#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 3.66 -0.37 1.61 0.01 -1.26 -4.95 113.70 112.40 2hsp s SER 2 Ca 0.00 1.53 -0.29 0.00 1.31 0.00 0.00 55.95 58.50 2hsp s SER 2 Cb 0.00 -2.22 0.02 0.00 0.21 0.00 0.00 66.02 64.03 2hsp s SER 2 CO 0.00 -2.53 1.19 -2.16 0.41 0.00 0.00 173.24 170.15 2hsp s PRO 3 N -4.93 3.88 0.55 12.44 0.04 -1.26 -5.03 135.00 140.68 2hsp s PRO 3 Ca 0.63 0.97 0.01 0.00 0.04 0.00 0.00 61.00 62.66 2hsp s PRO 3 Cb -0.18 -3.85 0.03 0.00 0.04 0.00 0.00 34.50 30.54 2hsp s PRO 3 CO 0.57 -1.16 0.77 0.95 0.04 0.00 0.00 177.00 178.16 2hsp s THR 4 N 4.26 2.72 -0.26 1.26 -4.23 -1.26 -5.10 115.64 113.03 2hsp s THR 4 Ca 0.51 -0.66 -0.01 0.00 -1.18 0.00 0.00 61.69 60.35 2hsp s THR 4 Cb -0.12 -3.02 0.13 0.00 1.34 0.00 0.00 72.50 70.83 2hsp s THR 4 CO 0.24 -0.01 0.33 0.12 -0.54 0.00 0.00 174.62 174.75 2hsp s PHE 5 N -2.75 -0.64 0.21 3.99 5.36 -1.26 -5.04 117.98 117.84 2hsp s PHE 5 Ca 0.57 0.30 0.01 0.00 -0.96 0.00 0.00 56.93 56.85 2hsp s PHE 5 Cb -0.10 -0.24 0.01 0.00 -0.34 0.00 0.00 43.02 42.35 2hsp s PHE 5 CO 0.38 -0.81 0.09 1.63 -1.46 0.00 0.00 175.22 175.05 2hsp n LYS 6 N 5.34 1.32 -0.74 10.12 4.01 -1.26 -5.05 118.16 131.89 2hsp n LYS 6 Ca -0.03 -1.38 -0.14 0.00 -0.51 0.00 0.00 58.31 56.26 2hsp n LYS 6 Cb 0.49 0.24 0.11 0.00 -0.51 0.00 0.00 35.03 35.36 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 -3.62 0.14 -3.00 0.00 0.00 -1.26 -1.79 120.51 110.98 2hsp n ALA 8 Ca -0.10 -0.68 0.00 0.00 0.00 0.00 0.00 53.44 52.66 2hsp n ALA 8 Cb 0.28 0.39 0.00 0.00 0.00 0.00 0.00 19.45 20.12 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 -0.36 0.00 -2.72 0.00 0.24 -1.12 -4.61 118.33 109.76 2hsp n VAL 9 Ca -0.05 0.00 -0.04 0.00 -2.04 0.00 0.00 64.34 62.21 2hsp n VAL 9 Cb 0.19 0.00 0.03 0.00 -1.47 0.00 0.00 33.84 32.59 2hsp n VAL 9 CO 0.00 0.00 0.00 1.17 -2.14 0.00 0.00 176.83 175.86 2hsp n LYS 10 N 0.00 0.38 -0.70 7.34 3.00 -1.24 -4.56 118.16 122.37 2hsp n LYS 10 Ca 0.00 -1.44 -0.31 0.00 -0.00 0.00 0.00 58.31 56.56 2hsp n LYS 10 Cb 0.00 -0.79 -0.06 0.00 0.00 0.00 0.00 35.03 34.18 2hsp n LYS 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2hsp n ALA 11 N 2.54 -0.15 0.03 3.14 0.00 -0.41 -4.64 120.51 121.03 2hsp n ALA 11 Ca 0.13 0.14 -0.10 0.00 0.00 0.00 0.00 53.44 53.62 2hsp n ALA 11 Cb 0.61 -1.00 -0.13 0.00 0.00 0.00 0.00 19.45 18.93 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 3.79 0.10-10.35 0.00 3.38 -1.89 -0.94 115.31 109.40 2hsp h LEU 12 Ca -0.10 -0.14 -0.44 0.00 0.09 0.00 0.00 57.88 57.28 2hsp h LEU 12 Cb 0.69 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.42 2hsp h LEU 12 CO 0.52 1.12 -0.30 -0.36 0.09 0.00 0.00 178.44 179.51 2hsp s PHE 13 N -2.65 2.82 -0.13 1.13 0.40 -1.13 -4.75 117.98 113.68 2hsp s PHE 13 Ca -0.04 -0.40 -0.03 0.00 -0.60 0.00 0.00 56.93 55.86 2hsp s PHE 13 Cb 0.08 -2.27 -0.03 0.00 0.51 0.00 0.00 43.02 41.31 2hsp s PHE 13 CO 0.83 -0.29 -0.02 -0.51 0.70 0.00 0.00 175.22 175.93 2hsp s ASP 14 N -4.27 4.98 0.47 1.36 1.11 -1.26 -3.27 116.67 115.78 2hsp s ASP 14 Ca 0.52 -0.03 0.06 0.00 0.18 0.00 0.00 52.55 53.28 2hsp s ASP 14 Cb -0.08 -1.68 -0.01 0.00 1.07 0.00 0.00 42.92 42.22 2hsp s ASP 14 CO 0.31 0.23 0.30 -0.47 1.18 0.00 0.00 175.17 176.73 2hsp s TYR 15 N -0.03 2.22 -0.41 4.23 6.14 0.23 -4.97 117.35 124.77 2hsp s TYR 15 Ca 0.02 -0.68 0.09 0.00 0.64 0.00 0.00 57.07 57.14 2hsp s TYR 15 Cb -0.13 -1.97 0.34 0.00 0.42 0.00 0.00 41.96 40.62 2hsp s TYR 15 CO 0.02 -0.13 0.93 1.17 0.64 0.00 0.00 175.55 178.19 2hsp n LYS 16 N -1.50 1.00 -0.07 4.97 4.81 -1.26 -4.29 118.16 121.83 2hsp n LYS 16 Ca -0.01 -2.68 -0.12 0.00 -0.87 0.00 0.00 58.31 54.63 2hsp n LYS 16 Cb 0.64 -1.34 -0.06 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 0.28 1.80 0.00 3.14 0.00 -1.21 -4.78 120.51 119.75 2hsp n ALA 17 Ca 0.15 -0.59 0.00 0.00 0.00 0.00 0.00 53.44 53.00 2hsp n ALA 17 Cb 0.69 0.22 0.00 0.00 0.00 0.00 0.00 19.45 20.36 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 -3.15 0.00 0.00 0.00 7.27 -1.26 -4.36 117.38 115.89 2hsp n GLN 18 Ca -0.26 0.00 0.00 0.00 0.07 0.00 0.00 57.00 56.81 2hsp n GLN 18 Cb 0.75 -0.67 0.00 0.00 2.41 0.00 0.00 30.24 32.73 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 -0.66 3.69 0.63 -1.15 -4.48 116.66 114.69 2hsp n ARG 19 Ca 0.00 0.00 -0.01 0.00 -0.92 0.00 0.00 57.85 56.92 2hsp n ARG 19 Cb 0.00 0.00 -0.01 0.00 0.45 0.00 0.00 32.46 32.90 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 -1.54 -0.14 -0.00 -1.26 -4.86 120.64 112.84 2hsp n GLU 20 Ca 0.00 -0.51 0.00 0.00 -0.00 0.00 0.00 57.16 56.65 2hsp n GLU 20 Cb 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 31.44 31.44 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 0.03 -1.03 -3.61 -1.84 2.03 -1.26 -4.99 116.55 105.88 2hsp n ASP 21 Ca -0.05 0.00 -0.05 0.00 0.52 0.00 0.00 54.79 55.21 2hsp n ASP 21 Cb 0.62 -0.41 -0.04 0.00 -0.72 0.00 0.00 41.12 40.57 2hsp n ASP 21 CO 0.00 0.00 0.00 -0.70 -1.92 0.00 0.00 177.20 174.58 2hsp s GLU 22 N -3.23 0.25 0.35 -0.67 2.12 -1.26 -3.27 118.70 112.99 2hsp s GLU 22 Ca 0.00 0.01 0.05 0.00 0.36 0.00 0.00 54.97 55.39 2hsp s GLU 22 Cb 0.00 0.12 -0.07 0.00 0.26 0.00 0.00 34.13 34.44 2hsp s GLU 22 CO 0.00 -0.09 0.04 -0.51 -0.54 0.00 0.00 175.26 174.16 2hsp s LEU 23 N -1.40 2.43 -0.17 2.70 1.43 -1.24 -2.93 118.68 119.50 2hsp s LEU 23 Ca 0.07 -1.37 0.06 0.00 -1.03 0.00 0.00 54.13 51.85 2hsp s LEU 23 Cb -0.01 -0.57 0.43 0.00 0.03 0.00 0.00 46.19 46.07 2hsp s LEU 23 CO -0.05 -0.55 1.30 1.07 0.23 0.00 0.00 176.35 178.36 2hsp n THR 24 N -0.78 1.77 -1.50 5.49 5.66 -1.26 -3.30 114.28 120.37 2hsp n THR 24 Ca -0.03 -0.87 -0.47 0.00 -3.05 0.00 0.00 64.05 59.62 2hsp n THR 24 Cb 0.67 -0.49 -0.03 0.00 -1.55 0.00 0.00 70.33 68.93 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 0.08 0.42 -3.17 1.09 1.16 -1.26 -4.28 117.46 111.51 2hsp n PHE 25 Ca 0.22 0.84 -0.19 0.00 -1.87 0.00 0.00 57.45 56.44 2hsp n PHE 25 Cb 0.91 -2.11 0.03 0.00 -1.61 0.00 0.00 39.48 36.69 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 -0.94 2.45 -0.11 1.97 -4.36 -1.26 -0.60 121.20 118.34 2hsp s ILE 26 Ca 0.63 -1.09 -0.29 0.00 -0.26 0.00 0.00 60.65 59.64 2hsp s ILE 26 Cb -0.83 -2.54 -0.05 0.00 1.25 0.00 0.00 42.46 40.29 2hsp s ILE 26 CO 0.57 0.00 1.72 -0.75 0.24 0.00 0.00 174.94 176.72 2hsp s LYS 27 N -4.46 3.97 0.00 0.37 2.20 -1.20 -1.27 119.74 119.35 2hsp s LYS 27 Ca 0.55 2.05 0.00 0.00 -0.36 0.00 0.00 55.97 58.21 2hsp s LYS 27 Cb -0.07 -4.05 0.00 0.00 -1.51 0.00 0.00 37.83 32.20 2hsp s LYS 27 CO 0.34 -1.10 0.00 0.45 -0.36 0.00 0.00 175.35 174.68 2hsp n SER 28 N 7.95 0.00 -4.75 1.43 2.88 -0.36 -5.01 113.62 115.77 2hsp n SER 28 Ca 0.19 0.00 -0.42 0.00 -1.33 0.00 0.00 58.87 57.31 2hsp n SER 28 Cb 0.44 0.00 -0.01 0.00 -0.75 0.00 0.00 64.21 63.88 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 0.00 2.35 -2.82 -1.46 0.00 -0.39 -4.72 120.51 113.47 2hsp n ALA 29 Ca 0.00 0.37 -0.32 0.00 0.00 0.00 0.00 53.44 53.49 2hsp n ALA 29 Cb 0.00 -2.43 -0.02 0.00 0.00 0.00 0.00 19.45 17.00 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 1.57 4.11 -1.44 0.00 -0.00 -1.26 -1.29 119.36 121.05 2hsp n ILE 30 Ca 0.07 -5.70 -0.41 0.00 -0.00 0.00 0.00 62.75 56.71 2hsp n ILE 30 Cb 0.37 -1.45 0.01 0.00 -0.00 0.00 0.00 39.64 38.57 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 -0.19 1.68 -4.30 1.39 5.41 -1.26 -4.67 119.36 117.41 2hsp n ILE 31 Ca 0.37 -0.50 -0.26 0.00 1.00 0.00 0.00 62.75 63.36 2hsp n ILE 31 Cb 0.35 -0.50 -0.09 0.00 -0.71 0.00 0.00 39.64 38.69 2hsp n ILE 31 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2hsp s GLN 32 N -1.57 2.07 -0.16 0.38 0.00 -1.18 -2.80 119.66 116.40 2hsp s GLN 32 Ca 0.63 -1.33 -0.11 0.00 -0.00 0.00 0.00 55.36 54.55 2hsp s GLN 32 Cb -0.58 -2.13 0.04 0.00 0.00 0.00 0.00 33.01 30.34 2hsp s GLN 32 CO 0.58 0.42 0.23 -1.71 0.00 0.00 0.00 175.29 174.81 2hsp n ASN 33 N -0.16 -1.33 -4.27 12.60 5.15 -0.74 -2.90 115.26 123.61 2hsp n ASN 33 Ca -0.10 1.42 -0.15 0.00 -0.60 0.00 0.00 54.58 55.15 2hsp n ASN 33 Cb 0.56 -5.27 -0.10 0.00 -0.53 0.00 0.00 39.78 34.44 2hsp n ASN 33 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 2hsp s VAL 34 N -0.65 1.30 -0.30 3.44 1.01 -1.11 -3.01 120.40 121.07 2hsp s VAL 34 Ca -0.26 -2.08 -0.12 0.00 0.00 0.00 0.00 61.98 59.52 2hsp s VAL 34 Cb 0.02 -1.88 0.18 0.00 0.00 0.00 0.00 36.38 34.70 2hsp s VAL 34 CO 0.71 -0.70 1.04 -0.70 0.00 0.00 0.00 175.10 175.45 2hsp s GLU 35 N -3.69 0.16 1.00 2.72 2.12 -1.26 -4.69 118.70 115.06 2hsp s GLU 35 Ca 0.18 0.20 -0.18 0.00 0.36 0.00 0.00 54.97 55.53 2hsp s GLU 35 Cb 0.02 0.10 -0.13 0.00 0.26 0.00 0.00 34.13 34.38 2hsp s GLU 35 CO 0.02 -0.26 -0.79 1.63 -0.54 0.00 0.00 175.26 175.32 2hsp n LYS 36 N 5.24 -0.08 -3.79 4.30 4.76 -1.25 -3.84 118.16 123.50 2hsp n LYS 36 Ca 0.04 -0.02 -0.00 0.00 -2.87 0.00 0.00 58.31 55.45 2hsp n LYS 36 Cb 0.56 -1.11 0.00 0.00 -1.84 0.00 0.00 35.03 32.64 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 -2.22 0.79 -0.08 1.97 -0.44 1.01 -4.81 119.66 115.89 2hsp s GLN 37 Ca 0.42 -0.48 0.00 0.00 -2.50 0.00 0.00 55.36 52.80 2hsp s GLN 37 Cb -0.13 0.24 0.00 0.00 -1.64 0.00 0.00 33.01 31.48 2hsp s GLN 37 CO 0.78 -0.37 0.00 0.39 0.50 0.00 0.00 175.29 176.59 2hsp n GLU 38 N -0.63 -1.95 -0.89 1.67 -0.58 -1.26 0.73 120.64 117.72 2hsp n GLU 38 Ca -0.04 0.30 0.00 0.00 -0.42 0.00 0.00 57.16 57.00 2hsp n GLU 38 Cb 0.61 -3.94 0.00 0.00 -0.57 0.00 0.00 31.44 27.54 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 0.50 1.11 0.00 0.62 0.00 -1.26 -4.77 105.19 101.40 2hsp n GLY 39 Ca -0.01 -0.29 0.00 0.00 0.00 0.00 0.00 46.02 45.73 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 -0.46 0.87 2.96 -0.02 0.00 0.32 -5.01 105.19 103.85 2hsp n GLY 40 Ca 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.82 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 -1.53 0.89 0.10 1.61 0.52 0.22 -0.27 118.94 120.48 2hsp s TRP 41 Ca 0.00 -0.24 0.04 0.00 0.02 0.00 0.00 56.10 55.91 2hsp s TRP 41 Cb 0.00 -0.69 -0.04 0.00 -1.15 0.00 0.00 33.47 31.60 2hsp s TRP 41 CO 0.00 -0.15 0.09 -1.58 0.02 0.00 0.00 176.95 175.34 2hsp s TRP 42 N 0.51 3.17 0.51 -1.98 0.52 0.19 0.33 118.94 122.19 2hsp s TRP 42 Ca -0.08 0.05 0.03 0.00 0.02 0.00 0.00 56.10 56.12 2hsp s TRP 42 Cb -0.11 -1.59 -0.00 0.00 -1.15 0.00 0.00 33.47 30.62 2hsp s TRP 42 CO 0.01 0.52 0.14 1.03 0.02 0.00 0.00 176.95 178.66 2hsp s ARG 43 N -2.60 2.21 0.00 4.98 0.52 -1.25 0.23 118.95 123.04 2hsp s ARG 43 Ca 0.30 -2.24 0.00 0.00 -0.52 0.00 0.00 55.73 53.27 2hsp s ARG 43 Cb -0.12 -1.74 0.00 0.00 0.52 0.00 0.00 34.95 33.62 2hsp s ARG 43 CO 0.22 -0.41 0.00 0.41 0.02 0.00 0.00 175.30 175.54 2hsp n GLY 44 N -1.40 4.50 3.73 -3.53 0.00 -1.16 -4.04 105.19 103.28 2hsp n GLY 44 Ca -0.12 -1.19 -0.33 0.00 0.00 0.00 0.00 46.02 44.38 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 4.14 -0.38 1.61 -1.08 -1.14 -3.39 116.67 116.43 2hsp s ASP 45 Ca 0.00 2.17 0.09 0.00 -0.52 0.00 0.00 52.55 54.28 2hsp s ASP 45 Cb 0.00 -2.57 0.35 0.00 -1.46 0.00 0.00 42.92 39.25 2hsp s ASP 45 CO 0.00 -2.29 1.34 0.00 0.52 0.00 0.00 175.17 174.74 2hsp n TYR 46 N -3.12 -2.17 0.00 -5.34 9.36 -1.24 -3.07 117.16 111.58 2hsp n TYR 46 Ca 0.12 -1.74 0.00 0.00 3.32 0.00 0.00 57.90 59.60 2hsp n TYR 46 Cb 0.51 1.54 0.00 0.00 -0.63 0.00 0.00 39.34 40.77 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 -0.71 0.45 0.00 2.98 0.00 -1.26 -4.78 105.19 101.87 2hsp n GLY 47 Ca -0.08 -1.23 0.14 0.00 0.00 0.00 0.00 46.02 44.85 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 -1.48 3.95 -0.02 0.00 -1.26 -4.82 105.19 101.56 2hsp n GLY 48 Ca 0.00 -0.11 -0.23 0.00 0.00 0.00 0.00 46.02 45.68 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 -2.98 3.46 -0.35 1.61 3.01 -1.26 -5.08 119.74 118.15 2hsp s LYS 49 Ca 0.15 -0.55 0.02 0.00 -1.01 0.00 0.00 55.97 54.58 2hsp s LYS 49 Cb 0.19 -2.79 0.11 0.00 -1.01 0.00 0.00 37.83 34.33 2hsp s LYS 49 CO 0.53 0.30 0.10 0.21 0.51 0.00 0.00 175.35 177.01 2hsp s LYS 50 N -4.09 1.18 -0.12 1.68 2.20 -1.26 -3.68 119.74 115.65 2hsp s LYS 50 Ca 0.37 -1.62 -0.03 0.00 -0.36 0.00 0.00 55.97 54.33 2hsp s LYS 50 Cb -0.09 -2.63 0.00 0.00 -1.51 0.00 0.00 37.83 33.60 2hsp s LYS 50 CO 0.32 -1.00 0.09 1.04 -0.36 0.00 0.00 175.35 175.45 2hsp n GLN 51 N 4.33 -1.03 0.00 4.03 6.02 -1.22 -4.80 117.38 124.72 2hsp n GLN 51 Ca 0.02 1.18 0.00 0.00 -0.01 0.00 0.00 57.00 58.19 2hsp n GLN 51 Cb 0.40 -2.70 0.00 0.00 1.02 0.00 0.00 30.24 28.96 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 -0.07 0.00 -3.66 1.08 4.77 -1.24 -4.64 117.00 113.24 2hsp n LEU 52 Ca 0.02 0.00 -0.14 0.00 -0.03 0.00 0.00 56.01 55.86 2hsp n LEU 52 Cb 0.07 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.08 2hsp n LEU 52 CO 0.16 0.00 0.27 0.26 -1.33 0.00 0.00 177.39 176.75 2hsp s TRP 53 N 2.56 -0.60 -0.03 -1.77 0.52 -1.20 -4.45 118.94 113.97 2hsp s TRP 53 Ca 0.00 1.37 -0.00 0.00 0.02 0.00 0.00 56.10 57.49 2hsp s TRP 53 Cb 0.00 0.24 0.03 0.00 -1.15 0.00 0.00 33.47 32.59 2hsp s TRP 53 CO 0.00 -0.36 0.02 -0.06 0.02 0.00 0.00 176.95 176.57 2hsp s PHE 54 N -0.08 0.16 0.61 -1.98 0.08 0.14 -3.67 117.98 113.23 2hsp s PHE 54 Ca -0.03 0.09 -0.18 0.00 0.12 0.00 0.00 56.93 56.93 2hsp s PHE 54 Cb -0.04 -0.35 -0.06 0.00 -0.57 0.00 0.00 43.02 42.01 2hsp s PHE 54 CO 0.03 -0.12 0.75 -2.30 -0.10 0.00 0.00 175.22 173.47 2hsp n PRO 55 N 4.34 0.65 -0.17 0.24 -0.02 -1.26 0.54 135.00 139.32 2hsp n PRO 55 Ca -0.24 0.26 0.07 0.00 -2.02 0.00 0.00 63.50 61.57 2hsp n PRO 55 Cb 0.50 -1.96 0.22 0.00 -0.02 0.00 0.00 33.50 32.24 2hsp n PRO 55 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2hsp n SER 56 N -0.33 1.99 -0.00 2.55 2.88 0.63 -1.42 113.62 119.91 2hsp n SER 56 Ca 0.13 -1.93 0.06 0.00 -1.33 0.00 0.00 58.87 55.79 2hsp n SER 56 Cb 0.48 -0.22 -0.08 0.00 -0.75 0.00 0.00 64.21 63.64 2hsp n SER 56 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 2hsp n ASN 57 N 0.57 0.83 -0.05 -3.46 3.02 -1.26 -4.65 115.26 110.26 2hsp n ASN 57 Ca 0.14 -0.66 -0.10 0.00 -0.03 0.00 0.00 54.58 53.93 2hsp n ASN 57 Cb 0.33 1.10 -0.04 0.00 -0.61 0.00 0.00 39.78 40.56 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 -1.40 0.00 -2.65 3.10 4.02 -0.90 -4.98 117.16 114.35 2hsp n TYR 58 Ca 0.02 0.00 -0.06 0.00 -0.01 0.00 0.00 57.90 57.84 2hsp n TYR 58 Cb 0.22 -0.38 0.03 0.00 -0.02 0.00 0.00 39.34 39.19 2hsp n TYR 58 CO 0.00 0.00 0.00 1.33 -1.01 0.00 0.00 176.86 177.18 2hsp n VAL 59 N -3.23 0.00 -3.64 -0.72 0.24 -0.51 -2.82 118.33 107.64 2hsp n VAL 59 Ca -0.20 -0.52 -0.02 0.00 -2.04 0.00 0.00 64.34 61.56 2hsp n VAL 59 Cb 0.66 -1.07 -0.05 0.00 -1.47 0.00 0.00 33.84 31.91 2hsp n VAL 59 CO 0.00 0.00 0.00 -0.70 -2.14 0.00 0.00 176.83 173.99 2hsp s GLU 60 N -3.01 0.06 -0.75 7.34 2.56 -1.26 -4.79 118.70 118.85 2hsp s GLU 60 Ca 0.19 0.03 -0.18 0.00 0.00 0.00 0.00 54.97 55.01 2hsp s GLU 60 Cb -0.01 0.03 -0.14 0.00 2.00 0.00 0.00 34.13 36.01 2hsp s GLU 60 CO 0.12 -0.01 1.93 -0.85 -0.56 0.00 0.00 175.26 175.89 2hsp n GLU 61 N 0.85 1.54 -3.38 4.30 0.28 -1.26 -3.73 120.64 119.24 2hsp n GLU 61 Ca -0.03 -1.67 -0.31 0.00 -0.16 0.00 0.00 57.16 54.99 2hsp n GLU 61 Cb 0.58 -2.75 0.03 0.00 1.43 0.00 0.00 31.44 30.73 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 6.27 -1.88 -0.54 3.44 2.81 -1.26 -4.92 117.12 121.05 2hsp n MET 62 Ca 0.47 1.49 -0.00 0.00 -1.81 0.00 0.00 57.70 57.84 2hsp n MET 62 Cb 0.32 -2.49 -0.00 0.00 -0.71 0.00 0.00 33.22 30.34 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 -0.05 0.00 -1.25 2.03 0.31 -1.26 -5.08 118.33 113.02 2hsp n VAL 63 Ca -0.05 -0.03 0.10 0.00 -0.01 0.00 0.00 64.34 64.35 2hsp n VAL 63 Cb 0.63 0.32 -0.06 0.00 -0.91 0.00 0.00 33.84 33.82 2hsp n VAL 63 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 2hsp n ASN 64 N 0.01 -5.79 -1.20 4.52 4.13 -1.26 -4.98 115.26 110.70 2hsp n ASN 64 Ca -0.00 1.13 0.00 0.00 1.68 0.00 0.00 54.58 57.39 2hsp n ASN 64 Cb 0.64 -4.08 0.00 0.00 -1.54 0.00 0.00 39.78 34.79 2hsp n ASN 64 CO 0.00 0.00 0.00 -0.81 0.28 0.00 0.00 177.26 176.73 2hsp n PRO 65 N -3.68 3.20 -4.22 3.52 -0.04 -1.26 -5.11 135.00 127.41 2hsp n PRO 65 Ca -0.06 0.00 -0.19 0.00 -0.04 0.00 0.00 63.50 63.21 2hsp n PRO 65 Cb 0.47 0.00 -0.12 0.00 -0.04 0.00 0.00 33.50 33.81 2hsp n PRO 65 CO 0.00 0.00 0.00 -1.83 -0.04 0.00 0.00 175.50 173.63 2hsp s GLU 66 N 2.23 0.95 0.00 0.54 -1.05 -1.26 -5.05 118.70 115.06 2hsp s GLU 66 Ca 0.00 -1.10 0.00 0.00 -0.15 0.00 0.00 54.97 53.72 2hsp s GLU 66 Cb 0.00 -0.96 0.00 0.00 -0.44 0.00 0.00 34.13 32.73 2hsp s GLU 66 CO 0.00 0.21 0.63 0.41 0.95 0.00 0.00 175.26 177.46 2hsp n GLY 67 N 0.96 -0.26 3.54 -3.83 0.00 -1.26 -5.05 105.19 99.29 2hsp n GLY 67 Ca -0.19 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.40 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 4.58 0.18 -0.61 1.01 -1.26 -4.78 121.20 120.32 2hsp s ILE 68 Ca 0.00 0.42 0.00 0.00 0.00 0.00 0.00 60.65 61.07 2hsp s ILE 68 Cb 0.00 -4.38 0.00 0.00 0.01 0.00 0.00 42.46 38.09 2hsp s ILE 68 CO 0.00 -0.81 0.00 1.57 0.00 0.00 0.00 174.94 175.70 2hsp n HIS 69 N 6.91 -2.06 -3.73 3.97 -0.00 -1.26 -4.94 115.22 114.09 2hsp n HIS 69 Ca 0.02 1.08 -0.37 0.00 0.46 0.00 0.00 57.72 58.91 2hsp n HIS 69 Cb 0.48 -2.39 -0.12 0.00 -0.12 0.00 0.00 29.99 27.84 2hsp n HIS 69 CO 0.00 0.00 0.00 -0.98 0.46 0.00 0.00 176.34 175.82 2hsp s ARG 70 N -3.50 3.78 0.00 1.57 1.70 -1.26 -5.18 118.95 116.06 2hsp s ARG 70 Ca 0.00 -0.42 0.00 0.00 -0.47 0.00 0.00 55.73 54.84 2hsp s ARG 70 Cb 0.00 -3.41 0.00 0.00 -0.57 0.00 0.00 34.95 30.97 2hsp s ARG 70 CO 0.00 -0.14 0.00 -0.25 -1.08 0.00 0.00 175.30 173.83