#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 4.28 -0.43 -0.89 2.96 0.19 -4.91 118.68 119.88 2jva s LEU 2 Ca 0.00 -1.23 -0.29 0.00 -0.22 0.00 0.00 54.13 52.39 2jva s LEU 2 Cb 0.00 -2.45 0.02 0.00 0.50 0.00 0.00 46.19 44.26 2jva s LEU 2 CO 0.00 -1.41 1.26 -0.69 -1.32 0.00 0.00 176.35 174.19 2jva s VAL 3 N 4.06 4.10 -0.25 1.68 1.01 -1.26 -0.74 120.40 129.00 2jva s VAL 3 Ca 0.29 1.14 -0.01 0.00 0.00 0.00 0.00 61.98 63.40 2jva s VAL 3 Cb -0.11 -4.40 -0.17 0.00 0.00 0.00 0.00 36.38 31.70 2jva s VAL 3 CO 0.04 -0.84 -0.19 -0.38 0.00 0.00 0.00 175.10 173.73 2jva n ILE 4 N 6.83 1.52 -3.67 2.22 5.41 -0.83 -5.02 119.36 125.83 2jva n ILE 4 Ca 0.14 -0.54 -0.07 0.00 1.00 0.00 0.00 62.75 63.28 2jva n ILE 4 Cb 0.48 -1.52 -0.00 0.00 -0.71 0.00 0.00 39.64 37.89 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 -3.44 -0.93 -0.14 4.38 2.88 -0.43 -4.97 113.62 110.95 2jva n SER 5 Ca -0.46 -1.95 -0.09 0.00 -1.33 0.00 0.00 58.87 55.04 2jva n SER 5 Cb 0.98 1.65 -0.01 0.00 -0.75 0.00 0.00 64.21 66.08 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 1.06 0.61 -0.43 -3.46 -1.24 -2.03 -2.99 115.58 107.11 2jva h ASN 6 Ca -0.16 -0.20 0.00 0.00 0.71 0.00 0.00 56.30 56.65 2jva h ASN 6 Cb 0.65 -0.16 0.00 0.00 0.73 0.00 0.00 38.32 39.54 2jva h ASN 6 CO 0.21 0.65 0.00 0.59 -1.29 0.00 0.00 177.43 177.59 2jva n ASN 7 N -4.58 3.50 -4.00 1.15 4.13 -1.26 -4.90 115.26 109.30 2jva n ASN 7 Ca 0.00 -2.24 -0.30 0.00 1.68 0.00 0.00 54.58 53.72 2jva n ASN 7 Cb 0.18 -0.37 -0.16 0.00 -1.54 0.00 0.00 39.78 37.89 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 -1.44 1.57 -0.02 2.41 1.01 -1.13 -5.01 120.40 117.80 2jva s VAL 8 Ca 0.34 -0.81 -0.01 0.00 0.00 0.00 0.00 61.98 61.50 2jva s VAL 8 Cb 0.21 -1.57 0.01 0.00 0.00 0.00 0.00 36.38 35.02 2jva s VAL 8 CO 0.18 0.30 0.04 -1.00 0.00 0.00 0.00 175.10 174.63 2jva s HIS 9 N 1.46 -0.04 -0.16 5.22 3.76 -1.26 -1.32 115.29 122.94 2jva s HIS 9 Ca 0.02 0.12 0.01 0.00 -0.15 0.00 0.00 55.06 55.06 2jva s HIS 9 Cb -0.15 -0.01 0.01 0.00 1.11 0.00 0.00 32.58 33.54 2jva s HIS 9 CO -0.09 -0.03 -0.18 -0.51 -0.85 0.00 0.00 174.74 173.08 2jva s LEU 10 N 0.14 2.30 0.40 0.89 1.43 0.08 -4.77 118.68 119.14 2jva s LEU 10 Ca -0.01 -0.56 -0.27 0.00 -1.03 0.00 0.00 54.13 52.26 2jva s LEU 10 Cb -0.02 -1.52 -0.10 0.00 0.03 0.00 0.00 46.19 44.59 2jva s LEU 10 CO -0.00 0.05 1.43 -2.84 0.23 0.00 0.00 176.35 175.21 2jva s PRO 11 N 1.01 4.00 0.27 1.29 0.02 -1.26 0.57 135.00 140.91 2jva s PRO 11 Ca -0.02 2.43 -0.00 0.00 0.02 0.00 0.00 61.00 63.43 2jva s PRO 11 Cb -0.15 -2.87 0.48 0.00 0.02 0.00 0.00 34.50 31.99 2jva s PRO 11 CO -0.05 -0.57 1.86 -0.44 -0.33 0.00 0.00 177.00 177.48 2jva h ASP 12 N 2.82 0.99 0.13 2.53 3.32 -1.95 -1.29 116.42 122.96 2jva h ASP 12 Ca -0.50 0.03 -0.00 0.00 0.02 0.00 0.00 57.03 56.57 2jva h ASP 12 Cb 1.25 -0.18 -0.00 0.00 0.22 0.00 0.00 39.33 40.62 2jva h ASP 12 CO 0.63 0.58 -0.00 0.00 -1.72 0.00 0.00 179.24 178.73 2jva h ALA 13 N 1.50 1.03 -0.04 3.45 0.00 -2.04 -1.69 119.26 121.46 2jva h ALA 13 Ca 0.47 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.37 2jva h ALA 13 Cb 0.33 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.12 2jva h ALA 13 CO -0.22 0.00 0.00 0.39 0.00 0.00 0.00 179.25 179.42 2jva n GLU 14 N -3.13 1.29 -4.04 0.00 1.02 -0.49 -4.58 120.64 110.72 2jva n GLU 14 Ca -0.03 -0.43 -0.33 0.00 -0.02 0.00 0.00 57.16 56.35 2jva n GLU 14 Cb 0.10 -1.41 -0.15 0.00 -0.02 0.00 0.00 31.44 29.96 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 -1.96 2.41 -0.56 -3.67 1.01 -0.64 -4.15 121.20 113.64 2jva s ILE 15 Ca 0.37 -1.26 -0.28 0.00 0.00 0.00 0.00 60.65 59.48 2jva s ILE 15 Cb 0.18 -2.26 0.03 0.00 0.01 0.00 0.00 42.46 40.43 2jva s ILE 15 CO 0.29 0.18 1.19 -0.70 0.00 0.00 0.00 174.94 175.90 2jva s GLU 16 N 1.23 3.55 -0.45 2.79 2.12 -0.54 -4.98 118.70 122.42 2jva s GLU 16 Ca -0.02 0.30 -0.18 0.00 0.36 0.00 0.00 54.97 55.42 2jva s GLU 16 Cb -0.17 -4.00 0.03 0.00 0.26 0.00 0.00 34.13 30.25 2jva s GLU 16 CO -0.07 -1.64 0.53 -0.51 -0.54 0.00 0.00 175.26 173.04 2jva s LEU 17 N 4.89 4.85 0.30 2.70 1.43 -1.26 -2.39 118.68 129.19 2jva s LEU 17 Ca 0.44 -0.69 0.05 0.00 -1.03 0.00 0.00 54.13 52.89 2jva s LEU 17 Cb -0.07 -2.47 -0.06 0.00 0.03 0.00 0.00 46.19 43.61 2jva s LEU 17 CO 0.26 -0.71 0.01 0.42 0.23 0.00 0.00 176.35 176.56 2jva s THR 18 N 2.40 1.35 0.07 5.49 -4.23 -0.26 -5.01 115.64 115.46 2jva s THR 18 Ca 0.15 -2.05 0.09 0.00 -1.18 0.00 0.00 61.69 58.71 2jva s THR 18 Cb -0.17 -2.61 -0.03 0.00 1.34 0.00 0.00 72.50 71.02 2jva s THR 18 CO 0.14 -0.15 -0.25 0.00 -0.54 0.00 0.00 174.62 173.82 2jva s ALA 19 N -3.20 2.16 -0.35 3.99 0.00 -1.26 0.32 121.76 123.42 2jva s ALA 19 Ca 0.33 -1.29 -0.10 0.00 0.00 0.00 0.00 51.96 50.90 2jva s ALA 19 Cb 0.07 -0.40 0.02 0.00 0.00 0.00 0.00 23.12 22.80 2jva s ALA 19 CO 0.13 0.50 0.18 0.42 0.00 0.00 0.00 175.76 176.99 2jva s ILE 20 N -0.91 4.51 -0.19 0.00 1.01 0.14 -4.74 121.20 121.01 2jva s ILE 20 Ca 0.11 -0.74 -0.12 0.00 0.00 0.00 0.00 60.65 59.90 2jva s ILE 20 Cb -0.10 -3.45 -0.05 0.00 0.01 0.00 0.00 42.46 38.88 2jva s ILE 20 CO 0.03 -0.13 0.24 -0.60 0.00 0.00 0.00 174.94 174.48 2jva s ARG 21 N 1.56 4.19 0.36 2.79 3.00 -1.26 -4.37 118.95 125.22 2jva s ARG 21 Ca 0.03 -0.05 -0.28 0.00 -1.00 0.00 0.00 55.73 54.43 2jva s ARG 21 Cb -0.18 -3.47 -0.11 0.00 0.00 0.00 0.00 34.95 31.18 2jva s ARG 21 CO 0.06 0.17 1.46 0.00 0.00 0.00 0.00 175.30 176.99 2jva n ALA 22 N 3.86 2.16 -3.15 6.12 0.00 -1.26 -5.02 120.51 123.23 2jva n ALA 22 Ca -0.13 0.35 -0.15 0.00 0.00 0.00 0.00 53.44 53.51 2jva n ALA 22 Cb 0.52 -2.39 0.03 0.00 0.00 0.00 0.00 19.45 17.61 2jva n ALA 22 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jva n GLN 23 N 0.71 0.80 0.00 0.00 0.00 -1.26 -4.92 117.38 112.72 2jva n GLN 23 Ca 0.03 -1.91 0.00 0.00 0.00 0.00 0.00 57.00 55.12 2jva n GLN 23 Cb 0.38 -0.08 0.00 0.00 0.00 0.00 0.00 30.24 30.54 2jva n GLN 23 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2jva n GLY 24 N 0.80 -0.68 3.55 2.61 0.00 -1.26 -4.98 105.19 105.22 2jva n GLY 24 Ca 0.08 -0.44 -0.38 0.00 0.00 0.00 0.00 46.02 45.28 2jva n GLY 24 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jva s ALA 25 N -1.00 2.42 0.00 4.61 0.00 -1.26 -4.21 121.76 122.32 2jva s ALA 25 Ca 0.00 -1.34 0.00 0.00 0.00 0.00 0.00 51.96 50.62 2jva s ALA 25 Cb 0.00 -4.36 0.00 0.00 0.00 0.00 0.00 23.12 18.76 2jva s ALA 25 CO 0.00 -3.73 0.00 0.41 0.00 0.00 0.00 175.76 172.44 2jva n GLY 26 N 5.94 1.53 0.00 0.00 0.00 -1.26 -3.90 105.19 107.50 2jva n GLY 26 Ca 0.18 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.18 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 0.00 0.87 0.52 -0.02 0.00 -1.26 -4.96 105.19 100.33 2jva n GLY 27 Ca 0.00 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.12 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 -0.86 1.68 0.00 1.61 7.27 -1.25 -3.42 117.38 122.41 2jva n GLN 28 Ca 0.00 -1.03 0.03 0.00 0.07 0.00 0.00 57.00 56.07 2jva n GLN 28 Cb 0.00 -1.37 -0.03 0.00 2.41 0.00 0.00 30.24 31.26 2jva n GLN 28 CO 0.00 0.00 0.00 0.27 0.07 0.00 0.00 177.06 177.40 2jva n ASN 29 N 0.26 0.42 -3.67 1.69 6.94 -1.26 -4.78 115.26 114.85 2jva n ASN 29 Ca 0.15 -0.71 -0.30 0.00 -0.02 0.00 0.00 54.58 53.71 2jva n ASN 29 Cb 0.30 0.89 -0.08 0.00 -2.36 0.00 0.00 39.78 38.53 2jva n ASN 29 CO 0.00 0.00 0.00 1.33 -1.03 0.00 0.00 177.26 177.56 2jva n VAL 30 N -0.98 2.49 -0.35 3.53 0.24 -1.22 -4.81 118.33 117.24 2jva n VAL 30 Ca 0.01 -5.18 0.07 0.00 -2.04 0.00 0.00 64.34 57.20 2jva n VAL 30 Cb 0.10 -2.15 0.31 0.00 -1.47 0.00 0.00 33.84 30.63 2jva n VAL 30 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 2jva n ASN 31 N 1.34 4.35 -4.77 -1.34 3.02 -1.26 -4.87 115.26 111.73 2jva n ASN 31 Ca 0.26 -2.51 -0.36 0.00 -0.03 0.00 0.00 54.58 51.94 2jva n ASN 31 Cb 0.38 -0.57 -0.08 0.00 -0.61 0.00 0.00 39.78 38.90 2jva n ASN 31 CO 0.00 0.00 0.00 -1.59 -2.62 0.00 0.00 177.26 173.05 2jva s LYS 32 N -2.03 3.25 0.14 3.52 -2.85 -1.26 -5.09 119.74 115.42 2jva s LYS 32 Ca 0.43 -0.28 -0.27 0.00 -1.00 0.00 0.00 55.97 54.86 2jva s LYS 32 Cb 0.30 -3.00 -0.07 0.00 -2.06 0.00 0.00 37.83 33.00 2jva s LYS 32 CO 0.18 0.71 0.83 0.54 0.10 0.00 0.00 175.35 177.71 2jva s VAL 33 N -0.87 4.42 0.29 1.79 0.11 -1.26 -4.73 120.40 120.14 2jva s VAL 33 Ca 0.13 1.81 -0.07 0.00 -2.93 0.00 0.00 61.98 60.93 2jva s VAL 33 Cb -0.12 -4.19 -0.06 0.00 -1.53 0.00 0.00 36.38 30.48 2jva s VAL 33 CO 0.03 0.45 0.57 -0.44 -3.33 0.00 0.00 175.10 172.39 2jva s SER 34 N -0.75 6.49 0.04 3.54 0.01 -1.26 -4.99 113.70 116.79 2jva s SER 34 Ca 0.39 0.81 0.26 0.00 1.31 0.00 0.00 55.95 58.72 2jva s SER 34 Cb -0.23 -2.18 0.79 0.00 0.21 0.00 0.00 66.02 64.61 2jva s SER 34 CO 0.27 -0.19 1.64 -1.54 0.41 0.00 0.00 173.24 173.83 2jva n SER 35 N -0.78 0.38 -4.59 2.44 3.41 -1.26 -4.79 113.62 108.43 2jva n SER 35 Ca -0.01 0.19 -0.41 0.00 -0.26 0.00 0.00 58.87 58.38 2jva n SER 35 Cb 0.54 -0.17 -0.03 0.00 -0.26 0.00 0.00 64.21 64.29 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 -3.04 2.52 0.08 7.33 0.00 -1.25 -4.46 121.76 122.94 2jva s ALA 36 Ca 0.11 0.38 -0.06 0.00 0.00 0.00 0.00 51.96 52.39 2jva s ALA 36 Cb 0.17 -4.13 -0.05 0.00 0.00 0.00 0.00 23.12 19.11 2jva s ALA 36 CO 0.63 -3.15 0.33 -1.64 0.00 0.00 0.00 175.76 171.93 2jva s MET 37 N 6.56 3.62 -0.21 0.00 -1.94 0.12 0.25 119.30 127.70 2jva s MET 37 Ca 0.91 -0.06 -0.05 0.00 -1.71 0.00 0.00 55.69 54.78 2jva s MET 37 Cb -0.25 -2.96 -0.02 0.00 2.01 0.00 0.00 34.83 33.60 2jva s MET 37 CO 0.32 0.55 -0.00 -1.58 -0.01 0.00 0.00 175.02 174.30 2jva s HIS 38 N -1.49 3.02 -0.14 -0.03 5.04 0.15 0.01 115.29 121.85 2jva s HIS 38 Ca 0.35 -0.58 -0.02 0.00 -1.54 0.00 0.00 55.06 53.27 2jva s HIS 38 Cb -0.13 -2.11 -0.02 0.00 0.04 0.00 0.00 32.58 30.36 2jva s HIS 38 CO 0.21 -0.34 -0.09 -0.51 -2.34 0.00 0.00 174.74 171.68 2jva s LEU 39 N 1.21 2.97 -0.22 8.88 2.01 0.00 -1.10 118.68 132.44 2jva s LEU 39 Ca 0.03 -0.23 -0.04 0.00 0.01 0.00 0.00 54.13 53.90 2jva s LEU 39 Cb -0.15 -1.69 0.07 0.00 0.01 0.00 0.00 46.19 44.44 2jva s LEU 39 CO 0.01 0.17 0.09 -0.60 1.01 0.00 0.00 176.35 177.02 2jva s ARG 40 N 0.33 0.30 -0.17 1.70 3.52 -1.01 -0.27 118.95 123.36 2jva s ARG 40 Ca -0.08 -0.35 -0.00 0.00 -0.13 0.00 0.00 55.73 55.17 2jva s ARG 40 Cb -0.15 -1.77 -0.00 0.00 -1.56 0.00 0.00 34.95 31.47 2jva s ARG 40 CO 0.04 -0.77 -0.14 0.12 -0.81 0.00 0.00 175.30 173.74 2jva s PHE 41 N 2.01 2.81 -0.49 5.12 5.36 -0.14 -1.46 117.98 131.19 2jva s PHE 41 Ca 0.03 -1.07 -0.22 0.00 -0.96 0.00 0.00 56.93 54.72 2jva s PHE 41 Cb -0.16 -1.92 0.04 0.00 -0.34 0.00 0.00 43.02 40.64 2jva s PHE 41 CO -0.16 -0.51 0.75 0.34 -1.46 0.00 0.00 175.22 174.17 2jva s ASP 42 N 0.94 6.31 0.33 6.13 -1.08 -1.26 -0.59 116.67 127.45 2jva s ASP 42 Ca -0.03 -0.49 0.18 0.00 -0.52 0.00 0.00 52.55 51.69 2jva s ASP 42 Cb -0.15 -2.35 0.29 0.00 -1.46 0.00 0.00 42.92 39.25 2jva s ASP 42 CO -0.02 -0.97 1.55 0.40 0.52 0.00 0.00 175.17 176.66 2jva h ILE 43 N 5.93 0.70 0.16 4.11 2.04 -0.71 -3.00 117.51 126.73 2jva h ILE 43 Ca -0.26 -1.83 -0.01 0.00 1.00 0.00 0.00 64.86 63.76 2jva h ILE 43 Cb 1.09 2.23 0.00 0.00 -0.74 0.00 0.00 36.82 39.39 2jva h ILE 43 CO 0.98 0.37 -0.08 -1.13 0.00 0.00 0.00 178.15 178.30 2jva h ASN 44 N 0.00 -0.18 -0.23 1.72 -0.73 -1.63 -3.33 115.58 111.20 2jva h ASN 44 Ca -0.00 -0.20 0.00 0.00 1.87 0.00 0.00 56.30 57.97 2jva h ASN 44 Cb 1.19 0.05 0.00 0.00 0.27 0.00 0.00 38.32 39.83 2jva h ASN 44 CO 0.05 0.11 0.00 0.00 -0.37 0.00 0.00 177.43 177.22 2jva n ALA 45 N -2.33 2.30 -1.52 1.57 0.00 -1.25 -5.02 120.51 114.26 2jva n ALA 45 Ca -0.09 -1.46 -0.29 0.00 0.00 0.00 0.00 53.44 51.60 2jva n ALA 45 Cb 0.20 -0.39 0.16 0.00 0.00 0.00 0.00 19.45 19.42 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 -1.33 3.02 0.00 0.00 1.04 -1.13 -4.91 113.70 110.38 2jva s SER 46 Ca 0.22 0.80 0.00 0.00 0.48 0.00 0.00 55.95 57.45 2jva s SER 46 Cb 0.15 -1.23 0.00 0.00 0.10 0.00 0.00 66.02 65.03 2jva s SER 46 CO 0.10 -2.84 0.69 -1.20 0.98 0.00 0.00 173.24 170.97 2jva n SER 47 N -3.93 0.62 -4.73 7.02 7.64 -1.26 -4.84 113.62 114.13 2jva n SER 47 Ca 0.09 -1.99 -0.41 0.00 1.01 0.00 0.00 58.87 57.57 2jva n SER 47 Cb 0.59 -0.31 -0.04 0.00 -1.01 0.00 0.00 64.21 63.45 2jva n SER 47 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2jva s LEU 48 N -0.38 4.48 0.58 -3.43 1.43 -1.26 -4.77 118.68 115.33 2jva s LEU 48 Ca 0.00 2.04 -0.21 0.00 -1.03 0.00 0.00 54.13 54.93 2jva s LEU 48 Cb 0.00 -3.60 -0.04 0.00 0.03 0.00 0.00 46.19 42.58 2jva s LEU 48 CO 0.00 -0.22 1.34 -2.84 0.23 0.00 0.00 176.35 174.87 2jva s PRO 49 N -0.19 2.96 0.47 1.29 0.02 -1.26 -4.74 135.00 133.54 2jva s PRO 49 Ca 0.50 2.19 0.25 0.00 0.02 0.00 0.00 61.00 63.96 2jva s PRO 49 Cb -0.28 -2.13 1.29 0.00 0.02 0.00 0.00 34.50 33.39 2jva s PRO 49 CO 0.34 -1.32 1.83 -1.00 -0.33 0.00 0.00 177.00 176.51 2jva h PRO 50 N 1.18 0.21 0.00 5.54 0.13 -1.97 -0.36 132.00 136.73 2jva h PRO 50 Ca -0.51 -0.01 0.03 0.00 -0.87 0.00 0.00 66.00 64.64 2jva h PRO 50 Cb 1.31 -0.05 -0.04 0.00 0.13 0.00 0.00 31.00 32.36 2jva h PRO 50 CO 0.56 0.14 -0.21 0.35 -0.23 0.00 0.00 178.00 178.61 2jva h PHE 51 N 0.22 -0.54 -0.33 1.56 3.57 -2.00 0.33 116.94 119.75 2jva h PHE 51 Ca 0.52 0.02 -0.11 0.00 3.53 0.00 0.00 57.97 61.93 2jva h PHE 51 Cb 1.64 0.24 -0.01 0.00 2.79 0.00 0.00 35.95 40.60 2jva h PHE 51 CO -0.00 -0.29 -0.25 1.88 -2.23 0.00 0.00 178.31 177.42 2jva h TYR 52 N -0.33 0.74 0.10 0.41 0.05 -1.45 -3.05 116.97 113.44 2jva h TYR 52 Ca 0.06 -0.17 0.00 0.00 0.05 0.00 0.00 58.73 58.67 2jva h TYR 52 Cb 0.41 -0.18 -0.01 0.00 1.01 0.00 0.00 36.73 37.96 2jva h TYR 52 CO -0.25 0.84 -0.09 0.87 -1.05 0.00 0.00 178.16 178.48 2jva h LYS 53 N 0.57 -0.20 -0.90 4.88 1.57 -0.91 -2.87 116.57 118.70 2jva h LYS 53 Ca 0.08 0.01 0.12 0.00 -1.87 0.00 0.00 60.65 58.99 2jva h LYS 53 Cb 0.73 0.05 -0.08 0.00 0.08 0.00 0.00 32.23 33.00 2jva h LYS 53 CO 0.06 -0.14 0.53 0.93 -0.57 0.00 0.00 179.45 180.26 2jva h GLU 54 N -0.21 0.81 0.02 3.15 5.08 -0.86 0.21 114.58 122.78 2jva h GLU 54 Ca 0.00 -0.05 0.01 0.00 -1.00 0.00 0.00 59.36 58.33 2jva h GLU 54 Cb 0.20 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 29.25 2jva h GLU 54 CO -0.02 0.54 -0.08 0.00 -1.00 0.00 0.00 179.01 178.44 2jva h ARG 55 N 0.83 -0.15 -0.09 2.33 2.47 -1.41 0.36 114.38 118.72 2jva h ARG 55 Ca 0.45 0.01 -0.18 0.00 -1.26 0.00 0.00 59.98 59.00 2jva h ARG 55 Cb 0.47 0.03 0.01 0.00 -1.65 0.00 0.00 29.97 28.84 2jva h ARG 55 CO -0.28 -0.10 -0.64 -0.07 0.56 0.00 0.00 179.97 179.44 2jva h LEU 56 N -0.16 0.72 -1.69 3.04 3.38 -1.27 -3.01 115.31 116.32 2jva h LEU 56 Ca 0.03 -0.66 -0.02 0.00 0.09 0.00 0.00 57.88 57.31 2jva h LEU 56 Cb 0.19 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 40.72 2jva h LEU 56 CO -0.07 1.27 -0.10 -0.07 0.09 0.00 0.00 178.44 179.56 2jva h LEU 57 N 0.22 0.00 -3.09 1.67 3.38 -0.53 -1.34 115.31 115.63 2jva h LEU 57 Ca -0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.92 2jva h LEU 57 Cb 1.29 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.04 2jva h LEU 57 CO 0.13 0.10 0.00 0.00 0.09 0.00 0.00 178.44 178.76 2jva n ALA 58 N -2.18 3.00 -2.17 1.53 0.00 0.11 -4.95 120.51 115.84 2jva n ALA 58 Ca -0.01 -1.56 -0.36 0.00 0.00 0.00 0.00 53.44 51.51 2jva n ALA 58 Cb 0.29 -1.02 -0.06 0.00 0.00 0.00 0.00 19.45 18.66 2jva n ALA 58 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 2jva s LEU 59 N -1.72 4.34 -0.07 0.00 2.96 -0.51 -4.80 118.68 118.87 2jva s LEU 59 Ca 0.52 1.33 0.11 0.00 -0.22 0.00 0.00 54.13 55.86 2jva s LEU 59 Cb 0.32 -3.51 0.44 0.00 0.50 0.00 0.00 46.19 43.95 2jva s LEU 59 CO 0.27 0.05 1.28 -3.20 -1.32 0.00 0.00 176.35 173.43 2jva n ASN 60 N 0.73 3.12 -4.73 3.68 4.05 -1.26 -4.92 115.26 115.93 2jva n ASN 60 Ca -0.03 -2.29 -0.42 0.00 0.45 0.00 0.00 54.58 52.29 2jva n ASN 60 Cb 0.51 -0.46 -0.03 0.00 1.23 0.00 0.00 39.78 41.03 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 -0.72 6.90 0.59 1.20 -1.08 -1.26 -4.89 116.67 117.41 2jva s ASP 61 Ca 0.31 2.31 0.39 0.00 -0.52 0.00 0.00 52.55 55.04 2jva s ASP 61 Cb 0.20 -2.60 1.99 0.00 -1.46 0.00 0.00 42.92 41.05 2jva s ASP 61 CO 0.15 -0.56 2.18 0.28 0.52 0.00 0.00 175.17 177.73 2jva h SER 62 N 6.10 0.00 0.72 -0.34 0.02 -2.02 -0.06 113.55 117.97 2jva h SER 62 Ca -0.43 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.52 2jva h SER 62 Cb 1.21 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.75 2jva h SER 62 CO 0.81 0.00 -0.13 0.54 -1.14 0.00 0.00 176.83 176.91 2jva n ARG 63 N -2.96 0.18 -3.30 3.45 1.74 -1.26 -4.72 116.66 109.79 2jva n ARG 63 Ca -0.02 -0.04 -0.39 0.00 -0.77 0.00 0.00 57.85 56.62 2jva n ARG 63 Cb 0.13 -1.50 -0.08 0.00 -1.02 0.00 0.00 32.46 29.99 2jva n ARG 63 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 2jva s ILE 64 N -2.85 5.12 0.36 0.55 -1.09 -0.04 -2.77 121.20 120.47 2jva s ILE 64 Ca 0.18 0.77 0.00 0.00 -2.23 0.00 0.00 60.65 59.37 2jva s ILE 64 Cb 0.19 -3.78 -0.03 0.00 -1.58 0.00 0.00 42.46 37.26 2jva s ILE 64 CO 0.55 0.13 0.57 0.42 -1.23 0.00 0.00 174.94 175.37 2jva s THR 65 N 2.11 4.98 -0.48 2.92 -4.23 -0.54 -4.88 115.64 115.51 2jva s THR 65 Ca 0.19 -0.45 0.24 0.00 -1.18 0.00 0.00 61.69 60.49 2jva s THR 65 Cb -0.16 -3.82 0.25 0.00 1.34 0.00 0.00 72.50 70.11 2jva s THR 65 CO 0.09 -0.54 1.71 -1.20 -0.54 0.00 0.00 174.62 174.14 2jva n SER 66 N -1.83 0.67 0.09 3.99 7.64 -1.26 -1.50 113.62 121.42 2jva n SER 66 Ca -0.04 0.66 0.13 0.00 1.01 0.00 0.00 58.87 60.63 2jva n SER 66 Cb 0.56 -0.81 0.44 0.00 -1.01 0.00 0.00 64.21 63.40 2jva n SER 66 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 2jva n ASP 67 N -2.24 0.67 0.00 6.43 8.00 -1.26 -4.90 116.55 123.26 2jva n ASP 67 Ca 0.02 0.58 0.00 0.00 0.71 0.00 0.00 54.79 56.10 2jva n ASP 67 Cb 0.23 -0.75 0.00 0.00 -0.02 0.00 0.00 41.12 40.58 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 1.12 1.17 3.23 0.44 0.00 -0.56 -4.74 105.19 105.86 2jva n GLY 68 Ca 0.05 -0.42 -0.29 0.00 0.00 0.00 0.00 46.02 45.36 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 -2.00 1.84 -0.18 1.61 1.01 -1.25 0.09 120.40 121.52 2jva s VAL 69 Ca 0.00 -0.96 -0.05 0.00 0.00 0.00 0.00 61.98 60.97 2jva s VAL 69 Cb 0.00 -1.55 -0.03 0.00 0.00 0.00 0.00 36.38 34.80 2jva s VAL 69 CO 0.00 0.52 -0.01 -0.51 0.00 0.00 0.00 175.10 175.10 2jva s ILE 70 N -0.21 4.07 -0.08 2.22 2.07 0.24 -1.47 121.20 128.04 2jva s ILE 70 Ca -0.00 -0.28 0.05 0.00 -1.41 0.00 0.00 60.65 59.00 2jva s ILE 70 Cb -0.12 -2.82 -0.01 0.00 0.13 0.00 0.00 42.46 39.64 2jva s ILE 70 CO 0.02 0.46 -0.22 0.54 -1.91 0.00 0.00 174.94 173.83 2jva s VAL 71 N 0.61 2.26 0.13 4.00 0.11 -1.12 -0.97 120.40 125.43 2jva s VAL 71 Ca -0.01 -0.98 0.04 0.00 -2.93 0.00 0.00 61.98 58.10 2jva s VAL 71 Cb -0.14 -1.85 -0.04 0.00 -1.53 0.00 0.00 36.38 32.81 2jva s VAL 71 CO 0.02 0.56 -0.09 -0.76 -3.33 0.00 0.00 175.10 171.50 2jva s LEU 72 N -0.01 2.51 -0.22 2.54 1.02 0.63 -4.85 118.68 120.31 2jva s LEU 72 Ca -0.08 -0.99 -0.02 0.00 0.02 0.00 0.00 54.13 53.07 2jva s LEU 72 Cb -0.15 -0.27 0.07 0.00 0.02 0.00 0.00 46.19 45.85 2jva s LEU 72 CO 0.05 -0.36 0.02 -0.54 0.02 0.00 0.00 176.35 175.55 2jva s LYS 73 N -3.66 0.90 -0.56 1.70 1.02 -1.26 -0.82 119.74 117.07 2jva s LYS 73 Ca 0.14 -0.67 -0.18 0.00 0.02 0.00 0.00 55.97 55.28 2jva s LYS 73 Cb 0.03 -2.22 0.09 0.00 -0.52 0.00 0.00 37.83 35.21 2jva s LYS 73 CO -0.01 -0.68 0.65 0.00 -0.92 0.00 0.00 175.35 174.38 2jva s ALA 74 N 1.70 3.43 -0.09 5.17 0.00 0.10 -4.81 121.76 127.27 2jva s ALA 74 Ca -0.01 -2.11 0.15 0.00 0.00 0.00 0.00 51.96 49.99 2jva s ALA 74 Cb -0.18 -3.43 0.32 0.00 0.00 0.00 0.00 23.12 19.83 2jva s ALA 74 CO -0.10 -2.19 1.15 0.00 0.00 0.00 0.00 175.76 174.62 2jva n GLN 75 N 6.13 0.74 0.03 0.00 10.64 -1.26 0.10 117.38 133.76 2jva n GLN 75 Ca -0.09 -2.33 -0.13 0.00 -1.83 0.00 0.00 57.00 52.62 2jva n GLN 75 Cb 0.43 -0.89 -0.09 0.00 -0.86 0.00 0.00 30.24 28.83 2jva n GLN 75 CO 0.00 0.00 0.00 0.37 -1.83 0.00 0.00 177.06 175.60 2jva h GLN 76 N 0.62 -0.12 -6.73 2.61 5.75 -1.89 -3.46 115.11 111.89 2jva h GLN 76 Ca -0.07 0.01 -0.46 0.00 -0.15 0.00 0.00 58.65 57.98 2jva h GLN 76 Cb 1.35 0.03 0.03 0.00 1.07 0.00 0.00 27.48 29.96 2jva h GLN 76 CO 0.03 0.31 -0.08 0.71 -2.65 0.00 0.00 178.83 177.16 2jva s TYR 77 N -4.26 3.18 0.23 3.99 1.51 -1.26 -5.01 117.35 115.74 2jva s TYR 77 Ca -0.15 0.22 -0.01 0.00 -1.01 0.00 0.00 57.07 56.12 2jva s TYR 77 Cb 0.02 -2.37 0.26 0.00 -0.11 0.00 0.00 41.96 39.75 2jva s TYR 77 CO 0.62 -0.43 1.62 -0.09 -1.11 0.00 0.00 175.55 176.16 2jva h ARG 78 N 0.35 0.56 -6.21 -0.62 9.65 -1.96 -3.45 114.38 112.69 2jva h ARG 78 Ca -0.46 -0.26 -0.49 0.00 -1.10 0.00 0.00 59.98 57.67 2jva h ARG 78 Cb 1.26 -0.01 -0.04 0.00 -1.39 0.00 0.00 29.97 29.79 2jva h ARG 78 CO 0.57 0.83 -0.46 0.95 2.80 0.00 0.00 179.97 184.66 2jva s THR 79 N -4.32 3.93 0.17 0.20 -4.23 -1.26 -4.53 115.64 105.60 2jva s THR 79 Ca -0.07 -1.34 0.02 0.00 -1.18 0.00 0.00 61.69 59.12 2jva s THR 79 Cb 0.13 -3.30 -0.14 0.00 1.34 0.00 0.00 72.50 70.53 2jva s THR 79 CO 0.82 -0.23 1.39 1.56 -0.54 0.00 0.00 174.62 177.61 2jva h GLN 80 N 1.29 0.23 -0.01 3.99 4.20 -1.88 -3.21 115.11 119.72 2jva h GLN 80 Ca -0.46 -0.24 0.01 0.00 0.06 0.00 0.00 58.65 58.02 2jva h GLN 80 Cb 1.25 0.07 -0.01 0.00 0.30 0.00 0.00 27.48 29.08 2jva h GLN 80 CO 0.59 0.95 -0.04 1.49 -0.67 0.00 0.00 178.83 181.14 2jva h GLU 81 N 0.13 -0.07 -0.51 1.46 4.81 -1.95 0.24 114.58 118.69 2jva h GLU 81 Ca -0.04 0.00 -0.12 0.00 -0.13 0.00 0.00 59.36 59.07 2jva h GLU 81 Cb 1.47 0.02 -0.02 0.00 0.63 0.00 0.00 28.75 30.85 2jva h GLU 81 CO 0.13 -0.05 -0.14 1.96 -0.73 0.00 0.00 179.01 180.19 2jva h GLN 82 N -0.07 0.99 -0.53 1.92 7.50 -1.98 -0.93 115.11 122.01 2jva h GLN 82 Ca 0.02 -0.38 -0.04 0.00 0.50 0.00 0.00 58.65 58.76 2jva h GLN 82 Cb 0.10 -0.06 -0.03 0.00 0.05 0.00 0.00 27.48 27.55 2jva h GLN 82 CO -0.05 1.05 0.18 -0.91 -1.50 0.00 0.00 178.83 177.60 2jva h ASN 83 N 0.87 0.72 0.18 1.46 2.35 -1.48 0.68 115.58 120.36 2jva h ASN 83 Ca 0.13 -0.10 -0.01 0.00 -0.55 0.00 0.00 56.30 55.77 2jva h ASN 83 Cb 0.70 -0.19 0.00 0.00 0.05 0.00 0.00 38.32 38.89 2jva h ASN 83 CO 0.05 0.67 -0.09 -0.09 -1.65 0.00 0.00 177.43 176.33 2jva h ARG 84 N 0.77 -0.24 -0.51 0.81 2.43 -0.04 -1.42 114.38 116.18 2jva h ARG 84 Ca 0.18 0.02 -0.10 0.00 -0.81 0.00 0.00 59.98 59.27 2jva h ARG 84 Cb 0.20 0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 29.78 2jva h ARG 84 CO -0.01 0.06 -0.06 0.00 -1.51 0.00 0.00 179.97 178.45 2jva h ALA 85 N 0.21 0.93 0.10 2.80 0.00 -1.04 -2.30 119.26 119.95 2jva h ALA 85 Ca -0.03 -0.31 -0.00 0.00 0.00 0.00 0.00 54.91 54.57 2jva h ALA 85 Cb 0.41 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.00 2jva h ALA 85 CO 0.04 0.63 -0.05 0.22 0.00 0.00 0.00 179.25 180.10 2jva h ASP 86 N 0.83 -0.11 -0.74 0.00 1.82 -0.89 -2.86 116.42 114.48 2jva h ASP 86 Ca 0.14 -0.31 0.04 0.00 -0.39 0.00 0.00 57.03 56.51 2jva h ASP 86 Cb 0.58 0.03 -0.05 0.00 0.68 0.00 0.00 39.33 40.57 2jva h ASP 86 CO 0.03 0.26 0.46 0.00 -1.61 0.00 0.00 179.24 178.39 2jva h ALA 87 N 0.36 0.98 -0.27 -0.78 0.00 -1.22 -0.50 119.26 117.83 2jva h ALA 87 Ca -0.01 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.84 2jva h ALA 87 Cb 0.41 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 2jva h ALA 87 CO 0.02 0.23 -0.01 -0.07 0.00 0.00 0.00 179.25 179.43 2jva h LEU 88 N 0.89 0.37 -0.07 0.00 3.38 -1.44 0.18 115.31 118.62 2jva h LEU 88 Ca 0.30 -0.06 -0.07 0.00 0.09 0.00 0.00 57.88 58.14 2jva h LEU 88 Cb 0.05 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.71 2jva h LEU 88 CO -0.12 0.44 -0.24 0.25 0.09 0.00 0.00 178.44 178.86 2jva h LEU 89 N 0.39 0.33 -1.15 1.67 7.12 -1.06 -2.47 115.31 120.14 2jva h LEU 89 Ca 0.09 -0.62 -0.06 0.00 0.13 0.00 0.00 57.88 57.42 2jva h LEU 89 Cb 0.27 -0.10 -0.02 0.00 -0.53 0.00 0.00 40.66 40.29 2jva h LEU 89 CO 0.01 0.89 -0.01 0.03 -0.13 0.00 0.00 178.44 179.24 2jva h ARG 90 N -0.22 0.58 0.08 1.25 3.08 -0.80 -1.64 114.38 116.71 2jva h ARG 90 Ca -0.01 -0.13 -0.00 0.00 0.07 0.00 0.00 59.98 59.90 2jva h ARG 90 Cb 0.87 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.84 2jva h ARG 90 CO 0.05 0.61 -0.04 1.25 -1.07 0.00 0.00 179.97 180.78 2jva h LEU 91 N 0.56 -0.09 -0.68 3.04 5.85 -0.66 -0.16 115.31 123.16 2jva h LEU 91 Ca 0.12 -0.27 -0.03 0.00 0.84 0.00 0.00 57.88 58.54 2jva h LEU 91 Cb 0.36 0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.39 2jva h LEU 91 CO 0.01 0.23 0.31 0.77 -0.34 0.00 0.00 178.44 179.42 2jva h SER 92 N -0.41 0.90 -0.70 1.25 4.64 -1.35 -2.27 113.55 115.61 2jva h SER 92 Ca -0.01 -0.14 -0.05 0.00 -0.47 0.00 0.00 61.79 61.12 2jva h SER 92 Cb 0.35 -0.23 -0.03 0.00 -0.31 0.00 0.00 62.40 62.18 2jva h SER 92 CO 0.02 0.80 0.24 -0.08 -0.87 0.00 0.00 176.83 176.94 2jva h GLU 93 N 0.95 1.08 -0.90 4.77 4.22 -1.29 -2.85 114.58 120.55 2jva h GLU 93 Ca 0.23 -0.22 0.10 0.00 0.08 0.00 0.00 59.36 59.55 2jva h GLU 93 Cb 0.14 -0.16 -0.07 0.00 0.50 0.00 0.00 28.75 29.17 2jva h GLU 93 CO -0.03 0.91 0.58 1.25 -2.18 0.00 0.00 179.01 179.55 2jva h LEU 94 N 1.02 0.82 -0.56 1.64 5.85 -0.45 1.02 115.31 124.65 2jva h LEU 94 Ca 0.23 0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.97 2jva h LEU 94 Cb 0.27 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 41.12 2jva h LEU 94 CO -0.01 0.48 0.33 0.40 -0.34 0.00 0.00 178.44 179.30 2jva h ILE 95 N 0.91 1.17 0.00 4.05 2.04 -1.24 -0.87 117.51 123.58 2jva h ILE 95 Ca 0.42 -0.41 -0.20 0.00 1.00 0.00 0.00 64.86 65.67 2jva h ILE 95 Cb 0.39 0.43 -0.01 0.00 -0.74 0.00 0.00 36.82 36.90 2jva h ILE 95 CO -0.18 0.18 -0.88 0.58 0.00 0.00 0.00 178.15 177.85 2jva h VAL 96 N 0.75 1.48 -0.64 1.67 2.07 -1.12 -3.17 116.25 117.29 2jva h VAL 96 Ca 0.20 -2.58 0.04 0.00 0.82 0.00 0.00 66.70 65.18 2jva h VAL 96 Cb 0.01 2.45 -0.04 0.00 -1.52 0.00 0.00 31.29 32.19 2jva h VAL 96 CO -0.04 0.75 0.42 -1.13 0.02 0.00 0.00 177.57 177.60 2jva h ASN 97 N 0.13 0.63 0.36 0.57 -0.73 0.15 0.44 115.58 117.13 2jva h ASN 97 Ca -0.05 -0.01 -0.02 0.00 1.87 0.00 0.00 56.30 58.10 2jva h ASN 97 Cb 1.51 -0.15 -0.00 0.00 0.27 0.00 0.00 38.32 39.95 2jva h ASN 97 CO 0.14 0.43 -0.08 0.00 -0.37 0.00 0.00 177.43 177.55 2jva h ALA 98 N 1.63 1.24 -0.00 1.57 0.00 -1.14 -0.11 119.26 122.45 2jva h ALA 98 Ca 0.26 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.09 2jva h ALA 98 Cb 0.11 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.88 2jva h ALA 98 CO -0.07 0.10 -0.26 0.00 0.00 0.00 0.00 179.25 179.02 2jva n ALA 99 N -2.24 2.98 0.15 0.00 0.00 0.12 -3.32 120.51 118.20 2jva n ALA 99 Ca -0.02 -0.24 0.11 0.00 0.00 0.00 0.00 53.44 53.29 2jva n ALA 99 Cb 0.21 -1.28 0.07 0.00 0.00 0.00 0.00 19.45 18.45 2jva n ALA 99 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 2jva h LYS 100 N 0.07 0.00 0.00 0.00 1.57 -0.78 -3.47 116.57 113.97 2jva h LYS 100 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2jva h LYS 100 Cb 0.49 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.80 2jva h LYS 100 CO 0.00 0.03 0.00 1.28 -0.57 0.00 0.00 179.45 180.19 2jva n LEU 101 N -2.87 0.00 0.00 2.94 4.77 -1.15 -5.09 117.00 115.59 2jva n LEU 101 Ca 0.01 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.99 2jva n LEU 101 Cb 0.56 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.65 2jva n LEU 101 CO 0.38 -0.36 0.00 -0.62 -1.33 0.00 0.00 177.39 175.46 2jva n GLU 102 N -0.72 0.42 0.00 3.23 -0.58 -1.26 -5.03 120.64 116.70 2jva n GLU 102 Ca 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 2jva n GLU 102 Cb 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 30.87 2jva n GLU 102 CO 0.00 0.00 0.00 0.72 -0.48 0.00 0.00 177.13 177.37 2jva n HIS 103 N -1.06 0.00 0.00 -0.32 8.25 -1.26 -4.94 115.22 115.89 2jva n HIS 103 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 2jva n HIS 103 Cb 0.00 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.11 2jva n HIS 103 CO 0.00 0.00 0.00 -2.39 0.64 0.00 0.00 176.34 174.59 2jva n HIS 104 N -0.17 0.00 -4.20 4.41 1.44 -1.26 -4.83 115.22 110.61 2jva n HIS 104 Ca 0.00 0.00 -0.17 0.00 -2.01 0.00 0.00 57.72 55.54 2jva n HIS 104 Cb 0.00 0.00 -0.12 0.00 0.12 0.00 0.00 29.99 29.99 2jva n HIS 104 CO 0.00 0.00 0.00 -1.01 -2.81 0.00 0.00 176.34 172.52 2jva s HIS 105 N 0.00 0.98 0.00 -1.40 3.76 -1.26 -4.82 115.29 112.55 2jva s HIS 105 Ca 0.00 -0.40 0.00 0.00 -0.15 0.00 0.00 55.06 54.51 2jva s HIS 105 Cb 0.00 -0.57 0.00 0.00 1.11 0.00 0.00 32.58 33.12 2jva s HIS 105 CO 0.00 0.00 0.00 1.58 -0.85 0.00 0.00 174.74 175.47 2jva n HIS 106 N 1.72 0.00 0.00 1.40 -0.00 -1.26 -4.94 115.22 112.14 2jva n HIS 106 Ca -0.20 0.00 0.00 0.00 0.46 0.00 0.00 57.72 57.98 2jva n HIS 106 Cb 0.55 0.00 0.00 0.00 -0.12 0.00 0.00 29.99 30.42 2jva n HIS 106 CO 0.00 0.00 0.00 1.58 0.46 0.00 0.00 176.34 178.38 2jva n HIS 107 N -0.23 0.00 -0.23 1.57 -0.00 -1.26 -5.21 115.22 109.86 2jva n HIS 107 Ca 0.00 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.18 2jva n HIS 107 Cb 0.00 0.00 0.00 0.00 -0.12 0.00 0.00 29.99 29.87 2jva n HIS 107 CO 0.00 0.00 0.00 1.58 0.46 0.00 0.00 176.34 178.38