#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hsp n SER 2 N 0.00 -0.46 -4.65 1.61 7.64 -1.26 -5.10 113.62 111.40 2hsp n SER 2 Ca 0.00 -2.84 -0.42 0.00 1.01 0.00 0.00 58.87 56.62 2hsp n SER 2 Cb 0.00 -0.11 -0.03 0.00 -1.01 0.00 0.00 64.21 63.06 2hsp n SER 2 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 2hsp s PRO 3 N -0.83 4.09 0.23 1.43 0.04 -1.26 -4.98 135.00 133.72 2hsp s PRO 3 Ca 0.34 2.01 -0.07 0.00 0.04 0.00 0.00 61.00 63.33 2hsp s PRO 3 Cb 0.19 -3.98 -0.02 0.00 0.04 0.00 0.00 34.50 30.73 2hsp s PRO 3 CO -0.14 -0.95 0.31 0.95 0.04 0.00 0.00 177.00 177.22 2hsp s THR 4 N 4.30 0.00 0.00 1.26 -4.23 -1.26 -4.88 115.64 110.83 2hsp s THR 4 Ca 0.71 -1.70 0.00 0.00 -1.18 0.00 0.00 61.69 59.52 2hsp s THR 4 Cb -0.30 -2.36 0.00 0.00 1.34 0.00 0.00 72.50 71.17 2hsp s THR 4 CO 0.28 0.00 0.00 0.33 -0.54 0.00 0.00 174.62 174.69 2hsp n PHE 5 N -0.34 -1.26 -1.35 3.99 7.35 -1.26 -4.85 117.46 119.75 2hsp n PHE 5 Ca 0.00 0.00 0.09 0.00 -0.76 0.00 0.00 57.45 56.79 2hsp n PHE 5 Cb 0.64 0.00 -0.05 0.00 0.35 0.00 0.00 39.48 40.42 2hsp n PHE 5 CO 0.00 0.00 0.00 1.63 -0.76 0.00 0.00 176.76 177.63 2hsp n LYS 6 N -0.67 -2.92 -2.78 -4.13 4.01 -1.26 -4.57 118.16 105.85 2hsp n LYS 6 Ca 0.00 2.35 -0.43 0.00 -0.51 0.00 0.00 58.31 59.72 2hsp n LYS 6 Cb 0.00 -3.30 -0.04 0.00 -0.51 0.00 0.00 35.03 31.19 2hsp n LYS 6 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 2hsp n ALA 8 N 7.46 0.32 -3.97 0.00 0.00 -1.26 -1.79 120.51 121.28 2hsp n ALA 8 Ca 0.06 -1.23 -0.14 0.00 0.00 0.00 0.00 53.44 52.12 2hsp n ALA 8 Cb 0.48 0.62 -0.04 0.00 0.00 0.00 0.00 19.45 20.51 2hsp n ALA 8 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 2hsp n VAL 9 N -0.88 0.00 -3.51 0.00 0.24 -1.06 -3.70 118.33 109.42 2hsp n VAL 9 Ca -0.08 -1.71 -0.29 0.00 -2.04 0.00 0.00 64.34 60.23 2hsp n VAL 9 Cb 0.35 1.01 -0.12 0.00 -1.47 0.00 0.00 33.84 33.60 2hsp n VAL 9 CO 0.00 0.00 0.00 -0.75 -2.14 0.00 0.00 176.83 173.94 2hsp s LYS 10 N -2.81 0.76 -0.42 7.34 2.20 -1.21 -3.47 119.74 122.13 2hsp s LYS 10 Ca 0.28 -1.57 -0.43 0.00 -0.36 0.00 0.00 55.97 53.89 2hsp s LYS 10 Cb -0.00 -1.55 -0.19 0.00 -1.51 0.00 0.00 37.83 34.58 2hsp s LYS 10 CO 0.20 -1.22 1.44 0.00 -0.36 0.00 0.00 175.35 175.41 2hsp n ALA 11 N 3.80 -1.47 -0.02 3.13 0.00 -0.36 -4.55 120.51 121.05 2hsp n ALA 11 Ca 0.13 0.47 -0.04 0.00 0.00 0.00 0.00 53.44 54.00 2hsp n ALA 11 Cb 0.37 -1.77 -0.12 0.00 0.00 0.00 0.00 19.45 17.93 2hsp n ALA 11 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2hsp n LEU 12 N 3.50 0.62 -4.87 0.00 4.77 -1.21 0.43 117.00 120.25 2hsp n LEU 12 Ca 0.28 0.29 -0.21 0.00 -0.03 0.00 0.00 56.01 56.33 2hsp n LEU 12 Cb -0.04 0.19 -0.03 0.00 -2.33 0.00 0.00 43.42 41.20 2hsp n LEU 12 CO 0.81 0.29 -0.03 -0.36 -1.33 0.00 0.00 177.39 176.77 2hsp s PHE 13 N -2.77 2.77 -0.12 -1.77 0.40 -1.24 -4.70 117.98 110.56 2hsp s PHE 13 Ca -0.05 -0.43 -0.05 0.00 -0.60 0.00 0.00 56.93 55.79 2hsp s PHE 13 Cb 0.08 -2.04 -0.04 0.00 0.51 0.00 0.00 43.02 41.53 2hsp s PHE 13 CO 0.83 -0.02 0.09 0.34 0.70 0.00 0.00 175.22 177.16 2hsp s ASP 14 N -4.08 5.96 0.42 1.36 2.15 -1.26 -3.23 116.67 117.98 2hsp s ASP 14 Ca 0.46 0.33 0.07 0.00 0.43 0.00 0.00 52.55 53.84 2hsp s ASP 14 Cb -0.04 -1.87 -0.06 0.00 -0.30 0.00 0.00 42.92 40.65 2hsp s ASP 14 CO 0.27 0.38 0.12 -0.47 -0.17 0.00 0.00 175.17 175.30 2hsp s TYR 15 N -0.84 2.54 -0.46 -5.34 6.14 -0.45 -4.97 117.35 113.98 2hsp s TYR 15 Ca 0.13 -0.63 0.06 0.00 0.64 0.00 0.00 57.07 57.27 2hsp s TYR 15 Cb -0.12 -1.89 0.19 0.00 0.42 0.00 0.00 41.96 40.56 2hsp s TYR 15 CO 0.03 0.27 0.54 1.17 0.64 0.00 0.00 175.55 178.20 2hsp n LYS 16 N -1.15 0.41 0.01 4.97 4.81 -1.26 -4.27 118.16 121.67 2hsp n LYS 16 Ca -0.03 -2.65 0.00 0.00 -0.87 0.00 0.00 58.31 54.76 2hsp n LYS 16 Cb 0.65 -1.54 0.00 0.00 0.02 0.00 0.00 35.03 34.17 2hsp n LYS 16 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2hsp n ALA 17 N 2.66 3.00 0.00 3.14 0.00 -1.24 -4.79 120.51 123.28 2hsp n ALA 17 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.67 2hsp n ALA 17 Cb 0.53 0.35 0.00 0.00 0.00 0.00 0.00 19.45 20.33 2hsp n ALA 17 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 2hsp n GLN 18 N -2.92 0.00 -2.67 0.00 7.27 -1.26 -4.26 117.38 113.54 2hsp n GLN 18 Ca 0.00 0.00 -0.04 0.00 0.07 0.00 0.00 57.00 57.03 2hsp n GLN 18 Cb 0.34 -0.13 0.06 0.00 2.41 0.00 0.00 30.24 32.92 2hsp n GLN 18 CO 0.00 0.00 0.00 2.89 0.07 0.00 0.00 177.06 180.02 2hsp n ARG 19 N 0.00 0.15 0.00 3.69 1.85 -1.21 -4.50 116.66 116.64 2hsp n ARG 19 Ca 0.00 -0.80 0.00 0.00 -1.00 0.00 0.00 57.85 56.05 2hsp n ARG 19 Cb 0.00 -0.17 0.00 0.00 -1.05 0.00 0.00 32.46 31.24 2hsp n ARG 19 CO 0.00 0.00 0.00 -0.85 -0.01 0.00 0.00 177.63 176.77 2hsp n GLU 20 N 1.96 0.37 0.00 2.89 -0.00 -1.26 -4.86 120.64 119.73 2hsp n GLU 20 Ca 0.06 -0.55 0.00 0.00 -0.00 0.00 0.00 57.16 56.67 2hsp n GLU 20 Cb 0.68 -0.72 0.00 0.00 -0.00 0.00 0.00 31.44 31.39 2hsp n GLU 20 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 2hsp n ASP 21 N -0.10 0.00 -4.32 -1.84 9.92 -1.26 -5.04 116.55 113.91 2hsp n ASP 21 Ca 0.00 0.00 -0.17 0.00 -0.53 0.00 0.00 54.79 54.09 2hsp n ASP 21 Cb 0.25 0.00 -0.10 0.00 -0.64 0.00 0.00 41.12 40.63 2hsp n ASP 21 CO 0.00 0.00 0.00 -0.70 0.13 0.00 0.00 177.20 176.63 2hsp s GLU 22 N -0.38 1.27 0.26 -1.24 -6.30 -1.26 0.27 118.70 111.32 2hsp s GLU 22 Ca 0.00 -1.59 0.06 0.00 -2.50 0.00 0.00 54.97 50.94 2hsp s GLU 22 Cb 0.00 -0.81 -0.05 0.00 0.00 0.00 0.00 34.13 33.26 2hsp s GLU 22 CO 0.00 0.05 -0.06 -0.51 0.02 0.00 0.00 175.26 174.76 2hsp s LEU 23 N -3.28 2.44 -0.15 2.70 1.02 -1.24 -3.31 118.68 116.87 2hsp s LEU 23 Ca 0.23 -1.17 0.04 0.00 0.02 0.00 0.00 54.13 53.25 2hsp s LEU 23 Cb 0.03 -0.57 0.32 0.00 0.02 0.00 0.00 46.19 45.98 2hsp s LEU 23 CO 0.06 -0.35 1.23 1.07 0.02 0.00 0.00 176.35 178.38 2hsp n THR 24 N -0.52 1.59 -1.47 5.49 5.66 -1.26 -3.63 114.28 120.14 2hsp n THR 24 Ca -0.06 -0.72 -0.45 0.00 -3.05 0.00 0.00 64.05 59.77 2hsp n THR 24 Cb 0.63 -0.60 -0.01 0.00 -1.55 0.00 0.00 70.33 68.80 2hsp n THR 24 CO 0.00 0.00 0.00 2.22 -3.05 0.00 0.00 175.07 174.24 2hsp n PHE 25 N 0.02 -0.03 -3.66 1.09 1.16 -1.26 -4.37 117.46 110.40 2hsp n PHE 25 Ca 0.19 0.76 -0.20 0.00 -1.87 0.00 0.00 57.45 56.33 2hsp n PHE 25 Cb 0.84 -2.05 -0.03 0.00 -1.61 0.00 0.00 39.48 36.64 2hsp n PHE 25 CO 0.00 0.00 0.00 0.96 -1.87 0.00 0.00 176.76 175.85 2hsp s ILE 26 N -1.19 3.45 0.01 1.97 -5.25 -1.26 -1.34 121.20 117.58 2hsp s ILE 26 Ca 0.62 -1.28 -0.34 0.00 -0.99 0.00 0.00 60.65 58.66 2hsp s ILE 26 Cb -0.75 -3.18 -0.12 0.00 2.95 0.00 0.00 42.46 41.36 2hsp s ILE 26 CO 0.58 -0.13 1.78 1.17 -1.79 0.00 0.00 174.94 176.55 2hsp n LYS 27 N -1.48 2.21 0.00 0.37 0.00 -1.20 -0.37 118.16 117.69 2hsp n LYS 27 Ca -0.00 0.81 0.00 0.00 0.00 0.00 0.00 58.31 59.11 2hsp n LYS 27 Cb 0.60 -2.63 0.00 0.00 0.00 0.00 0.00 35.03 33.00 2hsp n LYS 27 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.40 176.27 2hsp n SER 28 N 5.52 0.00 -4.76 3.14 3.41 0.17 -4.99 113.62 116.11 2hsp n SER 28 Ca 0.20 0.00 -0.39 0.00 -0.26 0.00 0.00 58.87 58.43 2hsp n SER 28 Cb 0.30 0.00 0.02 0.00 -0.26 0.00 0.00 64.21 64.27 2hsp n SER 28 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2hsp s ALA 29 N -2.00 2.98 -0.18 7.33 0.00 0.50 -4.70 121.76 125.70 2hsp s ALA 29 Ca 0.00 1.28 0.01 0.00 0.00 0.00 0.00 51.96 53.25 2hsp s ALA 29 Cb 0.00 -3.53 0.02 0.00 0.00 0.00 0.00 23.12 19.61 2hsp s ALA 29 CO 0.00 -1.15 -0.20 0.42 0.00 0.00 0.00 175.76 174.83 2hsp s ILE 30 N -1.32 2.07 0.12 0.00 1.09 -1.26 -1.22 121.20 120.67 2hsp s ILE 30 Ca 0.66 -0.94 0.05 0.00 -1.10 0.00 0.00 60.65 59.33 2hsp s ILE 30 Cb -0.39 -1.86 -0.04 0.00 -1.06 0.00 0.00 42.46 39.11 2hsp s ILE 30 CO 0.47 0.54 0.03 -0.63 -0.10 0.00 0.00 174.94 175.25 2hsp s ILE 31 N 1.26 4.10 0.35 2.92 1.01 -1.23 -4.86 121.20 124.76 2hsp s ILE 31 Ca 0.04 -1.06 0.08 0.00 0.00 0.00 0.00 60.65 59.71 2hsp s ILE 31 Cb -0.13 -3.00 -0.05 0.00 0.01 0.00 0.00 42.46 39.29 2hsp s ILE 31 CO -0.12 0.04 0.08 -1.10 0.00 0.00 0.00 174.94 173.84 2hsp s GLN 32 N -2.57 2.19 -0.18 2.79 -0.21 -1.12 -2.55 119.66 118.00 2hsp s GLN 32 Ca 0.27 -1.71 -0.07 0.00 0.02 0.00 0.00 55.36 53.87 2hsp s GLN 32 Cb -0.11 -2.01 0.01 0.00 1.00 0.00 0.00 33.01 31.90 2hsp s GLN 32 CO 0.20 0.08 0.15 0.09 -2.12 0.00 0.00 175.29 173.68 2hsp n ASN 33 N -1.07 -6.91 -4.35 5.90 5.03 -0.82 -2.87 115.26 110.18 2hsp n ASN 33 Ca -0.03 0.61 -0.23 0.00 0.87 0.00 0.00 54.58 55.79 2hsp n ASN 33 Cb 0.62 -2.89 -0.12 0.00 -1.02 0.00 0.00 39.78 36.38 2hsp n ASN 33 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.26 175.97 2hsp s VAL 34 N -1.36 1.93 -0.30 2.41 0.11 -0.74 -3.08 120.40 119.37 2hsp s VAL 34 Ca 0.08 -1.89 -0.13 0.00 -2.93 0.00 0.00 61.98 57.10 2hsp s VAL 34 Cb -0.01 -1.87 0.18 0.00 -1.53 0.00 0.00 36.38 33.15 2hsp s VAL 34 CO 0.40 -0.23 1.08 -0.70 -3.33 0.00 0.00 175.10 172.32 2hsp s GLU 35 N -2.64 0.15 0.22 1.54 -6.30 -1.25 -4.91 118.70 105.51 2hsp s GLU 35 Ca 0.16 0.24 -0.30 0.00 -2.50 0.00 0.00 54.97 52.56 2hsp s GLU 35 Cb -0.07 0.13 -0.15 0.00 0.00 0.00 0.00 34.13 34.04 2hsp s GLU 35 CO 0.07 -0.20 1.01 0.36 0.02 0.00 0.00 175.26 176.52 2hsp n LYS 36 N 5.38 1.06 -4.31 4.30 2.85 -1.26 -3.91 118.16 122.28 2hsp n LYS 36 Ca -0.03 0.37 -0.31 0.00 -1.05 0.00 0.00 58.31 57.29 2hsp n LYS 36 Cb 0.55 -1.75 -0.09 0.00 -0.65 0.00 0.00 35.03 33.09 2hsp n LYS 36 CO 0.00 0.00 0.00 -1.14 -0.05 0.00 0.00 177.40 176.21 2hsp s GLN 37 N -0.95 2.55 -0.11 -1.58 -0.44 0.29 -4.90 119.66 114.53 2hsp s GLN 37 Ca 0.66 -0.76 -0.01 0.00 -2.50 0.00 0.00 55.36 52.75 2hsp s GLN 37 Cb -0.81 -2.53 -0.04 0.00 -1.64 0.00 0.00 33.01 28.00 2hsp s GLN 37 CO 0.56 0.58 0.73 0.39 0.50 0.00 0.00 175.29 178.05 2hsp n GLU 38 N 1.17 0.00 0.00 1.67 -0.58 -1.26 -1.02 120.64 120.62 2hsp n GLU 38 Ca -0.14 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.60 2hsp n GLU 38 Cb 0.52 -0.61 0.00 0.00 -0.57 0.00 0.00 31.44 30.79 2hsp n GLU 38 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2hsp n GLY 39 N 2.83 0.17 0.20 0.62 0.00 -1.26 -4.93 105.19 102.82 2hsp n GLY 39 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.09 2hsp n GLY 39 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2hsp n GLY 40 N 0.00 0.79 3.04 -0.02 0.00 -0.19 -5.01 105.19 103.80 2hsp n GLY 40 Ca 0.00 -0.09 -0.17 0.00 0.00 0.00 0.00 46.02 45.76 2hsp n GLY 40 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2hsp s TRP 41 N -1.81 0.80 0.14 1.61 0.52 -1.21 -1.70 118.94 117.27 2hsp s TRP 41 Ca 0.00 -0.24 0.06 0.00 0.02 0.00 0.00 56.10 55.95 2hsp s TRP 41 Cb 0.00 -0.50 -0.04 0.00 -1.15 0.00 0.00 33.47 31.78 2hsp s TRP 41 CO 0.00 -0.01 -0.00 -1.58 0.02 0.00 0.00 176.95 175.37 2hsp s TRP 42 N -0.51 2.90 0.48 -1.98 0.52 0.22 0.11 118.94 120.67 2hsp s TRP 42 Ca 0.01 -0.09 0.06 0.00 0.02 0.00 0.00 56.10 56.09 2hsp s TRP 42 Cb -0.05 -1.45 -0.01 0.00 -1.15 0.00 0.00 33.47 30.81 2hsp s TRP 42 CO 0.00 0.49 0.24 1.03 0.02 0.00 0.00 176.95 178.73 2hsp s ARG 43 N -2.66 2.25 0.00 4.98 0.52 -1.25 -0.53 118.95 122.25 2hsp s ARG 43 Ca 0.26 -1.99 0.00 0.00 -0.52 0.00 0.00 55.73 53.49 2hsp s ARG 43 Cb -0.10 -1.96 0.00 0.00 0.52 0.00 0.00 34.95 33.40 2hsp s ARG 43 CO 0.18 -0.34 0.00 0.41 0.02 0.00 0.00 175.30 175.58 2hsp n GLY 44 N -1.44 4.47 3.77 -3.53 0.00 -1.18 -3.97 105.19 103.31 2hsp n GLY 44 Ca -0.04 -1.25 -0.37 0.00 0.00 0.00 0.00 46.02 44.36 2hsp n GLY 44 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2hsp s ASP 45 N 0.00 6.16 -0.36 1.61 1.47 -1.14 -2.77 116.67 121.64 2hsp s ASP 45 Ca 0.00 2.30 0.06 0.00 1.18 0.00 0.00 52.55 56.09 2hsp s ASP 45 Cb 0.00 -2.60 0.18 0.00 -0.34 0.00 0.00 42.92 40.15 2hsp s ASP 45 CO 0.00 -0.92 0.54 -0.47 0.68 0.00 0.00 175.17 175.00 2hsp s TYR 46 N -1.55 -1.37 0.00 2.11 5.04 -1.26 -2.81 117.35 117.51 2hsp s TYR 46 Ca 0.64 0.20 0.00 0.00 -2.44 0.00 0.00 57.07 55.47 2hsp s TYR 46 Cb -0.28 0.11 0.00 0.00 0.35 0.00 0.00 41.96 42.13 2hsp s TYR 46 CO 0.34 -1.09 0.00 0.41 -1.34 0.00 0.00 175.55 173.87 2hsp n GLY 47 N 4.70 0.95 0.27 8.97 0.00 -1.26 -4.15 105.19 114.67 2hsp n GLY 47 Ca 0.08 -1.66 0.10 0.00 0.00 0.00 0.00 46.02 44.55 2hsp n GLY 47 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2hsp n GLY 48 N 0.00 -0.38 4.00 -0.02 0.00 -1.26 -4.85 105.19 102.68 2hsp n GLY 48 Ca 0.00 -0.27 -0.24 0.00 0.00 0.00 0.00 46.02 45.51 2hsp n GLY 48 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2hsp s LYS 49 N -1.91 1.51 -0.28 1.61 -0.14 -1.26 -5.10 119.74 114.16 2hsp s LYS 49 Ca 0.31 -1.26 0.02 0.00 -1.36 0.00 0.00 55.97 53.68 2hsp s LYS 49 Cb 0.16 -2.32 0.16 0.00 -1.68 0.00 0.00 37.83 34.14 2hsp s LYS 49 CO 0.25 -1.58 0.43 0.21 -0.76 0.00 0.00 175.35 173.90 2hsp s LYS 50 N -5.19 0.42 -0.32 1.68 2.20 -1.26 -4.07 119.74 113.21 2hsp s LYS 50 Ca 0.68 0.25 -0.00 0.00 -0.36 0.00 0.00 55.97 56.54 2hsp s LYS 50 Cb -0.04 -0.25 -0.00 0.00 -1.51 0.00 0.00 37.83 36.03 2hsp s LYS 50 CO 0.45 -0.97 0.30 1.04 -0.36 0.00 0.00 175.35 175.80 2hsp n GLN 51 N 5.36 -0.58 0.00 4.03 6.02 -1.18 -4.80 117.38 126.23 2hsp n GLN 51 Ca 0.00 0.83 0.00 0.00 -0.01 0.00 0.00 57.00 57.83 2hsp n GLN 51 Cb 0.50 -3.23 0.00 0.00 1.02 0.00 0.00 30.24 28.53 2hsp n GLN 51 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 2hsp n LEU 52 N -1.43 0.00 -3.90 1.08 4.77 -1.12 -4.56 117.00 111.85 2hsp n LEU 52 Ca -0.00 0.00 -0.11 0.00 -0.03 0.00 0.00 56.01 55.87 2hsp n LEU 52 Cb 0.51 0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 41.48 2hsp n LEU 52 CO 0.22 0.00 -0.29 0.26 -1.33 0.00 0.00 177.39 176.24 2hsp s TRP 53 N 4.11 0.06 -0.09 -1.77 0.52 0.78 -4.11 118.94 118.44 2hsp s TRP 53 Ca 0.00 -0.11 -0.05 0.00 0.02 0.00 0.00 56.10 55.96 2hsp s TRP 53 Cb 0.00 -0.06 0.04 0.00 -1.15 0.00 0.00 33.47 32.30 2hsp s TRP 53 CO 0.00 -0.13 0.21 -0.59 0.02 0.00 0.00 176.95 176.47 2hsp s PHE 54 N -0.70 -0.27 0.70 -1.98 -0.71 0.31 -3.67 117.98 111.66 2hsp s PHE 54 Ca -0.08 0.68 -0.16 0.00 -1.04 0.00 0.00 56.93 56.32 2hsp s PHE 54 Cb -0.05 0.02 -0.04 0.00 -1.21 0.00 0.00 43.02 41.74 2hsp s PHE 54 CO 0.00 -0.20 0.57 -2.30 -1.34 0.00 0.00 175.22 171.95 2hsp n PRO 55 N 4.04 0.35 -0.29 1.99 -0.02 -1.26 0.68 135.00 140.49 2hsp n PRO 55 Ca -0.24 0.16 0.11 0.00 -2.02 0.00 0.00 63.50 61.51 2hsp n PRO 55 Cb 0.53 -1.85 0.28 0.00 -0.02 0.00 0.00 33.50 32.44 2hsp n PRO 55 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 2hsp n SER 56 N -0.31 3.39 -0.00 2.55 3.41 -0.69 -1.99 113.62 119.97 2hsp n SER 56 Ca 0.10 -1.98 0.07 0.00 -0.26 0.00 0.00 58.87 56.80 2hsp n SER 56 Cb 0.50 -0.38 -0.10 0.00 -0.26 0.00 0.00 64.21 63.97 2hsp n SER 56 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 2hsp n ASN 57 N 1.37 1.43 -0.09 4.04 3.02 -1.26 -4.64 115.26 119.13 2hsp n ASN 57 Ca 0.21 -0.25 -0.17 0.00 -0.03 0.00 0.00 54.58 54.34 2hsp n ASN 57 Cb 0.55 1.44 -0.07 0.00 -0.61 0.00 0.00 39.78 41.09 2hsp n ASN 57 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 2hsp n TYR 58 N -1.78 0.00 -2.33 3.10 4.02 -1.17 -4.99 117.16 114.01 2hsp n TYR 58 Ca -0.01 0.00 -0.25 0.00 -0.01 0.00 0.00 57.90 57.63 2hsp n TYR 58 Cb 0.32 -0.64 0.07 0.00 -0.02 0.00 0.00 39.34 39.07 2hsp n TYR 58 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 176.86 175.99 2hsp s VAL 59 N -2.33 2.35 -0.24 -0.72 -7.23 -0.84 -3.34 120.40 108.05 2hsp s VAL 59 Ca -0.24 -0.38 -0.08 0.00 -1.81 0.00 0.00 61.98 59.46 2hsp s VAL 59 Cb 0.08 -2.97 0.10 0.00 0.56 0.00 0.00 36.38 34.16 2hsp s VAL 59 CO 0.34 0.00 0.52 -1.61 -0.31 0.00 0.00 175.10 174.03 2hsp s GLU 60 N -5.14 0.44 -0.89 4.82 0.41 -1.26 -4.79 118.70 112.28 2hsp s GLU 60 Ca 0.60 1.20 -0.23 0.00 -0.41 0.00 0.00 54.97 56.13 2hsp s GLU 60 Cb -0.10 0.52 -0.19 0.00 -1.78 0.00 0.00 34.13 32.58 2hsp s GLU 60 CO 0.43 -0.22 2.02 -0.85 -0.49 0.00 0.00 175.26 176.15 2hsp n GLU 61 N 5.34 0.16 -2.83 1.61 0.28 -1.26 -3.32 120.64 120.61 2hsp n GLU 61 Ca -0.11 -1.27 0.00 0.00 -0.16 0.00 0.00 57.16 55.62 2hsp n GLU 61 Cb 0.50 -3.42 0.00 0.00 1.43 0.00 0.00 31.44 29.95 2hsp n GLU 61 CO 0.00 0.00 0.00 -1.33 -0.16 0.00 0.00 177.13 175.64 2hsp n MET 62 N 7.68 -1.17 -0.40 3.44 2.81 -1.24 -4.74 117.12 123.49 2hsp n MET 62 Ca 0.37 1.12 0.00 0.00 -1.81 0.00 0.00 57.70 57.38 2hsp n MET 62 Cb 0.46 -0.75 0.15 0.00 -0.71 0.00 0.00 33.22 32.36 2hsp n MET 62 CO 0.00 0.00 0.00 0.28 1.51 0.00 0.00 175.97 177.76 2hsp n VAL 63 N 2.41 1.32 -3.59 2.03 0.31 -1.26 -4.50 118.33 115.05 2hsp n VAL 63 Ca 0.00 -0.63 -0.29 0.00 -0.01 0.00 0.00 64.34 63.41 2hsp n VAL 63 Cb 0.00 -0.49 -0.14 0.00 -0.91 0.00 0.00 33.84 32.30 2hsp n VAL 63 CO 0.00 0.00 0.00 0.20 -1.32 0.00 0.00 176.83 175.71 2hsp s ASN 64 N -0.24 3.48 0.00 4.52 -0.87 -1.26 -5.13 114.94 115.45 2hsp s ASN 64 Ca 0.23 -1.91 0.00 0.00 -1.57 0.00 0.00 52.86 49.61 2hsp s ASN 64 Cb 0.18 -0.61 0.00 0.00 -0.02 0.00 0.00 41.25 40.80 2hsp s ASN 64 CO 0.06 -0.36 0.00 -2.65 -2.57 0.00 0.00 177.10 171.58 2hsp n PRO 65 N 4.45 3.09 -1.26 -0.60 -0.02 -1.26 -4.94 135.00 134.46 2hsp n PRO 65 Ca 0.03 0.00 0.15 0.00 -2.02 0.00 0.00 63.50 61.66 2hsp n PRO 65 Cb 0.39 0.00 -0.06 0.00 -0.02 0.00 0.00 33.50 33.81 2hsp n PRO 65 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2hsp n GLU 66 N 0.00 -2.56 0.00 -0.52 1.02 -1.26 -5.05 120.64 112.27 2hsp n GLU 66 Ca 0.00 1.97 0.00 0.00 -0.02 0.00 0.00 57.16 59.11 2hsp n GLU 66 Cb 0.00 -3.14 0.00 0.00 -0.02 0.00 0.00 31.44 28.28 2hsp n GLU 66 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2hsp n GLY 67 N -3.92 2.56 3.70 0.62 0.00 -1.26 -5.07 105.19 101.82 2hsp n GLY 67 Ca -0.05 -0.02 -0.23 0.00 0.00 0.00 0.00 46.02 45.73 2hsp n GLY 67 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2hsp s ILE 68 N -0.76 3.75 -0.13 -0.61 1.01 -1.26 -5.12 121.20 118.07 2hsp s ILE 68 Ca 0.00 -1.76 -0.04 0.00 0.00 0.00 0.00 60.65 58.85 2hsp s ILE 68 Cb 0.00 -3.01 -0.03 0.00 0.01 0.00 0.00 42.46 39.42 2hsp s ILE 68 CO 0.00 -0.37 0.02 -1.38 0.00 0.00 0.00 174.94 173.22 2hsp s HIS 69 N -2.27 3.20 0.00 3.97 0.00 -1.26 -4.93 115.29 114.00 2hsp s HIS 69 Ca 0.32 0.10 0.00 0.00 -3.00 0.00 0.00 55.06 52.48 2hsp s HIS 69 Cb -0.07 -1.91 0.00 0.00 -4.00 0.00 0.00 32.58 26.60 2hsp s HIS 69 CO 0.21 0.31 0.00 -2.13 -1.00 0.00 0.00 174.74 172.14 2hsp n ARG 70 N 2.77 0.87 0.00 -0.38 3.00 -1.26 -5.27 116.66 116.39 2hsp n ARG 70 Ca -0.18 0.00 0.10 0.00 -0.00 0.00 0.00 57.85 57.77 2hsp n ARG 70 Cb 0.53 0.00 0.08 0.00 0.00 0.00 0.00 32.46 33.07 2hsp n ARG 70 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.63 177.38