#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 3.58 -0.49 -0.89 1.98 -1.26 -5.05 118.68 116.56 2hva s LEU 2 Ca 0.00 1.32 0.05 0.00 -2.89 0.00 0.00 54.13 52.61 2hva s LEU 2 Cb 0.00 -4.27 0.22 0.00 0.66 0.00 0.00 46.19 42.80 2hva s LEU 2 CO 0.00 -0.60 0.85 0.61 -1.89 0.00 0.00 176.35 175.32 2hva n GLY 3 N -1.89 -0.35 3.87 7.98 0.00 -1.26 -5.15 105.19 108.39 2hva n GLY 3 Ca 0.04 0.35 -0.28 0.00 0.00 0.00 0.00 46.02 46.13 2hva n GLY 3 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2hva s MET 4 N 0.74 3.22 -0.05 1.61 0.00 -1.26 -5.12 119.30 118.45 2hva s MET 4 Ca 0.31 -0.63 0.03 0.00 0.00 0.00 0.00 55.69 55.40 2hva s MET 4 Cb 0.14 -2.88 0.01 0.00 0.00 0.00 0.00 34.83 32.10 2hva s MET 4 CO -0.16 0.55 -0.12 0.42 0.00 0.00 0.00 175.02 175.71 2hva s ILE 5 N -1.61 1.06 -0.13 10.11 1.09 -1.26 -5.14 121.20 125.33 2hva s ILE 5 Ca 0.33 -0.48 -0.04 0.00 -1.10 0.00 0.00 60.65 59.37 2hva s ILE 5 Cb -0.12 -0.96 -0.03 0.00 -1.06 0.00 0.00 42.46 40.30 2hva s ILE 5 CO 0.26 0.33 -0.01 -0.13 -0.10 0.00 0.00 174.94 175.29 2hva s ARG 6 N 0.41 3.48 -0.17 2.79 1.81 -1.26 -5.10 118.95 120.91 2hva s ARG 6 Ca -0.09 -0.46 -0.03 0.00 -1.72 0.00 0.00 55.73 53.44 2hva s ARG 6 Cb -0.13 -2.91 -0.02 0.00 -0.45 0.00 0.00 34.95 31.44 2hva s ARG 6 CO 0.02 0.41 -0.07 -0.80 -0.68 0.00 0.00 175.30 174.18 2hva s ASN 7 N -0.07 4.35 0.39 0.23 0.01 -1.26 -5.11 114.94 113.49 2hva s ASN 7 Ca 0.03 -0.29 -0.08 0.00 -0.71 0.00 0.00 52.86 51.82 2hva s ASN 7 Cb -0.13 -1.71 -0.05 0.00 0.41 0.00 0.00 41.25 39.77 2hva s ASN 7 CO 0.02 0.10 0.71 -0.44 -1.51 0.00 0.00 177.10 175.99 2hva s SER 8 N 0.74 6.44 0.45 -1.22 0.01 -1.26 -4.94 113.70 113.92 2hva s SER 8 Ca -0.03 0.97 0.00 0.00 1.31 0.00 0.00 55.95 58.20 2hva s SER 8 Cb -0.15 -2.26 0.00 0.00 0.21 0.00 0.00 66.02 63.83 2hva s SER 8 CO 0.02 -0.39 0.00 0.18 0.41 0.00 0.00 173.24 173.46 2hva n LEU 9 N -1.43 -0.84 -2.62 2.44 4.32 -1.26 -4.85 117.00 112.76 2hva n LEU 9 Ca 0.01 1.91 -0.21 0.00 -0.02 0.00 0.00 56.01 57.69 2hva n LEU 9 Cb 0.54 -4.67 0.01 0.00 -1.62 0.00 0.00 43.42 37.68 2hva n LEU 9 CO 0.49 -3.36 -0.13 0.33 -1.22 0.00 0.00 177.39 173.50 2hva n PHE 10 N -4.33 -1.44 0.00 -1.77 7.35 -1.26 -4.96 117.46 111.05 2hva n PHE 10 Ca -0.02 0.25 0.00 0.00 -0.76 0.00 0.00 57.45 56.92 2hva n PHE 10 Cb 0.68 -4.16 0.00 0.00 0.35 0.00 0.00 39.48 36.36 2hva n PHE 10 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 2hva n GLY 11 N -1.26 -1.87 3.70 7.13 0.00 -1.26 -4.70 105.19 106.93 2hva n GLY 11 Ca -0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.42 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 -1.85 6.61 0.01 1.61 0.15 -1.26 -5.00 113.70 113.96 2hva s SER 12 Ca 0.00 2.54 0.01 0.00 0.70 0.00 0.00 55.95 59.20 2hva s SER 12 Cb 0.00 -2.58 -0.01 0.00 -1.71 0.00 0.00 66.02 61.72 2hva s SER 12 CO 0.00 -0.85 -0.04 0.68 1.20 0.00 0.00 173.24 174.24 2hva s VAL 13 N 1.86 0.26 0.07 4.45 -7.23 -1.26 -5.16 120.40 113.38 2hva s VAL 13 Ca 0.72 -0.36 0.04 0.00 -1.81 0.00 0.00 61.98 60.56 2hva s VAL 13 Cb -0.41 -0.26 -0.03 0.00 0.56 0.00 0.00 36.38 36.23 2hva s VAL 13 CO 0.32 -0.07 -0.11 -1.61 -0.31 0.00 0.00 175.10 173.31 2hva s GLU 14 N -0.46 0.74 -0.27 4.82 2.02 -1.26 -5.13 118.70 119.15 2hva s GLU 14 Ca -0.03 -0.93 -0.14 0.00 0.02 0.00 0.00 54.97 53.89 2hva s GLU 14 Cb -0.04 -0.61 -0.04 0.00 0.10 0.00 0.00 34.13 33.55 2hva s GLU 14 CO -0.00 0.12 0.32 -0.08 0.02 0.00 0.00 175.26 175.64 2hva s THR 15 N -1.53 5.21 0.33 3.63 -1.32 -1.26 -5.08 115.64 115.62 2hva s THR 15 Ca -0.03 0.45 0.07 0.00 -1.21 0.00 0.00 61.69 60.97 2hva s THR 15 Cb -0.09 -3.65 -0.02 0.00 -1.51 0.00 0.00 72.50 67.24 2hva s THR 15 CO 0.01 0.18 0.39 0.26 -2.21 0.00 0.00 174.62 173.25 2hva s TRP 16 N 1.98 3.06 -0.20 9.09 0.23 -1.26 -5.04 118.94 126.80 2hva s TRP 16 Ca 0.13 -0.23 -0.29 0.00 -2.03 0.00 0.00 56.10 53.68 2hva s TRP 16 Cb -0.16 -1.87 -0.05 0.00 0.03 0.00 0.00 33.47 31.42 2hva s TRP 16 CO 0.10 0.11 2.00 -1.25 0.96 0.00 0.00 176.95 178.87 2hva s PRO 17 N -4.08 3.44 -0.65 4.98 0.04 -1.26 -3.36 135.00 134.10 2hva s PRO 17 Ca 0.42 1.95 -0.00 0.00 0.04 0.00 0.00 61.00 63.41 2hva s PRO 17 Cb -0.08 -4.25 -0.00 0.00 0.04 0.00 0.00 34.50 30.21 2hva s PRO 17 CO 0.29 -1.74 0.61 1.87 0.04 0.00 0.00 177.00 178.07 2hva n TRP 18 N 10.23 -2.62 -4.01 0.56 -0.00 0.29 -5.00 117.44 116.90 2hva n TRP 18 Ca 0.25 1.00 -0.31 0.00 -0.00 0.00 0.00 57.50 58.44 2hva n TRP 18 Cb 0.45 -3.80 -0.16 0.00 -0.00 0.00 0.00 31.31 27.80 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 -3.01 2.10 -0.27 5.87 2.00 -0.73 -4.88 119.66 120.73 2hva s GLN 19 Ca 0.00 -0.86 -0.29 0.00 -2.00 0.00 0.00 55.36 52.21 2hva s GLN 19 Cb -0.00 -2.44 -0.01 0.00 0.80 0.00 0.00 33.01 31.36 2hva s GLN 19 CO 0.66 -0.42 1.38 0.08 -0.50 0.00 0.00 175.29 176.48 2hva s VAL 20 N 1.38 4.04 -2.81 1.34 1.01 -1.26 -1.58 120.40 122.52 2hva s VAL 20 Ca -0.01 1.18 0.25 0.00 0.00 0.00 0.00 61.98 63.40 2hva s VAL 20 Cb -0.16 -4.04 0.32 0.00 0.00 0.00 0.00 36.38 32.50 2hva s VAL 20 CO -0.08 -0.41 1.43 0.18 0.00 0.00 0.00 175.10 176.22 2hva n LEU 21 N 7.76 2.48 -3.56 3.92 4.77 -0.66 -4.97 117.00 126.74 2hva n LEU 21 Ca 0.16 -0.83 -0.06 0.00 -0.03 0.00 0.00 56.01 55.24 2hva n LEU 21 Cb 0.46 -0.01 -0.02 0.00 -2.33 0.00 0.00 43.42 41.53 2hva n LEU 21 CO 0.63 0.42 0.82 -0.55 -1.33 0.00 0.00 177.39 177.38 2hva s SER 22 N -1.99 -0.26 0.00 -1.43 0.15 -1.23 -4.84 113.70 104.10 2hva s SER 22 Ca 0.32 -0.04 0.00 0.00 0.70 0.00 0.00 55.95 56.93 2hva s SER 22 Cb 0.20 0.30 0.00 0.00 -1.71 0.00 0.00 66.02 64.81 2hva s SER 22 CO 0.31 -0.49 0.00 0.35 1.20 0.00 0.00 173.24 174.61 2hva n THR 23 N -0.22 0.00 -1.70 6.45 -2.24 -1.26 -2.48 114.28 112.83 2hva n THR 23 Ca -0.05 0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 61.29 2hva n THR 23 Cb 0.61 -0.11 -0.02 0.00 -2.10 0.00 0.00 70.33 68.71 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 -0.36 0.89 3.32 3.38 0.00 -1.26 -4.54 105.19 106.63 2hva n GLY 24 Ca 0.00 0.43 -0.19 0.00 0.00 0.00 0.00 46.02 46.27 2hva n GLY 24 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2hva s GLY 25 N 0.17 2.10 0.66 -0.02 0.00 -1.26 -4.42 107.32 104.56 2hva s GLY 25 Ca 0.63 -1.79 -0.11 0.00 0.00 0.00 0.00 44.72 43.45 2hva s GLY 25 CO 0.53 -1.56 1.05 1.25 0.00 0.00 0.00 173.10 174.38 2hva s LYS 26 N -3.75 3.25 0.33 2.90 2.47 -0.57 -4.83 119.74 119.53 2hva s LYS 26 Ca 0.36 0.73 0.07 0.00 -1.56 0.00 0.00 55.97 55.57 2hva s LYS 26 Cb 0.04 -2.04 0.58 0.00 -1.46 0.00 0.00 37.83 34.95 2hva s LYS 26 CO 0.19 -0.82 1.80 1.49 0.16 0.00 0.00 175.35 178.17 2hva h GLU 27 N -0.50 0.31 0.07 4.03 4.81 -2.01 -3.12 114.58 118.16 2hva h GLU 27 Ca -0.44 -0.10 -0.33 0.00 -0.13 0.00 0.00 59.36 58.36 2hva h GLU 27 Cb 1.21 -0.02 -0.03 0.00 0.63 0.00 0.00 28.75 30.53 2hva h GLU 27 CO 0.61 0.54 -1.82 0.22 -0.73 0.00 0.00 179.01 177.83 2hva h ASP 28 N 0.28 0.22 -2.47 1.04 3.58 -1.98 -3.45 116.42 113.63 2hva h ASP 28 Ca 0.04 -0.48 -0.29 0.00 0.42 0.00 0.00 57.03 56.72 2hva h ASP 28 Cb 0.59 -0.07 -0.35 0.00 1.72 0.00 0.00 39.33 41.22 2hva h ASP 28 CO 0.04 1.43 -0.60 0.68 -2.88 0.00 0.00 179.24 177.91 2hva s VAL 29 N -2.58 -0.37 0.23 2.25 -7.23 -1.18 -4.88 120.40 106.64 2hva s VAL 29 Ca -0.13 -0.07 -0.02 0.00 -1.81 0.00 0.00 61.98 59.95 2hva s VAL 29 Cb 0.07 -0.67 -0.04 0.00 0.56 0.00 0.00 36.38 36.30 2hva s VAL 29 CO 0.80 -0.16 0.44 -0.94 -0.31 0.00 0.00 175.10 174.93 2hva s SER 30 N 2.36 6.40 0.05 4.85 1.04 -1.19 -1.52 113.70 125.70 2hva s SER 30 Ca 0.07 0.48 -0.00 0.00 0.48 0.00 0.00 55.95 56.98 2hva s SER 30 Cb -0.15 -2.04 -0.04 0.00 0.10 0.00 0.00 66.02 63.88 2hva s SER 30 CO -0.12 -0.09 -0.04 -0.72 0.98 0.00 0.00 173.24 173.25 2hva s TYR 31 N -1.95 0.53 -0.10 5.02 1.13 -1.26 -3.84 117.35 116.88 2hva s TYR 31 Ca 0.40 -0.96 -0.04 0.00 -1.41 0.00 0.00 57.07 55.06 2hva s TYR 31 Cb -0.11 -0.38 0.05 0.00 -1.10 0.00 0.00 41.96 40.43 2hva s TYR 31 CO 0.29 -0.32 0.21 -1.21 -2.51 0.00 0.00 175.55 172.02 2hva s GLU 32 N -3.50 0.10 -0.04 -3.49 2.02 -1.22 -4.28 118.70 108.29 2hva s GLU 32 Ca 0.04 0.62 -0.24 0.00 0.02 0.00 0.00 54.97 55.41 2hva s GLU 32 Cb 0.05 -0.15 -0.04 0.00 0.10 0.00 0.00 34.13 34.08 2hva s GLU 32 CO -0.08 -0.27 0.73 -2.00 0.02 0.00 0.00 175.26 173.66 2hva s GLU 33 N 2.14 4.45 -0.02 1.61 2.12 -1.04 -3.69 118.70 124.28 2hva s GLU 33 Ca 0.00 0.94 0.00 0.00 0.36 0.00 0.00 54.97 56.27 2hva s GLU 33 Cb -0.12 -3.42 0.03 0.00 0.26 0.00 0.00 34.13 30.88 2hva s GLU 33 CO -0.07 0.12 0.03 1.03 -0.54 0.00 0.00 175.26 175.83 2hva s ARG 34 N 0.58 -0.02 -0.26 4.30 0.52 -1.11 -1.65 118.95 121.31 2hva s ARG 34 Ca 0.38 0.17 -0.08 0.00 -0.52 0.00 0.00 55.73 55.68 2hva s ARG 34 Cb -0.19 -0.24 -0.04 0.00 0.52 0.00 0.00 34.95 35.01 2hva s ARG 34 CO 0.20 -0.16 0.11 0.00 0.02 0.00 0.00 175.30 175.46 2hva s ALA 35 N 1.01 3.27 -0.02 2.13 0.00 -0.61 -3.52 121.76 124.01 2hva s ALA 35 Ca -0.08 -1.11 0.03 0.00 0.00 0.00 0.00 51.96 50.79 2hva s ALA 35 Cb -0.12 -2.20 0.00 0.00 0.00 0.00 0.00 23.12 20.80 2hva s ALA 35 CO -0.03 -0.50 -0.09 0.00 0.00 0.00 0.00 175.76 175.14 2hva n GLU 37 N 3.22 2.51 0.00 0.00 1.02 -1.26 -3.81 120.64 122.31 2hva n GLU 37 Ca -0.17 -4.53 0.00 0.00 -0.02 0.00 0.00 57.16 52.43 2hva n GLU 37 Cb 0.55 -2.35 0.00 0.00 -0.02 0.00 0.00 31.44 29.62 2hva n GLU 37 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2hva n GLY 38 N 1.80 -2.25 0.00 0.62 0.00 -1.26 -4.97 105.19 99.13 2hva n GLY 38 Ca 0.23 -1.40 0.00 0.00 0.00 0.00 0.00 46.02 44.85 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 2.35 0.48 3.56 -0.02 0.00 -1.26 -4.28 105.19 106.02 2hva n GLY 39 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 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 2.12 0.06 1.61 3.01 -1.26 -1.86 119.74 123.43 2hva s LYS 40 Ca 0.00 -1.01 0.01 0.00 -1.01 0.00 0.00 55.97 53.96 2hva s LYS 40 Cb 0.00 -2.29 -0.04 0.00 -1.01 0.00 0.00 37.83 34.49 2hva s LYS 40 CO 0.00 0.51 -0.05 -0.06 0.51 0.00 0.00 175.35 176.26 2hva s PHE 41 N -1.17 0.66 -0.01 3.18 0.08 -1.19 -3.44 117.98 116.09 2hva s PHE 41 Ca 0.20 -0.84 -0.14 0.00 0.12 0.00 0.00 56.93 56.27 2hva s PHE 41 Cb -0.11 -0.42 -0.06 0.00 -0.57 0.00 0.00 43.02 41.87 2hva s PHE 41 CO 0.12 -0.21 0.38 0.00 -0.10 0.00 0.00 175.22 175.42 2hva s ALA 42 N -3.05 3.72 -0.03 5.36 0.00 -1.16 -2.68 121.76 123.92 2hva s ALA 42 Ca 0.03 -0.26 0.01 0.00 0.00 0.00 0.00 51.96 51.74 2hva s ALA 42 Cb 0.01 -2.34 0.02 0.00 0.00 0.00 0.00 23.12 20.81 2hva s ALA 42 CO -0.05 0.50 -0.03 0.95 0.00 0.00 0.00 175.76 177.13 2hva s THR 43 N -1.09 0.41 -0.09 0.00 -4.23 0.67 -1.36 115.64 109.95 2hva s THR 43 Ca 0.23 -0.08 0.01 0.00 -1.18 0.00 0.00 61.69 60.67 2hva s THR 43 Cb -0.16 -0.43 0.02 0.00 1.34 0.00 0.00 72.50 73.26 2hva s THR 43 CO 0.13 0.18 -0.12 -0.69 -0.54 0.00 0.00 174.62 173.58 2hva s VAL 44 N 0.72 1.20 -0.11 2.29 1.01 -1.08 -0.45 120.40 123.98 2hva s VAL 44 Ca -0.09 -0.46 -0.11 0.00 0.00 0.00 0.00 61.98 61.32 2hva s VAL 44 Cb -0.12 -1.13 -0.05 0.00 0.00 0.00 0.00 36.38 35.08 2hva s VAL 44 CO -0.00 0.38 0.26 -0.70 0.00 0.00 0.00 175.10 175.04 2hva s GLU 45 N 1.10 3.89 -0.09 2.72 -6.30 -1.26 -1.93 118.70 116.82 2hva s GLU 45 Ca -0.06 0.08 -0.03 0.00 -2.50 0.00 0.00 54.97 52.47 2hva s GLU 45 Cb -0.14 -3.29 0.04 0.00 0.00 0.00 0.00 34.13 30.73 2hva s GLU 45 CO -0.02 0.54 0.05 0.08 0.02 0.00 0.00 175.26 175.94 2hva s VAL 46 N -0.45 0.07 0.39 3.70 1.01 -1.09 -5.02 120.40 119.02 2hva s VAL 46 Ca 0.17 0.13 0.08 0.00 0.00 0.00 0.00 61.98 62.36 2hva s VAL 46 Cb -0.13 -0.42 -0.01 0.00 0.00 0.00 0.00 36.38 35.81 2hva s VAL 46 CO 0.06 0.06 0.41 0.42 0.00 0.00 0.00 175.10 176.05 2hva s THR 47 N 2.09 3.13 -1.01 3.92 -4.23 -1.26 -3.04 115.64 115.24 2hva s THR 47 Ca 0.04 -1.23 -0.06 0.00 -1.18 0.00 0.00 61.69 59.27 2hva s THR 47 Cb -0.13 -3.10 0.05 0.00 1.34 0.00 0.00 72.50 70.65 2hva s THR 47 CO -0.05 -0.06 0.25 -0.67 -0.54 0.00 0.00 174.62 173.55 2hva n ASP 48 N -1.59 -3.16 -3.66 3.99 2.03 -1.15 -4.91 116.55 108.09 2hva n ASP 48 Ca 0.03 -0.09 -0.08 0.00 0.52 0.00 0.00 54.79 55.17 2hva n ASP 48 Cb 0.60 -2.68 -0.09 0.00 -0.72 0.00 0.00 41.12 38.23 2hva n ASP 48 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 2hva s LYS 49 N -5.59 0.37 0.00 -0.67 1.02 -1.21 -5.06 119.74 108.61 2hva s LYS 49 Ca 0.23 1.06 0.00 0.00 0.02 0.00 0.00 55.97 57.27 2hva s LYS 49 Cb -0.12 0.34 0.00 0.00 -0.52 0.00 0.00 37.83 37.53 2hva s LYS 49 CO 0.28 -0.23 0.00 -2.30 -0.92 0.00 0.00 175.35 172.18 2hva n PRO 50 N 5.21 1.01 0.10 -1.68 -0.02 -1.26 -4.29 135.00 134.08 2hva n PRO 50 Ca -0.11 0.00 -0.07 0.00 -2.02 0.00 0.00 63.50 61.30 2hva n PRO 50 Cb 0.50 0.00 -0.04 0.00 -0.02 0.00 0.00 33.50 33.95 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 -0.95 0.17 -0.59 -1.45 2.07 -1.95 -1.04 116.25 112.51 2hva h VAL 51 Ca 0.00 -0.81 0.06 0.00 0.82 0.00 0.00 66.70 66.76 2hva h VAL 51 Cb 0.00 0.29 -0.05 0.00 -1.52 0.00 0.00 31.29 30.01 2hva h VAL 51 CO 0.00 0.05 0.31 -0.78 0.02 0.00 0.00 177.57 177.16 2hva h ASP 52 N -1.07 0.44 -0.22 0.57 3.58 -1.93 -0.06 116.42 117.74 2hva h ASP 52 Ca -0.04 0.03 -0.05 0.00 0.42 0.00 0.00 57.03 57.40 2hva h ASP 52 Cb 0.35 -0.05 -0.01 0.00 1.72 0.00 0.00 39.33 41.34 2hva h ASP 52 CO 0.06 0.29 -0.04 -0.33 -2.88 0.00 0.00 179.24 176.34 2hva h GLU 53 N 0.57 0.42 -0.79 0.28 5.08 -1.90 -3.03 114.58 115.21 2hva h GLU 53 Ca 0.26 -0.15 0.03 0.00 -1.00 0.00 0.00 59.36 58.50 2hva h GLU 53 Cb 0.18 -0.03 -0.05 0.00 0.50 0.00 0.00 28.75 29.35 2hva h GLU 53 CO -0.18 0.65 0.51 0.00 -1.00 0.00 0.00 179.01 178.99 2hva h ALA 54 N 0.76 1.04 -0.68 3.43 0.00 -0.83 -1.82 119.26 121.15 2hva h ALA 54 Ca 0.06 -0.03 0.07 0.00 0.00 0.00 0.00 54.91 55.01 2hva h ALA 54 Cb 0.48 -0.28 -0.04 0.00 0.00 0.00 0.00 17.79 17.96 2hva h ALA 54 CO 0.02 0.34 0.45 -0.07 0.00 0.00 0.00 179.25 179.99 2hva h LEU 55 N 1.00 0.58 -1.23 0.00 3.38 -0.96 0.72 115.31 118.81 2hva h LEU 55 Ca 0.31 0.01 -0.07 0.00 0.09 0.00 0.00 57.88 58.22 2hva h LEU 55 Cb -0.01 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.61 2hva h LEU 55 CO -0.11 0.37 -0.20 -0.09 0.09 0.00 0.00 178.44 178.50 2hva h ARG 56 N 0.66 0.28 0.16 1.13 2.43 -1.21 0.53 114.38 118.35 2hva h ARG 56 Ca 0.30 -0.08 -0.35 0.00 -0.81 0.00 0.00 59.98 59.04 2hva h ARG 56 Cb 0.33 -0.03 -0.00 0.00 -0.42 0.00 0.00 29.97 29.85 2hva h ARG 56 CO -0.10 0.48 -1.83 1.49 -1.51 0.00 0.00 179.97 178.50 2hva h GLU 57 N 0.26 0.33 -0.13 0.20 4.57 -0.91 -3.37 114.58 115.53 2hva h GLU 57 Ca 0.05 -0.56 -0.20 0.00 -1.18 0.00 0.00 59.36 57.46 2hva h GLU 57 Cb 0.51 0.21 0.00 0.00 -0.16 0.00 0.00 28.75 29.31 2hva h GLU 57 CO 0.03 1.27 -0.73 0.00 -1.18 0.00 0.00 179.01 178.41 2hva h ALA 58 N 0.08 0.47 -0.64 2.92 0.00 0.45 -3.21 119.26 119.33 2hva h ALA 58 Ca -0.38 -0.59 0.04 0.00 0.00 0.00 0.00 54.91 53.98 2hva h ALA 58 Cb 2.04 -0.04 -0.05 0.00 0.00 0.00 0.00 17.79 19.75 2hva h ALA 58 CO 0.13 0.72 0.37 0.52 0.00 0.00 0.00 179.25 180.99 2hva h MET 59 N 0.43 0.70 -0.24 0.00 2.86 -0.11 0.79 114.93 119.35 2hva h MET 59 Ca -0.04 -0.04 -0.15 0.00 -2.06 0.00 0.00 59.70 57.41 2hva h MET 59 Cb 1.33 -0.16 -0.01 0.00 0.06 0.00 0.00 31.60 32.82 2hva h MET 59 CO 0.14 0.46 -0.47 -1.00 1.06 0.00 0.00 176.91 177.10 2hva h PRO 60 N 0.72 0.62 -0.25 -0.22 0.13 -1.71 0.90 132.00 132.19 2hva h PRO 60 Ca 0.27 -0.35 -0.11 0.00 -0.87 0.00 0.00 66.00 64.94 2hva h PRO 60 Cb 0.10 0.02 -0.00 0.00 0.13 0.00 0.00 31.00 31.25 2hva h PRO 60 CO -0.14 0.96 -0.28 0.87 -0.23 0.00 0.00 178.00 179.17 2hva h LYS 61 N 0.49 0.63 0.00 0.86 1.57 -1.49 -2.85 116.57 115.79 2hva h LYS 61 Ca 0.03 -0.35 -0.12 0.00 -1.87 0.00 0.00 60.65 58.34 2hva h LYS 61 Cb 1.01 0.02 -0.02 0.00 0.08 0.00 0.00 32.23 33.32 2hva h LYS 61 CO 0.09 0.95 -0.57 0.97 -0.57 0.00 0.00 179.45 180.32 2hva h ILE 62 N 0.34 1.08 -0.59 1.86 2.10 -0.85 -3.24 117.51 118.21 2hva h ILE 62 Ca 0.04 -2.24 -0.09 0.00 1.08 0.00 0.00 64.86 63.64 2hva h ILE 62 Cb 0.85 2.34 -0.02 0.00 -1.09 0.00 0.00 36.82 38.90 2hva h ILE 62 CO 0.07 0.56 0.01 0.24 -1.08 0.00 0.00 178.15 177.95 2hva h MET 63 N 0.00 1.02 -0.18 2.19 2.86 -0.77 -2.61 114.93 117.44 2hva h MET 63 Ca -0.01 -0.31 0.02 0.00 -2.06 0.00 0.00 59.70 57.35 2hva h MET 63 Cb 1.29 -0.10 -0.01 0.00 0.06 0.00 0.00 31.60 32.84 2hva h MET 63 CO 0.07 0.99 0.12 0.87 1.06 0.00 0.00 176.91 180.03 2hva h LYS 64 N 0.94 0.14 -0.02 1.72 6.56 -1.52 0.88 116.57 125.25 2hva h LYS 64 Ca 0.17 -0.01 -0.02 0.00 -1.06 0.00 0.00 60.65 59.74 2hva h LYS 64 Cb 0.53 -0.03 0.00 0.00 -0.57 0.00 0.00 32.23 32.16 2hva h LYS 64 CO 0.03 0.09 -0.04 -0.92 -2.06 0.00 0.00 179.45 176.54 2hva h TYR 65 N 0.14 0.09 -0.00 -1.35 3.20 -1.58 -0.48 116.97 116.98 2hva h TYR 65 Ca 0.08 -0.03 -0.17 0.00 3.14 0.00 0.00 58.73 61.74 2hva h TYR 65 Cb 0.13 -0.02 -0.02 0.00 1.54 0.00 0.00 36.73 38.37 2hva h TYR 65 CO -0.00 0.62 -0.78 -0.39 -1.64 0.00 0.00 178.16 175.96 2hva h VAL 66 N -0.46 1.53 0.00 1.81 -1.51 -1.28 -3.39 116.25 112.95 2hva h VAL 66 Ca 0.00 -2.59 0.00 0.00 -1.23 0.00 0.00 66.70 62.88 2hva h VAL 66 Cb 0.61 2.40 0.00 0.00 -2.13 0.00 0.00 31.29 32.18 2hva h VAL 66 CO 0.01 0.74 0.00 0.61 -1.23 0.00 0.00 177.57 177.70 2hva n GLY 67 N 0.70 -1.52 2.06 5.19 0.00 0.30 -4.18 105.19 107.74 2hva n GLY 67 Ca -0.01 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 45.98 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 0.57 1.41 0.66 -0.02 0.00 -1.22 -4.79 105.19 101.80 2hva n GLY 68 Ca 0.00 -0.39 0.05 0.00 0.00 0.00 0.00 46.02 45.68 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 -0.63 2.24 0.61 2.61 -1.04 -0.19 -4.64 114.28 113.23 2hva n THR 69 Ca -0.13 -3.25 0.12 0.00 -2.04 0.00 0.00 64.05 58.75 2hva n THR 69 Cb 0.85 -0.27 0.17 0.00 -1.82 0.00 0.00 70.33 69.26 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 -1.11 0.67 0.00 8.00 6.94 -1.26 -3.94 115.26 124.57 2hva n ASN 70 Ca 0.20 0.07 0.00 0.00 -0.02 0.00 0.00 54.58 54.83 2hva n ASN 70 Cb 0.71 0.21 0.00 0.00 -2.36 0.00 0.00 39.78 38.35 2hva n ASN 70 CO 0.00 0.00 0.00 -0.67 -1.03 0.00 0.00 177.26 175.56 2hva n ASP 71 N -2.04 0.00 -0.07 0.53 2.03 -1.26 -4.32 116.55 111.41 2hva n ASP 71 Ca 0.03 0.00 -0.22 0.00 0.52 0.00 0.00 54.79 55.12 2hva n ASP 71 Cb 0.43 -0.15 -0.12 0.00 -0.72 0.00 0.00 41.12 40.55 2hva n ASP 71 CO 0.00 0.00 0.00 1.17 -1.92 0.00 0.00 177.20 176.45 2hva n LYS 72 N -2.00 0.66 -1.16 -0.67 3.00 -1.26 -5.03 118.16 111.70 2hva n LYS 72 Ca 0.00 0.32 0.00 0.00 -0.00 0.00 0.00 58.31 58.63 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 1.78 1.00 3.61 3.14 0.00 -1.26 -5.10 105.19 108.36 2hva n GLY 73 Ca -0.39 -0.32 -0.18 0.00 0.00 0.00 0.00 46.02 45.13 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 -1.24 0.00 -3.83 1.61 0.24 -1.26 -5.09 118.33 108.75 2hva n VAL 74 Ca 0.00 -1.80 -0.29 0.00 -2.04 0.00 0.00 64.34 60.21 2hva n VAL 74 Cb 0.23 -0.54 -0.13 0.00 -1.47 0.00 0.00 33.84 31.93 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 -4.42 2.19 -0.10 7.63 0.00 -1.26 -4.93 107.32 106.42 2hva s GLY 75 Ca 0.56 -3.08 -0.21 0.00 0.00 0.00 0.00 44.72 41.99 2hva s GLY 75 CO 0.35 1.26 0.68 -0.33 0.00 0.00 0.00 173.10 175.06 2hva h MET 76 N 6.39 0.19 0.00 2.90 2.86 -1.87 -3.49 114.93 121.91 2hva h MET 76 Ca -0.01 -0.33 0.00 0.00 -2.06 0.00 0.00 59.70 57.31 2hva h MET 76 Cb 0.88 0.12 0.00 0.00 0.06 0.00 0.00 31.60 32.67 2hva h MET 76 CO 0.61 1.16 0.00 0.41 1.06 0.00 0.00 176.91 180.14 2hva n GLY 77 N 1.66 2.07 0.00 8.32 0.00 -1.26 -4.30 105.19 111.67 2hva n GLY 77 Ca -0.19 -0.26 0.00 0.00 0.00 0.00 0.00 46.02 45.57 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 0.00 0.00 0.00 1.61 1.56 -1.26 -4.83 117.12 114.19 2hva n MET 78 Ca 0.00 0.00 0.00 0.00 -0.27 0.00 0.00 57.70 57.43 2hva n MET 78 Cb 0.00 0.00 0.00 0.00 2.15 0.00 0.00 33.22 35.37 2hva n MET 78 CO 0.00 0.00 0.00 2.41 -0.73 0.00 0.00 175.97 177.65 2hva n THR 79 N -0.60 0.00 -1.07 1.12 -1.04 -1.26 -4.78 114.28 106.65 2hva n THR 79 Ca 0.00 0.00 -0.35 0.00 -2.04 0.00 0.00 64.05 61.66 2hva n THR 79 Cb 0.00 0.00 0.09 0.00 -1.82 0.00 0.00 70.33 68.60 2hva n THR 79 CO 0.00 0.00 0.00 1.33 -0.64 0.00 0.00 175.07 175.76 2hva n VAL 80 N -0.81 1.07 -1.75 12.58 0.24 -1.26 -4.87 118.33 123.53 2hva n VAL 80 Ca 0.00 -0.31 -0.41 0.00 -2.04 0.00 0.00 64.34 61.58 2hva n VAL 80 Cb 0.00 -0.70 -0.01 0.00 -1.47 0.00 0.00 33.84 31.65 2hva n VAL 80 CO 0.00 0.00 0.00 -0.81 -2.14 0.00 0.00 176.83 173.88 2hva n PRO 81 N -1.19 2.75 -3.12 7.34 -0.04 -1.26 -4.94 135.00 134.54 2hva n PRO 81 Ca 0.09 0.98 -0.35 0.00 -0.04 0.00 0.00 63.50 64.17 2hva n PRO 81 Cb 0.51 -2.77 -0.06 0.00 -0.04 0.00 0.00 33.50 31.14 2hva n PRO 81 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 2hva s VAL 82 N -0.02 4.61 0.47 0.52 -7.23 -1.26 -4.98 120.40 112.51 2hva s VAL 82 Ca 0.64 1.19 0.05 0.00 -1.81 0.00 0.00 61.98 62.05 2hva s VAL 82 Cb -0.48 -3.81 -0.03 0.00 0.56 0.00 0.00 36.38 32.62 2hva s VAL 82 CO 0.49 0.14 0.16 -0.94 -0.31 0.00 0.00 175.10 174.63 2hva s SER 83 N -1.77 4.32 0.14 4.85 1.04 -1.21 -4.87 113.70 116.19 2hva s SER 83 Ca 0.45 -1.31 0.07 0.00 0.48 0.00 0.00 55.95 55.64 2hva s SER 83 Cb -0.15 -0.02 -0.04 0.00 0.10 0.00 0.00 66.02 65.91 2hva s SER 83 CO 0.20 -0.73 -0.16 0.72 0.98 0.00 0.00 173.24 174.25 2hva s PHE 84 N -2.72 1.58 0.02 5.02 -0.71 -1.15 -1.57 117.98 118.44 2hva s PHE 84 Ca 0.29 -0.51 -0.20 0.00 -1.04 0.00 0.00 56.93 55.47 2hva s PHE 84 Cb 0.03 -0.81 -0.06 0.00 -1.21 0.00 0.00 43.02 40.97 2hva s PHE 84 CO 0.16 0.22 0.57 0.00 -1.34 0.00 0.00 175.22 174.83 2hva s ALA 85 N -2.03 3.53 -0.21 1.99 0.00 0.38 -1.56 121.76 123.86 2hva s ALA 85 Ca 0.11 0.01 -0.02 0.00 0.00 0.00 0.00 51.96 52.06 2hva s ALA 85 Cb -0.06 -2.68 0.06 0.00 0.00 0.00 0.00 23.12 20.45 2hva s ALA 85 CO 0.04 0.26 0.02 0.14 0.00 0.00 0.00 175.76 176.21 2hva s VAL 86 N -0.52 0.84 -0.44 0.00 -7.23 0.23 -2.74 120.40 110.54 2hva s VAL 86 Ca 0.30 -0.81 -0.26 0.00 -1.81 0.00 0.00 61.98 59.39 2hva s VAL 86 Cb -0.18 -1.30 0.02 0.00 0.56 0.00 0.00 36.38 35.48 2hva s VAL 86 CO 0.17 -0.22 0.96 -0.36 -0.31 0.00 0.00 175.10 175.35 2hva s PHE 87 N 1.71 2.95 -0.05 2.82 0.40 -1.26 -2.53 117.98 122.02 2hva s PHE 87 Ca -0.02 0.55 -0.29 0.00 -0.60 0.00 0.00 56.93 56.57 2hva s PHE 87 Cb -0.18 -3.95 -0.02 0.00 0.51 0.00 0.00 43.02 39.38 2hva s PHE 87 CO -0.09 -1.05 0.96 -1.25 0.70 0.00 0.00 175.22 174.50 2hva s PRO 88 N 3.79 4.48 0.51 0.24 0.04 -1.25 -3.89 135.00 138.91 2hva s PRO 88 Ca 0.39 1.35 -0.03 0.00 0.04 0.00 0.00 61.00 62.76 2hva s PRO 88 Cb -0.10 -3.50 -0.00 0.00 0.04 0.00 0.00 34.50 30.94 2hva s PRO 88 CO 0.25 -0.16 0.77 -0.80 0.04 0.00 0.00 177.00 177.10 2hva s ASN 89 N 1.04 5.77 0.35 6.66 0.02 0.26 -4.88 114.94 124.16 2hva s ASN 89 Ca 0.49 0.51 0.26 0.00 -1.02 0.00 0.00 52.86 53.10 2hva s ASN 89 Cb -0.19 -1.66 1.22 0.00 0.02 0.00 0.00 41.25 40.63 2hva s ASN 89 CO 0.23 -0.84 1.78 -0.08 0.02 0.00 0.00 177.10 178.21 2hva h GLU 90 N 0.15 0.00 -0.00 -0.60 4.81 -1.97 -1.54 114.58 115.42 2hva h GLU 90 Ca -0.46 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.77 2hva h GLU 90 Cb 1.25 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.63 2hva h GLU 90 CO 0.59 0.00 -0.11 -3.47 -0.73 0.00 0.00 179.01 175.29 2hva n ASP 91 N -2.41 0.33 0.00 1.04 -0.08 -1.26 -4.90 116.55 109.27 2hva n ASP 91 Ca 0.00 -0.35 0.00 0.00 -1.51 0.00 0.00 54.79 52.94 2hva n ASP 91 Cb 0.15 -0.13 0.00 0.00 2.34 0.00 0.00 41.12 43.48 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 1.32 0.57 0.00 0.27 0.00 -0.58 -5.05 105.19 101.72 2hva n GLY 92 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 2hva n GLY 92 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2hva n SER 93 N 0.00 1.86 -4.89 1.61 2.88 -1.26 -4.83 113.62 108.99 2hva n SER 93 Ca 0.00 -0.99 -0.20 0.00 -1.33 0.00 0.00 58.87 56.35 2hva n SER 93 Cb 0.00 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.43 2hva n SER 93 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 2hva s LEU 94 N 0.00 3.45 -0.50 2.46 1.43 -1.26 0.93 118.68 125.18 2hva s LEU 94 Ca 0.00 -0.67 0.01 0.00 -1.03 0.00 0.00 54.13 52.44 2hva s LEU 94 Cb 0.00 -2.16 0.52 0.00 0.03 0.00 0.00 46.19 44.58 2hva s LEU 94 CO 0.00 -0.64 1.93 0.00 0.23 0.00 0.00 176.35 177.87 2hva n GLN 95 N -1.57 2.33 -2.08 1.70 10.64 -1.25 -4.86 117.38 122.28 2hva n GLN 95 Ca 0.04 -2.87 -0.12 0.00 -1.83 0.00 0.00 57.00 52.22 2hva n GLN 95 Cb 0.61 -2.13 -0.02 0.00 -0.86 0.00 0.00 30.24 27.84 2hva n GLN 95 CO 0.00 0.00 0.00 1.63 -1.83 0.00 0.00 177.06 176.86 2hva n LYS 96 N -0.88 -1.93 -4.10 2.61 4.76 -1.26 -4.85 118.16 112.51 2hva n LYS 96 Ca 0.56 0.61 -0.27 0.00 -2.87 0.00 0.00 58.31 56.34 2hva n LYS 96 Cb 1.15 -5.07 -0.17 0.00 -1.84 0.00 0.00 35.03 29.10 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 -4.35 1.76 -0.01 1.97 2.20 -1.26 -2.95 119.74 117.10 2hva s LYS 97 Ca 0.00 -0.36 0.02 0.00 -0.36 0.00 0.00 55.97 55.27 2hva s LYS 97 Cb 0.00 -1.67 -0.01 0.00 -1.51 0.00 0.00 37.83 34.64 2hva s LYS 97 CO 0.00 -0.19 -0.08 -1.17 -0.36 0.00 0.00 175.35 173.55 2hva s LEU 98 N 1.42 2.02 -0.23 5.43 0.20 -1.17 -4.29 118.68 122.05 2hva s LEU 98 Ca 0.00 -0.14 0.00 0.00 0.69 0.00 0.00 54.13 54.68 2hva s LEU 98 Cb -0.13 -0.41 0.03 0.00 -0.43 0.00 0.00 46.19 45.25 2hva s LEU 98 CO -0.06 0.10 -0.12 -0.54 -0.29 0.00 0.00 176.35 175.44 2hva s LYS 99 N -0.19 2.75 -0.30 1.98 1.02 -1.11 -2.66 119.74 121.24 2hva s LYS 99 Ca 0.03 -1.01 -0.29 0.00 0.02 0.00 0.00 55.97 54.72 2hva s LYS 99 Cb -0.03 -2.81 0.01 0.00 -0.52 0.00 0.00 37.83 34.48 2hva s LYS 99 CO -0.00 -0.37 1.13 0.08 -0.92 0.00 0.00 175.35 175.27 2hva s VAL 100 N 1.26 4.43 -0.03 3.17 1.01 -0.81 0.14 120.40 129.56 2hva s VAL 100 Ca -0.00 1.66 -0.09 0.00 0.00 0.00 0.00 61.98 63.55 2hva s VAL 100 Cb -0.16 -4.32 -0.05 0.00 0.00 0.00 0.00 36.38 31.85 2hva s VAL 100 CO -0.08 -0.43 0.26 0.26 0.00 0.00 0.00 175.10 175.12 2hva s TRP 101 N 3.75 3.62 0.08 5.22 0.52 -0.61 -2.64 118.94 128.88 2hva s TRP 101 Ca 0.48 0.66 0.07 0.00 0.02 0.00 0.00 56.10 57.33 2hva s TRP 101 Cb -0.14 -2.05 -0.03 0.00 -1.15 0.00 0.00 33.47 30.10 2hva s TRP 101 CO 0.16 0.66 -0.18 0.12 0.02 0.00 0.00 176.95 177.73 2hva s PHE 102 N -1.17 1.57 -0.36 -1.98 2.19 -0.46 -3.35 117.98 114.42 2hva s PHE 102 Ca 0.23 -0.42 -0.10 0.00 0.33 0.00 0.00 56.93 56.98 2hva s PHE 102 Cb -0.14 -0.88 0.03 0.00 -1.31 0.00 0.00 43.02 40.72 2hva s PHE 102 CO 0.12 0.13 0.18 0.50 1.83 0.00 0.00 175.22 177.97 2hva s ARG 103 N -1.67 2.79 0.05 10.12 6.06 -1.26 -2.97 118.95 132.08 2hva s ARG 103 Ca 0.04 -1.09 -0.30 0.00 -2.50 0.00 0.00 55.73 51.87 2hva s ARG 103 Cb -0.10 -3.65 -0.05 0.00 0.06 0.00 0.00 34.95 31.21 2hva s ARG 103 CO 0.03 -0.68 1.14 0.42 -2.50 0.00 0.00 175.30 173.71 2hva s ILE 104 N 1.52 4.23 0.74 4.11 -1.09 -1.22 -4.91 121.20 124.57 2hva s ILE 104 Ca 0.01 1.62 -0.16 0.00 -2.23 0.00 0.00 60.65 59.89 2hva s ILE 104 Cb -0.19 -4.04 -0.00 0.00 -1.58 0.00 0.00 42.46 36.65 2hva s ILE 104 CO 0.06 0.14 0.78 -2.65 -1.23 0.00 0.00 174.94 172.03 2hva n PRO 105 N 3.82 0.34 0.25 2.79 -0.02 -1.26 -4.57 135.00 136.35 2hva n PRO 105 Ca 0.08 0.17 0.14 0.00 -2.02 0.00 0.00 63.50 61.86 2hva n PRO 105 Cb 0.47 -2.06 0.80 0.00 -0.02 0.00 0.00 33.50 32.69 2hva n PRO 105 CO 0.00 0.00 0.00 -0.91 1.98 0.00 0.00 175.50 176.57 2hva h ASN 106 N -0.45 0.00 -0.04 2.55 2.35 -1.98 0.29 115.58 118.30 2hva h ASN 106 Ca -0.46 0.00 -0.06 0.00 -0.55 0.00 0.00 56.30 55.23 2hva h ASN 106 Cb 1.33 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.69 2hva h ASN 106 CO 0.44 0.00 -0.12 1.56 -1.65 0.00 0.00 177.43 177.66 2hva h GLN 107 N 0.00 0.34 -0.01 0.81 1.08 -2.03 -2.90 115.11 112.40 2hva h GLN 107 Ca 0.03 -0.08 0.00 0.00 -1.45 0.00 0.00 58.65 57.15 2hva h GLN 107 Cb 0.15 -0.04 0.00 0.00 -0.05 0.00 0.00 27.48 27.54 2hva h GLN 107 CO -0.00 0.47 -0.17 1.19 -0.95 0.00 0.00 178.83 179.36 2hva n PHE 108 N -4.25 0.00 -0.16 2.96 3.01 -0.35 -4.54 117.46 114.13 2hva n PHE 108 Ca -0.00 0.00 0.17 0.00 1.01 0.00 0.00 57.45 58.63 2hva n PHE 108 Cb 0.29 0.00 0.53 0.00 -0.01 0.00 0.00 39.48 40.29 2hva n PHE 108 CO 0.00 0.00 0.00 -0.56 1.01 0.00 0.00 176.76 177.21 2hva h GLN 109 N 1.96 0.34 -0.17 -1.08 -0.00 -0.28 0.39 115.11 116.28 2hva h GLN 109 Ca 0.00 -0.02 -0.12 0.00 -0.00 0.00 0.00 58.65 58.51 2hva h GLN 109 Cb 0.50 -0.08 -0.01 0.00 -0.00 0.00 0.00 27.48 27.90 2hva h GLN 109 CO 0.00 0.23 -0.40 0.78 -0.00 0.00 0.00 178.83 179.44 2hva h GLY 110 N 0.35 0.42 -5.58 0.06 0.00 -1.80 -3.39 103.07 93.14 2hva h GLY 110 Ca 0.37 -0.41 0.03 0.00 0.00 0.00 0.00 47.33 47.32 2hva h GLY 110 CO -0.11 0.37 -0.28 -0.45 0.00 0.00 0.00 176.54 176.06 2hva s SER 111 N -6.86 -0.94 0.88 0.19 0.15 -0.04 -5.09 113.70 101.99 2hva s SER 111 Ca -0.06 -0.51 -0.10 0.00 0.70 0.00 0.00 55.95 55.98 2hva s SER 111 Cb 0.13 1.20 0.12 0.00 -1.71 0.00 0.00 66.02 65.76 2hva s SER 111 CO 0.79 -0.10 1.13 -2.84 1.20 0.00 0.00 173.24 173.42 2hva s PRO 112 N 1.85 1.34 0.60 5.44 0.02 -0.24 -4.86 135.00 139.16 2hva s PRO 112 Ca 0.16 1.42 -0.17 0.00 0.02 0.00 0.00 61.00 62.44 2hva s PRO 112 Cb -0.00 -1.77 -0.03 0.00 0.02 0.00 0.00 34.50 32.72 2hva s PRO 112 CO -0.11 -2.36 1.10 -2.14 -0.33 0.00 0.00 177.00 173.16 2hva s PRO 113 N -4.72 3.11 -0.29 5.54 0.02 -1.26 -4.94 135.00 132.45 2hva s PRO 113 Ca 0.65 1.41 -0.28 0.00 0.02 0.00 0.00 61.00 62.80 2hva s PRO 113 Cb -0.21 -1.99 -0.02 0.00 0.02 0.00 0.00 34.50 32.30 2hva s PRO 113 CO 0.57 -1.01 1.81 0.00 -0.33 0.00 0.00 177.00 178.05 2hva s ALA 114 N -2.18 2.93 0.24 -1.55 0.00 -1.26 -4.95 121.76 114.99 2hva s ALA 114 Ca 0.68 0.37 -0.31 0.00 0.00 0.00 0.00 51.96 52.70 2hva s ALA 114 Cb -0.20 -3.99 -0.11 0.00 0.00 0.00 0.00 23.12 18.81 2hva s ALA 114 CO 0.35 -2.51 1.62 -2.14 0.00 0.00 0.00 175.76 173.08 2hva s PRO 115 N 5.54 4.15 -0.59 0.00 0.02 -1.26 -4.58 135.00 138.29 2hva s PRO 115 Ca 0.81 2.52 -0.02 0.00 0.02 0.00 0.00 61.00 64.33 2hva s PRO 115 Cb -0.24 -3.07 0.25 0.00 0.02 0.00 0.00 34.50 31.45 2hva s PRO 115 CO 0.33 -0.65 2.29 0.45 -0.33 0.00 0.00 177.00 179.09 2hva n SER 116 N 3.16 7.02 -3.47 2.53 2.88 -1.25 -4.81 113.62 119.68 2hva n SER 116 Ca 0.12 -3.48 -0.12 0.00 -1.33 0.00 0.00 58.87 54.06 2hva n SER 116 Cb 0.37 -1.11 -0.10 0.00 -0.75 0.00 0.00 64.21 62.62 2hva n SER 116 CO 0.00 0.00 0.00 -1.81 -1.23 0.00 0.00 175.04 172.00 2hva s ASP 117 N -0.51 0.46 0.62 -3.46 1.01 -1.26 -5.01 116.67 108.52 2hva s ASP 117 Ca 0.53 0.27 0.33 0.00 0.71 0.00 0.00 52.55 54.40 2hva s ASP 117 Cb 0.40 0.91 1.89 0.00 1.01 0.00 0.00 42.92 47.14 2hva s ASP 117 CO -0.20 -0.29 2.19 -0.33 0.21 0.00 0.00 175.17 176.75 2hva h GLU 118 N 8.23 0.00 0.01 8.23 3.07 -2.00 -0.09 114.58 132.02 2hva h GLU 118 Ca -0.18 0.00 -0.23 0.00 -0.50 0.00 0.00 59.36 58.45 2hva h GLU 118 Cb 1.14 0.00 -0.03 0.00 -0.84 0.00 0.00 28.75 29.02 2hva h GLU 118 CO 0.24 0.00 -1.17 0.77 -1.40 0.00 0.00 179.01 177.45 2hva h SER 119 N 0.00 0.02 -3.52 1.42 0.02 -1.94 -3.43 113.55 106.12 2hva h SER 119 Ca 0.03 -0.03 -0.60 0.00 -0.84 0.00 0.00 61.79 60.35 2hva h SER 119 Cb 0.26 -0.01 -0.10 0.00 0.14 0.00 0.00 62.40 62.69 2hva h SER 119 CO -0.00 1.02 0.52 -0.69 -1.14 0.00 0.00 176.83 176.54 2hva s VAL 120 N -2.68 4.63 0.10 2.27 1.01 -0.05 -4.16 120.40 121.52 2hva s VAL 120 Ca -0.01 1.04 0.05 0.00 0.00 0.00 0.00 61.98 63.07 2hva s VAL 120 Cb 0.09 -4.30 -0.04 0.00 0.00 0.00 0.00 36.38 32.14 2hva s VAL 120 CO 0.82 -0.52 -0.00 -0.54 0.00 0.00 0.00 175.10 174.86 2hva s LYS 121 N 3.35 2.52 -0.13 2.72 1.02 0.40 -4.72 119.74 124.91 2hva s LYS 121 Ca 0.35 -0.86 0.02 0.00 0.02 0.00 0.00 55.97 55.50 2hva s LYS 121 Cb -0.12 -2.52 -0.00 0.00 -0.52 0.00 0.00 37.83 34.67 2hva s LYS 121 CO 0.19 0.53 -0.20 0.42 -0.92 0.00 0.00 175.35 175.37 2hva s ILE 122 N -1.34 2.36 -0.19 2.17 -1.09 -1.26 -0.23 121.20 121.62 2hva s ILE 122 Ca 0.26 -0.90 -0.11 0.00 -2.23 0.00 0.00 60.65 57.67 2hva s ILE 122 Cb -0.12 -1.95 -0.05 0.00 -1.58 0.00 0.00 42.46 38.77 2hva s ILE 122 CO 0.18 0.54 0.18 -0.70 -1.23 0.00 0.00 174.94 173.91 2hva s GLU 123 N 0.54 4.21 0.08 2.79 -6.30 -1.09 -4.94 118.70 114.00 2hva s GLU 123 Ca -0.12 -0.13 -0.20 0.00 -2.50 0.00 0.00 54.97 52.02 2hva s GLU 123 Cb -0.17 -3.42 -0.07 0.00 0.00 0.00 0.00 34.13 30.47 2hva s GLU 123 CO 0.04 0.28 0.59 -2.00 0.02 0.00 0.00 175.26 174.19 2hva s GLU 124 N 0.40 4.24 0.55 4.30 2.12 -1.26 -3.20 118.70 125.85 2hva s GLU 124 Ca 0.11 0.78 0.00 0.00 0.36 0.00 0.00 54.97 56.22 2hva s GLU 124 Cb -0.12 -3.24 0.00 0.00 0.26 0.00 0.00 34.13 31.03 2hva s GLU 124 CO -0.00 0.63 0.00 0.54 -0.54 0.00 0.00 175.26 175.89 2hva n ARG 125 N 1.72 -3.77 -1.15 4.30 1.74 -0.77 -5.00 116.66 113.72 2hva n ARG 125 Ca -0.10 2.94 0.00 0.00 -0.77 0.00 0.00 57.85 59.92 2hva n ARG 125 Cb 0.51 -3.69 0.00 0.00 -1.02 0.00 0.00 32.46 28.25 2hva n ARG 125 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 2hva n GLU 126 N -2.60 0.00 0.00 5.56 -0.58 -1.26 -4.90 120.64 116.86 2hva n GLU 126 Ca -0.00 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 2hva n GLU 126 Cb 0.46 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.33 2hva n GLU 126 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2hva n GLY 127 N 0.00 0.39 3.04 0.62 0.00 -1.26 -4.68 105.19 103.31 2hva n GLY 127 Ca 0.00 0.23 -0.15 0.00 0.00 0.00 0.00 46.02 46.11 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 0.00 0.58 -0.15 -0.61 -5.25 -1.25 -5.05 121.20 109.47 2hva s ILE 128 Ca 0.00 -0.81 -0.06 0.00 -0.99 0.00 0.00 60.65 58.79 2hva s ILE 128 Cb 0.00 -0.58 -0.04 0.00 2.95 0.00 0.00 42.46 44.79 2hva s ILE 128 CO 0.00 -0.18 0.06 -0.89 -1.79 0.00 0.00 174.94 172.14 2hva s THR 129 N -0.93 4.77 0.22 8.37 2.01 -1.26 -4.20 115.64 124.63 2hva s THR 129 Ca -0.05 -0.05 0.00 0.00 0.31 0.00 0.00 61.69 61.90 2hva s THR 129 Cb -0.07 -3.11 -0.05 0.00 0.01 0.00 0.00 72.50 69.28 2hva s THR 129 CO 0.00 0.51 0.10 0.68 -0.69 0.00 0.00 174.62 175.23 2hva s VAL 130 N -0.07 0.32 -0.04 3.82 -7.23 -1.23 0.19 120.40 116.17 2hva s VAL 130 Ca 0.06 -1.99 0.01 0.00 -1.81 0.00 0.00 61.98 58.25 2hva s VAL 130 Cb -0.12 -2.51 0.02 0.00 0.56 0.00 0.00 36.38 34.33 2hva s VAL 130 CO 0.01 -0.06 -0.02 -0.72 -0.31 0.00 0.00 175.10 174.00 2hva s TYR 131 N -3.92 0.52 0.06 2.82 -0.85 -1.25 -2.74 117.35 112.00 2hva s TYR 131 Ca 0.37 -0.10 0.03 0.00 -0.52 0.00 0.00 57.07 56.84 2hva s TYR 131 Cb 0.07 -0.53 -0.04 0.00 0.38 0.00 0.00 41.96 41.84 2hva s TYR 131 CO 0.12 -0.16 0.07 -1.54 -1.52 0.00 0.00 175.55 172.52 2hva s SER 132 N 0.98 5.50 -0.01 -0.18 1.04 -1.24 -3.63 113.70 116.15 2hva s SER 132 Ca -0.10 0.00 0.04 0.00 0.48 0.00 0.00 55.95 56.37 2hva s SER 132 Cb -0.14 -1.48 -0.01 0.00 0.10 0.00 0.00 66.02 64.49 2hva s SER 132 CO -0.01 0.19 -0.12 0.28 0.98 0.00 0.00 173.24 174.57 2hva s THR 133 N -1.34 0.95 -0.09 2.02 -1.32 -1.24 -3.46 115.64 111.17 2hva s THR 133 Ca 0.28 -0.51 0.03 0.00 -1.21 0.00 0.00 61.69 60.28 2hva s THR 133 Cb -0.12 -0.80 -0.01 0.00 -1.51 0.00 0.00 72.50 70.05 2hva s THR 133 CO 0.20 0.27 -0.18 0.00 -2.21 0.00 0.00 174.62 172.70 2hva s GLN 134 N -0.22 2.91 0.00 7.08 -2.07 -1.26 -3.55 119.66 122.55 2hva s GLN 134 Ca 0.03 -0.78 0.00 0.00 -1.82 0.00 0.00 55.36 52.80 2hva s GLN 134 Cb -0.05 -2.39 0.00 0.00 -1.09 0.00 0.00 33.01 29.47 2hva s GLN 134 CO -0.00 0.35 0.00 1.97 -1.32 0.00 0.00 175.29 176.28 2hva n PHE 135 N 3.09 0.00 0.00 9.60 -1.74 -1.26 -4.60 117.46 122.55 2hva n PHE 135 Ca -0.18 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 56.71 2hva n PHE 135 Cb 0.52 0.12 0.00 0.00 1.52 0.00 0.00 39.48 41.65 2hva n PHE 135 CO 0.00 0.00 0.00 0.41 -0.56 0.00 0.00 176.76 176.61 2hva n GLY 136 N 2.53 3.01 0.00 4.97 0.00 -1.26 -5.04 105.19 109.39 2hva n GLY 136 Ca 0.00 -1.74 0.00 0.00 0.00 0.00 0.00 46.02 44.28 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 -0.01 -1.27 2.86 -0.02 0.00 -1.21 -4.87 105.19 100.67 2hva n GLY 137 Ca 0.00 -2.12 -0.23 0.00 0.00 0.00 0.00 46.02 43.67 2hva n GLY 137 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2hva s TYR 138 N -0.02 0.96 0.48 1.61 -0.85 -1.26 -4.19 117.35 114.08 2hva s TYR 138 Ca 0.00 -0.35 0.06 0.00 -0.52 0.00 0.00 57.07 56.25 2hva s TYR 138 Cb 0.00 -0.89 -0.01 0.00 0.38 0.00 0.00 41.96 41.44 2hva s TYR 138 CO 0.00 -0.33 0.26 0.00 -1.52 0.00 0.00 175.55 173.96 2hva s ALA 139 N 1.47 4.04 0.00 9.51 0.00 -1.26 -5.02 121.76 130.50 2hva s ALA 139 Ca -0.02 -1.49 0.00 0.00 0.00 0.00 0.00 51.96 50.46 2hva s ALA 139 Cb -0.13 -0.51 0.00 0.00 0.00 0.00 0.00 23.12 22.48 2hva s ALA 139 CO -0.04 -0.26 0.00 1.63 0.00 0.00 0.00 175.76 177.09 2hva n LYS 140 N -1.48 0.00 0.18 0.00 5.02 -1.26 -4.93 118.16 115.69 2hva n LYS 140 Ca -0.04 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.25 2hva n LYS 140 Cb 0.65 -0.16 0.00 0.00 -0.02 0.00 0.00 35.03 35.50 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 -1.85 0.00 -0.10 1.97 0.00 -1.26 -4.76 120.64 114.64 2hva n GLU 141 Ca 0.00 0.00 0.13 0.00 0.00 0.00 0.00 57.16 57.29 2hva n GLU 141 Cb 0.00 0.00 0.50 0.00 0.00 0.00 0.00 31.44 31.94 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 2.04 -0.24 4.31 0.00 -1.98 0.11 119.26 123.49 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 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 2hva h ALA 142 CO 0.00 -0.18 -0.31 0.22 0.00 0.00 0.00 179.25 178.97 2hva h ASP 143 N 0.41 0.51 -0.69 0.00 3.58 -1.93 -2.79 116.42 115.51 2hva h ASP 143 Ca 0.30 -0.19 -0.06 0.00 0.42 0.00 0.00 57.03 57.49 2hva h ASP 143 Cb 0.61 -0.14 -0.03 0.00 1.72 0.00 0.00 39.33 41.49 2hva h ASP 143 CO -0.08 0.80 0.18 1.88 -2.88 0.00 0.00 179.24 179.13 2hva h TYR 144 N 0.43 1.15 -0.95 0.28 0.05 -1.14 -2.19 116.97 114.60 2hva h TYR 144 Ca 0.05 -0.13 0.15 0.00 0.05 0.00 0.00 58.73 58.85 2hva h TYR 144 Cb 0.76 -0.33 -0.08 0.00 1.01 0.00 0.00 36.73 38.10 2hva h TYR 144 CO 0.03 0.93 0.60 0.28 -1.05 0.00 0.00 178.16 178.95 2hva h VAL 145 N 1.03 0.84 -0.29 -2.88 2.07 -1.10 0.39 116.25 116.31 2hva h VAL 145 Ca 0.22 -0.28 -0.14 0.00 0.82 0.00 0.00 66.70 67.33 2hva h VAL 145 Cb 0.35 -0.04 -0.01 0.00 -1.52 0.00 0.00 31.29 30.08 2hva h VAL 145 CO 0.00 0.15 -0.38 0.00 0.02 0.00 0.00 177.57 177.35 2hva h ALA 146 N 1.59 0.80 -0.14 1.67 0.00 -1.32 -1.97 119.26 119.87 2hva h ALA 146 Ca 0.49 -0.44 -0.07 0.00 0.00 0.00 0.00 54.91 54.90 2hva h ALA 146 Cb 0.69 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.36 2hva h ALA 146 CO -0.26 0.65 -0.17 0.45 0.00 0.00 0.00 179.25 179.92 2hva h HIS 147 N 0.55 0.45 -0.26 0.00 -0.00 -0.23 -2.70 115.15 112.96 2hva h HIS 147 Ca 0.05 -0.14 -0.02 0.00 -0.00 0.00 0.00 60.37 60.25 2hva h HIS 147 Cb 0.90 -0.09 -0.01 0.00 -0.00 0.00 0.00 27.41 28.21 2hva h HIS 147 CO 0.04 0.78 0.06 0.00 -0.00 0.00 0.00 177.93 178.81 2hva h ALA 148 N 0.59 1.61 -0.42 2.45 0.00 -0.38 -2.30 119.26 120.81 2hva h ALA 148 Ca 0.02 -0.11 -0.12 0.00 0.00 0.00 0.00 54.91 54.70 2hva h ALA 148 Cb 0.72 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 2hva h ALA 148 CO 0.04 0.29 -0.21 1.15 0.00 0.00 0.00 179.25 180.52 2hva h THR 149 N 0.37 1.27 -0.63 0.00 2.02 -1.28 -2.89 112.91 111.77 2hva h THR 149 Ca 0.09 -1.34 0.03 0.00 0.77 0.00 0.00 66.41 65.96 2hva h THR 149 Cb 0.16 1.17 -0.03 0.00 -1.74 0.00 0.00 68.15 67.71 2hva h THR 149 CO -0.00 0.45 0.42 1.56 0.37 0.00 0.00 175.52 178.32 2hva h GLN 150 N 0.74 0.73 -0.94 6.66 4.20 -1.08 -1.62 115.11 123.79 2hva h GLN 150 Ca 0.10 -0.04 0.02 0.00 0.06 0.00 0.00 58.65 58.79 2hva h GLN 150 Cb 0.75 -0.16 -0.05 0.00 0.30 0.00 0.00 27.48 28.31 2hva h GLN 150 CO 0.06 0.48 0.62 1.25 -0.67 0.00 0.00 178.83 180.57 2hva h LEU 151 N 0.75 1.05 -0.71 1.46 5.85 -1.42 -0.78 115.31 121.51 2hva h LEU 151 Ca 0.25 -0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.95 2hva h LEU 151 Cb 0.07 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 40.82 2hva h LEU 151 CO -0.07 0.74 0.42 0.03 -0.34 0.00 0.00 178.44 179.22 2hva h ARG 152 N 1.23 0.97 -0.62 1.25 3.08 -1.33 -1.74 114.38 117.22 2hva h ARG 152 Ca 0.36 -0.09 -0.05 0.00 0.07 0.00 0.00 59.98 60.27 2hva h ARG 152 Cb -0.06 -0.20 -0.03 0.00 0.08 0.00 0.00 29.97 29.76 2hva h ARG 152 CO -0.10 0.69 0.19 1.15 -1.07 0.00 0.00 179.97 180.83 2hva h THR 153 N 0.97 1.25 -0.19 2.04 2.02 -1.17 -1.35 112.91 116.48 2hva h THR 153 Ca 0.25 -0.84 0.03 0.00 0.77 0.00 0.00 66.41 66.62 2hva h THR 153 Cb -0.02 0.62 -0.03 0.00 -1.74 0.00 0.00 68.15 66.99 2hva h THR 153 CO -0.05 0.32 0.02 0.74 0.37 0.00 0.00 175.52 176.93 2hva h THR 154 N 0.88 0.90 0.00 3.16 2.02 -0.68 -0.78 112.91 118.41 2hva h THR 154 Ca 0.20 -0.03 0.00 0.00 0.77 0.00 0.00 66.41 67.35 2hva h THR 154 Cb 0.29 0.79 0.00 0.00 -1.74 0.00 0.00 68.15 67.50 2hva h THR 154 CO -0.01 0.02 0.00 0.18 0.37 0.00 0.00 175.52 176.08 2hva n LEU 155 N -5.10 0.00 -0.35 2.58 4.77 -0.70 -3.58 117.00 114.62 2hva n LEU 155 Ca -0.03 0.45 0.26 0.00 -0.03 0.00 0.00 56.01 56.67 2hva n LEU 155 Cb 0.09 -0.45 0.55 0.00 -2.33 0.00 0.00 43.42 41.28 2hva n LEU 155 CO 0.28 -0.15 1.22 -0.08 -1.33 0.00 0.00 177.39 177.33 2hva h GLU 156 N 0.00 0.30 -1.11 3.23 4.81 0.05 0.46 114.58 122.31 2hva h GLU 156 Ca 0.00 -0.02 -0.50 0.00 -0.13 0.00 0.00 59.36 58.71 2hva h GLU 156 Cb 0.31 -0.07 -0.24 0.00 0.63 0.00 0.00 28.75 29.38 2hva h GLU 156 CO 0.00 0.20 0.65 0.41 -0.73 0.00 0.00 179.01 179.54 2hva n GLY 157 N -1.48 4.79 3.34 1.92 0.00 -1.23 -4.92 105.19 107.60 2hva n GLY 157 Ca 0.29 -1.50 -0.10 0.00 0.00 0.00 0.00 46.02 44.70 2hva n GLY 157 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2hva s THR 158 N -3.46 0.03 -1.06 2.61 -4.23 0.16 -5.04 115.64 104.65 2hva s THR 158 Ca 0.51 -1.67 0.04 0.00 -1.18 0.00 0.00 61.69 59.39 2hva s THR 158 Cb 0.41 -2.20 0.20 0.00 1.34 0.00 0.00 72.50 72.25 2hva s THR 158 CO 0.03 -0.13 0.89 -0.81 -0.54 0.00 0.00 174.62 174.07 2hva n PRO 159 N -0.27 1.89 -0.46 3.99 -0.05 -1.26 -4.94 135.00 133.90 2hva n PRO 159 Ca -0.02 -0.79 -0.29 0.00 -0.05 0.00 0.00 63.50 62.35 2hva n PRO 159 Cb 0.64 -1.58 0.26 0.00 -0.05 0.00 0.00 33.50 32.76 2hva n PRO 159 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 175.50 175.45 2hva n ALA 160 N 0.14 -3.45 -4.14 0.55 0.00 -1.26 -5.06 120.51 107.29 2hva n ALA 160 Ca 0.07 -1.33 -0.21 0.00 0.00 0.00 0.00 53.44 51.98 2hva n ALA 160 Cb 0.42 -1.87 -0.06 0.00 0.00 0.00 0.00 19.45 17.94 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 -5.06 0.00 -3.69 0.00 -1.04 -1.26 -5.05 114.28 98.18 2hva n THR 161 Ca 0.03 -2.02 -0.13 0.00 -2.04 0.00 0.00 64.05 59.90 2hva n THR 161 Cb 0.56 0.91 -0.09 0.00 -1.82 0.00 0.00 70.33 69.88 2hva n THR 161 CO 0.00 0.00 0.00 -0.31 -0.64 0.00 0.00 175.07 174.12 2hva s TYR 162 N -3.02 -0.64 0.01 -1.42 1.51 -1.26 -3.81 117.35 108.71 2hva s TYR 162 Ca 0.28 1.49 -0.06 0.00 -1.01 0.00 0.00 57.07 57.77 2hva s TYR 162 Cb 0.01 0.25 -0.03 0.00 -0.11 0.00 0.00 41.96 42.08 2hva s TYR 162 CO 0.19 -0.31 0.92 1.96 -1.11 0.00 0.00 175.55 177.20 2hva h GLN 163 N 5.63 -0.19 0.00 -0.62 1.08 -1.79 -3.39 115.11 115.83 2hva h GLN 163 Ca -0.29 0.01 0.00 0.00 -1.45 0.00 0.00 58.65 56.92 2hva h GLN 163 Cb 1.18 0.04 0.00 0.00 -0.05 0.00 0.00 27.48 28.65 2hva h GLN 163 CO 0.18 -0.13 0.00 0.41 -0.95 0.00 0.00 178.83 178.34 2hva n GLY 164 N -0.61 -1.88 2.74 3.46 0.00 -1.26 -4.98 105.19 102.65 2hva n GLY 164 Ca -0.03 0.55 -0.08 0.00 0.00 0.00 0.00 46.02 46.46 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 -1.02 -2.81 -3.64 1.61 9.92 -1.26 -5.12 116.55 114.23 2hva n ASP 165 Ca 0.00 -3.32 -0.07 0.00 -0.53 0.00 0.00 54.79 50.87 2hva n ASP 165 Cb 0.00 1.79 -0.07 0.00 -0.64 0.00 0.00 41.12 42.20 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 0.63 0.00 0.21 2.53 0.11 -1.26 -3.92 120.40 118.71 2hva s VAL 166 Ca 0.32 0.00 -0.01 0.00 -2.93 0.00 0.00 61.98 59.35 2hva s VAL 166 Cb 0.23 -1.00 -0.04 0.00 -1.53 0.00 0.00 36.38 34.05 2hva s VAL 166 CO -0.24 0.00 0.16 -0.72 -3.33 0.00 0.00 175.10 170.98 2hva s TYR 167 N 1.39 1.15 -0.06 1.54 1.13 -1.05 -3.48 117.35 117.97 2hva s TYR 167 Ca -0.08 -1.36 0.05 0.00 -1.41 0.00 0.00 57.07 54.27 2hva s TYR 167 Cb -0.05 -0.52 -0.02 0.00 -1.10 0.00 0.00 41.96 40.27 2hva s TYR 167 CO -0.16 -0.68 -0.21 0.71 -2.51 0.00 0.00 175.55 172.70 2hva s TYR 168 N -4.10 2.53 0.00 -3.49 2.02 -0.11 0.77 117.35 114.97 2hva s TYR 168 Ca 0.38 -0.52 0.03 0.00 -0.37 0.00 0.00 57.07 56.60 2hva s TYR 168 Cb 0.06 -1.62 -0.03 0.00 -0.40 0.00 0.00 41.96 39.97 2hva s TYR 168 CO 0.13 -0.08 -0.08 0.00 -1.57 0.00 0.00 175.55 173.95 2hva s ALA 170 N -0.98 0.95 0.00 0.00 0.00 0.31 -2.94 121.76 119.09 2hva s ALA 170 Ca 0.17 -0.72 0.00 0.00 0.00 0.00 0.00 51.96 51.41 2hva s ALA 170 Cb -0.11 -0.13 0.00 0.00 0.00 0.00 0.00 23.12 22.88 2hva s ALA 170 CO 0.07 0.16 0.00 0.41 0.00 0.00 0.00 175.76 176.40 2hva n GLY 171 N 1.99 0.35 3.18 0.00 0.00 -1.26 -1.00 105.19 108.45 2hva n GLY 171 Ca -0.18 -0.82 -0.30 0.00 0.00 0.00 0.00 46.02 44.72 2hva n GLY 171 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2hva s TYR 172 N 0.00 2.25 -0.16 1.61 -0.85 -1.26 -4.81 117.35 114.12 2hva s TYR 172 Ca 0.00 -0.87 -0.19 0.00 -0.52 0.00 0.00 57.07 55.49 2hva s TYR 172 Cb 0.00 -1.52 0.05 0.00 0.38 0.00 0.00 41.96 40.87 2hva s TYR 172 CO 0.00 -0.35 0.52 -0.51 -1.52 0.00 0.00 175.55 173.69 2hva s ASP 173 N 0.34 -0.52 -0.10 -0.18 1.01 -1.26 -5.10 116.67 110.85 2hva s ASP 173 Ca -0.15 0.93 -0.30 0.00 0.71 0.00 0.00 52.55 53.74 2hva s ASP 173 Cb -0.17 0.94 -0.02 0.00 1.01 0.00 0.00 42.92 44.69 2hva s ASP 173 CO 0.07 -0.26 1.19 -2.16 0.21 0.00 0.00 175.17 174.22 2hva s PRO 174 N -0.04 4.32 -0.37 8.23 0.04 -1.26 -4.91 135.00 141.00 2hva s PRO 174 Ca -0.03 1.62 -0.36 0.00 0.04 0.00 0.00 61.00 62.28 2hva s PRO 174 Cb -0.03 -3.62 -0.12 0.00 0.04 0.00 0.00 34.50 30.76 2hva s PRO 174 CO 0.02 -0.52 2.19 -2.30 0.04 0.00 0.00 177.00 176.43 2hva n PRO 175 N 5.66 0.95 0.11 0.56 -0.02 -1.26 -4.55 135.00 136.46 2hva n PRO 175 Ca 0.12 0.26 0.00 0.00 -2.02 0.00 0.00 63.50 61.85 2hva n PRO 175 Cb 0.46 -2.36 0.00 0.00 -0.02 0.00 0.00 33.50 31.58 2hva n PRO 175 CO 0.00 0.00 0.00 -1.33 1.98 0.00 0.00 175.50 176.15 2hva n MET 176 N 8.14 0.00 -3.83 -0.52 2.81 -1.26 -5.11 117.12 117.35 2hva n MET 176 Ca 0.43 0.00 -0.25 0.00 -1.81 0.00 0.00 57.70 56.06 2hva n MET 176 Cb 0.20 0.00 -0.17 0.00 -0.71 0.00 0.00 33.22 32.54 2hva n MET 176 CO 0.00 0.00 0.00 -1.59 1.51 0.00 0.00 175.97 175.89 2hva s LYS 177 N -2.00 1.05 0.89 0.03 0.00 -1.26 -5.15 119.74 113.30 2hva s LYS 177 Ca 0.00 -0.15 -0.13 0.00 0.00 0.00 0.00 55.97 55.69 2hva s LYS 177 Cb 0.00 -1.42 0.15 0.00 0.00 0.00 0.00 37.83 36.56 2hva s LYS 177 CO 0.00 -0.33 1.25 -1.25 0.00 0.00 0.00 175.35 175.01 2hva s PRO 178 N 1.82 1.16 -1.59 1.78 0.04 -1.26 -4.29 135.00 132.66 2hva s PRO 178 Ca 0.04 -0.30 -0.04 0.00 0.04 0.00 0.00 61.00 60.74 2hva s PRO 178 Cb -0.13 -1.92 0.01 0.00 0.04 0.00 0.00 34.50 32.49 2hva s PRO 178 CO -0.07 -2.06 0.57 0.66 0.04 0.00 0.00 177.00 176.14 2hva n TYR 179 N -3.54 -1.92 -2.03 0.56 4.01 -1.26 -4.83 117.16 108.16 2hva n TYR 179 Ca 0.13 0.49 -0.01 0.00 -0.16 0.00 0.00 57.90 58.35 2hva n TYR 179 Cb 0.60 -4.50 -0.01 0.00 -0.31 0.00 0.00 39.34 35.11 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 -1.50 0.81 3.18 2.72 0.00 -1.26 -5.08 105.19 104.06 2hva n GLY 180 Ca -0.12 -0.05 -0.11 0.00 0.00 0.00 0.00 46.02 45.73 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 1.06 -0.04 1.61 3.00 -1.26 -5.07 118.95 118.25 2hva s ARG 181 Ca 0.02 -1.53 -0.01 0.00 0.00 0.00 0.00 55.73 54.21 2hva s ARG 181 Cb 0.03 0.17 0.03 0.00 0.00 0.00 0.00 34.95 35.17 2hva s ARG 181 CO -0.01 -0.29 0.04 1.03 0.00 0.00 0.00 175.30 176.06 2hva s ARG 182 N -4.07 0.08 0.04 3.54 3.00 -1.26 -3.36 118.95 116.92 2hva s ARG 182 Ca 0.30 0.25 0.09 0.00 0.00 0.00 0.00 55.73 56.36 2hva s ARG 182 Cb 0.07 -0.51 -0.03 0.00 0.00 0.00 0.00 34.95 34.49 2hva s ARG 182 CO 0.06 -0.26 -0.25 -0.80 0.00 0.00 0.00 175.30 174.05 2hva s ASN 183 N 1.71 3.02 0.01 0.23 -0.87 -1.26 -4.52 114.94 113.26 2hva s ASN 183 Ca -0.01 -0.57 0.01 0.00 -1.57 0.00 0.00 52.86 50.73 2hva s ASN 183 Cb -0.13 -0.28 -0.01 0.00 -0.02 0.00 0.00 41.25 40.82 2hva s ASN 183 CO -0.03 0.25 -0.04 -1.61 -2.57 0.00 0.00 177.10 173.09 2hva s GLU 184 N -1.17 0.33 -0.17 -0.60 2.02 -0.17 -4.06 118.70 114.88 2hva s GLU 184 Ca 0.11 -0.29 -0.00 0.00 0.02 0.00 0.00 54.97 54.80 2hva s GLU 184 Cb -0.10 -0.23 0.04 0.00 0.10 0.00 0.00 34.13 33.94 2hva s GLU 184 CO 0.02 0.06 -0.05 0.08 0.02 0.00 0.00 175.26 175.38 2hva s VAL 185 N -0.47 1.15 -0.18 2.63 1.01 -1.23 -0.53 120.40 122.77 2hva s VAL 185 Ca -0.03 -0.67 0.00 0.00 0.00 0.00 0.00 61.98 61.28 2hva s VAL 185 Cb -0.04 -1.32 0.01 0.00 0.00 0.00 0.00 36.38 35.03 2hva s VAL 185 CO -0.00 0.12 -0.16 -1.66 0.00 0.00 0.00 175.10 173.39 2hva s TRP 186 N 1.61 2.80 0.03 5.22 1.48 -0.40 -3.62 118.94 126.05 2hva s TRP 186 Ca 0.00 -1.34 -0.15 0.00 -1.06 0.00 0.00 56.10 53.56 2hva s TRP 186 Cb -0.15 -1.93 -0.06 0.00 -1.16 0.00 0.00 33.47 30.17 2hva s TRP 186 CO -0.08 -0.66 0.44 -0.51 -4.06 0.00 0.00 176.95 172.08 2hva s LEU 187 N 1.15 4.46 -0.18 -4.66 1.43 -1.24 -0.94 118.68 118.70 2hva s LEU 187 Ca 0.01 0.99 -0.29 0.00 -1.03 0.00 0.00 54.13 53.81 2hva s LEU 187 Cb -0.14 -2.72 -0.02 0.00 0.03 0.00 0.00 46.19 43.34 2hva s LEU 187 CO -0.07 0.29 1.34 -0.69 0.23 0.00 0.00 176.35 177.45 2hva s VAL 188 N -1.15 4.13 0.20 -1.59 1.01 -1.23 -3.77 120.40 118.00 2hva s VAL 188 Ca 0.26 1.34 -0.16 0.00 0.00 0.00 0.00 61.98 63.43 2hva s VAL 188 Cb -0.17 -3.93 -0.08 0.00 0.00 0.00 0.00 36.38 32.20 2hva s VAL 188 CO 0.15 -0.19 0.63 -0.75 0.00 0.00 0.00 175.10 174.93 2hva s LYS 189 N 3.77 4.06 0.00 2.72 2.36 0.13 -2.94 119.74 129.83 2hva s LYS 189 Ca 0.59 0.62 0.24 0.00 -2.55 0.00 0.00 55.97 54.86 2hva s LYS 189 Cb -0.23 -2.84 0.19 0.00 -1.05 0.00 0.00 37.83 33.90 2hva s LYS 189 CO 0.19 0.41 1.25 0.00 1.55 0.00 0.00 175.35 178.74