#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1zdi s SER 2 N 0.00 -0.54 0.00 0.00 0.01 -1.26 -4.99 113.70 106.92 1zdi s SER 2 Ca 0.00 0.79 0.02 0.00 1.31 0.00 0.00 55.95 58.07 1zdi s SER 2 Cb 0.00 0.71 0.03 0.00 0.21 0.00 0.00 66.02 66.98 1zdi s SER 2 CO 0.00 -0.36 0.82 -0.46 0.41 0.00 0.00 173.24 173.65 1zdi n ASN 3 N 1.48 1.69 -3.89 2.44 6.94 -1.26 -4.78 115.26 117.88 1zdi n ASN 3 Ca -0.14 -1.58 -0.43 0.00 -0.02 0.00 0.00 54.58 52.42 1zdi n ASN 3 Cb 0.57 -0.02 0.01 0.00 -2.36 0.00 0.00 39.78 37.97 1zdi n ASN 3 CO 0.00 0.00 0.00 0.33 -1.03 0.00 0.00 177.26 176.56 1zdi n PHE 4 N -0.14 2.74 -4.53 -2.53 7.35 -1.26 -4.93 117.46 114.16 1zdi n PHE 4 Ca 0.01 -2.73 -0.26 0.00 -0.76 0.00 0.00 57.45 53.71 1zdi n PHE 4 Cb 0.17 -1.78 -0.08 0.00 0.35 0.00 0.00 39.48 38.14 1zdi n PHE 4 CO 0.00 0.00 0.00 0.95 -0.76 0.00 0.00 176.76 176.95 1zdi s THR 5 N -0.42 0.63 0.45 -2.13 -4.23 -1.26 -4.81 115.64 103.87 1zdi s THR 5 Ca 0.38 -2.00 -0.20 0.00 -1.18 0.00 0.00 61.69 58.68 1zdi s THR 5 Cb 0.09 -2.32 -0.10 0.00 1.34 0.00 0.00 72.50 71.50 1zdi s THR 5 CO 0.03 0.00 0.96 0.00 -0.54 0.00 0.00 174.62 175.07 1zdi s GLN 6 N -3.71 4.14 0.18 3.99 -2.07 -1.26 -4.48 119.66 116.45 1zdi s GLN 6 Ca 0.22 1.11 -0.16 0.00 -1.82 0.00 0.00 55.36 54.71 1zdi s GLN 6 Cb 0.02 -2.16 0.02 0.00 -1.09 0.00 0.00 33.01 29.80 1zdi s GLN 6 CO 0.14 -0.11 0.47 -0.59 -1.32 0.00 0.00 175.29 173.88 1zdi s PHE 7 N -2.24 -0.06 -0.27 9.60 -0.71 -0.65 -4.99 117.98 118.66 1zdi s PHE 7 Ca 0.62 -0.28 -0.25 0.00 -1.04 0.00 0.00 56.93 55.98 1zdi s PHE 7 Cb -0.10 0.31 -0.00 0.00 -1.21 0.00 0.00 43.02 42.02 1zdi s PHE 7 CO 0.17 -0.86 0.84 0.08 -1.34 0.00 0.00 175.22 174.11 1zdi s VAL 8 N -3.88 4.79 -0.13 -2.49 1.01 -1.26 -1.03 120.40 117.42 1zdi s VAL 8 Ca 0.09 1.47 -0.18 0.00 0.00 0.00 0.00 61.98 63.37 1zdi s VAL 8 Cb -0.00 -4.15 -0.25 0.00 0.00 0.00 0.00 36.38 31.97 1zdi s VAL 8 CO -0.04 -0.16 0.50 0.25 0.00 0.00 0.00 175.10 175.65 1zdi h LEU 9 N 9.35 0.27 -7.94 3.92 5.85 -1.17 -3.45 115.31 122.14 1zdi h LEU 9 Ca -0.23 -0.80 -0.67 0.00 0.84 0.00 0.00 57.88 57.02 1zdi h LEU 9 Cb 1.09 -0.09 -0.36 0.00 0.37 0.00 0.00 40.66 41.67 1zdi h LEU 9 CO 0.89 1.55 -0.81 -0.69 -0.34 0.00 0.00 178.44 179.04 1zdi s VAL 10 N -2.44 2.20 -0.40 1.05 1.01 -0.98 -4.97 120.40 115.89 1zdi s VAL 10 Ca -0.22 -1.40 -0.20 0.00 0.00 0.00 0.00 61.98 60.16 1zdi s VAL 10 Cb 0.04 -2.18 0.01 0.00 0.00 0.00 0.00 36.38 34.25 1zdi s VAL 10 CO 0.72 0.14 0.61 -0.62 0.00 0.00 0.00 175.10 175.95 1zdi s ASP 11 N 1.17 6.35 -0.70 3.32 -1.08 -1.26 -0.43 116.67 124.04 1zdi s ASP 11 Ca -0.04 -0.14 0.05 0.00 -0.52 0.00 0.00 52.55 51.89 1zdi s ASP 11 Cb -0.18 -2.31 0.26 0.00 -1.46 0.00 0.00 42.92 39.24 1zdi s ASP 11 CO -0.07 -0.66 0.87 0.59 0.52 0.00 0.00 175.17 176.42 1zdi n ASN 12 N 6.08 4.19 0.00 -0.34 3.02 -1.26 -4.99 115.26 121.96 1zdi n ASN 12 Ca -0.02 -3.46 0.00 0.00 -0.03 0.00 0.00 54.58 51.07 1zdi n ASN 12 Cb 0.48 -0.74 0.00 0.00 -0.61 0.00 0.00 39.78 38.91 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 0.83 2.26 0.03 7.41 0.00 -1.26 -1.79 105.19 112.68 1zdi n GLY 13 Ca 0.30 -0.34 0.02 0.00 0.00 0.00 0.00 46.02 46.00 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 0.00 2.81 2.91 -0.02 0.00 -1.26 -4.87 105.19 104.76 1zdi n GLY 14 Ca 0.00 -0.26 -0.15 0.00 0.00 0.00 0.00 46.02 45.60 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 -1.31 -0.36 0.00 2.61 -4.23 -0.74 -4.68 115.64 106.92 1zdi s THR 15 Ca 0.07 0.21 0.00 0.00 -1.18 0.00 0.00 61.69 60.79 1zdi s THR 15 Cb 0.06 -0.47 0.00 0.00 1.34 0.00 0.00 72.50 73.44 1zdi s THR 15 CO 0.01 0.05 0.00 0.61 -0.54 0.00 0.00 174.62 174.75 1zdi n GLY 16 N 5.34 1.12 3.74 3.99 0.00 -1.26 -4.77 105.19 113.34 1zdi n GLY 16 Ca -0.06 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.55 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 -2.00 6.92 -0.27 1.61 1.01 -1.26 -4.49 116.67 118.20 1zdi s ASP 17 Ca 0.00 2.41 -0.14 0.00 0.71 0.00 0.00 52.55 55.53 1zdi s ASP 17 Cb 0.00 -2.61 -0.04 0.00 1.01 0.00 0.00 42.92 41.28 1zdi s ASP 17 CO 0.00 -0.49 0.34 -0.69 0.21 0.00 0.00 175.17 174.54 1zdi s VAL 18 N -0.11 5.20 -0.05 -1.27 1.01 0.42 -4.95 120.40 120.66 1zdi s VAL 18 Ca 0.55 0.50 -0.01 0.00 0.00 0.00 0.00 61.98 63.02 1zdi s VAL 18 Cb -0.36 -3.67 -0.04 0.00 0.00 0.00 0.00 36.38 32.32 1zdi s VAL 18 CO 0.40 0.18 0.02 -0.89 0.00 0.00 0.00 175.10 174.81 1zdi s THR 19 N 1.97 4.39 -0.11 3.92 2.01 -1.26 -0.56 115.64 126.01 1zdi s THR 19 Ca 0.14 -0.36 0.03 0.00 0.31 0.00 0.00 61.69 61.81 1zdi s THR 19 Cb -0.16 -2.91 0.01 0.00 0.01 0.00 0.00 72.50 69.45 1zdi s THR 19 CO 0.10 0.49 -0.21 0.54 -0.69 0.00 0.00 174.62 174.86 1zdi s VAL 20 N -1.00 1.88 0.05 3.82 0.11 -0.19 -4.28 120.40 120.78 1zdi s VAL 20 Ca 0.17 -0.89 0.05 0.00 -2.93 0.00 0.00 61.98 58.37 1zdi s VAL 20 Cb -0.12 -1.66 -0.04 0.00 -1.53 0.00 0.00 36.38 33.04 1zdi s VAL 20 CO 0.07 0.52 -0.07 0.00 -3.33 0.00 0.00 175.10 172.29 1zdi s ALA 21 N 0.64 3.04 0.44 1.54 0.00 -0.21 -1.63 121.76 125.59 1zdi s ALA 21 Ca -0.12 -1.10 -0.23 0.00 0.00 0.00 0.00 51.96 50.50 1zdi s ALA 21 Cb -0.16 -1.06 -0.10 0.00 0.00 0.00 0.00 23.12 21.79 1zdi s ALA 21 CO 0.03 0.64 0.99 -2.30 0.00 0.00 0.00 175.76 175.11 1zdi n PRO 22 N 1.15 1.27 0.00 0.00 -0.02 -1.26 -1.41 135.00 134.74 1zdi n PRO 22 Ca -0.14 0.46 0.00 0.00 -2.02 0.00 0.00 63.50 61.80 1zdi n PRO 22 Cb 0.52 -2.04 0.00 0.00 -0.02 0.00 0.00 33.50 31.96 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 0.38 0.88 -3.60 2.55 3.41 -0.31 -4.77 113.62 112.15 1zdi n SER 23 Ca 0.10 0.00 -0.16 0.00 -0.26 0.00 0.00 58.87 58.55 1zdi n SER 23 Cb 0.40 0.03 -0.07 0.00 -0.26 0.00 0.00 64.21 64.31 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 -2.75 -0.60 -0.36 4.04 3.84 -1.21 -5.02 114.94 112.89 1zdi s ASN 24 Ca 0.00 0.83 0.13 0.00 0.21 0.00 0.00 52.86 54.03 1zdi s ASN 24 Cb 0.00 0.77 0.38 0.00 -0.55 0.00 0.00 41.25 41.85 1zdi s ASN 24 CO 0.00 -0.45 0.82 0.33 -2.79 0.00 0.00 177.10 175.00 1zdi n PHE 25 N 1.58 0.27 -3.69 0.43 -0.00 -1.26 -1.07 117.46 113.73 1zdi n PHE 25 Ca -0.18 -3.43 -0.36 0.00 -0.00 0.00 0.00 57.45 53.48 1zdi n PHE 25 Cb 0.56 -0.29 -0.06 0.00 -0.00 0.00 0.00 39.48 39.70 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 -2.46 3.80 -1.46 3.13 0.00 -1.19 -4.43 121.76 119.15 1zdi s ALA 26 Ca 0.35 -0.46 -0.10 0.00 0.00 0.00 0.00 51.96 51.75 1zdi s ALA 26 Cb 0.38 -2.16 0.06 0.00 0.00 0.00 0.00 23.12 21.40 1zdi s ALA 26 CO -0.05 0.58 0.80 0.09 0.00 0.00 0.00 175.76 177.18 1zdi n ASN 27 N 1.55 -5.06 0.00 0.00 4.13 -1.26 -2.13 115.26 112.49 1zdi n ASN 27 Ca -0.14 -0.54 0.00 0.00 1.68 0.00 0.00 54.58 55.58 1zdi n ASN 27 Cb 0.53 -4.07 0.00 0.00 -1.54 0.00 0.00 39.78 34.70 1zdi n ASN 27 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1zdi n GLY 28 N -1.56 0.53 3.24 7.41 0.00 -1.26 -4.99 105.19 108.56 1zdi n GLY 28 Ca -0.01 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.65 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 -2.35 3.27 0.09 1.61 1.01 -0.90 -4.37 120.40 118.75 1zdi s VAL 29 Ca 0.00 -0.97 -0.21 0.00 0.00 0.00 0.00 61.98 60.79 1zdi s VAL 29 Cb 0.00 -2.70 -0.07 0.00 0.00 0.00 0.00 36.38 33.61 1zdi s VAL 29 CO 0.00 0.11 0.64 0.00 0.00 0.00 0.00 175.10 175.85 1zdi s ALA 30 N 1.37 3.53 -0.01 5.51 0.00 -0.13 -3.15 121.76 128.88 1zdi s ALA 30 Ca 0.00 0.14 0.04 0.00 0.00 0.00 0.00 51.96 52.14 1zdi s ALA 30 Cb -0.17 -2.75 -0.01 0.00 0.00 0.00 0.00 23.12 20.18 1zdi s ALA 30 CO -0.02 0.33 -0.14 -2.00 0.00 0.00 0.00 175.76 173.93 1zdi s GLU 31 N -0.96 1.18 -0.01 0.00 2.12 -0.23 -1.55 118.70 119.27 1zdi s GLU 31 Ca 0.32 -0.50 0.06 0.00 0.36 0.00 0.00 54.97 55.20 1zdi s GLU 31 Cb -0.20 -1.13 -0.01 0.00 0.26 0.00 0.00 34.13 33.04 1zdi s GLU 31 CO 0.21 0.29 -0.18 -1.58 -0.54 0.00 0.00 175.26 173.46 1zdi s TRP 32 N -0.27 1.59 0.02 5.30 0.51 0.28 -1.16 118.94 125.20 1zdi s TRP 32 Ca 0.04 -0.31 0.01 0.00 -2.12 0.00 0.00 56.10 53.72 1zdi s TRP 32 Cb -0.06 -1.01 -0.01 0.00 -0.81 0.00 0.00 33.47 31.57 1zdi s TRP 32 CO -0.00 -0.01 -0.04 0.42 -0.51 0.00 0.00 176.95 176.80 1zdi s ILE 33 N -0.47 0.25 0.71 2.03 -1.09 -0.50 -1.18 121.20 120.96 1zdi s ILE 33 Ca 0.07 -0.58 -0.09 0.00 -2.23 0.00 0.00 60.65 57.81 1zdi s ILE 33 Cb -0.07 -0.30 0.04 0.00 -1.58 0.00 0.00 42.46 40.55 1zdi s ILE 33 CO -0.00 -0.22 1.06 -0.94 -1.23 0.00 0.00 174.94 173.61 1zdi s SER 34 N -0.85 5.07 1.01 3.58 1.04 -0.76 -1.04 113.70 121.76 1zdi s SER 34 Ca -0.07 0.79 -0.15 0.00 0.48 0.00 0.00 55.95 57.00 1zdi s SER 34 Cb -0.06 -1.51 0.20 0.00 0.10 0.00 0.00 66.02 64.75 1zdi s SER 34 CO -0.00 -1.50 1.16 -0.55 0.98 0.00 0.00 173.24 173.33 1zdi s SER 35 N -4.45 2.59 0.29 7.02 0.15 -1.26 -4.71 113.70 113.34 1zdi s SER 35 Ca 0.59 0.75 0.00 0.00 0.70 0.00 0.00 55.95 57.99 1zdi s SER 35 Cb -0.11 -1.14 0.00 0.00 -1.71 0.00 0.00 66.02 63.07 1zdi s SER 35 CO 0.48 -3.10 0.00 0.59 1.20 0.00 0.00 173.24 172.41 1zdi n ASN 36 N -4.09 -1.52 -4.61 5.45 3.02 -1.26 -4.80 115.26 107.44 1zdi n ASN 36 Ca 0.10 0.00 -0.61 0.00 -0.03 0.00 0.00 54.58 54.04 1zdi n ASN 36 Cb 0.59 0.00 -0.08 0.00 -0.61 0.00 0.00 39.78 39.68 1zdi n ASN 36 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1zdi n SER 37 N -0.32 0.78 0.26 6.41 7.64 -1.26 -4.78 113.62 122.36 1zdi n SER 37 Ca 0.00 1.16 0.09 0.00 1.01 0.00 0.00 58.87 61.13 1zdi n SER 37 Cb 0.00 -0.95 0.68 0.00 -1.01 0.00 0.00 64.21 62.92 1zdi n SER 37 CO 0.00 0.00 0.00 -0.09 -3.01 0.00 0.00 175.04 171.94 1zdi h ARG 38 N 4.20 0.00 -0.17 1.43 9.65 -1.90 -1.37 114.38 126.23 1zdi h ARG 38 Ca -0.48 0.00 -0.04 0.00 -1.10 0.00 0.00 59.98 58.36 1zdi h ARG 38 Cb 1.39 0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 29.96 1zdi h ARG 38 CO 0.80 0.00 -0.07 0.66 2.80 0.00 0.00 179.97 184.16 1zdi h SER 39 N 0.00 0.23 -0.38 -3.80 4.64 -1.87 -2.82 113.55 109.55 1zdi h SER 39 Ca -0.00 -0.04 0.00 0.00 -0.47 0.00 0.00 61.79 61.28 1zdi h SER 39 Cb 0.00 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 62.03 1zdi h SER 39 CO 0.00 0.34 0.00 0.00 -0.87 0.00 0.00 176.83 176.30 1zdi n GLN 40 N -4.32 3.17 -2.86 4.77 6.02 -0.55 -3.89 117.38 119.73 1zdi n GLN 40 Ca -0.01 -2.61 -0.29 0.00 -0.01 0.00 0.00 57.00 54.08 1zdi n GLN 40 Cb 0.23 -1.69 -0.02 0.00 1.02 0.00 0.00 30.24 29.77 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 -2.03 3.39 0.39 -1.58 0.00 -1.00 -4.81 121.76 116.11 1zdi s ALA 41 Ca 0.38 -0.32 -0.12 0.00 0.00 0.00 0.00 51.96 51.90 1zdi s ALA 41 Cb 0.27 -2.63 -0.07 0.00 0.00 0.00 0.00 23.12 20.69 1zdi s ALA 41 CO 0.15 -0.06 0.78 0.71 0.00 0.00 0.00 175.76 177.33 1zdi s TYR 42 N -2.43 3.44 -0.05 0.00 1.51 -1.26 -4.59 117.35 113.97 1zdi s TYR 42 Ca 0.49 1.13 -0.04 0.00 -1.01 0.00 0.00 57.07 57.64 1zdi s TYR 42 Cb -0.10 -2.50 0.01 0.00 -0.11 0.00 0.00 41.96 39.26 1zdi s TYR 42 CO 0.34 -0.06 0.12 0.21 -1.11 0.00 0.00 175.55 175.05 1zdi s LYS 43 N -3.60 0.13 -0.03 -0.62 2.20 -1.14 -1.83 119.74 114.86 1zdi s LYS 43 Ca 0.53 0.19 0.02 0.00 -0.36 0.00 0.00 55.97 56.35 1zdi s LYS 43 Cb -0.10 0.04 0.01 0.00 -1.51 0.00 0.00 37.83 36.26 1zdi s LYS 43 CO 0.27 -0.03 -0.07 0.08 -0.36 0.00 0.00 175.35 175.24 1zdi s VAL 44 N 0.20 0.64 0.08 4.02 1.01 -0.33 -1.50 120.40 124.53 1zdi s VAL 44 Ca -0.01 -0.26 0.04 0.00 0.00 0.00 0.00 61.98 61.75 1zdi s VAL 44 Cb -0.02 -0.60 -0.03 0.00 0.00 0.00 0.00 36.38 35.73 1zdi s VAL 44 CO -0.01 0.22 -0.11 0.42 0.00 0.00 0.00 175.10 175.62 1zdi s THR 45 N 0.40 0.96 -0.08 3.92 -4.23 -0.56 -0.56 115.64 115.49 1zdi s THR 45 Ca -0.06 -1.49 -0.17 0.00 -1.18 0.00 0.00 61.69 58.80 1zdi s THR 45 Cb -0.10 -1.20 0.04 0.00 1.34 0.00 0.00 72.50 72.58 1zdi s THR 45 CO 0.00 -0.44 0.41 0.00 -0.54 0.00 0.00 174.62 174.05 1zdi s SER 47 N -0.65 -0.40 0.09 0.00 1.04 -0.78 -0.95 113.70 112.05 1zdi s SER 47 Ca -0.07 0.16 0.07 0.00 0.48 0.00 0.00 55.95 56.58 1zdi s SER 47 Cb -0.04 0.46 -0.03 0.00 0.10 0.00 0.00 66.02 66.52 1zdi s SER 47 CO 0.03 -0.68 -0.18 -0.69 0.98 0.00 0.00 173.24 172.71 1zdi s VAL 48 N -2.28 1.44 0.01 5.02 1.01 -1.26 -1.64 120.40 122.71 1zdi s VAL 48 Ca -0.06 -1.43 -0.25 0.00 0.00 0.00 0.00 61.98 60.24 1zdi s VAL 48 Cb -0.01 -1.34 0.06 0.00 0.00 0.00 0.00 36.38 35.09 1zdi s VAL 48 CO -0.01 -0.13 0.56 0.00 0.00 0.00 0.00 175.10 175.52 1zdi s ARG 49 N -1.83 1.02 -0.71 2.72 1.70 -0.83 -4.96 118.95 116.06 1zdi s ARG 49 Ca 0.03 -0.07 -0.25 0.00 -0.47 0.00 0.00 55.73 54.96 1zdi s ARG 49 Cb -0.10 0.47 0.05 0.00 -0.57 0.00 0.00 34.95 34.80 1zdi s ARG 49 CO 0.03 -0.35 1.16 -1.14 -1.08 0.00 0.00 175.30 173.92 1zdi s GLN 50 N -1.97 3.16 0.39 3.89 2.00 -1.26 0.44 119.66 126.31 1zdi s GLN 50 Ca -0.08 -0.46 0.13 0.00 -2.00 0.00 0.00 55.36 52.96 1zdi s GLN 50 Cb -0.01 -4.20 0.79 0.00 0.80 0.00 0.00 33.01 30.40 1zdi s GLN 50 CO 0.02 -2.02 1.87 0.66 -0.50 0.00 0.00 175.29 175.32 1zdi h SER 51 N 9.85 0.00 -1.17 6.67 4.64 -1.04 -3.47 113.55 129.03 1zdi h SER 51 Ca -0.28 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.04 1zdi h SER 51 Cb 1.06 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.15 1zdi h SER 51 CO 1.24 0.33 0.00 -1.54 -0.87 0.00 0.00 176.83 175.99 1zdi n SER 52 N -4.13 -0.00 -0.08 4.97 3.41 -1.05 -4.97 113.62 111.78 1zdi n SER 52 Ca -0.02 -1.00 -0.01 0.00 -0.26 0.00 0.00 58.87 57.58 1zdi n SER 52 Cb 0.37 0.00 0.25 0.00 -0.26 0.00 0.00 64.21 64.57 1zdi n SER 52 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1zdi h ALA 53 N 1.83 1.32 -0.00 7.33 0.00 -2.03 -3.11 119.26 124.60 1zdi h ALA 53 Ca -0.00 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.73 1zdi h ALA 53 Cb 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.60 1zdi h ALA 53 CO 0.00 0.48 -0.77 1.04 0.00 0.00 0.00 179.25 180.01 1zdi n GLN 54 N -4.30 1.38 -4.45 0.00 6.02 -1.26 -4.91 117.38 109.87 1zdi n GLN 54 Ca 0.03 -0.08 -0.30 0.00 -0.01 0.00 0.00 57.00 56.64 1zdi n GLN 54 Cb 0.21 -1.31 -0.12 0.00 1.02 0.00 0.00 30.24 30.04 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 -2.56 3.71 0.04 1.08 0.01 -1.18 0.79 114.94 116.83 1zdi s ASN 55 Ca 0.07 -0.57 0.07 0.00 -0.71 0.00 0.00 52.86 51.73 1zdi s ASN 55 Cb 0.13 -0.48 -0.03 0.00 0.41 0.00 0.00 41.25 41.28 1zdi s ASN 55 CO 0.68 0.20 -0.18 -0.13 -1.51 0.00 0.00 177.10 176.16 1zdi s ARG 56 N -1.89 2.08 -0.04 -0.60 0.52 -0.86 -0.43 118.95 117.72 1zdi s ARG 56 Ca 0.16 -0.97 0.01 0.00 -0.52 0.00 0.00 55.73 54.41 1zdi s ARG 56 Cb -0.10 -2.18 0.02 0.00 0.52 0.00 0.00 34.95 33.20 1zdi s ARG 56 CO 0.08 0.54 -0.06 0.21 0.02 0.00 0.00 175.30 176.08 1zdi s LYS 57 N -1.38 0.99 -0.09 3.54 2.20 0.17 -1.53 119.74 123.65 1zdi s LYS 57 Ca 0.14 -0.19 -0.05 0.00 -0.36 0.00 0.00 55.97 55.52 1zdi s LYS 57 Cb -0.10 -0.93 -0.04 0.00 -1.51 0.00 0.00 37.83 35.25 1zdi s LYS 57 CO 0.05 -0.03 0.11 0.71 -0.36 0.00 0.00 175.35 175.83 1zdi s TYR 58 N 0.74 3.48 -0.19 4.03 1.51 0.12 -1.97 117.35 125.07 1zdi s TYR 58 Ca -0.11 0.41 0.01 0.00 -1.01 0.00 0.00 57.07 56.36 1zdi s TYR 58 Cb -0.14 -1.88 0.04 0.00 -0.11 0.00 0.00 41.96 39.88 1zdi s TYR 58 CO 0.01 0.66 -0.09 0.99 -1.11 0.00 0.00 175.55 176.01 1zdi s THR 59 N -1.06 1.50 0.01 -0.71 2.01 -0.65 -1.38 115.64 115.37 1zdi s THR 59 Ca 0.17 -0.94 0.07 0.00 0.31 0.00 0.00 61.69 61.30 1zdi s THR 59 Cb -0.12 -1.62 -0.03 0.00 0.01 0.00 0.00 72.50 70.74 1zdi s THR 59 CO 0.07 0.13 -0.21 -0.63 -0.69 0.00 0.00 174.62 173.29 1zdi s ILE 60 N 1.45 2.54 0.00 1.82 -1.09 -0.39 -1.87 121.20 123.67 1zdi s ILE 60 Ca -0.01 -1.13 0.01 0.00 -2.23 0.00 0.00 60.65 57.29 1zdi s ILE 60 Cb -0.16 -2.00 -0.01 0.00 -1.58 0.00 0.00 42.46 38.71 1zdi s ILE 60 CO -0.08 0.44 -0.03 -0.54 -1.23 0.00 0.00 174.94 173.50 1zdi s LYS 61 N -1.09 0.24 0.00 2.79 1.02 -0.64 -0.97 119.74 121.10 1zdi s LYS 61 Ca 0.12 -0.20 0.01 0.00 0.02 0.00 0.00 55.97 55.92 1zdi s LYS 61 Cb -0.10 -0.17 -0.01 0.00 -0.52 0.00 0.00 37.83 37.03 1zdi s LYS 61 CO 0.02 0.04 -0.04 0.08 -0.92 0.00 0.00 175.35 174.54 1zdi s VAL 62 N -0.31 0.26 -0.07 3.17 1.01 -0.60 -1.50 120.40 122.35 1zdi s VAL 62 Ca -0.02 -0.30 0.02 0.00 0.00 0.00 0.00 61.98 61.68 1zdi s VAL 62 Cb -0.03 -0.25 0.02 0.00 0.00 0.00 0.00 36.38 36.12 1zdi s VAL 62 CO -0.00 -0.03 -0.11 -1.61 0.00 0.00 0.00 175.10 173.35 1zdi s GLU 63 N -0.35 1.65 -0.24 2.72 2.02 -0.56 -0.94 118.70 122.99 1zdi s GLU 63 Ca -0.02 -0.37 -0.01 0.00 0.02 0.00 0.00 54.97 54.59 1zdi s GLU 63 Cb -0.03 -1.43 0.03 0.00 0.10 0.00 0.00 34.13 32.80 1zdi s GLU 63 CO -0.00 -0.04 -0.07 0.08 0.02 0.00 0.00 175.26 175.25 1zdi s VAL 64 N 0.88 2.84 0.44 2.63 1.01 -1.05 -2.90 120.40 124.25 1zdi s VAL 64 Ca -0.11 -1.02 -0.06 0.00 0.00 0.00 0.00 61.98 60.79 1zdi s VAL 64 Cb -0.15 -2.43 -0.05 0.00 0.00 0.00 0.00 36.38 33.75 1zdi s VAL 64 CO 0.01 0.22 0.75 -2.16 0.00 0.00 0.00 175.10 173.92 1zdi s PRO 65 N 1.32 3.61 -0.49 2.72 0.04 -1.26 -1.69 135.00 139.26 1zdi s PRO 65 Ca 0.00 0.24 -0.09 0.00 0.04 0.00 0.00 61.00 61.20 1zdi s PRO 65 Cb -0.16 -2.41 0.12 0.00 0.04 0.00 0.00 34.50 32.09 1zdi s PRO 65 CO -0.05 -0.11 0.35 0.21 0.04 0.00 0.00 177.00 177.45 1zdi s LYS 66 N -4.37 2.48 0.13 4.56 2.47 -0.20 -4.98 119.74 119.83 1zdi s LYS 66 Ca 0.48 -1.83 -0.31 0.00 -1.56 0.00 0.00 55.97 52.74 1zdi s LYS 66 Cb -0.10 -3.91 -0.09 0.00 -1.46 0.00 0.00 37.83 32.26 1zdi s LYS 66 CO 0.39 -1.19 1.60 0.08 0.16 0.00 0.00 175.35 176.40 1zdi s VAL 67 N 1.23 2.78 0.22 4.02 1.01 -1.26 0.87 120.40 129.28 1zdi s VAL 67 Ca 0.07 0.46 -0.17 0.00 0.00 0.00 0.00 61.98 62.34 1zdi s VAL 67 Cb -0.25 -3.29 0.02 0.00 0.00 0.00 0.00 36.38 32.85 1zdi s VAL 67 CO -0.01 0.02 0.55 0.00 0.00 0.00 0.00 175.10 175.66 1zdi s ALA 68 N 1.73 -0.81 -0.13 5.51 0.00 -0.51 -4.76 121.76 122.79 1zdi s ALA 68 Ca 0.72 -0.41 -0.03 0.00 0.00 0.00 0.00 51.96 52.24 1zdi s ALA 68 Cb -0.42 0.91 -0.03 0.00 0.00 0.00 0.00 23.12 23.57 1zdi s ALA 68 CO 0.32 -0.86 -0.02 0.99 0.00 0.00 0.00 175.76 176.19 1zdi s THR 69 N -3.92 4.10 -0.14 0.00 2.01 -1.26 -0.69 115.64 115.75 1zdi s THR 69 Ca 0.13 -0.30 -0.06 0.00 0.31 0.00 0.00 61.69 61.77 1zdi s THR 69 Cb -0.02 -2.77 -0.04 0.00 0.01 0.00 0.00 72.50 69.68 1zdi s THR 69 CO 0.02 0.53 0.05 -1.58 -0.69 0.00 0.00 174.62 172.96 1zdi s GLN 70 N -0.12 3.58 -0.19 4.92 0.74 0.69 -4.92 119.66 124.37 1zdi s GLN 70 Ca 0.03 -0.33 0.01 0.00 0.05 0.00 0.00 55.36 55.13 1zdi s GLN 70 Cb -0.13 -3.07 0.03 0.00 1.10 0.00 0.00 33.01 30.94 1zdi s GLN 70 CO 0.02 0.49 -0.17 0.99 -0.55 0.00 0.00 175.29 176.08 1zdi s THR 71 N -0.26 1.93 -0.05 -0.34 2.01 -1.26 -0.77 115.64 116.89 1zdi s THR 71 Ca 0.08 -0.97 -0.01 0.00 0.31 0.00 0.00 61.69 61.10 1zdi s THR 71 Cb -0.12 -1.82 0.03 0.00 0.01 0.00 0.00 72.50 70.60 1zdi s THR 71 CO 0.02 0.42 0.02 -0.69 -0.69 0.00 0.00 174.62 173.69 1zdi s VAL 72 N 1.32 0.18 -1.92 3.82 1.01 -0.37 -4.79 120.40 119.65 1zdi s VAL 72 Ca 0.03 0.19 0.00 0.00 0.00 0.00 0.00 61.98 62.20 1zdi s VAL 72 Cb -0.14 -0.34 0.00 0.00 0.00 0.00 0.00 36.38 35.89 1zdi s VAL 72 CO -0.11 0.20 0.00 0.61 0.00 0.00 0.00 175.10 175.80 1zdi n GLY 73 N 4.86 0.55 1.96 4.51 0.00 -1.26 -0.46 105.19 115.35 1zdi n GLY 73 Ca -0.12 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 45.87 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 -0.79 1.60 3.56 -0.02 0.00 -1.26 -5.01 105.19 103.27 1zdi n GLY 74 Ca -0.23 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.39 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 -2.86 5.22 -0.15 1.61 1.01 0.39 -5.07 120.40 120.54 1zdi s VAL 75 Ca 0.00 0.09 -0.06 0.00 0.00 0.00 0.00 61.98 62.00 1zdi s VAL 75 Cb 0.00 -3.73 -0.04 0.00 0.00 0.00 0.00 36.38 32.61 1zdi s VAL 75 CO 0.00 0.02 0.06 -1.83 0.00 0.00 0.00 175.10 173.35 1zdi s GLU 76 N 1.92 3.71 0.13 2.72 -1.05 -1.26 -1.23 118.70 123.64 1zdi s GLU 76 Ca 0.10 -0.32 0.10 0.00 -0.15 0.00 0.00 54.97 54.70 1zdi s GLU 76 Cb -0.17 -3.13 -0.04 0.00 -0.44 0.00 0.00 34.13 30.36 1zdi s GLU 76 CO 0.11 0.44 -0.24 -0.51 0.95 0.00 0.00 175.26 176.01 1zdi s LEU 77 N -0.09 2.33 -0.14 1.83 1.43 0.05 -4.93 118.68 119.15 1zdi s LEU 77 Ca 0.07 -0.74 -0.29 0.00 -1.03 0.00 0.00 54.13 52.13 1zdi s LEU 77 Cb -0.12 -1.06 -0.01 0.00 0.03 0.00 0.00 46.19 45.03 1zdi s LEU 77 CO 0.01 0.11 1.05 -2.84 0.23 0.00 0.00 176.35 174.92 1zdi s PRO 78 N -2.09 4.35 0.34 1.29 0.02 -1.26 -0.22 135.00 137.42 1zdi s PRO 78 Ca 0.12 1.43 0.05 0.00 0.02 0.00 0.00 61.00 62.62 1zdi s PRO 78 Cb -0.10 -3.59 -0.03 0.00 0.02 0.00 0.00 34.50 30.81 1zdi s PRO 78 CO 0.06 -0.45 0.22 0.14 -0.33 0.00 0.00 177.00 176.64 1zdi s VAL 79 N 2.49 0.16 -0.24 3.83 -7.23 0.14 -4.70 120.40 114.85 1zdi s VAL 79 Ca 0.48 -2.00 -0.03 0.00 -1.81 0.00 0.00 61.98 58.62 1zdi s VAL 79 Cb -0.18 -2.46 0.01 0.00 0.56 0.00 0.00 36.38 34.31 1zdi s VAL 79 CO 0.14 0.00 -0.04 0.00 -0.31 0.00 0.00 175.10 174.89 1zdi s ALA 80 N -3.46 2.78 0.36 1.32 0.00 -1.25 -1.42 121.76 120.09 1zdi s ALA 80 Ca 0.36 -1.33 0.08 0.00 0.00 0.00 0.00 51.96 51.08 1zdi s ALA 80 Cb 0.03 -1.73 0.81 0.00 0.00 0.00 0.00 23.12 22.23 1zdi s ALA 80 CO 0.23 -0.64 1.90 0.00 0.00 0.00 0.00 175.76 177.24 1zdi h ALA 81 N 8.08 1.81 -2.59 0.00 0.00 0.18 -3.46 119.26 123.28 1zdi h ALA 81 Ca -0.37 0.00 0.13 0.00 0.00 0.00 0.00 54.91 54.68 1zdi h ALA 81 Cb 1.13 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.75 1zdi h ALA 81 CO 0.59 -0.00 0.52 1.67 0.00 0.00 0.00 179.25 182.03 1zdi s TRP 82 N -5.66 0.06 -0.06 0.00 1.48 -1.25 -5.00 118.94 108.51 1zdi s TRP 82 Ca -0.10 -0.50 -0.09 0.00 -1.06 0.00 0.00 56.10 54.36 1zdi s TRP 82 Cb 0.21 0.72 0.02 0.00 -1.16 0.00 0.00 33.47 33.26 1zdi s TRP 82 CO 0.78 -1.02 0.22 1.03 -4.06 0.00 0.00 176.95 173.90 1zdi s ARG 83 N -2.31 0.37 0.10 3.25 0.52 -1.26 -1.03 118.95 118.58 1zdi s ARG 83 Ca 0.20 0.11 -0.09 0.00 -0.52 0.00 0.00 55.73 55.42 1zdi s ARG 83 Cb -0.03 0.17 -0.06 0.00 0.52 0.00 0.00 34.95 35.55 1zdi s ARG 83 CO 0.06 -0.07 0.41 -1.12 0.02 0.00 0.00 175.30 174.60 1zdi s SER 84 N -0.38 6.63 -0.18 0.23 0.01 -0.68 -4.95 113.70 114.37 1zdi s SER 84 Ca -0.05 0.79 0.01 0.00 1.31 0.00 0.00 55.95 58.01 1zdi s SER 84 Cb -0.03 -2.18 0.03 0.00 0.21 0.00 0.00 66.02 64.06 1zdi s SER 84 CO 0.01 0.14 -0.13 -0.31 0.41 0.00 0.00 173.24 173.37 1zdi s TYR 85 N -1.45 2.43 -0.16 2.43 1.51 -1.26 -2.51 117.35 118.33 1zdi s TYR 85 Ca 0.35 -1.52 -0.07 0.00 -1.01 0.00 0.00 57.07 54.81 1zdi s TYR 85 Cb -0.14 -1.67 -0.04 0.00 -0.11 0.00 0.00 41.96 40.00 1zdi s TYR 85 CO 0.19 -0.74 0.08 -1.17 -1.11 0.00 0.00 175.55 172.81 1zdi s LEU 86 N 1.40 3.99 -0.07 -1.29 2.96 -0.12 -4.98 118.68 120.57 1zdi s LEU 86 Ca 0.01 0.20 0.00 0.00 -0.22 0.00 0.00 54.13 54.12 1zdi s LEU 86 Cb -0.15 -2.00 0.02 0.00 0.50 0.00 0.00 46.19 44.57 1zdi s LEU 86 CO -0.09 0.25 -0.04 0.20 -1.32 0.00 0.00 176.35 175.34 1zdi s ASN 87 N -0.05 1.43 0.02 3.68 0.01 -1.26 -1.56 114.94 117.21 1zdi s ASN 87 Ca 0.08 -0.16 0.03 0.00 -0.71 0.00 0.00 52.86 52.09 1zdi s ASN 87 Cb -0.12 -0.55 -0.01 0.00 0.41 0.00 0.00 41.25 40.98 1zdi s ASN 87 CO 0.01 -0.10 -0.08 0.00 -1.51 0.00 0.00 177.10 175.41 1zdi s MET 88 N 1.37 0.59 -0.09 -0.60 0.23 -0.15 -5.00 119.30 115.65 1zdi s MET 88 Ca -0.04 -0.50 0.03 0.00 -1.03 0.00 0.00 55.69 54.15 1zdi s MET 88 Cb -0.13 -0.50 0.01 0.00 -1.53 0.00 0.00 34.83 32.68 1zdi s MET 88 CO -0.03 0.12 -0.17 -1.21 -2.03 0.00 0.00 175.02 171.71 1zdi s GLU 89 N -0.82 2.27 -0.16 3.16 2.02 -1.26 -1.27 118.70 122.65 1zdi s GLU 89 Ca -0.02 -0.60 0.01 0.00 0.02 0.00 0.00 54.97 54.37 1zdi s GLU 89 Cb -0.06 -1.83 0.02 0.00 0.10 0.00 0.00 34.13 32.36 1zdi s GLU 89 CO 0.00 0.04 -0.17 -1.17 0.02 0.00 0.00 175.26 173.99 1zdi s LEU 90 N 0.67 1.89 -0.21 1.80 2.96 -0.48 -4.95 118.68 120.36 1zdi s LEU 90 Ca -0.13 -0.56 -0.09 0.00 -0.22 0.00 0.00 54.13 53.12 1zdi s LEU 90 Cb -0.16 -1.32 -0.05 0.00 0.50 0.00 0.00 46.19 45.16 1zdi s LEU 90 CO 0.04 -0.03 0.11 -0.89 -1.32 0.00 0.00 176.35 174.26 1zdi s THR 91 N 1.39 5.12 -0.14 3.68 2.01 -1.26 -0.70 115.64 125.74 1zdi s THR 91 Ca 0.05 0.09 -0.01 0.00 0.31 0.00 0.00 61.69 62.13 1zdi s THR 91 Cb -0.13 -3.35 0.04 0.00 0.01 0.00 0.00 72.50 69.07 1zdi s THR 91 CO -0.12 0.41 -0.01 -0.63 -0.69 0.00 0.00 174.62 173.58 1zdi s ILE 92 N 0.69 0.69 0.61 1.82 1.01 -0.58 -4.99 121.20 120.44 1zdi s ILE 92 Ca 0.06 -0.33 -0.19 0.00 0.00 0.00 0.00 60.65 60.19 1zdi s ILE 92 Cb -0.13 -0.94 -0.03 0.00 0.01 0.00 0.00 42.46 41.36 1zdi s ILE 92 CO 0.01 0.09 1.13 -2.65 0.00 0.00 0.00 174.94 173.52 1zdi n PRO 93 N 5.02 1.06 0.00 2.79 -0.02 -1.26 -2.03 135.00 140.55 1zdi n PRO 93 Ca -0.09 0.41 0.06 0.00 -2.02 0.00 0.00 63.50 61.85 1zdi n PRO 93 Cb 0.48 -2.34 0.31 0.00 -0.02 0.00 0.00 33.50 31.94 1zdi n PRO 93 CO 0.00 0.00 0.00 0.44 1.98 0.00 0.00 175.50 177.92 1zdi n ILE 94 N -1.72 0.43 1.04 4.25 -5.35 0.24 -1.68 119.36 116.57 1zdi n ILE 94 Ca 0.14 0.11 0.13 0.00 -0.27 0.00 0.00 62.75 62.86 1zdi n ILE 94 Cb 0.47 -0.92 0.40 0.00 -1.74 0.00 0.00 39.64 37.85 1zdi n ILE 94 CO 0.00 0.00 0.00 0.49 -1.76 0.00 0.00 176.55 175.28 1zdi n PHE 95 N -1.17 0.00 -2.24 4.28 3.72 -1.26 -4.85 117.46 115.93 1zdi n PHE 95 Ca 0.07 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 57.04 1zdi n PHE 95 Cb 0.07 -0.32 -0.03 0.00 -0.94 0.00 0.00 39.48 38.26 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 -2.94 3.58 0.92 4.37 0.00 -0.68 -5.02 121.76 121.99 1zdi s ALA 96 Ca 0.14 0.84 -0.10 0.00 0.00 0.00 0.00 51.96 52.83 1zdi s ALA 96 Cb 0.18 -3.60 0.17 0.00 0.00 0.00 0.00 23.12 19.87 1zdi s ALA 96 CO 0.62 -0.95 1.05 0.25 0.00 0.00 0.00 175.76 176.73 1zdi n THR 97 N 4.76 0.00 0.11 0.00 -2.24 -1.26 -4.86 114.28 110.79 1zdi n THR 97 Ca 0.13 -0.96 -0.00 0.00 -2.27 0.00 0.00 64.05 60.95 1zdi n THR 97 Cb 0.44 -1.43 0.29 0.00 -2.10 0.00 0.00 70.33 67.53 1zdi n THR 97 CO 0.00 0.00 0.00 0.78 -0.57 0.00 0.00 175.07 175.28 1zdi h ASN 98 N -1.23 0.21 -0.60 3.42 4.21 -1.99 -2.44 115.58 117.16 1zdi h ASN 98 Ca -0.34 -0.07 -0.09 0.00 1.21 0.00 0.00 56.30 57.00 1zdi h ASN 98 Cb 1.01 -0.06 -0.02 0.00 -1.12 0.00 0.00 38.32 38.13 1zdi h ASN 98 CO 0.27 0.53 0.01 0.28 -1.29 0.00 0.00 177.43 177.23 1zdi h SER 99 N 0.18 1.03 -0.75 5.81 0.02 -2.00 -1.79 113.55 116.05 1zdi h SER 99 Ca 0.02 -0.30 -0.05 0.00 -0.84 0.00 0.00 61.79 60.63 1zdi h SER 99 Cb 0.67 -0.28 -0.03 0.00 0.14 0.00 0.00 62.40 62.90 1zdi h SER 99 CO 0.05 1.07 0.28 0.44 -1.14 0.00 0.00 176.83 177.53 1zdi h ASP 100 N 0.95 1.06 -0.08 3.07 3.32 -1.85 -2.65 116.42 120.24 1zdi h ASP 100 Ca 0.17 -0.19 -0.08 0.00 0.02 0.00 0.00 57.03 56.96 1zdi h ASP 100 Cb 0.54 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.80 1zdi h ASP 100 CO 0.03 0.96 -0.17 0.00 -1.72 0.00 0.00 179.24 178.34 1zdi h GLU 102 N 0.41 0.22 -0.32 0.00 5.08 -1.08 -1.58 114.58 117.32 1zdi h GLU 102 Ca 0.07 -0.10 -0.18 0.00 -1.00 0.00 0.00 59.36 58.15 1zdi h GLU 102 Cb 0.53 -0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.78 1zdi h GLU 102 CO 0.03 0.60 -0.49 1.25 -1.00 0.00 0.00 179.01 179.40 1zdi h LEU 103 N 0.18 0.98 -0.86 1.33 5.85 -1.11 -1.65 115.31 120.03 1zdi h LEU 103 Ca 0.02 -0.51 -0.02 0.00 0.84 0.00 0.00 57.88 58.20 1zdi h LEU 103 Cb 0.82 -0.28 -0.04 0.00 0.37 0.00 0.00 40.66 41.53 1zdi h LEU 103 CO 0.06 1.30 0.45 0.40 -0.34 0.00 0.00 178.44 180.32 1zdi h ILE 104 N 0.68 1.25 -0.40 4.05 2.04 -1.04 -1.53 117.51 122.56 1zdi h ILE 104 Ca 0.03 -0.65 -0.10 0.00 1.00 0.00 0.00 64.86 65.14 1zdi h ILE 104 Cb 1.10 0.12 -0.02 0.00 -0.74 0.00 0.00 36.82 37.28 1zdi h ILE 104 CO 0.11 0.29 -0.15 0.58 0.00 0.00 0.00 178.15 178.98 1zdi h VAL 105 N 1.20 1.26 -0.07 1.67 2.07 -1.11 -2.55 116.25 118.73 1zdi h VAL 105 Ca 0.30 -1.22 -0.10 0.00 0.82 0.00 0.00 66.70 66.50 1zdi h VAL 105 Cb 0.05 1.12 -0.01 0.00 -1.52 0.00 0.00 31.29 30.93 1zdi h VAL 105 CO -0.05 0.41 -0.43 0.11 0.02 0.00 0.00 177.57 177.64 1zdi h LYS 106 N 0.67 0.16 -0.21 1.57 1.57 -0.86 -2.13 116.57 117.34 1zdi h LYS 106 Ca 0.11 -0.08 -0.09 0.00 -1.87 0.00 0.00 60.65 58.72 1zdi h LYS 106 Cb 0.63 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.93 1zdi h LYS 106 CO 0.04 0.56 -0.25 0.00 -0.57 0.00 0.00 179.45 179.24 1zdi h ALA 107 N 1.43 1.19 0.00 3.86 0.00 -0.92 -0.32 119.26 124.50 1zdi h ALA 107 Ca 0.01 -0.33 -0.22 0.00 0.00 0.00 0.00 54.91 54.37 1zdi h ALA 107 Cb 0.81 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.49 1zdi h ALA 107 CO 0.06 0.52 -0.94 0.52 0.00 0.00 0.00 179.25 179.42 1zdi h MET 108 N 0.35 0.40 -0.24 0.00 2.86 -1.12 -2.26 114.93 114.91 1zdi h MET 108 Ca 0.05 -0.43 -0.18 0.00 -2.06 0.00 0.00 59.70 57.08 1zdi h MET 108 Cb 0.63 0.12 -0.00 0.00 0.06 0.00 0.00 31.60 32.41 1zdi h MET 108 CO 0.05 1.10 -0.58 1.96 1.06 0.00 0.00 176.91 180.49 1zdi h GLN 109 N 0.22 0.78 -0.28 1.72 4.20 -1.20 -3.17 115.11 117.39 1zdi h GLN 109 Ca -0.08 -0.51 -0.11 0.00 0.06 0.00 0.00 58.65 58.01 1zdi h GLN 109 Cb 1.58 0.07 -0.01 0.00 0.30 0.00 0.00 27.48 29.41 1zdi h GLN 109 CO 0.16 1.14 -0.28 0.78 -0.67 0.00 0.00 178.83 179.96 1zdi h GLY 110 N 0.79 0.60 0.76 3.46 0.00 -1.07 -1.68 103.07 105.93 1zdi h GLY 110 Ca 0.00 -0.52 0.06 0.00 0.00 0.00 0.00 47.33 46.88 1zdi h GLY 110 CO 0.12 0.47 0.61 -2.00 0.00 0.00 0.00 176.54 175.74 1zdi h LEU 111 N 0.48 0.98 -2.44 3.11 5.85 -1.41 -2.91 115.31 118.97 1zdi h LEU 111 Ca 0.06 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.79 1zdi h LEU 111 Cb 0.73 -0.20 0.00 0.00 0.37 0.00 0.00 40.66 41.56 1zdi h LEU 111 CO 0.06 0.63 0.00 0.18 -0.34 0.00 0.00 178.44 178.97 1zdi n LEU 112 N -4.54 3.61 -4.77 2.25 4.77 -1.06 -4.27 117.00 113.00 1zdi n LEU 112 Ca 0.14 -1.63 -0.40 0.00 -0.03 0.00 0.00 56.01 54.10 1zdi n LEU 112 Cb 0.17 -0.32 0.00 0.00 -2.33 0.00 0.00 43.42 40.94 1zdi n LEU 112 CO 0.32 0.81 1.01 -0.75 -1.33 0.00 0.00 177.39 177.46 1zdi s LYS 113 N -1.36 3.86 0.17 3.23 2.20 -0.66 -4.74 119.74 122.43 1zdi s LYS 113 Ca 0.42 2.28 -0.34 0.00 -0.36 0.00 0.00 55.97 57.98 1zdi s LYS 113 Cb 0.24 -2.72 -0.15 0.00 -1.51 0.00 0.00 37.83 33.69 1zdi s LYS 113 CO 0.32 -0.63 1.44 -0.25 -0.36 0.00 0.00 175.35 175.88 1zdi n ASP 114 N 0.01 2.53 0.00 1.43 8.00 -1.26 -1.73 116.55 125.53 1zdi n ASP 114 Ca 0.04 1.11 0.00 0.00 0.71 0.00 0.00 54.79 56.65 1zdi n ASP 114 Cb 0.43 -1.36 0.00 0.00 -0.02 0.00 0.00 41.12 40.17 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 2.77 3.35 3.82 0.44 0.00 -1.26 -5.06 105.19 109.25 1zdi n GLY 115 Ca 0.16 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.85 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 -1.03 6.08 0.25 1.61 0.01 -0.70 -4.89 114.94 116.27 1zdi s ASN 116 Ca 0.00 1.71 -0.13 0.00 -0.71 0.00 0.00 52.86 53.73 1zdi s ASN 116 Cb 0.00 -2.52 0.34 0.00 0.41 0.00 0.00 41.25 39.48 1zdi s ASN 116 CO 0.00 -0.96 1.56 -0.65 -1.51 0.00 0.00 177.10 175.54 1zdi h PRO 117 N 0.54 -0.01 0.16 -0.60 0.11 -1.88 -2.73 132.00 127.58 1zdi h PRO 117 Ca -0.47 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.64 1zdi h PRO 117 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1zdi h PRO 117 CO 0.59 -0.01 -0.08 0.82 -0.21 0.00 0.00 178.00 179.12 1zdi h ILE 118 N -0.01 0.98 0.00 4.15 2.04 -1.93 -1.64 117.51 121.10 1zdi h ILE 118 Ca 0.40 -0.83 -0.02 0.00 1.00 0.00 0.00 64.86 65.41 1zdi h ILE 118 Cb 0.65 1.47 -0.00 0.00 -0.74 0.00 0.00 36.82 38.20 1zdi h ILE 118 CO -0.96 0.19 -0.09 1.55 0.00 0.00 0.00 178.15 178.84 1zdi h PRO 119 N -0.63 0.00 -0.14 2.37 0.13 -1.73 -2.55 132.00 129.45 1zdi h PRO 119 Ca -0.02 0.00 -0.22 0.00 -0.87 0.00 0.00 66.00 64.89 1zdi h PRO 119 Cb 0.47 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.61 1zdi h PRO 119 CO 0.04 0.09 -0.77 0.77 -0.23 0.00 0.00 178.00 177.90 1zdi h SER 120 N 0.00 0.85 -0.14 1.44 0.02 -1.39 -2.19 113.55 112.14 1zdi h SER 120 Ca -0.00 -0.55 -0.02 0.00 -0.84 0.00 0.00 61.79 60.37 1zdi h SER 120 Cb 0.27 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 62.55 1zdi h SER 120 CO 0.01 1.34 0.01 0.00 -1.14 0.00 0.00 176.83 177.05 1zdi h ALA 121 N 0.64 0.19 -0.03 3.77 0.00 -0.92 -3.17 119.26 119.74 1zdi h ALA 121 Ca -0.05 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.68 1zdi h ALA 121 Cb 1.38 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 19.12 1zdi h ALA 121 CO 0.15 -0.13 0.02 0.82 0.00 0.00 0.00 179.25 180.12 1zdi h ILE 122 N -0.01 1.02 0.00 0.00 2.04 -1.52 0.20 117.51 119.25 1zdi h ILE 122 Ca 0.04 -0.05 0.00 0.00 1.00 0.00 0.00 64.86 65.85 1zdi h ILE 122 Cb 0.34 1.00 0.00 0.00 -0.74 0.00 0.00 36.82 37.42 1zdi h ILE 122 CO 0.01 0.02 0.00 0.00 0.00 0.00 0.00 178.15 178.17 1zdi n ALA 123 N -2.11 1.24 -1.05 1.87 0.00 -0.82 -2.07 120.51 117.56 1zdi n ALA 123 Ca -0.06 -0.02 0.09 0.00 0.00 0.00 0.00 53.44 53.45 1zdi n ALA 123 Cb 0.04 -1.08 0.12 0.00 0.00 0.00 0.00 19.45 18.53 1zdi n ALA 123 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1zdi n ALA 124 N -1.49 2.23 -3.29 0.00 0.00 -0.93 -4.97 120.51 112.06 1zdi n ALA 124 Ca 0.01 -2.45 -0.24 0.00 0.00 0.00 0.00 53.44 50.77 1zdi n ALA 124 Cb 0.06 -0.36 0.03 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 -1.31 -5.35 -4.59 0.00 3.02 -0.88 -4.95 115.26 101.20 1zdi n ASN 125 Ca 0.14 -0.40 -0.29 0.00 -0.03 0.00 0.00 54.58 54.00 1zdi n ASN 125 Cb 0.62 -4.32 -0.09 0.00 -0.61 0.00 0.00 39.78 35.38 1zdi n ASN 125 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 1zdi s SER 126 N -2.85 3.66 0.00 6.41 0.01 0.66 -5.03 113.70 116.56 1zdi s SER 126 Ca 0.41 -1.53 0.00 0.00 1.31 0.00 0.00 55.95 56.14 1zdi s SER 126 Cb -0.19 0.14 0.00 0.00 0.21 0.00 0.00 66.02 66.17 1zdi s SER 126 CO 0.50 -0.70 0.00 0.61 0.41 0.00 0.00 173.24 174.07 1zdi n GLY 127 N -1.05 7.73 3.83 3.44 0.00 -1.26 -4.25 105.19 113.64 1zdi n GLY 127 Ca -0.11 -2.03 -0.38 0.00 0.00 0.00 0.00 46.02 43.50 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 0.97 4.95 0.00 -0.61 -1.09 -1.26 -4.79 121.20 119.37 1zdi s ILE 128 Ca 0.00 0.90 0.00 0.00 -2.23 0.00 0.00 60.65 59.32 1zdi s ILE 128 Cb 0.00 -3.75 0.00 0.00 -1.58 0.00 0.00 42.46 37.13 1zdi s ILE 128 CO 0.00 0.53 0.00 0.00 -1.23 0.00 0.00 174.94 174.24