#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jrs n GLY 2 N 0.00 1.55 3.36 3.03 0.00 -1.26 -4.77 105.19 107.11 2jrs n GLY 2 Ca 0.00 -0.02 -0.39 0.00 0.00 0.00 0.00 46.02 45.62 2jrs n GLY 2 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2jrs s HIS 3 N 0.00 3.20 -0.62 1.61 -0.00 -1.26 -4.93 115.29 113.29 2jrs s HIS 3 Ca 0.00 -0.95 0.21 0.00 -0.00 0.00 0.00 55.06 54.32 2jrs s HIS 3 Cb 0.00 -2.34 -0.27 0.00 -0.00 0.00 0.00 32.58 29.97 2jrs s HIS 3 CO 0.00 -0.59 0.73 1.58 -0.00 0.00 0.00 174.74 176.46 2jrs n HIS 4 N 4.92 0.00 -4.06 0.38 -0.00 -1.26 -4.97 115.22 110.23 2jrs n HIS 4 Ca -0.13 0.00 -0.09 0.00 -0.00 0.00 0.00 57.72 57.49 2jrs n HIS 4 Cb 0.47 -0.19 -0.11 0.00 -0.00 0.00 0.00 29.99 30.16 2jrs n HIS 4 CO 0.00 0.00 0.00 -1.01 -0.00 0.00 0.00 176.34 175.33 2jrs s HIS 5 N -3.18 0.53 0.00 1.57 3.76 -1.26 -5.05 115.29 111.66 2jrs s HIS 5 Ca 0.02 -0.76 0.00 0.00 -0.15 0.00 0.00 55.06 54.16 2jrs s HIS 5 Cb 0.15 -0.35 0.00 0.00 1.11 0.00 0.00 32.58 33.49 2jrs s HIS 5 CO 0.88 -0.22 0.00 1.58 -0.85 0.00 0.00 174.74 176.12 2jrs n HIS 6 N 0.81 0.00 0.28 1.40 -0.00 -1.26 -4.96 115.22 111.49 2jrs n HIS 6 Ca -0.18 0.00 0.17 0.00 -0.00 0.00 0.00 57.72 57.71 2jrs n HIS 6 Cb 0.58 0.00 0.77 0.00 -0.00 0.00 0.00 29.99 31.33 2jrs n HIS 6 CO 0.00 0.00 0.00 1.12 -0.00 0.00 0.00 176.34 177.46 2jrs h HIS 7 N 0.00 0.00 0.00 1.57 -0.00 -1.99 -3.46 115.15 111.27 2jrs h HIS 7 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.37 2jrs h HIS 7 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 27.41 2jrs h HIS 7 CO 0.00 0.03 0.00 0.72 -0.00 0.00 0.00 177.93 178.68 2jrs n HIS 8 N -3.16 0.00 -4.13 6.12 -0.00 -1.26 -4.70 115.22 108.09 2jrs n HIS 8 Ca -0.00 0.00 -0.08 0.00 -0.00 0.00 0.00 57.72 57.64 2jrs n HIS 8 Cb 0.27 0.00 -0.03 0.00 -0.00 0.00 0.00 29.99 30.23 2jrs n HIS 8 CO 0.00 0.00 0.00 0.43 -0.00 0.00 0.00 176.34 176.77 2jrs n SER 9 N 1.52 0.24 0.23 0.41 7.64 -1.26 -5.03 113.62 117.36 2jrs n SER 9 Ca 0.00 -1.76 0.09 0.00 1.01 0.00 0.00 58.87 58.20 2jrs n SER 9 Cb 0.00 0.50 0.53 0.00 -1.01 0.00 0.00 64.21 64.23 2jrs n SER 9 CO 0.00 0.00 0.00 -0.74 -3.01 0.00 0.00 175.04 171.29 2jrs h HIS 10 N 1.32 0.00 -0.68 1.43 -0.00 -1.95 -3.37 115.15 111.90 2jrs h HIS 10 Ca -0.09 0.00 -0.32 0.00 -0.00 0.00 0.00 60.37 59.96 2jrs h HIS 10 Cb 0.42 0.00 -0.05 0.00 -0.00 0.00 0.00 27.41 27.78 2jrs h HIS 10 CO 0.00 0.24 0.86 1.41 -0.00 0.00 0.00 177.93 180.43 2jrs s MET 11 N -4.03 2.60 0.00 5.26 -2.45 -1.26 -3.14 119.30 116.28 2jrs s MET 11 Ca -0.02 -0.54 0.00 0.00 -1.25 0.00 0.00 55.69 53.88 2jrs s MET 11 Cb 0.13 -5.12 0.00 0.00 1.25 0.00 0.00 34.83 31.09 2jrs s MET 11 CO 0.64 -3.45 0.00 0.00 1.05 0.00 0.00 175.02 173.26 2jrs n ALA 12 N 13.79 0.00 -2.42 4.11 0.00 -1.25 -4.96 120.51 129.78 2jrs n ALA 12 Ca 0.41 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 53.53 2jrs n ALA 12 Cb 0.47 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.78 2jrs n ALA 12 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jrs s ALA 13 N -1.30 2.50 0.00 0.00 0.00 -1.19 -4.79 121.76 116.99 2jrs s ALA 13 Ca 0.00 -1.08 0.00 0.00 0.00 0.00 0.00 51.96 50.88 2jrs s ALA 13 Cb 0.00 -0.78 0.00 0.00 0.00 0.00 0.00 23.12 22.34 2jrs s ALA 13 CO 0.00 0.55 0.00 0.00 0.00 0.00 0.00 175.76 176.31 2jrs n ALA 14 N 2.13 0.00 -2.60 0.00 0.00 -1.26 -4.86 120.51 113.91 2jrs n ALA 14 Ca -0.17 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 52.84 2jrs n ALA 14 Cb 0.52 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.95 2jrs n ALA 14 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 2jrs s MET 15 N 0.00 3.76 0.24 0.00 -1.94 -1.26 -4.99 119.30 115.12 2jrs s MET 15 Ca 0.00 0.62 -0.20 0.00 -1.71 0.00 0.00 55.69 54.40 2jrs s MET 15 Cb 0.00 -3.88 0.03 0.00 2.01 0.00 0.00 34.83 32.98 2jrs s MET 15 CO 0.00 -1.31 0.63 0.00 -0.01 0.00 0.00 175.02 174.34 2jrs s ALA 16 N 4.31 -1.10 -0.60 3.03 0.00 -1.26 -3.84 121.76 122.30 2jrs s ALA 16 Ca 0.47 -0.25 -0.20 0.00 0.00 0.00 0.00 51.96 51.98 2jrs s ALA 16 Cb -0.08 0.88 0.08 0.00 0.00 0.00 0.00 23.12 24.01 2jrs s ALA 16 CO 0.29 -0.93 0.80 0.54 0.00 0.00 0.00 175.76 176.46 2jrs s ASN 17 N -2.90 6.19 0.12 0.00 4.22 -1.26 -4.80 114.94 116.51 2jrs s ASN 17 Ca 0.11 -1.18 0.00 0.00 -2.14 0.00 0.00 52.86 49.65 2jrs s ASN 17 Cb -0.04 -2.35 0.00 0.00 1.28 0.00 0.00 41.25 40.15 2jrs s ASN 17 CO 0.02 -1.21 0.00 0.59 -2.04 0.00 0.00 177.10 174.47 2jrs n ASN 18 N 6.84 0.39 -4.40 3.54 5.03 -1.26 -4.98 115.26 120.43 2jrs n ASN 18 Ca -0.07 0.19 -0.45 0.00 0.87 0.00 0.00 54.58 55.12 2jrs n ASN 18 Cb 0.44 -0.02 -0.03 0.00 -1.02 0.00 0.00 39.78 39.14 2jrs n ASN 18 CO 0.00 0.00 0.00 -0.22 -1.83 0.00 0.00 177.26 175.21 2jrs s LEU 19 N -6.52 5.46 -0.16 3.41 2.96 -1.26 -4.85 118.68 117.72 2jrs s LEU 19 Ca 0.00 -1.83 -0.14 0.00 -0.22 0.00 0.00 54.13 51.94 2jrs s LEU 19 Cb 0.00 -2.33 -0.05 0.00 0.50 0.00 0.00 46.19 44.32 2jrs s LEU 19 CO 0.00 -1.03 -0.28 1.67 -1.32 0.00 0.00 176.35 175.40 2jrs n GLN 20 N 6.08 0.47 -3.42 1.98 7.27 -1.26 -4.95 117.38 123.54 2jrs n GLN 20 Ca 0.06 0.28 -0.22 0.00 0.07 0.00 0.00 57.00 57.19 2jrs n GLN 20 Cb 0.46 -1.43 -0.10 0.00 2.41 0.00 0.00 30.24 31.57 2jrs n GLN 20 CO 0.00 0.00 0.00 0.21 0.07 0.00 0.00 177.06 177.34 2jrs s LYS 21 N -2.59 0.49 0.86 3.69 2.36 -1.26 -5.04 119.74 118.25 2jrs s LYS 21 Ca -0.23 -0.81 0.00 0.00 -2.55 0.00 0.00 55.97 52.38 2jrs s LYS 21 Cb 0.03 -0.94 0.00 0.00 -1.05 0.00 0.00 37.83 35.87 2jrs s LYS 21 CO 0.34 -1.14 0.00 0.41 1.55 0.00 0.00 175.35 176.51 2jrs n GLY 22 N 4.53 0.86 3.21 5.54 0.00 -1.26 -4.67 105.19 113.40 2jrs n GLY 22 Ca 0.06 0.54 -0.10 0.00 0.00 0.00 0.00 46.02 46.53 2jrs n GLY 22 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2jrs s SER 23 N -4.00 0.02 0.13 1.61 0.01 -1.26 -5.04 113.70 105.17 2jrs s SER 23 Ca 0.00 -0.41 -0.02 0.00 1.31 0.00 0.00 55.95 56.83 2jrs s SER 23 Cb 0.00 0.32 -0.04 0.00 0.21 0.00 0.00 66.02 66.52 2jrs s SER 23 CO 0.00 -0.63 0.08 0.00 0.41 0.00 0.00 173.24 173.11 2jrs s ALA 24 N -2.96 0.78 0.00 1.44 0.00 -1.26 -5.04 121.76 114.72 2jrs s ALA 24 Ca -0.02 -1.41 0.00 0.00 0.00 0.00 0.00 51.96 50.52 2jrs s ALA 24 Cb 0.01 0.88 0.00 0.00 0.00 0.00 0.00 23.12 24.00 2jrs s ALA 24 CO -0.06 -0.51 0.00 0.41 0.00 0.00 0.00 175.76 175.60 2jrs n GLY 25 N -0.11 2.19 3.68 0.00 0.00 -1.26 -5.12 105.19 104.56 2jrs n GLY 25 Ca -0.06 0.14 -0.49 0.00 0.00 0.00 0.00 46.02 45.61 2jrs n GLY 25 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2jrs n PRO 26 N 0.00 2.02 -3.84 1.61 -0.02 -1.26 -4.62 135.00 128.89 2jrs n PRO 26 Ca 0.00 0.74 -0.36 0.00 -2.02 0.00 0.00 63.50 61.86 2jrs n PRO 26 Cb 0.00 -2.54 -0.08 0.00 -0.02 0.00 0.00 33.50 30.86 2jrs n PRO 26 CO 0.00 0.00 0.00 1.41 1.98 0.00 0.00 175.50 178.89 2jrs s MET 27 N 3.31 3.86 -0.15 -0.52 1.75 0.85 -4.87 119.30 123.53 2jrs s MET 27 Ca 0.91 -0.21 -0.02 0.00 -1.25 0.00 0.00 55.69 55.11 2jrs s MET 27 Cb -0.74 -3.29 -0.02 0.00 2.84 0.00 0.00 34.83 33.61 2jrs s MET 27 CO 0.51 0.48 -0.07 0.50 -0.65 0.00 0.00 175.02 175.78 2jrs s ARG 28 N -0.17 3.54 -0.05 4.11 3.52 -1.26 -0.25 118.95 128.40 2jrs s ARG 28 Ca 0.10 -0.59 -0.02 0.00 -0.13 0.00 0.00 55.73 55.09 2jrs s ARG 28 Cb -0.12 -2.81 -0.04 0.00 -1.56 0.00 0.00 34.95 30.43 2jrs s ARG 28 CO 0.00 0.21 0.08 -0.51 -0.81 0.00 0.00 175.30 174.27 2jrs s LEU 29 N 0.42 3.95 -0.37 -0.88 1.43 0.63 -1.76 118.68 122.11 2jrs s LEU 29 Ca -0.06 0.23 -0.14 0.00 -1.03 0.00 0.00 54.13 53.13 2jrs s LEU 29 Cb -0.15 -2.12 -0.00 0.00 0.03 0.00 0.00 46.19 43.95 2jrs s LEU 29 CO 0.04 0.33 0.28 -0.47 0.23 0.00 0.00 176.35 176.76 2jrs s TYR 30 N -1.08 3.23 -0.24 0.29 5.04 0.14 -1.12 117.35 123.62 2jrs s TYR 30 Ca 0.19 -0.33 -0.00 0.00 -2.44 0.00 0.00 57.07 54.48 2jrs s TYR 30 Cb -0.12 -2.54 0.03 0.00 0.35 0.00 0.00 41.96 39.68 2jrs s TYR 30 CO 0.09 -0.45 -0.10 0.08 -1.34 0.00 0.00 175.55 173.82 2jrs s VAL 31 N 1.74 2.60 -0.35 3.14 1.01 -0.19 -1.24 120.40 127.11 2jrs s VAL 31 Ca 0.06 -1.10 -0.01 0.00 0.00 0.00 0.00 61.98 60.93 2jrs s VAL 31 Cb -0.18 -2.31 0.08 0.00 0.00 0.00 0.00 36.38 33.98 2jrs s VAL 31 CO 0.11 0.23 0.09 -0.83 0.00 0.00 0.00 175.10 174.70 2jrs s GLY 32 N 1.28 1.88 0.00 4.51 0.00 0.75 -0.72 107.32 115.03 2jrs s GLY 32 Ca -0.00 -2.20 0.00 0.00 0.00 0.00 0.00 44.72 42.52 2jrs s GLY 32 CO -0.06 0.87 0.14 -1.26 0.00 0.00 0.00 173.10 172.79 2jrs n SER 33 N 4.56 -0.03 -4.40 1.64 2.88 -0.93 -1.68 113.62 115.66 2jrs n SER 33 Ca -0.06 -0.28 -0.45 0.00 -1.33 0.00 0.00 58.87 56.74 2jrs n SER 33 Cb 0.42 0.01 -0.03 0.00 -0.75 0.00 0.00 64.21 63.86 2jrs n SER 33 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 2jrs s LEU 34 N 0.00 5.61 -1.60 2.46 1.43 -0.17 -4.93 118.68 121.48 2jrs s LEU 34 Ca 0.00 -2.12 -0.11 0.00 -1.03 0.00 0.00 54.13 50.88 2jrs s LEU 34 Cb 0.00 -2.33 -0.07 0.00 0.03 0.00 0.00 46.19 43.83 2jrs s LEU 34 CO 0.00 -0.93 2.85 0.00 0.23 0.00 0.00 176.35 178.50 2jrs n HIS 35 N 5.76 2.59 -4.04 0.29 1.44 -1.26 -4.16 115.22 115.84 2jrs n HIS 35 Ca 0.15 -3.08 -0.32 0.00 -2.01 0.00 0.00 57.72 52.46 2jrs n HIS 35 Cb 0.47 -2.50 0.00 0.00 0.12 0.00 0.00 29.99 28.08 2jrs n HIS 35 CO 0.00 0.00 0.00 0.34 -2.81 0.00 0.00 176.34 173.87 2jrs n PHE 36 N 3.94 -2.02 0.02 -1.40 7.35 -1.26 -4.71 117.46 119.39 2jrs n PHE 36 Ca 0.75 0.85 0.00 0.00 -0.76 0.00 0.00 57.45 58.29 2jrs n PHE 36 Cb 0.25 -3.56 0.00 0.00 0.35 0.00 0.00 39.48 36.53 2jrs n PHE 36 CO 0.00 0.00 0.00 -1.71 -0.76 0.00 0.00 176.76 174.29 2jrs n ASN 37 N -2.78 -0.19 -4.73 -2.13 4.05 -1.26 -5.12 115.26 103.11 2jrs n ASN 37 Ca 0.02 0.06 -0.41 0.00 0.45 0.00 0.00 54.58 54.69 2jrs n ASN 37 Cb 0.53 0.41 -0.04 0.00 1.23 0.00 0.00 39.78 41.91 2jrs n ASN 37 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 177.26 173.58 2jrs s ILE 38 N -2.00 4.42 0.53 -1.44 1.01 -1.26 -5.06 121.20 117.40 2jrs s ILE 38 Ca 0.00 1.96 0.04 0.00 0.00 0.00 0.00 60.65 62.65 2jrs s ILE 38 Cb 0.00 -4.26 0.02 0.00 0.01 0.00 0.00 42.46 38.23 2jrs s ILE 38 CO 0.00 0.28 0.23 0.42 0.00 0.00 0.00 174.94 175.87 2jrs s THR 39 N 0.15 1.45 0.24 2.92 -4.23 -1.26 -4.91 115.64 110.00 2jrs s THR 39 Ca 0.49 -1.71 -0.05 0.00 -1.18 0.00 0.00 61.69 59.23 2jrs s THR 39 Cb -0.24 -2.16 0.22 0.00 1.34 0.00 0.00 72.50 71.65 2jrs s THR 39 CO 0.30 0.00 1.70 -0.33 -0.54 0.00 0.00 174.62 175.76 2jrs h GLU 40 N 1.02 0.32 -0.64 3.99 3.07 -1.97 -2.57 114.58 117.80 2jrs h GLU 40 Ca -0.40 -0.02 0.07 0.00 -0.50 0.00 0.00 59.36 58.51 2jrs h GLU 40 Cb 1.31 -0.07 -0.06 0.00 -0.84 0.00 0.00 28.75 29.09 2jrs h GLU 40 CO 0.65 0.21 0.32 -0.44 -1.40 0.00 0.00 179.01 178.35 2jrs h ASP 41 N 0.33 0.44 -0.01 1.42 5.19 -1.97 0.45 116.42 122.28 2jrs h ASP 41 Ca 0.40 0.04 -0.00 0.00 -0.62 0.00 0.00 57.03 56.86 2jrs h ASP 41 Cb 0.65 -0.04 -0.00 0.00 0.18 0.00 0.00 39.33 40.12 2jrs h ASP 41 CO -0.46 0.28 -0.00 -0.03 -3.12 0.00 0.00 179.24 175.91 2jrs h MET 42 N 0.59 0.01 -0.03 3.56 4.05 -1.87 -1.23 114.93 120.01 2jrs h MET 42 Ca 0.30 -0.00 0.03 0.00 -0.28 0.00 0.00 59.70 59.75 2jrs h MET 42 Cb 0.25 -0.00 -0.04 0.00 -0.80 0.00 0.00 31.60 31.01 2jrs h MET 42 CO -0.22 0.33 -0.23 -0.07 0.23 0.00 0.00 176.91 176.95 2jrs h LEU 43 N -0.31 -0.69 -0.83 3.39 3.38 -1.36 -1.74 115.31 117.15 2jrs h LEU 43 Ca 0.00 0.10 0.16 0.00 0.09 0.00 0.00 57.88 58.23 2jrs h LEU 43 Cb 0.33 0.29 -0.10 0.00 0.09 0.00 0.00 40.66 41.26 2jrs h LEU 43 CO 0.00 -0.29 0.38 -0.09 0.09 0.00 0.00 178.44 178.53 2jrs h ARG 44 N -0.35 0.50 0.00 1.13 2.43 -0.88 0.10 114.38 117.31 2jrs h ARG 44 Ca 0.07 -0.03 -0.03 0.00 -0.81 0.00 0.00 59.98 59.18 2jrs h ARG 44 Cb 0.44 -0.11 -0.00 0.00 -0.42 0.00 0.00 29.97 29.88 2jrs h ARG 44 CO -0.23 0.33 -0.12 0.78 -1.51 0.00 0.00 179.97 179.22 2jrs h GLY 45 N 0.51 0.00 1.08 2.80 0.00 -0.38 -0.02 103.07 107.06 2jrs h GLY 45 Ca 0.47 0.00 -0.33 0.00 0.00 0.00 0.00 47.33 47.47 2jrs h GLY 45 CO -0.41 0.00 -1.64 -2.22 0.00 0.00 0.00 176.54 172.27 2jrs h ILE 46 N 0.00 1.04 0.00 2.60 1.08 -0.18 -3.40 117.51 118.65 2jrs h ILE 46 Ca -0.00 -2.67 -0.21 0.00 -0.39 0.00 0.00 64.86 61.59 2jrs h ILE 46 Cb 0.24 2.74 -0.03 0.00 -3.07 0.00 0.00 36.82 36.70 2jrs h ILE 46 CO 0.02 0.82 -1.27 -0.26 -0.69 0.00 0.00 178.15 176.77 2jrs h PHE 47 N 0.08 0.00 -0.86 1.37 -1.00 -0.69 -3.36 116.94 112.48 2jrs h PHE 47 Ca -0.29 0.00 0.06 0.00 2.81 0.00 0.00 57.97 60.55 2jrs h PHE 47 Cb 2.05 0.00 -0.05 0.00 3.61 0.00 0.00 35.95 41.55 2jrs h PHE 47 CO 0.08 0.80 0.56 0.93 -1.61 0.00 0.00 178.31 179.07 2jrs h GLU 48 N 0.00 0.95 0.00 1.51 5.08 -1.19 0.22 114.58 121.15 2jrs h GLU 48 Ca -0.14 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.16 2jrs h GLU 48 Cb 1.74 -0.21 0.00 0.00 0.50 0.00 0.00 28.75 30.77 2jrs h GLU 48 CO 0.08 0.63 0.60 -1.35 -1.00 0.00 0.00 179.01 177.97 2jrs h PRO 49 N 0.98 0.00 0.02 2.33 0.11 -1.79 -1.79 132.00 131.86 2jrs h PRO 49 Ca 0.36 0.00 -0.36 0.00 0.11 0.00 0.00 66.00 66.12 2jrs h PRO 49 Cb 0.18 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 31.24 2jrs h PRO 49 CO -0.13 0.00 -2.00 1.19 -0.21 0.00 0.00 178.00 176.85 2jrs n PHE 50 N -2.71 0.58 0.00 0.65 3.01 0.03 -5.10 117.46 113.92 2jrs n PHE 50 Ca -0.01 0.20 0.00 0.00 1.01 0.00 0.00 57.45 58.65 2jrs n PHE 50 Cb 0.63 -1.06 0.00 0.00 -0.01 0.00 0.00 39.48 39.03 2jrs n PHE 50 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2jrs n GLY 51 N 1.60 3.06 3.13 1.37 0.00 -0.67 -4.84 105.19 108.84 2jrs n GLY 51 Ca -0.42 -0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.40 2jrs n GLY 51 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2jrs s ARG 52 N 4.35 1.00 -0.05 1.61 3.52 -1.26 -4.30 118.95 123.82 2jrs s ARG 52 Ca 0.00 -0.67 -0.13 0.00 -0.13 0.00 0.00 55.73 54.80 2jrs s ARG 52 Cb 0.00 -1.00 -0.05 0.00 -1.56 0.00 0.00 34.95 32.34 2jrs s ARG 52 CO 0.00 0.26 0.34 0.42 -0.81 0.00 0.00 175.30 175.51 2jrs s ILE 53 N -0.67 5.16 -0.22 4.11 1.09 -1.26 -3.98 121.20 125.43 2jrs s ILE 53 Ca 0.03 0.68 -0.10 0.00 -1.10 0.00 0.00 60.65 60.16 2jrs s ILE 53 Cb -0.07 -3.64 -0.18 0.00 -1.06 0.00 0.00 42.46 37.51 2jrs s ILE 53 CO 0.01 0.56 -0.03 -0.62 -0.10 0.00 0.00 174.94 174.76 2jrs n GLU 54 N 2.09 0.64 -3.71 2.79 -0.58 0.48 -4.99 120.64 117.35 2jrs n GLU 54 Ca -0.15 0.31 -0.14 0.00 -0.42 0.00 0.00 57.16 56.76 2jrs n GLU 54 Cb 0.53 -1.61 -0.08 0.00 -0.57 0.00 0.00 31.44 29.71 2jrs n GLU 54 CO 0.00 0.00 0.00 0.45 -0.48 0.00 0.00 177.13 177.10 2jrs s SER 55 N -7.01 -0.35 -0.25 1.62 0.15 -1.24 -4.98 113.70 101.64 2jrs s SER 55 Ca -0.32 0.43 -0.01 0.00 0.70 0.00 0.00 55.95 56.75 2jrs s SER 55 Cb 0.09 0.52 0.07 0.00 -1.71 0.00 0.00 66.02 65.00 2jrs s SER 55 CO 0.60 -0.39 0.03 -0.63 1.20 0.00 0.00 173.24 174.05 2jrs s ILE 56 N -0.84 1.01 -0.24 6.45 1.01 -1.26 -0.41 121.20 126.92 2jrs s ILE 56 Ca -0.09 -1.09 -0.06 0.00 0.00 0.00 0.00 60.65 59.42 2jrs s ILE 56 Cb -0.04 -1.52 -0.02 0.00 0.01 0.00 0.00 42.46 40.89 2jrs s ILE 56 CO 0.04 -0.33 0.02 -1.10 0.00 0.00 0.00 174.94 173.57 2jrs s GLN 57 N 1.60 3.52 -0.06 2.79 -1.52 -0.31 -4.87 119.66 120.82 2jrs s GLN 57 Ca 0.01 -0.55 -0.08 0.00 -1.95 0.00 0.00 55.36 52.79 2jrs s GLN 57 Cb -0.18 -3.17 -0.04 0.00 -0.22 0.00 0.00 33.01 29.39 2jrs s GLN 57 CO -0.13 -0.19 0.22 -0.51 -0.25 0.00 0.00 175.29 174.43 2jrs s LEU 58 N 1.55 4.40 -0.51 2.90 1.02 -1.26 -0.14 118.68 126.64 2jrs s LEU 58 Ca 0.06 0.57 -0.14 0.00 0.02 0.00 0.00 54.13 54.64 2jrs s LEU 58 Cb -0.15 -2.35 0.11 0.00 0.02 0.00 0.00 46.19 43.83 2jrs s LEU 58 CO 0.00 0.35 0.44 -0.04 0.02 0.00 0.00 176.35 177.12 2jrs s MET 59 N -1.28 2.89 -0.24 1.70 -1.94 0.43 -4.97 119.30 115.89 2jrs s MET 59 Ca 0.20 -1.63 0.02 0.00 -1.71 0.00 0.00 55.69 52.57 2jrs s MET 59 Cb -0.13 -4.18 0.04 0.00 2.01 0.00 0.00 34.83 32.58 2jrs s MET 59 CO 0.10 -1.22 -0.13 0.00 -0.01 0.00 0.00 175.02 173.75 2jrs s MET 60 N 1.56 2.53 0.00 2.03 0.23 -1.26 -3.00 119.30 121.39 2jrs s MET 60 Ca 0.04 -1.16 0.00 0.00 -1.03 0.00 0.00 55.69 53.54 2jrs s MET 60 Cb -0.28 -2.82 0.00 0.00 -1.53 0.00 0.00 34.83 30.20 2jrs s MET 60 CO 0.03 -0.45 0.00 -0.40 -2.03 0.00 0.00 175.02 172.17 2jrs n ASP 61 N 4.52 0.00 -3.80 -1.18 5.75 -0.53 -4.70 116.55 116.60 2jrs n ASP 61 Ca -0.16 0.00 -0.29 0.00 -0.01 0.00 0.00 54.79 54.32 2jrs n ASP 61 Cb 0.45 0.00 -0.03 0.00 -1.03 0.00 0.00 41.12 40.51 2jrs n ASP 61 CO 0.00 0.00 0.00 -0.24 -0.11 0.00 0.00 177.20 176.85 2jrs n SER 62 N 0.00 -2.95 0.02 -1.12 2.88 -1.26 -4.52 113.62 106.66 2jrs n SER 62 Ca 0.00 -0.68 0.00 0.00 -1.33 0.00 0.00 58.87 56.86 2jrs n SER 62 Cb 0.00 -2.47 0.00 0.00 -0.75 0.00 0.00 64.21 60.99 2jrs n SER 62 CO 0.00 0.00 0.00 1.21 -1.23 0.00 0.00 175.04 175.02 2jrs n GLU 63 N -3.89 0.00 0.00 -1.46 4.07 -1.26 -5.03 120.64 113.07 2jrs n GLU 63 Ca 0.05 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.15 2jrs n GLU 63 Cb 0.50 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.88 2jrs n GLU 63 CO 0.00 0.00 0.00 -2.37 -0.06 0.00 0.00 177.13 174.70 2jrs n THR 64 N -2.51 0.00 0.00 6.31 5.66 -1.26 -5.05 114.28 117.42 2jrs n THR 64 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 2jrs n THR 64 Cb 0.00 -0.55 0.00 0.00 -1.55 0.00 0.00 70.33 68.23 2jrs n THR 64 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2jrs n GLY 65 N 2.38 1.54 2.21 1.09 0.00 -1.26 -5.13 105.19 106.03 2jrs n GLY 65 Ca 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.82 2jrs n GLY 65 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jrs n ARG 66 N -1.04 1.24 -4.20 1.61 1.74 -1.26 -5.01 116.66 109.74 2jrs n ARG 66 Ca 0.00 -2.24 -0.34 0.00 -0.77 0.00 0.00 57.85 54.50 2jrs n ARG 66 Cb 0.00 0.58 -0.11 0.00 -1.02 0.00 0.00 32.46 31.91 2jrs n ARG 66 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 2jrs s SER 67 N -2.71 5.24 -0.14 0.55 1.04 -1.26 -1.45 113.70 114.96 2jrs s SER 67 Ca 0.01 -0.01 -0.10 0.00 0.48 0.00 0.00 55.95 56.34 2jrs s SER 67 Cb -0.00 -1.86 -0.04 0.00 0.10 0.00 0.00 66.02 64.22 2jrs s SER 67 CO 0.01 0.18 -0.13 0.11 0.98 0.00 0.00 173.24 174.39 2jrs h LYS 68 N 6.62 0.00 0.00 4.02 1.57 -1.90 -3.45 116.57 123.42 2jrs h LYS 68 Ca -0.35 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.43 2jrs h LYS 68 Cb 1.18 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.49 2jrs h LYS 68 CO 0.66 0.08 0.00 0.41 -0.57 0.00 0.00 179.45 180.03 2jrs n GLY 69 N 1.62 1.44 3.09 3.86 0.00 -1.16 -4.98 105.19 109.05 2jrs n GLY 69 Ca -0.08 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.84 2jrs n GLY 69 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2jrs s TYR 70 N -2.00 0.15 0.09 1.61 -0.85 -1.26 -1.00 117.35 114.09 2jrs s TYR 70 Ca 0.00 -0.36 0.02 0.00 -0.52 0.00 0.00 57.07 56.21 2jrs s TYR 70 Cb 0.00 -0.11 -0.04 0.00 0.38 0.00 0.00 41.96 42.19 2jrs s TYR 70 CO 0.00 -0.30 -0.07 0.20 -1.52 0.00 0.00 175.55 173.86 2jrs s GLY 71 N -1.72 0.72 -0.19 5.49 0.00 0.10 -0.43 107.32 111.29 2jrs s GLY 71 Ca -0.11 -1.24 -0.04 0.00 0.00 0.00 0.00 44.72 43.33 2jrs s GLY 71 CO -0.01 -1.34 -0.03 -1.36 0.00 0.00 0.00 173.10 170.36 2jrs s PHE 72 N -3.20 2.99 -0.09 1.90 0.08 0.80 -1.02 117.98 119.44 2jrs s PHE 72 Ca 0.08 -0.56 0.01 0.00 0.12 0.00 0.00 56.93 56.58 2jrs s PHE 72 Cb 0.02 -2.04 -0.02 0.00 -0.57 0.00 0.00 43.02 40.41 2jrs s PHE 72 CO -0.04 -0.27 -0.12 0.42 -0.10 0.00 0.00 175.22 175.11 2jrs s ILE 73 N 0.93 3.17 -0.17 0.64 1.01 -0.27 -1.16 121.20 125.35 2jrs s ILE 73 Ca 0.00 -0.65 -0.09 0.00 0.00 0.00 0.00 60.65 59.91 2jrs s ILE 73 Cb -0.15 -2.30 -0.05 0.00 0.01 0.00 0.00 42.46 39.98 2jrs s ILE 73 CO 0.01 0.56 0.13 -0.89 0.00 0.00 0.00 174.94 174.75 2jrs s THR 74 N -0.22 5.45 0.03 2.92 2.01 0.45 -0.27 115.64 126.02 2jrs s THR 74 Ca 0.01 0.20 0.07 0.00 0.31 0.00 0.00 61.69 62.28 2jrs s THR 74 Cb -0.13 -3.44 -0.02 0.00 0.01 0.00 0.00 72.50 68.91 2jrs s THR 74 CO 0.03 0.51 -0.20 -0.36 -0.69 0.00 0.00 174.62 173.91 2jrs s PHE 75 N -0.19 1.75 -1.47 4.92 0.40 0.66 -0.39 117.98 123.66 2jrs s PHE 75 Ca 0.11 -0.36 0.30 0.00 -0.60 0.00 0.00 56.93 56.37 2jrs s PHE 75 Cb -0.11 -1.06 1.42 0.00 0.51 0.00 0.00 43.02 43.77 2jrs s PHE 75 CO 0.00 0.06 1.99 0.43 0.70 0.00 0.00 175.22 178.40 2jrs n SER 76 N 2.02 0.14 -4.00 1.36 7.64 -1.26 -0.11 113.62 119.41 2jrs n SER 76 Ca -0.17 -0.25 -0.30 0.00 1.01 0.00 0.00 58.87 59.16 2jrs n SER 76 Cb 0.53 -0.22 -0.16 0.00 -1.01 0.00 0.00 64.21 63.35 2jrs n SER 76 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2jrs s ASP 77 N -2.56 3.25 0.48 6.43 -1.08 -1.26 -4.68 116.67 117.25 2jrs s ASP 77 Ca 0.28 -0.80 0.27 0.00 -0.52 0.00 0.00 52.55 51.78 2jrs s ASP 77 Cb 0.20 -1.23 1.03 0.00 -1.46 0.00 0.00 42.92 41.46 2jrs s ASP 77 CO 0.47 -0.12 1.86 0.28 0.52 0.00 0.00 175.17 178.18 2jrs h SER 78 N 7.99 0.00 0.26 -0.34 0.02 -1.84 -2.26 113.55 117.38 2jrs h SER 78 Ca -0.30 0.00 -0.34 0.00 -0.84 0.00 0.00 61.79 60.31 2jrs h SER 78 Cb 1.11 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 63.62 2jrs h SER 78 CO 0.49 0.13 -1.87 -0.33 -1.14 0.00 0.00 176.83 174.11 2jrs h GLU 79 N 0.00 0.19 -0.62 3.45 3.07 -1.97 -2.14 114.58 116.55 2jrs h GLU 79 Ca -0.00 -0.32 -0.10 0.00 -0.50 0.00 0.00 59.36 58.44 2jrs h GLU 79 Cb 0.69 0.12 -0.02 0.00 -0.84 0.00 0.00 28.75 28.70 2jrs h GLU 79 CO 0.02 0.99 0.01 0.00 -1.40 0.00 0.00 179.01 178.63 2jrs h ALA 81 N 1.00 0.66 -0.63 0.00 0.00 -1.54 -1.13 119.26 117.60 2jrs h ALA 81 Ca 0.18 -0.38 -0.02 0.00 0.00 0.00 0.00 54.91 54.68 2jrs h ALA 81 Cb 0.56 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.16 2jrs h ALA 81 CO 0.03 0.63 0.31 -0.22 0.00 0.00 0.00 179.25 180.00 2jrs h LYS 82 N 0.81 0.91 0.08 0.00 3.64 -1.18 -0.50 116.57 120.33 2jrs h LYS 82 Ca 0.11 -0.13 -0.00 0.00 -1.27 0.00 0.00 60.65 59.36 2jrs h LYS 82 Cb 0.77 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 32.43 2jrs h LYS 82 CO 0.06 0.72 -0.04 -0.22 -2.27 0.00 0.00 179.45 177.70 2jrs h LYS 83 N 0.87 -0.11 -0.95 1.90 3.64 -0.74 -1.69 116.57 119.49 2jrs h LYS 83 Ca 0.22 0.01 0.20 0.00 -1.27 0.00 0.00 60.65 59.81 2jrs h LYS 83 Cb 0.10 0.02 -0.11 0.00 -0.41 0.00 0.00 32.23 31.84 2jrs h LYS 83 CO -0.03 -0.01 0.53 0.00 -2.27 0.00 0.00 179.45 177.68 2jrs h ALA 84 N 0.73 1.58 -0.15 5.00 0.00 -0.91 0.29 119.26 125.79 2jrs h ALA 84 Ca -0.01 0.11 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 2jrs h ALA 84 Cb 0.15 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 2jrs h ALA 84 CO 0.02 -0.17 0.09 1.25 0.00 0.00 0.00 179.25 180.44 2jrs h LEU 85 N 0.62 0.19 -0.94 0.00 6.46 -0.84 0.85 115.31 121.65 2jrs h LEU 85 Ca 0.57 -0.08 -0.10 0.00 -0.12 0.00 0.00 57.88 58.16 2jrs h LEU 85 Cb 0.96 -0.05 -0.01 0.00 -0.73 0.00 0.00 40.66 40.83 2jrs h LEU 85 CO -0.43 0.21 -0.29 -0.08 -0.62 0.00 0.00 178.44 177.24 2jrs h GLU 86 N 0.15 0.43 0.03 1.25 4.81 0.08 -2.55 114.58 118.80 2jrs h GLU 86 Ca 0.05 -0.17 -0.32 0.00 -0.13 0.00 0.00 59.36 58.80 2jrs h GLU 86 Cb 0.06 -0.02 -0.04 0.00 0.63 0.00 0.00 28.75 29.38 2jrs h GLU 86 CO -0.01 0.68 -1.83 1.04 -0.73 0.00 0.00 179.01 178.16 2jrs n GLN 87 N -4.10 0.67 -0.00 1.92 1.13 0.77 -4.39 117.38 113.37 2jrs n GLN 87 Ca -0.01 0.27 0.10 0.00 -1.94 0.00 0.00 57.00 55.43 2jrs n GLN 87 Cb 0.42 -1.76 -0.11 0.00 0.11 0.00 0.00 30.24 28.91 2jrs n GLN 87 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 2jrs n LEU 88 N -3.15 0.86 -4.56 1.08 4.77 0.28 -4.71 117.00 111.58 2jrs n LEU 88 Ca -0.22 -0.41 -0.29 0.00 -0.03 0.00 0.00 56.01 55.05 2jrs n LEU 88 Cb 1.05 -0.01 -0.04 0.00 -2.33 0.00 0.00 43.42 42.09 2jrs n LEU 88 CO 0.44 0.21 1.53 0.21 -1.33 0.00 0.00 177.39 178.45 2jrs s ASN 89 N -3.20 4.78 0.00 -1.43 3.84 -0.96 -0.57 114.94 117.40 2jrs s ASN 89 Ca 0.06 0.11 0.00 0.00 0.21 0.00 0.00 52.86 53.24 2jrs s ASN 89 Cb 0.16 -2.54 0.00 0.00 -0.55 0.00 0.00 41.25 38.32 2jrs s ASN 89 CO 0.87 -2.90 0.00 0.61 -2.79 0.00 0.00 177.10 172.88 2jrs n GLY 90 N 6.34 1.50 3.78 1.21 0.00 0.76 -4.93 105.19 113.84 2jrs n GLY 90 Ca 0.35 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.99 2jrs n GLY 90 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2jrs s PHE 91 N -2.00 3.79 -1.10 1.61 5.36 0.26 -4.59 117.98 121.30 2jrs s PHE 91 Ca 0.00 1.77 -0.22 0.00 -0.96 0.00 0.00 56.93 57.52 2jrs s PHE 91 Cb 0.00 -2.89 -0.00 0.00 -0.34 0.00 0.00 43.02 39.78 2jrs s PHE 91 CO 0.00 0.32 1.76 -1.21 -1.46 0.00 0.00 175.22 174.63 2jrs s GLU 92 N -1.73 3.18 -0.23 10.12 0.41 -1.26 -0.40 118.70 128.79 2jrs s GLU 92 Ca 0.46 -1.16 -0.09 0.00 -0.41 0.00 0.00 54.97 53.77 2jrs s GLU 92 Cb -0.21 -5.31 -0.04 0.00 -1.78 0.00 0.00 34.13 26.79 2jrs s GLU 92 CO 0.26 -2.94 0.10 -1.17 -0.49 0.00 0.00 175.26 171.03 2jrs s LEU 93 N 7.48 3.81 -1.37 1.80 2.96 0.15 -4.42 118.68 129.09 2jrs s LEU 93 Ca 0.59 -0.00 0.00 0.00 -0.22 0.00 0.00 54.13 54.50 2jrs s LEU 93 Cb -0.01 -2.01 0.00 0.00 0.50 0.00 0.00 46.19 44.68 2jrs s LEU 93 CO 0.02 0.06 0.00 0.00 -1.32 0.00 0.00 176.35 175.12 2jrs n ALA 94 N 4.28 -0.20 -0.36 5.97 0.00 -1.26 -0.67 120.51 128.27 2jrs n ALA 94 Ca -0.16 0.21 0.00 0.00 0.00 0.00 0.00 53.44 53.49 2jrs n ALA 94 Cb 0.52 -1.84 0.00 0.00 0.00 0.00 0.00 19.45 18.13 2jrs n ALA 94 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2jrs n GLY 95 N 0.14 0.82 3.16 0.00 0.00 -1.26 -5.08 105.19 102.96 2jrs n GLY 95 Ca -0.13 -0.04 -0.14 0.00 0.00 0.00 0.00 46.02 45.71 2jrs n GLY 95 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2jrs s ARG 96 N -0.65 0.80 0.15 1.61 0.52 0.15 -5.08 118.95 116.45 2jrs s ARG 96 Ca 0.00 -1.12 -0.31 0.00 -0.52 0.00 0.00 55.73 53.78 2jrs s ARG 96 Cb 0.00 -0.47 -0.09 0.00 0.52 0.00 0.00 34.95 34.91 2jrs s ARG 96 CO 0.00 0.07 1.48 -2.14 0.02 0.00 0.00 175.30 174.73 2jrs s PRO 97 N -2.71 4.27 -0.22 3.54 0.02 -1.26 0.32 135.00 138.96 2jrs s PRO 97 Ca 0.04 2.23 -0.13 0.00 0.02 0.00 0.00 61.00 63.16 2jrs s PRO 97 Cb -0.03 -3.19 -0.05 0.00 0.02 0.00 0.00 34.50 31.25 2jrs s PRO 97 CO -0.00 -0.52 0.25 1.41 -0.33 0.00 0.00 177.00 177.81 2jrs s MET 98 N 1.03 4.12 -0.48 5.54 1.75 0.47 -4.82 119.30 126.91 2jrs s MET 98 Ca 0.67 -0.08 -0.23 0.00 -1.25 0.00 0.00 55.69 54.80 2jrs s MET 98 Cb -0.40 -3.53 0.03 0.00 2.84 0.00 0.00 34.83 33.77 2jrs s MET 98 CO 0.31 0.05 0.79 0.15 -0.65 0.00 0.00 175.02 175.67 2jrs s LYS 99 N 1.07 3.33 -0.18 4.11 -0.14 -0.68 -0.17 119.74 127.08 2jrs s LYS 99 Ca 0.12 -0.28 -0.01 0.00 -1.36 0.00 0.00 55.97 54.44 2jrs s LYS 99 Cb -0.14 -3.99 0.00 0.00 -1.68 0.00 0.00 37.83 32.03 2jrs s LYS 99 CO 0.05 -1.21 -0.14 0.08 -0.76 0.00 0.00 175.35 173.38 2jrs s VAL 100 N 3.31 2.69 -0.03 3.17 1.01 -1.26 -0.17 120.40 129.11 2jrs s VAL 100 Ca 0.27 -0.74 -0.09 0.00 0.00 0.00 0.00 61.98 61.42 2jrs s VAL 100 Cb -0.13 -2.16 0.01 0.00 0.00 0.00 0.00 36.38 34.10 2jrs s VAL 100 CO 0.20 0.50 0.20 -0.83 0.00 0.00 0.00 175.10 175.16 2jrs s GLY 101 N 1.14 -0.06 0.31 4.51 0.00 -0.37 -4.69 107.32 108.16 2jrs s GLY 101 Ca 0.01 0.19 -0.28 0.00 0.00 0.00 0.00 44.72 44.65 2jrs s GLY 101 CO -0.05 0.06 1.04 -2.38 0.00 0.00 0.00 173.10 171.77 2jrs s HIS 102 N -0.90 3.59 0.08 1.90 -3.43 -1.26 0.27 115.29 115.53 2jrs s HIS 102 Ca -0.10 1.74 -0.31 0.00 -0.80 0.00 0.00 55.06 55.59 2jrs s HIS 102 Cb -0.05 -3.14 -0.10 0.00 -1.43 0.00 0.00 32.58 27.85 2jrs s HIS 102 CO 0.02 -0.29 1.90 1.33 -2.00 0.00 0.00 174.74 175.69 2jrs n VAL 103 N 0.84 0.54 -2.73 -5.38 0.24 -0.72 -4.79 118.33 106.33 2jrs n VAL 103 Ca 0.01 -0.10 -0.09 0.00 -2.04 0.00 0.00 64.34 62.12 2jrs n VAL 103 Cb 0.47 -2.19 0.09 0.00 -1.47 0.00 0.00 33.84 30.74 2jrs n VAL 103 CO 0.00 0.00 0.00 1.07 -2.14 0.00 0.00 176.83 175.76 2jrs n THR 104 N 5.06 0.00 -2.03 3.34 5.66 -1.26 -4.98 114.28 120.07 2jrs n THR 104 Ca 0.19 -1.45 -0.41 0.00 -3.05 0.00 0.00 64.05 59.33 2jrs n THR 104 Cb 0.38 1.47 -0.01 0.00 -1.55 0.00 0.00 70.33 70.63 2jrs n THR 104 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 2jrs n GLU 105 N 0.52 2.72 -4.18 1.09 1.02 -1.26 -4.87 120.64 115.68 2jrs n GLU 105 Ca 0.06 -2.77 -0.14 0.00 -0.02 0.00 0.00 57.16 54.29 2jrs n GLU 105 Cb 0.70 -3.37 -0.08 0.00 -0.02 0.00 0.00 31.44 28.66 2jrs n GLU 105 CO 0.00 0.00 0.00 -0.98 1.18 0.00 0.00 177.13 177.33 2jrs s ARG 106 N 4.10 1.49 -0.00 3.49 1.70 -1.26 -5.17 118.95 123.30 2jrs s ARG 106 Ca 0.53 -1.71 -0.02 0.00 -0.47 0.00 0.00 55.73 54.06 2jrs s ARG 106 Cb 0.09 0.33 -0.04 0.00 -0.57 0.00 0.00 34.95 34.76 2jrs s ARG 106 CO 0.02 -0.55 0.16 0.99 -1.08 0.00 0.00 175.30 174.85 2jrs s THR 107 N -3.80 5.28 -2.00 4.99 2.01 -1.26 -5.31 115.64 115.55 2jrs s THR 107 Ca 0.36 -0.24 0.01 0.00 0.31 0.00 0.00 61.69 62.14 2jrs s THR 107 Cb 0.04 -3.47 0.02 0.00 0.01 0.00 0.00 72.50 69.10 2jrs s THR 107 CO 0.17 0.31 0.54 -0.67 -0.69 0.00 0.00 174.62 174.28