#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pla s GLU 2 N 0.00 1.43 -0.20 0.00 2.02 -1.26 -2.52 118.70 118.17 1pla s GLU 2 Ca 0.00 -0.23 -0.03 0.00 0.02 0.00 0.00 54.97 54.73 1pla s GLU 2 Cb 0.00 -1.48 -0.01 0.00 0.10 0.00 0.00 34.13 32.74 1pla s GLU 2 CO 0.00 -0.23 -0.07 0.08 0.02 0.00 0.00 175.26 175.06 1pla s VAL 3 N 1.59 3.23 -0.32 2.63 1.01 -0.49 -4.39 120.40 123.65 1pla s VAL 3 Ca 0.02 -0.55 -0.17 0.00 0.00 0.00 0.00 61.98 61.28 1pla s VAL 3 Cb -0.13 -2.44 -0.01 0.00 0.00 0.00 0.00 36.38 33.80 1pla s VAL 3 CO -0.06 0.45 0.46 -0.54 0.00 0.00 0.00 175.10 175.41 1pla s LYS 4 N 1.23 3.74 -0.63 2.72 1.02 0.11 -0.05 119.74 127.88 1pla s LYS 4 Ca 0.03 -0.11 -0.27 0.00 0.02 0.00 0.00 55.97 55.64 1pla s LYS 4 Cb -0.14 -3.76 0.01 0.00 -0.52 0.00 0.00 37.83 33.42 1pla s LYS 4 CO -0.03 -0.51 1.46 -0.51 -0.92 0.00 0.00 175.35 174.84 1pla s LEU 5 N 2.25 3.30 0.00 3.17 1.43 0.93 -2.68 118.68 127.08 1pla s LEU 5 Ca 0.17 0.06 0.00 0.00 -1.03 0.00 0.00 54.13 53.33 1pla s LEU 5 Cb -0.16 -2.79 0.00 0.00 0.03 0.00 0.00 46.19 43.28 1pla s LEU 5 CO 0.12 -1.89 0.00 0.61 0.23 0.00 0.00 176.35 175.42 1pla n GLY 6 N 5.39 3.39 0.00 -3.19 0.00 -1.02 -2.96 105.19 106.80 1pla n GLY 6 Ca 0.11 -1.85 0.00 0.00 0.00 0.00 0.00 46.02 44.28 1pla n GLY 6 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1pla n SER 7 N 0.00 0.00 0.00 1.61 3.41 0.27 -4.69 113.62 114.22 1pla n SER 7 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 1pla n SER 7 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 1pla n SER 7 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1pla n ASP 8 N -0.76 0.00 0.00 4.04 8.00 -1.26 -4.93 116.55 121.63 1pla n ASP 8 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.50 1pla n ASP 8 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.10 1pla n ASP 8 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 1pla n ASP 9 N -0.25 0.00 0.00 -2.24 5.68 -1.26 -5.00 116.55 113.48 1pla n ASP 9 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.29 1pla n ASP 9 Cb 0.00 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 39.98 1pla n ASP 9 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1pla n GLY 10 N 0.00 1.03 3.09 6.12 0.00 -1.26 -5.11 105.19 109.07 1pla n GLY 10 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1pla n GLY 10 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1pla s GLY 11 N -2.00 -0.82 -0.54 -0.02 0.00 -1.26 -5.02 107.32 97.65 1pla s GLY 11 Ca 0.00 1.59 -0.16 0.00 0.00 0.00 0.00 44.72 46.15 1pla s GLY 11 CO 0.00 3.16 0.53 1.08 0.00 0.00 0.00 173.10 177.87 1pla s LEU 12 N 2.77 5.99 0.04 0.66 1.43 -1.26 0.97 118.68 129.28 1pla s LEU 12 Ca 0.18 -1.68 -0.13 0.00 -1.03 0.00 0.00 54.13 51.47 1pla s LEU 12 Cb -0.15 -2.23 0.02 0.00 0.03 0.00 0.00 46.19 43.86 1pla s LEU 12 CO -0.19 -0.88 0.30 0.68 0.23 0.00 0.00 176.35 176.48 1pla s VAL 13 N 1.80 0.08 -0.45 -1.59 -7.23 -1.26 -4.43 120.40 107.32 1pla s VAL 13 Ca 0.05 -0.69 -0.29 0.00 -1.81 0.00 0.00 61.98 59.24 1pla s VAL 13 Cb -0.28 -0.93 0.02 0.00 0.56 0.00 0.00 36.38 35.75 1pla s VAL 13 CO 0.04 -0.38 1.24 -0.36 -0.31 0.00 0.00 175.10 175.33 1pla s PHE 14 N -2.53 2.67 -0.31 2.82 0.08 -1.26 -2.43 117.98 117.02 1pla s PHE 14 Ca -0.05 0.70 -0.01 0.00 0.12 0.00 0.00 56.93 57.69 1pla s PHE 14 Cb -0.01 -4.39 0.06 0.00 -0.57 0.00 0.00 43.02 38.11 1pla s PHE 14 CO -0.03 -1.52 0.01 -1.12 -0.10 0.00 0.00 175.22 172.45 1pla s SER 15 N 2.98 4.89 1.29 1.36 0.01 -1.09 -0.85 113.70 122.29 1pla s SER 15 Ca 0.53 -1.35 -0.21 0.00 1.31 0.00 0.00 55.95 56.23 1pla s SER 15 Cb -0.09 -1.71 0.32 0.00 0.21 0.00 0.00 66.02 64.75 1pla s SER 15 CO 0.32 -0.28 1.04 -2.16 0.41 0.00 0.00 173.24 172.57 1pla s PRO 16 N 1.23 -1.92 -0.15 12.44 0.05 -1.26 0.06 135.00 145.45 1pla s PRO 16 Ca -0.04 -0.01 -0.13 0.00 0.05 0.00 0.00 61.00 60.87 1pla s PRO 16 Cb -0.20 -1.51 -0.04 0.00 0.05 0.00 0.00 34.50 32.80 1pla s PRO 16 CO -0.02 -4.18 -0.25 -1.13 0.05 0.00 0.00 177.00 171.47 1pla n SER 17 N -5.11 1.79 -4.25 6.66 3.41 -0.03 -4.86 113.62 111.23 1pla n SER 17 Ca 0.13 0.47 -0.31 0.00 -0.26 0.00 0.00 58.87 58.91 1pla n SER 17 Cb 0.60 -0.79 -0.16 0.00 -0.26 0.00 0.00 64.21 63.59 1pla n SER 17 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1pla s SER 18 N -5.73 2.91 -0.23 4.04 1.04 -1.26 -2.55 113.70 111.92 1pla s SER 18 Ca -0.21 -0.48 -0.23 0.00 0.48 0.00 0.00 55.95 55.51 1pla s SER 18 Cb 0.03 -0.79 0.06 0.00 0.10 0.00 0.00 66.02 65.42 1pla s SER 18 CO 0.31 0.23 0.64 0.72 0.98 0.00 0.00 173.24 176.12 1pla s PHE 19 N -0.14 -0.70 0.35 5.02 -0.71 -1.00 -5.00 117.98 115.81 1pla s PHE 19 Ca -0.03 1.67 -0.10 0.00 -1.04 0.00 0.00 56.93 57.42 1pla s PHE 19 Cb -0.13 0.25 -0.07 0.00 -1.21 0.00 0.00 43.02 41.86 1pla s PHE 19 CO 0.03 -0.36 0.70 0.95 -1.34 0.00 0.00 175.22 175.21 1pla s THR 20 N 0.23 4.83 0.07 -4.49 -4.23 -1.26 -2.18 115.64 108.60 1pla s THR 20 Ca -0.01 0.55 -0.08 0.00 -1.18 0.00 0.00 61.69 60.97 1pla s THR 20 Cb -0.04 -3.70 -0.01 0.00 1.34 0.00 0.00 72.50 70.09 1pla s THR 20 CO 0.01 -0.38 0.16 0.68 -0.54 0.00 0.00 174.62 174.56 1pla s VAL 21 N -2.19 0.15 0.40 2.29 -7.23 -0.66 -4.86 120.40 108.29 1pla s VAL 21 Ca 0.50 -1.19 -0.24 0.00 -1.81 0.00 0.00 61.98 59.23 1pla s VAL 21 Cb -0.10 -1.26 -0.09 0.00 0.56 0.00 0.00 36.38 35.49 1pla s VAL 21 CO 0.28 -0.66 1.05 0.00 -0.31 0.00 0.00 175.10 175.46 1pla s ALA 22 N -3.56 3.09 -0.72 1.32 0.00 -1.26 -1.56 121.76 119.06 1pla s ALA 22 Ca 0.03 0.71 -0.24 0.00 0.00 0.00 0.00 51.96 52.45 1pla s ALA 22 Cb 0.04 -3.28 -0.20 0.00 0.00 0.00 0.00 23.12 19.68 1pla s ALA 22 CO -0.09 -0.23 1.87 0.00 0.00 0.00 0.00 175.76 177.31 1pla n ALA 23 N -0.06 2.20 0.00 0.00 0.00 -0.86 -1.80 120.51 120.00 1pla n ALA 23 Ca 0.05 -3.03 0.00 0.00 0.00 0.00 0.00 53.44 50.46 1pla n ALA 23 Cb 0.49 -3.60 0.00 0.00 0.00 0.00 0.00 19.45 16.34 1pla n ALA 23 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1pla n GLY 24 N 5.04 0.00 3.95 0.00 0.00 -1.25 -4.88 105.19 108.05 1pla n GLY 24 Ca 0.47 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 46.25 1pla n GLY 24 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1pla s GLU 25 N 0.00 3.46 -0.11 1.61 2.12 -0.74 -5.06 118.70 119.98 1pla s GLU 25 Ca 0.00 -0.58 -0.14 0.00 0.36 0.00 0.00 54.97 54.62 1pla s GLU 25 Cb 0.00 -2.88 -0.05 0.00 0.26 0.00 0.00 34.13 31.46 1pla s GLU 25 CO 0.00 0.43 0.32 0.15 -0.54 0.00 0.00 175.26 175.62 1pla s LYS 26 N -3.62 4.06 -0.42 4.30 -0.14 -1.26 -4.39 119.74 118.26 1pla s LYS 26 Ca 0.36 0.19 -0.09 0.00 -1.36 0.00 0.00 55.97 55.06 1pla s LYS 26 Cb -0.10 -3.34 0.08 0.00 -1.68 0.00 0.00 37.83 32.79 1pla s LYS 26 CO 0.30 0.43 0.26 0.42 -0.76 0.00 0.00 175.35 176.00 1pla s ILE 27 N -0.15 4.17 -0.30 2.17 1.01 -0.25 -2.59 121.20 125.24 1pla s ILE 27 Ca 0.19 -1.46 -0.11 0.00 0.00 0.00 0.00 60.65 59.28 1pla s ILE 27 Cb -0.14 -3.58 -0.03 0.00 0.01 0.00 0.00 42.46 38.72 1pla s ILE 27 CO 0.07 -0.53 0.19 0.42 0.00 0.00 0.00 174.94 175.09 1pla s THR 28 N 1.41 5.07 -0.45 2.92 -4.23 -1.05 -0.90 115.64 118.41 1pla s THR 28 Ca 0.03 -0.11 -0.21 0.00 -1.18 0.00 0.00 61.69 60.22 1pla s THR 28 Cb -0.23 -3.51 0.03 0.00 1.34 0.00 0.00 72.50 70.12 1pla s THR 28 CO 0.02 0.13 0.68 -0.36 -0.54 0.00 0.00 174.62 174.55 1pla s PHE 29 N 1.71 3.04 -0.14 3.99 0.08 -0.13 -1.40 117.98 125.13 1pla s PHE 29 Ca 0.06 -0.03 -0.06 0.00 0.12 0.00 0.00 56.93 57.02 1pla s PHE 29 Cb -0.17 -3.43 -0.04 0.00 -0.57 0.00 0.00 43.02 38.81 1pla s PHE 29 CO 0.09 -0.91 0.07 0.21 -0.10 0.00 0.00 175.22 174.59 1pla s LYS 30 N 2.93 3.61 -0.55 0.44 2.20 0.92 -2.34 119.74 126.95 1pla s LYS 30 Ca 0.24 -0.29 -0.25 0.00 -0.36 0.00 0.00 55.97 55.31 1pla s LYS 30 Cb -0.14 -3.12 0.04 0.00 -1.51 0.00 0.00 37.83 33.10 1pla s LYS 30 CO 0.19 0.52 1.00 -0.80 -0.36 0.00 0.00 175.35 175.91 1pla s ASN 31 N -0.32 6.38 -0.06 1.43 -0.87 -1.05 -0.05 114.94 120.39 1pla s ASN 31 Ca 0.09 -0.21 0.15 0.00 -1.57 0.00 0.00 52.86 51.33 1pla s ASN 31 Cb -0.12 -2.47 -0.22 0.00 -0.02 0.00 0.00 41.25 38.43 1pla s ASN 31 CO 0.02 -1.28 0.53 -0.46 -2.57 0.00 0.00 177.10 173.33 1pla n ASN 32 N 7.69 0.59 0.00 -1.22 6.94 -1.16 -3.56 115.26 124.55 1pla n ASN 32 Ca 0.04 0.27 0.00 0.00 -0.02 0.00 0.00 54.58 54.87 1pla n ASN 32 Cb 0.48 0.38 0.00 0.00 -2.36 0.00 0.00 39.78 38.27 1pla n ASN 32 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1pla n ALA 33 N -2.56 0.00 0.00 -2.53 0.00 -1.18 -4.99 120.51 109.25 1pla n ALA 33 Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.25 1pla n ALA 33 Cb 1.01 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.46 1pla n ALA 33 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1pla n GLY 34 N -0.08 1.09 3.38 0.00 0.00 -1.26 -4.20 105.19 104.12 1pla n GLY 34 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 1pla n GLY 34 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 1pla n PHE 35 N -0.85 -1.43 -1.80 1.61 -1.74 -1.26 -4.69 117.46 107.29 1pla n PHE 35 Ca 0.00 0.20 -0.31 0.00 -0.56 0.00 0.00 57.45 56.79 1pla n PHE 35 Cb 0.00 -1.73 0.03 0.00 1.52 0.00 0.00 39.48 39.30 1pla n PHE 35 CO 0.00 0.00 0.00 -1.25 -0.56 0.00 0.00 176.76 174.95 1pla s PRO 36 N -3.60 3.16 0.38 3.97 0.04 -1.26 -5.09 135.00 132.60 1pla s PRO 36 Ca 0.57 0.70 0.04 0.00 0.04 0.00 0.00 61.00 62.34 1pla s PRO 36 Cb -0.19 -2.04 -0.05 0.00 0.04 0.00 0.00 34.50 32.26 1pla s PRO 36 CO 0.67 -0.87 0.06 -1.01 0.04 0.00 0.00 177.00 175.88 1pla s HIS 37 N -3.20 2.03 -0.23 0.56 3.76 -1.05 -4.98 115.29 112.18 1pla s HIS 37 Ca 0.57 -0.96 -0.06 0.00 -0.15 0.00 0.00 55.06 54.45 1pla s HIS 37 Cb -0.12 -1.40 0.11 0.00 1.11 0.00 0.00 32.58 32.28 1pla s HIS 37 CO 0.54 0.07 0.45 1.21 -0.85 0.00 0.00 174.74 176.15 1pla s ASN 38 N -3.61 -0.35 -0.16 1.40 2.47 -1.26 -3.16 114.94 110.27 1pla s ASN 38 Ca 0.30 0.92 -0.14 0.00 0.42 0.00 0.00 52.86 54.36 1pla s ASN 38 Cb 0.07 1.48 -0.05 0.00 -1.45 0.00 0.00 41.25 41.30 1pla s ASN 38 CO 0.14 -0.24 0.29 -0.63 -3.72 0.00 0.00 177.10 172.94 1pla s ILE 39 N 2.65 5.30 -0.05 -5.21 1.09 -1.26 -3.80 121.20 119.93 1pla s ILE 39 Ca 0.02 0.55 -0.04 0.00 -1.10 0.00 0.00 60.65 60.08 1pla s ILE 39 Cb -0.13 -3.63 0.02 0.00 -1.06 0.00 0.00 42.46 37.65 1pla s ILE 39 CO -0.15 0.38 0.12 -0.69 -0.10 0.00 0.00 174.94 174.51 1pla s VAL 40 N 0.53 -0.01 -0.30 2.92 1.01 -1.00 0.11 120.40 123.66 1pla s VAL 40 Ca 0.16 0.03 -0.13 0.00 0.00 0.00 0.00 61.98 62.04 1pla s VAL 40 Cb -0.13 -0.18 -0.03 0.00 0.00 0.00 0.00 36.38 36.03 1pla s VAL 40 CO 0.04 0.01 0.28 -0.36 0.00 0.00 0.00 175.10 175.07 1pla s PHE 41 N 0.22 3.23 -0.13 5.22 0.40 -1.26 -2.06 117.98 123.58 1pla s PHE 41 Ca -0.01 0.11 -0.36 0.00 -0.60 0.00 0.00 56.93 56.07 1pla s PHE 41 Cb -0.02 -2.50 -0.13 0.00 0.51 0.00 0.00 43.02 40.87 1pla s PHE 41 CO -0.01 -0.27 1.84 -3.47 0.70 0.00 0.00 175.22 174.01 1pla n ASP 42 N 5.20 3.14 0.00 1.36 2.03 -0.24 -4.79 116.55 123.26 1pla n ASP 42 Ca -0.11 1.00 0.10 0.00 0.52 0.00 0.00 54.79 56.30 1pla n ASP 42 Cb 0.51 -1.31 0.61 0.00 -0.72 0.00 0.00 41.12 40.21 1pla n ASP 42 CO 0.00 0.00 0.00 1.21 -1.92 0.00 0.00 177.20 176.49 1pla n GLU 43 N 6.21 0.68 -0.10 -0.67 2.13 -1.26 -2.32 120.64 125.31 1pla n GLU 43 Ca 0.24 0.00 0.07 0.00 0.66 0.00 0.00 57.16 58.13 1pla n GLU 43 Cb 0.25 -1.48 0.12 0.00 0.27 0.00 0.00 31.44 30.60 1pla n GLU 43 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 1pla n ASP 44 N -0.98 2.62 -2.77 4.31 8.00 -1.26 -4.60 116.55 121.87 1pla n ASP 44 Ca 0.16 -1.77 -0.10 0.00 0.71 0.00 0.00 54.79 53.79 1pla n ASP 44 Cb 0.07 -0.13 0.04 0.00 -0.02 0.00 0.00 41.12 41.09 1pla n ASP 44 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1pla n GLU 45 N 0.81 1.11 -4.05 -1.24 1.02 -0.98 -5.11 120.64 112.21 1pla n GLU 45 Ca 0.11 -2.84 -0.12 0.00 -0.02 0.00 0.00 57.16 54.29 1pla n GLU 45 Cb 0.41 -1.03 -0.12 0.00 -0.02 0.00 0.00 31.44 30.68 1pla n GLU 45 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1pla s VAL 46 N -1.97 0.41 0.45 2.62 1.01 -1.25 -2.63 120.40 119.04 1pla s VAL 46 Ca 0.28 -0.89 -0.22 0.00 0.00 0.00 0.00 61.98 61.14 1pla s VAL 46 Cb 0.41 -0.48 -0.11 0.00 0.00 0.00 0.00 36.38 36.21 1pla s VAL 46 CO -0.02 -0.33 0.74 -2.65 0.00 0.00 0.00 175.10 172.84 1pla n PRO 47 N 1.74 0.86 -2.37 2.72 -0.01 -1.26 -4.79 135.00 131.89 1pla n PRO 47 Ca -0.21 0.31 -0.37 0.00 -0.01 0.00 0.00 63.50 63.22 1pla n PRO 47 Cb 0.55 -1.77 -0.03 0.00 -0.01 0.00 0.00 33.50 32.25 1pla n PRO 47 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 175.50 175.49 1pla s ALA 48 N -1.43 2.63 0.00 3.55 0.00 -1.26 -3.20 121.76 122.06 1pla s ALA 48 Ca 0.65 -2.49 0.00 0.00 0.00 0.00 0.00 51.96 50.12 1pla s ALA 48 Cb -0.56 -4.64 0.00 0.00 0.00 0.00 0.00 23.12 17.93 1pla s ALA 48 CO 0.56 -4.09 0.00 0.41 0.00 0.00 0.00 175.76 172.65 1pla n GLY 49 N 5.81 1.75 3.53 0.00 0.00 -1.26 -5.08 105.19 109.94 1pla n GLY 49 Ca 0.45 -0.12 -0.42 0.00 0.00 0.00 0.00 46.02 45.93 1pla n GLY 49 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1pla s VAL 50 N 0.00 3.96 0.35 1.61 1.01 -1.19 -4.98 120.40 121.16 1pla s VAL 50 Ca 0.00 -0.24 -0.24 0.00 0.00 0.00 0.00 61.98 61.49 1pla s VAL 50 Cb 0.00 -4.92 -0.14 0.00 0.00 0.00 0.00 36.38 31.32 1pla s VAL 50 CO 0.00 -1.80 0.56 0.59 0.00 0.00 0.00 175.10 174.45 1pla n ASN 51 N 8.75 -0.83 -0.59 3.32 4.13 -1.26 -4.76 115.26 124.01 1pla n ASN 51 Ca 0.13 0.98 0.12 0.00 1.68 0.00 0.00 54.58 57.50 1pla n ASN 51 Cb 0.49 -1.08 0.24 0.00 -1.54 0.00 0.00 39.78 37.89 1pla n ASN 51 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1pla n ALA 52 N -0.54 2.86 0.03 5.41 0.00 -1.26 -4.14 120.51 122.88 1pla n ALA 52 Ca 0.12 -0.56 -0.16 0.00 0.00 0.00 0.00 53.44 52.85 1pla n ALA 52 Cb 0.36 -0.96 -0.14 0.00 0.00 0.00 0.00 19.45 18.71 1pla n ALA 52 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1pla h GLU 53 N 2.91 0.19 -0.20 0.00 5.08 -1.91 -2.45 114.58 118.20 1pla h GLU 53 Ca 0.00 -0.32 -0.11 0.00 -1.00 0.00 0.00 59.36 57.92 1pla h GLU 53 Cb 0.72 0.12 -0.01 0.00 0.50 0.00 0.00 28.75 30.08 1pla h GLU 53 CO 0.00 1.00 -0.37 0.87 -1.00 0.00 0.00 179.01 179.51 1pla h LYS 54 N 0.05 0.43 0.00 2.33 1.57 -1.96 -3.18 116.57 115.81 1pla h LYS 54 Ca -0.28 -0.20 -0.28 0.00 -1.87 0.00 0.00 60.65 58.02 1pla h LYS 54 Cb 2.01 -0.01 -0.05 0.00 0.08 0.00 0.00 32.23 34.26 1pla h LYS 54 CO 0.13 0.74 -1.67 -0.84 -0.57 0.00 0.00 179.45 177.24 1pla h ILE 55 N 0.37 0.84 -2.59 1.86 3.07 -1.74 -3.47 117.51 115.84 1pla h ILE 55 Ca 0.04 -2.66 -0.30 0.00 1.55 0.00 0.00 64.86 63.48 1pla h ILE 55 Cb 0.81 2.40 0.18 0.00 -0.27 0.00 0.00 36.82 39.94 1pla h ILE 55 CO 0.07 0.48 -0.15 -1.20 -1.05 0.00 0.00 178.15 176.30 1pla n SER 56 N -3.04 -3.83 -3.09 2.16 7.64 -0.92 -4.91 113.62 107.62 1pla n SER 56 Ca -0.16 -0.73 -0.19 0.00 1.01 0.00 0.00 58.87 58.80 1pla n SER 56 Cb 1.03 -0.85 -0.04 0.00 -1.01 0.00 0.00 64.21 63.34 1pla n SER 56 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1pla n GLN 57 N -4.95 0.59 0.00 1.43 6.02 0.12 -4.94 117.38 115.65 1pla n GLN 57 Ca 0.11 -2.77 0.02 0.00 -0.01 0.00 0.00 57.00 54.36 1pla n GLN 57 Cb 0.50 -1.39 0.10 0.00 1.02 0.00 0.00 30.24 30.46 1pla n GLN 57 CO 0.00 0.00 0.00 -2.30 -1.01 0.00 0.00 177.06 173.75 1pla n PRO 58 N 1.93 0.07 -3.32 -1.09 -0.02 -1.26 -4.24 135.00 127.06 1pla n PRO 58 Ca 0.20 0.20 -0.46 0.00 -2.02 0.00 0.00 63.50 61.42 1pla n PRO 58 Cb 0.54 -1.50 -0.05 0.00 -0.02 0.00 0.00 33.50 32.47 1pla n PRO 58 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 1pla s GLU 59 N -2.45 2.97 1.02 -0.52 2.02 -1.26 -5.06 118.70 115.42 1pla s GLU 59 Ca 0.04 -1.71 -0.18 0.00 0.02 0.00 0.00 54.97 53.14 1pla s GLU 59 Cb 0.02 -4.28 -0.02 0.00 0.10 0.00 0.00 34.13 29.95 1pla s GLU 59 CO 0.05 -1.32 -0.31 0.66 0.02 0.00 0.00 175.26 174.36 1pla n TYR 60 N 5.23 -2.23 -3.81 1.61 4.01 -1.26 -4.96 117.16 115.75 1pla n TYR 60 Ca -0.14 0.22 -0.13 0.00 -0.16 0.00 0.00 57.90 57.70 1pla n TYR 60 Cb 0.40 -1.57 -0.14 0.00 -0.31 0.00 0.00 39.34 37.72 1pla n TYR 60 CO 0.00 0.00 0.00 -0.48 -0.46 0.00 0.00 176.86 175.92 1pla s LEU 61 N 2.36 1.34 -0.29 7.72 0.05 -1.19 -5.03 118.68 123.64 1pla s LEU 61 Ca 0.49 0.19 0.18 0.00 0.05 0.00 0.00 54.13 55.04 1pla s LEU 61 Cb -0.12 0.26 0.49 0.00 -2.05 0.00 0.00 46.19 44.76 1pla s LEU 61 CO 0.70 -0.08 1.09 -0.46 -0.55 0.00 0.00 176.35 177.06 1pla n ASN 62 N 3.51 2.30 -4.64 1.48 0.23 -1.26 -2.54 115.26 114.33 1pla n ASN 62 Ca -0.18 -2.54 -0.35 0.00 -0.53 0.00 0.00 54.58 50.98 1pla n ASN 62 Cb 0.56 -0.46 -0.10 0.00 -2.08 0.00 0.00 39.78 37.70 1pla n ASN 62 CO 0.00 0.00 0.00 -0.83 -0.93 0.00 0.00 177.26 175.50 1pla s GLY 63 N -3.63 1.94 -0.50 4.83 0.00 -1.26 -4.99 107.32 103.71 1pla s GLY 63 Ca 0.32 -0.79 -0.29 0.00 0.00 0.00 0.00 44.72 43.97 1pla s GLY 63 CO -0.02 0.17 1.27 0.00 0.00 0.00 0.00 173.10 174.52 1pla s ALA 64 N 0.59 3.02 0.00 3.20 0.00 -1.26 -2.67 121.76 124.64 1pla s ALA 64 Ca 0.05 -0.51 0.00 0.00 0.00 0.00 0.00 51.96 51.50 1pla s ALA 64 Cb -0.13 -3.98 0.00 0.00 0.00 0.00 0.00 23.12 19.01 1pla s ALA 64 CO 0.01 -2.52 0.00 0.41 0.00 0.00 0.00 175.76 173.66 1pla n GLY 65 N 5.04 0.23 3.79 0.00 0.00 -1.23 -5.07 105.19 107.95 1pla n GLY 65 Ca 0.12 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.83 1pla n GLY 65 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1pla s GLU 66 N -0.98 2.77 0.14 1.61 2.56 -1.09 -4.76 118.70 118.96 1pla s GLU 66 Ca 0.00 1.18 -0.10 0.00 0.00 0.00 0.00 54.97 56.05 1pla s GLU 66 Cb 0.00 -1.96 0.00 0.00 2.00 0.00 0.00 34.13 34.17 1pla s GLU 66 CO 0.00 -1.24 0.29 0.95 -0.56 0.00 0.00 175.26 174.69 1pla s THR 67 N -2.71 0.08 -0.01 -1.70 -4.23 -1.26 -2.53 115.64 103.28 1pla s THR 67 Ca 0.62 -1.21 0.02 0.00 -1.18 0.00 0.00 61.69 59.95 1pla s THR 67 Cb -0.17 -1.62 -0.00 0.00 1.34 0.00 0.00 72.50 72.05 1pla s THR 67 CO 0.48 -0.38 -0.07 -0.47 -0.54 0.00 0.00 174.62 173.64 1pla s TYR 68 N -3.92 0.62 0.04 3.99 6.14 -0.99 -4.94 117.35 118.30 1pla s TYR 68 Ca 0.12 -0.12 0.01 0.00 0.64 0.00 0.00 57.07 57.71 1pla s TYR 68 Cb 0.03 -0.42 -0.04 0.00 0.42 0.00 0.00 41.96 41.96 1pla s TYR 68 CO -0.04 -0.02 0.13 -1.21 0.64 0.00 0.00 175.55 175.05 1pla s GLU 69 N -0.07 3.17 -0.06 4.97 8.01 -1.26 -0.95 118.70 132.50 1pla s GLU 69 Ca 0.01 -0.52 -0.03 0.00 0.01 0.00 0.00 54.97 54.45 1pla s GLU 69 Cb -0.04 -2.91 0.04 0.00 -4.31 0.00 0.00 34.13 26.92 1pla s GLU 69 CO -0.00 0.61 0.13 0.08 0.01 0.00 0.00 175.26 176.09 1pla s VAL 70 N -1.38 -0.12 -0.25 2.63 1.01 -0.08 -4.93 120.40 117.27 1pla s VAL 70 Ca 0.29 0.26 0.00 0.00 0.00 0.00 0.00 61.98 62.54 1pla s VAL 70 Cb -0.12 -0.23 0.04 0.00 0.00 0.00 0.00 36.38 36.06 1pla s VAL 70 CO 0.22 0.11 -0.08 -0.89 0.00 0.00 0.00 175.10 174.45 1pla s THR 71 N 1.60 2.54 0.35 3.92 2.01 -1.26 -1.09 115.64 123.70 1pla s THR 71 Ca -0.04 -1.31 0.02 0.00 0.31 0.00 0.00 61.69 60.66 1pla s THR 71 Cb -0.12 -2.37 -0.02 0.00 0.01 0.00 0.00 72.50 70.00 1pla s THR 71 CO -0.05 0.09 0.53 -0.76 -0.69 0.00 0.00 174.62 173.74 1pla s LEU 72 N 1.22 3.98 -0.32 4.42 1.43 -1.26 -5.04 118.68 123.11 1pla s LEU 72 Ca -0.04 0.26 0.17 0.00 -1.03 0.00 0.00 54.13 53.49 1pla s LEU 72 Cb -0.18 -3.12 0.45 0.00 0.03 0.00 0.00 46.19 43.37 1pla s LEU 72 CO -0.05 -0.36 1.30 0.41 0.23 0.00 0.00 176.35 177.87 1pla n THR 73 N -1.77 0.56 -3.40 5.49 -1.04 -1.26 -3.78 114.28 109.09 1pla n THR 73 Ca -0.04 -1.99 -0.15 0.00 -2.04 0.00 0.00 64.05 59.83 1pla n THR 73 Cb 0.57 1.07 -0.10 0.00 -1.82 0.00 0.00 70.33 70.05 1pla n THR 73 CO 0.00 0.00 0.00 -0.70 -0.64 0.00 0.00 175.07 173.73 1pla s GLU 74 N -1.63 0.31 -0.38 -2.82 2.56 -1.26 -5.03 118.70 110.45 1pla s GLU 74 Ca 0.19 0.03 -0.44 0.00 0.00 0.00 0.00 54.97 54.76 1pla s GLU 74 Cb 0.40 -0.69 -0.18 0.00 2.00 0.00 0.00 34.13 35.66 1pla s GLU 74 CO -0.07 -0.92 1.67 0.36 -0.56 0.00 0.00 175.26 175.74 1pla n LYS 75 N 5.32 0.57 0.00 4.30 2.85 -1.26 -4.68 118.16 125.27 1pla n LYS 75 Ca -0.03 0.21 0.00 0.00 -1.05 0.00 0.00 58.31 57.44 1pla n LYS 75 Cb 0.48 -1.80 0.00 0.00 -0.65 0.00 0.00 35.03 33.06 1pla n LYS 75 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1pla n GLY 76 N 4.07 -0.68 2.90 2.58 0.00 -0.79 -4.94 105.19 108.33 1pla n GLY 76 Ca 0.29 -0.43 -0.14 0.00 0.00 0.00 0.00 46.02 45.74 1pla n GLY 76 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1pla s THR 77 N -4.00 -0.07 -0.07 2.61 2.01 -1.26 -1.83 115.64 113.03 1pla s THR 77 Ca 0.00 0.20 0.04 0.00 0.31 0.00 0.00 61.69 62.24 1pla s THR 77 Cb 0.00 -0.24 -0.02 0.00 0.01 0.00 0.00 72.50 72.25 1pla s THR 77 CO 0.00 0.08 -0.17 -0.31 -0.69 0.00 0.00 174.62 173.53 1pla s TYR 78 N 1.30 2.64 -0.28 4.92 1.51 -1.05 -4.34 117.35 122.06 1pla s TYR 78 Ca -0.08 -0.40 -0.07 0.00 -1.01 0.00 0.00 57.07 55.52 1pla s TYR 78 Cb -0.12 -1.66 -0.00 0.00 -0.11 0.00 0.00 41.96 40.07 1pla s TYR 78 CO -0.06 0.00 0.07 0.15 -1.11 0.00 0.00 175.55 174.61 1pla s LYS 79 N -0.37 3.24 0.26 -0.62 3.01 -1.08 -2.53 119.74 121.64 1pla s LYS 79 Ca 0.03 -0.76 0.04 0.00 -1.01 0.00 0.00 55.97 54.28 1pla s LYS 79 Cb -0.12 -3.35 -0.05 0.00 -1.01 0.00 0.00 37.83 33.29 1pla s LYS 79 CO 0.02 -0.37 0.01 -0.59 0.51 0.00 0.00 175.35 174.93 1pla s PHE 80 N 1.53 1.68 0.04 3.18 -0.71 0.88 -1.08 117.98 123.50 1pla s PHE 80 Ca 0.04 -0.93 -0.06 0.00 -1.04 0.00 0.00 56.93 54.93 1pla s PHE 80 Cb -0.17 -1.00 0.02 0.00 -1.21 0.00 0.00 43.02 40.66 1pla s PHE 80 CO 0.03 -0.02 0.30 2.48 -1.34 0.00 0.00 175.22 176.66 1pla n TYR 81 N -0.49 -0.66 -4.08 3.49 4.11 -0.87 0.16 117.16 118.81 1pla n TYR 81 Ca -0.04 -0.32 -0.35 0.00 -0.00 0.00 0.00 57.90 57.19 1pla n TYR 81 Cb 0.65 0.15 -0.12 0.00 -0.00 0.00 0.00 39.34 40.02 1pla n TYR 81 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.86 176.86 1pla h GLU 83 N 7.28 0.29 -0.16 0.00 5.08 -1.91 -1.04 114.58 124.12 1pla h GLU 83 Ca -0.35 -0.13 -0.02 0.00 -1.00 0.00 0.00 59.36 57.86 1pla h GLU 83 Cb 1.18 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.42 1pla h GLU 83 CO 0.63 0.64 0.04 -1.00 -1.00 0.00 0.00 179.01 178.31 1pla h PRO 84 N -0.07 0.26 -0.77 2.33 0.14 -1.95 -2.66 132.00 129.28 1pla h PRO 84 Ca 0.03 -0.06 0.00 0.00 0.14 0.00 0.00 66.00 66.10 1pla h PRO 84 Cb 0.56 -0.03 0.00 0.00 0.14 0.00 0.00 31.00 31.67 1pla h PRO 84 CO 0.02 0.41 0.00 0.72 0.14 0.00 0.00 178.00 179.29 1pla n HIS 85 N -4.81 1.14 0.14 1.56 8.25 -1.24 -4.24 115.22 116.01 1pla n HIS 85 Ca -0.05 -0.39 0.09 0.00 -0.26 0.00 0.00 57.72 57.11 1pla n HIS 85 Cb 0.17 -0.32 0.51 0.00 1.12 0.00 0.00 29.99 31.46 1pla n HIS 85 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1pla n ALA 86 N 0.35 1.01 0.77 -1.41 0.00 -0.39 0.13 120.51 120.96 1pla n ALA 86 Ca 0.15 0.17 0.11 0.00 0.00 0.00 0.00 53.44 53.88 1pla n ALA 86 Cb 0.77 -1.24 0.07 0.00 0.00 0.00 0.00 19.45 19.04 1pla n ALA 86 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1pla n GLY 87 N -1.32 -1.19 0.04 0.00 0.00 -1.26 -3.87 105.19 97.59 1pla n GLY 87 Ca -0.01 -0.42 0.12 0.00 0.00 0.00 0.00 46.02 45.71 1pla n GLY 87 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pla n ALA 88 N -1.68 3.10 -0.24 4.61 0.00 0.12 -4.93 120.51 121.49 1pla n ALA 88 Ca 0.03 -0.28 0.00 0.00 0.00 0.00 0.00 53.44 53.19 1pla n ALA 88 Cb 0.39 -1.15 0.00 0.00 0.00 0.00 0.00 19.45 18.69 1pla n ALA 88 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1pla n GLY 89 N 1.38 1.38 3.51 0.00 0.00 -1.15 -4.96 105.19 105.35 1pla n GLY 89 Ca 0.04 -0.15 -0.42 0.00 0.00 0.00 0.00 46.02 45.49 1pla n GLY 89 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1pla s MET 90 N -0.95 3.16 0.26 1.61 1.00 -1.21 -4.83 119.30 118.35 1pla s MET 90 Ca 0.00 -0.53 0.11 0.00 0.00 0.00 0.00 55.69 55.28 1pla s MET 90 Cb 0.00 -4.22 -0.05 0.00 0.00 0.00 0.00 34.83 30.56 1pla s MET 90 CO 0.00 -2.00 -0.19 -1.59 0.00 0.00 0.00 175.02 171.23 1pla s LYS 91 N 4.97 1.62 -0.04 2.03 -2.85 -1.26 -2.37 119.74 121.83 1pla s LYS 91 Ca 0.29 -1.73 -0.06 0.00 -1.00 0.00 0.00 55.97 53.47 1pla s LYS 91 Cb -0.12 -1.68 0.01 0.00 -2.06 0.00 0.00 37.83 33.99 1pla s LYS 91 CO 0.12 0.31 0.16 0.20 0.10 0.00 0.00 175.35 176.25 1pla s GLY 92 N -3.44 -0.08 -0.08 0.59 0.00 0.43 -4.36 107.32 100.39 1pla s GLY 92 Ca 0.28 0.29 -0.15 0.00 0.00 0.00 0.00 44.72 45.15 1pla s GLY 92 CO 0.14 0.21 0.37 -0.54 0.00 0.00 0.00 173.10 173.27 1pla s GLU 93 N -0.36 0.57 -0.05 2.90 2.02 -1.06 -0.08 118.70 122.64 1pla s GLU 93 Ca -0.04 0.21 -0.00 0.00 0.02 0.00 0.00 54.97 55.16 1pla s GLU 93 Cb -0.03 0.27 0.02 0.00 0.10 0.00 0.00 34.13 34.49 1pla s GLU 93 CO 0.01 -0.12 -0.02 0.54 0.02 0.00 0.00 175.26 175.68 1pla s VAL 94 N -0.52 0.43 -0.57 2.63 0.11 -1.05 -2.36 120.40 119.06 1pla s VAL 94 Ca -0.06 0.00 -0.14 0.00 -2.93 0.00 0.00 61.98 58.85 1pla s VAL 94 Cb -0.04 -0.52 0.14 0.00 -1.53 0.00 0.00 36.38 34.44 1pla s VAL 94 CO 0.03 0.23 0.51 -0.89 -3.33 0.00 0.00 175.10 171.64 1pla s THR 95 N 1.36 5.04 0.48 5.04 2.01 -0.93 -2.52 115.64 126.11 1pla s THR 95 Ca -0.04 -1.75 -0.18 0.00 0.31 0.00 0.00 61.69 60.03 1pla s THR 95 Cb -0.13 -4.22 -0.09 0.00 0.01 0.00 0.00 72.50 68.06 1pla s THR 95 CO -0.02 -0.88 0.97 -0.69 -0.69 0.00 0.00 174.62 173.31 1pla s VAL 96 N 1.29 4.44 -0.09 3.82 1.01 -0.76 -1.65 120.40 128.45 1pla s VAL 96 Ca 0.06 1.32 0.01 0.00 0.00 0.00 0.00 61.98 63.37 1pla s VAL 96 Cb -0.26 -3.66 0.01 0.00 0.00 0.00 0.00 36.38 32.47 1pla s VAL 96 CO 0.00 -0.52 0.52 0.59 0.00 0.00 0.00 175.10 175.69