#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hva s LEU 2 N 0.00 3.16 0.00 4.03 2.34 -1.26 -5.10 118.68 121.85 2hva s LEU 2 Ca 0.00 -0.69 0.00 0.00 0.06 0.00 0.00 54.13 53.50 2hva s LEU 2 Cb 0.00 -1.71 0.00 0.00 -0.56 0.00 0.00 46.19 43.92 2hva s LEU 2 CO 0.00 -0.10 0.00 0.61 -1.06 0.00 0.00 176.35 175.80 2hva n GLY 3 N 4.74 -1.76 2.92 -3.48 0.00 -1.26 -5.02 105.19 101.32 2hva n GLY 3 Ca -0.17 -0.66 -0.26 0.00 0.00 0.00 0.00 46.02 44.94 2hva n GLY 3 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2hva s MET 4 N 0.00 1.46 -0.18 1.61 -1.94 -1.26 -5.03 119.30 113.96 2hva s MET 4 Ca 0.00 -0.25 -0.16 0.00 -1.71 0.00 0.00 55.69 53.56 2hva s MET 4 Cb 0.00 -1.47 -0.06 0.00 2.01 0.00 0.00 34.83 35.30 2hva s MET 4 CO 0.00 -0.20 -0.31 -0.89 -0.01 0.00 0.00 175.02 173.60 2hva n ILE 5 N 4.70 1.49 -2.89 2.53 -0.00 -1.26 -4.92 119.36 119.01 2hva n ILE 5 Ca -0.15 0.10 -0.41 0.00 -0.00 0.00 0.00 62.75 62.29 2hva n ILE 5 Cb 0.50 -2.31 -0.04 0.00 -0.00 0.00 0.00 39.64 37.80 2hva n ILE 5 CO 0.00 0.00 0.00 -0.13 -0.00 0.00 0.00 176.55 176.42 2hva s ARG 6 N -2.76 4.28 -0.15 0.38 1.81 -1.26 -5.04 118.95 116.22 2hva s ARG 6 Ca -0.28 1.01 -0.05 0.00 -1.72 0.00 0.00 55.73 54.69 2hva s ARG 6 Cb 0.05 -3.58 -0.04 0.00 -0.45 0.00 0.00 34.95 30.93 2hva s ARG 6 CO 0.41 -0.35 0.04 -0.80 -0.68 0.00 0.00 175.30 173.91 2hva s ASN 7 N 1.18 5.47 -0.09 0.23 0.02 -1.26 -5.09 114.94 115.40 2hva s ASN 7 Ca 0.38 0.10 -0.23 0.00 -1.02 0.00 0.00 52.86 52.09 2hva s ASN 7 Cb -0.16 -1.82 -0.03 0.00 0.02 0.00 0.00 41.25 39.25 2hva s ASN 7 CO 0.12 0.25 0.69 -0.44 0.02 0.00 0.00 177.10 177.74 2hva s SER 8 N -0.11 6.94 0.00 -1.22 0.01 -1.26 -5.07 113.70 112.99 2hva s SER 8 Ca 0.06 1.13 0.00 0.00 1.31 0.00 0.00 55.95 58.45 2hva s SER 8 Cb -0.12 -2.40 0.00 0.00 0.21 0.00 0.00 66.02 63.71 2hva s SER 8 CO 0.01 -0.14 0.00 0.18 0.41 0.00 0.00 173.24 173.70 2hva n LEU 9 N 4.00 0.00 0.00 2.44 4.77 -1.26 -5.11 117.00 121.84 2hva n LEU 9 Ca -0.01 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.97 2hva n LEU 9 Cb 0.51 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.60 2hva n LEU 9 CO 0.47 -0.41 0.00 0.49 -1.33 0.00 0.00 177.39 176.61 2hva n PHE 10 N -0.81 0.00 -2.14 -1.77 3.72 -1.26 -4.98 117.46 110.22 2hva n PHE 10 Ca 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 2hva n PHE 10 Cb 0.00 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.54 2hva n PHE 10 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2hva n GLY 11 N 2.62 2.49 3.69 1.37 0.00 -1.26 -4.42 105.19 109.68 2hva n GLY 11 Ca 0.00 -0.26 -0.39 0.00 0.00 0.00 0.00 46.02 45.38 2hva n GLY 11 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2hva s SER 12 N -4.00 6.66 -0.01 1.61 0.15 -1.26 -5.07 113.70 111.78 2hva s SER 12 Ca 0.00 0.79 0.00 0.00 0.70 0.00 0.00 55.95 57.44 2hva s SER 12 Cb 0.00 -2.30 -0.04 0.00 -1.71 0.00 0.00 66.02 61.97 2hva s SER 12 CO 0.00 -0.09 0.05 -0.69 1.20 0.00 0.00 173.24 173.70 2hva s VAL 13 N 1.10 4.51 -0.02 4.45 1.01 -1.26 -5.12 120.40 125.07 2hva s VAL 13 Ca 0.26 -0.46 -0.01 0.00 0.00 0.00 0.00 61.98 61.77 2hva s VAL 13 Cb -0.15 -3.03 0.02 0.00 0.00 0.00 0.00 36.38 33.21 2hva s VAL 13 CO 0.11 0.38 0.05 -1.61 0.00 0.00 0.00 175.10 174.02 2hva s GLU 14 N -1.61 0.02 0.04 2.72 0.41 -1.26 -5.14 118.70 113.88 2hva s GLU 14 Ca 0.21 0.13 -0.26 0.00 -0.41 0.00 0.00 54.97 54.64 2hva s GLU 14 Cb -0.12 -0.08 -0.05 0.00 -1.78 0.00 0.00 34.13 32.10 2hva s GLU 14 CO 0.12 -0.07 0.80 -0.08 -0.49 0.00 0.00 175.26 175.54 2hva s THR 15 N 0.47 4.75 -0.06 3.63 -1.32 -1.26 -5.06 115.64 116.79 2hva s THR 15 Ca -0.04 1.70 -0.15 0.00 -1.21 0.00 0.00 61.69 61.99 2hva s THR 15 Cb -0.05 -4.15 0.03 0.00 -1.51 0.00 0.00 72.50 66.82 2hva s THR 15 CO -0.02 0.33 0.36 0.26 -2.21 0.00 0.00 174.62 173.34 2hva s TRP 16 N 0.15 -0.29 0.03 9.09 0.51 -1.26 -5.07 118.94 122.10 2hva s TRP 16 Ca 0.41 0.57 -0.20 0.00 -2.12 0.00 0.00 56.10 54.76 2hva s TRP 16 Cb -0.21 0.13 -0.16 0.00 -0.81 0.00 0.00 33.47 32.43 2hva s TRP 16 CO 0.24 -0.34 1.28 -1.00 -0.51 0.00 0.00 176.95 176.61 2hva h PRO 17 N 4.35 0.41 -2.50 4.98 0.13 -1.97 -3.42 132.00 133.98 2hva h PRO 17 Ca -0.28 -0.27 0.12 0.00 -0.87 0.00 0.00 66.00 64.70 2hva h PRO 17 Cb 1.18 0.04 -0.10 0.00 0.13 0.00 0.00 31.00 32.24 2hva h PRO 17 CO 0.36 0.87 0.42 1.67 -0.23 0.00 0.00 178.00 181.08 2hva s TRP 18 N -3.98 -0.24 -0.24 1.56 -2.14 -1.26 -4.58 118.94 108.06 2hva s TRP 18 Ca -0.14 -0.04 0.01 0.00 2.66 0.00 0.00 56.10 58.59 2hva s TRP 18 Cb 0.05 0.62 0.06 0.00 -3.10 0.00 0.00 33.47 31.10 2hva s TRP 18 CO 0.78 -0.83 -0.05 -1.14 -2.66 0.00 0.00 176.95 173.05 2hva s GLN 19 N -3.39 1.63 -0.27 3.25 0.74 0.20 -4.87 119.66 116.93 2hva s GLN 19 Ca 0.09 -1.02 -0.29 0.00 0.05 0.00 0.00 55.36 54.19 2hva s GLN 19 Cb -0.02 -2.60 -0.01 0.00 1.10 0.00 0.00 33.01 31.48 2hva s GLN 19 CO -0.01 -0.61 1.39 0.08 -0.55 0.00 0.00 175.29 175.59 2hva s VAL 20 N 1.38 4.02 -0.43 1.34 1.01 -1.26 -0.52 120.40 125.94 2hva s VAL 20 Ca -0.05 1.15 0.22 0.00 0.00 0.00 0.00 61.98 63.30 2hva s VAL 20 Cb -0.19 -4.02 -0.21 0.00 0.00 0.00 0.00 36.38 31.96 2hva s VAL 20 CO -0.06 -0.41 0.79 0.18 0.00 0.00 0.00 175.10 175.60 2hva n LEU 21 N 7.83 0.47 -3.66 3.92 4.77 -0.03 -4.99 117.00 125.31 2hva n LEU 21 Ca 0.16 -0.08 -0.03 0.00 -0.03 0.00 0.00 56.01 56.03 2hva n LEU 21 Cb 0.46 -0.04 -0.01 0.00 -2.33 0.00 0.00 43.42 41.50 2hva n LEU 21 CO 0.63 0.05 0.82 -0.55 -1.33 0.00 0.00 177.39 177.01 2hva s SER 22 N -4.10 -0.18 0.22 -1.43 0.15 -1.23 -4.97 113.70 102.16 2hva s SER 22 Ca -0.00 -0.22 -0.03 0.00 0.70 0.00 0.00 55.95 56.39 2hva s SER 22 Cb 0.14 0.36 0.01 0.00 -1.71 0.00 0.00 66.02 64.82 2hva s SER 22 CO 0.86 -0.64 0.34 0.35 1.20 0.00 0.00 173.24 175.35 2hva n THR 23 N -0.40 0.00 -3.14 6.45 -2.24 -1.26 -2.22 114.28 111.47 2hva n THR 23 Ca -0.07 -0.94 0.02 0.00 -2.27 0.00 0.00 64.05 60.80 2hva n THR 23 Cb 0.61 0.64 -0.01 0.00 -2.10 0.00 0.00 70.33 69.48 2hva n THR 23 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2hva n GLY 24 N -0.34 -1.82 0.00 3.38 0.00 -1.22 -4.94 105.19 100.25 2hva n GLY 24 Ca -0.01 -1.31 0.00 0.00 0.00 0.00 0.00 46.02 44.70 2hva n GLY 24 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2hva n GLY 25 N -0.70 -1.74 3.69 -0.02 0.00 -1.26 -2.65 105.19 102.51 2hva n GLY 25 Ca 0.00 0.69 -0.08 0.00 0.00 0.00 0.00 46.02 46.63 2hva n GLY 25 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2hva s LYS 26 N 0.00 1.50 0.35 1.61 1.02 0.42 -4.94 119.74 119.70 2hva s LYS 26 Ca 0.00 -0.75 0.09 0.00 0.02 0.00 0.00 55.97 55.33 2hva s LYS 26 Cb 0.00 0.56 0.66 0.00 -0.52 0.00 0.00 37.83 38.53 2hva s LYS 26 CO 0.00 -0.68 1.82 0.93 -0.92 0.00 0.00 175.35 176.50 2hva h GLU 27 N 2.00 0.18 0.02 1.68 5.08 -2.03 -3.06 114.58 118.45 2hva h GLU 27 Ca -0.24 -0.06 -0.30 0.00 -1.00 0.00 0.00 59.36 57.76 2hva h GLU 27 Cb 1.26 -0.01 -0.04 0.00 0.50 0.00 0.00 28.75 30.46 2hva h GLU 27 CO 0.28 0.45 -1.71 -0.44 -1.00 0.00 0.00 179.01 176.60 2hva h ASP 28 N 0.16 0.06 -4.08 1.42 5.19 -2.05 -3.47 116.42 113.65 2hva h ASP 28 Ca 0.02 -0.13 -0.16 0.00 -0.62 0.00 0.00 57.03 56.14 2hva h ASP 28 Cb 0.59 -0.02 -0.25 0.00 0.18 0.00 0.00 39.33 39.84 2hva h ASP 28 CO 0.04 1.11 -0.46 -0.69 -3.12 0.00 0.00 179.24 176.13 2hva s VAL 29 N -2.60 0.02 0.04 -1.35 1.01 -1.16 -5.16 120.40 111.20 2hva s VAL 29 Ca -0.07 -0.15 0.03 0.00 0.00 0.00 0.00 61.98 61.80 2hva s VAL 29 Cb 0.08 -0.35 -0.02 0.00 0.00 0.00 0.00 36.38 36.09 2hva s VAL 29 CO 0.82 -0.08 -0.09 -0.44 0.00 0.00 0.00 175.10 175.31 2hva s SER 30 N -0.23 1.02 0.09 3.32 0.01 -1.26 0.16 113.70 116.82 2hva s SER 30 Ca -0.03 -0.51 -0.01 0.00 1.31 0.00 0.00 55.95 56.71 2hva s SER 30 Cb -0.03 0.00 -0.04 0.00 0.21 0.00 0.00 66.02 66.17 2hva s SER 30 CO 0.01 -0.14 -0.00 -0.72 0.41 0.00 0.00 173.24 172.79 2hva s TYR 31 N -1.21 0.73 -0.09 2.43 1.13 -1.08 -4.51 117.35 114.74 2hva s TYR 31 Ca -0.07 -1.11 -0.04 0.00 -1.41 0.00 0.00 57.07 54.45 2hva s TYR 31 Cb -0.09 -0.46 0.05 0.00 -1.10 0.00 0.00 41.96 40.36 2hva s TYR 31 CO 0.01 -0.39 0.19 -1.21 -2.51 0.00 0.00 175.55 171.64 2hva s GLU 32 N -3.96 0.08 -0.28 -3.49 2.02 -1.24 -3.42 118.70 108.42 2hva s GLU 32 Ca 0.15 0.58 -0.24 0.00 0.02 0.00 0.00 54.97 55.48 2hva s GLU 32 Cb 0.07 -0.19 -0.00 0.00 0.10 0.00 0.00 34.13 34.11 2hva s GLU 32 CO -0.04 -0.27 0.80 -2.00 0.02 0.00 0.00 175.26 173.77 2hva s GLU 33 N 2.08 4.06 -0.06 1.61 2.12 -0.94 -3.62 118.70 123.94 2hva s GLU 33 Ca -0.00 0.73 0.01 0.00 0.36 0.00 0.00 54.97 56.07 2hva s GLU 33 Cb -0.12 -3.69 0.02 0.00 0.26 0.00 0.00 34.13 30.60 2hva s GLU 33 CO -0.07 -0.61 -0.06 1.03 -0.54 0.00 0.00 175.26 175.02 2hva s ARG 34 N 2.91 1.02 -0.17 4.30 0.52 -1.25 -0.85 118.95 125.43 2hva s ARG 34 Ca 0.33 -0.15 -0.04 0.00 -0.52 0.00 0.00 55.73 55.35 2hva s ARG 34 Cb -0.15 -1.01 -0.02 0.00 0.52 0.00 0.00 34.95 34.29 2hva s ARG 34 CO 0.10 -0.10 -0.04 0.00 0.02 0.00 0.00 175.30 175.29 2hva s ALA 35 N 1.04 2.96 0.22 2.13 0.00 0.32 -4.08 121.76 124.35 2hva s ALA 35 Ca -0.09 -0.88 0.05 0.00 0.00 0.00 0.00 51.96 51.03 2hva s ALA 35 Cb -0.14 -1.58 -0.03 0.00 0.00 0.00 0.00 23.12 21.37 2hva s ALA 35 CO -0.00 0.10 0.34 0.00 0.00 0.00 0.00 175.76 176.19 2hva h GLU 37 N 1.39 -0.27 0.00 0.00 5.08 -1.82 -3.43 114.58 115.52 2hva h GLU 37 Ca -0.51 0.02 0.00 0.00 -1.00 0.00 0.00 59.36 57.87 2hva h GLU 37 Cb 1.22 0.06 0.00 0.00 0.50 0.00 0.00 28.75 30.53 2hva h GLU 37 CO 0.63 -0.17 0.00 0.41 -1.00 0.00 0.00 179.01 178.87 2hva n GLY 38 N -1.18 0.78 0.00 -3.84 0.00 -1.26 -4.43 105.19 95.25 2hva n GLY 38 Ca -0.09 -1.97 0.00 0.00 0.00 0.00 0.00 46.02 43.96 2hva n GLY 38 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2hva n GLY 39 N 0.00 0.75 3.91 -0.02 0.00 -1.26 -4.77 105.19 103.79 2hva n GLY 39 Ca 0.00 -2.10 -0.31 0.00 0.00 0.00 0.00 46.02 43.60 2hva n GLY 39 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2hva s LYS 40 N -1.06 3.50 0.05 1.61 1.02 -1.26 -4.05 119.74 119.55 2hva s LYS 40 Ca 0.00 -0.32 0.01 0.00 0.02 0.00 0.00 55.97 55.68 2hva s LYS 40 Cb 0.00 -2.98 -0.03 0.00 -0.52 0.00 0.00 37.83 34.30 2hva s LYS 40 CO 0.00 0.57 -0.05 -0.06 -0.92 0.00 0.00 175.35 174.88 2hva s PHE 41 N -1.55 0.59 -0.01 3.18 0.08 -1.21 -4.02 117.98 115.03 2hva s PHE 41 Ca 0.37 -0.70 -0.14 0.00 0.12 0.00 0.00 56.93 56.58 2hva s PHE 41 Cb -0.13 -0.37 -0.06 0.00 -0.57 0.00 0.00 43.02 41.90 2hva s PHE 41 CO 0.26 -0.18 0.38 0.00 -0.10 0.00 0.00 175.22 175.59 2hva s ALA 42 N -2.33 3.72 -0.00 5.36 0.00 -1.22 -2.75 121.76 124.53 2hva s ALA 42 Ca -0.04 -0.26 0.04 0.00 0.00 0.00 0.00 51.96 51.70 2hva s ALA 42 Cb -0.04 -2.34 -0.03 0.00 0.00 0.00 0.00 23.12 20.71 2hva s ALA 42 CO -0.03 0.50 -0.10 0.95 0.00 0.00 0.00 175.76 177.08 2hva s THR 43 N -1.08 3.38 -0.07 0.00 -4.23 -0.77 -0.91 115.64 111.96 2hva s THR 43 Ca 0.23 -0.84 0.00 0.00 -1.18 0.00 0.00 61.69 59.91 2hva s THR 43 Cb -0.16 -2.44 0.02 0.00 1.34 0.00 0.00 72.50 71.26 2hva s THR 43 CO 0.12 0.42 -0.06 -0.69 -0.54 0.00 0.00 174.62 173.88 2hva s VAL 44 N -0.93 0.76 -0.11 2.29 1.01 -0.05 -3.32 120.40 120.05 2hva s VAL 44 Ca 0.15 -0.19 -0.06 0.00 0.00 0.00 0.00 61.98 61.89 2hva s VAL 44 Cb -0.11 -0.78 -0.04 0.00 0.00 0.00 0.00 36.38 35.45 2hva s VAL 44 CO 0.06 0.30 0.11 -0.70 0.00 0.00 0.00 175.10 174.86 2hva s GLU 45 N 1.27 3.33 -0.04 2.72 2.12 -1.26 -1.55 118.70 125.29 2hva s GLU 45 Ca -0.05 -0.20 -0.01 0.00 0.36 0.00 0.00 54.97 55.08 2hva s GLU 45 Cb -0.14 -3.09 0.03 0.00 0.26 0.00 0.00 34.13 31.19 2hva s GLU 45 CO -0.02 0.76 0.03 0.08 -0.54 0.00 0.00 175.26 175.56 2hva s VAL 46 N -1.00 0.08 0.37 3.70 1.01 -1.19 -4.89 120.40 118.48 2hva s VAL 46 Ca 0.15 0.24 0.07 0.00 0.00 0.00 0.00 61.98 62.45 2hva s VAL 46 Cb -0.12 -0.26 -0.02 0.00 0.00 0.00 0.00 36.38 35.98 2hva s VAL 46 CO 0.04 0.18 0.36 0.42 0.00 0.00 0.00 175.10 176.10 2hva s THR 47 N 1.68 3.27 -1.24 3.92 -4.23 -1.26 -4.18 115.64 113.60 2hva s THR 47 Ca -0.01 -1.29 -0.06 0.00 -1.18 0.00 0.00 61.69 59.15 2hva s THR 47 Cb -0.13 -3.13 0.04 0.00 1.34 0.00 0.00 72.50 70.62 2hva s THR 47 CO -0.03 -0.10 0.36 -0.67 -0.54 0.00 0.00 174.62 173.64 2hva n ASP 48 N -1.50 -4.02 -3.69 3.99 -0.08 -1.26 -4.94 116.55 105.05 2hva n ASP 48 Ca 0.01 -0.21 -0.10 0.00 -1.51 0.00 0.00 54.79 52.98 2hva n ASP 48 Cb 0.60 -3.34 -0.11 0.00 2.34 0.00 0.00 41.12 40.62 2hva n ASP 48 CO 0.00 0.00 0.00 -0.54 0.12 0.00 0.00 177.20 176.78 2hva s LYS 49 N -5.69 0.38 0.00 -0.67 3.01 -1.26 -4.96 119.74 110.55 2hva s LYS 49 Ca 0.27 0.83 -0.01 0.00 -1.01 0.00 0.00 55.97 56.04 2hva s LYS 49 Cb -0.14 0.02 -0.01 0.00 -1.01 0.00 0.00 37.83 36.69 2hva s LYS 49 CO 0.34 -0.17 1.00 -1.35 0.51 0.00 0.00 175.35 175.67 2hva h PRO 50 N 7.28 -0.05 0.00 -1.68 0.11 -1.92 -3.34 132.00 132.40 2hva h PRO 50 Ca -0.34 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.78 2hva h PRO 50 Cb 1.17 0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.29 2hva h PRO 50 CO 0.27 -0.03 0.00 0.28 -0.21 0.00 0.00 178.00 178.30 2hva n VAL 51 N -2.15 0.00 -0.20 3.15 0.31 -1.26 -4.43 118.33 113.75 2hva n VAL 51 Ca -0.01 0.00 -0.02 0.00 -0.01 0.00 0.00 64.34 64.31 2hva n VAL 51 Cb 0.02 -0.03 0.09 0.00 -0.91 0.00 0.00 33.84 33.01 2hva n VAL 51 CO 0.00 0.00 0.00 0.44 -1.32 0.00 0.00 176.83 175.95 2hva h ASP 52 N 0.00 0.39 -0.48 4.52 3.32 -1.94 -0.81 116.42 121.43 2hva h ASP 52 Ca 0.00 0.05 -0.06 0.00 0.02 0.00 0.00 57.03 57.03 2hva h ASP 52 Cb 0.00 -0.02 -0.02 0.00 0.22 0.00 0.00 39.33 39.51 2hva h ASP 52 CO 0.00 0.25 0.05 -0.33 -1.72 0.00 0.00 179.24 177.49 2hva h GLU 53 N 0.54 0.81 -0.63 3.56 4.39 -1.93 -3.03 114.58 118.30 2hva h GLU 53 Ca 0.28 -0.23 0.02 0.00 0.34 0.00 0.00 59.36 59.77 2hva h GLU 53 Cb 0.24 -0.09 -0.04 0.00 -0.10 0.00 0.00 28.75 28.76 2hva h GLU 53 CO -0.22 0.83 0.39 0.00 -1.16 0.00 0.00 179.01 178.86 2hva h ALA 54 N 0.95 0.81 -0.68 3.43 0.00 -1.66 -2.01 119.26 120.08 2hva h ALA 54 Ca 0.14 -0.02 0.08 0.00 0.00 0.00 0.00 54.91 55.11 2hva h ALA 54 Cb 0.44 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 17.98 2hva h ALA 54 CO 0.02 0.15 0.45 -0.07 0.00 0.00 0.00 179.25 179.80 2hva h LEU 55 N 0.78 0.56 -1.44 0.00 3.38 -1.05 0.82 115.31 118.36 2hva h LEU 55 Ca 0.25 0.01 -0.03 0.00 0.09 0.00 0.00 57.88 58.20 2hva h LEU 55 Cb -0.01 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.62 2hva h LEU 55 CO -0.09 0.35 0.06 0.03 0.09 0.00 0.00 178.44 178.88 2hva h ARG 56 N 0.63 0.42 0.00 1.13 3.08 -1.26 0.50 114.38 118.88 2hva h ARG 56 Ca 0.31 -0.06 -0.25 0.00 0.07 0.00 0.00 59.98 60.04 2hva h ARG 56 Cb 0.38 -0.08 -0.04 0.00 0.08 0.00 0.00 29.97 30.31 2hva h ARG 56 CO -0.10 0.41 -1.48 1.49 -1.07 0.00 0.00 179.97 179.22 2hva h GLU 57 N 0.42 0.00 -0.10 0.04 4.57 -0.78 -3.36 114.58 115.37 2hva h GLU 57 Ca 0.10 0.00 -0.15 0.00 -1.18 0.00 0.00 59.36 58.13 2hva h GLU 57 Cb 0.19 0.00 0.01 0.00 -0.16 0.00 0.00 28.75 28.79 2hva h GLU 57 CO -0.00 0.57 -0.52 0.00 -1.18 0.00 0.00 179.01 177.88 2hva h ALA 58 N 1.07 0.20 -0.66 2.92 0.00 0.12 -3.29 119.26 119.62 2hva h ALA 58 Ca -0.20 -0.51 0.05 0.00 0.00 0.00 0.00 54.91 54.24 2hva h ALA 58 Cb 1.89 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 19.62 2hva h ALA 58 CO 0.08 0.39 0.39 0.52 0.00 0.00 0.00 179.25 180.63 2hva h MET 59 N 0.12 0.72 -0.73 0.00 2.86 -0.20 -1.27 114.93 116.43 2hva h MET 59 Ca -0.04 -0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.56 2hva h MET 59 Cb 1.16 -0.16 -0.04 0.00 0.06 0.00 0.00 31.60 32.62 2hva h MET 59 CO 0.11 0.47 0.47 -1.35 1.06 0.00 0.00 176.91 177.67 2hva h PRO 60 N 0.74 0.97 -0.18 -0.22 0.11 -1.71 0.73 132.00 132.44 2hva h PRO 60 Ca 0.28 -0.07 -0.09 0.00 0.11 0.00 0.00 66.00 66.24 2hva h PRO 60 Cb 0.11 -0.21 -0.00 0.00 0.11 0.00 0.00 31.00 31.01 2hva h PRO 60 CO -0.15 0.65 -0.23 0.87 -0.21 0.00 0.00 178.00 178.94 2hva h LYS 61 N 0.99 0.47 0.00 1.05 1.57 -1.48 -2.99 116.57 116.18 2hva h LYS 61 Ca 0.27 -0.27 -0.14 0.00 -1.87 0.00 0.00 60.65 58.64 2hva h LYS 61 Cb -0.09 0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.22 2hva h LYS 61 CO -0.06 0.85 -0.66 0.97 -0.57 0.00 0.00 179.45 179.99 2hva h ILE 62 N 0.12 1.29 -0.25 1.86 2.10 -0.95 -3.15 117.51 118.53 2hva h ILE 62 Ca 0.02 -2.40 -0.04 0.00 1.08 0.00 0.00 64.86 63.52 2hva h ILE 62 Cb 0.79 2.36 -0.01 0.00 -1.09 0.00 0.00 36.82 38.87 2hva h ILE 62 CO 0.05 0.64 -0.01 0.24 -1.08 0.00 0.00 178.15 178.00 2hva h MET 63 N 0.00 0.38 -0.65 2.19 2.86 0.49 -2.29 114.93 117.90 2hva h MET 63 Ca -0.01 -0.07 -0.08 0.00 -2.06 0.00 0.00 59.70 57.48 2hva h MET 63 Cb 1.31 -0.06 -0.03 0.00 0.06 0.00 0.00 31.60 32.89 2hva h MET 63 CO 0.09 0.41 0.08 -0.22 1.06 0.00 0.00 176.91 178.33 2hva h LYS 64 N 0.37 1.10 0.61 1.72 3.64 -1.48 0.65 116.57 123.18 2hva h LYS 64 Ca 0.08 -0.31 -0.03 0.00 -1.27 0.00 0.00 60.65 59.13 2hva h LYS 64 Cb 0.26 -0.12 0.01 0.00 -0.41 0.00 0.00 32.23 31.97 2hva h LYS 64 CO 0.01 1.02 -0.29 -0.92 -2.27 0.00 0.00 179.45 176.99 2hva h TYR 65 N 1.02 -0.76 0.00 1.91 3.20 -1.51 -2.76 116.97 118.07 2hva h TYR 65 Ca 0.20 -0.02 -0.07 0.00 3.14 0.00 0.00 58.73 61.98 2hva h TYR 65 Cb 0.48 0.25 -0.01 0.00 1.54 0.00 0.00 36.73 38.99 2hva h TYR 65 CO 0.03 -0.42 -0.34 -0.39 -1.64 0.00 0.00 178.16 175.40 2hva h VAL 66 N -1.06 1.21 0.00 1.81 -1.51 -1.46 -3.36 116.25 111.88 2hva h VAL 66 Ca -0.08 -1.18 0.00 0.00 -1.23 0.00 0.00 66.70 64.21 2hva h VAL 66 Cb 0.68 1.64 0.00 0.00 -2.13 0.00 0.00 31.29 31.48 2hva h VAL 66 CO 0.14 0.33 0.00 0.61 -1.23 0.00 0.00 177.57 177.42 2hva n GLY 67 N -0.51 -2.67 1.78 5.19 0.00 0.23 -2.71 105.19 106.48 2hva n GLY 67 Ca -0.02 -0.82 -0.19 0.00 0.00 0.00 0.00 46.02 44.99 2hva n GLY 67 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2hva n GLY 68 N 0.97 5.54 1.21 -0.02 0.00 -1.26 -4.54 105.19 107.10 2hva n GLY 68 Ca 0.00 -1.89 -0.01 0.00 0.00 0.00 0.00 46.02 44.12 2hva n GLY 68 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2hva n THR 69 N -0.96 1.80 0.42 2.61 -1.04 -1.05 -4.71 114.28 111.35 2hva n THR 69 Ca 0.46 -3.01 0.12 0.00 -2.04 0.00 0.00 64.05 59.58 2hva n THR 69 Cb 0.98 -0.09 0.13 0.00 -1.82 0.00 0.00 70.33 69.53 2hva n THR 69 CO 0.00 0.00 0.00 -0.55 -0.64 0.00 0.00 175.07 173.88 2hva h ASN 70 N 1.35 0.00 0.00 8.00 7.08 -1.71 -3.37 115.58 126.93 2hva h ASN 70 Ca 0.02 -0.14 0.00 0.00 -3.08 0.00 0.00 56.30 53.10 2hva h ASN 70 Cb 1.29 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 37.53 2hva h ASN 70 CO 0.19 0.07 0.00 0.47 -2.08 0.00 0.00 177.43 176.08 2hva n ASP 71 N -2.33 0.00 -0.04 6.14 8.00 -1.26 -4.14 116.55 122.93 2hva n ASP 71 Ca 0.02 0.00 -0.17 0.00 0.71 0.00 0.00 54.79 55.36 2hva n ASP 71 Cb 0.47 0.00 -0.14 0.00 -0.02 0.00 0.00 41.12 41.44 2hva n ASP 71 CO 0.00 0.00 0.00 1.17 -0.39 0.00 0.00 177.20 177.98 2hva n LYS 72 N -2.00 0.70 -1.55 -1.24 3.00 -1.26 -5.02 118.16 110.79 2hva n LYS 72 Ca 0.00 0.22 0.00 0.00 -0.00 0.00 0.00 58.31 58.53 2hva n LYS 72 Cb 0.00 -1.68 0.00 0.00 0.00 0.00 0.00 35.03 33.35 2hva n LYS 72 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2hva n GLY 73 N 1.92 0.81 3.98 3.14 0.00 -1.26 -5.09 105.19 108.69 2hva n GLY 73 Ca -0.31 -0.41 -0.20 0.00 0.00 0.00 0.00 46.02 45.10 2hva n GLY 73 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2hva s VAL 74 N -2.56 4.45 -0.96 1.61 -7.23 -1.26 -5.04 120.40 109.42 2hva s VAL 74 Ca 0.00 -0.99 -0.01 0.00 -1.81 0.00 0.00 61.98 59.17 2hva s VAL 74 Cb 0.00 -3.55 0.33 0.00 0.56 0.00 0.00 36.38 33.72 2hva s VAL 74 CO 0.00 -0.21 1.79 0.61 -0.31 0.00 0.00 175.10 176.98 2hva n GLY 75 N -1.57 6.01 0.00 2.32 0.00 -1.26 -4.81 105.19 105.88 2hva n GLY 75 Ca -0.03 -2.58 0.00 0.00 0.00 0.00 0.00 46.02 43.41 2hva n GLY 75 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2hva n MET 76 N -0.16 0.00 0.00 1.61 2.81 -1.26 -5.02 117.12 115.10 2hva n MET 76 Ca 0.47 0.27 0.00 0.00 -1.81 0.00 0.00 57.70 56.63 2hva n MET 76 Cb 0.27 -1.07 0.00 0.00 -0.71 0.00 0.00 33.22 31.71 2hva n MET 76 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2hva n GLY 77 N 0.43 0.65 3.20 3.03 0.00 -1.10 -4.95 105.19 106.45 2hva n GLY 77 Ca 0.00 -1.16 0.04 0.00 0.00 0.00 0.00 46.02 44.90 2hva n GLY 77 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2hva s MET 78 N 0.00 0.07 0.46 1.61 1.75 -1.26 -3.86 119.30 118.06 2hva s MET 78 Ca 0.00 0.17 -0.24 0.00 -1.25 0.00 0.00 55.69 54.37 2hva s MET 78 Cb 0.00 0.10 -0.07 0.00 2.84 0.00 0.00 34.83 37.70 2hva s MET 78 CO 0.00 -0.03 1.21 -0.08 -0.65 0.00 0.00 175.02 175.47 2hva s THR 79 N 2.25 2.89 0.00 10.11 -1.32 -1.26 -4.97 115.64 123.33 2hva s THR 79 Ca -0.01 0.70 -0.25 0.00 -1.21 0.00 0.00 61.69 60.92 2hva s THR 79 Cb -0.03 -3.37 -0.17 0.00 -1.51 0.00 0.00 72.50 67.43 2hva s THR 79 CO -0.15 0.02 1.23 0.58 -2.21 0.00 0.00 174.62 174.09 2hva h VAL 80 N 1.96 0.84 -4.00 5.08 2.07 -1.99 -3.44 116.25 116.77 2hva h VAL 80 Ca -0.49 -0.71 -0.49 0.00 0.82 0.00 0.00 66.70 65.83 2hva h VAL 80 Cb 1.25 1.24 0.03 0.00 -1.52 0.00 0.00 31.29 32.29 2hva h VAL 80 CO 0.60 0.15 0.43 -2.16 0.02 0.00 0.00 177.57 176.61 2hva s PRO 81 N -4.55 3.97 -0.20 1.57 0.04 -1.26 -4.92 135.00 129.64 2hva s PRO 81 Ca -0.14 1.56 -0.09 0.00 0.04 0.00 0.00 61.00 62.36 2hva s PRO 81 Cb 0.02 -2.41 0.08 0.00 0.04 0.00 0.00 34.50 32.23 2hva s PRO 81 CO 0.57 -0.33 0.47 0.08 0.04 0.00 0.00 177.00 177.83 2hva s VAL 82 N -1.69 -0.31 0.05 -0.36 1.01 -1.26 -4.85 120.40 112.99 2hva s VAL 82 Ca 0.61 0.10 0.07 0.00 0.00 0.00 0.00 61.98 62.76 2hva s VAL 82 Cb -0.23 -0.71 -0.03 0.00 0.00 0.00 0.00 36.38 35.41 2hva s VAL 82 CO 0.28 0.04 -0.15 -0.55 0.00 0.00 0.00 175.10 174.72 2hva s SER 83 N 1.96 4.01 0.08 3.32 0.15 -1.26 -4.14 113.70 117.82 2hva s SER 83 Ca -0.07 -0.39 0.06 0.00 0.70 0.00 0.00 55.95 56.26 2hva s SER 83 Cb -0.09 -0.70 -0.03 0.00 -1.71 0.00 0.00 66.02 63.48 2hva s SER 83 CO -0.14 0.24 -0.17 0.72 1.20 0.00 0.00 173.24 175.10 2hva s PHE 84 N -0.99 1.42 0.04 3.44 -0.12 -0.91 -2.20 117.98 118.66 2hva s PHE 84 Ca 0.16 -0.43 -0.21 0.00 -0.05 0.00 0.00 56.93 56.40 2hva s PHE 84 Cb -0.11 -0.80 -0.06 0.00 -0.63 0.00 0.00 43.02 41.42 2hva s PHE 84 CO 0.07 0.10 0.62 0.00 -0.05 0.00 0.00 175.22 175.96 2hva s ALA 85 N -1.17 3.50 -0.02 1.99 0.00 0.36 -1.49 121.76 124.94 2hva s ALA 85 Ca 0.01 0.08 0.06 0.00 0.00 0.00 0.00 51.96 52.11 2hva s ALA 85 Cb -0.10 -2.75 -0.01 0.00 0.00 0.00 0.00 23.12 20.26 2hva s ALA 85 CO 0.03 0.24 -0.19 0.14 0.00 0.00 0.00 175.76 175.97 2hva s VAL 86 N -0.52 1.49 -0.41 0.00 -7.23 0.28 -0.87 120.40 113.14 2hva s VAL 86 Ca 0.31 -0.80 -0.07 0.00 -1.81 0.00 0.00 61.98 59.61 2hva s VAL 86 Cb -0.19 -1.24 0.09 0.00 0.56 0.00 0.00 36.38 35.59 2hva s VAL 86 CO 0.19 0.42 0.23 -0.36 -0.31 0.00 0.00 175.10 175.27 2hva s PHE 87 N -0.42 3.39 0.27 2.82 0.40 -1.20 -1.73 117.98 121.51 2hva s PHE 87 Ca 0.07 -1.79 -0.29 0.00 -0.60 0.00 0.00 56.93 54.31 2hva s PHE 87 Cb -0.08 -2.97 -0.10 0.00 0.51 0.00 0.00 43.02 40.39 2hva s PHE 87 CO -0.01 -0.88 1.27 -1.25 0.70 0.00 0.00 175.22 175.05 2hva s PRO 88 N 1.34 4.42 0.65 0.24 0.04 -1.26 -4.76 135.00 135.68 2hva s PRO 88 Ca 0.04 2.08 -0.02 0.00 0.04 0.00 0.00 61.00 63.13 2hva s PRO 88 Cb -0.23 -3.14 0.07 0.00 0.04 0.00 0.00 34.50 31.24 2hva s PRO 88 CO 0.00 -0.14 0.92 -0.80 0.04 0.00 0.00 177.00 177.02 2hva s ASN 89 N -0.21 4.84 0.36 6.66 0.01 -0.31 -4.96 114.94 121.32 2hva s ASN 89 Ca 0.51 0.07 0.26 0.00 -0.71 0.00 0.00 52.86 53.00 2hva s ASN 89 Cb -0.37 -0.74 1.26 0.00 0.41 0.00 0.00 41.25 41.81 2hva s ASN 89 CO 0.45 -1.51 1.79 -0.08 -1.51 0.00 0.00 177.10 176.24 2hva h GLU 90 N -0.35 0.00 -0.01 -0.60 4.81 -1.96 -1.43 114.58 115.05 2hva h GLU 90 Ca -0.42 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.81 2hva h GLU 90 Cb 1.29 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.67 2hva h GLU 90 CO 0.52 0.00 -0.02 -3.47 -0.73 0.00 0.00 179.01 175.30 2hva n ASP 91 N -2.43 0.63 0.00 1.04 2.03 -1.26 -4.89 116.55 111.66 2hva n ASP 91 Ca 0.00 -1.08 0.00 0.00 0.52 0.00 0.00 54.79 54.23 2hva n ASP 91 Cb 0.14 -0.02 0.00 0.00 -0.72 0.00 0.00 41.12 40.53 2hva n ASP 91 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2hva n GLY 92 N 1.12 1.58 3.65 0.27 0.00 -0.54 -5.02 105.19 106.26 2hva n GLY 92 Ca 0.20 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.93 2hva n GLY 92 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2hva s SER 93 N -3.20 3.95 -0.49 1.61 0.01 -1.26 -4.83 113.70 109.49 2hva s SER 93 Ca 0.00 -1.41 -0.03 0.00 1.31 0.00 0.00 55.95 55.82 2hva s SER 93 Cb 0.00 -0.24 0.13 0.00 0.21 0.00 0.00 66.02 66.12 2hva s SER 93 CO 0.00 -0.53 0.30 -0.76 0.41 0.00 0.00 173.24 172.66 2hva s LEU 94 N -3.75 5.30 -0.55 2.44 1.43 -1.26 -1.16 118.68 121.12 2hva s LEU 94 Ca 0.30 -2.29 -0.19 0.00 -1.03 0.00 0.00 54.13 50.92 2hva s LEU 94 Cb 0.08 -1.86 0.09 0.00 0.03 0.00 0.00 46.19 44.53 2hva s LEU 94 CO 0.16 -0.50 0.65 0.00 0.23 0.00 0.00 176.35 176.89 2hva s GLN 95 N 0.77 3.07 -0.23 1.70 -2.07 -1.26 -4.70 119.66 116.93 2hva s GLN 95 Ca 0.11 -1.18 -0.10 0.00 -1.82 0.00 0.00 55.36 52.37 2hva s GLN 95 Cb -0.22 -4.20 0.01 0.00 -1.09 0.00 0.00 33.01 27.51 2hva s GLN 95 CO -0.04 -1.40 0.21 1.63 -1.32 0.00 0.00 175.29 174.38 2hva n LYS 96 N 6.18 -1.72 0.00 9.60 4.01 -1.26 -5.01 118.16 129.97 2hva n LYS 96 Ca -0.09 1.60 0.00 0.00 -0.51 0.00 0.00 58.31 59.32 2hva n LYS 96 Cb 0.43 -2.94 0.00 0.00 -0.51 0.00 0.00 35.03 32.02 2hva n LYS 96 CO 0.00 0.00 0.00 1.17 -1.11 0.00 0.00 177.40 177.46 2hva n LYS 97 N 0.64 0.00 -3.79 1.97 4.81 -1.25 -4.85 118.16 115.69 2hva n LYS 97 Ca -0.00 0.00 -0.13 0.00 -0.87 0.00 0.00 58.31 57.31 2hva n LYS 97 Cb 0.40 0.00 -0.13 0.00 0.02 0.00 0.00 35.03 35.32 2hva n LYS 97 CO 0.00 0.00 0.00 -1.17 1.17 0.00 0.00 177.40 177.40 2hva s LEU 98 N 0.00 1.09 -0.18 3.14 0.20 -1.26 -3.28 118.68 118.39 2hva s LEU 98 Ca 0.00 0.32 0.00 0.00 0.69 0.00 0.00 54.13 55.14 2hva s LEU 98 Cb 0.00 0.47 0.04 0.00 -0.43 0.00 0.00 46.19 46.27 2hva s LEU 98 CO 0.00 -0.10 -0.10 -0.75 -0.29 0.00 0.00 176.35 175.12 2hva s LYS 99 N 0.57 1.93 -0.02 1.98 2.20 -0.05 -3.14 119.74 123.22 2hva s LYS 99 Ca -0.04 -0.72 -0.17 0.00 -0.36 0.00 0.00 55.97 54.68 2hva s LYS 99 Cb -0.06 -2.27 -0.05 0.00 -1.51 0.00 0.00 37.83 33.94 2hva s LYS 99 CO -0.03 -0.40 0.47 0.54 -0.36 0.00 0.00 175.35 175.58 2hva s VAL 100 N 1.47 5.00 -0.03 4.02 0.11 -0.59 0.14 120.40 130.51 2hva s VAL 100 Ca 0.00 0.98 0.02 0.00 -2.93 0.00 0.00 61.98 60.05 2hva s VAL 100 Cb -0.15 -3.80 -0.03 0.00 -1.53 0.00 0.00 36.38 30.87 2hva s VAL 100 CO -0.08 0.49 -0.07 0.26 -3.33 0.00 0.00 175.10 172.37 2hva s TRP 101 N -0.55 2.92 0.00 1.54 0.52 -0.93 -0.87 118.94 121.56 2hva s TRP 101 Ca 0.26 -0.01 0.01 0.00 0.02 0.00 0.00 56.10 56.38 2hva s TRP 101 Cb -0.17 -1.66 -0.04 0.00 -1.15 0.00 0.00 33.47 30.46 2hva s TRP 101 CO 0.14 0.36 0.05 0.12 0.02 0.00 0.00 176.95 177.64 2hva s PHE 102 N -0.91 3.20 -0.37 -1.98 2.19 -0.09 -4.04 117.98 115.98 2hva s PHE 102 Ca 0.15 0.15 -0.17 0.00 0.33 0.00 0.00 56.93 57.39 2hva s PHE 102 Cb -0.11 -1.70 0.00 0.00 -1.31 0.00 0.00 43.02 39.90 2hva s PHE 102 CO 0.05 0.52 0.44 0.50 1.83 0.00 0.00 175.22 178.56 2hva s ARG 103 N -1.72 3.45 -0.01 10.12 3.52 -1.26 -3.43 118.95 129.63 2hva s ARG 103 Ca 0.22 -0.42 -0.18 0.00 -0.13 0.00 0.00 55.73 55.22 2hva s ARG 103 Cb -0.12 -3.85 -0.06 0.00 -1.56 0.00 0.00 34.95 29.36 2hva s ARG 103 CO 0.13 -0.67 0.51 0.42 -0.81 0.00 0.00 175.30 174.89 2hva s ILE 104 N 2.21 4.95 0.75 4.11 1.01 -1.26 -4.85 121.20 128.13 2hva s ILE 104 Ca 0.15 1.07 -0.15 0.00 0.00 0.00 0.00 60.65 61.72 2hva s ILE 104 Cb -0.16 -3.84 0.05 0.00 0.01 0.00 0.00 42.46 38.52 2hva s ILE 104 CO 0.13 0.48 1.24 -2.16 0.00 0.00 0.00 174.94 174.62 2hva s PRO 105 N -0.51 1.94 0.57 2.79 0.04 -1.26 -4.82 135.00 133.75 2hva s PRO 105 Ca 0.27 1.86 0.26 0.00 0.04 0.00 0.00 61.00 63.44 2hva s PRO 105 Cb -0.18 -1.80 1.59 0.00 0.04 0.00 0.00 34.50 34.15 2hva s PRO 105 CO 0.15 -2.01 2.12 -0.97 0.04 0.00 0.00 177.00 176.34 2hva h ASN 106 N -0.42 0.00 -0.40 6.66 -1.24 -1.97 -2.17 115.58 116.05 2hva h ASN 106 Ca -0.48 0.00 0.04 0.00 0.71 0.00 0.00 56.30 56.58 2hva h ASN 106 Cb 1.31 0.00 -0.04 0.00 0.73 0.00 0.00 38.32 40.32 2hva h ASN 106 CO 0.48 0.00 0.16 1.56 -1.29 0.00 0.00 177.43 178.34 2hva h GLN 107 N 0.00 0.32 -0.06 6.67 4.20 -2.03 -1.76 115.11 122.45 2hva h GLN 107 Ca 0.08 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.77 2hva h GLN 107 Cb 0.38 -0.07 0.00 0.00 0.30 0.00 0.00 27.48 28.09 2hva h GLN 107 CO -0.00 0.21 0.00 1.19 -0.67 0.00 0.00 178.83 179.56 2hva n PHE 108 N -4.99 0.07 -0.36 2.96 3.01 -0.85 -4.21 117.46 113.10 2hva n PHE 108 Ca 0.02 -0.03 0.07 0.00 1.01 0.00 0.00 57.45 58.52 2hva n PHE 108 Cb 0.14 0.00 0.25 0.00 -0.01 0.00 0.00 39.48 39.85 2hva n PHE 108 CO 0.00 0.00 0.00 0.37 1.01 0.00 0.00 176.76 178.14 2hva h GLN 109 N 2.39 0.96 -0.55 -1.08 4.15 -0.94 -0.48 115.11 119.55 2hva h GLN 109 Ca 0.00 -0.06 0.07 0.00 0.77 0.00 0.00 58.65 59.43 2hva h GLN 109 Cb 0.51 -0.22 -0.03 0.00 0.21 0.00 0.00 27.48 27.95 2hva h GLN 109 CO 0.00 0.63 0.37 0.78 -1.93 0.00 0.00 178.83 178.68 2hva h GLY 110 N 0.99 0.62 -5.41 2.39 0.00 -1.73 -3.42 103.07 96.51 2hva h GLY 110 Ca 0.49 -0.20 0.20 0.00 0.00 0.00 0.00 47.33 47.82 2hva h GLY 110 CO -0.25 0.15 -0.01 -1.35 0.00 0.00 0.00 176.54 175.07 2hva s SER 111 N -6.37 -0.13 0.96 0.19 1.04 -0.32 -5.13 113.70 103.93 2hva s SER 111 Ca -0.08 -0.04 -0.12 0.00 0.48 0.00 0.00 55.95 56.20 2hva s SER 111 Cb 0.19 0.49 0.12 0.00 0.10 0.00 0.00 66.02 66.91 2hva s SER 111 CO 0.75 -0.02 0.81 -2.65 0.98 0.00 0.00 173.24 173.11 2hva n PRO 112 N 4.09 -0.60 -1.73 4.02 -0.02 -0.45 -4.91 135.00 135.40 2hva n PRO 112 Ca 0.07 -0.12 -0.33 0.00 -2.02 0.00 0.00 63.50 61.10 2hva n PRO 112 Cb 0.62 -2.14 0.05 0.00 -0.02 0.00 0.00 33.50 32.01 2hva n PRO 112 CO 0.00 0.00 0.00 -2.14 1.98 0.00 0.00 175.50 175.34 2hva s PRO 113 N -4.20 2.82 -0.26 0.52 0.02 -1.26 -4.95 135.00 127.70 2hva s PRO 113 Ca 0.63 1.31 -0.29 0.00 0.02 0.00 0.00 61.00 62.67 2hva s PRO 113 Cb -0.22 -1.96 -0.03 0.00 0.02 0.00 0.00 34.50 32.31 2hva s PRO 113 CO 0.62 -1.23 1.79 0.00 -0.33 0.00 0.00 177.00 177.85 2hva s ALA 114 N -2.46 3.05 0.88 -1.55 0.00 -1.26 -4.97 121.76 115.45 2hva s ALA 114 Ca 0.65 0.46 -0.12 0.00 0.00 0.00 0.00 51.96 52.94 2hva s ALA 114 Cb -0.19 -3.95 0.07 0.00 0.00 0.00 0.00 23.12 19.05 2hva s ALA 114 CO 0.43 -2.33 0.80 -2.30 0.00 0.00 0.00 175.76 172.36 2hva n PRO 115 N 8.13 -0.16 -0.02 0.00 -0.02 -1.26 -4.49 135.00 137.17 2hva n PRO 115 Ca 0.22 0.01 -0.03 0.00 -2.02 0.00 0.00 63.50 61.68 2hva n PRO 115 Cb 0.46 -2.13 -0.03 0.00 -0.02 0.00 0.00 33.50 31.79 2hva n PRO 115 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 2hva n SER 116 N -2.44 3.70 -4.69 2.55 7.64 -1.26 -4.99 113.62 114.13 2hva n SER 116 Ca 0.10 -0.02 -0.42 0.00 1.01 0.00 0.00 58.87 59.54 2hva n SER 116 Cb 0.52 0.07 -0.03 0.00 -1.01 0.00 0.00 64.21 63.76 2hva n SER 116 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2hva s ASP 117 N -4.26 7.00 0.60 6.43 2.15 -1.26 -4.90 116.67 122.43 2hva s ASP 117 Ca -0.06 1.92 0.31 0.00 0.43 0.00 0.00 52.55 55.15 2hva s ASP 117 Cb 0.02 -2.56 1.79 0.00 -0.30 0.00 0.00 42.92 41.86 2hva s ASP 117 CO 0.13 -0.61 2.16 -0.08 -0.17 0.00 0.00 175.17 176.60 2hva h GLU 118 N 7.47 0.00 0.02 4.34 4.81 -1.96 -0.24 114.58 129.02 2hva h GLU 118 Ca -0.36 0.00 -0.23 0.00 -0.13 0.00 0.00 59.36 58.64 2hva h GLU 118 Cb 1.17 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 30.52 2hva h GLU 118 CO 0.88 0.00 -1.17 0.77 -0.73 0.00 0.00 179.01 178.76 2hva h SER 119 N 0.00 0.05 -3.48 1.04 0.02 -1.92 -3.43 113.55 105.83 2hva h SER 119 Ca 0.05 -0.06 -0.60 0.00 -0.84 0.00 0.00 61.79 60.34 2hva h SER 119 Cb 0.32 -0.02 -0.10 0.00 0.14 0.00 0.00 62.40 62.75 2hva h SER 119 CO -0.00 1.05 0.51 -0.69 -1.14 0.00 0.00 176.83 176.56 2hva s VAL 120 N -2.68 4.67 0.18 2.27 1.01 -0.10 -4.46 120.40 121.29 2hva s VAL 120 Ca -0.01 1.13 0.08 0.00 0.00 0.00 0.00 61.98 63.19 2hva s VAL 120 Cb 0.09 -4.26 -0.04 0.00 0.00 0.00 0.00 36.38 32.17 2hva s VAL 120 CO 0.83 -0.44 -0.17 -0.75 0.00 0.00 0.00 175.10 174.56 2hva s LYS 121 N 3.27 1.30 -0.22 2.72 2.20 -1.21 -4.64 119.74 123.16 2hva s LYS 121 Ca 0.35 -1.48 -0.07 0.00 -0.36 0.00 0.00 55.97 54.41 2hva s LYS 121 Cb -0.13 -1.26 -0.04 0.00 -1.51 0.00 0.00 37.83 34.90 2hva s LYS 121 CO 0.17 0.24 0.07 0.42 -0.36 0.00 0.00 175.35 175.89 2hva s ILE 122 N -2.38 4.56 -0.04 5.43 -1.09 -1.26 -1.85 121.20 124.57 2hva s ILE 122 Ca 0.18 -0.10 0.02 0.00 -2.23 0.00 0.00 60.65 58.53 2hva s ILE 122 Cb -0.04 -3.10 0.01 0.00 -1.58 0.00 0.00 42.46 37.75 2hva s ILE 122 CO 0.07 0.39 -0.10 -1.61 -1.23 0.00 0.00 174.94 172.46 2hva s GLU 123 N 1.03 1.15 -0.07 2.79 2.02 -1.11 -5.00 118.70 119.51 2hva s GLU 123 Ca 0.04 -0.32 -0.21 0.00 0.02 0.00 0.00 54.97 54.49 2hva s GLU 123 Cb -0.14 -1.04 -0.04 0.00 0.10 0.00 0.00 34.13 33.01 2hva s GLU 123 CO 0.03 0.08 0.62 -1.21 0.02 0.00 0.00 175.26 174.80 2hva s GLU 124 N 0.37 4.39 -0.06 1.61 2.02 -1.26 -3.34 118.70 122.43 2hva s GLU 124 Ca -0.07 0.73 0.11 0.00 0.02 0.00 0.00 54.97 55.76 2hva s GLU 124 Cb -0.11 -3.43 0.19 0.00 0.10 0.00 0.00 34.13 30.88 2hva s GLU 124 CO 0.01 0.14 1.09 0.54 0.02 0.00 0.00 175.26 177.06 2hva n ARG 125 N 3.59 0.54 -3.17 1.61 5.12 -1.26 -5.00 116.66 118.09 2hva n ARG 125 Ca -0.04 -1.85 -0.20 0.00 -1.93 0.00 0.00 57.85 53.83 2hva n ARG 125 Cb 0.51 -0.83 -0.04 0.00 -1.16 0.00 0.00 32.46 30.94 2hva n ARG 125 CO 0.00 0.00 0.00 -0.85 -1.93 0.00 0.00 177.63 174.85 2hva n GLU 126 N -0.46 -0.88 -0.69 5.56 0.28 -1.26 -4.26 120.64 118.92 2hva n GLU 126 Ca 0.08 0.06 0.08 0.00 -0.16 0.00 0.00 57.16 57.22 2hva n GLU 126 Cb 0.75 -2.27 -0.05 0.00 1.43 0.00 0.00 31.44 31.31 2hva n GLU 126 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2hva n GLY 127 N -1.07 -3.00 3.01 -1.84 0.00 -1.26 -4.71 105.19 96.32 2hva n GLY 127 Ca -0.00 -1.25 -0.11 0.00 0.00 0.00 0.00 46.02 44.66 2hva n GLY 127 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2hva s ILE 128 N -3.64 0.06 -0.26 -0.61 -4.36 -1.26 -4.97 121.20 106.15 2hva s ILE 128 Ca 0.00 -0.50 -0.09 0.00 -0.26 0.00 0.00 60.65 59.81 2hva s ILE 128 Cb 0.00 -0.25 -0.04 0.00 1.25 0.00 0.00 42.46 43.42 2hva s ILE 128 CO 0.00 -0.27 0.11 -0.89 0.24 0.00 0.00 174.94 174.13 2hva s THR 129 N -0.86 4.67 0.11 8.37 2.01 -1.26 -4.39 115.64 124.29 2hva s THR 129 Ca -0.09 -0.05 -0.00 0.00 0.31 0.00 0.00 61.69 61.85 2hva s THR 129 Cb -0.06 -3.20 -0.04 0.00 0.01 0.00 0.00 72.50 69.21 2hva s THR 129 CO 0.00 0.31 0.01 0.68 -0.69 0.00 0.00 174.62 174.94 2hva s VAL 130 N 1.63 0.27 -0.17 3.82 -7.23 -1.26 -2.62 120.40 114.83 2hva s VAL 130 Ca 0.06 -1.89 -0.05 0.00 -1.81 0.00 0.00 61.98 58.29 2hva s VAL 130 Cb -0.15 -1.88 -0.03 0.00 0.56 0.00 0.00 36.38 34.88 2hva s VAL 130 CO 0.06 -0.65 -0.01 -0.31 -0.31 0.00 0.00 175.10 173.88 2hva s TYR 131 N -3.92 3.08 -0.13 2.82 2.02 -1.23 -3.91 117.35 116.08 2hva s TYR 131 Ca 0.18 -0.26 -0.04 0.00 -0.37 0.00 0.00 57.07 56.58 2hva s TYR 131 Cb 0.07 -2.02 -0.03 0.00 -0.40 0.00 0.00 41.96 39.58 2hva s TYR 131 CO -0.02 -0.05 0.02 -1.12 -1.57 0.00 0.00 175.55 172.81 2hva s SER 132 N 0.54 5.37 -0.02 2.29 0.01 -1.24 -3.39 113.70 117.27 2hva s SER 132 Ca -0.01 0.11 0.04 0.00 1.31 0.00 0.00 55.95 57.40 2hva s SER 132 Cb -0.14 -1.71 -0.01 0.00 0.21 0.00 0.00 66.02 64.38 2hva s SER 132 CO 0.02 0.29 -0.13 0.28 0.41 0.00 0.00 173.24 174.11 2hva s THR 133 N -0.36 1.07 0.18 1.44 -1.32 -1.25 -3.66 115.64 111.73 2hva s THR 133 Ca 0.08 -0.57 0.10 0.00 -1.21 0.00 0.00 61.69 60.09 2hva s THR 133 Cb -0.12 -0.90 -0.04 0.00 -1.51 0.00 0.00 72.50 69.93 2hva s THR 133 CO 0.02 0.31 -0.16 0.00 -2.21 0.00 0.00 174.62 172.57 2hva s GLN 134 N -0.23 1.81 0.31 7.08 -2.07 -1.26 -3.89 119.66 121.40 2hva s GLN 134 Ca 0.03 -1.36 -0.12 0.00 -1.82 0.00 0.00 55.36 52.09 2hva s GLN 134 Cb -0.06 -2.03 0.05 0.00 -1.09 0.00 0.00 33.01 29.88 2hva s GLN 134 CO -0.00 0.43 0.65 1.97 -1.32 0.00 0.00 175.29 177.01 2hva n PHE 135 N 0.22 -2.07 -3.79 9.60 1.16 -1.26 -4.91 117.46 116.40 2hva n PHE 135 Ca -0.12 -1.48 -0.35 0.00 -1.87 0.00 0.00 57.45 53.64 2hva n PHE 135 Cb 0.55 0.74 -0.11 0.00 -1.61 0.00 0.00 39.48 39.05 2hva n PHE 135 CO 0.00 0.00 0.00 0.20 -1.87 0.00 0.00 176.76 175.09 2hva s GLY 136 N -2.69 2.35 0.00 4.97 0.00 -1.26 -4.71 107.32 105.99 2hva s GLY 136 Ca 0.13 -3.07 0.00 0.00 0.00 0.00 0.00 44.72 41.78 2hva s GLY 136 CO 0.09 1.06 0.00 0.61 0.00 0.00 0.00 173.10 174.86 2hva n GLY 137 N 3.70 1.32 3.51 0.20 0.00 -1.26 -5.17 105.19 107.48 2hva n GLY 137 Ca 0.05 -0.32 -0.30 0.00 0.00 0.00 0.00 46.02 45.45 2hva n GLY 137 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2hva s TYR 138 N -2.00 0.17 -0.22 1.61 2.02 -1.26 -4.77 117.35 112.91 2hva s TYR 138 Ca 0.00 0.52 -0.34 0.00 -0.37 0.00 0.00 57.07 56.89 2hva s TYR 138 Cb 0.00 -3.30 0.15 0.00 -0.40 0.00 0.00 41.96 38.41 2hva s TYR 138 CO 0.00 -4.20 1.24 0.00 -1.57 0.00 0.00 175.55 171.02 2hva s ALA 139 N -2.80 -2.08 0.00 3.71 0.00 -1.26 -5.00 121.76 114.32 2hva s ALA 139 Ca 0.70 1.70 0.00 0.00 0.00 0.00 0.00 51.96 54.36 2hva s ALA 139 Cb -0.11 -0.54 0.00 0.00 0.00 0.00 0.00 23.12 22.47 2hva s ALA 139 CO 0.57 -0.48 0.00 1.63 0.00 0.00 0.00 175.76 177.48 2hva n LYS 140 N 0.15 0.00 0.00 0.00 4.01 -1.26 -4.98 118.16 116.07 2hva n LYS 140 Ca -0.00 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.80 2hva n LYS 140 Cb 0.58 0.00 0.00 0.00 -0.51 0.00 0.00 35.03 35.10 2hva n LYS 140 CO 0.00 0.00 0.00 -0.85 -1.11 0.00 0.00 177.40 175.44 2hva n GLU 141 N -2.15 0.00 0.06 1.97 0.00 -1.26 -4.63 120.64 114.63 2hva n GLU 141 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 57.16 57.09 2hva n GLU 141 Cb 0.00 -0.07 0.10 0.00 0.00 0.00 0.00 31.44 31.47 2hva n GLU 141 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2hva h ALA 142 N 0.00 0.79 -0.27 -1.84 0.00 -1.95 -2.83 119.26 113.16 2hva h ALA 142 Ca 0.00 -0.54 -0.10 0.00 0.00 0.00 0.00 54.91 54.27 2hva h ALA 142 Cb 0.00 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 2hva h ALA 142 CO 0.00 0.72 -0.26 -0.44 0.00 0.00 0.00 179.25 179.27 2hva h ASP 143 N 0.25 0.53 -0.74 0.00 3.32 -1.96 -2.67 116.42 115.14 2hva h ASP 143 Ca -0.00 -0.18 -0.04 0.00 0.02 0.00 0.00 57.03 56.82 2hva h ASP 143 Cb 1.12 -0.14 -0.03 0.00 0.22 0.00 0.00 39.33 40.49 2hva h ASP 143 CO 0.10 0.78 0.29 1.88 -1.72 0.00 0.00 179.24 180.57 2hva h TYR 144 N 0.46 1.13 -0.95 4.55 0.05 -1.85 -1.84 116.97 118.52 2hva h TYR 144 Ca 0.07 -0.09 0.14 0.00 0.05 0.00 0.00 58.73 58.90 2hva h TYR 144 Cb 0.69 -0.34 -0.08 0.00 1.01 0.00 0.00 36.73 38.01 2hva h TYR 144 CO 0.02 0.86 0.60 0.28 -1.05 0.00 0.00 178.16 178.88 2hva h VAL 145 N 1.06 0.85 -0.17 -2.88 2.07 -1.24 0.34 116.25 116.28 2hva h VAL 145 Ca 0.25 -0.28 -0.14 0.00 0.82 0.00 0.00 66.70 67.35 2hva h VAL 145 Cb 0.21 -0.04 -0.01 0.00 -1.52 0.00 0.00 31.29 29.94 2hva h VAL 145 CO -0.02 0.15 -0.48 0.00 0.02 0.00 0.00 177.57 177.24 2hva h ALA 146 N 1.58 0.86 -0.26 1.67 0.00 -1.25 -2.62 119.26 119.23 2hva h ALA 146 Ca 0.49 -0.47 -0.12 0.00 0.00 0.00 0.00 54.91 54.81 2hva h ALA 146 Cb 0.67 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.36 2hva h ALA 146 CO -0.25 0.66 -0.31 0.45 0.00 0.00 0.00 179.25 179.80 2hva h HIS 147 N 0.36 0.81 -0.26 0.00 -0.00 0.15 -2.18 115.15 114.02 2hva h HIS 147 Ca 0.02 -0.25 -0.02 0.00 -0.00 0.00 0.00 60.37 60.11 2hva h HIS 147 Cb 0.97 -0.17 -0.01 0.00 -0.00 0.00 0.00 27.41 28.20 2hva h HIS 147 CO 0.03 1.00 0.07 0.00 -0.00 0.00 0.00 177.93 179.03 2hva h ALA 148 N 0.68 1.64 -0.20 2.45 0.00 -0.48 -2.15 119.26 121.19 2hva h ALA 148 Ca 0.04 -0.10 -0.17 0.00 0.00 0.00 0.00 54.91 54.67 2hva h ALA 148 Cb 0.88 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.56 2hva h ALA 148 CO 0.07 0.28 -0.55 1.15 0.00 0.00 0.00 179.25 180.21 2hva h THR 149 N 0.37 1.31 -0.68 0.00 2.02 -1.34 -2.95 112.91 111.63 2hva h THR 149 Ca 0.09 -1.77 0.02 0.00 0.77 0.00 0.00 66.41 65.52 2hva h THR 149 Cb 0.14 1.88 -0.04 0.00 -1.74 0.00 0.00 68.15 68.39 2hva h THR 149 CO -0.00 0.56 0.44 1.56 0.37 0.00 0.00 175.52 178.44 2hva h GLN 150 N 0.43 0.86 -0.57 6.66 4.20 -0.90 -1.01 115.11 124.78 2hva h GLN 150 Ca -0.01 -0.05 0.02 0.00 0.06 0.00 0.00 58.65 58.67 2hva h GLN 150 Cb 1.16 -0.19 -0.03 0.00 0.30 0.00 0.00 27.48 28.72 2hva h GLN 150 CO 0.12 0.57 0.35 1.25 -0.67 0.00 0.00 178.83 180.45 2hva h LEU 151 N 0.88 0.58 -0.30 1.46 5.85 -1.41 0.25 115.31 122.63 2hva h LEU 151 Ca 0.26 -0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.98 2hva h LEU 151 Cb -0.05 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 40.84 2hva h LEU 151 CO -0.08 0.41 0.17 -0.09 -0.34 0.00 0.00 178.44 178.51 2hva h ARG 152 N 0.70 0.41 -0.35 1.25 2.43 -1.25 0.08 114.38 117.65 2hva h ARG 152 Ca 0.22 -0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 59.34 2hva h ARG 152 Cb -0.01 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 29.44 2hva h ARG 152 CO -0.08 0.34 0.20 1.15 -1.51 0.00 0.00 179.97 180.07 2hva h THR 153 N 0.37 1.13 -0.49 0.20 2.02 -0.75 -0.36 112.91 115.03 2hva h THR 153 Ca 0.11 -0.34 0.04 0.00 0.77 0.00 0.00 66.41 66.99 2hva h THR 153 Cb 0.05 0.72 -0.04 0.00 -1.74 0.00 0.00 68.15 67.14 2hva h THR 153 CO -0.02 0.14 0.25 0.74 0.37 0.00 0.00 175.52 177.00 2hva h THR 154 N 0.45 0.98 0.00 3.16 2.02 -0.25 -0.12 112.91 119.13 2hva h THR 154 Ca 0.12 -0.17 0.00 0.00 0.77 0.00 0.00 66.41 67.13 2hva h THR 154 Cb 0.04 0.43 0.00 0.00 -1.74 0.00 0.00 68.15 66.88 2hva h THR 154 CO -0.02 0.09 0.00 0.18 0.37 0.00 0.00 175.52 176.14 2hva n LEU 155 N -4.88 0.00 -0.32 2.58 4.77 -0.01 -3.56 117.00 115.58 2hva n LEU 155 Ca 0.04 0.50 0.15 0.00 -0.03 0.00 0.00 56.01 56.66 2hva n LEU 155 Cb 0.12 -0.50 0.34 0.00 -2.33 0.00 0.00 43.42 41.05 2hva n LEU 155 CO 0.30 -0.17 1.07 -0.08 -1.33 0.00 0.00 177.39 177.18 2hva h GLU 156 N 0.00 0.40 0.00 3.23 4.57 0.76 0.76 114.58 124.30 2hva h GLU 156 Ca 0.00 -0.02 -0.04 0.00 -1.18 0.00 0.00 59.36 58.12 2hva h GLU 156 Cb 0.33 -0.09 -0.01 0.00 -0.16 0.00 0.00 28.75 28.82 2hva h GLU 156 CO 0.00 0.26 -0.18 0.78 -1.18 0.00 0.00 179.01 178.69 2hva h GLY 157 N 0.41 0.00 -2.37 1.92 0.00 -1.73 -3.44 103.07 97.87 2hva h GLY 157 Ca 0.59 0.00 -0.46 0.00 0.00 0.00 0.00 47.33 47.46 2hva h GLY 157 CO -0.54 0.00 -0.13 -0.51 0.00 0.00 0.00 176.54 175.36 2hva s THR 158 N -4.31 4.24 -0.88 4.70 -4.23 0.26 -4.99 115.64 110.44 2hva s THR 158 Ca -0.03 -0.52 0.02 0.00 -1.18 0.00 0.00 61.69 59.98 2hva s THR 158 Cb 0.14 -3.56 0.12 0.00 1.34 0.00 0.00 72.50 70.54 2hva s THR 158 CO 0.64 -0.37 0.69 -0.81 -0.54 0.00 0.00 174.62 174.23 2hva n PRO 159 N -1.98 1.57 -1.72 3.99 -0.04 -1.26 -4.93 135.00 130.63 2hva n PRO 159 Ca -0.00 -0.46 -0.38 0.00 -0.04 0.00 0.00 63.50 62.62 2hva n PRO 159 Cb 0.57 -1.61 0.05 0.00 -0.04 0.00 0.00 33.50 32.48 2hva n PRO 159 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2hva n ALA 160 N 0.09 1.18 -2.07 0.55 0.00 -1.26 -5.02 120.51 113.97 2hva n ALA 160 Ca 0.04 0.06 -0.20 0.00 0.00 0.00 0.00 53.44 53.35 2hva n ALA 160 Cb 0.39 -2.30 0.04 0.00 0.00 0.00 0.00 19.45 17.58 2hva n ALA 160 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2hva s THR 161 N -1.36 2.28 0.10 0.00 2.01 -1.26 -4.99 115.64 112.43 2hva s THR 161 Ca 0.76 -1.06 -0.19 0.00 0.31 0.00 0.00 61.69 61.51 2hva s THR 161 Cb -0.41 -2.34 0.05 0.00 0.01 0.00 0.00 72.50 69.81 2hva s THR 161 CO 0.45 0.00 0.47 -0.31 -0.69 0.00 0.00 174.62 174.54 2hva s TYR 162 N -2.61 -0.33 -0.09 4.92 2.02 -1.26 -4.30 117.35 115.70 2hva s TYR 162 Ca 0.57 0.15 0.01 0.00 -0.37 0.00 0.00 57.07 57.43 2hva s TYR 162 Cb -0.06 0.33 -0.25 0.00 -0.40 0.00 0.00 41.96 41.58 2hva s TYR 162 CO 0.36 -0.70 0.48 1.04 -1.57 0.00 0.00 175.55 175.16 2hva n GLN 163 N -0.03 0.71 -3.55 -0.62 1.13 -0.82 -4.10 117.38 110.10 2hva n GLN 163 Ca -0.17 0.28 -0.19 0.00 -1.94 0.00 0.00 57.00 54.97 2hva n GLN 163 Cb 0.63 -1.74 0.07 0.00 0.11 0.00 0.00 30.24 29.30 2hva n GLN 163 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2hva n GLY 164 N 1.82 -0.34 0.55 1.08 0.00 -1.26 -4.80 105.19 102.23 2hva n GLY 164 Ca -0.26 0.12 0.00 0.00 0.00 0.00 0.00 46.02 45.88 2hva n GLY 164 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2hva n ASP 165 N -3.09 0.00 -3.63 1.61 2.03 -1.26 -5.13 116.55 107.08 2hva n ASP 165 Ca -0.27 0.00 -0.12 0.00 0.52 0.00 0.00 54.79 54.92 2hva n ASP 165 Cb 0.66 0.13 -0.07 0.00 -0.72 0.00 0.00 41.12 41.12 2hva n ASP 165 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 2hva s VAL 166 N -1.27 0.00 0.34 5.18 0.11 -1.26 -4.07 120.40 119.43 2hva s VAL 166 Ca 0.00 0.00 0.03 0.00 -2.93 0.00 0.00 61.98 59.08 2hva s VAL 166 Cb 0.00 -1.00 -0.05 0.00 -1.53 0.00 0.00 36.38 33.80 2hva s VAL 166 CO 0.00 0.00 0.08 -0.72 -3.33 0.00 0.00 175.10 171.13 2hva s TYR 167 N 0.71 1.87 0.19 1.54 1.13 -0.70 -4.62 117.35 117.47 2hva s TYR 167 Ca -0.03 -1.07 0.08 0.00 -1.41 0.00 0.00 57.07 54.65 2hva s TYR 167 Cb -0.05 -1.21 -0.04 0.00 -1.10 0.00 0.00 41.96 39.56 2hva s TYR 167 CO -0.05 -0.11 -0.05 0.71 -2.51 0.00 0.00 175.55 173.55 2hva s TYR 168 N -3.32 2.71 0.01 -3.49 1.51 -0.33 0.98 117.35 115.43 2hva s TYR 168 Ca 0.33 -0.19 -0.02 0.00 -1.01 0.00 0.00 57.07 56.18 2hva s TYR 168 Cb 0.07 -1.30 -0.01 0.00 -0.11 0.00 0.00 41.96 40.61 2hva s TYR 168 CO 0.15 0.53 0.02 0.00 -1.11 0.00 0.00 175.55 175.14 2hva s ALA 170 N -1.33 2.32 0.00 0.00 0.00 0.14 -2.14 121.76 120.74 2hva s ALA 170 Ca -0.15 -1.07 0.00 0.00 0.00 0.00 0.00 51.96 50.75 2hva s ALA 170 Cb -0.09 -1.05 0.00 0.00 0.00 0.00 0.00 23.12 21.99 2hva s ALA 170 CO -0.00 -0.00 0.26 0.41 0.00 0.00 0.00 175.76 176.42 2hva n GLY 171 N 4.02 -0.28 5.14 0.00 0.00 -1.26 -1.00 105.19 111.81 2hva n GLY 171 Ca -0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.82 2hva n GLY 171 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2hva n TYR 172 N -0.36 0.00 -5.04 1.61 4.01 -1.26 -4.54 117.16 111.58 2hva n TYR 172 Ca 0.00 0.00 -0.28 0.00 -0.16 0.00 0.00 57.90 57.46 2hva n TYR 172 Cb 0.02 0.00 -0.16 0.00 -0.31 0.00 0.00 39.34 38.89 2hva n TYR 172 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 2hva s ASP 173 N -4.00 2.56 1.05 7.72 1.01 -1.26 -4.67 116.67 119.07 2hva s ASP 173 Ca 0.00 -0.41 -0.13 0.00 0.71 0.00 0.00 52.55 52.72 2hva s ASP 173 Cb 0.00 -0.58 0.18 0.00 1.01 0.00 0.00 42.92 43.53 2hva s ASP 173 CO 0.00 0.22 0.83 -2.65 0.21 0.00 0.00 175.17 173.78 2hva n PRO 174 N 2.90 -1.32 -1.66 8.23 -0.02 -1.26 -4.85 135.00 137.02 2hva n PRO 174 Ca -0.17 -0.34 -0.45 0.00 -2.02 0.00 0.00 63.50 60.52 2hva n PRO 174 Cb 0.52 -2.13 -0.04 0.00 -0.02 0.00 0.00 33.50 31.84 2hva n PRO 174 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 2hva n PRO 175 N -3.83 2.47 0.00 0.52 -0.02 -1.26 -4.39 135.00 128.49 2hva n PRO 175 Ca 0.06 0.89 0.00 0.00 -2.02 0.00 0.00 63.50 62.43 2hva n PRO 175 Cb 0.54 -2.87 0.00 0.00 -0.02 0.00 0.00 33.50 31.15 2hva n PRO 175 CO 0.00 0.00 0.00 -0.12 1.98 0.00 0.00 175.50 177.36 2hva n MET 176 N 7.32 0.00 -3.54 -0.52 1.56 -1.26 -5.07 117.12 115.60 2hva n MET 176 Ca 0.23 0.00 -0.41 0.00 -0.27 0.00 0.00 57.70 57.24 2hva n MET 176 Cb 0.36 0.00 -0.07 0.00 2.15 0.00 0.00 33.22 35.66 2hva n MET 176 CO 0.00 0.00 0.00 0.15 -0.73 0.00 0.00 175.97 175.39 2hva s LYS 177 N -1.62 2.90 0.98 2.12 -0.14 -1.26 -5.08 119.74 117.63 2hva s LYS 177 Ca 0.00 -2.33 -0.12 0.00 -1.36 0.00 0.00 55.97 52.16 2hva s LYS 177 Cb 0.00 -4.02 0.18 0.00 -1.68 0.00 0.00 37.83 32.31 2hva s LYS 177 CO 0.00 -1.22 1.09 -1.25 -0.76 0.00 0.00 175.35 173.21 2hva s PRO 178 N 0.35 0.61 -0.56 -1.68 0.04 -1.26 -4.54 135.00 127.96 2hva s PRO 178 Ca 0.15 0.56 -0.09 0.00 0.04 0.00 0.00 61.00 61.66 2hva s PRO 178 Cb -0.18 -1.75 0.01 0.00 0.04 0.00 0.00 34.50 32.61 2hva s PRO 178 CO -0.05 -2.62 0.64 0.66 0.04 0.00 0.00 177.00 175.67 2hva n TYR 179 N -4.10 -3.24 0.00 0.56 4.02 -1.26 -4.86 117.16 108.28 2hva n TYR 179 Ca 0.06 1.28 0.00 0.00 -0.01 0.00 0.00 57.90 59.22 2hva n TYR 179 Cb 0.57 -4.09 0.00 0.00 -0.02 0.00 0.00 39.34 35.80 2hva n TYR 179 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2hva n GLY 180 N -0.95 0.36 3.51 2.72 0.00 -1.26 -5.17 105.19 104.40 2hva n GLY 180 Ca 0.07 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.83 2hva n GLY 180 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2hva s ARG 181 N 0.00 1.83 -0.05 1.61 1.81 -1.26 -5.09 118.95 117.79 2hva s ARG 181 Ca 0.00 -1.49 -0.01 0.00 -1.72 0.00 0.00 55.73 52.52 2hva s ARG 181 Cb 0.00 -1.97 0.03 0.00 -0.45 0.00 0.00 34.95 32.56 2hva s ARG 181 CO 0.00 0.39 -0.00 1.03 -0.68 0.00 0.00 175.30 176.04 2hva s ARG 182 N -3.04 0.51 -0.06 3.54 3.00 -1.26 -4.94 118.95 116.70 2hva s ARG 182 Ca 0.26 0.09 0.06 0.00 0.00 0.00 0.00 55.73 56.13 2hva s ARG 182 Cb -0.07 -0.79 -0.01 0.00 0.00 0.00 0.00 34.95 34.08 2hva s ARG 182 CO 0.14 -0.23 -0.24 -0.80 0.00 0.00 0.00 175.30 174.17 2hva s ASN 183 N 1.58 2.94 0.03 0.23 0.01 -1.26 -4.32 114.94 114.16 2hva s ASN 183 Ca -0.01 -0.49 -0.06 0.00 -0.71 0.00 0.00 52.86 51.59 2hva s ASN 183 Cb -0.13 -0.81 -0.01 0.00 0.41 0.00 0.00 41.25 40.71 2hva s ASN 183 CO -0.03 0.23 0.10 -1.61 -1.51 0.00 0.00 177.10 174.28 2hva s GLU 184 N -0.13 0.57 -0.08 -0.60 8.01 -0.17 -4.21 118.70 122.09 2hva s GLU 184 Ca -0.04 -0.71 0.03 0.00 0.01 0.00 0.00 54.97 54.26 2hva s GLU 184 Cb -0.13 0.23 0.01 0.00 -4.31 0.00 0.00 34.13 29.92 2hva s GLU 184 CO 0.04 -0.14 -0.18 0.08 0.01 0.00 0.00 175.26 175.07 2hva s VAL 185 N -2.44 1.57 -0.23 2.63 1.01 -1.25 0.25 120.40 121.94 2hva s VAL 185 Ca -0.06 -0.73 -0.06 0.00 0.00 0.00 0.00 61.98 61.12 2hva s VAL 185 Cb -0.02 -1.39 -0.02 0.00 0.00 0.00 0.00 36.38 34.95 2hva s VAL 185 CO -0.04 0.45 0.03 0.26 0.00 0.00 0.00 175.10 175.80 2hva s TRP 186 N 0.53 3.05 -0.08 5.22 0.51 0.30 -3.87 118.94 124.60 2hva s TRP 186 Ca -0.16 -0.52 -0.15 0.00 -2.12 0.00 0.00 56.10 53.15 2hva s TRP 186 Cb -0.17 -2.16 -0.05 0.00 -0.81 0.00 0.00 33.47 30.28 2hva s TRP 186 CO 0.06 -0.35 0.38 -0.51 -0.51 0.00 0.00 176.95 176.02 2hva s LEU 187 N 1.38 4.36 -0.22 2.99 1.43 -1.22 -1.19 118.68 126.21 2hva s LEU 187 Ca 0.05 0.78 -0.28 0.00 -1.03 0.00 0.00 54.13 53.64 2hva s LEU 187 Cb -0.15 -2.52 0.00 0.00 0.03 0.00 0.00 46.19 43.56 2hva s LEU 187 CO 0.02 0.19 0.99 -0.69 0.23 0.00 0.00 176.35 177.08 2hva s VAL 188 N -0.25 4.73 -0.35 -1.59 1.01 -1.26 -3.51 120.40 119.17 2hva s VAL 188 Ca 0.22 1.92 -0.22 0.00 0.00 0.00 0.00 61.98 63.89 2hva s VAL 188 Cb -0.15 -4.26 0.00 0.00 0.00 0.00 0.00 36.38 31.97 2hva s VAL 188 CO 0.09 -0.14 0.72 -0.75 0.00 0.00 0.00 175.10 175.03 2hva s LYS 189 N 3.03 3.77 0.00 2.72 2.20 -1.08 -1.93 119.74 128.45 2hva s LYS 189 Ca 0.42 0.26 0.25 0.00 -0.36 0.00 0.00 55.97 56.55 2hva s LYS 189 Cb -0.15 -3.79 1.52 0.00 -1.51 0.00 0.00 37.83 33.89 2hva s LYS 189 CO 0.07 -0.77 1.87 0.00 -0.36 0.00 0.00 175.35 176.17