#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 -6.05 -4.76 1.61 7.64 -1.26 -4.93 113.62 105.87 2hsp n SER 2 Ca 0.00 -0.72 -0.39 0.00 1.01 0.00 0.00 58.87 58.77 2hsp n SER 2 Cb 0.00 -3.75 -0.05 0.00 -1.01 0.00 0.00 64.21 59.39 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 -4.81 4.67 0.45 1.43 0.04 -1.26 -5.03 135.00 130.49 2hsp s PRO 3 Ca 0.25 1.55 -0.18 0.00 0.04 0.00 0.00 61.00 62.67 2hsp s PRO 3 Cb -0.08 -3.09 -0.09 0.00 0.04 0.00 0.00 34.50 31.28 2hsp s PRO 3 CO 0.83 0.31 0.93 0.99 0.04 0.00 0.00 177.00 180.10 2hsp s THR 4 N -1.31 4.49 0.13 1.26 2.01 -1.26 -5.07 115.64 115.90 2hsp s THR 4 Ca 0.45 1.29 -0.14 0.00 0.31 0.00 0.00 61.69 63.61 2hsp s THR 4 Cb -0.26 -3.65 0.02 0.00 0.01 0.00 0.00 72.50 68.62 2hsp s THR 4 CO 0.33 -0.45 0.36 -0.36 -0.69 0.00 0.00 174.62 173.81 2hsp s PHE 5 N -2.33 -0.04 0.00 4.92 0.40 -1.26 -5.17 117.98 114.51 2hsp s PHE 5 Ca 0.60 -0.32 0.00 0.00 -0.60 0.00 0.00 56.93 56.61 2hsp s PHE 5 Cb -0.09 0.17 0.00 0.00 0.51 0.00 0.00 43.02 43.60 2hsp s PHE 5 CO 0.21 -0.70 0.00 1.63 0.70 0.00 0.00 175.22 177.06 2hsp n LYS 6 N -0.20 -1.37 -1.83 0.44 5.02 -1.26 -4.76 118.16 114.19 2hsp n LYS 6 Ca -0.14 0.00 -0.38 0.00 -2.02 0.00 0.00 58.31 55.77 2hsp n LYS 6 Cb 0.63 0.00 -0.03 0.00 -0.02 0.00 0.00 35.03 35.61 2hsp n LYS 6 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2hsp s ALA 8 N 9.87 3.46 0.00 0.00 0.00 -1.26 -1.29 121.76 132.53 2hsp s ALA 8 Ca 0.82 -1.90 0.00 0.00 0.00 0.00 0.00 51.96 50.87 2hsp s ALA 8 Cb -0.17 -0.60 0.00 0.00 0.00 0.00 0.00 23.12 22.35 2hsp s ALA 8 CO 0.25 0.00 0.00 1.33 0.00 0.00 0.00 175.76 177.35 2hsp n VAL 9 N -1.13 0.00 -2.91 0.00 0.24 -1.08 -4.20 118.33 109.26 2hsp n VAL 9 Ca -0.03 0.00 -0.07 0.00 -2.04 0.00 0.00 64.34 62.20 2hsp n VAL 9 Cb 0.62 0.00 -0.01 0.00 -1.47 0.00 0.00 33.84 32.98 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 0.79 1.02 -0.28 7.34 2.47 -1.16 -4.37 119.74 125.54 2hsp s LYS 10 Ca 0.00 -1.13 -0.25 0.00 -1.56 0.00 0.00 55.97 53.02 2hsp s LYS 10 Cb 0.00 -0.24 -0.11 0.00 -1.46 0.00 0.00 37.83 36.02 2hsp s LYS 10 CO 0.00 -1.32 1.16 0.00 0.16 0.00 0.00 175.35 175.35 2hsp n ALA 11 N 3.10 -0.06 0.09 3.13 0.00 -0.71 -4.60 120.51 121.47 2hsp n ALA 11 Ca 0.19 0.14 -0.13 0.00 0.00 0.00 0.00 53.44 53.64 2hsp n ALA 11 Cb 0.55 -1.17 -0.10 0.00 0.00 0.00 0.00 19.45 18.73 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 4.67 0.35 -9.28 0.00 3.38 -1.78 -1.48 115.31 111.17 2hsp h LEU 12 Ca -0.10 -0.34 -0.64 0.00 0.09 0.00 0.00 57.88 56.89 2hsp h LEU 12 Cb 0.80 -0.11 -0.15 0.00 0.09 0.00 0.00 40.66 41.29 2hsp h LEU 12 CO 0.61 1.22 -0.74 -0.36 0.09 0.00 0.00 178.44 179.26 2hsp s PHE 13 N -2.86 2.65 0.59 1.13 0.08 -1.16 -4.78 117.98 113.64 2hsp s PHE 13 Ca -0.03 -0.21 -0.09 0.00 0.12 0.00 0.00 56.93 56.72 2hsp s PHE 13 Cb 0.08 -1.34 -0.03 0.00 -0.57 0.00 0.00 43.02 41.16 2hsp s PHE 13 CO 0.86 0.47 0.97 0.16 -0.10 0.00 0.00 175.22 177.58 2hsp s ASP 14 N -2.58 6.16 0.30 1.36 1.47 -1.26 -4.11 116.67 118.01 2hsp s ASP 14 Ca 0.23 1.25 0.03 0.00 1.18 0.00 0.00 52.55 55.23 2hsp s ASP 14 Cb -0.10 -2.34 -0.04 0.00 -0.34 0.00 0.00 42.92 40.10 2hsp s ASP 14 CO 0.14 -0.84 0.13 -0.47 0.68 0.00 0.00 175.17 174.81 2hsp s TYR 15 N -3.08 1.63 -0.41 2.11 6.14 -0.14 -4.91 117.35 118.69 2hsp s TYR 15 Ca 0.53 -1.26 0.09 0.00 0.64 0.00 0.00 57.07 57.07 2hsp s TYR 15 Cb -0.11 -0.94 0.36 0.00 0.42 0.00 0.00 41.96 41.69 2hsp s TYR 15 CO 0.51 -0.39 1.09 0.36 0.64 0.00 0.00 175.55 177.76 2hsp n LYS 16 N -0.59 1.07 -0.12 4.97 2.85 -1.26 -4.37 118.16 120.72 2hsp n LYS 16 Ca -0.00 -2.32 -0.25 0.00 -1.05 0.00 0.00 58.31 54.69 2hsp n LYS 16 Cb 0.65 -0.92 -0.11 0.00 -0.65 0.00 0.00 35.03 34.00 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 0.05 1.11 0.00 0.58 0.00 -1.11 -4.80 120.51 116.35 2hsp n ALA 17 Ca 0.08 -0.91 0.00 0.00 0.00 0.00 0.00 53.44 52.61 2hsp n ALA 17 Cb 0.74 -0.15 0.00 0.00 0.00 0.00 0.00 19.45 20.04 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 -4.04 0.00 -2.69 0.00 7.27 -1.24 -4.12 117.38 112.56 2hsp n GLN 18 Ca -0.46 0.00 -0.05 0.00 0.07 0.00 0.00 57.00 56.56 2hsp n GLN 18 Cb 0.87 -0.69 0.09 0.00 2.41 0.00 0.00 30.24 32.93 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 0.39 -0.10 3.69 0.63 -1.26 -4.50 116.66 115.51 2hsp n ARG 19 Ca 0.00 -1.07 0.01 0.00 -0.92 0.00 0.00 57.85 55.88 2hsp n ARG 19 Cb 0.00 -0.50 0.02 0.00 0.45 0.00 0.00 32.46 32.43 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 0.85 1.05 -0.76 -0.14 0.28 -1.26 -4.89 120.64 115.77 2hsp n GLU 20 Ca -0.00 -1.17 0.00 0.00 -0.16 0.00 0.00 57.16 55.83 2hsp n GLU 20 Cb 0.72 -0.78 0.00 0.00 1.43 0.00 0.00 31.44 32.81 2hsp n GLU 20 CO 0.00 0.00 0.00 -3.47 -0.16 0.00 0.00 177.13 173.50 2hsp n ASP 21 N -0.34 -1.37 -1.23 -1.84 -0.08 -1.26 -4.84 116.55 105.58 2hsp n ASP 21 Ca 0.02 0.00 0.04 0.00 -1.51 0.00 0.00 54.79 53.34 2hsp n ASP 21 Cb 0.48 -0.23 0.03 0.00 2.34 0.00 0.00 41.12 43.75 2hsp n ASP 21 CO 0.00 0.00 0.00 1.21 0.12 0.00 0.00 177.20 178.53 2hsp n GLU 22 N -2.46 0.15 0.00 -0.67 2.13 -1.26 0.29 120.64 118.82 2hsp n GLU 22 Ca 0.00 -1.94 0.00 0.00 0.66 0.00 0.00 57.16 55.88 2hsp n GLU 22 Cb 0.00 -0.24 0.00 0.00 0.27 0.00 0.00 31.44 31.47 2hsp n GLU 22 CO 0.00 0.00 0.00 1.28 -0.41 0.00 0.00 177.13 178.00 2hsp n LEU 23 N 0.25 0.00 -1.91 4.31 4.77 -1.26 -4.35 117.00 118.81 2hsp n LEU 23 Ca 0.06 0.00 -0.09 0.00 -0.03 0.00 0.00 56.01 55.95 2hsp n LEU 23 Cb 1.03 0.00 0.24 0.00 -2.33 0.00 0.00 43.42 42.36 2hsp n LEU 23 CO -0.03 0.00 1.01 1.07 -1.33 0.00 0.00 177.39 178.11 2hsp n THR 24 N 0.00 2.69 -1.50 -5.08 5.66 -1.26 -2.74 114.28 112.04 2hsp n THR 24 Ca 0.00 -1.46 -0.46 0.00 -3.05 0.00 0.00 64.05 59.08 2hsp n THR 24 Cb 0.00 -0.44 -0.02 0.00 -1.55 0.00 0.00 70.33 68.31 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 -0.29 0.48 -3.39 1.09 1.16 -1.26 -4.39 117.46 110.86 2hsp n PHE 25 Ca 0.40 0.83 -0.23 0.00 -1.87 0.00 0.00 57.45 56.58 2hsp n PHE 25 Cb 1.33 -2.12 0.04 0.00 -1.61 0.00 0.00 39.48 37.11 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 -1.02 1.88 -0.42 1.97 -4.36 -1.26 -0.96 121.20 117.03 2hsp s ILE 26 Ca 0.61 -1.20 -0.28 0.00 -0.26 0.00 0.00 60.65 59.52 2hsp s ILE 26 Cb -0.81 -2.09 -0.02 0.00 1.25 0.00 0.00 42.46 40.79 2hsp s ILE 26 CO 0.58 0.00 1.88 -0.75 0.24 0.00 0.00 174.94 176.89 2hsp s LYS 27 N -4.52 3.03 0.00 0.37 2.36 -1.26 -1.23 119.74 118.49 2hsp s LYS 27 Ca 0.50 1.21 0.00 0.00 -2.55 0.00 0.00 55.97 55.14 2hsp s LYS 27 Cb -0.04 -4.29 0.00 0.00 -1.05 0.00 0.00 37.83 32.45 2hsp s LYS 27 CO 0.32 -2.23 0.00 0.43 1.55 0.00 0.00 175.35 175.42 2hsp n SER 28 N 11.47 0.00 -4.59 1.43 7.64 -0.56 -4.99 113.62 124.02 2hsp n SER 28 Ca 0.23 0.00 -0.46 0.00 1.01 0.00 0.00 58.87 59.66 2hsp n SER 28 Cb 0.49 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.67 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 0.00 -0.28 -2.77 -0.43 0.00 -0.37 -4.64 120.51 112.02 2hsp n ALA 29 Ca 0.00 0.41 -0.30 0.00 0.00 0.00 0.00 53.44 53.55 2hsp n ALA 29 Cb 0.00 -2.04 -0.02 0.00 0.00 0.00 0.00 19.45 17.39 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 0.70 3.46 -1.27 0.00 5.41 -1.26 -1.73 119.36 124.67 2hsp n ILE 30 Ca 0.11 -5.48 -0.38 0.00 1.00 0.00 0.00 62.75 58.00 2hsp n ILE 30 Cb 0.30 -1.39 0.03 0.00 -0.71 0.00 0.00 39.64 37.87 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 -0.27 0.85 -4.52 1.39 5.41 -1.26 -4.57 119.36 116.39 2hsp n ILE 31 Ca 0.36 -0.48 -0.25 0.00 1.00 0.00 0.00 62.75 63.39 2hsp n ILE 31 Cb 0.41 -0.30 -0.11 0.00 -0.71 0.00 0.00 39.64 38.93 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 -1.73 1.76 -0.20 0.38 -2.07 -1.08 -2.62 119.66 114.10 2hsp s GLN 32 Ca 0.59 -1.94 -0.03 0.00 -1.82 0.00 0.00 55.36 52.16 2hsp s GLN 32 Cb -0.42 -1.41 0.00 0.00 -1.09 0.00 0.00 33.01 30.10 2hsp s GLN 32 CO 0.64 0.01 0.06 -1.71 -1.32 0.00 0.00 175.29 172.98 2hsp n ASN 33 N -0.77 -7.34 -4.61 12.60 5.15 -0.42 -2.78 115.26 117.10 2hsp n ASN 33 Ca -0.05 0.91 -0.25 0.00 -0.60 0.00 0.00 54.58 54.59 2hsp n ASN 33 Cb 0.65 -3.68 -0.09 0.00 -0.53 0.00 0.00 39.78 36.12 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 -1.43 2.52 -0.30 3.44 1.01 -0.93 -3.39 120.40 121.32 2hsp s VAL 34 Ca 0.03 -2.03 -0.15 0.00 0.00 0.00 0.00 61.98 59.84 2hsp s VAL 34 Cb -0.01 -2.76 0.18 0.00 0.00 0.00 0.00 36.38 33.79 2hsp s VAL 34 CO 0.48 -0.20 1.09 -0.70 0.00 0.00 0.00 175.10 175.77 2hsp s GLU 35 N -3.69 0.17 -0.61 2.72 2.12 -1.25 -4.93 118.70 113.23 2hsp s GLU 35 Ca 0.34 0.34 -0.27 0.00 0.36 0.00 0.00 54.97 55.74 2hsp s GLU 35 Cb 0.01 0.19 -0.01 0.00 0.26 0.00 0.00 34.13 34.58 2hsp s GLU 35 CO 0.19 -0.15 1.75 -1.59 -0.54 0.00 0.00 175.26 174.91 2hsp s LYS 36 N 2.76 2.80 0.63 4.30 -2.85 -1.26 -3.12 119.74 123.00 2hsp s LYS 36 Ca -0.02 0.54 -0.17 0.00 -1.00 0.00 0.00 55.97 55.31 2hsp s LYS 36 Cb -0.08 -4.33 -0.05 0.00 -2.06 0.00 0.00 37.83 31.31 2hsp s LYS 36 CO -0.12 -2.54 0.74 0.94 0.10 0.00 0.00 175.35 174.47 2hsp n GLN 37 N 9.12 0.61 -1.31 1.78 7.27 0.31 -4.63 117.38 130.53 2hsp n GLN 37 Ca 0.18 0.25 -0.13 0.00 0.07 0.00 0.00 57.00 57.36 2hsp n GLN 37 Cb 0.51 -1.96 -0.09 0.00 2.41 0.00 0.00 30.24 31.12 2hsp n GLN 37 CO 0.00 0.00 0.00 0.39 0.07 0.00 0.00 177.06 177.52 2hsp n GLU 38 N -0.75 0.06 0.00 3.69 4.71 -1.26 -1.73 120.64 125.35 2hsp n GLU 38 Ca 0.12 -1.16 0.00 0.00 -0.01 0.00 0.00 57.16 56.11 2hsp n GLU 38 Cb 0.48 -2.99 0.00 0.00 -1.01 0.00 0.00 31.44 27.92 2hsp n GLU 38 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 2hsp n GLY 39 N 5.53 0.44 0.00 0.62 0.00 -1.26 -4.99 105.19 105.53 2hsp n GLY 39 Ca 0.30 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 46.29 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 1.00 2.98 -0.02 0.00 -0.71 -5.07 105.19 103.37 2hsp n GLY 40 Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.85 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 -1.82 0.58 0.22 1.61 0.52 -1.25 -2.11 118.94 116.68 2hsp s TRP 41 Ca 0.00 -0.12 0.08 0.00 0.02 0.00 0.00 56.10 56.07 2hsp s TRP 41 Cb 0.00 -0.37 -0.04 0.00 -1.15 0.00 0.00 33.47 31.91 2hsp s TRP 41 CO 0.00 -0.01 0.06 -1.58 0.02 0.00 0.00 176.95 175.44 2hsp s TRP 42 N -0.20 2.90 0.43 -1.98 0.52 0.16 0.11 118.94 120.89 2hsp s TRP 42 Ca 0.02 -0.14 0.03 0.00 0.02 0.00 0.00 56.10 56.03 2hsp s TRP 42 Cb -0.03 -1.34 -0.03 0.00 -1.15 0.00 0.00 33.47 30.92 2hsp s TRP 42 CO -0.00 0.55 0.05 0.50 0.02 0.00 0.00 176.95 178.07 2hsp s ARG 43 N -3.41 1.99 0.00 4.98 3.52 -1.18 -0.36 118.95 124.50 2hsp s ARG 43 Ca 0.30 -2.21 0.00 0.00 -0.13 0.00 0.00 55.73 53.69 2hsp s ARG 43 Cb -0.08 -1.16 0.00 0.00 -1.56 0.00 0.00 34.95 32.15 2hsp s ARG 43 CO 0.21 -0.32 0.00 0.41 -0.81 0.00 0.00 175.30 174.79 2hsp n GLY 44 N -1.02 4.74 3.75 8.12 0.00 -1.22 -3.79 105.19 115.77 2hsp n GLY 44 Ca -0.10 -1.17 -0.41 0.00 0.00 0.00 0.00 46.02 44.34 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 6.92 -0.28 1.61 -1.08 -1.12 -3.05 116.67 119.66 2hsp s ASP 45 Ca 0.00 2.45 0.19 0.00 -0.52 0.00 0.00 52.55 54.67 2hsp s ASP 45 Cb 0.00 -2.62 0.49 0.00 -1.46 0.00 0.00 42.92 39.33 2hsp s ASP 45 CO 0.00 -0.48 1.09 0.00 0.52 0.00 0.00 175.17 176.30 2hsp n TYR 46 N 2.04 1.54 0.00 -5.34 9.36 -1.26 -2.63 117.16 120.86 2hsp n TYR 46 Ca 0.04 -2.33 0.00 0.00 3.32 0.00 0.00 57.90 58.93 2hsp n TYR 46 Cb 0.43 -0.27 0.00 0.00 -0.63 0.00 0.00 39.34 38.87 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 -0.50 0.66 0.06 2.98 0.00 -1.26 -4.76 105.19 102.37 2hsp n GLY 47 Ca 0.14 -1.62 0.05 0.00 0.00 0.00 0.00 46.02 44.59 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 -0.74 3.77 -0.02 0.00 -1.26 -4.63 105.19 102.32 2hsp n GLY 48 Ca 0.00 0.06 -0.26 0.00 0.00 0.00 0.00 46.02 45.82 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 -1.79 -0.73 -3.31 1.61 4.76 -1.26 -5.09 118.16 112.34 2hsp n LYS 49 Ca 0.00 -2.30 -0.08 0.00 -2.87 0.00 0.00 58.31 53.06 2hsp n LYS 49 Cb 0.05 -1.02 -0.07 0.00 -1.84 0.00 0.00 35.03 32.15 2hsp n LYS 49 CO 0.00 0.00 0.00 0.21 -1.37 0.00 0.00 177.40 176.24 2hsp s LYS 50 N -5.47 0.39 -0.36 1.97 2.20 -1.26 -4.29 119.74 112.92 2hsp s LYS 50 Ca 0.69 0.46 -0.09 0.00 -0.36 0.00 0.00 55.97 56.67 2hsp s LYS 50 Cb -0.03 -0.32 0.01 0.00 -1.51 0.00 0.00 37.83 35.99 2hsp s LYS 50 CO 0.48 -0.76 0.45 1.04 -0.36 0.00 0.00 175.35 176.19 2hsp n GLN 51 N 5.37 -1.58 0.00 4.03 3.00 -1.17 -4.82 117.38 122.20 2hsp n GLN 51 Ca -0.02 1.59 0.00 0.00 -0.01 0.00 0.00 57.00 58.56 2hsp n GLN 51 Cb 0.50 -4.56 0.00 0.00 0.00 0.00 0.00 30.24 26.18 2hsp n GLN 51 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.06 178.34 2hsp n LEU 52 N -0.60 0.00 -3.87 1.08 4.77 -1.18 -4.61 117.00 112.60 2hsp n LEU 52 Ca 0.07 0.00 -0.11 0.00 -0.03 0.00 0.00 56.01 55.94 2hsp n LEU 52 Cb 0.37 0.00 -0.11 0.00 -2.33 0.00 0.00 43.42 41.34 2hsp n LEU 52 CO 0.36 0.00 -0.23 0.26 -1.33 0.00 0.00 177.39 176.45 2hsp s TRP 53 N 4.07 -0.01 -0.10 -1.77 0.52 0.83 -4.28 118.94 118.21 2hsp s TRP 53 Ca 0.00 0.02 -0.04 0.00 0.02 0.00 0.00 56.10 56.10 2hsp s TRP 53 Cb 0.00 -0.03 0.05 0.00 -1.15 0.00 0.00 33.47 32.34 2hsp s TRP 53 CO 0.00 -0.17 0.21 -0.06 0.02 0.00 0.00 176.95 176.96 2hsp s PHE 54 N -0.71 -0.28 0.76 -1.98 0.08 0.52 -4.24 117.98 112.12 2hsp s PHE 54 Ca -0.08 0.72 -0.15 0.00 0.12 0.00 0.00 56.93 57.53 2hsp s PHE 54 Cb -0.05 -0.04 -0.01 0.00 -0.57 0.00 0.00 43.02 42.36 2hsp s PHE 54 CO 0.01 -0.24 0.69 -2.30 -0.10 0.00 0.00 175.22 173.27 2hsp n PRO 55 N 4.53 0.26 -0.25 0.24 -0.02 -1.26 0.38 135.00 138.88 2hsp n PRO 55 Ca -0.20 0.14 0.08 0.00 -2.02 0.00 0.00 63.50 61.50 2hsp n PRO 55 Cb 0.52 -1.99 0.23 0.00 -0.02 0.00 0.00 33.50 32.23 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 -1.07 2.66 -0.08 2.55 2.88 -0.90 -1.80 113.62 117.87 2hsp n SER 56 Ca 0.11 -1.99 0.06 0.00 -1.33 0.00 0.00 58.87 55.71 2hsp n SER 56 Cb 0.50 -0.33 -0.05 0.00 -0.75 0.00 0.00 64.21 63.59 2hsp n SER 56 CO 0.00 0.00 0.00 -3.20 -1.23 0.00 0.00 175.04 170.61 2hsp n ASN 57 N 0.96 0.77 -0.01 -3.46 5.15 -1.26 -4.59 115.26 112.82 2hsp n ASN 57 Ca 0.17 -0.89 -0.01 0.00 -0.60 0.00 0.00 54.58 53.25 2hsp n ASN 57 Cb 0.42 0.85 -0.02 0.00 -0.53 0.00 0.00 39.78 40.51 2hsp n ASN 57 CO 0.00 0.00 0.00 -1.22 1.40 0.00 0.00 177.26 177.44 2hsp n TYR 58 N -0.97 0.00 -3.53 1.20 4.02 -1.03 -4.95 117.16 111.91 2hsp n TYR 58 Ca 0.03 0.00 -0.23 0.00 -0.01 0.00 0.00 57.90 57.69 2hsp n TYR 58 Cb 0.20 -0.10 0.01 0.00 -0.02 0.00 0.00 39.34 39.43 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 -2.05 1.97 -0.29 -0.72 -7.23 -0.74 -2.23 120.40 109.11 2hsp s VAL 59 Ca -0.02 -1.29 -0.24 0.00 -1.81 0.00 0.00 61.98 58.62 2hsp s VAL 59 Cb 0.01 -2.26 0.14 0.00 0.56 0.00 0.00 36.38 34.82 2hsp s VAL 59 CO 0.08 0.00 1.13 -0.70 -0.31 0.00 0.00 175.10 175.30 2hsp s GLU 60 N -4.40 0.38 -1.07 4.82 2.56 -1.26 -4.82 118.70 114.92 2hsp s GLU 60 Ca 0.46 0.47 -0.24 0.00 0.00 0.00 0.00 54.97 55.65 2hsp s GLU 60 Cb -0.04 0.18 -0.16 0.00 2.00 0.00 0.00 34.13 36.12 2hsp s GLU 60 CO 0.28 -0.05 1.98 0.39 -0.56 0.00 0.00 175.26 177.30 2hsp n GLU 61 N 2.16 1.03 -1.50 4.30 1.02 -1.26 -3.00 120.64 123.39 2hsp n GLU 61 Ca -0.12 -2.11 0.00 0.00 -0.02 0.00 0.00 57.16 54.91 2hsp n GLU 61 Cb 0.56 -3.68 0.00 0.00 -0.02 0.00 0.00 31.44 28.30 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 8.12 -1.96 -0.70 3.49 2.81 -1.26 -3.66 117.12 123.96 2hsp n MET 62 Ca 0.44 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 56.33 2hsp n MET 62 Cb 0.46 -2.42 0.00 0.00 -0.71 0.00 0.00 33.22 30.55 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 -1.29 -0.16 -1.07 2.03 0.31 -1.26 -4.31 118.33 112.58 2hsp n VAL 63 Ca 0.00 0.00 -0.45 0.00 -0.01 0.00 0.00 64.34 63.88 2hsp n VAL 63 Cb 0.25 -0.56 -0.10 0.00 -0.91 0.00 0.00 33.84 32.52 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 1.49 0.52 -2.58 4.52 5.03 -1.24 -4.68 115.26 118.32 2hsp n ASN 64 Ca 0.00 0.45 -0.09 0.00 0.87 0.00 0.00 54.58 55.81 2hsp n ASN 64 Cb 0.00 -0.74 -0.05 0.00 -1.02 0.00 0.00 39.78 37.97 2hsp n ASN 64 CO 0.00 0.00 0.00 -0.81 -1.83 0.00 0.00 177.26 174.62 2hsp n PRO 65 N 6.33 1.07 -0.92 3.52 -0.04 -1.26 -4.91 135.00 138.78 2hsp n PRO 65 Ca 0.47 -0.68 -0.34 0.00 -0.04 0.00 0.00 63.50 62.91 2hsp n PRO 65 Cb -0.02 -1.92 0.11 0.00 -0.04 0.00 0.00 33.50 31.63 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 3.35 -0.13 0.00 0.54 1.02 -1.26 -4.95 120.64 119.21 2hsp n GLU 66 Ca 0.23 0.01 0.00 0.00 -0.02 0.00 0.00 57.16 57.38 2hsp n GLU 66 Cb 0.28 -1.90 0.00 0.00 -0.02 0.00 0.00 31.44 29.80 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 1.44 4.66 3.30 0.62 0.00 -1.26 -5.15 105.19 108.80 2hsp n GLY 67 Ca 0.08 -1.04 -0.26 0.00 0.00 0.00 0.00 46.02 44.79 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 -1.69 1.86 0.22 -0.61 1.01 -1.26 -5.10 121.20 115.62 2hsp s ILE 68 Ca 0.00 -1.42 -0.30 0.00 0.00 0.00 0.00 60.65 58.92 2hsp s ILE 68 Cb 0.00 -1.64 -0.10 0.00 0.01 0.00 0.00 42.46 40.73 2hsp s ILE 68 CO 0.00 0.14 1.46 -1.00 0.00 0.00 0.00 174.94 175.54 2hsp s HIS 69 N -0.94 3.06 -0.17 3.97 3.76 -1.26 -4.87 115.29 118.84 2hsp s HIS 69 Ca 0.09 0.93 0.01 0.00 -0.15 0.00 0.00 55.06 55.94 2hsp s HIS 69 Cb -0.10 -3.83 0.21 0.00 1.11 0.00 0.00 32.58 29.97 2hsp s HIS 69 CO 0.03 -2.79 1.46 2.89 -0.85 0.00 0.00 174.74 175.48 2hsp n ARG 70 N 2.86 1.45 -0.51 1.40 1.85 -1.26 -5.38 116.66 117.07 2hsp n ARG 70 Ca 0.09 -1.02 0.00 0.00 -1.00 0.00 0.00 57.85 55.92 2hsp n ARG 70 Cb 0.40 -1.40 0.00 0.00 -1.05 0.00 0.00 32.46 30.41 2hsp n ARG 70 CO 0.00 0.00 0.00 -0.25 -0.01 0.00 0.00 177.63 177.37