#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 4.52 -0.46 -0.89 2.96 -0.00 -4.91 118.68 119.90 2jva s LEU 2 Ca 0.00 -1.30 -0.29 0.00 -0.22 0.00 0.00 54.13 52.32 2jva s LEU 2 Cb 0.00 -2.42 0.03 0.00 0.50 0.00 0.00 46.19 44.29 2jva s LEU 2 CO 0.00 -1.34 1.19 -0.69 -1.32 0.00 0.00 176.35 174.18 2jva s VAL 3 N 3.74 4.16 -0.14 1.68 1.01 -1.26 -0.40 120.40 129.18 2jva s VAL 3 Ca 0.26 1.19 0.05 0.00 0.00 0.00 0.00 61.98 63.48 2jva s VAL 3 Cb -0.13 -4.52 -0.23 0.00 0.00 0.00 0.00 36.38 31.50 2jva s VAL 3 CO 0.04 -0.94 0.28 -0.38 0.00 0.00 0.00 175.10 174.10 2jva n ILE 4 N 6.84 1.61 -3.81 2.22 5.41 -0.63 -5.02 119.36 125.98 2jva n ILE 4 Ca 0.13 -0.72 -0.10 0.00 1.00 0.00 0.00 62.75 63.07 2jva n ILE 4 Cb 0.49 -1.25 -0.00 0.00 -0.71 0.00 0.00 39.64 38.16 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 -3.18 -1.35 -0.34 4.38 2.88 -0.78 -4.96 113.62 110.26 2jva n SER 5 Ca -0.31 -2.37 -0.04 0.00 -1.33 0.00 0.00 58.87 54.83 2jva n SER 5 Cb 1.06 2.38 0.09 0.00 -0.75 0.00 0.00 64.21 66.99 2jva n SER 5 CO 0.00 0.00 0.00 0.78 -1.23 0.00 0.00 175.04 174.59 2jva h ASN 6 N 1.53 1.11 -0.13 -3.46 4.21 -2.03 -3.00 115.58 113.82 2jva h ASN 6 Ca -0.23 -0.08 0.00 0.00 1.21 0.00 0.00 56.30 57.20 2jva h ASN 6 Cb 0.94 -0.28 0.00 0.00 -1.12 0.00 0.00 38.32 37.86 2jva h ASN 6 CO 0.30 0.87 0.00 0.59 -1.29 0.00 0.00 177.43 177.90 2jva n ASN 7 N -4.36 2.80 -3.99 5.81 4.13 -1.26 -4.94 115.26 113.44 2jva n ASN 7 Ca 0.10 -2.68 -0.30 0.00 1.68 0.00 0.00 54.58 53.38 2jva n ASN 7 Cb 0.07 -0.34 -0.16 0.00 -1.54 0.00 0.00 39.78 37.80 2jva n ASN 7 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 2jva s VAL 8 N -2.20 1.50 0.01 2.41 1.01 -1.13 -5.11 120.40 116.89 2jva s VAL 8 Ca 0.27 -0.68 0.01 0.00 0.00 0.00 0.00 61.98 61.58 2jva s VAL 8 Cb 0.22 -1.47 -0.01 0.00 0.00 0.00 0.00 36.38 35.12 2jva s VAL 8 CO 0.06 0.37 -0.04 -1.00 0.00 0.00 0.00 175.10 174.48 2jva s HIS 9 N 1.50 0.39 -0.32 5.22 3.76 -1.26 -1.61 115.29 122.98 2jva s HIS 9 Ca 0.03 -0.20 -0.05 0.00 -0.15 0.00 0.00 55.06 54.69 2jva s HIS 9 Cb -0.14 -0.25 0.04 0.00 1.11 0.00 0.00 32.58 33.34 2jva s HIS 9 CO -0.10 -0.04 0.07 -0.51 -0.85 0.00 0.00 174.74 173.31 2jva s LEU 10 N -0.55 4.08 0.33 0.89 1.43 0.46 -4.81 118.68 120.52 2jva s LEU 10 Ca -0.03 -1.09 -0.29 0.00 -1.03 0.00 0.00 54.13 51.70 2jva s LEU 10 Cb -0.04 -1.82 -0.10 0.00 0.03 0.00 0.00 46.19 44.25 2jva s LEU 10 CO -0.00 -0.28 1.35 -2.84 0.23 0.00 0.00 176.35 174.81 2jva s PRO 11 N 1.38 4.30 0.34 1.29 0.02 -1.26 -0.82 135.00 140.24 2jva s PRO 11 Ca -0.02 2.29 0.04 0.00 0.02 0.00 0.00 61.00 63.34 2jva s PRO 11 Cb -0.19 -3.05 0.67 0.00 0.02 0.00 0.00 34.50 31.94 2jva s PRO 11 CO 0.01 -0.27 1.93 -0.44 -0.33 0.00 0.00 177.00 177.90 2jva h ASP 12 N 3.43 0.76 -0.08 2.53 5.19 -1.96 -1.81 116.42 124.48 2jva h ASP 12 Ca -0.49 0.01 0.02 0.00 -0.62 0.00 0.00 57.03 55.95 2jva h ASP 12 Cb 1.23 -0.15 -0.00 0.00 0.18 0.00 0.00 39.33 40.58 2jva h ASP 12 CO 0.66 0.48 0.10 0.00 -3.12 0.00 0.00 179.24 177.36 2jva h ALA 13 N 1.57 1.56 -0.01 3.45 0.00 -2.05 -0.28 119.26 123.50 2jva h ALA 13 Ca 0.36 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.27 2jva h ALA 13 Cb 0.30 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.09 2jva h ALA 13 CO -0.13 -0.14 0.00 0.39 0.00 0.00 0.00 179.25 179.36 2jva n GLU 14 N -3.68 1.22 -3.73 0.00 1.02 -0.68 -4.71 120.64 110.08 2jva n GLU 14 Ca -0.01 -0.33 -0.37 0.00 -0.02 0.00 0.00 57.16 56.43 2jva n GLU 14 Cb 0.20 -1.47 -0.12 0.00 -0.02 0.00 0.00 31.44 30.03 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 -1.99 4.22 -0.58 -3.67 1.01 -0.12 -3.83 121.20 116.24 2jva s ILE 15 Ca 0.42 -0.49 -0.19 0.00 0.00 0.00 0.00 60.65 60.39 2jva s ILE 15 Cb 0.21 -3.11 0.09 0.00 0.01 0.00 0.00 42.46 39.65 2jva s ILE 15 CO 0.34 0.15 0.71 -0.70 0.00 0.00 0.00 174.94 175.44 2jva s GLU 16 N 1.56 3.07 -0.38 2.79 2.56 -0.04 -5.00 118.70 123.26 2jva s GLU 16 Ca 0.04 -1.16 -0.12 0.00 0.00 0.00 0.00 54.97 53.73 2jva s GLU 16 Cb -0.17 -4.22 0.03 0.00 2.00 0.00 0.00 34.13 31.77 2jva s GLU 16 CO 0.04 -1.49 0.23 -0.51 -0.56 0.00 0.00 175.26 172.96 2jva s LEU 17 N 2.82 4.82 0.17 2.70 1.43 -1.26 -1.23 118.68 128.13 2jva s LEU 17 Ca 0.14 -0.97 0.11 0.00 -1.03 0.00 0.00 54.13 52.37 2jva s LEU 17 Cb -0.22 -2.06 -0.04 0.00 0.03 0.00 0.00 46.19 43.90 2jva s LEU 17 CO 0.08 -0.40 -0.25 -0.89 0.23 0.00 0.00 176.35 175.12 2jva s THR 18 N 1.58 2.29 -0.14 5.49 2.01 0.55 -4.98 115.64 122.45 2jva s THR 18 Ca 0.03 -1.93 -0.04 0.00 0.31 0.00 0.00 61.69 60.06 2jva s THR 18 Cb -0.19 -2.06 -0.03 0.00 0.01 0.00 0.00 72.50 70.22 2jva s THR 18 CO 0.07 -0.05 -0.01 0.00 -0.69 0.00 0.00 174.62 173.94 2jva s ALA 19 N -1.46 3.14 -0.27 7.40 0.00 -1.26 0.81 121.76 130.12 2jva s ALA 19 Ca 0.18 -0.80 -0.14 0.00 0.00 0.00 0.00 51.96 51.19 2jva s ALA 19 Cb -0.09 -1.58 -0.04 0.00 0.00 0.00 0.00 23.12 21.41 2jva s ALA 19 CO 0.08 0.32 0.34 0.42 0.00 0.00 0.00 175.76 176.92 2jva s ILE 20 N -0.01 5.20 0.94 0.00 1.01 0.35 -4.88 121.20 123.80 2jva s ILE 20 Ca 0.02 0.48 -0.11 0.00 0.00 0.00 0.00 60.65 61.03 2jva s ILE 20 Cb -0.13 -3.68 0.15 0.00 0.01 0.00 0.00 42.46 38.82 2jva s ILE 20 CO 0.02 0.16 1.09 0.00 0.00 0.00 0.00 174.94 176.21 2jva s ARG 21 N 2.02 0.90 0.00 2.79 1.70 -1.26 -3.94 118.95 121.15 2jva s ARG 21 Ca 0.13 0.95 0.00 0.00 -0.47 0.00 0.00 55.73 56.34 2jva s ARG 21 Cb -0.16 -1.76 0.00 0.00 -0.57 0.00 0.00 34.95 32.46 2jva s ARG 21 CO 0.10 -2.53 0.00 0.00 -1.08 0.00 0.00 175.30 171.80 2jva n ALA 22 N -4.10 0.00 -1.66 7.88 0.00 -1.26 -4.71 120.51 116.66 2jva n ALA 22 Ca 0.07 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 53.19 2jva n ALA 22 Cb 0.54 0.00 0.01 0.00 0.00 0.00 0.00 19.45 20.01 2jva n ALA 22 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 2jva s GLN 23 N -0.39 3.29 0.00 0.00 -0.21 -1.26 -5.01 119.66 116.09 2jva s GLN 23 Ca 0.00 1.15 0.00 0.00 0.02 0.00 0.00 55.36 56.53 2jva s GLN 23 Cb 0.00 -2.03 0.00 0.00 1.00 0.00 0.00 33.01 31.98 2jva s GLN 23 CO 0.00 -0.83 0.00 0.41 -2.12 0.00 0.00 175.29 172.75 2jva n GLY 24 N -1.17 1.78 7.00 3.09 0.00 -1.26 -4.90 105.19 109.73 2jva n GLY 24 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.10 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 0.00 -1.05 4.61 0.00 -1.26 -4.65 120.51 115.16 2jva n ALA 25 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2jva n ALA 25 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 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 0.00 0.95 4.77 0.00 0.00 -1.26 -4.63 105.19 105.01 2jva n GLY 26 Ca 0.00 -1.44 0.00 0.00 0.00 0.00 0.00 46.02 44.58 2jva n GLY 26 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jva n GLY 27 N 5.00 1.58 3.16 -0.02 0.00 -1.26 -4.62 105.19 109.03 2jva n GLY 27 Ca 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 45.96 2jva n GLY 27 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2jva n GLN 28 N 0.00 -0.62 -0.02 1.61 7.27 -1.26 -4.69 117.38 119.67 2jva n GLN 28 Ca 0.00 0.15 0.02 0.00 0.07 0.00 0.00 57.00 57.24 2jva n GLN 28 Cb 0.00 -4.02 0.03 0.00 2.41 0.00 0.00 30.24 28.65 2jva n GLN 28 CO 0.00 0.00 0.00 0.09 0.07 0.00 0.00 177.06 177.22 2jva n ASN 29 N -0.31 1.69 -4.55 1.69 3.02 -1.26 -4.87 115.26 110.67 2jva n ASN 29 Ca 0.00 -1.48 -0.43 0.00 -0.03 0.00 0.00 54.58 52.64 2jva n ASN 29 Cb 0.15 -0.03 -0.00 0.00 -0.61 0.00 0.00 39.78 39.29 2jva n ASN 29 CO 0.00 0.00 0.00 0.68 -2.62 0.00 0.00 177.26 175.32 2jva s VAL 30 N -0.57 4.36 -0.50 2.41 -7.23 -1.26 -4.61 120.40 113.00 2jva s VAL 30 Ca 0.05 -2.03 0.12 0.00 -1.81 0.00 0.00 61.98 58.31 2jva s VAL 30 Cb 0.03 -5.11 0.35 0.00 0.56 0.00 0.00 36.38 32.22 2jva s VAL 30 CO 0.05 -1.91 1.28 0.59 -0.31 0.00 0.00 175.10 174.80 2jva n ASN 31 N 7.68 3.14 -4.23 4.85 4.13 -1.26 -5.00 115.26 124.57 2jva n ASN 31 Ca 0.44 -2.45 -0.23 0.00 1.68 0.00 0.00 54.58 54.03 2jva n ASN 31 Cb 0.45 -0.33 -0.13 0.00 -1.54 0.00 0.00 39.78 38.23 2jva n ASN 31 CO 0.00 0.00 0.00 -0.75 0.28 0.00 0.00 177.26 176.79 2jva s LYS 32 N -1.80 1.13 0.21 3.52 2.20 -1.26 -5.14 119.74 118.60 2jva s LYS 32 Ca 0.28 -0.97 -0.05 0.00 -0.36 0.00 0.00 55.97 54.87 2jva s LYS 32 Cb 0.20 -1.25 -0.06 0.00 -1.51 0.00 0.00 37.83 35.21 2jva s LYS 32 CO 0.11 0.30 0.47 0.54 -0.36 0.00 0.00 175.35 176.41 2jva s VAL 33 N -0.98 5.08 0.87 4.02 0.11 -1.26 -4.38 120.40 123.85 2jva s VAL 33 Ca 0.05 0.09 -0.12 0.00 -2.93 0.00 0.00 61.98 59.07 2jva s VAL 33 Cb -0.09 -3.67 0.14 0.00 -1.53 0.00 0.00 36.38 31.24 2jva s VAL 33 CO 0.02 -0.12 1.22 -0.55 -3.33 0.00 0.00 175.10 172.34 2jva s SER 34 N -2.71 3.82 0.00 3.54 0.15 -1.25 -4.88 113.70 112.36 2jva s SER 34 Ca 0.43 0.38 0.29 0.00 0.70 0.00 0.00 55.95 57.75 2jva s SER 34 Cb -0.11 -0.65 1.38 0.00 -1.71 0.00 0.00 66.02 64.93 2jva s SER 34 CO 0.26 -2.29 1.94 -1.54 1.20 0.00 0.00 173.24 172.81 2jva n SER 35 N -3.45 0.46 -4.59 5.45 3.41 -1.26 -4.79 113.62 108.85 2jva n SER 35 Ca 0.12 -0.75 -0.42 0.00 -0.26 0.00 0.00 58.87 57.57 2jva n SER 35 Cb 0.60 -0.07 -0.03 0.00 -0.26 0.00 0.00 64.21 64.46 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 -2.32 2.53 0.07 7.33 0.00 -1.26 -4.43 121.76 123.69 2jva s ALA 36 Ca 0.34 0.52 -0.04 0.00 0.00 0.00 0.00 51.96 52.78 2jva s ALA 36 Cb 0.21 -4.12 -0.05 0.00 0.00 0.00 0.00 23.12 19.16 2jva s ALA 36 CO 0.43 -3.11 0.28 -1.64 0.00 0.00 0.00 175.76 171.73 2jva s MET 37 N 6.61 3.54 -0.16 0.00 -1.94 0.11 -0.50 119.30 126.97 2jva s MET 37 Ca 0.96 -0.21 -0.03 0.00 -1.71 0.00 0.00 55.69 54.70 2jva s MET 37 Cb -0.28 -2.99 -0.02 0.00 2.01 0.00 0.00 34.83 33.55 2jva s MET 37 CO 0.33 0.57 -0.05 -1.58 -0.01 0.00 0.00 175.02 174.28 2jva s HIS 38 N -1.49 2.97 -0.13 -0.03 5.04 0.24 -0.83 115.29 121.06 2jva s HIS 38 Ca 0.35 -0.45 0.02 0.00 -1.54 0.00 0.00 55.06 53.44 2jva s HIS 38 Cb -0.13 -1.96 0.01 0.00 0.04 0.00 0.00 32.58 30.54 2jva s HIS 38 CO 0.23 -0.14 -0.20 -1.17 -2.34 0.00 0.00 174.74 171.12 2jva s LEU 39 N 0.53 1.98 -0.17 8.88 2.96 -1.15 -0.33 118.68 131.38 2jva s LEU 39 Ca -0.04 -0.54 0.01 0.00 -0.22 0.00 0.00 54.13 53.33 2jva s LEU 39 Cb -0.15 -1.33 0.03 0.00 0.50 0.00 0.00 46.19 45.25 2jva s LEU 39 CO 0.03 0.06 -0.13 -0.60 -1.32 0.00 0.00 176.35 174.39 2jva s ARG 40 N 0.84 2.28 -0.29 1.98 3.52 -0.36 -1.76 118.95 125.15 2jva s ARG 40 Ca -0.08 -0.67 -0.05 0.00 -0.13 0.00 0.00 55.73 54.80 2jva s ARG 40 Cb -0.15 -2.24 0.02 0.00 -1.56 0.00 0.00 34.95 31.02 2jva s ARG 40 CO -0.01 -0.29 0.04 0.12 -0.81 0.00 0.00 175.30 174.35 2jva s PHE 41 N 1.44 3.16 -0.65 5.12 5.36 -0.00 -0.86 117.98 131.55 2jva s PHE 41 Ca 0.03 -1.30 -0.22 0.00 -0.96 0.00 0.00 56.93 54.48 2jva s PHE 41 Cb -0.14 -2.20 0.07 0.00 -0.34 0.00 0.00 43.02 40.42 2jva s PHE 41 CO -0.10 -0.67 0.95 0.34 -1.46 0.00 0.00 175.22 174.29 2jva s ASP 42 N 1.41 6.18 0.35 6.13 -1.08 -1.25 -0.24 116.67 128.16 2jva s ASP 42 Ca 0.00 -0.99 0.09 0.00 -0.52 0.00 0.00 52.55 51.13 2jva s ASP 42 Cb -0.18 -2.41 0.64 0.00 -1.46 0.00 0.00 42.92 39.50 2jva s ASP 42 CO 0.01 -1.43 1.81 0.40 0.52 0.00 0.00 175.17 176.48 2jva h ILE 43 N 5.97 1.25 0.18 4.11 2.04 -0.32 -1.93 117.51 128.80 2jva h ILE 43 Ca -0.29 -1.17 0.00 0.00 1.00 0.00 0.00 64.86 64.41 2jva h ILE 43 Cb 1.07 1.48 -0.02 0.00 -0.74 0.00 0.00 36.82 38.62 2jva h ILE 43 CO 1.18 0.35 -0.19 -1.13 0.00 0.00 0.00 178.15 178.36 2jva h ASN 44 N 0.18 -0.51 -0.22 1.72 -0.73 -1.75 -2.07 115.58 112.20 2jva h ASN 44 Ca 0.03 0.05 0.00 0.00 1.87 0.00 0.00 56.30 58.25 2jva h ASN 44 Cb 0.60 0.18 0.00 0.00 0.27 0.00 0.00 38.32 39.37 2jva h ASN 44 CO 0.04 -0.28 0.00 0.00 -0.37 0.00 0.00 177.43 176.82 2jva n ALA 45 N -2.44 2.50 -1.63 1.57 0.00 -1.19 -4.93 120.51 114.39 2jva n ALA 45 Ca -0.08 -0.57 -0.32 0.00 0.00 0.00 0.00 53.44 52.47 2jva n ALA 45 Cb 0.23 -1.05 0.03 0.00 0.00 0.00 0.00 19.45 18.65 2jva n ALA 45 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2jva s SER 46 N -1.46 5.64 0.00 0.00 0.15 -0.73 -4.94 113.70 112.37 2jva s SER 46 Ca 0.31 1.70 0.14 0.00 0.70 0.00 0.00 55.95 58.80 2jva s SER 46 Cb 0.17 -2.51 0.67 0.00 -1.71 0.00 0.00 66.02 62.64 2jva s SER 46 CO 0.25 -1.26 1.46 -1.20 1.20 0.00 0.00 173.24 173.68 2jva n SER 47 N -2.56 0.73 -4.68 5.45 7.64 -1.26 -4.91 113.62 114.03 2jva n SER 47 Ca 0.08 -1.70 -0.44 0.00 1.01 0.00 0.00 58.87 57.82 2jva n SER 47 Cb 0.53 -0.06 -0.01 0.00 -1.01 0.00 0.00 64.21 63.65 2jva n SER 47 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 2jva n LEU 48 N -0.23 3.19 -4.74 -3.43 4.77 -1.26 -4.95 117.00 110.35 2jva n LEU 48 Ca 0.11 1.18 -0.38 0.00 -0.03 0.00 0.00 56.01 56.90 2jva n LEU 48 Cb 0.16 -1.44 0.05 0.00 -2.33 0.00 0.00 43.42 39.86 2jva n LEU 48 CO 0.09 -0.59 0.95 -2.84 -1.33 0.00 0.00 177.39 173.67 2jva s PRO 49 N -1.30 2.90 0.28 3.23 0.02 -1.26 -4.80 135.00 134.07 2jva s PRO 49 Ca 0.60 2.17 0.02 0.00 0.02 0.00 0.00 61.00 63.81 2jva s PRO 49 Cb -0.61 -2.09 0.66 0.00 0.02 0.00 0.00 34.50 32.48 2jva s PRO 49 CO 0.57 -1.36 1.72 -1.35 -0.33 0.00 0.00 177.00 176.26 2jva h PRO 50 N 1.09 0.46 -0.07 5.54 0.11 -1.99 -1.98 132.00 135.15 2jva h PRO 50 Ca -0.51 -0.03 0.04 0.00 0.11 0.00 0.00 66.00 65.61 2jva h PRO 50 Cb 1.32 -0.10 -0.05 0.00 0.11 0.00 0.00 31.00 32.28 2jva h PRO 50 CO 0.56 0.30 -0.20 0.35 -0.21 0.00 0.00 178.00 178.80 2jva h PHE 51 N 0.47 -0.51 -0.70 0.65 3.57 -1.99 0.52 116.94 118.95 2jva h PHE 51 Ca 0.53 0.02 -0.06 0.00 3.53 0.00 0.00 57.97 61.99 2jva h PHE 51 Cb 0.93 0.24 -0.03 0.00 2.79 0.00 0.00 35.95 39.88 2jva h PHE 51 CO -0.12 -0.28 0.22 1.88 -2.23 0.00 0.00 178.31 177.78 2jva h TYR 52 N -0.28 1.12 -0.31 0.41 0.05 -1.75 -0.04 116.97 116.18 2jva h TYR 52 Ca 0.08 -0.11 0.01 0.00 0.05 0.00 0.00 58.73 58.76 2jva h TYR 52 Cb 0.39 -0.33 -0.02 0.00 1.01 0.00 0.00 36.73 37.79 2jva h TYR 52 CO -0.28 0.90 0.19 0.87 -1.05 0.00 0.00 178.16 178.79 2jva h LYS 53 N 1.02 0.37 -0.57 4.88 1.57 -0.99 0.05 116.57 122.91 2jva h LYS 53 Ca 0.23 -0.02 -0.03 0.00 -1.87 0.00 0.00 60.65 58.95 2jva h LYS 53 Cb 0.30 -0.08 -0.03 0.00 0.08 0.00 0.00 32.23 32.50 2jva h LYS 53 CO -0.01 0.25 0.23 0.93 -0.57 0.00 0.00 179.45 180.28 2jva h GLU 54 N 0.38 0.84 -0.56 3.15 4.39 -0.55 -0.95 114.58 121.29 2jva h GLU 54 Ca 0.12 -0.15 -0.04 0.00 0.34 0.00 0.00 59.36 59.63 2jva h GLU 54 Cb -0.01 -0.14 -0.02 0.00 -0.10 0.00 0.00 28.75 28.47 2jva h GLU 54 CO -0.05 0.72 0.20 0.00 -1.16 0.00 0.00 179.01 178.72 2jva h ARG 55 N 0.77 0.85 -0.29 2.33 2.47 -0.79 -1.74 114.38 117.98 2jva h ARG 55 Ca 0.19 -0.17 -0.00 0.00 -1.26 0.00 0.00 59.98 58.74 2jva h ARG 55 Cb 0.19 -0.13 -0.01 0.00 -1.65 0.00 0.00 29.97 28.36 2jva h ARG 55 CO -0.02 0.75 0.18 -0.07 0.56 0.00 0.00 179.97 181.37 2jva h LEU 56 N 0.77 0.35 -2.14 3.04 3.38 -0.77 -2.30 115.31 117.64 2jva h LEU 56 Ca 0.18 -0.05 -0.01 0.00 0.09 0.00 0.00 57.88 58.09 2jva h LEU 56 Cb 0.24 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 40.90 2jva h LEU 56 CO -0.01 0.30 -0.07 -0.07 0.09 0.00 0.00 178.44 178.68 2jva h LEU 57 N 0.38 0.00 -2.23 1.67 3.38 -1.00 -2.21 115.31 115.30 2jva h LEU 57 Ca 0.11 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.08 2jva h LEU 57 Cb 0.01 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.76 2jva h LEU 57 CO -0.02 0.07 0.00 0.00 0.09 0.00 0.00 178.44 178.58 2jva n ALA 58 N -2.26 2.43 -1.54 1.53 0.00 -0.67 -4.97 120.51 115.03 2jva n ALA 58 Ca -0.02 -0.97 -0.32 0.00 0.00 0.00 0.00 53.44 52.12 2jva n ALA 58 Cb 0.18 -0.91 0.04 0.00 0.00 0.00 0.00 19.45 18.77 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 3.31 -0.08 0.00 1.43 -0.83 -4.92 118.68 116.14 2jva s LEU 59 Ca 0.39 1.81 0.12 0.00 -1.03 0.00 0.00 54.13 55.42 2jva s LEU 59 Cb 0.22 -4.53 0.47 0.00 0.03 0.00 0.00 46.19 42.39 2jva s LEU 59 CO 0.31 -1.48 1.32 -3.20 0.23 0.00 0.00 176.35 173.53 2jva n ASN 60 N -2.63 3.32 -4.67 2.29 4.05 -1.26 -4.90 115.26 111.45 2jva n ASN 60 Ca 0.09 -2.31 -0.43 0.00 0.45 0.00 0.00 54.58 52.38 2jva n ASN 60 Cb 0.53 -0.48 -0.02 0.00 1.23 0.00 0.00 39.78 41.04 2jva n ASN 60 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 177.26 173.59 2jva s ASP 61 N -0.73 7.17 0.05 1.20 2.15 -1.26 -4.82 116.67 120.42 2jva s ASP 61 Ca 0.33 1.46 0.22 0.00 0.43 0.00 0.00 52.55 54.99 2jva s ASP 61 Cb 0.22 -2.55 0.92 0.00 -0.30 0.00 0.00 42.92 41.21 2jva s ASP 61 CO 0.15 -0.56 1.70 -1.20 -0.17 0.00 0.00 175.17 175.09 2jva n SER 62 N 5.69 0.15 0.16 -0.34 7.64 -1.26 -2.27 113.62 123.39 2jva n SER 62 Ca 0.10 0.52 0.12 0.00 1.01 0.00 0.00 58.87 60.63 2jva n SER 62 Cb 0.47 -0.56 0.08 0.00 -1.01 0.00 0.00 64.21 63.19 2jva n SER 62 CO 0.00 0.00 0.00 -0.09 -3.01 0.00 0.00 175.04 171.94 2jva h ARG 63 N 0.00 0.00 -6.32 1.43 2.43 -1.96 -3.44 114.38 106.53 2jva h ARG 63 Ca 0.00 0.00 -0.55 0.00 -0.81 0.00 0.00 59.98 58.62 2jva h ARG 63 Cb 0.41 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.93 2jva h ARG 63 CO 0.00 0.01 0.46 0.42 -1.51 0.00 0.00 179.97 179.35 2jva s ILE 64 N -3.28 4.83 0.14 1.20 -1.09 -0.96 -4.43 121.20 117.61 2jva s ILE 64 Ca 0.03 2.03 0.03 0.00 -2.23 0.00 0.00 60.65 60.50 2jva s ILE 64 Cb 0.07 -4.31 -0.04 0.00 -1.58 0.00 0.00 42.46 36.61 2jva s ILE 64 CO 0.73 0.08 0.26 0.42 -1.23 0.00 0.00 174.94 175.21 2jva s THR 65 N 1.53 5.25 0.16 2.92 -4.23 -1.24 -4.95 115.64 115.09 2jva s THR 65 Ca 0.50 -0.70 0.33 0.00 -1.18 0.00 0.00 61.69 60.63 2jva s THR 65 Cb -0.19 -3.69 0.37 0.00 1.34 0.00 0.00 72.50 70.32 2jva s THR 65 CO 0.22 -0.08 1.99 0.28 -0.54 0.00 0.00 174.62 176.50 2jva h SER 66 N 2.24 0.00 1.08 3.99 0.02 -1.93 -1.41 113.55 117.53 2jva h SER 66 Ca -0.48 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.47 2jva h SER 66 Cb 1.19 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.73 2jva h SER 66 CO 0.69 0.04 0.00 0.47 -1.14 0.00 0.00 176.83 176.89 2jva n ASP 67 N -3.17 0.75 -0.62 3.07 8.00 -1.26 -4.91 116.55 118.41 2jva n ASP 67 Ca 0.00 0.63 0.00 0.00 0.71 0.00 0.00 54.79 56.13 2jva n ASP 67 Cb 0.30 -0.81 0.00 0.00 -0.02 0.00 0.00 41.12 40.60 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 0.60 0.78 3.16 0.44 0.00 -0.53 -4.50 105.19 105.14 2jva n GLY 68 Ca 0.04 -0.56 -0.30 0.00 0.00 0.00 0.00 46.02 45.19 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 -2.89 1.83 -0.38 1.61 1.01 -1.26 0.47 120.40 120.79 2jva s VAL 69 Ca 0.00 -0.87 -0.15 0.00 0.00 0.00 0.00 61.98 60.96 2jva s VAL 69 Cb 0.00 -1.61 0.00 0.00 0.00 0.00 0.00 36.38 34.78 2jva s VAL 69 CO 0.00 0.51 0.34 -0.63 0.00 0.00 0.00 175.10 175.32 2jva s ILE 70 N 0.56 5.19 -0.17 2.22 -1.09 0.66 -3.64 121.20 124.93 2jva s ILE 70 Ca -0.15 -0.28 0.01 0.00 -2.23 0.00 0.00 60.65 58.01 2jva s ILE 70 Cb -0.17 -3.88 0.03 0.00 -1.58 0.00 0.00 42.46 36.86 2jva s ILE 70 CO 0.05 -0.22 -0.14 -0.69 -1.23 0.00 0.00 174.94 172.72 2jva s VAL 71 N 1.91 1.70 0.38 2.92 1.01 -1.25 -0.82 120.40 126.25 2jva s VAL 71 Ca 0.09 -0.85 0.04 0.00 0.00 0.00 0.00 61.98 61.26 2jva s VAL 71 Cb -0.17 -1.65 -0.04 0.00 0.00 0.00 0.00 36.38 34.51 2jva s VAL 71 CO 0.12 0.36 0.09 -0.76 0.00 0.00 0.00 175.10 174.91 2jva s LEU 72 N 1.41 2.08 -0.19 3.92 1.02 -0.72 -5.00 118.68 121.20 2jva s LEU 72 Ca 0.02 -1.54 -0.04 0.00 0.02 0.00 0.00 54.13 52.59 2jva s LEU 72 Cb -0.14 -0.26 0.06 0.00 0.02 0.00 0.00 46.19 45.87 2jva s LEU 72 CO -0.10 -0.79 0.06 -0.54 0.02 0.00 0.00 176.35 175.00 2jva s LYS 73 N -3.80 0.43 -0.40 1.70 1.02 -1.26 -2.93 119.74 114.50 2jva s LYS 73 Ca 0.28 -0.33 -0.07 0.00 0.02 0.00 0.00 55.97 55.88 2jva s LYS 73 Cb 0.05 -1.98 0.08 0.00 -0.52 0.00 0.00 37.83 35.46 2jva s LYS 73 CO 0.14 -0.68 0.21 0.00 -0.92 0.00 0.00 175.35 174.10 2jva s ALA 74 N 1.96 3.19 -0.07 5.17 0.00 -0.01 -4.86 121.76 127.14 2jva s ALA 74 Ca 0.01 -2.16 0.16 0.00 0.00 0.00 0.00 51.96 49.96 2jva s ALA 74 Cb -0.17 -2.49 0.32 0.00 0.00 0.00 0.00 23.12 20.78 2jva s ALA 74 CO -0.10 -1.62 1.15 0.00 0.00 0.00 0.00 175.76 175.19 2jva n GLN 75 N 4.81 0.60 -0.05 0.00 -0.00 -1.26 0.09 117.38 121.56 2jva n GLN 75 Ca -0.09 -2.23 -0.10 0.00 -0.00 0.00 0.00 57.00 54.58 2jva n GLN 75 Cb 0.43 -0.73 -0.04 0.00 -0.00 0.00 0.00 30.24 29.89 2jva n GLN 75 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.06 177.43 2jva h GLN 76 N 0.67 0.28 -6.52 2.61 4.15 -1.89 -3.44 115.11 110.97 2jva h GLN 76 Ca -0.09 -0.04 -0.46 0.00 0.77 0.00 0.00 58.65 58.83 2jva h GLN 76 Cb 1.44 -0.05 0.02 0.00 0.21 0.00 0.00 27.48 29.09 2jva h GLN 76 CO 0.04 0.29 -0.21 0.71 -1.93 0.00 0.00 178.83 177.73 2jva s TYR 77 N -5.78 3.28 0.15 3.99 2.02 -1.26 -5.01 117.35 114.75 2jva s TYR 77 Ca -0.13 0.13 -0.08 0.00 -0.37 0.00 0.00 57.07 56.62 2jva s TYR 77 Cb 0.08 -2.07 -0.01 0.00 -0.40 0.00 0.00 41.96 39.56 2jva s TYR 77 CO 0.70 -0.09 1.43 -0.09 -1.57 0.00 0.00 175.55 175.94 2jva h ARG 78 N 0.67 0.72 -5.82 -0.62 2.43 -1.96 -3.44 114.38 106.36 2jva h ARG 78 Ca -0.47 -0.48 -0.59 0.00 -0.81 0.00 0.00 59.98 57.63 2jva h ARG 78 Cb 1.24 0.07 -0.07 0.00 -0.42 0.00 0.00 29.97 30.79 2jva h ARG 78 CO 0.58 1.10 -0.17 0.95 -1.51 0.00 0.00 179.97 180.92 2jva s THR 79 N -4.00 5.12 0.38 0.20 -4.23 -1.26 -4.57 115.64 107.28 2jva s THR 79 Ca -0.09 0.89 0.11 0.00 -1.18 0.00 0.00 61.69 61.42 2jva s THR 79 Cb 0.10 -3.77 0.12 0.00 1.34 0.00 0.00 72.50 70.30 2jva s THR 79 CO 0.87 0.42 1.87 1.56 -0.54 0.00 0.00 174.62 178.80 2jva h GLN 80 N 5.98 0.14 -0.72 3.99 4.20 -1.84 -2.74 115.11 124.11 2jva h GLN 80 Ca -0.45 -0.04 0.03 0.00 0.06 0.00 0.00 58.65 58.25 2jva h GLN 80 Cb 1.19 -0.01 -0.04 0.00 0.30 0.00 0.00 27.48 28.91 2jva h GLN 80 CO 0.71 0.39 0.45 1.49 -0.67 0.00 0.00 178.83 181.20 2jva h GLU 81 N 0.13 0.86 -0.30 1.46 4.81 -1.94 -0.46 114.58 119.14 2jva h GLU 81 Ca 0.02 -0.05 -0.12 0.00 -0.13 0.00 0.00 59.36 59.08 2jva h GLU 81 Cb 0.51 -0.19 -0.01 0.00 0.63 0.00 0.00 28.75 29.69 2jva h GLU 81 CO 0.04 0.57 -0.30 1.96 -0.73 0.00 0.00 179.01 180.55 2jva h GLN 82 N 0.89 0.64 -0.19 1.92 1.08 -1.90 -2.32 115.11 115.22 2jva h GLN 82 Ca 0.29 -0.28 -0.06 0.00 -1.45 0.00 0.00 58.65 57.15 2jva h GLN 82 Cb 0.02 -0.02 -0.01 0.00 -0.05 0.00 0.00 27.48 27.42 2jva h GLN 82 CO -0.11 0.86 -0.17 -0.91 -0.95 0.00 0.00 178.83 177.55 2jva h ASN 83 N 0.55 0.30 -0.03 1.46 2.35 -1.21 0.15 115.58 119.15 2jva h ASN 83 Ca 0.07 -0.08 -0.00 0.00 -0.55 0.00 0.00 56.30 55.74 2jva h ASN 83 Cb 0.78 -0.08 -0.00 0.00 0.05 0.00 0.00 38.32 39.07 2jva h ASN 83 CO 0.06 0.49 0.01 0.03 -1.65 0.00 0.00 177.43 176.38 2jva h ARG 84 N 0.29 0.04 -0.56 0.81 3.08 -0.69 -0.98 114.38 116.37 2jva h ARG 84 Ca 0.05 -0.01 -0.06 0.00 0.07 0.00 0.00 59.98 60.04 2jva h ARG 84 Cb 0.47 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.50 2jva h ARG 84 CO 0.03 0.20 0.12 0.00 -1.07 0.00 0.00 179.97 179.25 2jva h ALA 85 N 0.84 0.73 -0.32 0.04 0.00 -0.98 -0.90 119.26 118.67 2jva h ALA 85 Ca 0.01 -0.23 -0.00 0.00 0.00 0.00 0.00 54.91 54.69 2jva h ALA 85 Cb 0.17 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 2jva h ALA 85 CO -0.00 0.45 0.19 0.22 0.00 0.00 0.00 179.25 180.11 2jva h ASP 86 N 0.80 0.39 -0.17 0.00 3.58 -0.70 0.17 116.42 120.49 2jva h ASP 86 Ca 0.17 -0.06 0.00 0.00 0.42 0.00 0.00 57.03 57.56 2jva h ASP 86 Cb 0.36 -0.10 -0.01 0.00 1.72 0.00 0.00 39.33 41.31 2jva h ASP 86 CO 0.00 0.34 0.11 0.00 -2.88 0.00 0.00 179.24 176.81 2jva h ALA 87 N 1.07 0.22 -0.69 -0.78 0.00 -0.99 0.13 119.26 118.22 2jva h ALA 87 Ca 0.11 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.95 2jva h ALA 87 Cb 0.02 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.71 2jva h ALA 87 CO -0.02 -0.29 0.21 -0.07 0.00 0.00 0.00 179.25 179.07 2jva h LEU 88 N 0.22 0.99 0.07 0.00 3.38 -0.96 -0.40 115.31 118.63 2jva h LEU 88 Ca 0.06 -0.18 -0.00 0.00 0.09 0.00 0.00 57.88 57.85 2jva h LEU 88 Cb -0.01 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 40.48 2jva h LEU 88 CO -0.01 0.93 -0.03 0.25 0.09 0.00 0.00 178.44 179.66 2jva h LEU 89 N 1.02 -0.08 -1.49 1.67 7.12 -0.37 -1.81 115.31 121.38 2jva h LEU 89 Ca 0.22 -0.01 0.00 0.00 0.13 0.00 0.00 57.88 58.23 2jva h LEU 89 Cb 0.30 0.02 -0.02 0.00 -0.53 0.00 0.00 40.66 40.42 2jva h LEU 89 CO -0.01 -0.05 0.31 -0.09 -0.13 0.00 0.00 178.44 178.47 2jva h ARG 90 N -0.10 0.65 0.19 1.25 2.43 -0.68 0.10 114.38 118.22 2jva h ARG 90 Ca -0.01 -0.05 -0.01 0.00 -0.81 0.00 0.00 59.98 59.11 2jva h ARG 90 Cb 0.08 -0.14 0.00 0.00 -0.42 0.00 0.00 29.97 29.49 2jva h ARG 90 CO 0.02 0.45 -0.09 1.25 -1.51 0.00 0.00 179.97 180.08 2jva h LEU 91 N 0.67 -0.22 -0.70 3.80 5.85 -0.68 0.21 115.31 124.24 2jva h LEU 91 Ca 0.18 -0.09 -0.05 0.00 0.84 0.00 0.00 57.88 58.76 2jva h LEU 91 Cb -0.05 0.06 -0.03 0.00 0.37 0.00 0.00 40.66 41.01 2jva h LEU 91 CO -0.04 -0.05 0.22 -1.28 -0.34 0.00 0.00 178.44 176.96 2jva h SER 92 N -0.37 1.01 -0.25 1.25 0.87 -0.92 -1.81 113.55 113.32 2jva h SER 92 Ca -0.03 -0.21 0.01 0.00 -1.23 0.00 0.00 61.79 60.34 2jva h SER 92 Cb 0.29 -0.26 -0.02 0.00 -0.44 0.00 0.00 62.40 61.97 2jva h SER 92 CO 0.04 0.95 0.13 -0.08 -0.53 0.00 0.00 176.83 177.34 2jva h GLU 93 N 1.02 0.27 -0.59 2.24 4.57 -0.67 -2.35 114.58 119.07 2jva h GLU 93 Ca 0.23 -0.02 0.04 0.00 -1.18 0.00 0.00 59.36 58.43 2jva h GLU 93 Cb 0.29 -0.06 -0.04 0.00 -0.16 0.00 0.00 28.75 28.78 2jva h GLU 93 CO -0.01 0.18 0.33 1.25 -1.18 0.00 0.00 179.01 179.58 2jva h LEU 94 N 0.28 0.51 -0.27 1.64 5.85 -0.26 -1.01 115.31 122.05 2jva h LEU 94 Ca 0.10 0.02 0.03 0.00 0.84 0.00 0.00 57.88 58.87 2jva h LEU 94 Cb 0.02 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 40.93 2jva h LEU 94 CO -0.06 0.35 0.09 0.40 -0.34 0.00 0.00 178.44 178.87 2jva h ILE 95 N 0.64 0.92 -0.49 4.05 2.04 -0.99 0.57 117.51 124.26 2jva h ILE 95 Ca 0.25 -0.07 -0.10 0.00 1.00 0.00 0.00 64.86 65.95 2jva h ILE 95 Cb 0.10 0.70 -0.02 0.00 -0.74 0.00 0.00 36.82 36.86 2jva h ILE 95 CO -0.14 0.04 -0.07 0.58 0.00 0.00 0.00 178.15 178.55 2jva h VAL 96 N 0.21 1.26 -0.05 1.67 2.07 -1.13 -2.93 116.25 117.35 2jva h VAL 96 Ca 0.12 -1.16 -0.15 0.00 0.82 0.00 0.00 66.70 66.32 2jva h VAL 96 Cb 0.09 0.96 0.01 0.00 -1.52 0.00 0.00 31.29 30.83 2jva h VAL 96 CO -0.13 0.41 -0.56 0.78 0.02 0.00 0.00 177.57 178.09 2jva h ASN 97 N 0.80 0.58 0.20 0.57 2.35 -0.74 -3.30 115.58 116.04 2jva h ASN 97 Ca 0.14 -0.70 -0.03 0.00 -0.55 0.00 0.00 56.30 55.16 2jva h ASN 97 Cb 0.58 -0.18 -0.00 0.00 0.05 0.00 0.00 38.32 38.77 2jva h ASN 97 CO 0.04 1.20 -0.13 0.00 -1.65 0.00 0.00 177.43 176.88 2jva h ALA 98 N 0.40 1.59 0.00 -0.83 0.00 0.17 -0.55 119.26 120.04 2jva h ALA 98 Ca -0.06 -0.12 -0.04 0.00 0.00 0.00 0.00 54.91 54.69 2jva h ALA 98 Cb 1.24 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.00 2jva h ALA 98 CO 0.11 0.17 -0.20 0.00 0.00 0.00 0.00 179.25 179.33 2jva h ALA 99 N 1.87 1.43 0.00 0.00 0.00 -1.59 -2.68 119.26 118.29 2jva h ALA 99 Ca -0.00 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.73 2jva h ALA 99 Cb 0.27 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.02 2jva h ALA 99 CO 0.02 0.25 -1.58 1.63 0.00 0.00 0.00 179.25 179.56 2jva n LYS 100 N -3.96 0.62 -2.47 0.00 5.02 -0.31 -4.87 118.16 112.19 2jva n LYS 100 Ca -0.02 -0.07 -0.43 0.00 -2.02 0.00 0.00 58.31 55.77 2jva n LYS 100 Cb 0.28 -1.64 -0.02 0.00 -0.02 0.00 0.00 35.03 33.63 2jva n LYS 100 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2jva s LEU 101 N -4.80 3.87 -0.06 -0.35 1.43 -0.64 -4.92 118.68 113.21 2jva s LEU 101 Ca -0.05 1.14 -0.01 0.00 -1.03 0.00 0.00 54.13 54.18 2jva s LEU 101 Cb 0.12 -3.54 -0.00 0.00 0.03 0.00 0.00 46.19 42.80 2jva s LEU 101 CO 0.86 -1.06 -0.02 -0.08 0.23 0.00 0.00 176.35 176.29 2jva h GLU 102 N 9.08 0.00 0.00 1.70 4.22 -1.89 -3.47 114.58 124.21 2jva h GLU 102 Ca -0.25 0.00 -0.11 0.00 0.08 0.00 0.00 59.36 59.08 2jva h GLU 102 Cb 1.09 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.31 2jva h GLU 102 CO 1.04 0.00 -0.09 0.72 -2.18 0.00 0.00 179.01 178.50 2jva n HIS 103 N -3.57 -0.01 -4.73 0.92 8.25 -1.26 -4.87 115.22 109.95 2jva n HIS 103 Ca -0.01 -0.53 0.00 0.00 -0.26 0.00 0.00 57.72 56.92 2jva n HIS 103 Cb 0.03 0.01 0.00 0.00 1.12 0.00 0.00 29.99 31.15 2jva n HIS 103 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 2jva n HIS 104 N -0.17 -1.30 0.03 4.41 8.25 -1.26 -4.92 115.22 120.26 2jva n HIS 104 Ca -0.01 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.45 2jva n HIS 104 Cb 0.12 0.19 0.00 0.00 1.12 0.00 0.00 29.99 31.42 2jva n HIS 104 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56 2jva n HIS 105 N -0.83 -0.33 -1.00 4.41 -0.00 -1.26 -4.09 115.22 112.12 2jva n HIS 105 Ca 0.00 0.06 0.00 0.00 0.46 0.00 0.00 57.72 58.24 2jva n HIS 105 Cb 0.00 0.23 0.00 0.00 -0.12 0.00 0.00 29.99 30.10 2jva n HIS 105 CO 0.00 0.00 0.00 0.72 0.46 0.00 0.00 176.34 177.52 2jva n HIS 106 N -2.78 -2.76 -1.16 1.57 8.25 -1.26 -5.03 115.22 112.04 2jva n HIS 106 Ca 0.00 1.48 0.16 0.00 -0.26 0.00 0.00 57.72 59.10 2jva n HIS 106 Cb 0.00 -2.57 -0.04 0.00 1.12 0.00 0.00 29.99 28.50 2jva n HIS 106 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 2jva n HIS 107 N -1.17 -2.92 0.32 4.41 8.25 -1.26 -5.19 115.22 117.66 2jva n HIS 107 Ca 0.00 1.45 0.04 0.00 -0.26 0.00 0.00 57.72 58.95 2jva n HIS 107 Cb 0.06 -2.65 0.03 0.00 1.12 0.00 0.00 29.99 28.55 2jva n HIS 107 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56