#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hva n LEU 2 N 0.00 0.00 0.00 4.03 0.00 -1.26 -4.91 117.00 114.86 2hva n LEU 2 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56.01 56.01 2hva n LEU 2 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43.42 43.42 2hva n LEU 2 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 177.39 178.00 2hva n GLY 3 N 0.00 1.25 3.22 -3.96 0.00 -1.26 -4.87 105.19 99.58 2hva n GLY 3 Ca 0.00 -0.56 -0.13 0.00 0.00 0.00 0.00 46.02 45.33 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 1.20 -0.33 1.61 -1.94 -1.26 -5.08 119.30 113.49 2hva s MET 4 Ca 0.00 -1.62 0.06 0.00 -1.71 0.00 0.00 55.69 52.42 2hva s MET 4 Cb 0.00 0.08 0.24 0.00 2.01 0.00 0.00 34.83 37.17 2hva s MET 4 CO 0.00 -0.32 1.20 1.51 -0.01 0.00 0.00 175.02 177.40 2hva n ILE 5 N -0.29 0.00 -4.09 2.53 3.06 -1.26 -5.13 119.36 114.18 2hva n ILE 5 Ca -0.01 -1.01 -0.35 0.00 -2.50 0.00 0.00 62.75 58.89 2hva n ILE 5 Cb 0.65 0.81 -0.14 0.00 0.54 0.00 0.00 39.64 41.50 2hva n ILE 5 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 2hva s ARG 6 N 0.11 3.41 0.31 9.51 1.04 -1.26 -5.11 118.95 126.97 2hva s ARG 6 Ca 0.12 -0.62 0.04 0.00 -1.04 0.00 0.00 55.73 54.22 2hva s ARG 6 Cb 0.25 -2.94 -0.06 0.00 -2.04 0.00 0.00 34.95 30.16 2hva s ARG 6 CO -0.06 -0.09 0.05 0.54 -0.04 0.00 0.00 175.30 175.70 2hva s ASN 7 N 1.19 2.28 0.13 -2.89 4.22 -1.26 -5.12 114.94 113.49 2hva s ASN 7 Ca 0.02 -1.35 -0.31 0.00 -2.14 0.00 0.00 52.86 49.08 2hva s ASN 7 Cb -0.14 -0.07 -0.08 0.00 1.28 0.00 0.00 41.25 42.24 2hva s ASN 7 CO -0.01 -0.58 1.39 -0.44 -2.04 0.00 0.00 177.10 175.41 2hva s SER 8 N -3.46 6.82 0.16 3.54 0.01 -1.26 -4.92 113.70 114.58 2hva s SER 8 Ca 0.35 2.36 -0.07 0.00 1.31 0.00 0.00 55.95 59.90 2hva s SER 8 Cb 0.08 -2.59 0.00 0.00 0.21 0.00 0.00 66.02 63.72 2hva s SER 8 CO 0.14 -0.65 1.44 -0.07 0.41 0.00 0.00 173.24 174.52 2hva h LEU 9 N 6.58 0.80 -7.93 2.44 3.38 -2.05 -3.37 115.31 115.16 2hva h LEU 9 Ca -0.43 -0.44 -0.67 0.00 0.09 0.00 0.00 57.88 56.44 2hva h LEU 9 Cb 1.21 -0.23 -0.12 0.00 0.09 0.00 0.00 40.66 41.61 2hva h LEU 9 CO 0.85 1.20 1.63 -0.36 0.09 0.00 0.00 178.44 181.85 2hva s PHE 10 N -4.02 2.88 0.00 1.13 0.08 -1.26 -4.90 117.98 111.89 2hva s PHE 10 Ca -0.09 -1.44 0.00 0.00 0.12 0.00 0.00 56.93 55.52 2hva s PHE 10 Cb 0.11 -4.59 0.00 0.00 -0.57 0.00 0.00 43.02 37.97 2hva s PHE 10 CO 0.87 -1.73 0.00 0.41 -0.10 0.00 0.00 175.22 174.67 2hva n GLY 11 N 5.65 0.92 3.69 4.36 0.00 -1.26 -4.95 105.19 113.60 2hva n GLY 11 Ca 0.38 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.98 2hva n GLY 11 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2hva s SER 12 N -1.00 7.06 0.00 1.61 0.01 -1.26 -5.03 113.70 115.09 2hva s SER 12 Ca 0.00 1.79 0.05 0.00 1.31 0.00 0.00 55.95 59.09 2hva s SER 12 Cb 0.00 -2.56 -0.01 0.00 0.21 0.00 0.00 66.02 63.66 2hva s SER 12 CO 0.00 -0.58 -0.15 -0.69 0.41 0.00 0.00 173.24 172.23 2hva s VAL 13 N 2.25 1.16 0.03 3.43 1.01 -1.26 -5.15 120.40 121.87 2hva s VAL 13 Ca 0.55 -0.72 0.08 0.00 0.00 0.00 0.00 61.98 61.89 2hva s VAL 13 Cb -0.24 -0.99 -0.02 0.00 0.00 0.00 0.00 36.38 35.13 2hva s VAL 13 CO 0.21 0.26 -0.23 -1.61 0.00 0.00 0.00 175.10 173.73 2hva s GLU 14 N -0.53 1.65 -0.11 2.72 2.02 -1.26 -5.13 118.70 118.04 2hva s GLU 14 Ca 0.05 -0.98 0.01 0.00 0.02 0.00 0.00 54.97 54.08 2hva s GLU 14 Cb -0.06 -1.75 -0.01 0.00 0.10 0.00 0.00 34.13 32.41 2hva s GLU 14 CO -0.00 0.46 -0.16 -0.08 0.02 0.00 0.00 175.26 175.50 2hva s THR 15 N -0.74 2.82 0.30 3.63 -1.32 -1.26 -5.13 115.64 113.95 2hva s THR 15 Ca 0.09 -0.75 0.07 0.00 -1.21 0.00 0.00 61.69 59.90 2hva s THR 15 Cb -0.09 -2.16 -0.03 0.00 -1.51 0.00 0.00 72.50 68.71 2hva s THR 15 CO 0.01 0.54 0.24 0.26 -2.21 0.00 0.00 174.62 173.46 2hva s TRP 16 N 0.23 2.96 0.00 9.09 0.51 -1.26 -4.98 118.94 125.49 2hva s TRP 16 Ca -0.10 -0.23 0.00 0.00 -2.12 0.00 0.00 56.10 53.65 2hva s TRP 16 Cb -0.16 -1.62 0.00 0.00 -0.81 0.00 0.00 33.47 30.89 2hva s TRP 16 CO 0.06 0.34 0.00 -0.35 -0.51 0.00 0.00 176.95 176.48 2hva n PRO 17 N -1.27 -0.65 -1.53 4.98 -0.04 -1.26 -4.06 135.00 131.17 2hva n PRO 17 Ca -0.04 0.00 -0.37 0.00 -0.04 0.00 0.00 63.50 63.04 2hva n PRO 17 Cb 0.59 0.00 -0.08 0.00 -0.04 0.00 0.00 33.50 33.98 2hva n PRO 17 CO 0.00 0.00 0.00 1.87 -0.04 0.00 0.00 175.50 177.33 2hva n TRP 18 N -2.13 1.10 -3.87 0.54 -0.00 -0.73 -4.39 117.44 107.97 2hva n TRP 18 Ca 0.00 0.21 -0.28 0.00 -0.00 0.00 0.00 57.50 57.42 2hva n TRP 18 Cb 0.00 -2.53 -0.16 0.00 -0.00 0.00 0.00 31.31 28.62 2hva n TRP 18 CO 0.00 0.00 0.00 -1.14 -0.00 0.00 0.00 177.69 176.55 2hva s GLN 19 N 8.55 1.29 -0.33 5.87 0.74 -1.16 -4.92 119.66 129.70 2hva s GLN 19 Ca 1.12 -0.60 -0.29 0.00 0.05 0.00 0.00 55.36 55.64 2hva s GLN 19 Cb -0.56 -2.15 -0.00 0.00 1.10 0.00 0.00 33.01 31.39 2hva s GLN 19 CO 0.34 -0.52 1.42 0.08 -0.55 0.00 0.00 175.29 176.07 2hva s VAL 20 N 1.63 3.94 -1.50 1.34 1.01 -1.26 -3.25 120.40 122.30 2hva s VAL 20 Ca -0.01 1.02 0.24 0.00 0.00 0.00 0.00 61.98 63.23 2hva s VAL 20 Cb -0.16 -4.07 0.02 0.00 0.00 0.00 0.00 36.38 32.16 2hva s VAL 20 CO -0.07 -0.55 1.24 0.18 0.00 0.00 0.00 175.10 175.89 2hva n LEU 21 N 8.35 1.21 -3.65 3.92 4.77 -1.05 -4.99 117.00 125.55 2hva n LEU 21 Ca 0.16 -0.41 -0.03 0.00 -0.03 0.00 0.00 56.01 55.70 2hva n LEU 21 Cb 0.47 -0.08 -0.01 0.00 -2.33 0.00 0.00 43.42 41.46 2hva n LEU 21 CO 0.66 0.25 0.85 -0.55 -1.33 0.00 0.00 177.39 177.27 2hva s SER 22 N -2.71 -0.17 0.32 -1.43 0.15 -1.26 -4.92 113.70 103.68 2hva s SER 22 Ca 0.16 -0.21 -0.05 0.00 0.70 0.00 0.00 55.95 56.55 2hva s SER 22 Cb 0.18 0.33 0.02 0.00 -1.71 0.00 0.00 66.02 64.84 2hva s SER 22 CO 0.66 -0.60 0.50 0.35 1.20 0.00 0.00 173.24 175.35 2hva n THR 23 N -0.40 0.00 0.00 6.45 -2.24 -1.26 -2.97 114.28 113.87 2hva n THR 23 Ca -0.07 -1.40 0.00 0.00 -2.27 0.00 0.00 64.05 60.32 2hva n THR 23 Cb 0.61 0.95 0.00 0.00 -2.10 0.00 0.00 70.33 69.79 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 -0.50 1.08 0.00 3.38 0.00 -1.23 -4.84 105.19 103.08 2hva n GLY 24 Ca -0.02 0.33 0.00 0.00 0.00 0.00 0.00 46.02 46.33 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 0.00 1.77 3.55 -0.02 0.00 -1.26 -1.03 105.19 108.20 2hva n GLY 25 Ca 0.00 -0.77 -0.10 0.00 0.00 0.00 0.00 46.02 45.15 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 1.40 0.38 1.61 1.02 -0.19 -4.88 119.74 119.09 2hva s LYS 26 Ca 0.00 -0.61 0.12 0.00 0.02 0.00 0.00 55.97 55.49 2hva s LYS 26 Cb 0.00 0.58 0.75 0.00 -0.52 0.00 0.00 37.83 38.65 2hva s LYS 26 CO 0.00 -0.62 1.86 1.49 -0.92 0.00 0.00 175.35 177.15 2hva h GLU 27 N 2.00 0.06 0.06 1.68 4.81 -2.02 -3.09 114.58 118.09 2hva h GLU 27 Ca -0.29 -0.02 -0.33 0.00 -0.13 0.00 0.00 59.36 58.59 2hva h GLU 27 Cb 1.29 -0.01 -0.03 0.00 0.63 0.00 0.00 28.75 30.63 2hva h GLU 27 CO 0.33 0.36 -1.88 -3.47 -0.73 0.00 0.00 179.01 173.62 2hva n ASP 28 N -4.16 1.51 -3.58 1.04 2.03 -1.26 -4.88 116.55 107.26 2hva n ASP 28 Ca -0.02 0.29 -0.15 0.00 0.52 0.00 0.00 54.79 55.43 2hva n ASP 28 Cb 0.36 -0.45 -0.13 0.00 -0.72 0.00 0.00 41.12 40.18 2hva n ASP 28 CO 0.00 0.00 0.00 0.68 -1.92 0.00 0.00 177.20 175.96 2hva s VAL 29 N -2.57 -0.38 0.05 5.18 -7.23 -1.17 -5.02 120.40 109.25 2hva s VAL 29 Ca -0.14 0.11 -0.08 0.00 -1.81 0.00 0.00 61.98 60.06 2hva s VAL 29 Cb 0.07 -0.54 -0.05 0.00 0.56 0.00 0.00 36.38 36.42 2hva s VAL 29 CO 0.79 -0.02 0.33 -0.94 -0.31 0.00 0.00 175.10 174.96 2hva s SER 30 N 2.38 6.56 0.09 4.85 1.04 -1.22 -1.02 113.70 126.38 2hva s SER 30 Ca 0.04 0.66 -0.02 0.00 0.48 0.00 0.00 55.95 57.11 2hva s SER 30 Cb -0.14 -2.13 -0.04 0.00 0.10 0.00 0.00 66.02 63.82 2hva s SER 30 CO -0.10 0.21 0.03 -0.72 0.98 0.00 0.00 173.24 173.64 2hva s TYR 31 N -1.36 0.61 -0.07 5.02 -0.85 -0.20 -3.72 117.35 116.78 2hva s TYR 31 Ca 0.31 -1.08 -0.03 0.00 -0.52 0.00 0.00 57.07 55.75 2hva s TYR 31 Cb -0.13 -0.38 0.04 0.00 0.38 0.00 0.00 41.96 41.87 2hva s TYR 31 CO 0.18 -0.46 0.15 -1.21 -1.52 0.00 0.00 175.55 172.68 2hva s GLU 32 N -3.97 0.08 -0.13 -3.49 8.01 -1.10 -3.55 118.70 114.55 2hva s GLU 32 Ca 0.14 0.43 -0.24 0.00 0.01 0.00 0.00 54.97 55.30 2hva s GLU 32 Cb 0.07 -0.20 -0.03 0.00 -4.31 0.00 0.00 34.13 29.66 2hva s GLU 32 CO -0.05 -0.20 0.75 -1.21 0.01 0.00 0.00 175.26 174.56 2hva s GLU 33 N 1.48 4.35 -0.05 1.61 2.02 -1.16 -3.19 118.70 123.76 2hva s GLU 33 Ca -0.06 0.91 -0.02 0.00 0.02 0.00 0.00 54.97 55.83 2hva s GLU 33 Cb -0.12 -3.52 0.04 0.00 0.10 0.00 0.00 34.13 30.63 2hva s GLU 33 CO -0.06 -0.15 0.10 -0.98 0.02 0.00 0.00 175.26 174.19 2hva s ARG 34 N 1.54 0.03 -0.20 1.61 1.70 -1.25 -2.53 118.95 119.84 2hva s ARG 34 Ca 0.37 0.33 -0.04 0.00 -0.47 0.00 0.00 55.73 55.93 2hva s ARG 34 Cb -0.17 -0.24 -0.01 0.00 -0.57 0.00 0.00 34.95 33.96 2hva s ARG 34 CO 0.15 -0.20 -0.05 0.00 -1.08 0.00 0.00 175.30 174.12 2hva s ALA 35 N 1.35 2.83 0.06 7.88 0.00 -1.20 -3.77 121.76 128.91 2hva s ALA 35 Ca -0.07 -1.10 0.04 0.00 0.00 0.00 0.00 51.96 50.84 2hva s ALA 35 Cb -0.12 -1.65 -0.03 0.00 0.00 0.00 0.00 23.12 21.32 2hva s ALA 35 CO -0.05 -0.29 -0.12 0.00 0.00 0.00 0.00 175.76 175.30 2hva h GLU 37 N 4.35 -0.36 0.00 0.00 5.08 -1.89 -3.30 114.58 118.46 2hva h GLU 37 Ca -0.39 0.02 0.00 0.00 -1.00 0.00 0.00 59.36 57.99 2hva h GLU 37 Cb 1.19 0.08 0.00 0.00 0.50 0.00 0.00 28.75 30.53 2hva h GLU 37 CO 0.40 -0.24 0.00 0.41 -1.00 0.00 0.00 179.01 178.58 2hva n GLY 38 N 0.48 2.16 1.06 -3.84 0.00 -1.26 -3.88 105.19 99.91 2hva n GLY 38 Ca -0.05 -0.31 0.00 0.00 0.00 0.00 0.00 46.02 45.66 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 0.79 3.51 -0.02 0.00 -1.26 -4.76 105.19 103.45 2hva n GLY 39 Ca 0.00 -0.57 -0.31 0.00 0.00 0.00 0.00 46.02 45.14 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 0.00 2.14 -0.00 1.61 3.01 -1.26 -4.14 119.74 121.10 2hva s LYS 40 Ca 0.00 -0.96 0.01 0.00 -1.01 0.00 0.00 55.97 54.01 2hva s LYS 40 Cb 0.00 -2.26 -0.00 0.00 -1.01 0.00 0.00 37.83 34.56 2hva s LYS 40 CO 0.00 0.54 -0.03 -0.06 0.51 0.00 0.00 175.35 176.31 2hva s PHE 41 N -1.01 0.28 -0.33 3.18 0.40 -0.87 -3.46 117.98 116.16 2hva s PHE 41 Ca 0.17 -0.06 -0.18 0.00 -0.60 0.00 0.00 56.93 56.26 2hva s PHE 41 Cb -0.11 -0.18 -0.01 0.00 0.51 0.00 0.00 43.02 43.23 2hva s PHE 41 CO 0.08 -0.01 0.50 0.00 0.70 0.00 0.00 175.22 176.49 2hva s ALA 42 N -0.09 3.50 0.19 5.36 0.00 -1.22 -1.79 121.76 127.70 2hva s ALA 42 Ca 0.01 -0.96 0.08 0.00 0.00 0.00 0.00 51.96 51.10 2hva s ALA 42 Cb -0.01 -2.98 -0.04 0.00 0.00 0.00 0.00 23.12 20.09 2hva s ALA 42 CO -0.00 -1.12 -0.04 0.95 0.00 0.00 0.00 175.76 175.55 2hva s THR 43 N 2.35 3.44 -0.05 0.00 -4.23 -0.87 -1.23 115.64 115.06 2hva s THR 43 Ca 0.19 -1.61 -0.00 0.00 -1.18 0.00 0.00 61.69 59.08 2hva s THR 43 Cb -0.16 -2.74 0.03 0.00 1.34 0.00 0.00 72.50 70.97 2hva s THR 43 CO 0.12 -0.16 -0.00 -0.69 -0.54 0.00 0.00 174.62 173.36 2hva s VAL 44 N -1.82 0.27 -0.16 2.29 1.01 -1.06 -3.01 120.40 117.92 2hva s VAL 44 Ca 0.27 0.09 -0.14 0.00 0.00 0.00 0.00 61.98 62.20 2hva s VAL 44 Cb -0.09 -0.39 -0.05 0.00 0.00 0.00 0.00 36.38 35.86 2hva s VAL 44 CO 0.17 0.20 0.30 -0.70 0.00 0.00 0.00 175.10 175.07 2hva s GLU 45 N 1.40 4.24 -0.09 2.72 2.56 -1.26 -1.46 118.70 126.81 2hva s GLU 45 Ca -0.04 0.11 -0.03 0.00 0.00 0.00 0.00 54.97 55.01 2hva s GLU 45 Cb -0.13 -3.42 0.04 0.00 2.00 0.00 0.00 34.13 32.62 2hva s GLU 45 CO -0.03 0.25 0.05 0.08 -0.56 0.00 0.00 175.26 175.05 2hva s VAL 46 N 0.43 0.09 0.48 3.70 1.01 -1.17 -5.03 120.40 119.91 2hva s VAL 46 Ca 0.17 0.11 0.07 0.00 0.00 0.00 0.00 61.98 62.34 2hva s VAL 46 Cb -0.13 -0.44 0.01 0.00 0.00 0.00 0.00 36.38 35.83 2hva s VAL 46 CO 0.04 0.06 0.45 0.42 0.00 0.00 0.00 175.10 176.07 2hva s THR 47 N 2.08 2.30 -0.92 3.92 -4.23 -1.26 -3.79 115.64 113.73 2hva s THR 47 Ca 0.04 -1.33 -0.04 0.00 -1.18 0.00 0.00 61.69 59.18 2hva s THR 47 Cb -0.13 -2.62 0.03 0.00 1.34 0.00 0.00 72.50 71.11 2hva s THR 47 CO -0.05 0.00 0.18 -0.67 -0.54 0.00 0.00 174.62 173.53 2hva n ASP 48 N -1.72 -3.10 -3.68 3.99 -0.08 -1.25 -4.91 116.55 105.79 2hva n ASP 48 Ca 0.04 0.02 -0.09 0.00 -1.51 0.00 0.00 54.79 53.25 2hva n ASP 48 Cb 0.62 -2.65 -0.10 0.00 2.34 0.00 0.00 41.12 41.34 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 -5.42 0.43 0.00 -0.67 1.02 -1.26 -5.05 119.74 108.79 2hva s LYS 49 Ca 0.16 0.93 0.00 0.00 0.02 0.00 0.00 55.97 57.08 2hva s LYS 49 Cb -0.09 0.10 0.00 0.00 -0.52 0.00 0.00 37.83 37.33 2hva s LYS 49 CO 0.20 -0.18 0.00 -2.30 -0.92 0.00 0.00 175.35 172.15 2hva n PRO 50 N 4.55 -0.84 0.04 -1.68 -0.02 -1.26 -4.32 135.00 131.47 2hva n PRO 50 Ca -0.19 0.00 -0.11 0.00 -2.02 0.00 0.00 63.50 61.17 2hva n PRO 50 Cb 0.54 0.00 -0.08 0.00 -0.02 0.00 0.00 33.50 33.94 2hva n PRO 50 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2hva h VAL 51 N -1.71 0.98 -0.44 -1.45 2.07 -1.96 -0.57 116.25 113.17 2hva h VAL 51 Ca 0.00 -1.18 -0.05 0.00 0.82 0.00 0.00 66.70 66.29 2hva h VAL 51 Cb 0.00 1.64 -0.02 0.00 -1.52 0.00 0.00 31.29 31.39 2hva h VAL 51 CO 0.00 0.25 0.09 -2.24 0.02 0.00 0.00 177.57 175.69 2hva h ASP 52 N -0.80 0.69 -0.22 0.57 2.03 -1.92 -1.85 116.42 114.92 2hva h ASP 52 Ca -0.02 -0.25 -0.04 0.00 -0.73 0.00 0.00 57.03 55.99 2hva h ASP 52 Cb 0.55 -0.18 -0.01 0.00 -0.83 0.00 0.00 39.33 38.86 2hva h ASP 52 CO 0.03 0.76 -0.03 -0.08 -1.03 0.00 0.00 179.24 178.88 2hva h GLU 53 N 0.59 0.40 -0.89 4.15 4.57 -1.91 -3.07 114.58 118.43 2hva h GLU 53 Ca 0.14 -0.15 0.03 0.00 -1.18 0.00 0.00 59.36 58.20 2hva h GLU 53 Cb 0.35 -0.03 -0.05 0.00 -0.16 0.00 0.00 28.75 28.86 2hva h GLU 53 CO 0.01 0.63 0.58 0.00 -1.18 0.00 0.00 179.01 179.04 2hva h ALA 54 N 0.76 1.16 -0.67 2.92 0.00 -1.06 -1.84 119.26 120.53 2hva h ALA 54 Ca 0.06 -0.04 0.07 0.00 0.00 0.00 0.00 54.91 54.99 2hva h ALA 54 Cb 0.47 -0.32 -0.04 0.00 0.00 0.00 0.00 17.79 17.90 2hva h ALA 54 CO 0.02 0.44 0.44 -0.07 0.00 0.00 0.00 179.25 180.09 2hva h LEU 55 N 1.13 0.59 -1.26 0.00 3.38 -1.27 0.92 115.31 118.80 2hva h LEU 55 Ca 0.35 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 58.29 2hva h LEU 55 Cb -0.02 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.59 2hva h LEU 55 CO -0.11 0.38 0.11 0.03 0.09 0.00 0.00 178.44 178.94 2hva h ARG 56 N 0.67 0.62 0.00 1.13 3.08 -1.24 0.31 114.38 118.95 2hva h ARG 56 Ca 0.29 -0.11 -0.22 0.00 0.07 0.00 0.00 59.98 60.01 2hva h ARG 56 Cb 0.30 -0.11 -0.04 0.00 0.08 0.00 0.00 29.97 30.20 2hva h ARG 56 CO -0.09 0.56 -1.39 1.49 -1.07 0.00 0.00 179.97 179.47 2hva h GLU 57 N 0.61 0.00 -0.08 0.04 4.57 -0.96 -3.36 114.58 115.39 2hva h GLU 57 Ca 0.14 0.00 -0.11 0.00 -1.18 0.00 0.00 59.36 58.21 2hva h GLU 57 Cb 0.22 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.81 2hva h GLU 57 CO -0.00 0.52 -0.37 0.00 -1.18 0.00 0.00 179.01 177.97 2hva h ALA 58 N 1.17 0.15 -0.70 2.92 0.00 0.13 -3.30 119.26 119.63 2hva h ALA 58 Ca -0.18 -0.46 0.05 0.00 0.00 0.00 0.00 54.91 54.32 2hva h ALA 58 Cb 1.79 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 19.52 2hva h ALA 58 CO 0.08 0.24 0.42 0.52 0.00 0.00 0.00 179.25 180.51 2hva h MET 59 N -0.08 0.77 -0.87 0.00 2.86 -0.57 -1.10 114.93 115.95 2hva h MET 59 Ca -0.02 -0.05 0.05 0.00 -2.06 0.00 0.00 59.70 57.62 2hva h MET 59 Cb 1.02 -0.17 -0.06 0.00 0.06 0.00 0.00 31.60 32.45 2hva h MET 59 CO 0.08 0.51 0.55 -1.35 1.06 0.00 0.00 176.91 177.76 2hva h PRO 60 N 0.79 1.01 -0.16 -0.22 0.11 -1.71 1.07 132.00 132.89 2hva h PRO 60 Ca 0.30 -0.06 -0.08 0.00 0.11 0.00 0.00 66.00 66.27 2hva h PRO 60 Cb 0.11 -0.23 -0.00 0.00 0.11 0.00 0.00 31.00 30.99 2hva h PRO 60 CO -0.15 0.67 -0.20 0.87 -0.21 0.00 0.00 178.00 178.98 2hva h LYS 61 N 1.04 0.42 0.00 1.05 1.57 -1.53 -2.85 116.57 116.27 2hva h LYS 61 Ca 0.36 -0.24 -0.13 0.00 -1.87 0.00 0.00 60.65 58.78 2hva h LYS 61 Cb 0.08 0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.39 2hva h LYS 61 CO -0.14 0.81 -0.61 0.97 -0.57 0.00 0.00 179.45 179.91 2hva h ILE 62 N 0.05 1.22 -0.54 1.86 2.10 -0.94 -3.20 117.51 118.06 2hva h ILE 62 Ca 0.02 -2.26 -0.09 0.00 1.08 0.00 0.00 64.86 63.60 2hva h ILE 62 Cb 0.75 2.30 -0.02 0.00 -1.09 0.00 0.00 36.82 38.76 2hva h ILE 62 CO 0.05 0.60 -0.02 0.24 -1.08 0.00 0.00 178.15 177.93 2hva h MET 63 N 0.00 0.95 -0.67 2.19 2.86 0.12 -2.58 114.93 117.79 2hva h MET 63 Ca -0.01 -0.29 0.02 0.00 -2.06 0.00 0.00 59.70 57.36 2hva h MET 63 Cb 1.25 -0.09 -0.04 0.00 0.06 0.00 0.00 31.60 32.78 2hva h MET 63 CO 0.08 0.95 0.45 -0.22 1.06 0.00 0.00 176.91 179.23 2hva h LYS 64 N 0.87 0.82 0.35 1.72 1.63 -1.49 0.86 116.57 121.33 2hva h LYS 64 Ca 0.16 -0.05 -0.02 0.00 -0.85 0.00 0.00 60.65 59.89 2hva h LYS 64 Cb 0.55 -0.19 0.00 0.00 -0.60 0.00 0.00 32.23 31.99 2hva h LYS 64 CO 0.03 0.55 -0.17 -0.92 -3.45 0.00 0.00 179.45 175.49 2hva h TYR 65 N 0.85 -0.44 0.00 1.91 3.20 -1.58 -1.93 116.97 118.99 2hva h TYR 65 Ca 0.26 -0.01 -0.06 0.00 3.14 0.00 0.00 58.73 62.06 2hva h TYR 65 Cb -0.00 0.14 -0.01 0.00 1.54 0.00 0.00 36.73 38.40 2hva h TYR 65 CO -0.00 -0.10 -0.29 -0.39 -1.64 0.00 0.00 178.16 175.73 2hva h VAL 66 N -0.93 1.12 0.00 1.81 -1.51 -1.30 -3.41 116.25 112.03 2hva h VAL 66 Ca -0.05 -1.03 0.00 0.00 -1.23 0.00 0.00 66.70 64.39 2hva h VAL 66 Cb 0.53 1.57 0.00 0.00 -2.13 0.00 0.00 31.29 31.26 2hva h VAL 66 CO 0.08 0.29 0.00 0.61 -1.23 0.00 0.00 177.57 177.31 2hva n GLY 67 N -0.59 -1.14 2.44 5.19 0.00 0.30 -4.79 105.19 106.59 2hva n GLY 67 Ca -0.02 -0.22 -0.23 0.00 0.00 0.00 0.00 46.02 45.55 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 2.53 5.37 2.27 -0.02 0.00 -1.25 -4.83 105.19 109.26 2hva n GLY 68 Ca 0.00 -2.51 -0.18 0.00 0.00 0.00 0.00 46.02 43.33 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 -0.47 -0.26 -0.03 2.61 -1.04 -0.73 -4.89 114.28 109.48 2hva n THR 69 Ca 0.35 -4.01 0.01 0.00 -2.04 0.00 0.00 64.05 58.36 2hva n THR 69 Cb 0.74 -0.37 -0.09 0.00 -1.82 0.00 0.00 70.33 68.79 2hva n THR 69 CO 0.00 0.00 0.00 -0.46 -0.64 0.00 0.00 175.07 173.97 2hva n ASN 70 N 0.58 2.25 0.00 8.00 0.23 -1.26 -3.69 115.26 121.37 2hva n ASN 70 Ca 0.21 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 54.26 2hva n ASN 70 Cb 0.64 1.23 0.00 0.00 -2.08 0.00 0.00 39.78 39.57 2hva n ASN 70 CO 0.00 0.00 0.00 -0.67 -0.93 0.00 0.00 177.26 175.66 2hva n ASP 71 N -2.12 0.00 -0.05 0.53 -0.08 -1.26 -4.20 116.55 109.37 2hva n ASP 71 Ca -0.09 0.00 -0.20 0.00 -1.51 0.00 0.00 54.79 52.99 2hva n ASP 71 Cb 0.54 -0.07 -0.13 0.00 2.34 0.00 0.00 41.12 43.80 2hva n ASP 71 CO 0.00 0.00 0.00 1.17 0.12 0.00 0.00 177.20 178.49 2hva n LYS 72 N -2.00 0.71 -0.54 -0.67 3.00 -1.26 -5.04 118.16 112.36 2hva n LYS 72 Ca 0.00 0.23 0.00 0.00 -0.00 0.00 0.00 58.31 58.54 2hva n LYS 72 Cb 0.00 -1.64 0.00 0.00 0.00 0.00 0.00 35.03 33.39 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 2.05 0.54 3.14 3.14 0.00 -1.26 -5.11 105.19 107.69 2hva n GLY 73 Ca -0.37 -0.57 -0.20 0.00 0.00 0.00 0.00 46.02 44.88 2hva n GLY 73 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2hva n VAL 74 N -0.40 0.00 -3.64 1.61 0.24 -1.26 -5.16 118.33 109.71 2hva n VAL 74 Ca 0.00 -2.36 -0.19 0.00 -2.04 0.00 0.00 64.34 59.74 2hva n VAL 74 Cb 0.18 1.14 -0.16 0.00 -1.47 0.00 0.00 33.84 33.53 2hva n VAL 74 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 2hva s GLY 75 N -3.29 0.15 0.00 7.63 0.00 -1.26 -5.04 107.32 105.51 2hva s GLY 75 Ca 0.37 0.27 0.00 0.00 0.00 0.00 0.00 44.72 45.36 2hva s GLY 75 CO 0.26 1.62 0.00 1.03 0.00 0.00 0.00 173.10 176.01 2hva n MET 76 N 5.31 3.26 -0.00 2.90 2.81 -1.26 -5.09 117.12 125.04 2hva n MET 76 Ca -0.04 0.00 -0.01 0.00 -1.81 0.00 0.00 57.70 55.84 2hva n MET 76 Cb 0.50 0.00 -0.00 0.00 -0.71 0.00 0.00 33.22 33.00 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 5.00 -0.02 1.86 3.03 0.00 -1.26 -5.13 105.19 108.67 2hva n GLY 77 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.01 2hva n GLY 77 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 2hva n MET 78 N -2.41 -4.92 -0.52 1.61 1.56 -1.26 -4.95 117.12 106.23 2hva n MET 78 Ca -0.01 3.54 -0.29 0.00 -0.27 0.00 0.00 57.70 60.67 2hva n MET 78 Cb 0.52 -3.75 0.25 0.00 2.15 0.00 0.00 33.22 32.38 2hva n MET 78 CO 0.00 0.00 0.00 0.99 -0.73 0.00 0.00 175.97 176.23 2hva s THR 79 N -0.57 2.01 -0.18 1.12 2.01 -1.26 -4.99 115.64 113.78 2hva s THR 79 Ca 0.00 0.00 -0.22 0.00 0.31 0.00 0.00 61.69 61.79 2hva s THR 79 Cb 0.00 -2.02 -0.22 0.00 0.01 0.00 0.00 72.50 70.27 2hva s THR 79 CO 0.00 -0.00 0.38 0.58 -0.69 0.00 0.00 174.62 174.89 2hva h VAL 80 N -2.58 1.11 -3.32 3.82 2.07 -2.02 -3.46 116.25 111.86 2hva h VAL 80 Ca -0.59 -2.25 -0.57 0.00 0.82 0.00 0.00 66.70 64.10 2hva h VAL 80 Cb 1.32 2.55 -0.08 0.00 -1.52 0.00 0.00 31.29 33.57 2hva h VAL 80 CO 0.48 0.45 -0.12 -2.16 0.02 0.00 0.00 177.57 176.24 2hva s PRO 81 N -2.36 4.34 0.23 1.57 0.04 -1.26 -5.08 135.00 132.49 2hva s PRO 81 Ca -0.25 0.49 -0.06 0.00 0.04 0.00 0.00 61.00 61.21 2hva s PRO 81 Cb 0.04 -3.43 -0.06 0.00 0.04 0.00 0.00 34.50 31.09 2hva s PRO 81 CO 0.64 0.17 0.50 0.08 0.04 0.00 0.00 177.00 178.44 2hva s VAL 82 N 0.57 5.04 0.05 -0.36 1.01 -1.26 -4.94 120.40 120.52 2hva s VAL 82 Ca 0.27 0.14 0.07 0.00 0.00 0.00 0.00 61.98 62.46 2hva s VAL 82 Cb -0.15 -3.68 -0.03 0.00 0.00 0.00 0.00 36.38 32.52 2hva s VAL 82 CO 0.11 -0.16 -0.20 -0.94 0.00 0.00 0.00 175.10 173.91 2hva s SER 83 N -2.77 2.43 0.09 3.32 1.04 -1.25 -3.46 113.70 113.09 2hva s SER 83 Ca 0.44 -0.55 0.04 0.00 0.48 0.00 0.00 55.95 56.36 2hva s SER 83 Cb -0.11 -0.19 -0.03 0.00 0.10 0.00 0.00 66.02 65.79 2hva s SER 83 CO 0.26 0.13 -0.10 0.72 0.98 0.00 0.00 173.24 175.23 2hva s PHE 84 N -0.87 1.05 -0.07 5.02 -0.71 -0.75 -0.50 117.98 121.14 2hva s PHE 84 Ca 0.07 -0.61 -0.13 0.00 -1.04 0.00 0.00 56.93 55.21 2hva s PHE 84 Cb -0.09 -0.58 -0.05 0.00 -1.21 0.00 0.00 43.02 41.09 2hva s PHE 84 CO 0.02 0.00 0.34 0.00 -1.34 0.00 0.00 175.22 174.24 2hva s ALA 85 N -2.16 3.68 -0.07 1.99 0.00 0.98 -0.59 121.76 125.60 2hva s ALA 85 Ca 0.03 -0.35 0.01 0.00 0.00 0.00 0.00 51.96 51.65 2hva s ALA 85 Cb -0.05 -2.34 0.02 0.00 0.00 0.00 0.00 23.12 20.75 2hva s ALA 85 CO 0.00 0.37 -0.08 0.14 0.00 0.00 0.00 175.76 176.20 2hva s VAL 86 N -0.54 0.85 -0.57 0.00 -7.23 0.16 -2.72 120.40 110.35 2hva s VAL 86 Ca 0.21 -0.27 -0.17 0.00 -1.81 0.00 0.00 61.98 59.94 2hva s VAL 86 Cb -0.15 -0.84 0.12 0.00 0.56 0.00 0.00 36.38 36.07 2hva s VAL 86 CO 0.09 0.31 0.60 -0.36 -0.31 0.00 0.00 175.10 175.42 2hva s PHE 87 N 1.09 3.16 -0.02 2.82 0.40 -1.26 -1.83 117.98 122.34 2hva s PHE 87 Ca -0.08 -1.18 -0.30 0.00 -0.60 0.00 0.00 56.93 54.77 2hva s PHE 87 Cb -0.14 -3.89 -0.06 0.00 0.51 0.00 0.00 43.02 39.44 2hva s PHE 87 CO -0.01 -1.13 1.56 -1.25 0.70 0.00 0.00 175.22 175.09 2hva s PRO 88 N 2.00 4.21 0.64 0.24 0.04 -1.25 -4.17 135.00 136.71 2hva s PRO 88 Ca 0.07 2.12 -0.02 0.00 0.04 0.00 0.00 61.00 63.21 2hva s PRO 88 Cb -0.27 -3.78 0.06 0.00 0.04 0.00 0.00 34.50 30.54 2hva s PRO 88 CO 0.04 -0.74 0.90 1.21 0.04 0.00 0.00 177.00 178.45 2hva s ASN 89 N 2.67 4.97 0.35 6.66 2.47 -0.97 -4.90 114.94 126.20 2hva s ASN 89 Ca 0.70 0.15 0.26 0.00 0.42 0.00 0.00 52.86 54.39 2hva s ASN 89 Cb -0.33 -0.88 1.23 0.00 -1.45 0.00 0.00 41.25 39.82 2hva s ASN 89 CO 0.28 -1.42 1.79 -0.08 -3.72 0.00 0.00 177.10 173.95 2hva h GLU 90 N -0.28 0.00 -0.01 0.43 4.57 -1.95 -1.47 114.58 115.87 2hva h GLU 90 Ca -0.43 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.75 2hva h GLU 90 Cb 1.30 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.89 2hva h GLU 90 CO 0.54 0.00 -0.00 -3.47 -1.18 0.00 0.00 179.01 174.90 2hva n ASP 91 N -2.42 0.74 0.00 1.04 -0.08 -1.26 -4.90 116.55 109.68 2hva n ASP 91 Ca 0.00 -1.23 0.00 0.00 -1.51 0.00 0.00 54.79 52.05 2hva n ASP 91 Cb 0.15 -0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.61 2hva n ASP 91 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2hva n GLY 92 N 1.09 1.98 3.42 0.27 0.00 -0.55 -5.02 105.19 106.38 2hva n GLY 92 Ca 0.21 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 46.02 2hva n GLY 92 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2hva s SER 93 N -2.62 3.15 0.64 1.61 1.04 -1.26 -4.78 113.70 111.49 2hva s SER 93 Ca 0.00 -1.03 -0.11 0.00 0.48 0.00 0.00 55.95 55.29 2hva s SER 93 Cb 0.00 -0.23 -0.03 0.00 0.10 0.00 0.00 66.02 65.86 2hva s SER 93 CO 0.00 -0.06 1.04 -0.76 0.98 0.00 0.00 173.24 174.45 2hva s LEU 94 N -3.43 3.18 -0.54 2.42 1.43 -1.26 -2.29 118.68 118.19 2hva s LEU 94 Ca 0.27 1.43 -0.02 0.00 -1.03 0.00 0.00 54.13 54.78 2hva s LEU 94 Cb -0.03 -4.42 0.26 0.00 0.03 0.00 0.00 46.19 42.03 2hva s LEU 94 CO 0.12 -1.02 2.22 1.67 0.23 0.00 0.00 176.35 179.57 2hva n GLN 95 N -2.84 2.37 -2.26 1.70 7.27 -1.26 -4.80 117.38 117.55 2hva n GLN 95 Ca 0.06 -2.58 -0.13 0.00 0.07 0.00 0.00 57.00 54.42 2hva n GLN 95 Cb 0.54 -2.05 -0.01 0.00 2.41 0.00 0.00 30.24 31.13 2hva n GLN 95 CO 0.00 0.00 0.00 1.63 0.07 0.00 0.00 177.06 178.76 2hva n LYS 96 N -0.02 -2.03 -3.93 3.69 4.76 -1.26 -4.92 118.16 114.46 2hva n LYS 96 Ca 0.48 0.66 -0.33 0.00 -2.87 0.00 0.00 58.31 56.25 2hva n LYS 96 Cb 0.53 -5.21 -0.14 0.00 -1.84 0.00 0.00 35.03 28.38 2hva n LYS 96 CO 0.00 0.00 0.00 0.21 -1.37 0.00 0.00 177.40 176.24 2hva s LYS 97 N -4.72 1.69 -0.08 1.97 2.20 -1.26 -3.97 119.74 115.57 2hva s LYS 97 Ca 0.00 -1.89 0.02 0.00 -0.36 0.00 0.00 55.97 53.74 2hva s LYS 97 Cb 0.00 -3.35 0.01 0.00 -1.51 0.00 0.00 37.83 32.98 2hva s LYS 97 CO 0.00 -0.99 -0.13 -1.17 -0.36 0.00 0.00 175.35 172.70 2hva s LEU 98 N 0.94 1.63 -0.22 5.43 0.20 -1.25 -4.12 118.68 121.29 2hva s LEU 98 Ca 0.10 -0.34 -0.00 0.00 0.69 0.00 0.00 54.13 54.58 2hva s LEU 98 Cb -0.21 -0.92 0.03 0.00 -0.43 0.00 0.00 46.19 44.66 2hva s LEU 98 CO -0.06 0.02 -0.12 -1.59 -0.29 0.00 0.00 176.35 174.30 2hva s LYS 99 N 0.85 2.84 0.37 1.98 -2.85 -1.10 -3.06 119.74 118.77 2hva s LYS 99 Ca -0.11 -0.95 -0.27 0.00 -1.00 0.00 0.00 55.97 53.64 2hva s LYS 99 Cb -0.15 -2.81 -0.09 0.00 -2.06 0.00 0.00 37.83 32.71 2hva s LYS 99 CO 0.01 -0.34 1.29 0.08 0.10 0.00 0.00 175.35 176.50 2hva s VAL 100 N 1.29 2.72 -0.18 1.79 1.01 -0.53 -0.01 120.40 126.48 2hva s VAL 100 Ca 0.01 0.68 0.01 0.00 0.00 0.00 0.00 61.98 62.68 2hva s VAL 100 Cb -0.16 -3.42 0.02 0.00 0.00 0.00 0.00 36.38 32.83 2hva s VAL 100 CO -0.08 0.13 -0.19 0.26 0.00 0.00 0.00 175.10 175.22 2hva s TRP 101 N -1.22 2.77 0.15 5.22 0.52 0.34 -2.57 118.94 124.15 2hva s TRP 101 Ca 0.53 -1.67 0.05 0.00 0.02 0.00 0.00 56.10 55.03 2hva s TRP 101 Cb -0.38 -1.89 -0.04 0.00 -1.15 0.00 0.00 33.47 30.01 2hva s TRP 101 CO 0.50 -0.80 0.11 0.12 0.02 0.00 0.00 176.95 176.90 2hva s PHE 102 N 1.29 3.14 -0.20 -1.98 5.36 -0.37 -3.81 117.98 121.40 2hva s PHE 102 Ca 0.04 -0.01 -0.03 0.00 -0.96 0.00 0.00 56.93 55.97 2hva s PHE 102 Cb -0.14 -1.53 -0.01 0.00 -0.34 0.00 0.00 43.02 41.01 2hva s PHE 102 CO -0.12 0.52 -0.07 -0.98 -1.46 0.00 0.00 175.22 173.11 2hva s ARG 103 N -2.93 3.36 -0.10 10.12 1.70 -1.26 -3.43 118.95 126.41 2hva s ARG 103 Ca 0.30 -0.64 -0.11 0.00 -0.47 0.00 0.00 55.73 54.80 2hva s ARG 103 Cb -0.10 -2.92 -0.05 0.00 -0.57 0.00 0.00 34.95 31.31 2hva s ARG 103 CO 0.23 -0.12 0.26 0.42 -1.08 0.00 0.00 175.30 175.01 2hva s ILE 104 N 1.26 5.30 0.75 4.99 1.01 -1.22 -4.75 121.20 128.54 2hva s ILE 104 Ca 0.03 0.49 -0.15 0.00 0.00 0.00 0.00 60.65 61.03 2hva s ILE 104 Cb -0.14 -3.56 0.05 0.00 0.01 0.00 0.00 42.46 38.82 2hva s ILE 104 CO -0.03 0.53 1.23 -2.16 0.00 0.00 0.00 174.94 174.52 2hva s PRO 105 N -0.56 1.95 0.57 2.79 0.04 -1.26 -4.75 135.00 133.78 2hva s PRO 105 Ca 0.18 1.84 0.25 0.00 0.04 0.00 0.00 61.00 63.31 2hva s PRO 105 Cb -0.14 -1.80 1.63 0.00 0.04 0.00 0.00 34.50 34.23 2hva s PRO 105 CO 0.06 -2.00 2.20 -0.97 0.04 0.00 0.00 177.00 176.34 2hva h ASN 106 N -0.43 0.00 -0.56 6.66 -0.73 -1.98 -0.82 115.58 117.72 2hva h ASN 106 Ca -0.48 0.00 0.05 0.00 1.87 0.00 0.00 56.30 57.74 2hva h ASN 106 Cb 1.31 0.00 -0.05 0.00 0.27 0.00 0.00 38.32 39.85 2hva h ASN 106 CO 0.48 0.00 0.29 1.56 -0.37 0.00 0.00 177.43 179.40 2hva h GLN 107 N 0.00 0.54 -0.00 6.67 4.20 -1.99 -2.32 115.11 122.21 2hva h GLN 107 Ca 0.01 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.69 2hva h GLN 107 Cb 0.07 -0.12 0.00 0.00 0.30 0.00 0.00 27.48 27.73 2hva h GLN 107 CO -0.00 0.36 -0.72 1.19 -0.67 0.00 0.00 178.83 178.99 2hva n PHE 108 N -4.86 0.00 -0.28 2.96 3.01 -0.88 -4.25 117.46 113.16 2hva n PHE 108 Ca 0.06 0.00 0.13 0.00 1.01 0.00 0.00 57.45 58.65 2hva n PHE 108 Cb 0.15 -0.13 0.38 0.00 -0.01 0.00 0.00 39.48 39.87 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 0.07 0.66 0.00 -1.08 4.15 -0.57 0.80 115.11 119.14 2hva h GLN 109 Ca 0.00 -0.04 -0.02 0.00 0.77 0.00 0.00 58.65 59.36 2hva h GLN 109 Cb 0.50 -0.15 -0.00 0.00 0.21 0.00 0.00 27.48 28.04 2hva h GLN 109 CO 0.00 0.44 -0.12 0.78 -1.93 0.00 0.00 178.83 178.00 2hva h GLY 110 N 0.68 0.00 -5.00 2.39 0.00 -1.74 -3.40 103.07 96.01 2hva h GLY 110 Ca 0.47 0.00 -0.07 0.00 0.00 0.00 0.00 47.33 47.73 2hva h GLY 110 CO -0.23 0.00 -0.21 -1.14 0.00 0.00 0.00 176.54 174.96 2hva n SER 111 N -4.24 -1.93 -4.62 0.19 3.41 0.32 -5.16 113.62 101.59 2hva n SER 111 Ca -0.03 -1.81 -0.35 0.00 -0.26 0.00 0.00 58.87 56.42 2hva n SER 111 Cb 0.19 1.04 0.10 0.00 -0.26 0.00 0.00 64.21 65.28 2hva n SER 111 CO 0.00 0.00 0.00 -2.65 -0.16 0.00 0.00 175.04 172.23 2hva n PRO 112 N 2.23 0.33 -2.30 4.33 -0.02 0.25 -4.91 135.00 134.92 2hva n PRO 112 Ca 0.09 0.18 -0.33 0.00 -2.02 0.00 0.00 63.50 61.42 2hva n PRO 112 Cb 0.65 -2.25 -0.01 0.00 -0.02 0.00 0.00 33.50 31.87 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 -3.59 3.55 0.12 0.52 0.02 -1.26 -4.99 135.00 129.37 2hva s PRO 113 Ca 0.72 1.31 -0.31 0.00 0.02 0.00 0.00 61.00 62.73 2hva s PRO 113 Cb -0.32 -2.06 -0.08 0.00 0.02 0.00 0.00 34.50 32.06 2hva s PRO 113 CO 0.52 -0.63 1.45 0.00 -0.33 0.00 0.00 177.00 178.01 2hva s ALA 114 N -2.18 3.64 0.20 -1.55 0.00 -1.26 -4.98 121.76 115.63 2hva s ALA 114 Ca 0.66 1.17 -0.30 0.00 0.00 0.00 0.00 51.96 53.49 2hva s ALA 114 Cb -0.17 -3.57 -0.08 0.00 0.00 0.00 0.00 23.12 19.30 2hva s ALA 114 CO 0.28 -0.71 1.17 -1.25 0.00 0.00 0.00 175.76 175.25 2hva s PRO 115 N 1.30 4.53 -0.50 0.00 0.04 -1.26 -4.50 135.00 134.60 2hva s PRO 115 Ca 0.66 1.84 -0.04 0.00 0.04 0.00 0.00 61.00 63.50 2hva s PRO 115 Cb -0.38 -3.24 0.09 0.00 0.04 0.00 0.00 34.50 31.00 2hva s PRO 115 CO 0.30 -0.02 2.71 0.43 0.04 0.00 0.00 177.00 180.46 2hva n SER 116 N 2.31 6.58 -3.51 6.66 7.64 -1.24 -4.79 113.62 127.27 2hva n SER 116 Ca 0.03 -3.26 0.00 0.00 1.01 0.00 0.00 58.87 56.66 2hva n SER 116 Cb 0.45 -1.22 -0.03 0.00 -1.01 0.00 0.00 64.21 62.39 2hva n SER 116 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 2hva s ASP 117 N 0.23 -1.06 0.64 6.43 1.01 -1.26 -4.97 116.67 117.70 2hva s ASP 117 Ca 0.58 1.29 0.37 0.00 0.71 0.00 0.00 52.55 55.50 2hva s ASP 117 Cb 0.39 2.14 2.04 0.00 1.01 0.00 0.00 42.92 48.50 2hva s ASP 117 CO -0.24 -0.20 2.21 1.05 0.21 0.00 0.00 175.17 178.20 2hva h GLU 118 N 7.91 0.00 0.04 8.23 4.11 -2.01 -0.09 114.58 132.78 2hva h GLU 118 Ca -0.18 0.00 -0.24 0.00 0.07 0.00 0.00 59.36 59.00 2hva h GLU 118 Cb 1.11 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.34 2hva h GLU 118 CO 0.12 0.00 -1.19 0.66 0.07 0.00 0.00 179.01 178.66 2hva h SER 119 N 0.00 0.13 -3.33 3.06 4.64 -1.95 -3.44 113.55 112.67 2hva h SER 119 Ca 0.02 -0.15 -0.59 0.00 -0.47 0.00 0.00 61.79 60.59 2hva h SER 119 Cb 0.24 -0.04 -0.08 0.00 -0.31 0.00 0.00 62.40 62.20 2hva h SER 119 CO -0.00 1.12 0.35 -0.69 -0.87 0.00 0.00 176.83 176.75 2hva s VAL 120 N -2.67 4.90 0.13 0.95 1.01 -0.05 -4.41 120.40 120.26 2hva s VAL 120 Ca -0.02 1.50 0.08 0.00 0.00 0.00 0.00 61.98 63.55 2hva s VAL 120 Cb 0.09 -4.08 -0.04 0.00 0.00 0.00 0.00 36.38 32.35 2hva s VAL 120 CO 0.84 0.01 -0.20 -1.59 0.00 0.00 0.00 175.10 174.16 2hva s LYS 121 N 2.34 1.21 -0.28 2.72 -2.85 -1.16 -4.71 119.74 117.01 2hva s LYS 121 Ca 0.35 -1.29 -0.09 0.00 -1.00 0.00 0.00 55.97 53.94 2hva s LYS 121 Cb -0.16 -1.38 -0.02 0.00 -2.06 0.00 0.00 37.83 34.21 2hva s LYS 121 CO 0.10 0.30 0.12 0.42 0.10 0.00 0.00 175.35 176.39 2hva s ILE 122 N -1.59 4.48 -0.12 3.79 -1.09 -1.26 -2.05 121.20 123.36 2hva s ILE 122 Ca 0.11 -0.30 -0.09 0.00 -2.23 0.00 0.00 60.65 58.14 2hva s ILE 122 Cb -0.08 -3.20 -0.04 0.00 -1.58 0.00 0.00 42.46 37.56 2hva s ILE 122 CO 0.06 0.19 0.19 -1.61 -1.23 0.00 0.00 174.94 172.53 2hva s GLU 123 N 1.61 3.73 -0.27 2.79 2.02 -0.74 -4.86 118.70 122.98 2hva s GLU 123 Ca 0.05 -0.06 -0.00 0.00 0.02 0.00 0.00 54.97 54.98 2hva s GLU 123 Cb -0.16 -3.26 0.15 0.00 0.10 0.00 0.00 34.13 30.95 2hva s GLU 123 CO 0.05 0.62 0.39 -1.83 0.02 0.00 0.00 175.26 174.51 2hva s GLU 124 N -0.62 0.38 -0.41 1.61 -1.05 -1.26 -2.05 118.70 115.30 2hva s GLU 124 Ca 0.15 0.29 0.01 0.00 -0.15 0.00 0.00 54.97 55.27 2hva s GLU 124 Cb -0.12 -0.40 0.24 0.00 -0.44 0.00 0.00 34.13 33.40 2hva s GLU 124 CO 0.04 -0.86 1.02 -2.13 0.95 0.00 0.00 175.26 174.28 2hva n ARG 125 N 5.36 0.38 0.00 -4.83 0.00 -1.26 -5.07 116.66 111.23 2hva n ARG 125 Ca -0.01 -1.24 0.00 0.00 -0.00 0.00 0.00 57.85 56.60 2hva n ARG 125 Cb 0.49 -0.72 0.00 0.00 0.00 0.00 0.00 32.46 32.24 2hva n ARG 125 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.63 175.72 2hva n GLU 126 N 2.02 0.00 -1.10 -0.14 2.13 -1.26 -5.03 120.64 117.26 2hva n GLU 126 Ca 0.08 0.00 -0.30 0.00 0.66 0.00 0.00 57.16 57.60 2hva n GLU 126 Cb 0.65 0.00 0.25 0.00 0.27 0.00 0.00 31.44 32.61 2hva n GLU 126 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2hva n GLY 127 N -0.66 -2.71 2.90 8.31 0.00 -1.25 -4.90 105.19 106.88 2hva n GLY 127 Ca 0.00 -1.51 -0.11 0.00 0.00 0.00 0.00 46.02 44.40 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 -3.06 0.03 -0.16 -0.61 -5.25 -1.24 -5.07 121.20 105.83 2hva s ILE 128 Ca 0.72 -0.26 -0.02 0.00 -0.99 0.00 0.00 60.65 60.10 2hva s ILE 128 Cb -0.07 -0.08 -0.01 0.00 2.95 0.00 0.00 42.46 45.24 2hva s ILE 128 CO 0.55 -0.14 -0.09 -0.89 -1.79 0.00 0.00 174.94 172.58 2hva s THR 129 N -0.42 3.26 0.10 8.37 2.01 -1.26 -4.19 115.64 123.51 2hva s THR 129 Ca -0.05 -0.57 0.03 0.00 0.31 0.00 0.00 61.69 61.42 2hva s THR 129 Cb -0.03 -2.42 -0.04 0.00 0.01 0.00 0.00 72.50 70.03 2hva s THR 129 CO -0.00 0.49 -0.09 0.68 -0.69 0.00 0.00 174.62 175.01 2hva s VAL 130 N 0.71 0.87 -0.05 3.82 -7.23 -1.25 0.05 120.40 117.32 2hva s VAL 130 Ca -0.04 -1.78 -0.00 0.00 -1.81 0.00 0.00 61.98 58.34 2hva s VAL 130 Cb -0.15 -1.51 -0.03 0.00 0.56 0.00 0.00 36.38 35.24 2hva s VAL 130 CO 0.02 -0.69 -0.01 -0.31 -0.31 0.00 0.00 175.10 173.80 2hva s TYR 131 N -2.95 3.10 -0.16 2.82 2.02 -1.19 -3.86 117.35 117.12 2hva s TYR 131 Ca 0.09 0.13 -0.02 0.00 -0.37 0.00 0.00 57.07 56.89 2hva s TYR 131 Cb 0.01 -1.73 -0.02 0.00 -0.40 0.00 0.00 41.96 39.82 2hva s TYR 131 CO -0.02 0.45 -0.08 -1.54 -1.57 0.00 0.00 175.55 172.80 2hva s SER 132 N -1.13 4.34 -0.02 2.29 1.04 -1.19 -3.17 113.70 115.84 2hva s SER 132 Ca 0.16 -0.29 0.06 0.00 0.48 0.00 0.00 55.95 56.36 2hva s SER 132 Cb -0.11 -1.70 -0.01 0.00 0.10 0.00 0.00 66.02 64.29 2hva s SER 132 CO 0.05 0.11 -0.21 0.28 0.98 0.00 0.00 173.24 174.45 2hva s THR 133 N 0.69 1.67 0.02 2.02 -1.32 -1.24 -2.70 115.64 114.79 2hva s THR 133 Ca -0.04 -0.89 0.07 0.00 -1.21 0.00 0.00 61.69 59.62 2hva s THR 133 Cb -0.15 -1.40 -0.03 0.00 -1.51 0.00 0.00 72.50 69.41 2hva s THR 133 CO 0.02 0.47 -0.20 -1.10 -2.21 0.00 0.00 174.62 171.61 2hva s GLN 134 N -0.38 2.10 0.00 7.08 1.11 -1.24 -3.34 119.66 124.99 2hva s GLN 134 Ca 0.05 -0.95 0.00 0.00 0.01 0.00 0.00 55.36 54.47 2hva s GLN 134 Cb -0.09 -2.17 0.00 0.00 -1.01 0.00 0.00 33.01 29.74 2hva s GLN 134 CO 0.00 0.55 0.00 1.97 0.01 0.00 0.00 175.29 177.82 2hva n PHE 135 N 1.79 -0.13 -0.76 0.91 1.16 -1.18 -4.44 117.46 114.82 2hva n PHE 135 Ca -0.16 0.00 0.00 0.00 -1.87 0.00 0.00 57.45 55.42 2hva n PHE 135 Cb 0.52 0.24 0.00 0.00 -1.61 0.00 0.00 39.48 38.63 2hva n PHE 135 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 2hva n GLY 136 N 1.18 -1.87 0.00 4.97 0.00 -1.26 -4.97 105.19 103.24 2hva n GLY 136 Ca 0.00 -0.68 0.00 0.00 0.00 0.00 0.00 46.02 45.34 2hva n GLY 136 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2hva n GLY 137 N 0.76 1.14 2.68 -0.02 0.00 -1.26 -4.99 105.19 103.50 2hva n GLY 137 Ca 0.00 0.13 -0.20 0.00 0.00 0.00 0.00 46.02 45.94 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 1.15 -0.05 -0.09 1.61 2.02 -1.26 -4.92 117.35 115.81 2hva s TYR 138 Ca 0.00 -0.91 0.00 0.00 -0.37 0.00 0.00 57.07 55.79 2hva s TYR 138 Cb 0.00 -0.56 -0.02 0.00 -0.40 0.00 0.00 41.96 40.97 2hva s TYR 138 CO 0.00 -0.92 -0.09 0.00 -1.57 0.00 0.00 175.55 172.96 2hva s ALA 139 N 1.53 2.83 -0.21 3.71 0.00 -1.26 -5.00 121.76 123.36 2hva s ALA 139 Ca 0.16 -0.90 -0.09 0.00 0.00 0.00 0.00 51.96 51.13 2hva s ALA 139 Cb -0.17 -1.22 -0.10 0.00 0.00 0.00 0.00 23.12 21.64 2hva s ALA 139 CO -0.09 0.44 -0.25 1.63 0.00 0.00 0.00 175.76 177.48 2hva n LYS 140 N 2.76 0.45 0.03 0.00 5.02 -1.26 -4.93 118.16 120.23 2hva n LYS 140 Ca -0.18 0.18 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 2hva n LYS 140 Cb 0.53 -1.26 0.00 0.00 -0.02 0.00 0.00 35.03 34.27 2hva n LYS 140 CO 0.00 0.00 0.00 -1.91 -0.52 0.00 0.00 177.40 174.97 2hva n GLU 141 N -3.80 0.00 -0.07 1.97 0.00 -1.26 -4.61 120.64 112.87 2hva n GLU 141 Ca -0.40 0.00 0.10 0.00 0.00 0.00 0.00 57.16 56.86 2hva n GLU 141 Cb 0.80 0.00 0.48 0.00 0.00 0.00 0.00 31.44 32.73 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 1.95 -0.25 4.31 0.00 -1.97 0.34 119.26 123.64 2hva h ALA 142 Ca 0.00 -0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.79 2hva h ALA 142 Cb 0.00 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 2hva h ALA 142 CO 0.00 -0.06 -0.30 -0.44 0.00 0.00 0.00 179.25 178.45 2hva h ASP 143 N 0.45 0.52 -0.71 0.00 3.32 -1.92 -2.75 116.42 115.32 2hva h ASP 143 Ca 0.26 -0.19 -0.06 0.00 0.02 0.00 0.00 57.03 57.06 2hva h ASP 143 Cb 0.43 -0.14 -0.03 0.00 0.22 0.00 0.00 39.33 39.81 2hva h ASP 143 CO -0.07 0.79 0.22 1.88 -1.72 0.00 0.00 179.24 180.34 2hva h TYR 144 N 0.44 1.16 -0.95 4.55 0.05 -1.30 -2.03 116.97 118.88 2hva h TYR 144 Ca 0.06 -0.12 0.15 0.00 0.05 0.00 0.00 58.73 58.86 2hva h TYR 144 Cb 0.74 -0.33 -0.08 0.00 1.01 0.00 0.00 36.73 38.07 2hva h TYR 144 CO 0.03 0.92 0.60 0.28 -1.05 0.00 0.00 178.16 178.94 2hva h VAL 145 N 1.06 0.84 -0.16 -2.88 2.07 -1.10 0.31 116.25 116.39 2hva h VAL 145 Ca 0.23 -0.28 -0.13 0.00 0.82 0.00 0.00 66.70 67.35 2hva h VAL 145 Cb 0.31 -0.04 -0.01 0.00 -1.52 0.00 0.00 31.29 30.04 2hva h VAL 145 CO -0.01 0.15 -0.45 0.00 0.02 0.00 0.00 177.57 177.28 2hva h ALA 146 N 1.59 0.93 -0.32 1.67 0.00 -1.29 -2.75 119.26 119.09 2hva h ALA 146 Ca 0.49 -0.45 -0.14 0.00 0.00 0.00 0.00 54.91 54.80 2hva h ALA 146 Cb 0.68 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.38 2hva h ALA 146 CO -0.25 0.64 -0.35 0.45 0.00 0.00 0.00 179.25 179.73 2hva h HIS 147 N 0.32 0.97 -0.25 0.00 -0.00 -0.00 -2.98 115.15 113.20 2hva h HIS 147 Ca 0.02 -0.30 -0.02 0.00 -0.00 0.00 0.00 60.37 60.07 2hva h HIS 147 Cb 0.92 -0.20 -0.01 0.00 -0.00 0.00 0.00 27.41 28.12 2hva h HIS 147 CO 0.03 1.09 0.06 0.00 -0.00 0.00 0.00 177.93 179.11 2hva h ALA 148 N 0.72 1.64 -0.60 2.45 0.00 -0.72 -2.35 119.26 120.40 2hva h ALA 148 Ca 0.05 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 54.82 2hva h ALA 148 Cb 0.94 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.59 2hva h ALA 148 CO 0.09 0.28 0.25 1.15 0.00 0.00 0.00 179.25 181.02 2hva h THR 149 N 0.36 1.23 -0.44 0.00 2.02 -1.34 -1.69 112.91 113.05 2hva h THR 149 Ca 0.09 -0.69 0.02 0.00 0.77 0.00 0.00 66.41 66.60 2hva h THR 149 Cb 0.14 0.55 -0.03 0.00 -1.74 0.00 0.00 68.15 67.07 2hva h THR 149 CO -0.00 0.27 0.26 1.56 0.37 0.00 0.00 175.52 177.98 2hva h GLN 150 N 0.84 0.51 -0.88 6.66 1.08 -1.35 -1.79 115.11 120.17 2hva h GLN 150 Ca 0.20 -0.03 -0.02 0.00 -1.45 0.00 0.00 58.65 57.36 2hva h GLN 150 Cb 0.18 -0.12 -0.04 0.00 -0.05 0.00 0.00 27.48 27.45 2hva h GLN 150 CO -0.02 0.34 0.49 1.25 -0.95 0.00 0.00 178.83 179.94 2hva h LEU 151 N 0.53 1.10 -1.37 1.46 5.85 -1.34 -1.51 115.31 120.02 2hva h LEU 151 Ca 0.17 -0.09 0.03 0.00 0.84 0.00 0.00 57.88 58.83 2hva h LEU 151 Cb 0.00 -0.28 -0.04 0.00 0.37 0.00 0.00 40.66 40.71 2hva h LEU 151 CO -0.07 0.88 0.44 0.03 -0.34 0.00 0.00 178.44 179.38 2hva h ARG 152 N 1.24 0.80 -0.16 1.25 3.08 -0.62 -0.31 114.38 119.65 2hva h ARG 152 Ca 0.31 -0.05 -0.06 0.00 0.07 0.00 0.00 59.98 60.26 2hva h ARG 152 Cb 0.02 -0.18 -0.00 0.00 0.08 0.00 0.00 29.97 29.89 2hva h ARG 152 CO -0.05 0.53 -0.12 1.15 -1.07 0.00 0.00 179.97 180.41 2hva h THR 153 N 0.83 1.33 -0.20 2.04 2.02 -0.50 -1.09 112.91 117.34 2hva h THR 153 Ca 0.26 -1.23 0.03 0.00 0.77 0.00 0.00 66.41 66.24 2hva h THR 153 Cb 0.03 1.78 -0.03 0.00 -1.74 0.00 0.00 68.15 68.19 2hva h THR 153 CO -0.07 0.36 0.03 0.74 0.37 0.00 0.00 175.52 176.96 2hva h THR 154 N 0.03 0.90 0.00 3.16 2.02 -0.66 -0.92 112.91 117.43 2hva h THR 154 Ca 0.03 -0.04 0.00 0.00 0.77 0.00 0.00 66.41 67.17 2hva h THR 154 Cb 0.63 0.78 0.00 0.00 -1.74 0.00 0.00 68.15 67.82 2hva h THR 154 CO 0.03 0.02 0.00 0.18 0.37 0.00 0.00 175.52 176.12 2hva n LEU 155 N -5.09 0.00 -0.30 2.58 4.77 -0.19 -3.66 117.00 115.11 2hva n LEU 155 Ca -0.03 0.46 0.13 0.00 -0.03 0.00 0.00 56.01 56.54 2hva n LEU 155 Cb 0.09 -0.46 0.30 0.00 -2.33 0.00 0.00 43.42 41.02 2hva n LEU 155 CO 0.28 -0.14 1.02 -0.08 -1.33 0.00 0.00 177.39 177.14 2hva h GLU 156 N 0.00 0.34 0.00 3.23 4.81 0.20 0.83 114.58 123.99 2hva h GLU 156 Ca 0.00 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.21 2hva h GLU 156 Cb 0.32 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 29.62 2hva h GLU 156 CO 0.00 0.22 0.00 0.78 -0.73 0.00 0.00 179.01 179.28 2hva h GLY 157 N 0.35 0.00 -1.92 1.92 0.00 -1.73 -3.45 103.07 98.25 2hva h GLY 157 Ca 0.55 0.00 -0.44 0.00 0.00 0.00 0.00 47.33 47.44 2hva h GLY 157 CO -0.55 0.00 -0.06 -0.51 0.00 0.00 0.00 176.54 175.42 2hva s THR 158 N -3.29 2.87 -2.00 4.70 -4.23 0.29 -4.98 115.64 109.00 2hva s THR 158 Ca 0.06 -0.66 0.19 0.00 -1.18 0.00 0.00 61.69 60.10 2hva s THR 158 Cb 0.10 -3.07 0.55 0.00 1.34 0.00 0.00 72.50 71.42 2hva s THR 158 CO 0.45 -0.05 1.55 -2.65 -0.54 0.00 0.00 174.62 173.39 2hva n PRO 159 N -2.28 0.64 -1.68 3.99 -0.02 -1.26 -4.84 135.00 129.55 2hva n PRO 159 Ca 0.07 0.00 -0.45 0.00 -2.02 0.00 0.00 63.50 61.10 2hva n PRO 159 Cb 0.59 -1.47 -0.04 0.00 -0.02 0.00 0.00 33.50 32.56 2hva n PRO 159 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2hva n ALA 160 N -0.97 1.32 0.93 3.55 0.00 -1.26 -4.85 120.51 119.23 2hva n ALA 160 Ca 0.14 0.29 0.11 0.00 0.00 0.00 0.00 53.44 53.98 2hva n ALA 160 Cb 0.07 -2.55 0.05 0.00 0.00 0.00 0.00 19.45 17.02 2hva n ALA 160 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 2hva n THR 161 N 5.01 0.00 -1.04 0.00 -1.04 -1.26 -4.88 114.28 111.07 2hva n THR 161 Ca 0.21 -0.40 -0.07 0.00 -2.04 0.00 0.00 64.05 61.75 2hva n THR 161 Cb 0.34 1.36 -0.03 0.00 -1.82 0.00 0.00 70.33 70.18 2hva n THR 161 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 2hva n TYR 162 N 0.65 -0.28 0.00 -1.42 4.02 -1.25 -4.14 117.16 114.74 2hva n TYR 162 Ca 0.11 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 58.00 2hva n TYR 162 Cb 0.50 -1.97 0.00 0.00 -0.02 0.00 0.00 39.34 37.85 2hva n TYR 162 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 176.86 176.89 2hva n GLN 163 N -0.90 0.00 0.00 -0.72 1.13 -1.26 -4.16 117.38 111.48 2hva n GLN 163 Ca -0.07 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 54.99 2hva n GLN 163 Cb 0.34 0.00 0.00 0.00 0.11 0.00 0.00 30.24 30.69 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 0.00 -1.72 2.71 1.08 0.00 -1.26 -5.06 105.19 100.95 2hva n GLY 164 Ca 0.00 0.49 -0.09 0.00 0.00 0.00 0.00 46.02 46.42 2hva n GLY 164 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2hva n ASP 165 N -1.17 -2.61 -3.61 1.61 9.92 -1.26 -5.12 116.55 114.31 2hva n ASP 165 Ca 0.00 -3.34 -0.02 0.00 -0.53 0.00 0.00 54.79 50.90 2hva n ASP 165 Cb 0.00 1.70 -0.05 0.00 -0.64 0.00 0.00 41.12 42.13 2hva n ASP 165 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 2hva s VAL 166 N 0.49 -0.65 0.28 2.53 0.11 -1.26 -3.75 120.40 118.15 2hva s VAL 166 Ca 0.31 0.00 0.02 0.00 -2.93 0.00 0.00 61.98 59.37 2hva s VAL 166 Cb 0.24 -1.00 -0.05 0.00 -1.53 0.00 0.00 36.38 34.04 2hva s VAL 166 CO -0.21 0.00 0.09 -0.72 -3.33 0.00 0.00 175.10 170.93 2hva s TYR 167 N 2.46 1.64 0.22 1.54 1.13 -0.76 -4.11 117.35 119.48 2hva s TYR 167 Ca -0.07 -1.14 0.09 0.00 -1.41 0.00 0.00 57.07 54.55 2hva s TYR 167 Cb -0.09 -0.99 -0.04 0.00 -1.10 0.00 0.00 41.96 39.73 2hva s TYR 167 CO -0.19 -0.26 -0.02 0.71 -2.51 0.00 0.00 175.55 173.28 2hva s TYR 168 N -3.64 2.72 -0.04 -3.49 2.02 0.33 0.40 117.35 115.65 2hva s TYR 168 Ca 0.37 -0.20 0.01 0.00 -0.37 0.00 0.00 57.07 56.89 2hva s TYR 168 Cb 0.08 -1.27 0.02 0.00 -0.40 0.00 0.00 41.96 40.39 2hva s TYR 168 CO 0.14 0.57 -0.06 0.00 -1.57 0.00 0.00 175.55 174.63 2hva s ALA 170 N 0.74 2.04 0.00 0.00 0.00 -1.19 -1.80 121.76 121.55 2hva s ALA 170 Ca -0.11 -0.90 0.00 0.00 0.00 0.00 0.00 51.96 50.95 2hva s ALA 170 Cb -0.14 -0.80 0.00 0.00 0.00 0.00 0.00 23.12 22.19 2hva s ALA 170 CO 0.01 0.22 0.00 0.41 0.00 0.00 0.00 175.76 176.39 2hva n GLY 171 N 3.65 -0.68 1.61 0.00 0.00 -1.22 -3.77 105.19 104.77 2hva n GLY 171 Ca -0.20 -0.49 -0.09 0.00 0.00 0.00 0.00 46.02 45.25 2hva n GLY 171 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 2hva n TYR 172 N 1.87 -0.49 -1.29 1.61 4.11 -1.26 -4.33 117.16 117.37 2hva n TYR 172 Ca 0.00 -1.36 -0.36 0.00 -0.00 0.00 0.00 57.90 56.19 2hva n TYR 172 Cb 0.00 0.17 0.08 0.00 -0.00 0.00 0.00 39.34 39.59 2hva n TYR 172 CO 0.00 0.00 0.00 -0.25 -0.00 0.00 0.00 176.86 176.61 2hva n ASP 173 N -2.26 -0.26 -4.59 9.48 9.92 -1.26 -4.87 116.55 122.71 2hva n ASP 173 Ca 0.03 0.62 -0.42 0.00 -0.53 0.00 0.00 54.79 54.49 2hva n ASP 173 Cb 0.30 -1.33 -0.03 0.00 -0.64 0.00 0.00 41.12 39.43 2hva n ASP 173 CO 0.00 0.00 0.00 -2.16 0.13 0.00 0.00 177.20 175.17 2hva s PRO 174 N -3.13 3.31 0.00 -0.24 0.04 -1.26 -5.01 135.00 128.72 2hva s PRO 174 Ca 0.70 1.07 0.00 0.00 0.04 0.00 0.00 61.00 62.81 2hva s PRO 174 Cb -0.34 -4.16 0.00 0.00 0.04 0.00 0.00 34.50 30.04 2hva s PRO 174 CO 0.54 -1.89 0.00 -0.35 0.04 0.00 0.00 177.00 175.34 2hva n PRO 175 N 8.44 -0.51 0.00 0.56 -0.04 -1.26 -5.04 135.00 137.15 2hva n PRO 175 Ca 0.20 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.66 2hva n PRO 175 Cb 0.48 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.94 2hva n PRO 175 CO 0.00 0.00 0.00 -1.33 -0.04 0.00 0.00 175.50 174.13 2hva n MET 176 N -1.03 0.00 -3.17 0.54 2.81 -1.26 -5.01 117.12 109.99 2hva n MET 176 Ca 0.00 0.00 -0.43 0.00 -1.81 0.00 0.00 57.70 55.46 2hva n MET 176 Cb 0.00 -0.50 -0.07 0.00 -0.71 0.00 0.00 33.22 31.94 2hva n MET 176 CO 0.00 0.00 0.00 0.15 1.51 0.00 0.00 175.97 177.63 2hva s LYS 177 N -1.77 3.19 0.00 0.03 1.02 -1.26 -5.06 119.74 115.89 2hva s LYS 177 Ca 0.00 -0.61 0.00 0.00 0.02 0.00 0.00 55.97 55.38 2hva s LYS 177 Cb 0.00 -4.00 0.00 0.00 -0.52 0.00 0.00 37.83 33.31 2hva s LYS 177 CO 0.00 -1.04 0.00 -0.35 -0.92 0.00 0.00 175.35 173.04 2hva n PRO 178 N 6.10 -0.30 -2.26 -1.68 -0.04 -1.26 -4.37 135.00 131.19 2hva n PRO 178 Ca -0.04 0.00 -0.19 0.00 -0.04 0.00 0.00 63.50 63.23 2hva n PRO 178 Cb 0.47 0.00 -0.02 0.00 -0.04 0.00 0.00 33.50 33.91 2hva n PRO 178 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2hva n TYR 179 N -1.78 -0.80 -1.93 0.54 4.01 -1.26 -4.74 117.16 111.20 2hva n TYR 179 Ca 0.00 0.00 -0.01 0.00 -0.16 0.00 0.00 57.90 57.73 2hva n TYR 179 Cb 0.00 -3.68 0.00 0.00 -0.31 0.00 0.00 39.34 35.35 2hva n TYR 179 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2hva n GLY 180 N -0.97 -0.36 3.31 2.72 0.00 -1.26 -5.16 105.19 103.47 2hva n GLY 180 Ca -0.22 -0.01 -0.16 0.00 0.00 0.00 0.00 46.02 45.62 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 0.01 1.31 -0.06 1.61 1.81 -1.26 -5.11 118.95 117.26 2hva s ARG 181 Ca 0.01 -1.68 -0.02 0.00 -1.72 0.00 0.00 55.73 52.32 2hva s ARG 181 Cb 0.03 -0.42 0.04 0.00 -0.45 0.00 0.00 34.95 34.15 2hva s ARG 181 CO -0.01 -0.17 0.11 0.50 -0.68 0.00 0.00 175.30 175.05 2hva s ARG 182 N -3.93 0.02 -0.03 3.54 3.52 -1.26 -4.74 118.95 116.06 2hva s ARG 182 Ca 0.31 0.37 0.02 0.00 -0.13 0.00 0.00 55.73 56.30 2hva s ARG 182 Cb 0.07 -0.26 0.01 0.00 -1.56 0.00 0.00 34.95 33.20 2hva s ARG 182 CO 0.09 -0.22 -0.08 -0.80 -0.81 0.00 0.00 175.30 173.48 2hva s ASN 183 N 1.55 1.11 0.06 -2.12 0.01 -1.26 -4.77 114.94 109.52 2hva s ASN 183 Ca -0.04 -0.17 -0.08 0.00 -0.71 0.00 0.00 52.86 51.86 2hva s ASN 183 Cb -0.12 -0.38 -0.00 0.00 0.41 0.00 0.00 41.25 41.16 2hva s ASN 183 CO -0.05 0.03 0.16 -1.83 -1.51 0.00 0.00 177.10 173.90 2hva s GLU 184 N 0.42 0.73 -0.02 -0.60 -1.05 -1.25 -3.08 118.70 113.85 2hva s GLU 184 Ca -0.06 -0.81 0.06 0.00 -0.15 0.00 0.00 54.97 54.00 2hva s GLU 184 Cb -0.10 0.29 -0.01 0.00 -0.44 0.00 0.00 34.13 33.87 2hva s GLU 184 CO 0.01 -0.21 -0.20 0.08 0.95 0.00 0.00 175.26 175.89 2hva s VAL 185 N -3.15 1.58 -0.23 1.83 1.01 -1.21 -3.18 120.40 117.05 2hva s VAL 185 Ca -0.00 -0.85 -0.06 0.00 0.00 0.00 0.00 61.98 61.07 2hva s VAL 185 Cb 0.02 -1.32 -0.02 0.00 0.00 0.00 0.00 36.38 35.05 2hva s VAL 185 CO -0.07 0.45 0.03 0.26 0.00 0.00 0.00 175.10 175.77 2hva s TRP 186 N -0.39 3.06 -0.16 5.22 0.52 0.30 -3.59 118.94 123.89 2hva s TRP 186 Ca 0.06 -0.50 -0.10 0.00 0.02 0.00 0.00 56.10 55.57 2hva s TRP 186 Cb -0.08 -2.17 -0.05 0.00 -1.15 0.00 0.00 33.47 30.02 2hva s TRP 186 CO -0.00 -0.34 0.19 -0.51 0.02 0.00 0.00 176.95 176.30 2hva s LEU 187 N 1.40 4.28 -0.20 2.99 1.43 -1.19 0.12 118.68 127.51 2hva s LEU 187 Ca 0.05 0.40 -0.29 0.00 -1.03 0.00 0.00 54.13 53.26 2hva s LEU 187 Cb -0.15 -2.18 -0.01 0.00 0.03 0.00 0.00 46.19 43.89 2hva s LEU 187 CO 0.02 0.23 1.25 -0.69 0.23 0.00 0.00 176.35 177.40 2hva s VAL 188 N -0.09 4.29 0.38 -1.59 1.01 -1.26 -3.15 120.40 119.99 2hva s VAL 188 Ca 0.13 1.54 -0.23 0.00 0.00 0.00 0.00 61.98 63.41 2hva s VAL 188 Cb -0.12 -4.06 -0.10 0.00 0.00 0.00 0.00 36.38 32.10 2hva s VAL 188 CO 0.02 -0.21 0.95 -0.75 0.00 0.00 0.00 175.10 175.11 2hva s LYS 189 N 3.62 4.40 0.00 2.72 2.20 0.11 -3.94 119.74 128.85 2hva s LYS 189 Ca 0.54 1.22 0.15 0.00 -0.36 0.00 0.00 55.97 57.52 2hva s LYS 189 Cb -0.20 -2.48 0.12 0.00 -1.51 0.00 0.00 37.83 33.76 2hva s LYS 189 CO 0.16 0.12 0.97 0.00 -0.36 0.00 0.00 175.35 176.24