#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jva s LEU 2 N 0.00 5.48 -0.46 -0.89 2.01 0.43 -4.92 118.68 120.33 2jva s LEU 2 Ca 0.00 -1.31 -0.29 0.00 0.01 0.00 0.00 54.13 52.55 2jva s LEU 2 Cb 0.00 -2.29 0.03 0.00 0.01 0.00 0.00 46.19 43.94 2jva s LEU 2 CO 0.00 -0.86 1.10 -0.69 1.01 0.00 0.00 176.35 176.92 2jva s VAL 3 N 2.15 4.27 -0.18 -1.59 1.01 -1.26 0.02 120.40 124.82 2jva s VAL 3 Ca 0.09 1.23 -0.06 0.00 0.00 0.00 0.00 61.98 63.23 2jva s VAL 3 Cb -0.24 -4.56 -0.22 0.00 0.00 0.00 0.00 36.38 31.36 2jva s VAL 3 CO 0.07 -0.93 0.13 -0.38 0.00 0.00 0.00 175.10 174.00 2jva n ILE 4 N 6.68 1.66 -3.94 2.22 5.41 -0.72 -5.01 119.36 125.65 2jva n ILE 4 Ca 0.11 -0.56 -0.11 0.00 1.00 0.00 0.00 62.75 63.19 2jva n ILE 4 Cb 0.49 -1.68 -0.02 0.00 -0.71 0.00 0.00 39.64 37.72 2jva n ILE 4 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 176.55 176.31 2jva n SER 5 N -3.55 -1.02 -0.06 4.38 2.88 -0.81 -4.99 113.62 110.46 2jva n SER 5 Ca -0.37 -2.42 -0.08 0.00 -1.33 0.00 0.00 58.87 54.66 2jva n SER 5 Cb 0.99 1.90 -0.01 0.00 -0.75 0.00 0.00 64.21 66.33 2jva n SER 5 CO 0.00 0.00 0.00 -1.13 -1.23 0.00 0.00 175.04 172.68 2jva h ASN 6 N 1.48 0.11 -0.24 -3.46 -1.24 -2.03 -2.90 115.58 107.30 2jva h ASN 6 Ca -0.20 0.02 0.00 0.00 0.71 0.00 0.00 56.30 56.83 2jva h ASN 6 Cb 0.89 0.01 0.00 0.00 0.73 0.00 0.00 38.32 39.95 2jva h ASN 6 CO 0.28 0.10 0.00 -3.20 -1.29 0.00 0.00 177.43 173.31 2jva n ASN 7 N -5.03 3.68 -4.01 1.15 5.15 -1.26 -4.91 115.26 110.03 2jva n ASN 7 Ca -0.01 -2.95 -0.30 0.00 -0.60 0.00 0.00 54.58 50.71 2jva n ASN 7 Cb 0.09 -0.51 -0.16 0.00 -0.53 0.00 0.00 39.78 38.66 2jva n ASN 7 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 2jva s VAL 8 N -2.70 1.59 0.01 3.44 1.01 -1.10 -5.11 120.40 117.53 2jva s VAL 8 Ca 0.40 -0.73 0.00 0.00 0.00 0.00 0.00 61.98 61.65 2jva s VAL 8 Cb 0.32 -1.54 -0.01 0.00 0.00 0.00 0.00 36.38 35.15 2jva s VAL 8 CO 0.09 0.38 -0.02 -1.00 0.00 0.00 0.00 175.10 174.54 2jva s HIS 9 N 1.46 0.20 -0.41 5.22 3.76 -1.26 -1.76 115.29 122.50 2jva s HIS 9 Ca 0.03 -0.20 -0.07 0.00 -0.15 0.00 0.00 55.06 54.68 2jva s HIS 9 Cb -0.14 -0.13 0.09 0.00 1.11 0.00 0.00 32.58 33.51 2jva s HIS 9 CO -0.10 -0.06 0.22 -0.51 -0.85 0.00 0.00 174.74 173.44 2jva s LEU 10 N -0.54 5.09 0.36 0.89 1.43 0.10 -4.89 118.68 121.11 2jva s LEU 10 Ca -0.05 -1.66 -0.28 0.00 -1.03 0.00 0.00 54.13 51.11 2jva s LEU 10 Cb -0.04 -1.91 -0.11 0.00 0.03 0.00 0.00 46.19 44.16 2jva s LEU 10 CO -0.00 -0.52 1.42 -2.84 0.23 0.00 0.00 176.35 174.64 2jva s PRO 11 N 1.32 4.18 0.31 1.29 0.02 -1.26 -0.43 135.00 140.43 2jva s PRO 11 Ca 0.04 2.44 0.06 0.00 0.02 0.00 0.00 61.00 63.55 2jva s PRO 11 Cb -0.23 -2.99 0.71 0.00 0.02 0.00 0.00 34.50 32.01 2jva s PRO 11 CO -0.00 -0.42 1.82 -0.44 -0.33 0.00 0.00 177.00 177.63 2jva h ASP 12 N 3.11 0.79 0.18 2.53 5.19 -1.94 -0.31 116.42 125.96 2jva h ASP 12 Ca -0.50 0.06 -0.02 0.00 -0.62 0.00 0.00 57.03 55.95 2jva h ASP 12 Cb 1.24 -0.09 -0.00 0.00 0.18 0.00 0.00 39.33 40.65 2jva h ASP 12 CO 0.64 0.36 -0.10 0.00 -3.12 0.00 0.00 179.24 177.02 2jva h ALA 13 N 1.59 1.57 -0.01 3.45 0.00 -2.05 -1.88 119.26 121.94 2jva h ALA 13 Ca 0.52 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.33 2jva h ALA 13 Cb 0.73 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.50 2jva h ALA 13 CO -0.29 0.13 0.00 0.39 0.00 0.00 0.00 179.25 179.48 2jva n GLU 14 N -4.04 1.31 -3.94 0.00 1.02 -0.13 -4.63 120.64 110.23 2jva n GLU 14 Ca -0.02 -0.45 -0.35 0.00 -0.02 0.00 0.00 57.16 56.32 2jva n GLU 14 Cb 0.19 -1.49 -0.14 0.00 -0.02 0.00 0.00 31.44 29.98 2jva n GLU 14 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 2jva s ILE 15 N -2.00 3.10 -0.56 -3.67 1.01 -0.71 -4.66 121.20 113.71 2jva s ILE 15 Ca 0.43 -0.71 -0.27 0.00 0.00 0.00 0.00 60.65 60.10 2jva s ILE 15 Cb 0.21 -2.46 0.00 0.00 0.01 0.00 0.00 42.46 40.23 2jva s ILE 15 CO 0.35 0.36 1.57 -0.70 0.00 0.00 0.00 174.94 176.52 2jva s GLU 16 N 1.41 3.10 -0.38 2.79 2.56 -0.58 -4.94 118.70 122.68 2jva s GLU 16 Ca 0.04 0.55 -0.13 0.00 0.00 0.00 0.00 54.97 55.43 2jva s GLU 16 Cb -0.15 -4.21 0.02 0.00 2.00 0.00 0.00 34.13 31.79 2jva s GLU 16 CO -0.05 -2.17 0.24 -0.51 -0.56 0.00 0.00 175.26 172.21 2jva s LEU 17 N 6.98 4.79 0.26 2.70 1.43 -1.26 -1.18 118.68 132.39 2jva s LEU 17 Ca 0.58 -0.84 0.12 0.00 -1.03 0.00 0.00 54.13 52.95 2jva s LEU 17 Cb -0.12 -2.09 -0.05 0.00 0.03 0.00 0.00 46.19 43.96 2jva s LEU 17 CO 0.24 -0.37 -0.20 -0.89 0.23 0.00 0.00 176.35 175.35 2jva s THR 18 N 1.63 2.47 -0.12 5.49 2.01 0.13 -4.98 115.64 122.27 2jva s THR 18 Ca 0.04 -2.32 -0.02 0.00 0.31 0.00 0.00 61.69 59.70 2jva s THR 18 Cb -0.19 -2.27 -0.03 0.00 0.01 0.00 0.00 72.50 70.02 2jva s THR 18 CO 0.08 -0.34 -0.06 0.00 -0.69 0.00 0.00 174.62 173.62 2jva s ALA 19 N -2.33 2.97 -0.50 7.40 0.00 -1.26 0.38 121.76 128.42 2jva s ALA 19 Ca 0.28 -0.85 -0.10 0.00 0.00 0.00 0.00 51.96 51.29 2jva s ALA 19 Cb -0.06 -1.40 0.13 0.00 0.00 0.00 0.00 23.12 21.79 2jva s ALA 19 CO 0.14 0.37 0.38 0.42 0.00 0.00 0.00 175.76 177.07 2jva s ILE 20 N -0.12 4.34 -0.03 0.00 1.01 0.41 -4.87 121.20 121.93 2jva s ILE 20 Ca 0.02 -1.83 -0.29 0.00 0.00 0.00 0.00 60.65 58.54 2jva s ILE 20 Cb -0.13 -3.84 -0.03 0.00 0.01 0.00 0.00 42.46 38.47 2jva s ILE 20 CO 0.03 -0.80 0.97 -0.60 0.00 0.00 0.00 174.94 174.54 2jva s ARG 21 N 1.29 4.52 -0.37 2.79 3.52 -1.26 -4.13 118.95 125.30 2jva s ARG 21 Ca 0.06 1.38 -0.14 0.00 -0.13 0.00 0.00 55.73 56.90 2jva s ARG 21 Cb -0.26 -3.48 -0.00 0.00 -1.56 0.00 0.00 34.95 29.65 2jva s ARG 21 CO -0.01 -0.11 0.30 0.00 -0.81 0.00 0.00 175.30 174.67 2jva s ALA 22 N 1.26 3.49 0.12 6.12 0.00 -1.26 -5.03 121.76 126.47 2jva s ALA 22 Ca 0.50 -1.46 -0.30 0.00 0.00 0.00 0.00 51.96 50.70 2jva s ALA 22 Cb -0.20 -2.81 -0.07 0.00 0.00 0.00 0.00 23.12 20.04 2jva s ALA 22 CO 0.25 -1.20 1.18 1.14 0.00 0.00 0.00 175.76 177.12 2jva s GLN 23 N 1.82 4.48 0.00 0.00 -2.07 -1.26 -4.71 119.66 117.92 2jva s GLN 23 Ca 0.08 1.79 0.00 0.00 -1.82 0.00 0.00 55.36 55.41 2jva s GLN 23 Cb -0.18 -3.30 0.00 0.00 -1.09 0.00 0.00 33.01 28.44 2jva s GLN 23 CO 0.11 -0.14 0.00 0.41 -1.32 0.00 0.00 175.29 174.35 2jva n GLY 24 N 2.68 0.90 1.85 2.60 0.00 -1.26 -5.12 105.19 106.85 2jva n GLY 24 Ca 0.06 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.07 2jva n GLY 24 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jva n ALA 25 N -3.00 -2.79 -2.71 4.61 0.00 -1.26 -5.10 120.51 110.26 2jva n ALA 25 Ca 0.00 0.64 0.00 0.00 0.00 0.00 0.00 53.44 54.08 2jva n ALA 25 Cb 0.00 -1.43 0.00 0.00 0.00 0.00 0.00 19.45 18.02 2jva n ALA 25 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2jva n GLY 26 N 0.96 2.08 0.19 0.00 0.00 -1.26 -5.03 105.19 102.13 2jva n GLY 26 Ca -0.08 -0.12 -0.16 0.00 0.00 0.00 0.00 46.02 45.66 2jva n GLY 26 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2jva h GLY 27 N 0.00 0.70 -7.54 -0.02 0.00 -2.08 -3.42 103.07 90.72 2jva h GLY 27 Ca 0.00 -0.93 -0.63 0.00 0.00 0.00 0.00 47.33 45.77 2jva h GLY 27 CO 0.00 0.83 -0.38 1.62 0.00 0.00 0.00 176.54 178.61 2jva s GLN 28 N -3.84 3.99 0.41 4.80 0.74 -1.26 -5.04 119.66 119.46 2jva s GLN 28 Ca -0.12 -0.14 -0.25 0.00 0.05 0.00 0.00 55.36 54.90 2jva s GLN 28 Cb 0.07 -3.65 -0.10 0.00 1.10 0.00 0.00 33.01 30.43 2jva s GLN 28 CO 0.85 -0.21 1.17 0.27 -0.55 0.00 0.00 175.29 176.82 2jva n ASN 29 N 5.13 2.05 -4.18 6.67 6.94 -1.26 -4.78 115.26 125.82 2jva n ASN 29 Ca -0.11 1.10 -0.36 0.00 -0.02 0.00 0.00 54.58 55.18 2jva n ASN 29 Cb 0.51 -1.43 -0.12 0.00 -2.36 0.00 0.00 39.78 36.38 2jva n ASN 29 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 2jva s VAL 30 N -1.21 3.37 -0.58 3.53 0.11 -1.26 -4.85 120.40 119.51 2jva s VAL 30 Ca 0.61 -1.61 0.12 0.00 -2.93 0.00 0.00 61.98 58.17 2jva s VAL 30 Cb -0.54 -3.10 0.37 0.00 -1.53 0.00 0.00 36.38 31.58 2jva s VAL 30 CO 0.58 -0.40 1.30 -3.20 -3.33 0.00 0.00 175.10 170.05 2jva n ASN 31 N 4.67 3.21 -4.33 3.54 5.15 -1.26 -4.94 115.26 121.31 2jva n ASN 31 Ca -0.08 -2.40 -0.37 0.00 -0.60 0.00 0.00 54.58 51.13 2jva n ASN 31 Cb 0.43 -0.34 -0.13 0.00 -0.53 0.00 0.00 39.78 39.21 2jva n ASN 31 CO 0.00 0.00 0.00 -1.59 1.40 0.00 0.00 177.26 177.07 2jva s LYS 32 N -1.71 3.02 -0.11 1.20 -2.85 -1.26 -4.97 119.74 113.06 2jva s LYS 32 Ca 0.29 -0.90 0.01 0.00 -1.00 0.00 0.00 55.97 54.36 2jva s LYS 32 Cb 0.20 -3.37 0.14 0.00 -2.06 0.00 0.00 37.83 32.74 2jva s LYS 32 CO 0.12 -0.47 1.38 1.55 0.10 0.00 0.00 175.35 178.03 2jva n VAL 33 N 4.85 1.69 -1.01 1.79 3.14 -1.26 -4.87 118.33 122.66 2jva n VAL 33 Ca -0.14 -0.57 0.13 0.00 -2.96 0.00 0.00 64.34 60.79 2jva n VAL 33 Cb 0.47 -0.99 -0.05 0.00 -1.06 0.00 0.00 33.84 32.21 2jva n VAL 33 CO 0.00 0.00 0.00 -0.24 -6.46 0.00 0.00 176.83 170.13 2jva n SER 34 N 0.29 -5.90 -0.00 6.55 2.88 -1.26 -4.43 113.62 111.76 2jva n SER 34 Ca 0.14 0.83 0.00 0.00 -1.33 0.00 0.00 58.87 58.51 2jva n SER 34 Cb 0.72 -3.36 0.00 0.00 -0.75 0.00 0.00 64.21 60.83 2jva n SER 34 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2jva n SER 35 N -3.73 1.65 -4.62 -3.46 3.41 -1.26 -4.71 113.62 100.90 2jva n SER 35 Ca -0.04 -1.84 -0.42 0.00 -0.26 0.00 0.00 58.87 56.30 2jva n SER 35 Cb 0.48 -0.01 -0.04 0.00 -0.26 0.00 0.00 64.21 64.38 2jva n SER 35 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2jva s ALA 36 N -0.85 3.51 -0.02 7.33 0.00 -1.24 -4.34 121.76 126.15 2jva s ALA 36 Ca 0.01 -0.32 -0.03 0.00 0.00 0.00 0.00 51.96 51.62 2jva s ALA 36 Cb 0.00 -3.43 -0.04 0.00 0.00 0.00 0.00 23.12 19.66 2jva s ALA 36 CO 0.00 -1.31 0.16 -1.64 0.00 0.00 0.00 175.76 172.97 2jva s MET 37 N 3.19 3.38 -0.18 0.00 -1.94 0.72 -0.45 119.30 124.03 2jva s MET 37 Ca 0.37 -0.33 -0.01 0.00 -1.71 0.00 0.00 55.69 54.01 2jva s MET 37 Cb -0.13 -3.07 -0.00 0.00 2.01 0.00 0.00 34.83 33.64 2jva s MET 37 CO 0.14 0.68 -0.13 -1.58 -0.01 0.00 0.00 175.02 174.12 2jva s HIS 38 N -1.28 2.83 -0.15 -0.03 5.04 0.16 0.17 115.29 122.03 2jva s HIS 38 Ca 0.26 -1.08 0.02 0.00 -1.54 0.00 0.00 55.06 52.71 2jva s HIS 38 Cb -0.12 -1.95 0.01 0.00 0.04 0.00 0.00 32.58 30.55 2jva s HIS 38 CO 0.17 -0.53 -0.20 -0.51 -2.34 0.00 0.00 174.74 171.33 2jva s LEU 39 N 1.04 2.22 -0.24 8.88 1.02 -0.68 0.17 118.68 131.09 2jva s LEU 39 Ca -0.01 -0.57 0.01 0.00 0.02 0.00 0.00 54.13 53.58 2jva s LEU 39 Cb -0.15 -1.48 0.04 0.00 0.02 0.00 0.00 46.19 44.62 2jva s LEU 39 CO -0.03 0.07 -0.12 -0.60 0.02 0.00 0.00 176.35 175.69 2jva s ARG 40 N 0.88 2.53 -0.36 1.70 3.52 -0.33 -0.26 118.95 126.64 2jva s ARG 40 Ca -0.05 -1.16 -0.03 0.00 -0.13 0.00 0.00 55.73 54.37 2jva s ARG 40 Cb -0.15 -2.84 0.08 0.00 -1.56 0.00 0.00 34.95 30.47 2jva s ARG 40 CO -0.03 -0.46 0.11 0.12 -0.81 0.00 0.00 175.30 174.24 2jva s PHE 41 N 1.19 3.43 -0.72 5.12 5.36 0.74 -1.52 117.98 131.58 2jva s PHE 41 Ca -0.04 -2.11 -0.27 0.00 -0.96 0.00 0.00 56.93 53.55 2jva s PHE 41 Cb -0.18 -2.69 0.02 0.00 -0.34 0.00 0.00 43.02 39.84 2jva s PHE 41 CO -0.07 -0.88 1.35 -0.51 -1.46 0.00 0.00 175.22 173.65 2jva s ASP 42 N 1.54 6.06 0.28 6.13 1.11 -1.26 -0.21 116.67 130.32 2jva s ASP 42 Ca 0.02 -0.35 -0.03 0.00 0.18 0.00 0.00 52.55 52.38 2jva s ASP 42 Cb -0.21 -2.56 0.40 0.00 1.07 0.00 0.00 42.92 41.62 2jva s ASP 42 CO -0.02 -1.89 1.91 0.40 1.18 0.00 0.00 175.17 176.75 2jva h ILE 43 N 6.13 1.22 -0.01 0.77 2.04 -0.70 -1.81 117.51 125.16 2jva h ILE 43 Ca -0.28 -0.53 0.02 0.00 1.00 0.00 0.00 64.86 65.07 2jva h ILE 43 Cb 1.06 0.18 -0.03 0.00 -0.74 0.00 0.00 36.82 37.29 2jva h ILE 43 CO 1.27 0.24 -0.14 -1.13 0.00 0.00 0.00 178.15 178.39 2jva h ASN 44 N 1.06 -0.41 -0.62 1.72 -0.73 -1.73 -3.16 115.58 111.72 2jva h ASN 44 Ca 0.27 0.06 0.00 0.00 1.87 0.00 0.00 56.30 58.50 2jva h ASN 44 Cb 0.00 0.17 0.00 0.00 0.27 0.00 0.00 38.32 38.77 2jva h ASN 44 CO -0.05 -0.20 0.00 0.00 -0.37 0.00 0.00 177.43 176.82 2jva n ALA 45 N -2.45 2.98 -2.66 1.57 0.00 -1.11 -4.95 120.51 113.89 2jva n ALA 45 Ca -0.05 -1.60 -0.22 0.00 0.00 0.00 0.00 53.44 51.57 2jva n ALA 45 Cb 0.19 -0.95 -0.01 0.00 0.00 0.00 0.00 19.45 18.68 2jva n ALA 45 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2jva s SER 46 N -0.98 6.19 0.00 0.00 1.04 -0.70 -4.98 113.70 114.27 2jva s SER 46 Ca 0.49 0.24 -0.01 0.00 0.48 0.00 0.00 55.95 57.15 2jva s SER 46 Cb 0.31 -1.81 -0.04 0.00 0.10 0.00 0.00 66.02 64.59 2jva s SER 46 CO 0.24 -0.32 2.11 -1.54 0.98 0.00 0.00 173.24 174.71 2jva n SER 47 N -1.72 5.00 -4.84 7.02 3.41 -1.26 -4.87 113.62 116.36 2jva n SER 47 Ca -0.04 -2.34 -0.34 0.00 -0.26 0.00 0.00 58.87 55.89 2jva n SER 47 Cb 0.57 -1.10 -0.06 0.00 -0.26 0.00 0.00 64.21 63.36 2jva n SER 47 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2jva s LEU 48 N 0.00 4.18 0.36 1.04 1.43 -1.26 -4.83 118.68 119.60 2jva s LEU 48 Ca 0.09 1.28 -0.27 0.00 -1.03 0.00 0.00 54.13 54.20 2jva s LEU 48 Cb 0.05 -3.84 -0.09 0.00 0.03 0.00 0.00 46.19 42.33 2jva s LEU 48 CO 0.00 -0.10 1.22 -2.84 0.23 0.00 0.00 176.35 174.86 2jva s PRO 49 N -2.59 4.23 0.33 1.29 0.02 -1.26 -4.91 135.00 132.11 2jva s PRO 49 Ca 0.49 2.00 0.09 0.00 0.02 0.00 0.00 61.00 63.60 2jva s PRO 49 Cb -0.13 -2.89 0.83 0.00 0.02 0.00 0.00 34.50 32.34 2jva s PRO 49 CO 0.19 -0.22 1.80 -1.35 -0.33 0.00 0.00 177.00 177.08 2jva h PRO 50 N 3.06 0.65 -0.28 5.54 0.11 -1.98 -1.88 132.00 137.21 2jva h PRO 50 Ca -0.49 -0.04 0.06 0.00 0.11 0.00 0.00 66.00 65.65 2jva h PRO 50 Cb 1.23 -0.15 -0.06 0.00 0.11 0.00 0.00 31.00 32.13 2jva h PRO 50 CO 0.64 0.43 -0.10 0.35 -0.21 0.00 0.00 178.00 179.11 2jva h PHE 51 N 0.67 -0.24 -0.04 0.65 3.57 -2.00 0.25 116.94 119.81 2jva h PHE 51 Ca 0.55 0.03 -0.14 0.00 3.53 0.00 0.00 57.97 61.94 2jva h PHE 51 Cb 0.98 0.15 -0.01 0.00 2.79 0.00 0.00 35.95 39.86 2jva h PHE 51 CO -0.00 -0.17 -0.63 1.88 -2.23 0.00 0.00 178.31 177.16 2jva h TYR 52 N -0.05 0.20 -0.75 0.41 0.05 -1.75 -2.67 116.97 112.41 2jva h TYR 52 Ca 0.14 -0.08 -0.06 0.00 0.05 0.00 0.00 58.73 58.78 2jva h TYR 52 Cb 0.27 -0.03 -0.03 0.00 1.01 0.00 0.00 36.73 37.94 2jva h TYR 52 CO -0.30 0.74 0.24 0.87 -1.05 0.00 0.00 178.16 178.65 2jva h LYS 53 N 0.11 1.16 -0.31 4.88 1.57 -0.86 -2.27 116.57 120.85 2jva h LYS 53 Ca -0.01 -0.25 0.00 0.00 -1.87 0.00 0.00 60.65 58.52 2jva h LYS 53 Cb 1.13 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 33.25 2jva h LYS 53 CO 0.09 0.99 0.20 0.93 -0.57 0.00 0.00 179.45 181.08 2jva h GLU 54 N 1.11 0.41 -0.33 3.15 4.39 -0.71 -1.26 114.58 121.34 2jva h GLU 54 Ca 0.24 -0.03 -0.06 0.00 0.34 0.00 0.00 59.36 59.85 2jva h GLU 54 Cb 0.31 -0.09 -0.02 0.00 -0.10 0.00 0.00 28.75 28.85 2jva h GLU 54 CO -0.01 0.29 -0.06 0.00 -1.16 0.00 0.00 179.01 178.07 2jva h ARG 55 N 0.41 0.55 -0.29 2.33 2.47 -1.30 0.19 114.38 118.74 2jva h ARG 55 Ca 0.11 -0.14 -0.05 0.00 -1.26 0.00 0.00 59.98 58.64 2jva h ARG 55 Cb -0.03 -0.07 -0.01 0.00 -1.65 0.00 0.00 29.97 28.22 2jva h ARG 55 CO -0.02 0.62 -0.03 -0.07 0.56 0.00 0.00 179.97 181.02 2jva h LEU 56 N 0.51 0.52 -1.13 3.04 3.38 -1.20 -2.64 115.31 117.79 2jva h LEU 56 Ca 0.10 -0.33 0.00 0.00 0.09 0.00 0.00 57.88 57.74 2jva h LEU 56 Cb 0.42 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.03 2jva h LEU 56 CO 0.02 0.73 0.00 -0.07 0.09 0.00 0.00 178.44 179.21 2jva h LEU 57 N 0.30 0.00 -1.42 1.67 3.38 -0.78 -2.40 115.31 116.06 2jva h LEU 57 Ca 0.08 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.05 2jva h LEU 57 Cb 0.48 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.23 2jva h LEU 57 CO 0.02 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.55 2jva n ALA 58 N -1.95 2.48 -2.08 1.53 0.00 0.62 -4.91 120.51 116.21 2jva n ALA 58 Ca 0.01 -0.65 -0.31 0.00 0.00 0.00 0.00 53.44 52.48 2jva n ALA 58 Cb 0.27 -1.02 -0.04 0.00 0.00 0.00 0.00 19.45 18.66 2jva n ALA 58 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2jva s LEU 59 N -1.44 3.85 -0.12 0.00 1.43 -0.90 -4.94 118.68 116.56 2jva s LEU 59 Ca 0.33 1.30 0.15 0.00 -1.03 0.00 0.00 54.13 54.87 2jva s LEU 59 Cb 0.18 -4.17 0.64 0.00 0.03 0.00 0.00 46.19 42.87 2jva s LEU 59 CO 0.26 -0.39 1.52 -3.20 0.23 0.00 0.00 176.35 174.77 2jva n ASN 60 N -1.08 4.37 -4.74 2.29 2.85 -1.26 -4.94 115.26 112.76 2jva n ASN 60 Ca 0.04 -2.48 -0.40 0.00 -0.11 0.00 0.00 54.58 51.62 2jva n ASN 60 Cb 0.54 -0.57 -0.05 0.00 1.24 0.00 0.00 39.78 40.94 2jva n ASN 60 CO 0.00 0.00 0.00 -0.62 -2.11 0.00 0.00 177.26 174.53 2jva s ASP 61 N -0.79 7.25 0.00 1.20 -1.08 -1.26 -4.90 116.67 117.09 2jva s ASP 61 Ca 0.44 1.49 0.29 0.00 -0.52 0.00 0.00 52.55 54.26 2jva s ASP 61 Cb 0.30 -2.49 1.32 0.00 -1.46 0.00 0.00 42.92 40.59 2jva s ASP 61 CO 0.19 -0.03 1.91 -0.24 0.52 0.00 0.00 175.17 177.52 2jva n SER 62 N 2.99 0.49 0.08 -0.34 2.88 -1.26 -2.84 113.62 115.62 2jva n SER 62 Ca -0.01 -0.71 0.12 0.00 -1.33 0.00 0.00 58.87 56.94 2jva n SER 62 Cb 0.50 -0.06 0.22 0.00 -0.75 0.00 0.00 64.21 64.11 2jva n SER 62 CO 0.00 0.00 0.00 0.08 -1.23 0.00 0.00 175.04 173.89 2jva h ARG 63 N 0.65 0.00 -6.54 -1.46 0.11 -1.97 -3.43 114.38 101.74 2jva h ARG 63 Ca 0.00 0.00 -0.57 0.00 0.10 0.00 0.00 59.98 59.51 2jva h ARG 63 Cb 0.32 0.00 -0.08 0.00 1.11 0.00 0.00 29.97 31.32 2jva h ARG 63 CO 0.00 0.00 0.88 0.42 0.10 0.00 0.00 179.97 181.37 2jva s ILE 64 N -3.16 4.17 0.61 0.08 1.01 -1.13 -4.41 121.20 118.38 2jva s ILE 64 Ca 0.07 0.98 -0.14 0.00 0.00 0.00 0.00 60.65 61.56 2jva s ILE 64 Cb 0.13 -4.63 -0.03 0.00 0.01 0.00 0.00 42.46 37.94 2jva s ILE 64 CO 0.70 -1.13 1.04 0.42 0.00 0.00 0.00 174.94 175.97 2jva s THR 65 N 4.54 4.11 0.52 2.92 -4.23 -1.15 -4.93 115.64 117.41 2jva s THR 65 Ca 0.44 0.87 0.26 0.00 -1.18 0.00 0.00 61.69 62.07 2jva s THR 65 Cb -0.08 -3.50 0.31 0.00 1.34 0.00 0.00 72.50 70.57 2jva s THR 65 CO 0.28 -0.72 2.16 0.28 -0.54 0.00 0.00 174.62 176.08 2jva h SER 66 N 0.09 0.00 1.00 3.99 0.02 -1.95 0.78 113.55 117.48 2jva h SER 66 Ca -0.46 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.49 2jva h SER 66 Cb 1.21 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.75 2jva h SER 66 CO 0.58 0.06 0.00 0.47 -1.14 0.00 0.00 176.83 176.80 2jva n ASP 67 N -3.89 0.76 -0.51 3.07 8.00 -1.26 -4.89 116.55 117.83 2jva n ASP 67 Ca -0.03 0.64 0.00 0.00 0.71 0.00 0.00 54.79 56.12 2jva n ASP 67 Cb 0.15 -0.82 0.00 0.00 -0.02 0.00 0.00 41.12 40.43 2jva n ASP 67 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2jva n GLY 68 N 0.45 0.85 3.15 0.44 0.00 0.27 -4.55 105.19 105.79 2jva n GLY 68 Ca 0.03 -0.52 -0.28 0.00 0.00 0.00 0.00 46.02 45.24 2jva n GLY 68 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2jva s VAL 69 N -2.79 1.64 -0.32 1.61 1.01 -1.25 0.08 120.40 120.38 2jva s VAL 69 Ca 0.00 -0.80 -0.11 0.00 0.00 0.00 0.00 61.98 61.07 2jva s VAL 69 Cb 0.00 -1.42 -0.01 0.00 0.00 0.00 0.00 36.38 34.95 2jva s VAL 69 CO 0.00 0.47 0.19 -0.63 0.00 0.00 0.00 175.10 175.12 2jva s ILE 70 N 0.29 4.89 -0.18 2.22 -1.09 0.70 -2.95 121.20 125.07 2jva s ILE 70 Ca -0.12 -0.34 -0.04 0.00 -2.23 0.00 0.00 60.65 57.93 2jva s ILE 70 Cb -0.15 -3.50 -0.02 0.00 -1.58 0.00 0.00 42.46 37.21 2jva s ILE 70 CO 0.05 0.03 -0.04 -0.69 -1.23 0.00 0.00 174.94 173.06 2jva s VAL 71 N 1.66 3.68 0.18 2.92 1.01 -1.26 -0.19 120.40 128.41 2jva s VAL 71 Ca 0.05 -0.42 0.08 0.00 0.00 0.00 0.00 61.98 61.70 2jva s VAL 71 Cb -0.17 -2.63 -0.04 0.00 0.00 0.00 0.00 36.38 33.53 2jva s VAL 71 CO 0.08 0.46 -0.17 -0.76 0.00 0.00 0.00 175.10 174.71 2jva s LEU 72 N 0.80 2.49 -0.27 3.92 1.02 0.64 -4.99 118.68 122.29 2jva s LEU 72 Ca -0.01 -0.92 -0.00 0.00 0.02 0.00 0.00 54.13 53.21 2jva s LEU 72 Cb -0.15 -0.78 0.08 0.00 0.02 0.00 0.00 46.19 45.37 2jva s LEU 72 CO 0.02 -0.08 0.04 -0.54 0.02 0.00 0.00 176.35 175.81 2jva s LYS 73 N -3.13 1.00 -0.66 1.70 1.02 -1.26 -1.68 119.74 116.74 2jva s LYS 73 Ca 0.19 -0.98 -0.23 0.00 0.02 0.00 0.00 55.97 54.97 2jva s LYS 73 Cb -0.04 -2.28 0.07 0.00 -0.52 0.00 0.00 37.83 35.06 2jva s LYS 73 CO 0.07 -0.80 0.96 0.00 -0.92 0.00 0.00 175.35 174.66 2jva s ALA 74 N 1.55 3.12 -0.44 5.17 0.00 0.13 -4.86 121.76 126.42 2jva s ALA 74 Ca 0.03 -1.84 0.06 0.00 0.00 0.00 0.00 51.96 50.21 2jva s ALA 74 Cb -0.18 -3.86 0.20 0.00 0.00 0.00 0.00 23.12 19.29 2jva s ALA 74 CO -0.15 -2.77 0.54 0.94 0.00 0.00 0.00 175.76 174.32 2jva n GLN 75 N 7.70 0.46 0.00 0.00 7.27 -1.26 -0.20 117.38 131.34 2jva n GLN 75 Ca -0.04 -2.77 0.00 0.00 0.07 0.00 0.00 57.00 54.26 2jva n GLN 75 Cb 0.45 -1.49 0.00 0.00 2.41 0.00 0.00 30.24 31.62 2jva n GLN 75 CO 0.00 0.00 0.00 0.94 0.07 0.00 0.00 177.06 178.07 2jva n GLN 76 N 2.35 0.00 -2.16 3.69 7.27 -1.26 -5.00 117.38 122.26 2jva n GLN 76 Ca 0.23 0.00 -0.28 0.00 0.07 0.00 0.00 57.00 57.01 2jva n GLN 76 Cb 0.53 -0.48 0.04 0.00 2.41 0.00 0.00 30.24 32.74 2jva n GLN 76 CO 0.00 0.00 0.00 -0.47 0.07 0.00 0.00 177.06 176.66 2jva s TYR 77 N -1.00 3.29 0.16 3.69 6.14 -1.26 -5.00 117.35 123.36 2jva s TYR 77 Ca 0.00 0.83 -0.10 0.00 0.64 0.00 0.00 57.07 58.44 2jva s TYR 77 Cb 0.00 -2.89 -0.00 0.00 0.42 0.00 0.00 41.96 39.49 2jva s TYR 77 CO 0.00 -0.99 1.54 -0.09 0.64 0.00 0.00 175.55 176.65 2jva h ARG 78 N -0.39 0.99 -6.52 4.97 1.12 -1.98 -3.45 114.38 109.12 2jva h ARG 78 Ca -0.45 -0.44 -0.65 0.00 -1.11 0.00 0.00 59.98 57.33 2jva h ARG 78 Cb 1.25 -0.03 -0.15 0.00 -0.01 0.00 0.00 29.97 31.04 2jva h ARG 78 CO 0.62 1.11 -0.73 0.95 -3.11 0.00 0.00 179.97 178.81 2jva s THR 79 N -4.64 3.29 0.32 0.20 -4.23 -1.26 -4.81 115.64 104.50 2jva s THR 79 Ca -0.11 -1.43 0.01 0.00 -1.18 0.00 0.00 61.69 58.97 2jva s THR 79 Cb 0.12 -2.57 0.23 0.00 1.34 0.00 0.00 72.50 71.62 2jva s THR 79 CO 0.87 0.02 1.95 1.56 -0.54 0.00 0.00 174.62 178.48 2jva h GLN 80 N 3.33 0.86 -0.01 3.99 4.20 -1.84 -1.86 115.11 123.77 2jva h GLN 80 Ca -0.48 -0.09 0.01 0.00 0.06 0.00 0.00 58.65 58.15 2jva h GLN 80 Cb 1.18 -0.17 -0.01 0.00 0.30 0.00 0.00 27.48 28.77 2jva h GLN 80 CO 0.53 0.63 -0.06 1.49 -0.67 0.00 0.00 178.83 180.75 2jva h GLU 81 N 0.86 -0.09 -0.42 1.46 4.81 -1.95 0.28 114.58 119.53 2jva h GLU 81 Ca 0.22 0.01 -0.09 0.00 -0.13 0.00 0.00 59.36 59.36 2jva h GLU 81 Cb 0.03 0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.41 2jva h GLU 81 CO -0.04 -0.06 -0.12 1.96 -0.73 0.00 0.00 179.01 180.02 2jva h GLN 82 N -0.10 0.76 -0.79 1.92 1.08 -1.91 -1.43 115.11 114.65 2jva h GLN 82 Ca 0.03 -0.26 -0.04 0.00 -1.45 0.00 0.00 58.65 56.93 2jva h GLN 82 Cb 0.13 -0.06 -0.03 0.00 -0.05 0.00 0.00 27.48 27.47 2jva h GLN 82 CO -0.07 0.85 0.33 -0.91 -0.95 0.00 0.00 178.83 178.08 2jva h ASN 83 N 0.69 1.08 -0.19 1.46 2.35 -0.96 -0.52 115.58 119.48 2jva h ASN 83 Ca 0.12 -0.17 -0.01 0.00 -0.55 0.00 0.00 56.30 55.69 2jva h ASN 83 Cb 0.60 -0.28 -0.01 0.00 0.05 0.00 0.00 38.32 38.68 2jva h ASN 83 CO 0.04 0.95 0.09 -0.09 -1.65 0.00 0.00 177.43 176.77 2jva h ARG 84 N 1.14 0.28 -0.62 0.81 2.43 0.06 -0.05 114.38 118.43 2jva h ARG 84 Ca 0.26 -0.04 -0.08 0.00 -0.81 0.00 0.00 59.98 59.31 2jva h ARG 84 Cb 0.20 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 29.68 2jva h ARG 84 CO -0.02 0.31 0.07 0.00 -1.51 0.00 0.00 179.97 178.82 2jva h ALA 85 N 0.95 0.83 -0.03 2.80 0.00 -1.14 -2.14 119.26 120.54 2jva h ALA 85 Ca 0.07 -0.28 -0.00 0.00 0.00 0.00 0.00 54.91 54.69 2jva h ALA 85 Cb 0.13 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.68 2jva h ALA 85 CO -0.01 0.62 0.01 0.22 0.00 0.00 0.00 179.25 180.09 2jva h ASP 86 N 0.96 0.05 -0.73 0.00 3.58 -0.92 -2.31 116.42 117.06 2jva h ASP 86 Ca 0.19 -0.24 0.03 0.00 0.42 0.00 0.00 57.03 57.43 2jva h ASP 86 Cb 0.47 -0.01 -0.04 0.00 1.72 0.00 0.00 39.33 41.46 2jva h ASP 86 CO 0.02 0.28 0.46 0.00 -2.88 0.00 0.00 179.24 177.11 2jva h ALA 87 N 0.78 0.95 -0.63 -0.78 0.00 -0.94 0.51 119.26 119.16 2jva h ALA 87 Ca 0.01 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.84 2jva h ALA 87 Cb 0.25 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 2jva h ALA 87 CO 0.00 0.24 0.19 -0.07 0.00 0.00 0.00 179.25 179.61 2jva h LEU 88 N 0.89 0.89 -0.41 0.00 3.38 -1.33 0.11 115.31 118.85 2jva h LEU 88 Ca 0.29 -0.16 -0.16 0.00 0.09 0.00 0.00 57.88 57.95 2jva h LEU 88 Cb 0.02 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.53 2jva h LEU 88 CO -0.11 0.84 -0.39 0.25 0.09 0.00 0.00 178.44 179.12 2jva h LEU 89 N 0.92 0.98 -0.59 1.67 5.85 -0.78 -2.68 115.31 120.68 2jva h LEU 89 Ca 0.20 -0.45 -0.12 0.00 0.84 0.00 0.00 57.88 58.35 2jva h LEU 89 Cb 0.28 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 41.02 2jva h LEU 89 CO -0.01 1.25 -0.17 0.03 -0.34 0.00 0.00 178.44 179.20 2jva h ARG 90 N 0.75 0.95 0.14 1.25 3.08 -0.54 -1.73 114.38 118.28 2jva h ARG 90 Ca 0.06 -0.37 -0.01 0.00 0.07 0.00 0.00 59.98 59.73 2jva h ARG 90 Cb 0.98 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.98 2jva h ARG 90 CO 0.09 1.04 -0.07 1.25 -1.07 0.00 0.00 179.97 181.22 2jva h LEU 91 N 0.83 -0.15 -0.42 3.04 5.85 -0.72 0.95 115.31 124.68 2jva h LEU 91 Ca 0.12 -0.03 -0.07 0.00 0.84 0.00 0.00 57.88 58.74 2jva h LEU 91 Cb 0.72 0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.78 2jva h LEU 91 CO 0.06 -0.07 -0.02 0.77 -0.34 0.00 0.00 178.44 178.83 2jva h SER 92 N -0.22 0.75 -0.69 1.25 4.64 -1.48 -2.74 113.55 115.07 2jva h SER 92 Ca -0.02 -0.32 -0.01 0.00 -0.47 0.00 0.00 61.79 60.97 2jva h SER 92 Cb 0.17 -0.20 -0.03 0.00 -0.31 0.00 0.00 62.40 62.03 2jva h SER 92 CO 0.03 0.89 0.39 -0.08 -0.87 0.00 0.00 176.83 177.20 2jva h GLU 93 N 0.60 0.95 -0.81 4.77 4.22 -1.23 -2.75 114.58 120.33 2jva h GLU 93 Ca 0.12 -0.10 0.05 0.00 0.08 0.00 0.00 59.36 59.51 2jva h GLU 93 Cb 0.52 -0.19 -0.06 0.00 0.50 0.00 0.00 28.75 29.52 2jva h GLU 93 CO 0.03 0.70 0.50 1.25 -2.18 0.00 0.00 179.01 179.30 2jva h LEU 94 N 0.94 0.79 -0.60 1.64 7.12 -0.61 0.40 115.31 125.00 2jva h LEU 94 Ca 0.24 0.01 -0.00 0.00 0.13 0.00 0.00 57.88 58.26 2jva h LEU 94 Cb 0.01 -0.15 -0.03 0.00 -0.53 0.00 0.00 40.66 39.96 2jva h LEU 94 CO -0.04 0.52 0.37 0.40 -0.13 0.00 0.00 178.44 179.55 2jva h ILE 95 N 0.93 1.17 -0.06 4.05 2.04 -1.20 0.20 117.51 124.65 2jva h ILE 95 Ca 0.35 -0.38 -0.19 0.00 1.00 0.00 0.00 64.86 65.64 2jva h ILE 95 Cb 0.13 0.35 -0.01 0.00 -0.74 0.00 0.00 36.82 36.55 2jva h ILE 95 CO -0.16 0.18 -0.77 0.58 0.00 0.00 0.00 178.15 177.98 2jva h VAL 96 N 0.81 1.40 -0.59 1.67 2.07 -1.24 -3.19 116.25 117.18 2jva h VAL 96 Ca 0.22 -2.23 -0.05 0.00 0.82 0.00 0.00 66.70 65.45 2jva h VAL 96 Cb -0.03 2.19 -0.02 0.00 -1.52 0.00 0.00 31.29 31.90 2jva h VAL 96 CO -0.04 0.67 0.16 -1.13 0.02 0.00 0.00 177.57 177.24 2jva h ASN 97 N 0.24 0.88 -0.69 0.57 -0.73 0.29 -2.93 115.58 113.21 2jva h ASN 97 Ca -0.04 -0.22 0.09 0.00 1.87 0.00 0.00 56.30 58.00 2jva h ASN 97 Cb 1.35 -0.23 -0.04 0.00 0.27 0.00 0.00 38.32 39.66 2jva h ASN 97 CO 0.13 0.88 0.46 0.00 -0.37 0.00 0.00 177.43 178.52 2jva h ALA 98 N 1.04 1.85 0.00 1.57 0.00 -0.60 0.13 119.26 123.25 2jva h ALA 98 Ca 0.19 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.08 2jva h ALA 98 Cb 0.33 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.98 2jva h ALA 98 CO -0.00 0.01 0.00 0.00 0.00 0.00 0.00 179.25 179.26 2jva h ALA 99 N 1.64 1.00 0.00 0.00 0.00 -1.57 -2.59 119.26 117.75 2jva h ALA 99 Ca 0.31 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.22 2jva h ALA 99 Cb 0.44 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.23 2jva h ALA 99 CO -0.10 0.00 -1.24 1.17 0.00 0.00 0.00 179.25 179.07 2jva n LYS 100 N -2.87 0.39 -3.57 0.00 3.00 0.37 -4.91 118.16 110.58 2jva n LYS 100 Ca 0.01 -0.03 -0.37 0.00 -0.00 0.00 0.00 58.31 57.92 2jva n LYS 100 Cb 0.30 -1.60 -0.08 0.00 0.00 0.00 0.00 35.03 33.64 2jva n LYS 100 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.40 176.89 2jva s LEU 101 N -4.18 4.16 -0.60 3.14 1.43 -0.80 -5.00 118.68 116.85 2jva s LEU 101 Ca 0.01 0.32 0.06 0.00 -1.03 0.00 0.00 54.13 53.49 2jva s LEU 101 Cb 0.14 -2.27 0.25 0.00 0.03 0.00 0.00 46.19 44.34 2jva s LEU 101 CO 0.83 0.05 0.72 -1.84 0.23 0.00 0.00 176.35 176.34 2jva n GLU 102 N 4.10 2.26 -2.81 1.70 0.28 -1.26 -4.93 120.64 119.98 2jva n GLU 102 Ca -0.13 -4.45 -0.43 0.00 -0.16 0.00 0.00 57.16 52.00 2jva n GLU 102 Cb 0.52 -2.09 -0.04 0.00 1.43 0.00 0.00 31.44 31.26 2jva n GLU 102 CO 0.00 0.00 0.00 -1.01 -0.16 0.00 0.00 177.13 175.96 2jva s HIS 103 N -2.31 2.80 0.00 -1.84 3.76 -1.26 -4.96 115.29 111.48 2jva s HIS 103 Ca 0.39 0.11 0.00 0.00 -0.15 0.00 0.00 55.06 55.42 2jva s HIS 103 Cb 0.16 -4.10 0.00 0.00 1.11 0.00 0.00 32.58 29.75 2jva s HIS 103 CO -0.03 -1.32 0.60 0.72 -0.85 0.00 0.00 174.74 173.86 2jva n HIS 104 N 7.50 0.00 -3.48 1.40 8.25 -1.26 -4.47 115.22 123.16 2jva n HIS 104 Ca 0.03 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.50 2jva n HIS 104 Cb 0.48 -0.13 -0.05 0.00 1.12 0.00 0.00 29.99 31.41 2jva n HIS 104 CO 0.00 0.00 0.00 -3.38 0.64 0.00 0.00 176.34 173.60 2jva s HIS 105 N -1.47 -0.72 -0.05 4.41 -3.43 -1.26 -4.81 115.29 107.97 2jva s HIS 105 Ca 0.00 1.28 0.24 0.00 -0.80 0.00 0.00 55.06 55.78 2jva s HIS 105 Cb 0.00 0.43 0.43 0.00 -1.43 0.00 0.00 32.58 32.01 2jva s HIS 105 CO 0.00 -0.36 1.16 0.72 -2.00 0.00 0.00 174.74 174.26 2jva n HIS 106 N 4.72 0.21 -2.11 0.38 8.25 -1.26 -5.13 115.22 120.28 2jva n HIS 106 Ca -0.12 -0.80 -0.34 0.00 -0.26 0.00 0.00 57.72 56.20 2jva n HIS 106 Cb 0.53 -0.13 0.01 0.00 1.12 0.00 0.00 29.99 31.53 2jva n HIS 106 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 2jva s HIS 107 N -0.68 2.68 -2.00 4.41 2.46 -1.26 -5.23 115.29 115.67 2jva s HIS 107 Ca 0.31 1.55 0.07 0.00 0.47 0.00 0.00 55.06 57.46 2jva s HIS 107 Cb 0.36 -3.23 0.39 0.00 -0.13 0.00 0.00 32.58 29.98 2jva s HIS 107 CO -0.14 -1.56 0.86 1.58 -2.47 0.00 0.00 174.74 173.01