#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 5.98 -0.44 1.61 0.01 -1.26 -5.01 113.70 114.59 2hsp s SER 2 Ca 0.00 0.21 -0.27 0.00 1.31 0.00 0.00 55.95 57.20 2hsp s SER 2 Cb 0.00 -1.78 -0.07 0.00 0.21 0.00 0.00 66.02 64.38 2hsp s SER 2 CO 0.00 0.24 2.38 -0.81 0.41 0.00 0.00 173.24 175.45 2hsp n PRO 3 N 0.86 1.23 -3.20 12.44 -0.04 -1.26 -4.86 135.00 140.17 2hsp n PRO 3 Ca -0.10 0.13 0.01 0.00 -0.04 0.00 0.00 63.50 63.50 2hsp n PRO 3 Cb 0.52 -3.31 -0.02 0.00 -0.04 0.00 0.00 33.50 30.64 2hsp n PRO 3 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 2hsp s THR 4 N 11.08 -0.90 0.00 0.52 -4.23 -1.26 -5.15 115.64 115.69 2hsp s THR 4 Ca 1.00 -0.03 0.00 0.00 -1.18 0.00 0.00 61.69 61.48 2hsp s THR 4 Cb -0.27 -0.96 0.00 0.00 1.34 0.00 0.00 72.50 72.61 2hsp s THR 4 CO 0.30 -0.04 0.00 0.33 -0.54 0.00 0.00 174.62 174.67 2hsp n PHE 5 N 5.41 0.00 -1.17 3.99 7.35 -1.26 -5.15 117.46 126.63 2hsp n PHE 5 Ca -0.00 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.69 2hsp n PHE 5 Cb 0.51 0.00 0.00 0.00 0.35 0.00 0.00 39.48 40.34 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 0.00 -3.25 -3.64 -4.13 5.02 -1.26 -5.07 118.16 105.84 2hsp n LYS 6 Ca 0.00 2.46 -0.13 0.00 -2.02 0.00 0.00 58.31 58.62 2hsp n LYS 6 Cb 0.00 -2.88 -0.07 0.00 -0.02 0.00 0.00 35.03 32.06 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 0.61 3.94 0.00 0.00 0.00 -1.26 -3.57 121.76 121.48 2hsp s ALA 8 Ca -0.02 -1.11 0.00 0.00 0.00 0.00 0.00 51.96 50.83 2hsp s ALA 8 Cb -0.05 -1.77 0.00 0.00 0.00 0.00 0.00 23.12 21.30 2hsp s ALA 8 CO -0.03 0.40 0.00 0.28 0.00 0.00 0.00 175.76 176.41 2hsp n VAL 9 N -0.94 0.00 -3.00 0.00 0.31 -0.76 -4.58 118.33 109.36 2hsp n VAL 9 Ca -0.08 0.00 -0.06 0.00 -0.01 0.00 0.00 64.34 64.19 2hsp n VAL 9 Cb 0.55 -0.21 -0.02 0.00 -0.91 0.00 0.00 33.84 33.26 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 -0.79 0.95 -0.49 5.55 2.47 -1.25 -4.23 119.74 121.96 2hsp s LYS 10 Ca 0.00 -0.96 -0.46 0.00 -1.56 0.00 0.00 55.97 52.99 2hsp s LYS 10 Cb 0.00 -0.23 -0.20 0.00 -1.46 0.00 0.00 37.83 35.95 2hsp s LYS 10 CO 0.00 -1.29 1.68 0.00 0.16 0.00 0.00 175.35 175.90 2hsp n ALA 11 N 3.44 -1.11 0.02 3.13 0.00 -0.59 -4.61 120.51 120.80 2hsp n ALA 11 Ca 0.17 0.45 -0.06 0.00 0.00 0.00 0.00 53.44 54.00 2hsp n ALA 11 Cb 0.54 -1.95 -0.11 0.00 0.00 0.00 0.00 19.45 17.93 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 5.62 0.00-10.27 0.00 3.38 -1.86 0.68 115.31 112.86 2hsp h LEU 12 Ca -0.40 0.00 -0.48 0.00 0.09 0.00 0.00 57.88 57.09 2hsp h LEU 12 Cb 1.37 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.11 2hsp h LEU 12 CO 0.99 0.89 -0.33 -0.36 0.09 0.00 0.00 178.44 179.72 2hsp s PHE 13 N -2.71 2.61 -0.17 1.13 0.40 -1.18 -4.74 117.98 113.31 2hsp s PHE 13 Ca -0.02 -0.50 -0.03 0.00 -0.60 0.00 0.00 56.93 55.77 2hsp s PHE 13 Cb 0.09 -2.21 -0.02 0.00 0.51 0.00 0.00 43.02 41.39 2hsp s PHE 13 CO 0.81 -0.26 -0.04 0.16 0.70 0.00 0.00 175.22 176.59 2hsp s ASP 14 N -4.21 4.61 0.44 1.36 1.47 -1.26 -3.22 116.67 115.86 2hsp s ASP 14 Ca 0.50 -0.22 0.08 0.00 1.18 0.00 0.00 52.55 54.09 2hsp s ASP 14 Cb -0.05 -1.76 0.02 0.00 -0.34 0.00 0.00 42.92 40.79 2hsp s ASP 14 CO 0.29 0.12 0.56 -0.47 0.68 0.00 0.00 175.17 176.35 2hsp s TYR 15 N 0.68 2.57 -0.45 2.11 6.14 0.83 -4.96 117.35 124.28 2hsp s TYR 15 Ca -0.02 -0.47 0.06 0.00 0.64 0.00 0.00 57.07 57.27 2hsp s TYR 15 Cb -0.15 -2.30 0.19 0.00 0.42 0.00 0.00 41.96 40.12 2hsp s TYR 15 CO 0.02 -0.46 0.52 1.63 0.64 0.00 0.00 175.55 177.90 2hsp n LYS 16 N -1.84 0.41 0.05 4.97 5.02 -1.25 -4.17 118.16 121.34 2hsp n LYS 16 Ca 0.08 -2.73 0.00 0.00 -2.02 0.00 0.00 58.31 53.64 2hsp n LYS 16 Cb 0.60 -1.53 0.00 0.00 -0.02 0.00 0.00 35.03 34.08 2hsp n LYS 16 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2hsp n ALA 17 N 2.57 3.00 0.00 7.82 0.00 -1.22 -4.80 120.51 127.89 2hsp n ALA 17 Ca 0.24 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.68 2hsp n ALA 17 Cb 0.52 0.20 0.00 0.00 0.00 0.00 0.00 19.45 20.17 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 -3.14 0.00 -2.68 0.00 7.27 -1.25 -4.31 117.38 113.27 2hsp n GLN 18 Ca 0.00 0.00 -0.05 0.00 0.07 0.00 0.00 57.00 57.02 2hsp n GLN 18 Cb 0.13 0.00 0.08 0.00 2.41 0.00 0.00 30.24 32.86 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 0.23 -0.02 3.69 1.85 -1.12 -3.63 116.66 117.66 2hsp n ARG 19 Ca 0.00 -0.85 0.02 0.00 -1.00 0.00 0.00 57.85 56.02 2hsp n ARG 19 Cb 0.00 -0.37 0.03 0.00 -1.05 0.00 0.00 32.46 31.07 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 1.27 1.06 0.00 2.89 -0.00 -1.26 -4.81 120.64 119.79 2hsp n GLU 20 Ca 0.01 -1.13 0.00 0.00 -0.00 0.00 0.00 57.16 56.04 2hsp n GLU 20 Cb 0.71 -1.07 0.00 0.00 -0.00 0.00 0.00 31.44 31.08 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 -0.01 0.00 -4.45 -1.84 8.00 -1.26 -5.04 116.55 111.95 2hsp n ASP 21 Ca 0.02 0.00 -0.22 0.00 0.71 0.00 0.00 54.79 55.31 2hsp n ASP 21 Cb 0.18 0.00 -0.11 0.00 -0.02 0.00 0.00 41.12 41.17 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 -0.05 1.63 0.30 -1.24 2.12 -1.26 0.23 118.70 120.43 2hsp s GLU 22 Ca 0.00 -1.88 0.04 0.00 0.36 0.00 0.00 54.97 53.49 2hsp s GLU 22 Cb 0.00 -1.01 -0.06 0.00 0.26 0.00 0.00 34.13 33.32 2hsp s GLU 22 CO 0.00 -0.10 0.03 -0.51 -0.54 0.00 0.00 175.26 174.14 2hsp s LEU 23 N -3.49 2.21 -0.22 2.70 1.02 -1.24 -2.78 118.68 116.87 2hsp s LEU 23 Ca 0.34 -1.32 0.05 0.00 0.02 0.00 0.00 54.13 53.21 2hsp s LEU 23 Cb 0.07 -0.39 0.45 0.00 0.02 0.00 0.00 46.19 46.35 2hsp s LEU 23 CO 0.14 -0.56 1.45 1.07 0.02 0.00 0.00 176.35 178.47 2hsp n THR 24 N -0.62 2.10 -1.30 5.49 5.66 -1.26 -3.43 114.28 120.92 2hsp n THR 24 Ca -0.03 -1.05 -0.38 0.00 -3.05 0.00 0.00 64.05 59.54 2hsp n THR 24 Cb 0.66 -0.55 0.03 0.00 -1.55 0.00 0.00 70.33 68.91 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 -0.15 -2.15 -3.45 1.09 1.16 -1.26 -4.31 117.46 108.39 2hsp n PHE 25 Ca 0.29 0.40 -0.23 0.00 -1.87 0.00 0.00 57.45 56.04 2hsp n PHE 25 Cb 1.07 -1.78 0.04 0.00 -1.61 0.00 0.00 39.48 37.20 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 -1.90 1.80 -0.85 1.97 -4.36 -1.26 -0.12 121.20 116.48 2hsp s ILE 26 Ca 0.60 -1.23 -0.25 0.00 -0.26 0.00 0.00 60.65 59.51 2hsp s ILE 26 Cb -0.44 -2.03 -0.02 0.00 1.25 0.00 0.00 42.46 41.22 2hsp s ILE 26 CO 0.63 0.00 1.79 -0.75 0.24 0.00 0.00 174.94 176.85 2hsp s LYS 27 N -4.52 2.81 0.00 0.37 2.20 -1.20 -2.02 119.74 117.38 2hsp s LYS 27 Ca 0.48 -0.24 0.00 0.00 -0.36 0.00 0.00 55.97 55.85 2hsp s LYS 27 Cb -0.04 -4.90 0.00 0.00 -1.51 0.00 0.00 37.83 31.38 2hsp s LYS 27 CO 0.31 -2.93 0.00 0.45 -0.36 0.00 0.00 175.35 172.81 2hsp n SER 28 N 12.45 0.00 -4.44 1.43 2.88 0.23 -4.95 113.62 121.21 2hsp n SER 28 Ca 0.32 0.00 -0.45 0.00 -1.33 0.00 0.00 58.87 57.41 2hsp n SER 28 Cb 0.49 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.93 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 -1.96 -2.98 -1.46 0.00 -0.86 -4.51 120.51 108.75 2hsp n ALA 29 Ca 0.00 0.33 -0.28 0.00 0.00 0.00 0.00 53.44 53.49 2hsp n ALA 29 Cb 0.00 -1.73 -0.04 0.00 0.00 0.00 0.00 19.45 17.68 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 -0.25 3.28 -1.44 0.00 -0.00 -1.26 -1.54 119.36 118.15 2hsp n ILE 30 Ca 0.14 -5.58 -0.39 0.00 -0.00 0.00 0.00 62.75 56.91 2hsp n ILE 30 Cb 0.32 -1.51 0.03 0.00 -0.00 0.00 0.00 39.64 38.48 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 -0.08 1.83 -4.63 1.39 5.41 -1.26 -4.53 119.36 117.49 2hsp n ILE 31 Ca 0.32 -0.50 -0.29 0.00 1.00 0.00 0.00 62.75 63.29 2hsp n ILE 31 Cb 0.38 -0.56 -0.10 0.00 -0.71 0.00 0.00 39.64 38.65 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 -1.81 1.98 -0.25 0.38 -0.21 -1.20 -1.83 119.66 116.72 2hsp s GLN 32 Ca 0.66 -2.16 -0.10 0.00 0.02 0.00 0.00 55.36 53.78 2hsp s GLN 32 Cb -0.49 -1.55 0.01 0.00 1.00 0.00 0.00 33.01 31.99 2hsp s GLN 32 CO 0.57 -0.13 0.23 -1.71 -2.12 0.00 0.00 175.29 172.12 2hsp n ASN 33 N -1.01 -7.08 -4.45 5.90 5.15 -1.23 -2.97 115.26 109.56 2hsp n ASN 33 Ca -0.08 0.65 -0.24 0.00 -0.60 0.00 0.00 54.58 54.32 2hsp n ASN 33 Cb 0.67 -3.43 -0.10 0.00 -0.53 0.00 0.00 39.78 36.39 2hsp n ASN 33 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 2hsp s VAL 34 N -1.56 2.39 -0.32 3.44 0.11 -1.24 -3.07 120.40 120.15 2hsp s VAL 34 Ca 0.11 -2.36 -0.09 0.00 -2.93 0.00 0.00 61.98 56.71 2hsp s VAL 34 Cb -0.02 -2.26 0.19 0.00 -1.53 0.00 0.00 36.38 32.76 2hsp s VAL 34 CO 0.54 -0.40 1.03 -0.70 -3.33 0.00 0.00 175.10 172.24 2hsp s GLU 35 N -3.46 0.19 0.79 1.54 2.12 -1.26 -4.80 118.70 113.83 2hsp s GLU 35 Ca 0.28 -0.01 -0.14 0.00 0.36 0.00 0.00 54.97 55.46 2hsp s GLU 35 Cb -0.05 0.04 -0.13 0.00 0.26 0.00 0.00 34.13 34.25 2hsp s GLU 35 CO 0.14 -0.30 -0.62 0.36 -0.54 0.00 0.00 175.26 174.30 2hsp n LYS 36 N 4.11 0.00 -3.80 4.30 0.00 -1.26 -4.09 118.16 117.42 2hsp n LYS 36 Ca 0.07 0.00 -0.08 0.00 -0.00 0.00 0.00 58.31 58.29 2hsp n LYS 36 Cb 0.62 -0.84 -0.03 0.00 -0.00 0.00 0.00 35.03 34.78 2hsp n LYS 36 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.40 176.26 2hsp s GLN 37 N -1.59 1.62 0.00 -1.58 2.00 1.08 -4.83 119.66 116.36 2hsp s GLN 37 Ca 0.35 -0.93 0.00 0.00 -2.00 0.00 0.00 55.36 52.77 2hsp s GLN 37 Cb -0.18 0.57 0.00 0.00 0.80 0.00 0.00 33.01 34.20 2hsp s GLN 37 CO 0.68 -0.72 0.00 0.39 -0.50 0.00 0.00 175.29 175.14 2hsp n GLU 38 N -0.42 -1.64 -0.42 1.67 -0.58 -1.26 0.22 120.64 118.20 2hsp n GLU 38 Ca -0.06 0.28 0.00 0.00 -0.42 0.00 0.00 57.16 56.95 2hsp n GLU 38 Cb 0.61 -4.03 0.00 0.00 -0.57 0.00 0.00 31.44 27.45 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 0.37 0.74 0.00 0.62 0.00 -1.26 -4.82 105.19 100.84 2hsp n GLY 39 Ca 0.00 -0.40 0.00 0.00 0.00 0.00 0.00 46.02 45.62 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 -2.42 0.00 2.83 -0.02 0.00 0.13 -5.06 105.19 100.65 2hsp n GLY 40 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.88 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 0.00 0.06 0.05 1.61 0.52 0.96 -2.25 118.94 119.89 2hsp s TRP 41 Ca 0.00 0.04 0.03 0.00 0.02 0.00 0.00 56.10 56.20 2hsp s TRP 41 Cb 0.00 -0.14 -0.04 0.00 -1.15 0.00 0.00 33.47 32.14 2hsp s TRP 41 CO 0.00 -0.05 0.00 -1.58 0.02 0.00 0.00 176.95 175.35 2hsp s TRP 42 N 0.49 3.03 0.50 -1.98 0.52 0.18 0.35 118.94 122.03 2hsp s TRP 42 Ca -0.04 0.02 0.04 0.00 0.02 0.00 0.00 56.10 56.14 2hsp s TRP 42 Cb -0.06 -1.60 -0.01 0.00 -1.15 0.00 0.00 33.47 30.65 2hsp s TRP 42 CO -0.01 0.47 0.16 1.03 0.02 0.00 0.00 176.95 178.61 2hsp s ARG 43 N -1.96 2.20 0.00 4.98 0.52 -1.26 0.59 118.95 124.02 2hsp s ARG 43 Ca 0.23 -2.17 0.00 0.00 -0.52 0.00 0.00 55.73 53.27 2hsp s ARG 43 Cb -0.12 -1.79 0.00 0.00 0.52 0.00 0.00 34.95 33.57 2hsp s ARG 43 CO 0.15 -0.38 0.00 0.41 0.02 0.00 0.00 175.30 175.50 2hsp n GLY 44 N -1.39 4.42 3.77 -3.53 0.00 -1.18 -4.07 105.19 103.21 2hsp n GLY 44 Ca -0.10 -1.37 -0.39 0.00 0.00 0.00 0.00 46.02 44.16 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 6.81 0.23 1.61 2.15 0.31 -3.10 116.67 124.68 2hsp s ASP 45 Ca 0.00 2.41 0.00 0.00 0.43 0.00 0.00 52.55 55.39 2hsp s ASP 45 Cb 0.00 -2.63 0.00 0.00 -0.30 0.00 0.00 42.92 39.99 2hsp s ASP 45 CO 0.00 -0.48 0.00 0.00 -0.17 0.00 0.00 175.17 174.52 2hsp n TYR 46 N 0.59 -3.17 0.12 -5.34 9.36 -1.22 -3.25 117.16 114.25 2hsp n TYR 46 Ca 0.02 0.73 0.00 0.00 3.32 0.00 0.00 57.90 61.96 2hsp n TYR 46 Cb 0.45 1.98 0.00 0.00 -0.63 0.00 0.00 39.34 41.14 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 -0.83 -0.30 0.00 2.98 0.00 -1.26 -4.99 105.19 100.79 2hsp n GLY 47 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 1.51 -3.30 0.00 -0.02 0.00 -1.24 -4.94 105.19 97.21 2hsp n GLY 48 Ca 0.00 0.43 0.00 0.00 0.00 0.00 0.00 46.02 46.45 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 -0.76 1.20 0.11 1.61 5.02 -1.26 -5.04 118.16 119.04 2hsp n LYS 49 Ca 0.00 0.00 0.12 0.00 -2.02 0.00 0.00 58.31 56.41 2hsp n LYS 49 Cb 0.00 0.00 0.15 0.00 -0.02 0.00 0.00 35.03 35.16 2hsp n LYS 49 CO 0.00 0.00 0.00 -0.22 -0.52 0.00 0.00 177.40 176.66 2hsp h LYS 50 N 0.00 0.00 -0.82 1.97 3.64 -1.92 -3.24 116.57 116.21 2hsp h LYS 50 Ca 0.00 0.00 -0.10 0.00 -1.27 0.00 0.00 60.65 59.28 2hsp h LYS 50 Cb 0.00 0.00 -0.16 0.00 -0.41 0.00 0.00 32.23 31.66 2hsp h LYS 50 CO 0.00 0.00 -0.40 1.14 -2.27 0.00 0.00 179.45 177.92 2hsp s GLN 51 N -3.23 0.85 0.00 1.90 -2.07 -1.24 0.11 119.66 115.98 2hsp s GLN 51 Ca 0.05 -0.76 0.00 0.00 -1.82 0.00 0.00 55.36 52.83 2hsp s GLN 51 Cb 0.11 -0.02 0.00 0.00 -1.09 0.00 0.00 33.01 32.01 2hsp s GLN 51 CO 0.72 -1.07 0.00 1.28 -1.32 0.00 0.00 175.29 174.90 2hsp n LEU 52 N 3.10 0.00 -3.89 2.60 4.77 -1.18 -4.50 117.00 117.90 2hsp n LEU 52 Ca 0.15 0.00 -0.11 0.00 -0.03 0.00 0.00 56.01 56.02 2hsp n LEU 52 Cb 0.58 0.00 -0.13 0.00 -2.33 0.00 0.00 43.42 41.54 2hsp n LEU 52 CO -0.04 0.00 -0.33 0.26 -1.33 0.00 0.00 177.39 175.95 2hsp s TRP 53 N 1.34 0.04 -0.03 -1.77 0.52 0.61 -4.28 118.94 115.37 2hsp s TRP 53 Ca 0.00 -0.07 -0.01 0.00 0.02 0.00 0.00 56.10 56.03 2hsp s TRP 53 Cb 0.00 -0.04 0.03 0.00 -1.15 0.00 0.00 33.47 32.31 2hsp s TRP 53 CO 0.00 -0.07 0.04 -0.06 0.02 0.00 0.00 176.95 176.89 2hsp s PHE 54 N -0.38 0.11 0.56 -1.98 0.08 0.20 -3.66 117.98 112.91 2hsp s PHE 54 Ca -0.04 0.17 -0.20 0.00 0.12 0.00 0.00 56.93 56.98 2hsp s PHE 54 Cb -0.03 -0.42 -0.06 0.00 -0.57 0.00 0.00 43.02 41.94 2hsp s PHE 54 CO -0.00 -0.16 1.01 -2.30 -0.10 0.00 0.00 175.22 173.67 2hsp n PRO 55 N 4.85 1.08 -0.11 0.24 -0.02 -1.26 0.49 135.00 140.26 2hsp n PRO 55 Ca -0.13 0.41 0.07 0.00 -2.02 0.00 0.00 63.50 61.83 2hsp n PRO 55 Cb 0.50 -2.18 0.26 0.00 -0.02 0.00 0.00 33.50 32.06 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 -0.51 1.53 -0.21 2.55 3.41 -0.96 -0.82 113.62 118.62 2hsp n SER 56 Ca 0.12 -1.84 0.07 0.00 -0.26 0.00 0.00 58.87 56.97 2hsp n SER 56 Cb 0.45 -0.15 -0.04 0.00 -0.26 0.00 0.00 64.21 64.22 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 0.28 1.22 0.00 4.04 5.03 -1.26 -4.55 115.26 120.01 2hsp n ASN 57 Ca 0.13 -1.11 0.00 0.00 0.87 0.00 0.00 54.58 54.47 2hsp n ASN 57 Cb 0.27 0.69 0.00 0.00 -1.02 0.00 0.00 39.78 39.72 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 -0.64 0.00 -3.25 3.10 4.02 -0.61 -4.99 117.16 114.78 2hsp n TYR 58 Ca 0.05 0.00 -0.17 0.00 -0.01 0.00 0.00 57.90 57.77 2hsp n TYR 58 Cb 0.29 0.00 0.04 0.00 -0.02 0.00 0.00 39.34 39.65 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 -2.47 0.00 -3.49 -0.72 0.24 0.00 -3.12 118.33 108.77 2hsp n VAL 59 Ca 0.00 -1.58 0.03 0.00 -2.04 0.00 0.00 64.34 60.75 2hsp n VAL 59 Cb 0.50 -0.48 -0.05 0.00 -1.47 0.00 0.00 33.84 32.34 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 -3.98 0.02 -0.96 7.34 2.12 -1.26 -4.77 118.70 117.21 2hsp s GLU 60 Ca 0.41 0.03 -0.24 0.00 0.36 0.00 0.00 54.97 55.54 2hsp s GLU 60 Cb -0.03 0.01 -0.21 0.00 0.26 0.00 0.00 34.13 34.16 2hsp s GLU 60 CO 0.26 -0.00 1.98 0.39 -0.54 0.00 0.00 175.26 177.35 2hsp n GLU 61 N 3.51 0.08 -2.38 4.30 1.02 -1.26 -3.95 120.64 121.96 2hsp n GLU 61 Ca -0.14 -1.50 -0.04 0.00 -0.02 0.00 0.00 57.16 55.47 2hsp n GLU 61 Cb 0.56 -3.60 -0.01 0.00 -0.02 0.00 0.00 31.44 28.37 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 7.70 -0.98 -2.41 3.49 2.81 -1.26 -2.65 117.12 123.81 2hsp n MET 62 Ca 0.36 0.01 -0.01 0.00 -1.81 0.00 0.00 57.70 56.26 2hsp n MET 62 Cb 0.47 -0.43 -0.01 0.00 -0.71 0.00 0.00 33.22 32.55 2hsp n MET 62 CO 0.00 0.00 0.00 1.33 1.51 0.00 0.00 175.97 178.81 2hsp n VAL 63 N -1.20 -4.20 -3.49 2.03 0.24 -1.26 -4.98 118.33 105.48 2hsp n VAL 63 Ca -0.02 0.91 -0.28 0.00 -2.04 0.00 0.00 64.34 62.91 2hsp n VAL 63 Cb 0.06 -3.17 -0.11 0.00 -1.47 0.00 0.00 33.84 29.16 2hsp n VAL 63 CO 0.00 0.00 0.00 0.21 -2.14 0.00 0.00 176.83 174.90 2hsp s ASN 64 N -0.18 2.24 -0.22 -1.34 3.84 -1.09 -5.02 114.94 113.16 2hsp s ASN 64 Ca -0.03 -2.97 -0.02 0.00 0.21 0.00 0.00 52.86 50.05 2hsp s ASN 64 Cb 0.00 -0.61 -0.05 0.00 -0.55 0.00 0.00 41.25 40.05 2hsp s ASN 64 CO 0.09 -0.19 1.42 -2.65 -2.79 0.00 0.00 177.10 172.97 2hsp n PRO 65 N 3.01 0.75 -4.54 0.43 -0.02 -1.26 -4.80 135.00 128.57 2hsp n PRO 65 Ca 0.24 -0.62 -0.26 0.00 -2.02 0.00 0.00 63.50 60.85 2hsp n PRO 65 Cb 0.44 -1.93 -0.11 0.00 -0.02 0.00 0.00 33.50 31.88 2hsp n PRO 65 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 2hsp s GLU 66 N 3.41 1.81 0.00 -0.52 2.02 -1.26 -5.13 118.70 119.03 2hsp s GLU 66 Ca 0.18 -1.96 0.00 0.00 0.02 0.00 0.00 54.97 53.21 2hsp s GLU 66 Cb 0.06 -1.60 0.00 0.00 0.10 0.00 0.00 34.13 32.69 2hsp s GLU 66 CO -0.01 0.08 0.00 0.41 0.02 0.00 0.00 175.26 175.76 2hsp n GLY 67 N -0.80 0.65 2.70 -1.39 0.00 -1.26 -5.11 105.19 99.98 2hsp n GLY 67 Ca -0.05 0.61 -0.30 0.00 0.00 0.00 0.00 46.02 46.28 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 1.11 0.30 -0.61 -1.09 -1.26 -5.06 121.20 114.59 2hsp s ILE 68 Ca 0.00 -2.07 0.00 0.00 -2.23 0.00 0.00 60.65 56.35 2hsp s ILE 68 Cb 0.00 -1.80 0.00 0.00 -1.58 0.00 0.00 42.46 39.08 2hsp s ILE 68 CO 0.00 -0.82 0.00 1.57 -1.23 0.00 0.00 174.94 174.46 2hsp n HIS 69 N 4.05 -2.17 -2.86 3.97 -0.00 -1.26 -4.96 115.22 112.00 2hsp n HIS 69 Ca 0.05 1.17 -0.03 0.00 0.46 0.00 0.00 57.72 59.38 2hsp n HIS 69 Cb 0.37 -2.08 -0.02 0.00 -0.12 0.00 0.00 29.99 28.14 2hsp n HIS 69 CO 0.00 0.00 0.00 -2.13 0.46 0.00 0.00 176.34 174.67 2hsp n ARG 70 N -1.99 -2.77 0.00 1.57 0.63 -1.26 -5.27 116.66 107.57 2hsp n ARG 70 Ca 0.00 2.23 0.16 0.00 -0.92 0.00 0.00 57.85 59.31 2hsp n ARG 70 Cb 0.23 -2.70 0.91 0.00 0.45 0.00 0.00 32.46 31.35 2hsp n ARG 70 CO 0.00 0.00 0.00 -0.40 -2.51 0.00 0.00 177.63 174.72