#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 2.06 0.00 4.03 0.20 -1.26 -5.10 118.68 118.61 2hva s LEU 2 Ca 0.00 -0.14 0.00 0.00 0.69 0.00 0.00 54.13 54.68 2hva s LEU 2 Cb 0.00 -0.09 0.00 0.00 -0.43 0.00 0.00 46.19 45.67 2hva s LEU 2 CO 0.00 -0.04 0.00 0.61 -0.29 0.00 0.00 176.35 176.63 2hva n GLY 3 N 2.71 1.18 2.63 7.98 0.00 -1.26 -5.12 105.19 113.31 2hva n GLY 3 Ca -0.15 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.84 2hva n GLY 3 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2hva n MET 4 N 0.00 -4.05 -3.20 1.61 2.81 -1.26 -4.92 117.12 108.11 2hva n MET 4 Ca 0.00 3.12 -0.45 0.00 -1.81 0.00 0.00 57.70 58.56 2hva n MET 4 Cb 0.00 -5.16 -0.04 0.00 -0.71 0.00 0.00 33.22 27.31 2hva n MET 4 CO 0.00 0.00 0.00 0.96 1.51 0.00 0.00 175.97 178.44 2hva s ILE 5 N -1.10 5.09 -0.29 2.02 -4.36 -1.26 -5.03 121.20 116.27 2hva s ILE 5 Ca -0.16 -1.48 -0.12 0.00 -0.26 0.00 0.00 60.65 58.64 2hva s ILE 5 Cb 0.01 -4.46 -0.04 0.00 1.25 0.00 0.00 42.46 39.22 2hva s ILE 5 CO 0.78 -1.06 0.22 -0.60 0.24 0.00 0.00 174.94 174.53 2hva s ARG 6 N 1.87 3.90 -0.05 0.37 3.00 -1.26 -5.07 118.95 121.70 2hva s ARG 6 Ca 0.12 -0.32 0.01 0.00 -1.00 0.00 0.00 55.73 54.54 2hva s ARG 6 Cb -0.22 -3.68 0.02 0.00 0.00 0.00 0.00 34.95 31.07 2hva s ARG 6 CO 0.01 -0.23 -0.06 1.21 0.00 0.00 0.00 175.30 176.23 2hva s ASN 7 N 1.74 1.17 0.08 -2.12 2.47 -1.26 -5.13 114.94 111.89 2hva s ASN 7 Ca 0.08 -0.16 -0.26 0.00 0.42 0.00 0.00 52.86 52.94 2hva s ASN 7 Cb -0.16 -0.52 -0.06 0.00 -1.45 0.00 0.00 41.25 39.05 2hva s ASN 7 CO 0.11 -0.05 0.82 -0.55 -3.72 0.00 0.00 177.10 173.71 2hva s SER 8 N 0.98 7.32 -0.40 -4.21 0.15 -1.26 -5.00 113.70 111.28 2hva s SER 8 Ca -0.10 1.58 -0.01 0.00 0.70 0.00 0.00 55.95 58.11 2hva s SER 8 Cb -0.14 -2.51 0.20 0.00 -1.71 0.00 0.00 66.02 61.86 2hva s SER 8 CO -0.00 0.03 0.93 -0.22 1.20 0.00 0.00 173.24 175.17 2hva s LEU 9 N -0.23 -0.79 -0.31 3.45 0.20 -1.26 -5.11 118.68 114.63 2hva s LEU 9 Ca 0.40 -0.79 0.02 0.00 0.69 0.00 0.00 54.13 54.45 2hva s LEU 9 Cb -0.22 1.03 0.15 0.00 -0.43 0.00 0.00 46.19 46.72 2hva s LEU 9 CO 0.25 -0.04 0.38 -0.36 -0.29 0.00 0.00 176.35 176.29 2hva s PHE 10 N 1.20 -0.76 0.00 5.38 0.40 -1.26 -5.12 117.98 117.83 2hva s PHE 10 Ca 0.23 -0.03 0.00 0.00 -0.60 0.00 0.00 56.93 56.53 2hva s PHE 10 Cb 0.05 -0.27 0.00 0.00 0.51 0.00 0.00 43.02 43.31 2hva s PHE 10 CO -0.09 -0.97 0.00 0.41 0.70 0.00 0.00 175.22 175.26 2hva n GLY 11 N 5.11 1.09 3.69 4.36 0.00 -1.26 -4.97 105.19 113.21 2hva n GLY 11 Ca 0.02 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.65 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 6.79 0.04 1.61 0.01 -1.26 -5.06 113.70 114.82 2hva s SER 12 Ca 0.00 0.95 0.05 0.00 1.31 0.00 0.00 55.95 58.26 2hva s SER 12 Cb 0.00 -2.36 -0.02 0.00 0.21 0.00 0.00 66.02 63.85 2hva s SER 12 CO 0.00 -0.18 -0.15 0.68 0.41 0.00 0.00 173.24 174.00 2hva s VAL 13 N 1.34 1.20 -0.06 3.43 -7.23 -1.26 -5.15 120.40 112.68 2hva s VAL 13 Ca 0.31 -1.03 0.04 0.00 -1.81 0.00 0.00 61.98 59.49 2hva s VAL 13 Cb -0.16 -1.08 0.00 0.00 0.56 0.00 0.00 36.38 35.70 2hva s VAL 13 CO 0.13 0.04 -0.17 -1.61 -0.31 0.00 0.00 175.10 173.18 2hva s GLU 14 N -1.14 2.01 -0.12 4.82 0.41 -1.26 -5.13 118.70 118.28 2hva s GLU 14 Ca 0.03 -0.59 0.01 0.00 -0.41 0.00 0.00 54.97 54.00 2hva s GLU 14 Cb -0.08 -1.65 -0.01 0.00 -1.78 0.00 0.00 34.13 30.61 2hva s GLU 14 CO 0.01 0.15 -0.16 -0.08 -0.49 0.00 0.00 175.26 174.70 2hva s THR 15 N 0.32 2.76 -0.27 3.63 -1.32 -1.26 -5.09 115.64 114.42 2hva s THR 15 Ca -0.11 -0.76 -0.03 0.00 -1.21 0.00 0.00 61.69 59.57 2hva s THR 15 Cb -0.14 -2.14 0.09 0.00 -1.51 0.00 0.00 72.50 68.80 2hva s THR 15 CO 0.04 0.53 0.11 0.86 -2.21 0.00 0.00 174.62 173.95 2hva s TRP 16 N 0.40 0.60 0.41 9.09 -0.11 -1.26 -5.14 118.94 122.93 2hva s TRP 16 Ca -0.12 -0.95 -0.25 0.00 1.22 0.00 0.00 56.10 56.00 2hva s TRP 16 Cb -0.16 -1.02 -0.08 0.00 -1.50 0.00 0.00 33.47 30.70 2hva s TRP 16 CO 0.06 -0.77 1.22 -1.25 -4.62 0.00 0.00 176.95 171.58 2hva s PRO 17 N 2.00 3.97 -0.23 5.86 0.04 -1.26 -4.41 135.00 140.97 2hva s PRO 17 Ca 0.07 1.95 -0.03 0.00 0.04 0.00 0.00 61.00 63.03 2hva s PRO 17 Cb -0.16 -2.66 0.01 0.00 0.04 0.00 0.00 34.50 31.72 2hva s PRO 17 CO -0.29 -0.43 0.05 1.87 0.04 0.00 0.00 177.00 178.25 2hva n TRP 18 N 0.00 -3.47 -3.71 0.56 -0.00 -0.79 -4.97 117.44 105.06 2hva n TRP 18 Ca 0.05 1.67 -0.28 0.00 -0.00 0.00 0.00 57.50 58.94 2hva n TRP 18 Cb 0.46 -3.51 -0.16 0.00 -0.00 0.00 0.00 31.31 28.09 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 -1.29 0.58 -0.33 5.87 0.74 -0.30 -4.96 119.66 119.97 2hva s GLN 19 Ca -0.06 -0.47 -0.29 0.00 0.05 0.00 0.00 55.36 54.59 2hva s GLN 19 Cb 0.00 -2.02 -0.00 0.00 1.10 0.00 0.00 33.01 32.09 2hva s GLN 19 CO 0.66 -0.70 1.42 0.08 -0.55 0.00 0.00 175.29 176.20 2hva s VAL 20 N 1.87 3.94 -0.92 1.34 1.01 -1.26 -2.67 120.40 123.71 2hva s VAL 20 Ca 0.01 1.02 0.22 0.00 0.00 0.00 0.00 61.98 63.24 2hva s VAL 20 Cb -0.17 -4.06 -0.16 0.00 0.00 0.00 0.00 36.38 31.99 2hva s VAL 20 CO -0.11 -0.54 1.03 0.18 0.00 0.00 0.00 175.10 175.66 2hva n LEU 21 N 8.33 0.79 -3.62 3.92 4.77 -0.15 -5.00 117.00 126.04 2hva n LEU 21 Ca 0.17 -0.30 -0.04 0.00 -0.03 0.00 0.00 56.01 55.80 2hva n LEU 21 Cb 0.47 -0.08 -0.02 0.00 -2.33 0.00 0.00 43.42 41.47 2hva n LEU 21 CO 0.66 0.19 0.82 -0.55 -1.33 0.00 0.00 177.39 177.18 2hva s SER 22 N -3.16 -0.21 0.00 -1.43 0.15 -1.23 -4.88 113.70 102.94 2hva s SER 22 Ca 0.08 -0.15 0.00 0.00 0.70 0.00 0.00 55.95 56.58 2hva s SER 22 Cb 0.16 0.33 0.00 0.00 -1.71 0.00 0.00 66.02 64.80 2hva s SER 22 CO 0.82 -0.58 0.00 0.35 1.20 0.00 0.00 173.24 175.03 2hva n THR 23 N -0.33 0.00 -1.86 6.45 -2.24 -1.26 -2.61 114.28 112.43 2hva n THR 23 Ca -0.06 0.00 -0.41 0.00 -2.27 0.00 0.00 64.05 61.31 2hva n THR 23 Cb 0.61 -0.19 -0.01 0.00 -2.10 0.00 0.00 70.33 68.64 2hva n THR 23 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2hva s GLY 24 N -3.13 2.58 0.00 3.38 0.00 -1.26 -4.07 107.32 104.82 2hva s GLY 24 Ca 0.00 1.50 0.00 0.00 0.00 0.00 0.00 44.72 46.22 2hva s GLY 24 CO 0.00 2.32 0.00 0.61 0.00 0.00 0.00 173.10 176.03 2hva n GLY 25 N 1.32 5.35 3.85 0.20 0.00 -1.26 -4.61 105.19 110.04 2hva n GLY 25 Ca 0.04 -1.34 -0.31 0.00 0.00 0.00 0.00 46.02 44.40 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 1.38 3.50 0.44 1.61 1.02 -0.48 -4.86 119.74 122.35 2hva s LYS 26 Ca 0.00 0.88 0.20 0.00 0.02 0.00 0.00 55.97 57.06 2hva s LYS 26 Cb 0.00 -2.07 1.04 0.00 -0.52 0.00 0.00 37.83 36.29 2hva s LYS 26 CO 0.00 -0.64 1.94 1.49 -0.92 0.00 0.00 175.35 177.21 2hva h GLU 27 N -0.08 0.00 0.06 1.68 4.81 -2.01 -2.98 114.58 116.06 2hva h GLU 27 Ca -0.45 0.00 -0.33 0.00 -0.13 0.00 0.00 59.36 58.45 2hva h GLU 27 Cb 1.20 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 30.54 2hva h GLU 27 CO 0.60 0.24 -1.85 -3.47 -0.73 0.00 0.00 179.01 173.81 2hva n ASP 28 N -3.87 1.51 -3.56 1.04 2.03 -1.26 -4.87 116.55 107.56 2hva n ASP 28 Ca -0.02 0.32 -0.16 0.00 0.52 0.00 0.00 54.79 55.46 2hva n ASP 28 Cb 0.33 -0.47 -0.13 0.00 -0.72 0.00 0.00 41.12 40.13 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 -2.58 -0.37 0.16 5.18 -7.23 -1.13 -4.98 120.40 109.45 2hva s VAL 29 Ca -0.13 0.09 -0.04 0.00 -1.81 0.00 0.00 61.98 60.08 2hva s VAL 29 Cb 0.07 -0.56 -0.05 0.00 0.56 0.00 0.00 36.38 36.40 2hva s VAL 29 CO 0.80 -0.04 0.39 -0.55 -0.31 0.00 0.00 175.10 175.39 2hva s SER 30 N 2.37 6.48 0.07 4.85 0.15 -1.21 -1.39 113.70 125.02 2hva s SER 30 Ca 0.05 0.58 -0.00 0.00 0.70 0.00 0.00 55.95 57.28 2hva s SER 30 Cb -0.14 -2.09 -0.04 0.00 -1.71 0.00 0.00 66.02 62.04 2hva s SER 30 CO -0.10 0.02 -0.03 -0.72 1.20 0.00 0.00 173.24 173.61 2hva s TYR 31 N -1.71 0.62 -0.07 3.44 1.13 -1.26 -3.83 117.35 115.68 2hva s TYR 31 Ca 0.41 -1.04 -0.03 0.00 -1.41 0.00 0.00 57.07 55.00 2hva s TYR 31 Cb -0.12 -0.43 0.04 0.00 -1.10 0.00 0.00 41.96 40.36 2hva s TYR 31 CO 0.25 -0.34 0.15 -1.21 -2.51 0.00 0.00 175.55 171.90 2hva s GLU 32 N -3.91 0.06 -0.21 -3.49 8.01 -1.20 -4.02 118.70 113.94 2hva s GLU 32 Ca 0.09 0.46 -0.24 0.00 0.01 0.00 0.00 54.97 55.29 2hva s GLU 32 Cb 0.07 -0.23 -0.01 0.00 -4.31 0.00 0.00 34.13 29.65 2hva s GLU 32 CO -0.08 -0.24 0.78 -2.00 0.01 0.00 0.00 175.26 173.73 2hva s GLU 33 N 1.74 4.23 -0.07 1.61 2.12 -1.07 -3.25 118.70 124.00 2hva s GLU 33 Ca -0.03 0.88 0.01 0.00 0.36 0.00 0.00 54.97 56.20 2hva s GLU 33 Cb -0.12 -3.60 0.02 0.00 0.26 0.00 0.00 34.13 30.68 2hva s GLU 33 CO -0.06 -0.38 -0.09 -0.98 -0.54 0.00 0.00 175.26 173.21 2hva s ARG 34 N 2.37 1.45 -0.08 4.30 1.70 -1.23 -0.98 118.95 126.48 2hva s ARG 34 Ca 0.34 -0.31 0.05 0.00 -0.47 0.00 0.00 55.73 55.34 2hva s ARG 34 Cb -0.16 -1.29 -0.01 0.00 -0.57 0.00 0.00 34.95 32.92 2hva s ARG 34 CO 0.10 -0.05 -0.23 0.00 -1.08 0.00 0.00 175.30 174.03 2hva s ALA 35 N 0.91 2.22 0.09 7.88 0.00 -1.09 -3.81 121.76 127.96 2hva s ALA 35 Ca -0.10 -1.00 -0.01 0.00 0.00 0.00 0.00 51.96 50.85 2hva s ALA 35 Cb -0.15 -0.78 -0.04 0.00 0.00 0.00 0.00 23.12 22.15 2hva s ALA 35 CO 0.01 0.35 0.00 0.00 0.00 0.00 0.00 175.76 176.13 2hva s GLU 37 N -3.97 -0.86 0.00 0.00 2.12 -1.26 -4.51 118.70 110.22 2hva s GLU 37 Ca 0.14 0.63 0.00 0.00 0.36 0.00 0.00 54.97 56.10 2hva s GLU 37 Cb 0.08 -1.58 0.00 0.00 0.26 0.00 0.00 34.13 32.89 2hva s GLU 37 CO -0.05 -3.63 0.00 0.41 -0.54 0.00 0.00 175.26 171.46 2hva n GLY 38 N 0.29 -0.01 0.00 -1.50 0.00 -1.26 -4.75 105.19 97.96 2hva n GLY 38 Ca 0.04 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 45.99 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 3.95 0.05 3.84 -0.02 0.00 -1.26 -4.93 105.19 106.82 2hva n GLY 39 Ca 0.00 -2.29 -0.37 0.00 0.00 0.00 0.00 46.02 43.37 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 -0.08 3.65 0.08 1.61 3.01 -1.26 -3.83 119.74 122.93 2hva s LYS 40 Ca 0.00 -0.10 0.01 0.00 -1.01 0.00 0.00 55.97 54.87 2hva s LYS 40 Cb 0.00 -3.25 -0.04 0.00 -1.01 0.00 0.00 37.83 33.53 2hva s LYS 40 CO 0.00 0.66 -0.05 -0.06 0.51 0.00 0.00 175.35 176.41 2hva s PHE 41 N -0.71 0.74 -0.21 3.18 0.40 -0.91 -3.50 117.98 116.97 2hva s PHE 41 Ca 0.14 -0.97 -0.08 0.00 -0.60 0.00 0.00 56.93 55.42 2hva s PHE 41 Cb -0.12 -0.46 -0.04 0.00 0.51 0.00 0.00 43.02 42.90 2hva s PHE 41 CO 0.04 -0.24 0.09 0.00 0.70 0.00 0.00 175.22 175.80 2hva s ALA 42 N -3.71 3.41 -0.12 5.36 0.00 -1.15 -2.32 121.76 123.23 2hva s ALA 42 Ca 0.10 -0.85 -0.00 0.00 0.00 0.00 0.00 51.96 51.21 2hva s ALA 42 Cb 0.06 -2.04 -0.02 0.00 0.00 0.00 0.00 23.12 21.12 2hva s ALA 42 CO -0.07 -0.02 -0.11 0.95 0.00 0.00 0.00 175.76 176.51 2hva s THR 43 N 0.75 3.27 -0.10 0.00 -4.23 -0.74 -1.76 115.64 112.84 2hva s THR 43 Ca 0.04 -0.59 0.01 0.00 -1.18 0.00 0.00 61.69 59.97 2hva s THR 43 Cb -0.13 -2.38 0.02 0.00 1.34 0.00 0.00 72.50 71.35 2hva s THR 43 CO 0.02 0.53 -0.12 -0.69 -0.54 0.00 0.00 174.62 173.82 2hva s VAL 44 N 0.15 1.23 -0.06 2.29 1.01 -0.99 -2.60 120.40 121.44 2hva s VAL 44 Ca -0.05 -0.48 -0.11 0.00 0.00 0.00 0.00 61.98 61.33 2hva s VAL 44 Cb -0.15 -1.16 -0.05 0.00 0.00 0.00 0.00 36.38 35.02 2hva s VAL 44 CO 0.04 0.39 0.28 -0.70 0.00 0.00 0.00 175.10 175.11 2hva s GLU 45 N 1.09 3.69 -0.09 2.72 2.12 -1.26 -1.83 118.70 125.14 2hva s GLU 45 Ca -0.06 0.15 -0.03 0.00 0.36 0.00 0.00 54.97 55.39 2hva s GLU 45 Cb -0.14 -3.21 0.04 0.00 0.26 0.00 0.00 34.13 31.08 2hva s GLU 45 CO -0.02 0.73 0.05 0.08 -0.54 0.00 0.00 175.26 175.56 2hva s VAL 46 N -1.04 0.09 0.39 3.70 1.01 -0.76 -4.96 120.40 118.83 2hva s VAL 46 Ca 0.19 0.13 0.08 0.00 0.00 0.00 0.00 61.98 62.38 2hva s VAL 46 Cb -0.14 -0.43 -0.03 0.00 0.00 0.00 0.00 36.38 35.78 2hva s VAL 46 CO 0.09 0.07 0.30 0.42 0.00 0.00 0.00 175.10 175.97 2hva s THR 47 N 2.08 2.82 -0.70 3.92 -4.23 -1.26 -2.20 115.64 116.07 2hva s THR 47 Ca 0.04 -1.45 0.00 0.00 -1.18 0.00 0.00 61.69 59.09 2hva s THR 47 Cb -0.13 -3.03 0.00 0.00 1.34 0.00 0.00 72.50 70.67 2hva s THR 47 CO -0.05 -0.06 0.00 -0.67 -0.54 0.00 0.00 174.62 173.30 2hva n ASP 48 N -1.41 -2.80 -3.51 3.99 2.03 -1.26 -4.89 116.55 108.71 2hva n ASP 48 Ca 0.01 0.29 -0.07 0.00 0.52 0.00 0.00 54.79 55.54 2hva n ASP 48 Cb 0.62 -2.46 -0.08 0.00 -0.72 0.00 0.00 41.12 38.48 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 -4.78 0.36 0.23 -0.67 1.02 -1.25 -5.03 119.74 109.62 2hva s LYS 49 Ca 0.00 0.88 -0.03 0.00 0.02 0.00 0.00 55.97 56.84 2hva s LYS 49 Cb 0.00 0.09 0.05 0.00 -0.52 0.00 0.00 37.83 37.45 2hva s LYS 49 CO 0.00 -0.41 0.11 -2.30 -0.92 0.00 0.00 175.35 171.83 2hva n PRO 50 N 5.39 -0.86 0.41 -1.68 -0.02 -1.26 -3.80 135.00 133.18 2hva n PRO 50 Ca -0.06 -0.19 -0.16 0.00 -2.02 0.00 0.00 63.50 61.07 2hva n PRO 50 Cb 0.50 -0.32 -0.08 0.00 -0.02 0.00 0.00 33.50 33.58 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 -1.91 0.00 -0.60 -1.45 2.07 -1.88 0.88 116.25 113.36 2hva h VAL 51 Ca -0.05 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.54 2hva h VAL 51 Cb 0.17 0.00 -0.06 0.00 -1.52 0.00 0.00 31.29 29.88 2hva h VAL 51 CO 0.03 0.00 0.29 0.44 0.02 0.00 0.00 177.57 178.35 2hva h ASP 52 N -1.05 0.39 -0.26 0.57 5.19 -2.00 -0.26 116.42 119.01 2hva h ASP 52 Ca -0.11 0.04 -0.05 0.00 -0.62 0.00 0.00 57.03 56.30 2hva h ASP 52 Cb 0.81 -0.03 -0.01 0.00 0.18 0.00 0.00 39.33 40.28 2hva h ASP 52 CO 0.17 0.25 -0.04 -0.33 -3.12 0.00 0.00 179.24 176.17 2hva h GLU 53 N 0.54 0.49 -0.59 3.56 4.39 -1.86 -3.01 114.58 118.10 2hva h GLU 53 Ca 0.28 -0.18 0.03 0.00 0.34 0.00 0.00 59.36 59.83 2hva h GLU 53 Cb 0.23 -0.03 -0.04 0.00 -0.10 0.00 0.00 28.75 28.81 2hva h GLU 53 CO -0.21 0.69 0.36 0.00 -1.16 0.00 0.00 179.01 178.69 2hva h ALA 54 N 0.78 0.77 -0.71 3.43 0.00 0.12 -1.92 119.26 121.73 2hva h ALA 54 Ca 0.07 -0.02 0.08 0.00 0.00 0.00 0.00 54.91 55.04 2hva h ALA 54 Cb 0.50 -0.18 -0.05 0.00 0.00 0.00 0.00 17.79 18.07 2hva h ALA 54 CO 0.02 0.10 0.47 -0.07 0.00 0.00 0.00 179.25 179.77 2hva h LEU 55 N 0.71 0.59 -1.34 0.00 3.38 -1.02 0.70 115.31 118.33 2hva h LEU 55 Ca 0.24 0.01 -0.06 0.00 0.09 0.00 0.00 57.88 58.16 2hva h LEU 55 Cb 0.02 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 2hva h LEU 55 CO -0.10 0.37 -0.15 0.03 0.09 0.00 0.00 178.44 178.68 2hva h ARG 56 N 0.67 0.25 0.09 1.13 2.47 -1.22 0.32 114.38 118.08 2hva h ARG 56 Ca 0.32 -0.06 -0.32 0.00 -1.26 0.00 0.00 59.98 58.65 2hva h ARG 56 Cb 0.37 -0.03 -0.02 0.00 -1.65 0.00 0.00 29.97 28.63 2hva h ARG 56 CO -0.11 0.41 -1.72 1.49 0.56 0.00 0.00 179.97 180.60 2hva h GLU 57 N 0.23 0.18 -0.12 0.04 4.57 -0.76 -3.37 114.58 115.36 2hva h GLU 57 Ca 0.05 -0.31 -0.18 0.00 -1.18 0.00 0.00 59.36 57.73 2hva h GLU 57 Cb 0.42 0.12 0.01 0.00 -0.16 0.00 0.00 28.75 29.13 2hva h GLU 57 CO 0.03 0.97 -0.63 0.00 -1.18 0.00 0.00 179.01 178.20 2hva h ALA 58 N 0.50 0.24 -0.64 2.92 0.00 0.50 -3.24 119.26 119.54 2hva h ALA 58 Ca -0.31 -0.55 0.04 0.00 0.00 0.00 0.00 54.91 54.09 2hva h ALA 58 Cb 2.02 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 19.75 2hva h ALA 58 CO 0.12 0.51 0.37 0.52 0.00 0.00 0.00 179.25 180.77 2hva h MET 59 N 0.30 0.69 -0.74 0.00 2.86 -0.55 0.16 114.93 117.65 2hva h MET 59 Ca -0.04 -0.04 -0.06 0.00 -2.06 0.00 0.00 59.70 57.50 2hva h MET 59 Cb 1.27 -0.16 -0.03 0.00 0.06 0.00 0.00 31.60 32.74 2hva h MET 59 CO 0.13 0.46 0.24 -1.35 1.06 0.00 0.00 176.91 177.44 2hva h PRO 60 N 0.71 1.14 -0.24 -0.22 0.11 -1.71 0.70 132.00 132.49 2hva h PRO 60 Ca 0.27 -0.24 -0.11 0.00 0.11 0.00 0.00 66.00 66.03 2hva h PRO 60 Cb 0.11 -0.17 -0.00 0.00 0.11 0.00 0.00 31.00 31.05 2hva h PRO 60 CO -0.15 0.97 -0.28 0.87 -0.21 0.00 0.00 178.00 179.20 2hva h LYS 61 N 1.09 0.62 0.01 1.05 1.57 -1.48 -2.28 116.57 117.14 2hva h LYS 61 Ca 0.24 -0.34 -0.22 0.00 -1.87 0.00 0.00 60.65 58.46 2hva h LYS 61 Cb 0.30 0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.62 2hva h LYS 61 CO -0.01 0.94 -0.93 0.97 -0.57 0.00 0.00 179.45 179.85 2hva h ILE 62 N 0.33 1.46 -0.48 1.86 2.10 -0.57 -3.21 117.51 118.99 2hva h ILE 62 Ca 0.03 -2.59 -0.09 0.00 1.08 0.00 0.00 64.86 63.29 2hva h ILE 62 Cb 0.85 2.49 -0.02 0.00 -1.09 0.00 0.00 36.82 39.05 2hva h ILE 62 CO 0.07 0.76 -0.07 0.24 -1.08 0.00 0.00 178.15 178.07 2hva h MET 63 N 0.16 0.85 -0.53 2.19 2.86 0.40 -2.53 114.93 118.33 2hva h MET 63 Ca -0.07 -0.27 -0.03 0.00 -2.06 0.00 0.00 59.70 57.27 2hva h MET 63 Cb 1.57 -0.08 -0.03 0.00 0.06 0.00 0.00 31.60 33.13 2hva h MET 63 CO 0.15 0.90 0.21 0.87 1.06 0.00 0.00 176.91 180.10 2hva h LYS 64 N 0.77 0.77 -0.35 1.72 6.56 -1.44 0.92 116.57 125.52 2hva h LYS 64 Ca 0.13 -0.11 -0.12 0.00 -1.06 0.00 0.00 60.65 59.49 2hva h LYS 64 Cb 0.57 -0.14 -0.01 0.00 -0.57 0.00 0.00 32.23 32.09 2hva h LYS 64 CO 0.03 0.63 -0.24 -0.92 -2.06 0.00 0.00 179.45 176.90 2hva h TYR 65 N 0.76 0.91 0.00 -1.35 3.20 -1.50 0.50 116.97 119.49 2hva h TYR 65 Ca 0.18 -0.25 -0.08 0.00 3.14 0.00 0.00 58.73 61.73 2hva h TYR 65 Cb 0.16 -0.20 -0.01 0.00 1.54 0.00 0.00 36.73 38.21 2hva h TYR 65 CO 0.01 1.00 -0.54 -0.39 -1.64 0.00 0.00 178.16 176.60 2hva h VAL 66 N 0.55 0.51 0.00 1.81 -1.51 -1.11 -3.39 116.25 113.12 2hva h VAL 66 Ca 0.07 -1.76 0.00 0.00 -1.23 0.00 0.00 66.70 63.77 2hva h VAL 66 Cb 0.80 2.18 0.00 0.00 -2.13 0.00 0.00 31.29 32.14 2hva h VAL 66 CO 0.06 0.29 0.00 0.61 -1.23 0.00 0.00 177.57 177.31 2hva n GLY 67 N 1.21 1.65 2.68 5.19 0.00 0.32 -3.07 105.19 113.17 2hva n GLY 67 Ca 0.01 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.95 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 2.50 1.31 2.67 -0.02 0.00 -0.92 -3.89 105.19 106.85 2hva n GLY 68 Ca 0.00 -0.30 -0.29 0.00 0.00 0.00 0.00 46.02 45.43 2hva n GLY 68 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2hva s THR 69 N -0.30 1.05 0.27 2.61 2.01 0.17 -5.00 115.64 116.46 2hva s THR 69 Ca 0.23 -2.14 -0.16 0.00 0.31 0.00 0.00 61.69 59.94 2hva s THR 69 Cb 0.39 -1.75 0.01 0.00 0.01 0.00 0.00 72.50 71.15 2hva s THR 69 CO -0.07 -0.86 0.58 0.20 -0.69 0.00 0.00 174.62 173.78 2hva s ASN 70 N 0.77 -0.11 -0.58 3.53 0.01 -1.26 -4.28 114.94 113.03 2hva s ASN 70 Ca 0.16 -0.85 -0.02 0.00 -0.71 0.00 0.00 52.86 51.44 2hva s ASN 70 Cb -0.23 0.66 0.33 0.00 0.41 0.00 0.00 41.25 42.42 2hva s ASN 70 CO -0.05 -1.25 2.11 -0.90 -1.51 0.00 0.00 177.10 175.50 2hva n ASP 71 N -0.51 7.22 0.00 -1.22 5.68 -1.23 -4.22 116.55 122.27 2hva n ASP 71 Ca -0.03 -3.53 0.00 0.00 -0.50 0.00 0.00 54.79 50.73 2hva n ASP 71 Cb 0.61 -1.04 0.00 0.00 -1.14 0.00 0.00 41.12 39.55 2hva n ASP 71 CO 0.00 0.00 0.00 1.17 -1.33 0.00 0.00 177.20 177.04 2hva n LYS 72 N -0.32 0.00 0.00 0.11 3.00 -1.26 -4.94 118.16 114.75 2hva n LYS 72 Ca 0.51 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.82 2hva n LYS 72 Cb 0.56 -0.09 0.00 0.00 0.00 0.00 0.00 35.03 35.51 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 0.25 0.88 4.02 3.14 0.00 -1.26 -5.13 105.19 107.09 2hva n GLY 73 Ca 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.84 2hva n GLY 73 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2hva s VAL 74 N -1.64 2.58 -0.12 1.61 -7.23 -1.26 -5.12 120.40 109.22 2hva s VAL 74 Ca 0.00 -1.01 -0.02 0.00 -1.81 0.00 0.00 61.98 59.14 2hva s VAL 74 Cb 0.00 -2.59 0.04 0.00 0.56 0.00 0.00 36.38 34.39 2hva s VAL 74 CO 0.00 0.00 0.00 -0.83 -0.31 0.00 0.00 175.10 173.96 2hva s GLY 75 N -4.49 0.62 0.00 2.32 0.00 -1.26 -4.73 107.32 99.78 2hva s GLY 75 Ca 0.58 -0.41 0.00 0.00 0.00 0.00 0.00 44.72 44.89 2hva s GLY 75 CO 0.36 1.18 0.00 1.03 0.00 0.00 0.00 173.10 175.67 2hva n MET 76 N 5.07 3.29 0.00 2.90 2.81 -1.18 -5.11 117.12 124.91 2hva n MET 76 Ca -0.09 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.80 2hva n MET 76 Cb 0.49 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 4.19 1.55 3.03 0.00 -1.21 -4.75 105.19 113.00 2hva n GLY 77 Ca 0.00 -0.50 0.00 0.00 0.00 0.00 0.00 46.02 45.52 2hva n GLY 77 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2hva n MET 78 N 0.00 0.00 -2.51 1.61 2.81 -1.26 -4.62 117.12 113.15 2hva n MET 78 Ca 0.00 0.00 -0.04 0.00 -1.81 0.00 0.00 57.70 55.85 2hva n MET 78 Cb 0.00 -0.23 -0.04 0.00 -0.71 0.00 0.00 33.22 32.24 2hva n MET 78 CO 0.00 0.00 0.00 2.41 1.51 0.00 0.00 175.97 179.89 2hva n THR 79 N -3.23-13.01 -1.49 2.03 -1.04 -1.26 -4.61 114.28 91.66 2hva n THR 79 Ca 0.00 2.88 0.00 0.00 -2.04 0.00 0.00 64.05 64.89 2hva n THR 79 Cb 0.08 -6.43 0.00 0.00 -1.82 0.00 0.00 70.33 62.17 2hva n THR 79 CO 0.00 0.00 0.00 0.55 -0.64 0.00 0.00 175.07 174.98 2hva n VAL 80 N 1.72 -3.46 -1.77 12.58 3.14 -1.26 -4.60 118.33 124.69 2hva n VAL 80 Ca -0.32 1.61 -0.41 0.00 -2.96 0.00 0.00 64.34 62.26 2hva n VAL 80 Cb 0.50 -2.30 -0.01 0.00 -1.06 0.00 0.00 33.84 30.97 2hva n VAL 80 CO 0.00 0.00 0.00 -2.65 -6.46 0.00 0.00 176.83 167.72 2hva n PRO 81 N -1.33 2.70 -2.89 1.45 -0.02 -1.26 -4.84 135.00 128.80 2hva n PRO 81 Ca 0.00 0.95 -0.31 0.00 -2.02 0.00 0.00 63.50 62.12 2hva n PRO 81 Cb 0.09 -2.70 -0.04 0.00 -0.02 0.00 0.00 33.50 30.83 2hva n PRO 81 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 2hva s VAL 82 N -0.71 4.76 0.35 -1.45 -7.23 -1.26 -4.97 120.40 109.90 2hva s VAL 82 Ca 0.57 0.68 0.07 0.00 -1.81 0.00 0.00 61.98 61.50 2hva s VAL 82 Cb -0.48 -3.71 -0.07 0.00 0.56 0.00 0.00 36.38 32.68 2hva s VAL 82 CO 0.58 -0.47 -0.03 -0.44 -0.31 0.00 0.00 175.10 174.44 2hva s SER 83 N -3.01 3.41 -0.00 4.85 0.01 -1.20 -4.78 113.70 112.98 2hva s SER 83 Ca 0.52 -1.29 0.03 0.00 1.31 0.00 0.00 55.95 56.52 2hva s SER 83 Cb -0.10 -0.30 -0.01 0.00 0.21 0.00 0.00 66.02 65.82 2hva s SER 83 CO 0.29 -0.38 -0.09 0.72 0.41 0.00 0.00 173.24 174.19 2hva s PHE 84 N -2.82 0.80 0.19 2.43 -0.71 -1.21 -0.36 117.98 116.30 2hva s PHE 84 Ca 0.34 -0.17 -0.30 0.00 -1.04 0.00 0.00 56.93 55.76 2hva s PHE 84 Cb 0.06 -0.51 -0.08 0.00 -1.21 0.00 0.00 43.02 41.28 2hva s PHE 84 CO 0.16 -0.01 1.06 0.00 -1.34 0.00 0.00 175.22 175.08 2hva s ALA 85 N -0.27 3.35 -0.28 1.99 0.00 0.30 -2.52 121.76 124.33 2hva s ALA 85 Ca 0.03 0.76 -0.01 0.00 0.00 0.00 0.00 51.96 52.74 2hva s ALA 85 Cb -0.04 -3.32 0.09 0.00 0.00 0.00 0.00 23.12 19.85 2hva s ALA 85 CO -0.00 -0.12 0.07 0.14 0.00 0.00 0.00 175.76 175.85 2hva s VAL 86 N -0.43 0.93 -0.31 0.00 -7.23 0.18 -3.09 120.40 110.44 2hva s VAL 86 Ca 0.47 -1.26 -0.29 0.00 -1.81 0.00 0.00 61.98 59.10 2hva s VAL 86 Cb -0.28 -1.60 -0.01 0.00 0.56 0.00 0.00 36.38 35.05 2hva s VAL 86 CO 0.34 -0.53 1.62 -0.36 -0.31 0.00 0.00 175.10 175.86 2hva s PHE 87 N 1.61 2.10 0.06 2.82 0.08 -1.26 -3.73 117.98 119.66 2hva s PHE 87 Ca 0.06 0.62 -0.21 0.00 0.12 0.00 0.00 56.93 57.52 2hva s PHE 87 Cb -0.17 -4.12 -0.06 0.00 -0.57 0.00 0.00 43.02 38.09 2hva s PHE 87 CO -0.19 -2.64 0.63 -1.25 -0.10 0.00 0.00 175.22 171.66 2hva s PRO 88 N 5.09 4.32 0.32 0.24 0.04 -1.26 -2.24 135.00 141.51 2hva s PRO 88 Ca 0.71 0.83 -0.06 0.00 0.04 0.00 0.00 61.00 62.53 2hva s PRO 88 Cb -0.21 -3.29 -0.05 0.00 0.04 0.00 0.00 34.50 30.99 2hva s PRO 88 CO 0.32 0.51 0.60 -0.80 0.04 0.00 0.00 177.00 177.66 2hva s ASN 89 N -0.72 6.44 0.59 6.66 0.01 0.21 -4.96 114.94 123.18 2hva s ASN 89 Ca 0.32 0.78 0.39 0.00 -0.71 0.00 0.00 52.86 53.64 2hva s ASN 89 Cb -0.20 -2.17 2.09 0.00 0.41 0.00 0.00 41.25 41.38 2hva s ASN 89 CO 0.20 -0.25 2.20 -0.33 -1.51 0.00 0.00 177.10 177.41 2hva h GLU 90 N 1.50 0.00 -0.00 -0.60 4.39 -1.98 0.33 114.58 118.22 2hva h GLU 90 Ca -0.48 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.22 2hva h GLU 90 Cb 1.19 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.84 2hva h GLU 90 CO 0.65 0.00 -0.16 -0.25 -1.16 0.00 0.00 179.01 178.10 2hva n ASP 91 N -2.92 0.47 0.00 1.42 8.00 -1.26 -4.91 116.55 117.35 2hva n ASP 91 Ca -0.02 -0.44 0.00 0.00 0.71 0.00 0.00 54.79 55.04 2hva n ASP 91 Cb 0.09 -0.06 0.00 0.00 -0.02 0.00 0.00 41.12 41.13 2hva n ASP 91 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2hva n GLY 92 N 1.34 0.50 3.97 0.44 0.00 0.11 -5.08 105.19 106.47 2hva n GLY 92 Ca 0.12 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.93 2hva n GLY 92 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2hva s SER 93 N -2.85 5.82 -0.05 1.61 0.15 -1.25 -4.82 113.70 112.31 2hva s SER 93 Ca 0.00 0.09 0.02 0.00 0.70 0.00 0.00 55.95 56.76 2hva s SER 93 Cb 0.00 -1.35 -0.03 0.00 -1.71 0.00 0.00 66.02 62.93 2hva s SER 93 CO 0.00 -0.66 -0.10 -0.76 1.20 0.00 0.00 173.24 172.92 2hva s LEU 94 N -4.45 2.97 0.87 3.45 1.43 -1.26 0.68 118.68 122.37 2hva s LEU 94 Ca 0.48 -0.12 -0.11 0.00 -1.03 0.00 0.00 54.13 53.35 2hva s LEU 94 Cb -0.10 -1.64 0.11 0.00 0.03 0.00 0.00 46.19 44.59 2hva s LEU 94 CO 0.36 0.34 1.09 -1.10 0.23 0.00 0.00 176.35 177.27 2hva s GLN 95 N -0.87 1.49 0.08 1.70 -0.21 -0.95 -4.94 119.66 115.96 2hva s GLN 95 Ca 0.13 1.00 0.28 0.00 0.02 0.00 0.00 55.36 56.79 2hva s GLN 95 Cb -0.11 -1.82 1.07 0.00 1.00 0.00 0.00 33.01 33.15 2hva s GLN 95 CO 0.02 -2.13 1.87 1.63 -2.12 0.00 0.00 175.29 174.55 2hva n LYS 96 N -3.83 0.10 -3.01 2.91 4.76 -1.26 -4.69 118.16 113.13 2hva n LYS 96 Ca 0.08 0.08 -0.41 0.00 -2.87 0.00 0.00 58.31 55.20 2hva n LYS 96 Cb 0.54 -1.62 -0.05 0.00 -1.84 0.00 0.00 35.03 32.07 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 -3.04 4.29 0.00 1.97 2.20 -1.25 -3.81 119.74 120.10 2hva s LYS 97 Ca 0.13 0.83 0.03 0.00 -0.36 0.00 0.00 55.97 56.60 2hva s LYS 97 Cb 0.16 -3.55 -0.01 0.00 -1.51 0.00 0.00 37.83 32.92 2hva s LYS 97 CO 0.55 -0.22 -0.11 -1.17 -0.36 0.00 0.00 175.35 174.04 2hva s LEU 98 N 1.81 2.05 -0.20 5.43 2.96 -0.94 -4.49 118.68 125.31 2hva s LEU 98 Ca 0.34 -0.24 0.01 0.00 -0.22 0.00 0.00 54.13 54.02 2hva s LEU 98 Cb -0.16 -0.54 0.04 0.00 0.50 0.00 0.00 46.19 46.02 2hva s LEU 98 CO 0.12 0.10 -0.14 -0.75 -1.32 0.00 0.00 176.35 174.37 2hva s LYS 99 N -0.43 2.43 -0.13 1.98 2.20 -1.18 -1.82 119.74 122.79 2hva s LYS 99 Ca 0.03 -0.92 -0.19 0.00 -0.36 0.00 0.00 55.97 54.53 2hva s LYS 99 Cb -0.05 -2.54 -0.04 0.00 -1.51 0.00 0.00 37.83 33.69 2hva s LYS 99 CO -0.00 -0.37 0.54 0.08 -0.36 0.00 0.00 175.35 175.24 2hva s VAL 100 N 1.30 5.13 -0.07 4.02 1.01 -0.76 0.11 120.40 131.14 2hva s VAL 100 Ca -0.00 1.06 -0.03 0.00 0.00 0.00 0.00 61.98 63.01 2hva s VAL 100 Cb -0.16 -3.87 -0.04 0.00 0.00 0.00 0.00 36.38 32.31 2hva s VAL 100 CO -0.09 0.26 0.08 0.26 0.00 0.00 0.00 175.10 175.61 2hva s TRP 101 N 1.00 3.37 0.10 5.22 0.52 0.52 -2.34 118.94 127.33 2hva s TRP 101 Ca 0.28 0.32 0.08 0.00 0.02 0.00 0.00 56.10 56.80 2hva s TRP 101 Cb -0.16 -1.83 -0.03 0.00 -1.15 0.00 0.00 33.47 30.30 2hva s TRP 101 CO 0.11 0.60 -0.19 0.12 0.02 0.00 0.00 176.95 177.61 2hva s PHE 102 N -1.06 1.69 -0.37 -1.98 2.19 -0.72 -3.25 117.98 114.49 2hva s PHE 102 Ca 0.18 -0.43 -0.07 0.00 0.33 0.00 0.00 56.93 56.93 2hva s PHE 102 Cb -0.12 -0.92 0.05 0.00 -1.31 0.00 0.00 43.02 40.73 2hva s PHE 102 CO 0.08 0.19 0.16 1.03 1.83 0.00 0.00 175.22 178.51 2hva s ARG 103 N -2.01 2.59 0.14 10.12 1.81 -1.26 -2.93 118.95 127.41 2hva s ARG 103 Ca 0.06 -1.29 -0.30 0.00 -1.72 0.00 0.00 55.73 52.49 2hva s ARG 103 Cb -0.09 -3.56 -0.07 0.00 -0.45 0.00 0.00 34.95 30.78 2hva s ARG 103 CO 0.04 -0.77 0.95 0.42 -0.68 0.00 0.00 175.30 175.26 2hva s ILE 104 N 1.40 4.40 0.72 1.52 1.01 -1.23 -4.63 121.20 124.39 2hva s ILE 104 Ca 0.00 2.06 -0.15 0.00 0.00 0.00 0.00 60.65 62.56 2hva s ILE 104 Cb -0.21 -4.32 0.03 0.00 0.01 0.00 0.00 42.46 37.98 2hva s ILE 104 CO 0.02 0.37 1.19 -2.16 0.00 0.00 0.00 174.94 174.36 2hva s PRO 105 N -0.32 2.24 0.57 2.79 0.04 -1.26 -4.75 135.00 134.31 2hva s PRO 105 Ca 0.45 1.70 0.27 0.00 0.04 0.00 0.00 61.00 63.46 2hva s PRO 105 Cb -0.24 -1.85 1.55 0.00 0.04 0.00 0.00 34.50 34.00 2hva s PRO 105 CO 0.30 -1.75 2.05 -0.91 0.04 0.00 0.00 177.00 176.73 2hva h ASN 106 N -0.24 0.00 -0.98 6.66 2.35 -1.98 -1.24 115.58 120.15 2hva h ASN 106 Ca -0.47 0.00 0.07 0.00 -0.55 0.00 0.00 56.30 55.35 2hva h ASN 106 Cb 1.29 0.00 -0.07 0.00 0.05 0.00 0.00 38.32 39.59 2hva h ASN 106 CO 0.50 0.00 0.62 1.56 -1.65 0.00 0.00 177.43 178.47 2hva h GLN 107 N 0.00 1.09 -0.01 0.81 4.20 -2.04 -2.49 115.11 116.67 2hva h GLN 107 Ca 0.13 -0.07 0.00 0.00 0.06 0.00 0.00 58.65 58.78 2hva h GLN 107 Cb 0.67 -0.24 0.00 0.00 0.30 0.00 0.00 27.48 28.21 2hva h GLN 107 CO -0.00 0.72 -0.73 1.19 -0.67 0.00 0.00 178.83 179.33 2hva n PHE 108 N -4.54 0.00 -0.28 2.96 3.01 -0.60 -4.43 117.46 113.57 2hva n PHE 108 Ca 0.15 0.00 0.12 0.00 1.01 0.00 0.00 57.45 58.73 2hva n PHE 108 Cb 0.20 0.00 0.36 0.00 -0.01 0.00 0.00 39.48 40.03 2hva n PHE 108 CO 0.00 0.00 0.00 1.96 1.01 0.00 0.00 176.76 179.73 2hva h GLN 109 N 0.83 0.70 -0.36 -1.08 1.08 -0.78 0.76 115.11 116.25 2hva h GLN 109 Ca 0.00 -0.04 0.08 0.00 -1.45 0.00 0.00 58.65 57.24 2hva h GLN 109 Cb 0.54 -0.16 -0.02 0.00 -0.05 0.00 0.00 27.48 27.80 2hva h GLN 109 CO 0.00 0.47 0.25 0.78 -0.95 0.00 0.00 178.83 179.38 2hva h GLY 110 N 0.72 0.17 -5.15 3.46 0.00 -1.78 -3.39 103.07 97.11 2hva h GLY 110 Ca 0.46 -0.05 0.06 0.00 0.00 0.00 0.00 47.33 47.80 2hva h GLY 110 CO -0.22 0.04 -0.15 -0.45 0.00 0.00 0.00 176.54 175.76 2hva s SER 111 N -6.54 -0.41 0.50 0.19 0.15 0.04 -5.16 113.70 102.47 2hva s SER 111 Ca -0.06 -0.33 -0.22 0.00 0.70 0.00 0.00 55.95 56.03 2hva s SER 111 Cb 0.19 0.53 -0.07 0.00 -1.71 0.00 0.00 66.02 64.95 2hva s SER 111 CO 0.71 -0.03 1.20 -2.65 1.20 0.00 0.00 173.24 173.67 2hva n PRO 112 N 3.23 1.54 -2.14 5.44 -0.02 0.02 -4.92 135.00 138.16 2hva n PRO 112 Ca 0.09 0.56 -0.34 0.00 -2.02 0.00 0.00 63.50 61.79 2hva n PRO 112 Cb 0.63 -2.36 0.01 0.00 -0.02 0.00 0.00 33.50 31.77 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 -2.53 3.26 -0.27 0.52 0.02 -1.26 -4.95 135.00 129.78 2hva s PRO 113 Ca 0.68 1.48 -0.29 0.00 0.02 0.00 0.00 61.00 62.89 2hva s PRO 113 Cb -0.46 -2.00 -0.03 0.00 0.02 0.00 0.00 34.50 32.03 2hva s PRO 113 CO 0.52 -0.90 1.80 0.00 -0.33 0.00 0.00 177.00 178.10 2hva s ALA 114 N -2.02 2.99 0.89 -1.55 0.00 -1.26 -4.97 121.76 115.84 2hva s ALA 114 Ca 0.70 0.41 -0.11 0.00 0.00 0.00 0.00 51.96 52.95 2hva s ALA 114 Cb -0.21 -3.97 0.11 0.00 0.00 0.00 0.00 23.12 19.05 2hva s ALA 114 CO 0.31 -2.42 1.01 -2.30 0.00 0.00 0.00 175.76 172.36 2hva n PRO 115 N 8.23 -0.27 -0.97 0.00 -0.02 -1.26 -3.48 135.00 137.23 2hva n PRO 115 Ca 0.22 -0.01 -0.10 0.00 -2.02 0.00 0.00 63.50 61.59 2hva n PRO 115 Cb 0.46 -2.28 0.18 0.00 -0.02 0.00 0.00 33.50 31.84 2hva n PRO 115 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 2hva n SER 116 N -3.40 2.98 -3.85 2.55 7.64 -1.26 -4.84 113.62 113.44 2hva n SER 116 Ca 0.11 -3.77 -0.28 0.00 1.01 0.00 0.00 58.87 55.94 2hva n SER 116 Cb 0.52 -0.68 -0.16 0.00 -1.01 0.00 0.00 64.21 62.88 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 -2.35 3.10 0.54 6.43 1.01 -1.26 -4.99 116.67 119.14 2hva s ASP 117 Ca 0.48 -0.84 0.21 0.00 0.71 0.00 0.00 52.55 53.11 2hva s ASP 117 Cb 0.43 -0.86 1.40 0.00 1.01 0.00 0.00 42.92 44.90 2hva s ASP 117 CO 0.02 -0.24 2.11 1.05 0.21 0.00 0.00 175.17 178.31 2hva h GLU 118 N 8.12 0.00 0.00 8.23 4.11 -2.02 -0.54 114.58 132.48 2hva h GLU 118 Ca -0.19 0.00 -0.17 0.00 0.07 0.00 0.00 59.36 59.06 2hva h GLU 118 Cb 1.10 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.33 2hva h GLU 118 CO 0.38 0.00 -0.93 0.66 0.07 0.00 0.00 179.01 179.19 2hva h SER 119 N 0.00 0.00 -3.34 3.06 4.64 -1.95 -3.44 113.55 112.52 2hva h SER 119 Ca 0.09 0.00 -0.57 0.00 -0.47 0.00 0.00 61.79 60.83 2hva h SER 119 Cb 0.36 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.39 2hva h SER 119 CO -0.00 0.75 0.29 -0.69 -0.87 0.00 0.00 176.83 176.31 2hva s VAL 120 N -2.82 4.93 0.21 0.95 1.01 -0.21 -4.42 120.40 120.05 2hva s VAL 120 Ca 0.01 1.57 0.10 0.00 0.00 0.00 0.00 61.98 63.66 2hva s VAL 120 Cb 0.09 -4.11 -0.05 0.00 0.00 0.00 0.00 36.38 32.32 2hva s VAL 120 CO 0.79 0.09 -0.19 -0.75 0.00 0.00 0.00 175.10 175.04 2hva s LYS 121 N 1.74 1.44 -0.26 2.72 2.47 -1.07 -4.70 119.74 122.08 2hva s LYS 121 Ca 0.38 -1.56 -0.08 0.00 -1.56 0.00 0.00 55.97 53.15 2hva s LYS 121 Cb -0.17 -1.51 -0.03 0.00 -1.46 0.00 0.00 37.83 34.66 2hva s LYS 121 CO 0.14 0.30 0.08 0.42 0.16 0.00 0.00 175.35 176.45 2hva s ILE 122 N -2.26 4.38 0.09 5.43 -1.09 -1.26 -1.78 121.20 124.71 2hva s ILE 122 Ca 0.22 -0.19 -0.01 0.00 -2.23 0.00 0.00 60.65 58.44 2hva s ILE 122 Cb -0.05 -3.07 -0.04 0.00 -1.58 0.00 0.00 42.46 37.71 2hva s ILE 122 CO 0.09 0.30 0.26 -0.70 -1.23 0.00 0.00 174.94 173.67 2hva s GLU 123 N 1.62 3.48 0.06 2.79 2.56 -0.98 -4.93 118.70 123.30 2hva s GLU 123 Ca 0.06 -0.39 -0.15 0.00 0.00 0.00 0.00 54.97 54.49 2hva s GLU 123 Cb -0.15 -2.98 0.03 0.00 2.00 0.00 0.00 34.13 33.02 2hva s GLU 123 CO 0.04 0.56 0.35 -2.00 -0.56 0.00 0.00 175.26 173.65 2hva s GLU 124 N -2.67 0.90 -0.10 4.30 -6.30 -1.26 -2.14 118.70 111.42 2hva s GLU 124 Ca 0.36 -0.52 -0.07 0.00 -2.50 0.00 0.00 54.97 52.24 2hva s GLU 124 Cb -0.12 0.39 0.03 0.00 0.00 0.00 0.00 34.13 34.43 2hva s GLU 124 CO 0.27 -0.31 0.15 0.54 0.02 0.00 0.00 175.26 175.94 2hva n ARG 125 N 0.37 -4.68 0.05 4.30 1.74 -1.25 -4.98 116.66 112.22 2hva n ARG 125 Ca -0.18 3.47 0.00 0.00 -0.77 0.00 0.00 57.85 60.37 2hva n ARG 125 Cb 0.60 -4.74 0.00 0.00 -1.02 0.00 0.00 32.46 27.30 2hva n ARG 125 CO 0.00 0.00 0.00 -1.91 -1.52 0.00 0.00 177.63 174.20 2hva n GLU 126 N 1.81 0.00 -1.81 5.56 4.07 -1.26 -5.02 120.64 123.99 2hva n GLU 126 Ca -0.25 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 56.85 2hva n GLU 126 Cb 0.39 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.77 2hva n GLU 126 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2hva n GLY 127 N -1.41 -4.79 3.13 8.31 0.00 -1.26 -4.95 105.19 104.22 2hva n GLY 127 Ca 0.00 -0.20 -0.21 0.00 0.00 0.00 0.00 46.02 45.61 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 -0.38 1.15 -0.13 -0.61 -4.36 -1.26 -5.03 121.20 110.58 2hva s ILE 128 Ca 0.00 -0.83 0.01 0.00 -0.26 0.00 0.00 60.65 59.57 2hva s ILE 128 Cb 0.00 -1.00 -0.01 0.00 1.25 0.00 0.00 42.46 42.70 2hva s ILE 128 CO 0.00 0.16 -0.15 -0.89 0.24 0.00 0.00 174.94 174.30 2hva s THR 129 N -0.60 2.82 0.11 8.37 2.01 -1.26 -4.54 115.64 122.56 2hva s THR 129 Ca 0.04 -0.74 0.03 0.00 0.31 0.00 0.00 61.69 61.33 2hva s THR 129 Cb -0.07 -2.17 -0.04 0.00 0.01 0.00 0.00 72.50 70.23 2hva s THR 129 CO 0.00 0.53 -0.08 0.68 -0.69 0.00 0.00 174.62 175.06 2hva s VAL 130 N 0.45 0.84 -0.11 3.82 -7.23 -1.25 -1.15 120.40 115.77 2hva s VAL 130 Ca -0.11 -1.98 -0.02 0.00 -1.81 0.00 0.00 61.98 58.06 2hva s VAL 130 Cb -0.16 -1.74 -0.03 0.00 0.56 0.00 0.00 36.38 35.01 2hva s VAL 130 CO 0.05 -0.83 -0.02 -0.31 -0.31 0.00 0.00 175.10 173.68 2hva s TYR 131 N -3.53 3.09 -0.16 2.82 1.51 -1.25 -3.49 117.35 116.33 2hva s TYR 131 Ca 0.13 0.01 -0.06 0.00 -1.01 0.00 0.00 57.07 56.15 2hva s TYR 131 Cb 0.04 -1.85 -0.04 0.00 -0.11 0.00 0.00 41.96 40.01 2hva s TYR 131 CO -0.03 0.27 0.03 -1.54 -1.11 0.00 0.00 175.55 173.17 2hva s SER 132 N -0.41 5.34 -0.02 2.29 1.04 -1.20 -3.79 113.70 116.95 2hva s SER 132 Ca 0.07 0.03 0.06 0.00 0.48 0.00 0.00 55.95 56.59 2hva s SER 132 Cb -0.12 -1.86 -0.01 0.00 0.10 0.00 0.00 66.02 64.12 2hva s SER 132 CO 0.02 0.20 -0.19 0.28 0.98 0.00 0.00 173.24 174.53 2hva s THR 133 N 0.22 1.50 -0.06 2.02 -1.32 -1.25 -3.26 115.64 113.50 2hva s THR 133 Ca 0.02 -0.80 0.05 0.00 -1.21 0.00 0.00 61.69 59.74 2hva s THR 133 Cb -0.13 -1.25 -0.02 0.00 -1.51 0.00 0.00 72.50 69.59 2hva s THR 133 CO 0.01 0.43 -0.19 -1.10 -2.21 0.00 0.00 174.62 171.56 2hva s GLN 134 N -0.37 2.58 -0.00 7.08 -0.21 -1.26 -3.97 119.66 123.50 2hva s GLN 134 Ca 0.06 -0.80 0.02 0.00 0.02 0.00 0.00 55.36 54.66 2hva s GLN 134 Cb -0.08 -2.29 -0.01 0.00 1.00 0.00 0.00 33.01 31.63 2hva s GLN 134 CO -0.00 0.48 -0.07 -0.59 -2.12 0.00 0.00 175.29 172.99 2hva s PHE 135 N -0.39 0.65 -0.89 0.91 -0.12 -1.26 -4.65 117.98 112.22 2hva s PHE 135 Ca 0.04 -0.15 -0.25 0.00 -0.05 0.00 0.00 56.93 56.52 2hva s PHE 135 Cb -0.12 -0.41 0.03 0.00 -0.63 0.00 0.00 43.02 41.88 2hva s PHE 135 CO 0.02 -0.01 1.47 0.20 -0.05 0.00 0.00 175.22 176.84 2hva s GLY 136 N -0.27 0.96 0.00 1.99 0.00 -1.26 -4.85 107.32 103.89 2hva s GLY 136 Ca 0.02 -1.79 0.00 0.00 0.00 0.00 0.00 44.72 42.94 2hva s GLY 136 CO -0.00 2.80 0.00 0.61 0.00 0.00 0.00 173.10 176.51 2hva n GLY 137 N 6.32 3.10 3.61 0.20 0.00 -1.26 -5.15 105.19 112.01 2hva n GLY 137 Ca 0.23 -0.93 -0.29 0.00 0.00 0.00 0.00 46.02 45.03 2hva n GLY 137 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2hva s TYR 138 N -2.00 1.82 -0.02 1.61 2.02 -1.26 -5.01 117.35 114.50 2hva s TYR 138 Ca 0.00 1.17 -0.10 0.00 -0.37 0.00 0.00 57.07 57.78 2hva s TYR 138 Cb 0.00 -3.18 0.01 0.00 -0.40 0.00 0.00 41.96 38.39 2hva s TYR 138 CO 0.00 -3.18 0.21 0.00 -1.57 0.00 0.00 175.55 171.01 2hva s ALA 139 N -2.74 -0.51 0.22 3.71 0.00 -1.26 -5.07 121.76 116.11 2hva s ALA 139 Ca 0.66 0.16 0.04 0.00 0.00 0.00 0.00 51.96 52.82 2hva s ALA 139 Cb -0.21 0.00 -0.01 0.00 0.00 0.00 0.00 23.12 22.90 2hva s ALA 139 CO 0.60 -0.20 0.14 1.63 0.00 0.00 0.00 175.76 177.92 2hva n LYS 140 N 1.69 0.46 0.03 0.00 4.76 -1.26 -4.96 118.16 118.88 2hva n LYS 140 Ca -0.20 -2.08 -0.01 0.00 -2.87 0.00 0.00 58.31 53.15 2hva n LYS 140 Cb 0.56 1.44 -0.01 0.00 -1.84 0.00 0.00 35.03 35.19 2hva n LYS 140 CO 0.00 0.00 0.00 1.49 -1.37 0.00 0.00 177.40 177.52 2hva h GLU 141 N 0.00 -0.07 -0.41 1.97 4.81 -2.02 0.83 114.58 119.69 2hva h GLU 141 Ca -0.17 0.00 0.01 0.00 -0.13 0.00 0.00 59.36 59.08 2hva h GLU 141 Cb 0.74 0.02 -0.02 0.00 0.63 0.00 0.00 28.75 30.11 2hva h GLU 141 CO 0.25 -0.05 0.27 0.00 -0.73 0.00 0.00 179.01 178.76 2hva h ALA 142 N -1.88 1.75 -0.27 2.92 0.00 -1.99 -0.80 119.26 119.00 2hva h ALA 142 Ca -0.01 -0.03 -0.09 0.00 0.00 0.00 0.00 54.91 54.78 2hva h ALA 142 Cb 0.06 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 2hva h ALA 142 CO 0.01 0.22 -0.23 -0.44 0.00 0.00 0.00 179.25 178.80 2hva h ASP 143 N 0.52 0.51 -0.77 0.00 3.32 -1.92 -2.64 116.42 115.44 2hva h ASP 143 Ca 0.16 -0.17 -0.04 0.00 0.02 0.00 0.00 57.03 57.00 2hva h ASP 143 Cb 0.00 -0.14 -0.03 0.00 0.22 0.00 0.00 39.33 39.38 2hva h ASP 143 CO -0.04 0.74 0.34 1.88 -1.72 0.00 0.00 179.24 180.45 2hva h TYR 144 N 0.45 1.14 -0.96 4.55 0.05 0.22 -1.58 116.97 120.84 2hva h TYR 144 Ca 0.07 -0.07 0.14 0.00 0.05 0.00 0.00 58.73 58.92 2hva h TYR 144 Cb 0.65 -0.35 -0.08 0.00 1.01 0.00 0.00 36.73 37.96 2hva h TYR 144 CO 0.02 0.85 0.61 0.28 -1.05 0.00 0.00 178.16 178.87 2hva h VAL 145 N 1.10 0.85 -0.17 -2.88 2.07 -1.08 0.44 116.25 116.57 2hva h VAL 145 Ca 0.26 -0.29 -0.17 0.00 0.82 0.00 0.00 66.70 67.33 2hva h VAL 145 Cb 0.16 -0.06 -0.01 0.00 -1.52 0.00 0.00 31.29 29.86 2hva h VAL 145 CO -0.03 0.15 -0.58 0.00 0.02 0.00 0.00 177.57 177.14 2hva h ALA 146 N 1.58 0.67 -0.25 1.67 0.00 -1.24 -2.77 119.26 118.93 2hva h ALA 146 Ca 0.49 -0.53 -0.11 0.00 0.00 0.00 0.00 54.91 54.77 2hva h ALA 146 Cb 0.66 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.37 2hva h ALA 146 CO -0.26 0.70 -0.29 0.45 0.00 0.00 0.00 179.25 179.85 2hva h HIS 147 N 0.42 0.76 -0.27 0.00 -0.00 0.14 -2.99 115.15 113.21 2hva h HIS 147 Ca 0.00 -0.24 -0.01 0.00 -0.00 0.00 0.00 60.37 60.12 2hva h HIS 147 Cb 1.13 -0.16 -0.01 0.00 -0.00 0.00 0.00 27.41 28.37 2hva h HIS 147 CO 0.05 0.97 0.12 0.00 -0.00 0.00 0.00 177.93 179.06 2hva h ALA 148 N 0.67 1.70 -0.52 2.45 0.00 -0.29 -2.00 119.26 121.27 2hva h ALA 148 Ca 0.03 -0.07 -0.08 0.00 0.00 0.00 0.00 54.91 54.79 2hva h ALA 148 Cb 0.86 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.51 2hva h ALA 148 CO 0.07 0.25 -0.00 1.15 0.00 0.00 0.00 179.25 180.71 2hva h THR 149 N 0.38 1.25 -0.46 0.00 2.02 -1.37 -2.97 112.91 111.76 2hva h THR 149 Ca 0.10 -1.06 0.02 0.00 0.77 0.00 0.00 66.41 66.24 2hva h THR 149 Cb 0.07 0.86 -0.03 0.00 -1.74 0.00 0.00 68.15 67.31 2hva h THR 149 CO -0.01 0.38 0.27 1.56 0.37 0.00 0.00 175.52 178.08 2hva h GLN 150 N 0.81 0.52 -0.90 6.66 4.20 -1.22 -1.49 115.11 123.68 2hva h GLN 150 Ca 0.15 -0.03 0.04 0.00 0.06 0.00 0.00 58.65 58.87 2hva h GLN 150 Cb 0.49 -0.12 -0.05 0.00 0.30 0.00 0.00 27.48 28.10 2hva h GLN 150 CO 0.02 0.34 0.59 1.25 -0.67 0.00 0.00 178.83 180.37 2hva h LEU 151 N 0.54 0.97 -0.50 1.46 5.85 -1.46 0.14 115.31 122.31 2hva h LEU 151 Ca 0.18 -0.01 -0.04 0.00 0.84 0.00 0.00 57.88 58.85 2hva h LEU 151 Cb 0.02 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 40.81 2hva h LEU 151 CO -0.09 0.66 0.14 0.03 -0.34 0.00 0.00 178.44 178.84 2hva h ARG 152 N 1.12 0.78 -0.42 1.25 3.08 -1.23 -2.35 114.38 116.61 2hva h ARG 152 Ca 0.36 -0.18 -0.13 0.00 0.07 0.00 0.00 59.98 60.11 2hva h ARG 152 Cb 0.04 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 29.97 2hva h ARG 152 CO -0.11 0.75 -0.24 1.15 -1.07 0.00 0.00 179.97 180.45 2hva h THR 153 N 0.68 1.27 -0.21 2.04 2.02 -0.55 -1.73 112.91 116.43 2hva h THR 153 Ca 0.16 -1.38 0.03 0.00 0.77 0.00 0.00 66.41 65.99 2hva h THR 153 Cb 0.30 1.20 -0.03 0.00 -1.74 0.00 0.00 68.15 67.88 2hva h THR 153 CO -0.00 0.47 0.03 0.74 0.37 0.00 0.00 175.52 177.13 2hva h THR 154 N 0.75 0.90 0.00 3.16 2.02 -0.54 -1.61 112.91 117.58 2hva h THR 154 Ca 0.10 -0.04 0.00 0.00 0.77 0.00 0.00 66.41 67.24 2hva h THR 154 Cb 0.78 0.78 0.00 0.00 -1.74 0.00 0.00 68.15 67.97 2hva h THR 154 CO 0.06 0.02 0.00 -0.07 0.37 0.00 0.00 175.52 175.90 2hva h LEU 155 N 0.11 0.00 -8.25 2.58 3.38 -1.38 -3.44 115.31 108.30 2hva h LEU 155 Ca 0.09 0.00 -0.53 0.00 0.09 0.00 0.00 57.88 57.53 2hva h LEU 155 Cb 0.10 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 40.80 2hva h LEU 155 CO -0.13 0.00 1.65 1.21 0.09 0.00 0.00 178.44 181.25 2hva n GLU 156 N -3.01 0.44 0.00 1.13 0.00 -0.61 -1.47 120.64 117.12 2hva n GLU 156 Ca 0.02 0.04 0.00 0.00 0.00 0.00 0.00 57.16 57.22 2hva n GLU 156 Cb 0.37 -2.19 0.00 0.00 0.00 0.00 0.00 31.44 29.63 2hva n GLU 156 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2hva n GLY 157 N 6.44 1.73 3.29 8.31 0.00 -1.26 -5.03 105.19 118.67 2hva n GLY 157 Ca 0.54 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.46 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 -2.00 0.07 0.25 2.61 -4.23 -0.54 -5.03 115.64 106.77 2hva s THR 158 Ca 0.00 -1.53 0.30 0.00 -1.18 0.00 0.00 61.69 59.27 2hva s THR 158 Cb 0.00 -1.91 0.30 0.00 1.34 0.00 0.00 72.50 72.23 2hva s THR 158 CO 0.00 -0.33 1.90 -0.65 -0.54 0.00 0.00 174.62 175.00 2hva h PRO 159 N 2.62 0.00 -6.56 3.99 0.11 -2.01 -3.43 132.00 126.73 2hva h PRO 159 Ca -0.33 0.00 -0.56 0.00 0.11 0.00 0.00 66.00 65.23 2hva h PRO 159 Cb 1.22 0.00 0.06 0.00 0.11 0.00 0.00 31.00 32.39 2hva h PRO 159 CO 0.51 0.00 0.91 0.00 -0.21 0.00 0.00 178.00 179.21 2hva n ALA 160 N -1.87 1.97 -3.11 -0.75 0.00 -1.26 -4.99 120.51 110.50 2hva n ALA 160 Ca -0.02 0.41 -0.03 0.00 0.00 0.00 0.00 53.44 53.80 2hva n ALA 160 Cb 0.13 -2.44 0.01 0.00 0.00 0.00 0.00 19.45 17.15 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 3.79 0.00 -3.60 0.00 -1.04 -1.26 -4.97 114.28 107.19 2hva n THR 161 Ca 0.17 -0.25 -0.14 0.00 -2.04 0.00 0.00 64.05 61.79 2hva n THR 161 Cb 0.32 -0.84 -0.06 0.00 -1.82 0.00 0.00 70.33 67.93 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 0.38 -0.39 0.00 -1.42 1.51 -1.26 -4.08 117.35 112.09 2hva s TYR 162 Ca 0.07 0.45 0.00 0.00 -1.01 0.00 0.00 57.07 56.58 2hva s TYR 162 Cb -0.01 0.30 0.00 0.00 -0.11 0.00 0.00 41.96 42.15 2hva s TYR 162 CO 0.04 -0.61 0.00 1.04 -1.11 0.00 0.00 175.55 174.92 2hva n GLN 163 N 0.53 1.31 0.00 -0.62 6.02 -1.20 -4.05 117.38 119.37 2hva n GLN 163 Ca -0.19 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.80 2hva n GLN 163 Cb 0.60 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.86 2hva n GLN 163 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2hva n GLY 164 N 5.00 -2.43 2.76 1.08 0.00 -1.26 -4.85 105.19 105.48 2hva n GLY 164 Ca 0.00 0.04 -0.05 0.00 0.00 0.00 0.00 46.02 46.01 2hva n GLY 164 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2hva n ASP 165 N -0.19 -3.31 -3.64 1.61 2.03 -1.26 -5.13 116.55 106.65 2hva n ASP 165 Ca 0.00 -3.00 -0.08 0.00 0.52 0.00 0.00 54.79 52.23 2hva n ASP 165 Cb 0.00 1.77 -0.07 0.00 -0.72 0.00 0.00 41.12 42.10 2hva n ASP 165 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 2hva s VAL 166 N 0.83 0.00 0.11 5.18 0.11 -1.26 -4.36 120.40 121.01 2hva s VAL 166 Ca 0.30 0.00 -0.02 0.00 -2.93 0.00 0.00 61.98 59.33 2hva s VAL 166 Cb 0.06 -1.00 -0.03 0.00 -1.53 0.00 0.00 36.38 33.87 2hva s VAL 166 CO -0.10 0.00 0.06 -0.72 -3.33 0.00 0.00 175.10 171.01 2hva s TYR 167 N 1.29 0.68 0.23 1.54 1.13 -1.24 -3.85 117.35 117.13 2hva s TYR 167 Ca -0.07 -1.11 0.09 0.00 -1.41 0.00 0.00 57.07 54.57 2hva s TYR 167 Cb -0.05 -0.39 -0.04 0.00 -1.10 0.00 0.00 41.96 40.38 2hva s TYR 167 CO -0.15 -0.50 -0.03 0.71 -2.51 0.00 0.00 175.55 173.07 2hva s TYR 168 N -4.00 2.71 -0.06 -3.49 2.02 -0.82 0.51 117.35 114.23 2hva s TYR 168 Ca 0.18 -0.20 -0.04 0.00 -0.37 0.00 0.00 57.07 56.63 2hva s TYR 168 Cb 0.07 -1.25 0.02 0.00 -0.40 0.00 0.00 41.96 40.40 2hva s TYR 168 CO -0.02 0.57 0.14 0.00 -1.57 0.00 0.00 175.55 174.68 2hva s ALA 170 N 0.41 0.87 0.00 0.00 0.00 -1.12 -3.33 121.76 118.60 2hva s ALA 170 Ca -0.03 -0.41 0.00 0.00 0.00 0.00 0.00 51.96 51.52 2hva s ALA 170 Cb -0.04 -0.26 0.00 0.00 0.00 0.00 0.00 23.12 22.82 2hva s ALA 170 CO -0.02 0.19 0.00 0.41 0.00 0.00 0.00 175.76 176.34 2hva n GLY 171 N 2.99 2.29 3.06 0.00 0.00 -1.26 -2.62 105.19 109.65 2hva n GLY 171 Ca -0.15 -0.63 0.02 0.00 0.00 0.00 0.00 46.02 45.25 2hva n GLY 171 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2hva s TYR 172 N -2.00 -1.25 -0.01 1.61 2.02 -1.26 -5.06 117.35 111.40 2hva s TYR 172 Ca 0.00 0.26 -0.00 0.00 -0.37 0.00 0.00 57.07 56.96 2hva s TYR 172 Cb 0.00 0.23 0.02 0.00 -0.40 0.00 0.00 41.96 41.80 2hva s TYR 172 CO 0.00 -0.83 0.02 0.16 -1.57 0.00 0.00 175.55 173.33 2hva s ASP 173 N 2.02 0.03 0.08 2.29 1.47 -1.26 -4.69 116.67 116.61 2hva s ASP 173 Ca 0.16 0.03 -0.30 0.00 1.18 0.00 0.00 52.55 53.61 2hva s ASP 173 Cb -0.02 -0.03 -0.05 0.00 -0.34 0.00 0.00 42.92 42.48 2hva s ASP 173 CO -0.12 -0.07 1.02 -2.16 0.68 0.00 0.00 175.17 174.52 2hva s PRO 174 N 0.56 4.60 0.60 2.11 0.04 -1.26 -4.93 135.00 136.72 2hva s PRO 174 Ca -0.05 1.53 0.29 0.00 0.04 0.00 0.00 61.00 62.81 2hva s PRO 174 Cb -0.07 -3.38 1.46 0.00 0.04 0.00 0.00 34.50 32.55 2hva s PRO 174 CO -0.02 0.05 1.87 -1.35 0.04 0.00 0.00 177.00 177.59 2hva h PRO 175 N 6.03 0.00 -0.52 0.56 0.11 -2.02 -0.77 132.00 135.39 2hva h PRO 175 Ca -0.42 0.00 0.01 0.00 0.11 0.00 0.00 66.00 65.69 2hva h PRO 175 Cb 1.21 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.30 2hva h PRO 175 CO 0.74 0.00 0.34 0.52 -0.21 0.00 0.00 178.00 179.39 2hva h MET 176 N 0.00 0.68 -5.01 1.05 2.86 -2.04 -3.39 114.93 109.08 2hva h MET 176 Ca 0.20 -0.04 -0.66 0.00 -2.06 0.00 0.00 59.70 57.14 2hva h MET 176 Cb 1.21 -0.15 -0.17 0.00 0.06 0.00 0.00 31.60 32.55 2hva h MET 176 CO -0.00 0.45 -0.24 0.21 1.06 0.00 0.00 176.91 178.38 2hva s LYS 177 N -6.15 3.59 0.00 1.72 2.47 -0.30 -4.94 119.74 116.13 2hva s LYS 177 Ca -0.13 -0.36 0.19 0.00 -1.56 0.00 0.00 55.97 54.12 2hva s LYS 177 Cb 0.12 -3.80 0.90 0.00 -1.46 0.00 0.00 37.83 33.60 2hva s LYS 177 CO 0.74 -0.54 1.61 -0.35 0.16 0.00 0.00 175.35 176.98 2hva n PRO 178 N 5.45 0.14 -3.67 4.03 -0.04 -1.26 -4.62 135.00 135.03 2hva n PRO 178 Ca -0.08 0.14 -0.12 0.00 -0.04 0.00 0.00 63.50 63.39 2hva n PRO 178 Cb 0.49 -1.50 -0.12 0.00 -0.04 0.00 0.00 33.50 32.33 2hva n PRO 178 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 2hva s TYR 179 N -2.79 -0.53 0.00 0.54 2.02 -1.26 -4.95 117.35 110.38 2hva s TYR 179 Ca 0.14 1.13 0.00 0.00 -0.37 0.00 0.00 57.07 57.96 2hva s TYR 179 Cb 0.13 0.07 0.00 0.00 -0.40 0.00 0.00 41.96 41.76 2hva s TYR 179 CO 0.32 -0.38 0.00 0.41 -1.57 0.00 0.00 175.55 174.33 2hva n GLY 180 N 5.24 -2.00 3.81 0.71 0.00 -1.26 -5.13 105.19 106.56 2hva n GLY 180 Ca -0.09 0.59 -0.22 0.00 0.00 0.00 0.00 46.02 46.31 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 -0.96 2.50 -0.12 1.61 1.81 -1.26 -5.13 118.95 117.39 2hva s ARG 181 Ca 0.00 -1.51 -0.01 0.00 -1.72 0.00 0.00 55.73 52.49 2hva s ARG 181 Cb 0.00 -2.29 -0.02 0.00 -0.45 0.00 0.00 34.95 32.19 2hva s ARG 181 CO 0.00 -0.01 -0.10 1.03 -0.68 0.00 0.00 175.30 175.55 2hva s ARG 182 N -3.97 3.32 -0.09 3.54 0.52 -1.26 -4.94 118.95 116.06 2hva s ARG 182 Ca 0.42 -0.62 0.02 0.00 -0.52 0.00 0.00 55.73 55.03 2hva s ARG 182 Cb -0.03 -2.69 -0.02 0.00 0.52 0.00 0.00 34.95 32.74 2hva s ARG 182 CO 0.25 0.32 -0.16 0.54 0.02 0.00 0.00 175.30 176.26 2hva s ASN 183 N 0.11 3.78 0.05 0.23 4.22 -1.26 -4.63 114.94 117.43 2hva s ASN 183 Ca -0.04 -0.34 -0.05 0.00 -2.14 0.00 0.00 52.86 50.29 2hva s ASN 183 Cb -0.14 -1.23 -0.02 0.00 1.28 0.00 0.00 41.25 41.14 2hva s ASN 183 CO 0.04 0.23 0.08 -1.61 -2.04 0.00 0.00 177.10 173.80 2hva s GLU 184 N -0.06 0.63 -0.21 3.55 8.01 -1.08 -4.45 118.70 125.09 2hva s GLU 184 Ca -0.04 -0.90 0.02 0.00 0.01 0.00 0.00 54.97 54.06 2hva s GLU 184 Cb -0.14 0.24 0.04 0.00 -4.31 0.00 0.00 34.13 29.96 2hva s GLU 184 CO 0.04 -0.16 -0.14 0.08 0.01 0.00 0.00 175.26 175.10 2hva s VAL 185 N -3.12 1.96 -0.19 2.63 1.01 -1.25 -2.78 120.40 118.65 2hva s VAL 185 Ca -0.01 -1.20 -0.05 0.00 0.00 0.00 0.00 61.98 60.72 2hva s VAL 185 Cb 0.02 -1.95 -0.03 0.00 0.00 0.00 0.00 36.38 34.42 2hva s VAL 185 CO -0.07 0.22 0.00 0.26 0.00 0.00 0.00 175.10 175.52 2hva s TRP 186 N 1.26 3.06 0.02 5.22 0.51 -0.91 -4.28 118.94 123.82 2hva s TRP 186 Ca -0.02 -0.39 -0.15 0.00 -2.12 0.00 0.00 56.10 53.42 2hva s TRP 186 Cb -0.16 -2.07 -0.06 0.00 -0.81 0.00 0.00 33.47 30.37 2hva s TRP 186 CO -0.09 -0.18 0.44 -0.51 -0.51 0.00 0.00 176.95 176.10 2hva s LEU 187 N 0.88 4.47 0.08 2.99 1.43 -1.26 -1.94 118.68 125.33 2hva s LEU 187 Ca 0.01 1.01 -0.30 0.00 -1.03 0.00 0.00 54.13 53.82 2hva s LEU 187 Cb -0.14 -2.69 -0.06 0.00 0.03 0.00 0.00 46.19 43.33 2hva s LEU 187 CO 0.02 0.30 1.17 -0.69 0.23 0.00 0.00 176.35 177.38 2hva s VAL 188 N -1.12 4.03 0.69 -1.59 1.01 -1.25 -3.92 120.40 118.24 2hva s VAL 188 Ca 0.26 1.51 -0.11 0.00 0.00 0.00 0.00 61.98 63.63 2hva s VAL 188 Cb -0.17 -3.96 0.00 0.00 0.00 0.00 0.00 36.38 32.25 2hva s VAL 188 CO 0.15 0.14 1.08 -0.54 0.00 0.00 0.00 175.10 175.93 2hva s LYS 189 N 0.77 3.03 0.00 2.72 1.02 -0.30 -3.21 119.74 123.77 2hva s LYS 189 Ca 0.57 0.53 0.30 0.00 0.02 0.00 0.00 55.97 57.39 2hva s LYS 189 Cb -0.29 -2.03 1.56 0.00 -0.52 0.00 0.00 37.83 36.54 2hva s LYS 189 CO 0.30 -0.93 2.03 0.00 -0.92 0.00 0.00 175.35 175.84