#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hsp s SER 2 N 0.00 5.15 0.37 1.61 0.01 -1.26 -5.12 113.70 114.47 2hsp s SER 2 Ca 0.00 -0.56 0.00 0.00 1.31 0.00 0.00 55.95 56.70 2hsp s SER 2 Cb 0.00 -0.92 0.00 0.00 0.21 0.00 0.00 66.02 65.31 2hsp s SER 2 CO 0.00 -0.34 0.00 -2.65 0.41 0.00 0.00 173.24 170.66 2hsp n PRO 3 N -1.32 0.19 -4.39 12.44 -0.02 -1.26 -5.04 135.00 135.60 2hsp n PRO 3 Ca -0.02 0.00 -0.26 0.00 -2.02 0.00 0.00 63.50 61.20 2hsp n PRO 3 Cb 0.60 0.00 -0.09 0.00 -0.02 0.00 0.00 33.50 33.99 2hsp n PRO 3 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 2hsp s THR 4 N -0.37 2.17 -0.23 3.45 2.01 -1.26 -5.14 115.64 116.26 2hsp s THR 4 Ca 0.00 -1.87 -0.09 0.00 0.31 0.00 0.00 61.69 60.04 2hsp s THR 4 Cb 0.00 -2.98 0.09 0.00 0.01 0.00 0.00 72.50 69.62 2hsp s THR 4 CO 0.00 -0.01 0.52 -0.36 -0.69 0.00 0.00 174.62 174.07 2hsp s PHE 5 N -2.65 -0.95 0.31 4.92 0.08 -1.26 -5.17 117.98 113.25 2hsp s PHE 5 Ca 0.38 1.79 -0.04 0.00 0.12 0.00 0.00 56.93 59.17 2hsp s PHE 5 Cb 0.07 0.48 -0.00 0.00 -0.57 0.00 0.00 43.02 42.99 2hsp s PHE 5 CO 0.20 -0.52 0.43 -1.59 -0.10 0.00 0.00 175.22 173.65 2hsp s LYS 6 N 2.37 1.77 0.34 0.44 -2.85 -1.26 -4.93 119.74 115.62 2hsp s LYS 6 Ca -0.05 -1.66 -0.17 0.00 -1.00 0.00 0.00 55.97 53.09 2hsp s LYS 6 Cb -0.11 0.43 0.06 0.00 -2.06 0.00 0.00 37.83 36.15 2hsp s LYS 6 CO -0.15 -0.72 0.84 0.00 0.10 0.00 0.00 175.35 175.42 2hsp s ALA 8 N -2.34 3.63 0.00 0.00 0.00 -1.26 -2.99 121.76 118.81 2hsp s ALA 8 Ca 0.16 -1.03 0.00 0.00 0.00 0.00 0.00 51.96 51.10 2hsp s ALA 8 Cb -0.05 0.20 0.00 0.00 0.00 0.00 0.00 23.12 23.27 2hsp s ALA 8 CO 0.10 -0.10 0.00 0.28 0.00 0.00 0.00 175.76 176.04 2hsp n VAL 9 N -1.11 0.00 -3.09 0.00 0.31 -1.14 -4.37 118.33 108.92 2hsp n VAL 9 Ca -0.13 0.00 0.02 0.00 -0.01 0.00 0.00 64.34 64.21 2hsp n VAL 9 Cb 0.67 0.00 -0.00 0.00 -0.91 0.00 0.00 33.84 33.59 2hsp n VAL 9 CO 0.00 0.00 0.00 -0.75 -1.32 0.00 0.00 176.83 174.76 2hsp s LYS 10 N 0.22 0.60 -0.48 5.55 2.20 -1.26 -4.35 119.74 122.22 2hsp s LYS 10 Ca 0.00 -0.12 -0.45 0.00 -0.36 0.00 0.00 55.97 55.04 2hsp s LYS 10 Cb 0.00 0.09 -0.19 0.00 -1.51 0.00 0.00 37.83 36.22 2hsp s LYS 10 CO 0.00 -0.89 1.56 0.00 -0.36 0.00 0.00 175.35 175.66 2hsp n ALA 11 N 4.34 -1.23 0.11 3.13 0.00 -0.82 -4.51 120.51 121.54 2hsp n ALA 11 Ca 0.09 0.46 0.01 0.00 0.00 0.00 0.00 53.44 54.00 2hsp n ALA 11 Cb 0.58 -1.85 -0.01 0.00 0.00 0.00 0.00 19.45 18.17 2hsp n ALA 11 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 2hsp h LEU 12 N 4.99 0.00 0.00 0.00 3.38 -1.72 0.78 115.31 122.75 2hsp h LEU 12 Ca -0.41 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.53 2hsp h LEU 12 Cb 1.32 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.06 2hsp h LEU 12 CO 0.95 0.57 -0.02 0.49 0.09 0.00 0.00 178.44 180.52 2hsp n PHE 13 N -3.18 -0.05 -4.29 1.13 3.72 -1.24 -4.79 117.46 108.76 2hsp n PHE 13 Ca -0.00 -0.12 -0.25 0.00 -0.05 0.00 0.00 57.45 57.02 2hsp n PHE 13 Cb 0.78 -0.02 -0.08 0.00 -0.94 0.00 0.00 39.48 39.22 2hsp n PHE 13 CO 0.00 0.00 0.00 0.16 -0.05 0.00 0.00 176.76 176.87 2hsp s ASP 14 N -1.14 4.41 0.31 4.37 -4.77 -1.26 -2.11 116.67 116.48 2hsp s ASP 14 Ca 0.00 -0.60 0.03 0.00 -3.30 0.00 0.00 52.55 48.68 2hsp s ASP 14 Cb -0.00 -0.79 -0.06 0.00 -1.09 0.00 0.00 42.92 40.98 2hsp s ASP 14 CO 0.00 0.06 0.08 -0.47 0.70 0.00 0.00 175.17 175.54 2hsp s TYR 15 N -1.99 1.79 -0.40 2.11 6.14 -0.04 -4.93 117.35 120.04 2hsp s TYR 15 Ca 0.28 -1.07 0.11 0.00 0.64 0.00 0.00 57.07 57.03 2hsp s TYR 15 Cb -0.08 -1.13 0.37 0.00 0.42 0.00 0.00 41.96 41.54 2hsp s TYR 15 CO 0.17 -0.15 1.01 0.36 0.64 0.00 0.00 175.55 177.59 2hsp n LYS 16 N -0.62 1.06 -0.11 4.97 2.85 -1.26 -4.30 118.16 120.76 2hsp n LYS 16 Ca -0.02 -2.60 -0.16 0.00 -1.05 0.00 0.00 58.31 54.49 2hsp n LYS 16 Cb 0.66 -1.09 -0.10 0.00 -0.65 0.00 0.00 35.03 33.85 2hsp n LYS 16 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2hsp n ALA 17 N 0.08 1.53 0.00 0.58 0.00 -1.18 -4.79 120.51 116.73 2hsp n ALA 17 Ca 0.11 -0.93 0.00 0.00 0.00 0.00 0.00 53.44 52.62 2hsp n ALA 17 Cb 0.74 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.19 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 -3.18 0.00 -2.71 0.00 0.00 -1.25 -4.30 117.38 105.94 2hsp n GLN 18 Ca -0.39 0.00 -0.02 0.00 -0.00 0.00 0.00 57.00 56.59 2hsp n GLN 18 Cb 0.91 -0.06 0.03 0.00 0.00 0.00 0.00 30.24 31.11 2hsp n GLN 18 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.06 177.56 2hsp s ARG 19 N 0.00 0.34 -0.09 3.69 3.52 -1.14 -4.28 118.95 120.99 2hsp s ARG 19 Ca 0.00 -0.30 0.16 0.00 -0.13 0.00 0.00 55.73 55.46 2hsp s ARG 19 Cb 0.00 -0.01 0.31 0.00 -1.56 0.00 0.00 34.95 33.70 2hsp s ARG 19 CO 0.00 -0.43 1.16 -0.85 -0.81 0.00 0.00 175.30 174.37 2hsp n GLU 20 N 2.85 0.48 -2.43 5.12 -0.00 -1.26 -4.86 120.64 120.54 2hsp n GLU 20 Ca 0.11 -1.86 -0.07 0.00 -0.00 0.00 0.00 57.16 55.35 2hsp n GLU 20 Cb 0.63 -0.07 0.01 0.00 -0.00 0.00 0.00 31.44 32.01 2hsp n GLU 20 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.13 173.66 2hsp n ASP 21 N -0.10 -2.84 0.00 -1.84 2.03 -1.26 -4.96 116.55 107.57 2hsp n ASP 21 Ca -0.07 -0.07 0.00 0.00 0.52 0.00 0.00 54.79 55.17 2hsp n ASP 21 Cb 0.92 -1.84 0.00 0.00 -0.72 0.00 0.00 41.12 39.48 2hsp n ASP 21 CO 0.00 0.00 0.00 1.21 -1.92 0.00 0.00 177.20 176.49 2hsp n GLU 22 N -1.71 0.00 -4.64 -0.67 2.13 -1.26 -3.50 120.64 110.99 2hsp n GLU 22 Ca -0.04 0.00 -0.30 0.00 0.66 0.00 0.00 57.16 57.48 2hsp n GLU 22 Cb 0.54 0.00 -0.09 0.00 0.27 0.00 0.00 31.44 32.16 2hsp n GLU 22 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 2hsp s LEU 23 N 0.00 2.61 -0.23 4.31 1.43 -1.25 -2.88 118.68 122.68 2hsp s LEU 23 Ca 0.00 -1.48 0.07 0.00 -1.03 0.00 0.00 54.13 51.68 2hsp s LEU 23 Cb 0.00 -0.86 0.52 0.00 0.03 0.00 0.00 46.19 45.89 2hsp s LEU 23 CO 0.00 -0.66 1.48 1.07 0.23 0.00 0.00 176.35 178.47 2hsp n THR 24 N -1.14 2.18 -1.47 5.49 5.66 -1.26 -3.08 114.28 120.65 2hsp n THR 24 Ca -0.11 -1.12 -0.43 0.00 -3.05 0.00 0.00 64.05 59.34 2hsp n THR 24 Cb 0.67 -0.47 -0.00 0.00 -1.55 0.00 0.00 70.33 68.97 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 -0.03 -0.14 -3.72 1.09 1.16 -1.26 -4.32 117.46 110.24 2hsp n PHE 25 Ca 0.29 0.67 -0.23 0.00 -1.87 0.00 0.00 57.45 56.31 2hsp n PHE 25 Cb 1.08 -2.04 -0.02 0.00 -1.61 0.00 0.00 39.48 36.90 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 -1.32 2.15 0.19 1.97 -4.36 -1.26 -0.86 121.20 117.71 2hsp s ILE 26 Ca 0.62 -1.42 -0.33 0.00 -0.26 0.00 0.00 60.65 59.27 2hsp s ILE 26 Cb -0.67 -2.57 -0.14 0.00 1.25 0.00 0.00 42.46 40.33 2hsp s ILE 26 CO 0.58 0.00 1.44 1.17 0.24 0.00 0.00 174.94 178.37 2hsp n LYS 27 N -1.66 1.93 0.00 0.37 4.81 -0.90 0.14 118.16 122.86 2hsp n LYS 27 Ca 0.02 0.69 0.00 0.00 -0.87 0.00 0.00 58.31 58.15 2hsp n LYS 27 Cb 0.63 -2.37 0.00 0.00 0.02 0.00 0.00 35.03 33.31 2hsp n LYS 27 CO 0.00 0.00 0.00 0.43 1.17 0.00 0.00 177.40 179.00 2hsp n SER 28 N 2.60 0.00 -4.62 3.14 7.64 0.27 -4.98 113.62 117.67 2hsp n SER 28 Ca 0.14 0.00 -0.38 0.00 1.01 0.00 0.00 58.87 59.64 2hsp n SER 28 Cb 0.29 0.00 0.05 0.00 -1.01 0.00 0.00 64.21 63.54 2hsp n SER 28 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2hsp n ALA 29 N -1.21 0.21 -3.86 -0.43 0.00 0.12 -4.68 120.51 110.66 2hsp n ALA 29 Ca 0.00 0.02 -0.30 0.00 0.00 0.00 0.00 53.44 53.16 2hsp n ALA 29 Cb 0.00 -2.11 -0.15 0.00 0.00 0.00 0.00 19.45 17.19 2hsp n ALA 29 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2hsp s ILE 30 N -1.50 1.54 0.22 0.00 1.09 -1.26 -1.95 121.20 119.34 2hsp s ILE 30 Ca 0.75 -1.88 -0.16 0.00 -1.10 0.00 0.00 60.65 58.26 2hsp s ILE 30 Cb -0.42 -2.15 -0.08 0.00 -1.06 0.00 0.00 42.46 38.75 2hsp s ILE 30 CO 0.48 -0.65 0.66 -0.63 -0.10 0.00 0.00 174.94 174.70 2hsp s ILE 31 N 1.24 4.70 0.42 2.92 1.01 -1.26 -4.92 121.20 125.31 2hsp s ILE 31 Ca 0.11 1.02 0.07 0.00 0.00 0.00 0.00 60.65 61.84 2hsp s ILE 31 Cb -0.18 -3.75 -0.05 0.00 0.01 0.00 0.00 42.46 38.48 2hsp s ILE 31 CO -0.17 0.12 0.16 -1.10 0.00 0.00 0.00 174.94 173.95 2hsp s GLN 32 N -2.24 2.19 -0.17 2.79 -0.21 -1.23 -2.90 119.66 117.89 2hsp s GLN 32 Ca 0.44 -1.91 -0.02 0.00 0.02 0.00 0.00 55.36 53.89 2hsp s GLN 32 Cb -0.14 -1.93 0.01 0.00 1.00 0.00 0.00 33.01 31.95 2hsp s GLN 32 CO 0.20 -0.15 0.04 -1.71 -2.12 0.00 0.00 175.29 171.55 2hsp n ASN 33 N -1.23 -6.32 -4.35 5.90 2.85 -1.16 -3.12 115.26 107.82 2hsp n ASN 33 Ca -0.02 1.09 -0.18 0.00 -0.11 0.00 0.00 54.58 55.35 2hsp n ASN 33 Cb 0.65 -3.89 -0.10 0.00 1.24 0.00 0.00 39.78 37.68 2hsp n ASN 33 CO 0.00 0.00 0.00 -0.69 -2.11 0.00 0.00 177.26 174.46 2hsp s VAL 34 N -1.13 1.38 -0.30 3.44 1.01 -1.24 -2.93 120.40 120.63 2hsp s VAL 34 Ca -0.05 -2.10 -0.08 0.00 0.00 0.00 0.00 61.98 59.76 2hsp s VAL 34 Cb 0.00 -2.24 0.19 0.00 0.00 0.00 0.00 36.38 34.33 2hsp s VAL 34 CO 0.49 -0.44 0.95 -1.61 0.00 0.00 0.00 175.10 174.50 2hsp s GLU 35 N -3.76 0.23 1.04 2.72 2.02 -1.26 -4.64 118.70 115.05 2hsp s GLU 35 Ca 0.26 0.20 -0.23 0.00 0.02 0.00 0.00 54.97 55.22 2hsp s GLU 35 Cb 0.03 0.10 -0.08 0.00 0.10 0.00 0.00 34.13 34.28 2hsp s GLU 35 CO 0.08 -0.42 -0.88 1.63 0.02 0.00 0.00 175.26 175.68 2hsp n LYS 36 N 5.10 -0.53 -3.63 1.61 4.76 -1.25 -3.75 118.16 120.46 2hsp n LYS 36 Ca 0.08 -0.15 -0.12 0.00 -2.87 0.00 0.00 58.31 55.26 2hsp n LYS 36 Cb 0.57 -1.27 -0.07 0.00 -1.84 0.00 0.00 35.03 32.42 2hsp n LYS 36 CO 0.00 0.00 0.00 -1.14 -1.37 0.00 0.00 177.40 174.89 2hsp s GLN 37 N -2.55 0.79 0.00 1.97 2.00 0.14 -4.83 119.66 117.18 2hsp s GLN 37 Ca 0.44 1.04 0.00 0.00 -2.00 0.00 0.00 55.36 54.84 2hsp s GLN 37 Cb -0.01 0.34 0.00 0.00 0.80 0.00 0.00 33.01 34.14 2hsp s GLN 37 CO 0.68 -0.11 0.00 0.39 -0.50 0.00 0.00 175.29 175.75 2hsp n GLU 38 N 3.08 -0.39 0.00 1.67 -0.58 -1.26 -1.56 120.64 121.61 2hsp n GLU 38 Ca -0.15 -0.02 0.00 0.00 -0.42 0.00 0.00 57.16 56.56 2hsp n GLU 38 Cb 0.56 0.04 0.00 0.00 -0.57 0.00 0.00 31.44 31.47 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 -0.38 0.10 0.09 0.62 0.00 -1.26 -4.94 105.19 99.43 2hsp n GLY 39 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 0.57 3.19 -0.02 0.00 -0.60 -4.94 105.19 103.39 2hsp n GLY 40 Ca 0.00 -0.04 -0.25 0.00 0.00 0.00 0.00 46.02 45.73 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 -1.31 1.65 0.01 1.61 0.52 -1.19 -0.08 118.94 120.15 2hsp s TRP 41 Ca 0.00 -0.33 0.04 0.00 0.02 0.00 0.00 56.10 55.83 2hsp s TRP 41 Cb 0.00 -1.04 -0.03 0.00 -1.15 0.00 0.00 33.47 31.25 2hsp s TRP 41 CO 0.00 0.00 -0.07 -1.58 0.02 0.00 0.00 176.95 175.32 2hsp s TRP 42 N -0.54 2.86 0.53 -1.98 0.52 0.30 0.27 118.94 120.90 2hsp s TRP 42 Ca 0.07 -0.06 0.07 0.00 0.02 0.00 0.00 56.10 56.20 2hsp s TRP 42 Cb -0.08 -1.60 0.04 0.00 -1.15 0.00 0.00 33.47 30.69 2hsp s TRP 42 CO 0.00 0.37 0.52 1.03 0.02 0.00 0.00 176.95 178.89 2hsp s ARG 43 N -1.43 2.33 0.00 4.98 0.52 -1.25 0.63 118.95 124.73 2hsp s ARG 43 Ca 0.17 -1.80 0.00 0.00 -0.52 0.00 0.00 55.73 53.58 2hsp s ARG 43 Cb -0.11 -2.33 0.00 0.00 0.52 0.00 0.00 34.95 33.03 2hsp s ARG 43 CO 0.07 -0.61 0.00 0.41 0.02 0.00 0.00 175.30 175.20 2hsp n GLY 44 N -1.87 4.40 3.81 -3.53 0.00 -1.15 -4.03 105.19 102.81 2hsp n GLY 44 Ca 0.05 -1.39 -0.32 0.00 0.00 0.00 0.00 46.02 44.36 2hsp n GLY 44 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2hsp s ASP 45 N 0.00 5.46 0.00 1.61 2.15 0.80 -2.96 116.67 123.72 2hsp s ASP 45 Ca 0.00 1.74 0.00 0.00 0.43 0.00 0.00 52.55 54.72 2hsp s ASP 45 Cb 0.00 -2.52 0.00 0.00 -0.30 0.00 0.00 42.92 40.10 2hsp s ASP 45 CO 0.00 -1.39 0.00 0.00 -0.17 0.00 0.00 175.17 173.61 2hsp n TYR 46 N -2.66 0.00 0.00 -5.34 9.36 -1.26 -3.56 117.16 113.70 2hsp n TYR 46 Ca 0.08 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.30 2hsp n TYR 46 Cb 0.53 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 39.24 2hsp n TYR 46 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 2hsp n GLY 47 N -0.18 2.42 4.15 2.98 0.00 -1.26 -5.01 105.19 108.29 2hsp n GLY 47 Ca 0.00 0.26 0.00 0.00 0.00 0.00 0.00 46.02 46.28 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 1.73 0.00 -0.02 0.00 -1.26 -4.86 105.19 100.77 2hsp n GLY 48 Ca 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 46.02 45.89 2hsp n GLY 48 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2hsp n LYS 49 N 0.00 3.38 0.00 1.61 4.76 -1.26 -5.09 118.16 121.56 2hsp n LYS 49 Ca 0.00 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 2hsp n LYS 49 Cb 0.00 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.19 2hsp n LYS 49 CO 0.00 0.00 0.00 1.17 -1.37 0.00 0.00 177.40 177.20 2hsp n LYS 50 N 0.00 2.90 -2.95 1.97 4.81 -1.26 -4.40 118.16 119.22 2hsp n LYS 50 Ca 0.00 0.00 -0.09 0.00 -0.87 0.00 0.00 58.31 57.35 2hsp n LYS 50 Cb 0.00 -0.63 -0.02 0.00 0.02 0.00 0.00 35.03 34.40 2hsp n LYS 50 CO 0.00 0.00 0.00 -0.65 1.17 0.00 0.00 177.40 177.92 2hsp s GLN 51 N -0.85 1.01 0.00 1.64 -0.21 -1.24 0.28 119.66 120.28 2hsp s GLN 51 Ca 0.00 -1.25 0.00 0.00 0.02 0.00 0.00 55.36 54.13 2hsp s GLN 51 Cb 0.00 -0.37 0.00 0.00 1.00 0.00 0.00 33.01 33.64 2hsp s GLN 51 CO 0.00 -1.33 0.00 1.28 -2.12 0.00 0.00 175.29 173.12 2hsp n LEU 52 N 3.06 0.00 -3.70 2.90 4.77 -1.16 -4.54 117.00 118.34 2hsp n LEU 52 Ca 0.20 0.00 -0.14 0.00 -0.03 0.00 0.00 56.01 56.04 2hsp n LEU 52 Cb 0.54 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.54 2hsp n LEU 52 CO 0.01 0.00 0.18 0.26 -1.33 0.00 0.00 177.39 176.51 2hsp s TRP 53 N 2.05 -0.50 -0.04 -1.77 0.52 -1.23 -4.34 118.94 113.62 2hsp s TRP 53 Ca 0.00 1.15 -0.02 0.00 0.02 0.00 0.00 56.10 57.25 2hsp s TRP 53 Cb 0.00 0.19 0.03 0.00 -1.15 0.00 0.00 33.47 32.55 2hsp s TRP 53 CO 0.00 -0.31 0.09 -0.06 0.02 0.00 0.00 176.95 176.69 2hsp s PHE 54 N -0.12 -0.08 0.66 -1.98 0.08 0.20 -3.76 117.98 112.99 2hsp s PHE 54 Ca -0.03 0.32 -0.17 0.00 0.12 0.00 0.00 56.93 57.17 2hsp s PHE 54 Cb -0.03 -0.12 -0.05 0.00 -0.57 0.00 0.00 43.02 42.25 2hsp s PHE 54 CO 0.02 -0.12 0.68 -2.30 -0.10 0.00 0.00 175.22 173.40 2hsp n PRO 55 N 4.03 0.50 -0.25 0.24 -0.02 -1.26 0.11 135.00 138.36 2hsp n PRO 55 Ca -0.25 0.21 0.10 0.00 -2.02 0.00 0.00 63.50 61.54 2hsp n PRO 55 Cb 0.52 -1.93 0.26 0.00 -0.02 0.00 0.00 33.50 32.33 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 -0.42 2.89 -0.00 2.55 3.41 0.89 -1.78 113.62 121.15 2hsp n SER 56 Ca 0.12 -1.97 0.06 0.00 -0.26 0.00 0.00 58.87 56.82 2hsp n SER 56 Cb 0.49 -0.32 -0.09 0.00 -0.26 0.00 0.00 64.21 64.02 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 1.08 1.48 -0.09 4.04 4.13 -1.26 -4.60 115.26 120.04 2hsp n ASN 57 Ca 0.18 -0.31 -0.14 0.00 1.68 0.00 0.00 54.58 56.00 2hsp n ASN 57 Cb 0.47 1.37 -0.08 0.00 -1.54 0.00 0.00 39.78 40.00 2hsp n ASN 57 CO 0.00 0.00 0.00 -1.22 0.28 0.00 0.00 177.26 176.32 2hsp n TYR 58 N -1.70 0.00 -2.85 3.10 4.02 -1.13 -4.98 117.16 113.63 2hsp n TYR 58 Ca -0.01 0.00 -0.20 0.00 -0.01 0.00 0.00 57.90 57.69 2hsp n TYR 58 Cb 0.28 -0.66 0.05 0.00 -0.02 0.00 0.00 39.34 38.99 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 -2.34 2.53 -0.30 -0.72 -7.23 -0.73 -1.88 120.40 109.72 2hsp s VAL 59 Ca -0.24 -0.84 -0.17 0.00 -1.81 0.00 0.00 61.98 58.92 2hsp s VAL 59 Cb 0.07 -2.69 0.20 0.00 0.56 0.00 0.00 36.38 34.52 2hsp s VAL 59 CO 0.37 0.00 1.25 -1.61 -0.31 0.00 0.00 175.10 174.80 2hsp s GLU 60 N -4.68 0.07 -1.00 4.82 0.41 -1.26 -4.73 118.70 112.33 2hsp s GLU 60 Ca 0.59 0.14 -0.10 0.00 -0.41 0.00 0.00 54.97 55.20 2hsp s GLU 60 Cb -0.08 0.05 -0.33 0.00 -1.78 0.00 0.00 34.13 31.98 2hsp s GLU 60 CO 0.38 -0.02 2.17 0.39 -0.49 0.00 0.00 175.26 177.69 2hsp n GLU 61 N 3.72 0.00 -2.21 1.61 1.02 -1.26 -2.90 120.64 120.63 2hsp n GLU 61 Ca -0.13 -0.01 0.00 0.00 -0.02 0.00 0.00 57.16 57.00 2hsp n GLU 61 Cb 0.56 -1.04 0.00 0.00 -0.02 0.00 0.00 31.44 30.94 2hsp n GLU 61 CO 0.00 0.00 0.00 -1.33 1.18 0.00 0.00 177.13 176.98 2hsp n MET 62 N 5.62 -0.95 -1.23 3.49 2.81 -1.26 -2.70 117.12 122.89 2hsp n MET 62 Ca 0.68 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 56.57 2hsp n MET 62 Cb 0.14 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 32.65 2hsp n MET 62 CO 0.00 0.00 0.00 1.55 1.51 0.00 0.00 175.97 179.03 2hsp n VAL 63 N -0.87 -0.44 -2.68 2.03 3.14 -1.14 -4.96 118.33 113.41 2hsp n VAL 63 Ca 0.00 0.03 -0.05 0.00 -2.96 0.00 0.00 64.34 61.37 2hsp n VAL 63 Cb 0.00 -0.99 0.06 0.00 -1.06 0.00 0.00 33.84 31.86 2hsp n VAL 63 CO 0.00 0.00 0.00 -3.20 -6.46 0.00 0.00 176.83 167.17 2hsp n ASN 64 N 1.56 -1.52 -2.39 6.55 2.85 -1.10 -5.03 115.26 116.19 2hsp n ASN 64 Ca 0.00 -1.76 -0.11 0.00 -0.11 0.00 0.00 54.58 52.60 2hsp n ASN 64 Cb 0.03 0.84 -0.09 0.00 1.24 0.00 0.00 39.78 41.80 2hsp n ASN 64 CO 0.00 0.00 0.00 -0.81 -2.11 0.00 0.00 177.26 174.34 2hsp n PRO 65 N 1.79 1.45 -1.30 1.20 -0.04 -1.26 -4.91 135.00 131.93 2hsp n PRO 65 Ca 0.05 -0.80 -0.51 0.00 -0.04 0.00 0.00 63.50 62.20 2hsp n PRO 65 Cb 0.68 -1.94 -0.07 0.00 -0.04 0.00 0.00 33.50 32.13 2hsp n PRO 65 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 2hsp n GLU 66 N 2.97 0.00 -1.18 0.54 0.00 -1.26 -4.83 120.64 116.88 2hsp n GLU 66 Ca 0.31 0.00 0.02 0.00 0.00 0.00 0.00 57.16 57.49 2hsp n GLU 66 Cb 0.49 -1.15 0.01 0.00 0.00 0.00 0.00 31.44 30.79 2hsp n GLU 66 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2hsp n GLY 67 N 2.66 0.84 3.07 8.31 0.00 -1.26 -5.04 105.19 113.76 2hsp n GLY 67 Ca 0.22 -0.56 -0.32 0.00 0.00 0.00 0.00 46.02 45.36 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 0.00 2.18 -0.76 -0.61 1.01 -1.26 -5.05 121.20 116.71 2hsp s ILE 68 Ca 0.23 -1.67 0.01 0.00 0.00 0.00 0.00 60.65 59.22 2hsp s ILE 68 Cb 0.26 -2.30 0.19 0.00 0.01 0.00 0.00 42.46 40.62 2hsp s ILE 68 CO -0.11 -0.06 0.59 -1.00 0.00 0.00 0.00 174.94 174.36 2hsp s HIS 69 N 1.09 3.66 0.52 3.97 3.76 -1.26 -5.08 115.29 121.96 2hsp s HIS 69 Ca -0.08 -3.14 -0.18 0.00 -0.15 0.00 0.00 55.06 51.51 2hsp s HIS 69 Cb -0.20 -2.99 -0.07 0.00 1.11 0.00 0.00 32.58 30.43 2hsp s HIS 69 CO -0.05 -0.67 1.03 1.03 -0.85 0.00 0.00 174.74 175.23 2hsp s ARG 70 N -1.19 3.67 0.00 1.40 0.52 -1.26 -5.36 118.95 116.74 2hsp s ARG 70 Ca 0.25 1.23 0.12 0.00 -0.52 0.00 0.00 55.73 56.81 2hsp s ARG 70 Cb -0.09 -2.08 0.72 0.00 0.52 0.00 0.00 34.95 34.02 2hsp s ARG 70 CO -0.12 -0.52 1.15 -3.47 0.02 0.00 0.00 175.30 172.36