#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 3.31 0.10 0.00 8.01 -1.26 -2.37 118.70 126.49 1pla s GLU 2 Ca 0.00 -0.68 0.06 0.00 0.01 0.00 0.00 54.97 54.36 1pla s GLU 2 Cb 0.00 -2.84 -0.04 0.00 -4.31 0.00 0.00 34.13 26.94 1pla s GLU 2 CO 0.00 -0.10 -0.04 0.08 0.01 0.00 0.00 175.26 175.21 1pla s VAL 3 N 1.17 3.76 -0.17 2.63 1.01 -0.71 -4.59 120.40 123.51 1pla s VAL 3 Ca 0.02 -1.11 0.01 0.00 0.00 0.00 0.00 61.98 60.89 1pla s VAL 3 Cb -0.14 -2.79 0.03 0.00 0.00 0.00 0.00 36.38 33.48 1pla s VAL 3 CO -0.03 0.11 -0.12 -0.54 0.00 0.00 0.00 175.10 174.52 1pla s LYS 4 N -2.29 2.16 -0.46 2.72 1.02 0.95 -0.15 119.74 123.69 1pla s LYS 4 Ca 0.24 -0.67 -0.29 0.00 0.02 0.00 0.00 55.97 55.28 1pla s LYS 4 Cb -0.11 -2.22 0.02 0.00 -0.52 0.00 0.00 37.83 34.99 1pla s LYS 4 CO 0.17 -0.32 1.33 -0.51 -0.92 0.00 0.00 175.35 175.10 1pla s LEU 5 N 1.46 3.56 0.00 3.17 1.43 0.58 -2.68 118.68 126.20 1pla s LEU 5 Ca 0.02 0.61 0.00 0.00 -1.03 0.00 0.00 54.13 53.74 1pla s LEU 5 Cb -0.14 -3.45 0.00 0.00 0.03 0.00 0.00 46.19 42.62 1pla s LEU 5 CO -0.10 -1.43 0.00 0.61 0.23 0.00 0.00 176.35 175.66 1pla n GLY 6 N 5.05 2.98 0.00 -3.19 0.00 -1.06 -2.46 105.19 106.51 1pla n GLY 6 Ca 0.14 -2.00 0.00 0.00 0.00 0.00 0.00 46.02 44.16 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 0.46 -4.61 113.62 114.50 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 0.00 0.00 0.00 4.04 9.92 -1.26 -4.89 116.55 124.36 1pla n ASP 8 Ca 0.00 -1.00 0.00 0.00 -0.53 0.00 0.00 54.79 53.26 1pla n ASP 8 Cb 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.48 1pla n ASP 8 CO 0.00 0.00 0.00 -0.90 0.13 0.00 0.00 177.20 176.43 1pla n ASP 9 N 0.00 0.00 -2.69 -2.24 5.75 -1.26 -5.04 116.55 111.07 1pla n ASP 9 Ca 0.00 0.00 -0.06 0.00 -0.01 0.00 0.00 54.79 54.72 1pla n ASP 9 Cb 0.46 0.07 0.10 0.00 -1.03 0.00 0.00 41.12 40.72 1pla n ASP 9 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1pla n GLY 10 N -1.16 -0.65 3.47 6.12 0.00 -1.26 -5.13 105.19 106.58 1pla n GLY 10 Ca 0.00 0.52 -0.07 0.00 0.00 0.00 0.00 46.02 46.47 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 -0.71 -0.52 -0.67 -0.02 0.00 -1.26 -5.00 107.32 99.13 1pla s GLY 11 Ca 0.23 1.99 -0.15 0.00 0.00 0.00 0.00 44.72 46.78 1pla s GLY 11 CO -0.14 2.35 0.64 1.08 0.00 0.00 0.00 173.10 177.03 1pla s LEU 12 N 2.03 6.38 0.04 0.66 1.43 -1.26 0.18 118.68 128.14 1pla s LEU 12 Ca -0.07 -2.17 -0.07 0.00 -1.03 0.00 0.00 54.13 50.79 1pla s LEU 12 Cb -0.09 -2.22 -0.01 0.00 0.03 0.00 0.00 46.19 43.91 1pla s LEU 12 CO -0.16 -0.75 0.13 0.68 0.23 0.00 0.00 176.35 176.48 1pla s VAL 13 N 1.04 0.13 -0.41 -1.59 -7.23 -1.26 -4.02 120.40 107.06 1pla s VAL 13 Ca 0.10 -1.06 -0.29 0.00 -1.81 0.00 0.00 61.98 58.93 1pla s VAL 13 Cb -0.21 -0.95 0.02 0.00 0.56 0.00 0.00 36.38 35.80 1pla s VAL 13 CO -0.02 -0.58 1.19 -0.36 -0.31 0.00 0.00 175.10 175.01 1pla s PHE 14 N -2.73 2.80 -0.31 2.82 0.08 -1.26 -2.57 117.98 116.81 1pla s PHE 14 Ca -0.04 0.83 -0.02 0.00 0.12 0.00 0.00 56.93 57.82 1pla s PHE 14 Cb -0.00 -4.20 0.06 0.00 -0.57 0.00 0.00 43.02 38.30 1pla s PHE 14 CO -0.05 -1.33 0.03 -1.12 -0.10 0.00 0.00 175.22 172.65 1pla s SER 15 N 2.57 4.95 1.27 1.36 0.01 -1.09 -0.86 113.70 121.90 1pla s SER 15 Ca 0.51 -1.37 -0.20 0.00 1.31 0.00 0.00 55.95 56.19 1pla s SER 15 Cb -0.10 -1.73 0.31 0.00 0.21 0.00 0.00 66.02 64.71 1pla s SER 15 CO 0.27 -0.30 1.06 -2.16 0.41 0.00 0.00 173.24 172.52 1pla s PRO 16 N 1.24 -1.72 -0.21 12.44 0.05 -1.26 -0.03 135.00 145.50 1pla s PRO 16 Ca -0.03 0.00 -0.16 0.00 0.05 0.00 0.00 61.00 60.86 1pla s PRO 16 Cb -0.20 -1.53 -0.19 0.00 0.05 0.00 0.00 34.50 32.63 1pla s PRO 16 CO -0.01 -4.05 0.09 0.43 0.05 0.00 0.00 177.00 173.51 1pla n SER 17 N -5.02 1.93 -3.82 6.66 7.64 -0.04 -4.87 113.62 116.11 1pla n SER 17 Ca 0.13 0.34 -0.13 0.00 1.01 0.00 0.00 58.87 60.21 1pla n SER 17 Cb 0.59 -0.89 -0.15 0.00 -1.01 0.00 0.00 64.21 62.76 1pla n SER 17 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1pla s SER 18 N -7.01 0.00 -0.08 6.43 1.04 -1.26 -2.26 113.70 110.57 1pla s SER 18 Ca -0.30 0.06 -0.20 0.00 0.48 0.00 0.00 55.95 55.99 1pla s SER 18 Cb 0.08 0.01 0.04 0.00 0.10 0.00 0.00 66.02 66.26 1pla s SER 18 CO 0.60 -0.07 0.47 0.72 0.98 0.00 0.00 173.24 175.94 1pla s PHE 19 N 0.51 -0.43 0.24 5.02 -0.71 -1.06 -5.00 117.98 116.55 1pla s PHE 19 Ca -0.04 0.85 -0.08 0.00 -1.04 0.00 0.00 56.93 56.62 1pla s PHE 19 Cb -0.06 0.21 -0.07 0.00 -1.21 0.00 0.00 43.02 41.89 1pla s PHE 19 CO -0.02 -0.40 0.54 0.95 -1.34 0.00 0.00 175.22 174.95 1pla s THR 20 N -0.76 4.97 0.08 -4.49 -4.23 -1.26 -2.02 115.64 107.93 1pla s THR 20 Ca -0.08 0.34 -0.09 0.00 -1.18 0.00 0.00 61.69 60.67 1pla s THR 20 Cb -0.03 -3.65 0.00 0.00 1.34 0.00 0.00 72.50 70.16 1pla s THR 20 CO 0.05 -0.14 0.21 0.68 -0.54 0.00 0.00 174.62 174.88 1pla s VAL 21 N -1.88 0.13 0.23 2.29 -7.23 -0.88 -4.89 120.40 108.17 1pla s VAL 21 Ca 0.46 -1.07 -0.30 0.00 -1.81 0.00 0.00 61.98 59.26 1pla s VAL 21 Cb -0.11 -1.23 -0.09 0.00 0.56 0.00 0.00 36.38 35.51 1pla s VAL 21 CO 0.24 -0.59 1.16 0.00 -0.31 0.00 0.00 175.10 175.60 1pla s ALA 22 N -3.56 3.43 -0.96 1.32 0.00 -1.26 -1.43 121.76 119.30 1pla s ALA 22 Ca 0.03 0.94 -0.27 0.00 0.00 0.00 0.00 51.96 52.66 1pla s ALA 22 Cb 0.03 -3.38 -0.26 0.00 0.00 0.00 0.00 23.12 19.52 1pla s ALA 22 CO -0.09 -0.30 2.05 0.00 0.00 0.00 0.00 175.76 177.42 1pla n ALA 23 N 1.89 0.26 0.00 0.00 0.00 -0.94 -1.17 120.51 120.54 1pla n ALA 23 Ca 0.02 -2.28 0.00 0.00 0.00 0.00 0.00 53.44 51.18 1pla n ALA 23 Cb 0.45 -3.38 0.00 0.00 0.00 0.00 0.00 19.45 16.51 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 6.00 -0.08 3.94 0.00 0.00 -1.18 -4.81 105.19 109.07 1pla n GLY 24 Ca 0.42 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 46.19 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 3.49 -0.26 1.61 2.56 -0.31 -5.02 118.70 120.76 1pla s GLU 25 Ca 0.00 -0.42 -0.17 0.00 0.00 0.00 0.00 54.97 54.38 1pla s GLU 25 Cb 0.00 -2.76 -0.03 0.00 2.00 0.00 0.00 34.13 33.34 1pla s GLU 25 CO 0.00 0.28 0.46 0.15 -0.56 0.00 0.00 175.26 175.59 1pla s LYS 26 N -3.96 4.06 -0.25 4.30 1.02 -1.26 -4.33 119.74 119.32 1pla s LYS 26 Ca 0.38 0.23 -0.08 0.00 0.02 0.00 0.00 55.97 56.53 1pla s LYS 26 Cb -0.10 -3.65 -0.03 0.00 -0.52 0.00 0.00 37.83 33.53 1pla s LYS 26 CO 0.32 -0.31 0.08 0.42 -0.92 0.00 0.00 175.35 174.94 1pla s ILE 27 N 2.18 4.42 -0.22 2.17 1.01 0.54 -1.79 121.20 129.51 1pla s ILE 27 Ca 0.19 -0.14 0.01 0.00 0.00 0.00 0.00 60.65 60.71 1pla s ILE 27 Cb -0.16 -3.07 0.03 0.00 0.01 0.00 0.00 42.46 39.28 1pla s ILE 27 CO 0.09 0.34 -0.14 0.42 0.00 0.00 0.00 174.94 175.65 1pla s THR 28 N 1.56 2.35 -0.24 2.92 -4.23 -1.00 0.50 115.64 117.50 1pla s THR 28 Ca 0.06 -1.09 -0.22 0.00 -1.18 0.00 0.00 61.69 59.26 1pla s THR 28 Cb -0.15 -2.13 -0.01 0.00 1.34 0.00 0.00 72.50 71.54 1pla s THR 28 CO 0.04 0.32 0.70 -0.36 -0.54 0.00 0.00 174.62 174.79 1pla s PHE 29 N 1.27 3.30 -0.09 3.99 0.08 -0.29 -1.74 117.98 124.50 1pla s PHE 29 Ca 0.01 0.95 0.01 0.00 0.12 0.00 0.00 56.93 58.01 1pla s PHE 29 Cb -0.16 -2.91 -0.02 0.00 -0.57 0.00 0.00 43.02 39.36 1pla s PHE 29 CO -0.09 -0.34 -0.10 0.21 -0.10 0.00 0.00 175.22 174.80 1pla s LYS 30 N 2.58 2.96 -0.34 0.44 2.20 0.79 -1.89 119.74 126.47 1pla s LYS 30 Ca 0.30 -0.62 -0.29 0.00 -0.36 0.00 0.00 55.97 55.00 1pla s LYS 30 Cb -0.15 -2.58 0.02 0.00 -1.51 0.00 0.00 37.83 33.60 1pla s LYS 30 CO 0.08 0.49 1.07 -0.80 -0.36 0.00 0.00 175.35 175.83 1pla s ASN 31 N -0.35 6.88 -0.21 1.43 -0.87 -0.98 -0.31 114.94 120.54 1pla s ASN 31 Ca 0.04 0.95 0.16 0.00 -1.57 0.00 0.00 52.86 52.44 1pla s ASN 31 Cb -0.12 -2.54 -0.24 0.00 -0.02 0.00 0.00 41.25 38.33 1pla s ASN 31 CO 0.02 -0.92 0.03 -3.20 -2.57 0.00 0.00 177.10 170.46 1pla n ASN 32 N 6.97 0.32 0.00 -1.22 5.15 -1.03 -3.40 115.26 122.06 1pla n ASN 32 Ca 0.12 -0.02 0.00 0.00 -0.60 0.00 0.00 54.58 54.08 1pla n ASN 32 Cb 0.47 0.80 0.00 0.00 -0.53 0.00 0.00 39.78 40.53 1pla n ASN 32 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1pla n ALA 33 N -2.81 0.00 0.00 5.20 0.00 -1.17 -4.98 120.51 116.75 1pla n ALA 33 Ca -0.34 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.10 1pla n ALA 33 Cb 1.13 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.58 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 0.00 -0.03 3.20 0.00 0.00 -1.26 -4.43 105.19 102.67 1pla n GLY 34 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 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 0.00 -2.44 -2.56 1.61 -1.74 -1.26 -4.66 117.46 106.41 1pla n PHE 35 Ca 0.00 0.21 -0.38 0.00 -0.56 0.00 0.00 57.45 56.72 1pla n PHE 35 Cb 0.00 -1.57 -0.05 0.00 1.52 0.00 0.00 39.48 39.39 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 -2.87 4.45 0.28 3.97 0.04 -1.26 -5.10 135.00 134.51 1pla s PRO 36 Ca 0.48 1.61 0.10 0.00 0.04 0.00 0.00 61.00 63.23 1pla s PRO 36 Cb -0.13 -2.88 -0.04 0.00 0.04 0.00 0.00 34.50 31.49 1pla s PRO 36 CO 0.71 0.09 -0.01 -1.01 0.04 0.00 0.00 177.00 176.82 1pla s HIS 37 N -1.42 2.64 -0.09 0.56 3.76 -0.83 -4.92 115.29 114.99 1pla s HIS 37 Ca 0.50 -0.26 -0.05 0.00 -0.15 0.00 0.00 55.06 55.10 1pla s HIS 37 Cb -0.26 -1.22 0.04 0.00 1.11 0.00 0.00 32.58 32.24 1pla s HIS 37 CO 0.33 0.60 0.21 1.21 -0.85 0.00 0.00 174.74 176.24 1pla s ASN 38 N -3.67 -0.22 -0.19 1.40 2.47 -1.26 -2.62 114.94 110.85 1pla s ASN 38 Ca 0.32 0.45 -0.02 0.00 0.42 0.00 0.00 52.86 54.03 1pla s ASN 38 Cb -0.05 0.37 0.00 0.00 -1.45 0.00 0.00 41.25 40.12 1pla s ASN 38 CO 0.19 -0.13 -0.11 -0.63 -3.72 0.00 0.00 177.10 172.70 1pla s ILE 39 N 0.87 2.85 0.04 -5.21 1.09 -1.26 -4.05 121.20 115.53 1pla s ILE 39 Ca -0.06 -0.68 0.00 0.00 -1.10 0.00 0.00 60.65 58.81 1pla s ILE 39 Cb -0.08 -2.25 -0.03 0.00 -1.06 0.00 0.00 42.46 39.04 1pla s ILE 39 CO -0.05 0.48 -0.04 -0.69 -0.10 0.00 0.00 174.94 174.54 1pla s VAL 40 N 1.25 0.26 -0.13 2.92 1.01 -1.07 0.24 120.40 124.88 1pla s VAL 40 Ca 0.03 -1.38 -0.04 0.00 0.00 0.00 0.00 61.98 60.59 1pla s VAL 40 Cb -0.14 -0.92 -0.03 0.00 0.00 0.00 0.00 36.38 35.28 1pla s VAL 40 CO -0.05 -0.71 0.01 -0.36 0.00 0.00 0.00 175.10 173.98 1pla s PHE 41 N -2.60 3.15 -0.49 5.22 0.40 -1.26 -2.23 117.98 120.18 1pla s PHE 41 Ca -0.04 0.02 -0.28 0.00 -0.60 0.00 0.00 56.93 56.03 1pla s PHE 41 Cb -0.02 -1.92 0.01 0.00 0.51 0.00 0.00 43.02 41.60 1pla s PHE 41 CO -0.05 0.24 1.50 0.34 0.70 0.00 0.00 175.22 177.95 1pla s ASP 42 N -0.19 6.10 0.00 1.36 -1.08 -0.94 -4.84 116.67 117.09 1pla s ASP 42 Ca 0.05 0.60 0.00 0.00 -0.52 0.00 0.00 52.55 52.69 1pla s ASP 42 Cb -0.12 -2.54 0.00 0.00 -1.46 0.00 0.00 42.92 38.80 1pla s ASP 42 CO 0.02 -1.67 0.64 -0.62 0.52 0.00 0.00 175.17 174.07 1pla n GLU 43 N 8.47 0.47 0.00 4.34 1.02 -1.26 -2.76 120.64 130.92 1pla n GLU 43 Ca 0.16 0.00 0.05 0.00 -0.02 0.00 0.00 57.16 57.35 1pla n GLU 43 Cb 0.49 -1.27 -0.06 0.00 -0.02 0.00 0.00 31.44 30.58 1pla n GLU 43 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 1pla n ASP 44 N 1.15 0.49 0.00 1.62 8.00 -1.26 -4.69 116.55 121.86 1pla n ASP 44 Ca 0.00 -0.75 0.00 0.00 0.71 0.00 0.00 54.79 54.75 1pla n ASP 44 Cb 0.23 1.00 0.00 0.00 -0.02 0.00 0.00 41.12 42.33 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 -1.24 0.00 -2.27 -1.24 4.71 -1.11 -5.09 120.64 114.40 1pla n GLU 45 Ca 0.02 0.00 -0.37 0.00 -0.01 0.00 0.00 57.16 56.80 1pla n GLU 45 Cb 0.16 -0.18 -0.01 0.00 -1.01 0.00 0.00 31.44 30.40 1pla n GLU 45 CO 0.00 0.00 0.00 0.08 0.09 0.00 0.00 177.13 177.30 1pla s VAL 46 N 0.00 3.13 0.93 2.62 1.01 -1.24 -4.85 120.40 122.00 1pla s VAL 46 Ca 0.00 0.86 -0.13 0.00 0.00 0.00 0.00 61.98 62.70 1pla s VAL 46 Cb 0.00 -3.44 0.02 0.00 0.00 0.00 0.00 36.38 32.96 1pla s VAL 46 CO 0.00 -0.00 0.34 -2.65 0.00 0.00 0.00 175.10 172.79 1pla n PRO 47 N -0.42 -0.21 -0.90 2.72 -0.01 -1.26 -4.83 135.00 130.09 1pla n PRO 47 Ca 0.07 -0.02 -0.16 0.00 -0.01 0.00 0.00 63.50 63.37 1pla n PRO 47 Cb 0.48 -1.80 0.03 0.00 -0.01 0.00 0.00 33.50 32.20 1pla n PRO 47 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 175.50 175.49 1pla n ALA 48 N -3.40 5.13 0.00 3.55 0.00 -1.26 -3.87 120.51 120.66 1pla n ALA 48 Ca 0.06 -1.65 0.00 0.00 0.00 0.00 0.00 53.44 51.86 1pla n ALA 48 Cb 0.53 -1.39 0.00 0.00 0.00 0.00 0.00 19.45 18.59 1pla n ALA 48 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1pla n GLY 49 N 0.42 -0.03 3.53 0.00 0.00 -1.26 -4.98 105.19 102.87 1pla n GLY 49 Ca 0.30 -0.01 -0.42 0.00 0.00 0.00 0.00 46.02 45.88 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 -1.46 4.27 0.24 1.61 1.01 -1.25 -4.97 120.40 119.84 1pla s VAL 50 Ca 0.00 -1.45 -0.28 0.00 0.00 0.00 0.00 61.98 60.25 1pla s VAL 50 Cb 0.00 -5.02 -0.16 0.00 0.00 0.00 0.00 36.38 31.20 1pla s VAL 50 CO 0.00 -1.83 0.78 0.59 0.00 0.00 0.00 175.10 174.64 1pla n ASN 51 N 7.89 0.07 0.11 3.32 5.03 -1.26 -4.77 115.26 125.64 1pla n ASN 51 Ca 0.36 1.15 -0.02 0.00 0.87 0.00 0.00 54.58 56.94 1pla n ASN 51 Cb 0.48 -1.12 0.05 0.00 -1.02 0.00 0.00 39.78 38.17 1pla n ASN 51 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1pla h ALA 52 N 1.59 0.66 0.00 5.41 0.00 -1.93 -3.06 119.26 121.93 1pla h ALA 52 Ca -0.34 -0.66 0.00 0.00 0.00 0.00 0.00 54.91 53.91 1pla h ALA 52 Cb 1.39 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.06 1pla h ALA 52 CO 0.59 0.90 0.00 0.93 0.00 0.00 0.00 179.25 181.67 1pla h GLU 53 N 0.00 0.00 0.16 0.00 4.39 -1.90 0.65 114.58 117.88 1pla h GLU 53 Ca -0.01 0.00 -0.27 0.00 0.34 0.00 0.00 59.36 59.43 1pla h GLU 53 Cb 1.40 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 30.07 1pla h GLU 53 CO 0.09 0.00 -1.27 0.87 -1.16 0.00 0.00 179.01 177.54 1pla h LYS 54 N 0.00 0.33 0.07 2.33 6.56 -1.90 -3.39 116.57 120.58 1pla h LYS 54 Ca 0.00 -0.57 -0.36 0.00 -1.06 0.00 0.00 60.65 58.66 1pla h LYS 54 Cb 0.25 0.21 -0.04 0.00 -0.57 0.00 0.00 32.23 32.08 1pla h LYS 54 CO 0.00 1.27 -2.08 0.44 -2.06 0.00 0.00 179.45 177.02 1pla n ILE 55 N -3.91 1.67 -0.80 1.86 -5.35 -1.05 -4.96 119.36 106.81 1pla n ILE 55 Ca -0.20 -0.55 -0.34 0.00 -0.27 0.00 0.00 62.75 61.39 1pla n ILE 55 Cb 0.93 -1.69 0.12 0.00 -1.74 0.00 0.00 39.64 37.26 1pla n ILE 55 CO 0.00 0.00 0.00 -1.20 -1.76 0.00 0.00 176.55 173.59 1pla n SER 56 N -3.57 -2.87 -3.40 7.28 7.64 0.23 -4.98 113.62 113.95 1pla n SER 56 Ca -0.37 0.05 -0.27 0.00 1.01 0.00 0.00 58.87 59.30 1pla n SER 56 Cb 0.99 -0.92 -0.10 0.00 -1.01 0.00 0.00 64.21 63.17 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 -0.60 0.41 0.30 1.43 6.02 0.14 -4.91 117.38 120.18 1pla n GLN 57 Ca 0.01 -3.30 0.18 0.00 -0.01 0.00 0.00 57.00 53.88 1pla n GLN 57 Cb 0.62 -1.66 0.98 0.00 1.02 0.00 0.00 30.24 31.19 1pla n GLN 57 CO 0.00 0.00 0.00 -1.35 -1.01 0.00 0.00 177.06 174.70 1pla h PRO 58 N 5.38 0.00 -6.14 -1.09 0.11 -1.94 -3.35 132.00 124.96 1pla h PRO 58 Ca 0.23 0.00 -0.57 0.00 0.11 0.00 0.00 66.00 65.77 1pla h PRO 58 Cb 0.89 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 31.96 1pla h PRO 58 CO 0.41 0.02 0.89 -1.21 -0.21 0.00 0.00 178.00 177.91 1pla s GLU 59 N -4.30 4.23 1.13 1.05 2.02 -1.26 -5.00 118.70 116.57 1pla s GLU 59 Ca -0.04 1.60 -0.15 0.00 0.02 0.00 0.00 54.97 56.39 1pla s GLU 59 Cb 0.14 -3.75 0.19 0.00 0.10 0.00 0.00 34.13 30.80 1pla s GLU 59 CO 0.50 -0.71 0.51 0.66 0.02 0.00 0.00 175.26 176.25 1pla n TYR 60 N 6.60 -1.30 -3.83 1.61 4.02 -1.26 -4.88 117.16 118.12 1pla n TYR 60 Ca 0.14 0.02 -0.12 0.00 -0.01 0.00 0.00 57.90 57.92 1pla n TYR 60 Cb 0.45 -1.65 -0.12 0.00 -0.02 0.00 0.00 39.34 38.00 1pla n TYR 60 CO 0.00 0.00 0.00 -0.48 -1.01 0.00 0.00 176.86 175.37 1pla s LEU 61 N -4.11 1.41 -0.08 7.72 0.05 -1.08 -5.03 118.68 117.56 1pla s LEU 61 Ca 0.62 0.23 0.18 0.00 0.05 0.00 0.00 54.13 55.21 1pla s LEU 61 Cb -0.19 0.59 0.34 0.00 -2.05 0.00 0.00 46.19 44.88 1pla s LEU 61 CO 0.66 -0.12 1.15 -0.46 -0.55 0.00 0.00 176.35 177.03 1pla n ASN 62 N 2.69 0.41 -4.51 1.48 6.94 -1.26 -1.96 115.26 119.06 1pla n ASN 62 Ca -0.14 -2.02 -0.42 0.00 -0.02 0.00 0.00 54.58 51.97 1pla n ASN 62 Cb 0.58 -0.10 -0.09 0.00 -2.36 0.00 0.00 39.78 37.81 1pla n ASN 62 CO 0.00 0.00 0.00 -0.83 -1.03 0.00 0.00 177.26 175.40 1pla s GLY 63 N -2.02 1.91 -0.18 4.83 0.00 -1.26 -4.97 107.32 105.63 1pla s GLY 63 Ca 0.22 -1.41 -0.28 0.00 0.00 0.00 0.00 44.72 43.25 1pla s GLY 63 CO -0.10 1.07 2.18 0.00 0.00 0.00 0.00 173.10 176.25 1pla s ALA 64 N 2.04 2.85 0.00 3.20 0.00 -1.26 -0.19 121.76 128.40 1pla s ALA 64 Ca 0.11 0.86 0.00 0.00 0.00 0.00 0.00 51.96 52.93 1pla s ALA 64 Cb -0.17 -4.04 0.00 0.00 0.00 0.00 0.00 23.12 18.91 1pla s ALA 64 CO 0.12 -2.62 0.00 0.41 0.00 0.00 0.00 175.76 173.68 1pla n GLY 65 N 5.58 1.23 3.74 0.00 0.00 -1.22 -5.05 105.19 109.47 1pla n GLY 65 Ca 0.28 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.95 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 -0.83 2.61 0.16 1.61 2.12 0.74 -4.57 118.70 120.54 1pla s GLU 66 Ca 0.00 1.87 -0.04 0.00 0.36 0.00 0.00 54.97 57.17 1pla s GLU 66 Cb 0.00 -1.88 -0.03 0.00 0.26 0.00 0.00 34.13 32.48 1pla s GLU 66 CO 0.00 -1.50 0.16 0.95 -0.54 0.00 0.00 175.26 174.33 1pla s THR 67 N -1.65 0.06 -0.01 -1.70 -4.23 -1.26 -2.30 115.64 104.55 1pla s THR 67 Ca 0.78 -1.77 0.02 0.00 -1.18 0.00 0.00 61.69 59.54 1pla s THR 67 Cb -0.32 -2.11 0.00 0.00 1.34 0.00 0.00 72.50 71.41 1pla s THR 67 CO 0.39 -0.28 -0.05 -0.47 -0.54 0.00 0.00 174.62 173.66 1pla s TYR 68 N -4.05 0.50 0.15 3.99 6.14 -0.79 -4.95 117.35 118.33 1pla s TYR 68 Ca 0.26 -0.10 -0.00 0.00 0.64 0.00 0.00 57.07 57.87 1pla s TYR 68 Cb 0.06 -0.35 -0.04 0.00 0.42 0.00 0.00 41.96 42.04 1pla s TYR 68 CO 0.04 -0.03 0.32 -1.21 0.64 0.00 0.00 175.55 175.31 1pla s GLU 69 N 0.05 3.50 -0.14 4.97 8.01 -1.26 -1.14 118.70 132.69 1pla s GLU 69 Ca -0.00 -0.39 -0.09 0.00 0.01 0.00 0.00 54.97 54.49 1pla s GLU 69 Cb -0.04 -2.92 0.05 0.00 -4.31 0.00 0.00 34.13 26.91 1pla s GLU 69 CO -0.00 0.49 0.35 0.08 0.01 0.00 0.00 175.26 176.18 1pla s VAL 70 N -1.72 -0.02 -0.32 2.63 1.01 0.18 -4.96 120.40 117.20 1pla s VAL 70 Ca 0.37 0.07 0.02 0.00 0.00 0.00 0.00 61.98 62.44 1pla s VAL 70 Cb -0.12 -0.51 0.10 0.00 0.00 0.00 0.00 36.38 35.85 1pla s VAL 70 CO 0.28 0.03 0.07 -0.89 0.00 0.00 0.00 175.10 174.59 1pla s THR 71 N 0.92 1.58 0.70 3.92 2.01 -1.26 -0.34 115.64 123.17 1pla s THR 71 Ca -0.06 -1.86 -0.11 0.00 0.31 0.00 0.00 61.69 59.98 1pla s THR 71 Cb -0.07 -2.17 0.02 0.00 0.01 0.00 0.00 72.50 70.30 1pla s THR 71 CO -0.07 -0.62 1.08 -0.76 -0.69 0.00 0.00 174.62 173.56 1pla s LEU 72 N 1.26 2.89 -0.03 4.42 1.43 -1.26 -4.98 118.68 122.41 1pla s LEU 72 Ca 0.10 1.01 0.13 0.00 -1.03 0.00 0.00 54.13 54.34 1pla s LEU 72 Cb -0.18 -3.77 0.23 0.00 0.03 0.00 0.00 46.19 42.50 1pla s LEU 72 CO -0.16 -1.38 1.11 0.41 0.23 0.00 0.00 176.35 176.55 1pla n THR 73 N -2.99 0.06 -3.70 5.49 -1.04 -1.26 -3.07 114.28 107.77 1pla n THR 73 Ca 0.07 -0.62 -0.15 0.00 -2.04 0.00 0.00 64.05 61.30 1pla n THR 73 Cb 0.58 0.78 -0.15 0.00 -1.82 0.00 0.00 70.33 69.72 1pla n THR 73 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 1pla s GLU 74 N -0.18 0.06 0.16 -2.82 2.02 -1.26 -4.97 118.70 111.71 1pla s GLU 74 Ca 0.16 0.48 -0.32 0.00 0.02 0.00 0.00 54.97 55.31 1pla s GLU 74 Cb 0.21 -0.24 -0.12 0.00 0.10 0.00 0.00 34.13 34.08 1pla s GLU 74 CO -0.08 -0.25 1.74 0.36 0.02 0.00 0.00 175.26 177.05 1pla n LYS 75 N 4.85 2.63 0.00 1.61 2.85 -1.26 -4.62 118.16 124.22 1pla n LYS 75 Ca -0.14 0.95 0.00 0.00 -1.05 0.00 0.00 58.31 58.07 1pla n LYS 75 Cb 0.51 -2.80 0.00 0.00 -0.65 0.00 0.00 35.03 32.09 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 3.96 0.96 3.27 2.58 0.00 -0.57 -4.92 105.19 110.48 1pla n GLY 76 Ca 0.17 -1.32 -0.40 0.00 0.00 0.00 0.00 46.02 44.47 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 -1.92 4.21 0.37 2.61 2.01 -1.26 -0.47 115.64 121.21 1pla s THR 77 Ca 0.00 -1.36 -0.06 0.00 0.31 0.00 0.00 61.69 60.58 1pla s THR 77 Cb 0.00 -3.56 -0.05 0.00 0.01 0.00 0.00 72.50 68.90 1pla s THR 77 CO 0.00 -0.48 0.67 -0.31 -0.69 0.00 0.00 174.62 173.81 1pla s TYR 78 N 1.43 3.50 -0.14 4.92 2.02 -1.00 -4.77 117.35 123.31 1pla s TYR 78 Ca 0.03 0.76 0.00 0.00 -0.37 0.00 0.00 57.07 57.49 1pla s TYR 78 Cb -0.23 -2.22 -0.01 0.00 -0.40 0.00 0.00 41.96 39.10 1pla s TYR 78 CO 0.02 -0.02 -0.14 0.15 -1.57 0.00 0.00 175.55 173.99 1pla s LYS 79 N -4.00 3.30 0.06 -0.62 1.02 -1.26 -2.40 119.74 115.84 1pla s LYS 79 Ca 0.46 -0.72 0.00 0.00 0.02 0.00 0.00 55.97 55.74 1pla s LYS 79 Cb -0.10 -2.63 -0.04 0.00 -0.52 0.00 0.00 37.83 34.54 1pla s LYS 79 CO 0.34 0.12 -0.05 -0.59 -0.92 0.00 0.00 175.35 174.25 1pla s PHE 80 N 0.58 0.63 0.08 3.18 -0.71 -0.19 -2.21 117.98 119.33 1pla s PHE 80 Ca -0.08 -0.88 -0.12 0.00 -1.04 0.00 0.00 56.93 54.81 1pla s PHE 80 Cb -0.16 -0.41 0.04 0.00 -1.21 0.00 0.00 43.02 41.29 1pla s PHE 80 CO 0.03 -0.24 0.57 2.48 -1.34 0.00 0.00 175.22 176.72 1pla n TYR 81 N 0.42 -0.88 -3.83 3.49 4.11 -0.94 0.21 117.16 119.74 1pla n TYR 81 Ca -0.16 -0.63 -0.36 0.00 -0.00 0.00 0.00 57.90 56.75 1pla n TYR 81 Cb 0.59 0.30 -0.13 0.00 -0.00 0.00 0.00 39.34 40.11 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 8.17 0.89 -0.50 0.00 4.57 -1.90 -0.01 114.58 125.79 1pla h GLU 83 Ca -0.34 -0.46 -0.08 0.00 -1.18 0.00 0.00 59.36 57.30 1pla h GLU 83 Cb 1.13 0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 29.72 1pla h GLU 83 CO 0.59 1.11 0.00 -1.35 -1.18 0.00 0.00 179.01 178.19 1pla h PRO 84 N 0.73 0.88 -0.63 0.92 0.11 -1.94 -2.77 132.00 129.29 1pla h PRO 84 Ca 0.06 -0.28 0.00 0.00 0.11 0.00 0.00 66.00 65.89 1pla h PRO 84 Cb 0.96 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 31.99 1pla h PRO 84 CO 0.09 0.91 0.00 0.72 -0.21 0.00 0.00 178.00 179.51 1pla n HIS 85 N -4.32 1.76 0.44 0.65 8.25 -1.22 -4.40 115.22 116.38 1pla n HIS 85 Ca 0.01 -0.62 0.03 0.00 -0.26 0.00 0.00 57.72 56.88 1pla n HIS 85 Cb 0.31 -0.42 0.20 0.00 1.12 0.00 0.00 29.99 31.21 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 0.65 1.76 0.68 -1.41 0.00 -0.02 -1.07 120.51 121.10 1pla n ALA 86 Ca 0.25 -0.04 0.11 0.00 0.00 0.00 0.00 53.44 53.75 1pla n ALA 86 Cb 1.04 -1.11 0.04 0.00 0.00 0.00 0.00 19.45 19.41 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 -0.56 -1.18 0.12 0.00 0.00 -1.26 -4.34 105.19 97.97 1pla n GLY 87 Ca 0.05 -0.42 -0.24 0.00 0.00 0.00 0.00 46.02 45.41 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 -1.74 0.96 0.00 4.61 0.00 -0.23 -5.00 120.51 119.11 1pla n ALA 88 Ca 0.03 -0.72 0.00 0.00 0.00 0.00 0.00 53.44 52.75 1pla n ALA 88 Cb 0.41 -0.36 0.00 0.00 0.00 0.00 0.00 19.45 19.50 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 1.54 -0.17 3.55 0.00 0.00 -1.22 -5.07 105.19 103.83 1pla n GLY 89 Ca -0.39 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.24 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 0.00 2.75 0.07 1.61 1.00 -1.25 -4.77 119.30 118.71 1pla s MET 90 Ca 0.00 0.49 0.06 0.00 0.00 0.00 0.00 55.69 56.24 1pla s MET 90 Cb 0.00 -4.34 -0.03 0.00 0.00 0.00 0.00 34.83 30.46 1pla s MET 90 CO 0.00 -2.60 -0.16 -1.59 0.00 0.00 0.00 175.02 170.67 1pla s LYS 91 N 6.76 0.94 0.06 2.03 0.00 -1.26 -2.64 119.74 125.62 1pla s LYS 91 Ca 0.62 -0.93 0.02 0.00 0.00 0.00 0.00 55.97 55.67 1pla s LYS 91 Cb -0.12 -1.00 -0.03 0.00 0.00 0.00 0.00 37.83 36.68 1pla s LYS 91 CO 0.20 0.23 -0.07 0.20 0.00 0.00 0.00 175.35 175.92 1pla s GLY 92 N -1.56 0.58 -0.04 0.59 0.00 0.58 -4.38 107.32 103.09 1pla s GLY 92 Ca 0.01 -0.97 -0.22 0.00 0.00 0.00 0.00 44.72 43.53 1pla s GLY 92 CO 0.02 -1.05 0.49 -0.54 0.00 0.00 0.00 173.10 172.03 1pla s GLU 93 N -2.43 0.85 -0.11 2.90 2.02 -0.96 -1.03 118.70 119.94 1pla s GLU 93 Ca -0.02 0.07 -0.03 0.00 0.02 0.00 0.00 54.97 55.01 1pla s GLU 93 Cb -0.04 0.39 0.05 0.00 0.10 0.00 0.00 34.13 34.62 1pla s GLU 93 CO -0.02 -0.24 0.07 0.54 0.02 0.00 0.00 175.26 175.63 1pla s VAL 94 N -1.16 -0.02 -0.83 2.63 0.11 -1.01 -2.58 120.40 117.54 1pla s VAL 94 Ca -0.12 0.08 -0.20 0.00 -2.93 0.00 0.00 61.98 58.82 1pla s VAL 94 Cb -0.03 -0.42 0.11 0.00 -1.53 0.00 0.00 36.38 34.51 1pla s VAL 94 CO 0.07 -0.05 1.04 -0.89 -3.33 0.00 0.00 175.10 171.94 1pla s THR 95 N 2.12 4.65 0.41 5.04 2.01 -0.86 -2.37 115.64 126.64 1pla s THR 95 Ca 0.03 -1.22 -0.22 0.00 0.31 0.00 0.00 61.69 60.58 1pla s THR 95 Cb -0.14 -4.72 -0.10 0.00 0.01 0.00 0.00 72.50 67.55 1pla s THR 95 CO -0.06 -1.45 0.97 -0.69 -0.69 0.00 0.00 174.62 172.70 1pla s VAL 96 N 2.99 4.19 0.00 3.82 1.01 0.38 -2.07 120.40 130.73 1pla s VAL 96 Ca 0.28 1.49 0.00 0.00 0.00 0.00 0.00 61.98 63.75 1pla s VAL 96 Cb -0.10 -3.68 0.00 0.00 0.00 0.00 0.00 36.38 32.60 1pla s VAL 96 CO -0.03 -0.17 0.00 -0.46 0.00 0.00 0.00 175.10 174.44