0.00 61.79 61.18 1zdi h SER 99 Cb 0.83 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.92 1zdi h SER 99 CO 0.07 0.31 -0.51 0.44 -0.87 0.00 0.00 176.83 176.26 1zdi h ASP 100 N 0.00 0.96 -0.29 4.97 3.32 -1.79 -3.01 116.42 120.58 1zdi h ASP 100 Ca -0.00 -0.52 -0.10 0.00 0.02 0.00 0.00 57.03 56.43 1zdi h ASP 100 Cb 0.87 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 40.13 1zdi h ASP 100 CO 0.04 1.30 -0.15 0.00 -1.72 0.00 0.00 179.24 178.72 1zdi h GLU 102 N 0.66 0.00 -0.27 0.00 5.08 -1.11 -2.41 114.58 116.53 1zdi h GLU 102 Ca 0.11 0.00 -0.12 0.00 -1.00 0.00 0.00 59.36 58.35 1zdi h GLU 102 Cb 0.62 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.86 1zdi h GLU 102 CO 0.04 0.25 -0.34 1.25 -1.00 0.00 0.00 179.01 179.21 1zdi h LEU 103 N 0.00 0.61 -0.13 1.33 5.85 -1.35 -1.72 115.31 119.89 1zdi h LEU 103 Ca -0.00 -0.25 -0.05 0.00 0.84 0.00 0.00 57.88 58.43 1zdi h LEU 103 Cb 0.49 -0.17 -0.00 0.00 0.37 0.00 0.00 40.66 41.35 1zdi h LEU 103 CO 0.03 0.90 -0.10 0.40 -0.34 0.00 0.00 178.44 179.33 1zdi h ILE 104 N 0.49 1.34 -0.73 4.05 2.04 -1.33 -2.28 117.51 121.09 1zdi h ILE 104 Ca 0.05 -1.20 0.03 0.00 1.00 0.00 0.00 64.86 64.74 1zdi h ILE 104 Cb 0.82 1.85 -0.04 0.00 -0.74 0.00 0.00 36.82 38.70 1zdi h ILE 104 CO 0.07 0.35 0.46 0.58 0.00 0.00 0.00 178.15 179.61 1zdi h VAL 105 N -0.07 1.11 -0.35 1.67 2.07 -1.34 -1.84 116.25 117.50 1zdi h VAL 105 Ca 0.02 -0.31 -0.10 0.00 0.82 0.00 0.00 66.70 67.13 1zdi h VAL 105 Cb 0.60 0.12 -0.02 0.00 -1.52 0.00 0.00 31.29 30.47 1zdi h VAL 105 CO 0.03 0.17 -0.19 0.11 0.02 0.00 0.00 177.57 177.70 1zdi h LYS 106 N 0.91 0.66 -0.40 1.57 1.57 -1.31 -1.87 116.57 117.70 1zdi h LYS 106 Ca 0.29 -0.24 -0.07 0.00 -1.87 0.00 0.00 60.65 58.76 1zdi h LYS 106 Cb 0.00 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.25 1zdi h LYS 106 CO -0.11 0.81 -0.05 0.00 -0.57 0.00 0.00 179.45 179.54 1zdi h ALA 107 N 1.20 1.18 -0.13 3.86 0.00 -0.90 -1.08 119.26 123.39 1zdi h ALA 107 Ca 0.09 -0.26 -0.14 0.00 0.00 0.00 0.00 54.91 54.60 1zdi h ALA 107 Cb 0.65 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 1zdi h ALA 107 CO 0.05 0.53 -0.53 0.52 0.00 0.00 0.00 179.25 179.82 1zdi h MET 108 N 0.61 0.36 -0.17 0.00 2.86 -0.98 -1.28 114.93 116.33 1zdi h MET 108 Ca 0.12 -0.22 -0.20 0.00 -2.06 0.00 0.00 59.70 57.34 1zdi h MET 108 Cb 0.46 0.02 0.00 0.00 0.06 0.00 0.00 31.60 32.14 1zdi h MET 108 CO 0.02 0.80 -0.70 1.96 1.06 0.00 0.00 176.91 180.05 1zdi h GLN 109 N 0.28 0.72 -0.34 1.72 4.20 -1.12 -3.21 115.11 117.36 1zdi h GLN 109 Ca 0.01 -0.54 -0.15 0.00 0.06 0.00 0.00 58.65 58.02 1zdi h GLN 109 Cb 1.03 0.10 -0.01 0.00 0.30 0.00 0.00 27.48 28.90 1zdi h GLN 109 CO 0.09 1.16 -0.38 0.78 -0.67 0.00 0.00 178.83 179.81 1zdi h GLY 110 N 0.77 0.88 0.35 3.46 0.00 -1.07 -2.69 103.07 104.77 1zdi h GLY 110 Ca -0.03 -0.88 0.13 0.00 0.00 0.00 0.00 47.33 46.55 1zdi h GLY 110 CO 0.14 0.80 0.53 -2.00 0.00 0.00 0.00 176.54 176.01 1zdi h LEU 111 N 0.67 0.73 -2.19 3.11 5.85 -1.28 -2.71 115.31 119.49 1zdi h LEU 111 Ca 0.06 0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.85 1zdi h LEU 111 Cb 0.94 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 41.90 1zdi h LEU 111 CO 0.09 0.35 0.00 0.18 -0.34 0.00 0.00 178.44 178.72 1zdi n LEU 112 N -4.75 3.27 -4.76 2.25 4.77 -1.18 -4.34 117.00 112.26 1zdi n LEU 112 Ca 0.18 -1.42 -0.39 0.00 -0.03 0.00 0.00 56.01 54.35 1zdi n LEU 112 Cb 0.40 -0.25 0.02 0.00 -2.33 0.00 0.00 43.42 41.26 1zdi n LEU 112 CO 0.24 0.71 0.97 -0.75 -1.33 0.00 0.00 177.39 177.24 1zdi s LYS 113 N -1.51 3.53 0.22 3.23 2.20 -1.02 -4.78 119.74 121.62 1zdi s LYS 113 Ca 0.38 2.18 -0.32 0.00 -0.36 0.00 0.00 55.97 57.86 1zdi s LYS 113 Cb 0.22 -2.47 -0.13 0.00 -1.51 0.00 0.00 37.83 33.94 1zdi s LYS 113 CO 0.31 -0.86 1.56 -0.25 -0.36 0.00 0.00 175.35 175.75 1zdi n ASP 114 N -0.51 3.32 0.00 1.43 8.00 -1.26 -1.73 116.55 125.80 1zdi n ASP 114 Ca 0.07 1.11 0.00 0.00 0.71 0.00 0.00 54.79 56.68 1zdi n ASP 114 Cb 0.44 -1.49 0.00 0.00 -0.02 0.00 0.00 41.12 40.05 1zdi n ASP 114 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1zdi n GLY 115 N 2.86 3.24 3.82 0.44 0.00 -1.26 -5.05 105.19 109.24 1zdi n GLY 115 Ca 0.13 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.84 1zdi n GLY 115 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1zdi s ASN 116 N -1.08 5.66 0.14 1.61 0.01 -0.71 -4.89 114.94 115.69 1zdi s ASN 116 Ca 0.00 1.67 -0.32 0.00 -0.71 0.00 0.00 52.86 53.50 1zdi s ASN 116 Cb 0.00 -2.51 -0.09 0.00 0.41 0.00 0.00 41.25 39.06 1zdi s ASN 116 CO 0.00 -1.25 1.54 -0.65 -1.51 0.00 0.00 177.10 175.23 1zdi h PRO 117 N -0.19 -0.19 0.44 -0.60 0.11 -1.88 -2.63 132.00 127.06 1zdi h PRO 117 Ca -0.45 0.01 -0.02 0.00 0.11 0.00 0.00 66.00 65.65 1zdi h PRO 117 Cb 1.21 0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.36 1zdi h PRO 117 CO 0.58 -0.13 -0.23 0.82 -0.21 0.00 0.00 178.00 178.83 1zdi h ILE 118 N -0.19 0.52 0.00 4.15 2.04 -1.94 -0.54 117.51 121.55 1zdi h ILE 118 Ca 0.12 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.97 1zdi h ILE 118 Cb 0.50 0.52 -0.00 0.00 -0.74 0.00 0.00 36.82 37.10 1zdi h ILE 118 CO -0.76 0.00 -0.01 1.55 0.00 0.00 0.00 178.15 178.92 1zdi h PRO 119 N -0.62 0.00 -0.02 2.37 0.13 -1.75 -2.04 132.00 130.08 1zdi h PRO 119 Ca -0.06 0.00 -0.21 0.00 -0.87 0.00 0.00 66.00 64.87 1zdi h PRO 119 Cb 0.49 0.00 0.02 0.00 0.13 0.00 0.00 31.00 31.63 1zdi h PRO 119 CO 0.08 0.01 -0.80 0.77 -0.23 0.00 0.00 178.00 177.83 1zdi h SER 120 N 0.00 0.74 -0.14 1.44 0.02 -1.06 -2.84 113.55 111.71 1zdi h SER 120 Ca -0.00 -0.73 -0.01 0.00 -0.84 0.00 0.00 61.79 60.21 1zdi h SER 120 Cb 0.11 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 62.42 1zdi h SER 120 CO 0.00 1.37 0.05 0.00 -1.14 0.00 0.00 176.83 177.12 1zdi h ALA 121 N 0.38 0.18 -0.18 3.77 0.00 -0.42 -3.05 119.26 119.94 1zdi h ALA 121 Ca -0.10 -0.11 0.01 0.00 0.00 0.00 0.00 54.91 54.72 1zdi h ALA 121 Cb 1.48 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 19.20 1zdi h ALA 121 CO 0.16 -0.22 0.08 0.82 0.00 0.00 0.00 179.25 180.09 1zdi h ILE 122 N 0.07 0.98 0.00 0.00 2.04 -1.51 -1.58 117.51 117.51 1zdi h ILE 122 Ca 0.05 -0.06 0.00 0.00 1.00 0.00 0.00 64.86 65.85 1zdi h ILE 122 Cb 0.19 0.79 0.00 0.00 -0.74 0.00 0.00 36.82 37.05 1zdi h ILE 122 CO -0.00 0.03 0.00 0.00 0.00 0.00 0.00 178.15 178.18 1zdi h ALA 123 N 1.10 1.00 -0.27 1.87 0.00 -1.53 -2.51 119.26 118.92 1zdi h ALA 123 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1zdi h ALA 123 Cb 0.03 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1zdi h ALA 123 CO -0.06 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.19 1zdi n ALA 124 N -1.84 2.36 -3.74 0.00 0.00 -0.97 -4.97 120.51 111.35 1zdi n ALA 124 Ca 0.00 -1.47 -0.26 0.00 0.00 0.00 0.00 53.44 51.71 1zdi n ALA 124 Cb 0.15 -0.45 0.02 0.00 0.00 0.00 0.00 19.45 19.17 1zdi n ALA 124 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1zdi n ASN 125 N 0.07 -2.90 -4.22 0.00 3.02 -0.94 -4.97 115.26 105.31 1zdi n ASN 125 Ca 0.13 -0.95 -0.15 0.00 -0.03 0.00 0.00 54.58 53.58 1zdi n ASN 125 Cb 0.53 -3.55 -0.10 0.00 -0.61 0.00 0.00 39.78 36.05 1zdi n ASN 125 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 1zdi s SER 126 N -3.95 0.76 0.25 6.41 0.15 -0.63 -5.06 113.70 111.63 1zdi s SER 126 Ca 0.22 -1.41 0.02 0.00 0.70 0.00 0.00 55.95 55.49 1zdi s SER 126 Cb -0.07 0.28 0.02 0.00 -1.71 0.00 0.00 66.02 64.54 1zdi s SER 126 CO 0.85 -0.80 0.20 0.61 1.20 0.00 0.00 173.24 175.30 1zdi n GLY 127 N -0.39 2.84 3.80 9.45 0.00 -1.26 -4.37 105.19 115.25 1zdi n GLY 127 Ca 0.01 -2.23 -0.38 0.00 0.00 0.00 0.00 46.02 43.42 1zdi n GLY 127 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1zdi s ILE 128 N -1.21 5.00 0.00 -0.61 1.09 -1.26 -4.81 121.20 119.40 1zdi s ILE 128 Ca 0.15 0.97 0.00 0.00 -1.10 0.00 0.00 60.65 60.67 1zdi s ILE 128 Cb -0.01 -3.79 0.00 0.00 -1.06 0.00 0.00 42.46 37.60 1zdi s ILE 128 CO 0.10 0.50 0.00 0.00 -0.10 0.00 0.00 174.94 175.44