#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 -2.17 -4.55 1.61 2.88 -1.26 -5.10 113.62 105.03 2hsp n SER 2 Ca 0.00 -3.29 -0.39 0.00 -1.33 0.00 0.00 58.87 53.86 2hsp n SER 2 Cb 0.00 1.39 -0.03 0.00 -0.75 0.00 0.00 64.21 64.82 2hsp n SER 2 CO 0.00 0.00 0.00 -2.16 -1.23 0.00 0.00 175.04 171.65 2hsp s PRO 3 N 0.19 2.79 0.54 -1.46 0.04 -1.26 -4.87 135.00 130.98 2hsp s PRO 3 Ca 0.31 0.38 0.00 0.00 0.04 0.00 0.00 61.00 61.72 2hsp s PRO 3 Cb 0.24 -4.33 0.00 0.00 0.04 0.00 0.00 34.50 30.45 2hsp s PRO 3 CO -0.18 -2.56 0.00 2.41 0.04 0.00 0.00 177.00 176.71 2hsp n THR 4 N 6.98 0.00 0.00 1.26 -1.04 -1.26 -5.05 114.28 115.17 2hsp n THR 4 Ca 0.15 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.16 2hsp n THR 4 Cb 0.51 -0.29 0.00 0.00 -1.82 0.00 0.00 70.33 68.73 2hsp n THR 4 CO 0.00 0.00 0.00 0.33 -0.64 0.00 0.00 175.07 174.76 2hsp n PHE 5 N -2.93 0.00 -2.78 -1.42 -0.00 -1.26 -5.10 117.46 103.97 2hsp n PHE 5 Ca 0.01 0.00 -0.00 0.00 -0.00 0.00 0.00 57.45 57.45 2hsp n PHE 5 Cb 0.39 0.00 -0.00 0.00 -0.00 0.00 0.00 39.48 39.87 2hsp n PHE 5 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 176.76 178.39 2hsp n LYS 6 N 0.00 -1.16 -4.36 -4.13 5.02 -1.26 -5.01 118.16 107.27 2hsp n LYS 6 Ca 0.00 1.05 -0.30 0.00 -2.02 0.00 0.00 58.31 57.04 2hsp n LYS 6 Cb 0.00 -0.96 -0.04 0.00 -0.02 0.00 0.00 35.03 34.01 2hsp n LYS 6 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2hsp n ALA 8 N -1.56 0.09 -3.61 0.00 0.00 -1.26 -0.46 120.51 113.71 2hsp n ALA 8 Ca -0.20 -0.36 0.02 0.00 0.00 0.00 0.00 53.44 52.90 2hsp n ALA 8 Cb 0.64 0.23 -0.00 0.00 0.00 0.00 0.00 19.45 20.32 2hsp n ALA 8 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2hsp s VAL 9 N -1.66 0.00 -0.32 0.00 0.11 -1.21 -4.76 120.40 112.56 2hsp s VAL 9 Ca 0.03 -0.18 0.01 0.00 -2.93 0.00 0.00 61.98 58.91 2hsp s VAL 9 Cb 0.00 -1.96 0.10 0.00 -1.53 0.00 0.00 36.38 33.00 2hsp s VAL 9 CO 0.02 0.00 0.09 -0.75 -3.33 0.00 0.00 175.10 171.13 2hsp s LYS 10 N -2.35 0.98 -0.30 1.54 2.20 -1.25 -3.59 119.74 116.97 2hsp s LYS 10 Ca 0.14 -1.36 -0.39 0.00 -0.36 0.00 0.00 55.97 54.00 2hsp s LYS 10 Cb 0.05 -2.39 -0.15 0.00 -1.51 0.00 0.00 37.83 33.83 2hsp s LYS 10 CO -0.04 -0.98 1.86 0.00 -0.36 0.00 0.00 175.35 175.83 2hsp n ALA 11 N 4.61 0.14 0.06 3.13 0.00 -0.74 -4.32 120.51 123.39 2hsp n ALA 11 Ca 0.00 0.28 -0.13 0.00 0.00 0.00 0.00 53.44 53.60 2hsp n ALA 11 Cb 0.42 -2.29 -0.14 0.00 0.00 0.00 0.00 19.45 17.44 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 8.44 0.23-10.23 0.00 3.38 -1.87 0.22 115.31 115.48 2hsp h LEU 12 Ca -0.41 -0.30 -0.48 0.00 0.09 0.00 0.00 57.88 56.78 2hsp h LEU 12 Cb 1.32 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.97 2hsp h LEU 12 CO 0.98 1.25 -0.35 -0.36 0.09 0.00 0.00 178.44 180.05 2hsp s PHE 13 N -2.64 2.67 -0.03 1.13 0.08 -1.21 -4.66 117.98 113.31 2hsp s PHE 13 Ca -0.05 -0.49 -0.02 0.00 0.12 0.00 0.00 56.93 56.49 2hsp s PHE 13 Cb 0.08 -2.20 -0.04 0.00 -0.57 0.00 0.00 43.02 40.29 2hsp s PHE 13 CO 0.84 -0.20 0.10 0.34 -0.10 0.00 0.00 175.22 176.21 2hsp s ASP 14 N -4.18 5.88 0.45 1.36 2.15 -1.26 -3.45 116.67 117.62 2hsp s ASP 14 Ca 0.49 0.23 0.05 0.00 0.43 0.00 0.00 52.55 53.75 2hsp s ASP 14 Cb -0.04 -1.75 -0.05 0.00 -0.30 0.00 0.00 42.92 40.78 2hsp s ASP 14 CO 0.29 0.30 0.06 -0.47 -0.17 0.00 0.00 175.17 175.17 2hsp s TYR 15 N -1.17 2.26 -0.41 -5.34 6.14 0.23 -4.97 117.35 114.09 2hsp s TYR 15 Ca 0.22 -0.76 0.10 0.00 0.64 0.00 0.00 57.07 57.26 2hsp s TYR 15 Cb -0.12 -1.76 0.34 0.00 0.42 0.00 0.00 41.96 40.84 2hsp s TYR 15 CO 0.13 0.28 0.93 1.17 0.64 0.00 0.00 175.55 178.70 2hsp n LYS 16 N -1.16 1.01 -0.08 4.97 4.81 -1.25 -4.30 118.16 122.15 2hsp n LYS 16 Ca -0.09 -2.69 -0.10 0.00 -0.87 0.00 0.00 58.31 54.56 2hsp n LYS 16 Cb 0.66 -1.33 -0.10 0.00 0.02 0.00 0.00 35.03 34.29 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 0.26 1.62 0.00 3.14 0.00 -1.21 -4.79 120.51 119.53 2hsp n ALA 17 Ca 0.15 -0.87 0.00 0.00 0.00 0.00 0.00 53.44 52.72 2hsp n ALA 17 Cb 0.69 0.02 0.00 0.00 0.00 0.00 0.00 19.45 20.16 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 -2.83 0.00 0.00 0.00 7.27 -1.26 -4.19 117.38 116.37 2hsp n GLN 18 Ca -0.29 0.00 0.00 0.00 0.07 0.00 0.00 57.00 56.78 2hsp n GLN 18 Cb 0.90 -0.17 0.00 0.00 2.41 0.00 0.00 30.24 33.38 2hsp n GLN 18 CO 0.00 0.00 0.00 -2.13 0.07 0.00 0.00 177.06 175.00 2hsp n ARG 19 N 0.00 0.00 -0.07 3.69 0.63 -1.13 -4.27 116.66 115.51 2hsp n ARG 19 Ca 0.00 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.93 2hsp n ARG 19 Cb 0.00 0.00 0.00 0.00 0.45 0.00 0.00 32.46 32.91 2hsp n ARG 19 CO 0.00 0.00 0.00 -0.85 -2.51 0.00 0.00 177.63 174.27 2hsp n GLU 20 N 0.00 0.00 0.00 -0.14 0.28 -1.26 -4.84 120.64 114.68 2hsp n GLU 20 Ca 0.00 -0.50 0.00 0.00 -0.16 0.00 0.00 57.16 56.50 2hsp n GLU 20 Cb 0.00 -0.44 0.00 0.00 1.43 0.00 0.00 31.44 32.43 2hsp n GLU 20 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 2hsp n ASP 21 N 0.00 0.00 -4.28 -1.84 8.00 -1.26 -5.03 116.55 112.14 2hsp n ASP 21 Ca 0.00 0.00 -0.15 0.00 0.71 0.00 0.00 54.79 55.35 2hsp n ASP 21 Cb 0.52 0.00 -0.10 0.00 -0.02 0.00 0.00 41.12 41.52 2hsp n ASP 21 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 2hsp s GLU 22 N -0.29 1.19 0.30 -1.24 2.12 -1.26 0.30 118.70 119.81 2hsp s GLU 22 Ca 0.00 -1.57 0.03 0.00 0.36 0.00 0.00 54.97 53.79 2hsp s GLU 22 Cb 0.00 -0.51 -0.06 0.00 0.26 0.00 0.00 34.13 33.82 2hsp s GLU 22 CO 0.00 -0.06 0.07 -0.51 -0.54 0.00 0.00 175.26 174.22 2hsp s LEU 23 N -3.23 2.01 -0.19 2.70 1.43 -1.24 -2.84 118.68 117.32 2hsp s LEU 23 Ca 0.24 -1.37 0.06 0.00 -1.03 0.00 0.00 54.13 52.03 2hsp s LEU 23 Cb 0.05 -0.25 0.46 0.00 0.03 0.00 0.00 46.19 46.48 2hsp s LEU 23 CO 0.05 -0.64 1.37 1.07 0.23 0.00 0.00 176.35 178.43 2hsp n THR 24 N -0.60 1.93 -1.41 5.49 5.66 -1.26 -3.30 114.28 120.78 2hsp n THR 24 Ca -0.02 -0.97 -0.44 0.00 -3.05 0.00 0.00 64.05 59.58 2hsp n THR 24 Cb 0.66 -0.49 -0.01 0.00 -1.55 0.00 0.00 70.33 68.94 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 0.04 -0.72 -3.53 1.09 1.16 -1.26 -4.22 117.46 110.02 2hsp n PHE 25 Ca 0.24 0.73 -0.22 0.00 -1.87 0.00 0.00 57.45 56.33 2hsp n PHE 25 Cb 0.98 -1.95 0.00 0.00 -1.61 0.00 0.00 39.48 36.89 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 -1.33 2.19 -0.04 1.97 -4.36 -1.26 -0.60 121.20 117.77 2hsp s ILE 26 Ca 0.62 -1.30 -0.30 0.00 -0.26 0.00 0.00 60.65 59.41 2hsp s ILE 26 Cb -0.72 -2.49 -0.07 0.00 1.25 0.00 0.00 42.46 40.42 2hsp s ILE 26 CO 0.59 0.00 1.94 -0.75 0.24 0.00 0.00 174.94 176.96 2hsp s LYS 27 N -4.32 3.95 0.00 0.37 2.36 -1.22 -0.77 119.74 120.10 2hsp s LYS 27 Ca 0.46 2.38 0.00 0.00 -2.55 0.00 0.00 55.97 56.27 2hsp s LYS 27 Cb -0.04 -4.16 0.00 0.00 -1.05 0.00 0.00 37.83 32.58 2hsp s LYS 27 CO 0.28 -1.16 0.00 0.45 1.55 0.00 0.00 175.35 176.47 2hsp n SER 28 N 8.25 0.00 -4.50 1.43 2.88 0.76 -5.01 113.62 117.43 2hsp n SER 28 Ca 0.21 0.00 -0.44 0.00 -1.33 0.00 0.00 58.87 57.31 2hsp n SER 28 Cb 0.42 0.00 -0.01 0.00 -0.75 0.00 0.00 64.21 63.87 2hsp n SER 28 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2hsp n ALA 29 N -0.52 -1.27 -3.51 -1.46 0.00 0.05 -4.59 120.51 109.20 2hsp n ALA 29 Ca 0.00 0.32 -0.27 0.00 0.00 0.00 0.00 53.44 53.49 2hsp n ALA 29 Cb 0.00 -1.84 -0.09 0.00 0.00 0.00 0.00 19.45 17.52 2hsp n ALA 29 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 2hsp n ILE 30 N -0.22 2.19 -1.70 0.00 5.41 -1.26 -1.79 119.36 121.99 2hsp n ILE 30 Ca 0.12 -5.14 -0.39 0.00 1.00 0.00 0.00 62.75 58.35 2hsp n ILE 30 Cb 0.33 -2.12 0.04 0.00 -0.71 0.00 0.00 39.64 37.19 2hsp n ILE 30 CO 0.00 0.00 0.00 -0.38 0.00 0.00 0.00 176.55 176.17 2hsp n ILE 31 N 1.08 3.72 -4.57 1.39 5.41 -1.24 -4.83 119.36 120.32 2hsp n ILE 31 Ca 0.28 -0.50 -0.31 0.00 1.00 0.00 0.00 62.75 63.22 2hsp n ILE 31 Cb 0.40 -1.49 -0.07 0.00 -0.71 0.00 0.00 39.64 37.77 2hsp n ILE 31 CO 0.00 0.00 0.00 -1.10 0.00 0.00 0.00 176.55 175.45 2hsp s GLN 32 N -2.79 2.19 -1.39 0.38 -0.21 -1.18 -3.29 119.66 113.37 2hsp s GLN 32 Ca 0.72 -2.29 -0.18 0.00 0.02 0.00 0.00 55.36 53.64 2hsp s GLN 32 Cb -0.43 -1.66 0.02 0.00 1.00 0.00 0.00 33.01 31.94 2hsp s GLN 32 CO 0.49 -0.37 0.33 0.09 -2.12 0.00 0.00 175.29 173.71 2hsp n ASN 33 N -1.33 -1.50 -4.94 5.90 4.13 -1.08 -2.87 115.26 113.57 2hsp n ASN 33 Ca -0.14 -1.30 -0.24 0.00 1.68 0.00 0.00 54.58 54.58 2hsp n ASN 33 Cb 0.66 -1.58 0.01 0.00 -1.54 0.00 0.00 39.78 37.34 2hsp n ASN 33 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 2hsp s VAL 34 N -3.97 4.00 0.12 2.41 1.01 0.39 -3.70 120.40 120.66 2hsp s VAL 34 Ca 0.24 -0.34 -0.02 0.00 0.00 0.00 0.00 61.98 61.87 2hsp s VAL 34 Cb -0.14 -3.51 0.01 0.00 0.00 0.00 0.00 36.38 32.74 2hsp s VAL 34 CO 0.99 -0.40 0.18 -0.62 0.00 0.00 0.00 175.10 175.25 2hsp n GLU 35 N -2.20 0.26 -3.21 2.72 1.02 -1.08 -3.46 120.64 114.69 2hsp n GLU 35 Ca 0.02 -0.86 -0.18 0.00 -0.02 0.00 0.00 57.16 56.12 2hsp n GLU 35 Cb 0.57 0.88 -0.06 0.00 -0.02 0.00 0.00 31.44 32.81 2hsp n GLU 35 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 2hsp s LYS 36 N -2.20 0.87 0.23 3.49 1.02 -1.26 -3.30 119.74 118.60 2hsp s LYS 36 Ca 0.08 -1.48 -0.31 0.00 0.02 0.00 0.00 55.97 54.28 2hsp s LYS 36 Cb -0.01 -0.86 -0.15 0.00 -0.52 0.00 0.00 37.83 36.30 2hsp s LYS 36 CO 0.06 -1.32 1.16 0.94 -0.92 0.00 0.00 175.35 175.27 2hsp n GLN 37 N 3.26 1.42 -1.53 1.68 -0.06 0.35 -4.67 117.38 117.83 2hsp n GLN 37 Ca 0.21 0.50 -0.21 0.00 -2.00 0.00 0.00 57.00 55.51 2hsp n GLN 37 Cb 0.49 -1.99 -0.13 0.00 -4.06 0.00 0.00 30.24 24.56 2hsp n GLN 37 CO 0.00 0.00 0.00 0.39 -0.20 0.00 0.00 177.06 177.25 2hsp n GLU 38 N 1.41 0.37 0.00 3.69 1.02 -1.26 -1.90 120.64 123.97 2hsp n GLU 38 Ca 0.12 -0.41 0.00 0.00 -0.02 0.00 0.00 57.16 56.85 2hsp n GLU 38 Cb 0.29 -2.57 0.00 0.00 -0.02 0.00 0.00 31.44 29.14 2hsp n GLU 38 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2hsp n GLY 39 N 6.25 0.02 0.38 0.62 0.00 -1.26 -4.95 105.19 106.25 2hsp n GLY 39 Ca 0.55 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.57 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 0.63 2.83 -0.02 0.00 -0.80 -4.97 105.19 102.86 2hsp n GLY 40 Ca 0.00 -0.18 -0.14 0.00 0.00 0.00 0.00 46.02 45.70 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 -1.85 -0.02 0.00 1.61 0.52 -1.20 -1.35 118.94 116.65 2hsp s TRP 41 Ca 0.00 0.16 0.02 0.00 0.02 0.00 0.00 56.10 56.31 2hsp s TRP 41 Cb 0.00 -0.14 -0.03 0.00 -1.15 0.00 0.00 33.47 32.15 2hsp s TRP 41 CO 0.00 -0.08 -0.04 -1.58 0.02 0.00 0.00 176.95 175.28 2hsp s TRP 42 N 0.76 2.97 0.54 -1.98 0.52 0.31 0.13 118.94 122.19 2hsp s TRP 42 Ca -0.06 0.02 0.06 0.00 0.02 0.00 0.00 56.10 56.13 2hsp s TRP 42 Cb -0.09 -1.63 0.04 0.00 -1.15 0.00 0.00 33.47 30.64 2hsp s TRP 42 CO -0.02 0.42 0.41 0.50 0.02 0.00 0.00 176.95 178.27 2hsp s ARG 43 N -1.49 2.26 0.00 4.98 3.52 -1.21 0.11 118.95 127.11 2hsp s ARG 43 Ca 0.18 -2.01 0.00 0.00 -0.13 0.00 0.00 55.73 53.78 2hsp s ARG 43 Cb -0.11 -2.11 0.00 0.00 -1.56 0.00 0.00 34.95 31.17 2hsp s ARG 43 CO 0.09 -0.61 0.00 0.41 -0.81 0.00 0.00 175.30 174.38 2hsp n GLY 44 N -1.76 4.28 3.80 8.12 0.00 -1.24 -2.63 105.19 115.75 2hsp n GLY 44 Ca -0.01 -1.41 -0.34 0.00 0.00 0.00 0.00 46.02 44.26 2hsp n GLY 44 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2hsp s ASP 45 N 0.00 6.09 -0.29 1.61 1.01 -1.14 -2.58 116.67 121.38 2hsp s ASP 45 Ca 0.00 1.92 0.10 0.00 0.71 0.00 0.00 52.55 55.28 2hsp s ASP 45 Cb 0.00 -2.55 0.32 0.00 1.01 0.00 0.00 42.92 41.70 2hsp s ASP 45 CO 0.00 -0.96 1.33 0.00 0.21 0.00 0.00 175.17 175.75 2hsp n TYR 46 N -1.34 -1.70 0.00 4.23 9.36 -1.26 -3.12 117.16 123.33 2hsp n TYR 46 Ca 0.09 -1.41 0.00 0.00 3.32 0.00 0.00 57.90 59.91 2hsp n TYR 46 Cb 0.52 1.38 0.00 0.00 -0.63 0.00 0.00 39.34 40.62 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 -1.14 -0.02 0.08 2.98 0.00 -1.26 -4.86 105.19 100.96 2hsp n GLY 47 Ca -0.14 -1.08 0.09 0.00 0.00 0.00 0.00 46.02 44.90 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 -1.08 4.01 -0.02 0.00 -1.26 -4.71 105.19 102.14 2hsp n GLY 48 Ca 0.00 0.05 -0.22 0.00 0.00 0.00 0.00 46.02 45.85 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 -3.22 1.99 -0.26 1.61 -0.14 -1.26 -5.10 119.74 113.36 2hsp s LYS 49 Ca 0.04 -1.32 -0.02 0.00 -1.36 0.00 0.00 55.97 53.31 2hsp s LYS 49 Cb 0.08 -2.48 0.12 0.00 -1.68 0.00 0.00 37.83 33.88 2hsp s LYS 49 CO 0.30 -1.15 0.27 0.21 -0.76 0.00 0.00 175.35 174.21 2hsp s LYS 50 N -4.91 0.28 0.00 1.68 2.20 -1.26 -4.16 119.74 113.56 2hsp s LYS 50 Ca 0.64 -0.03 0.00 0.00 -0.36 0.00 0.00 55.97 56.22 2hsp s LYS 50 Cb -0.06 -0.84 0.00 0.00 -1.51 0.00 0.00 37.83 35.42 2hsp s LYS 50 CO 0.42 -0.90 0.00 1.04 -0.36 0.00 0.00 175.35 175.55 2hsp n GLN 51 N 5.31 0.00 0.00 4.03 6.02 -1.14 -4.82 117.38 126.78 2hsp n GLN 51 Ca -0.03 0.42 0.00 0.00 -0.01 0.00 0.00 57.00 57.38 2hsp n GLN 51 Cb 0.47 -1.27 0.00 0.00 1.02 0.00 0.00 30.24 30.46 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 -0.73 0.00 -3.86 1.08 4.77 -1.06 -4.59 117.00 112.61 2hsp n LEU 52 Ca 0.00 0.00 -0.12 0.00 -0.03 0.00 0.00 56.01 55.86 2hsp n LEU 52 Cb 0.30 0.00 -0.13 0.00 -2.33 0.00 0.00 43.42 41.27 2hsp n LEU 52 CO 0.00 0.00 -0.27 0.26 -1.33 0.00 0.00 177.39 176.05 2hsp s TRP 53 N 4.50 -0.04 -0.04 -1.77 0.52 0.86 -4.15 118.94 118.82 2hsp s TRP 53 Ca 0.00 0.10 -0.01 0.00 0.02 0.00 0.00 56.10 56.20 2hsp s TRP 53 Cb 0.00 -0.00 0.03 0.00 -1.15 0.00 0.00 33.47 32.35 2hsp s TRP 53 CO 0.00 -0.08 0.06 -0.06 0.02 0.00 0.00 176.95 176.89 2hsp s PHE 54 N -0.27 0.01 0.64 -1.98 0.08 0.29 -3.68 117.98 113.06 2hsp s PHE 54 Ca -0.03 0.24 -0.17 0.00 0.12 0.00 0.00 56.93 57.09 2hsp s PHE 54 Cb -0.02 -0.31 -0.05 0.00 -0.57 0.00 0.00 43.02 42.06 2hsp s PHE 54 CO 0.00 -0.14 0.67 -2.30 -0.10 0.00 0.00 175.22 173.35 2hsp n PRO 55 N 4.65 0.54 -0.16 0.24 -0.02 -1.26 0.11 135.00 139.09 2hsp n PRO 55 Ca -0.18 0.22 0.09 0.00 -2.02 0.00 0.00 63.50 61.62 2hsp n PRO 55 Cb 0.50 -1.90 0.27 0.00 -0.02 0.00 0.00 33.50 32.35 2hsp n PRO 55 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 2hsp n SER 56 N -0.26 2.27 -0.00 2.55 7.64 -0.46 -1.53 113.62 123.83 2hsp n SER 56 Ca 0.12 -1.88 0.08 0.00 1.01 0.00 0.00 58.87 58.19 2hsp n SER 56 Cb 0.48 -0.22 -0.11 0.00 -1.01 0.00 0.00 64.21 63.36 2hsp n SER 56 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 2hsp n ASN 57 N 0.72 0.92 -0.06 6.43 5.03 -1.26 -4.56 115.26 122.48 2hsp n ASN 57 Ca 0.16 -0.53 -0.10 0.00 0.87 0.00 0.00 54.58 54.97 2hsp n ASN 57 Cb 0.39 1.30 -0.05 0.00 -1.02 0.00 0.00 39.78 40.40 2hsp n ASN 57 CO 0.00 0.00 0.00 -1.22 -1.83 0.00 0.00 177.26 174.21 2hsp n TYR 58 N -1.66 0.00 -3.95 3.10 4.02 -1.05 -5.00 117.16 112.62 2hsp n TYR 58 Ca 0.01 0.00 -0.32 0.00 -0.01 0.00 0.00 57.90 57.57 2hsp n TYR 58 Cb 0.33 -0.47 -0.05 0.00 -0.02 0.00 0.00 39.34 39.12 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 -2.25 5.22 -0.13 -0.72 -7.23 -0.58 -3.32 120.40 111.40 2hsp s VAL 59 Ca -0.17 -0.32 -0.10 0.00 -1.81 0.00 0.00 61.98 59.58 2hsp s VAL 59 Cb 0.05 -3.47 0.04 0.00 0.56 0.00 0.00 36.38 33.56 2hsp s VAL 59 CO 0.27 0.26 0.33 -1.61 -0.31 0.00 0.00 175.10 174.04 2hsp s GLU 60 N -2.09 0.36 0.19 4.82 2.02 -1.26 -4.63 118.70 118.10 2hsp s GLU 60 Ca 0.29 0.53 -0.31 0.00 0.02 0.00 0.00 54.97 55.49 2hsp s GLU 60 Cb -0.13 0.10 -0.16 0.00 0.10 0.00 0.00 34.13 34.04 2hsp s GLU 60 CO 0.21 -0.08 0.91 0.39 0.02 0.00 0.00 175.26 176.70 2hsp n GLU 61 N 3.35 0.72 0.00 1.61 1.02 -1.26 -3.77 120.64 122.31 2hsp n GLU 61 Ca -0.17 0.25 0.00 0.00 -0.02 0.00 0.00 57.16 57.23 2hsp n GLU 61 Cb 0.57 -1.56 0.00 0.00 -0.02 0.00 0.00 31.44 30.42 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 1.22 0.00 -1.44 3.49 2.81 -1.26 -3.75 117.12 118.19 2hsp n MET 62 Ca 0.15 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 56.04 2hsp n MET 62 Cb 0.25 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 32.76 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 0.00 0.00 -2.73 2.03 3.14 -1.26 -5.01 118.33 114.50 2hsp n VAL 63 Ca 0.00 0.00 -0.08 0.00 -2.96 0.00 0.00 64.34 61.30 2hsp n VAL 63 Cb 0.00 -0.70 0.06 0.00 -1.06 0.00 0.00 33.84 32.14 2hsp n VAL 63 CO 0.00 0.00 0.00 -0.46 -6.46 0.00 0.00 176.83 169.91 2hsp n ASN 64 N 1.54 -2.55 -2.24 6.55 0.23 -1.25 -5.03 115.26 112.52 2hsp n ASN 64 Ca 0.00 -3.20 -0.11 0.00 -0.53 0.00 0.00 54.58 50.74 2hsp n ASN 64 Cb 0.00 1.73 -0.12 0.00 -2.08 0.00 0.00 39.78 39.31 2hsp n ASN 64 CO 0.00 0.00 0.00 -0.81 -0.93 0.00 0.00 177.26 175.52 2hsp n PRO 65 N 1.29 1.67 -1.50 -0.53 -0.04 -1.26 -4.92 135.00 129.70 2hsp n PRO 65 Ca 0.07 -0.88 -0.61 0.00 -0.04 0.00 0.00 63.50 62.04 2hsp n PRO 65 Cb 0.66 -1.96 -0.10 0.00 -0.04 0.00 0.00 33.50 32.06 2hsp n PRO 65 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2hsp n GLU 66 N 2.76 0.30 0.00 0.54 1.02 -1.26 -4.78 120.64 119.22 2hsp n GLU 66 Ca 0.36 0.10 0.00 0.00 -0.02 0.00 0.00 57.16 57.60 2hsp n GLU 66 Cb 0.65 -1.71 0.00 0.00 -0.02 0.00 0.00 31.44 30.36 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 5.78 3.87 0.00 0.62 0.00 -1.26 -5.16 105.19 109.03 2hsp n GLY 67 Ca 0.41 -0.37 0.00 0.00 0.00 0.00 0.00 46.02 46.06 2hsp n GLY 67 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2hsp n ILE 68 N -0.22 0.00 -0.45 -0.61 2.08 -1.26 -5.04 119.36 113.87 2hsp n ILE 68 Ca 0.00 0.00 -0.25 0.00 0.56 0.00 0.00 62.75 63.06 2hsp n ILE 68 Cb 0.00 0.00 0.21 0.00 -0.75 0.00 0.00 39.64 39.10 2hsp n ILE 68 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2hsp n HIS 69 N 0.00 -2.59 -0.24 1.39 1.44 -1.26 -4.96 115.22 109.01 2hsp n HIS 69 Ca 0.00 -0.26 -0.18 0.00 -2.01 0.00 0.00 57.72 55.28 2hsp n HIS 69 Cb 0.00 -1.42 0.17 0.00 0.12 0.00 0.00 29.99 28.86 2hsp n HIS 69 CO 0.00 0.00 0.00 0.54 -2.81 0.00 0.00 176.34 174.07 2hsp n ARG 70 N -3.34 -3.50 0.00 -1.40 1.74 -1.26 -5.27 116.66 103.63 2hsp n ARG 70 Ca 0.07 -0.88 0.00 0.00 -0.77 0.00 0.00 57.85 56.27 2hsp n ARG 70 Cb 0.48 -1.09 0.00 0.00 -1.02 0.00 0.00 32.46 30.83 2hsp n ARG 70 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86