#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 1.30 3.78 3.03 0.00 -1.26 -4.78 105.19 107.26 2jrs n GLY 2 Ca 0.00 0.02 -0.39 0.00 0.00 0.00 0.00 46.02 45.64 2jrs n GLY 2 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2jrs s HIS 3 N 0.00 3.89 -0.12 1.61 3.76 -1.26 -4.68 115.29 118.48 2jrs s HIS 3 Ca 0.00 1.57 -0.05 0.00 -0.15 0.00 0.00 55.06 56.43 2jrs s HIS 3 Cb 0.00 -2.73 0.02 0.00 1.11 0.00 0.00 32.58 30.98 2jrs s HIS 3 CO 0.00 0.52 0.11 0.72 -0.85 0.00 0.00 174.74 175.23 2jrs n HIS 4 N 1.67 -2.45 0.19 1.40 -0.00 -1.26 -4.96 115.22 109.80 2jrs n HIS 4 Ca -0.06 1.35 0.12 0.00 -0.00 0.00 0.00 57.72 59.12 2jrs n HIS 4 Cb 0.49 -2.87 0.11 0.00 -0.00 0.00 0.00 29.99 27.72 2jrs n HIS 4 CO 0.00 0.00 0.00 1.25 -0.00 0.00 0.00 176.34 177.59 2jrs h HIS 5 N 2.13 0.00 -3.32 4.41 -0.00 -1.98 -3.40 115.15 113.00 2jrs h HIS 5 Ca -0.24 0.00 -0.73 0.00 -0.00 0.00 0.00 60.37 59.40 2jrs h HIS 5 Cb 0.55 0.00 -0.26 0.00 -0.00 0.00 0.00 27.41 27.70 2jrs h HIS 5 CO 0.00 0.00 -0.37 -1.01 -0.00 0.00 0.00 177.93 176.55 2jrs s HIS 6 N -3.27 3.30 -1.06 5.26 0.09 -1.26 -4.93 115.29 113.42 2jrs s HIS 6 Ca 0.04 -1.32 0.28 0.00 -0.00 0.00 0.00 55.06 54.05 2jrs s HIS 6 Cb 0.07 -3.25 1.02 0.00 -0.00 0.00 0.00 32.58 30.42 2jrs s HIS 6 CO 0.72 -0.88 1.77 1.58 -0.00 0.00 0.00 174.74 177.93 2jrs n HIS 7 N 5.07 0.00 -4.06 1.40 -0.00 -1.26 -4.59 115.22 111.78 2jrs n HIS 7 Ca -0.11 0.00 -0.33 0.00 -0.00 0.00 0.00 57.72 57.28 2jrs n HIS 7 Cb 0.42 -0.39 -0.15 0.00 -0.00 0.00 0.00 29.99 29.87 2jrs n HIS 7 CO 0.00 0.00 0.00 -1.01 -0.00 0.00 0.00 176.34 175.33 2jrs s HIS 8 N -2.95 3.16 0.61 1.57 4.02 -1.26 -5.13 115.29 115.31 2jrs s HIS 8 Ca 0.15 -2.11 0.03 0.00 1.02 0.00 0.00 55.06 54.14 2jrs s HIS 8 Cb 0.19 -1.95 0.12 0.00 -1.02 0.00 0.00 32.58 29.91 2jrs s HIS 8 CO 0.58 -0.85 0.84 0.45 1.02 0.00 0.00 174.74 176.77 2jrs n SER 9 N 4.50 1.42 -1.64 1.40 2.88 -1.26 -4.45 113.62 116.47 2jrs n SER 9 Ca -0.15 -2.13 -0.13 0.00 -1.33 0.00 0.00 58.87 55.13 2jrs n SER 9 Cb 0.44 -0.51 0.01 0.00 -0.75 0.00 0.00 64.21 63.39 2jrs n SER 9 CO 0.00 0.00 0.00 1.57 -1.23 0.00 0.00 175.04 175.38 2jrs n HIS 10 N -2.52 -0.88 -2.70 0.66 -0.00 -1.26 -4.25 115.22 104.28 2jrs n HIS 10 Ca 0.15 0.16 -0.02 0.00 -0.00 0.00 0.00 57.72 58.00 2jrs n HIS 10 Cb 0.53 -2.91 -0.02 0.00 -0.00 0.00 0.00 29.99 27.58 2jrs n HIS 10 CO 0.00 0.00 0.00 -0.12 -0.00 0.00 0.00 176.34 176.22 2jrs n MET 11 N -2.43 -3.82 0.00 1.57 0.00 -1.26 -5.04 117.12 106.13 2jrs n MET 11 Ca -0.11 2.98 0.00 0.00 -0.00 0.00 0.00 57.70 60.58 2jrs n MET 11 Cb 0.59 -5.02 0.00 0.00 0.00 0.00 0.00 33.22 28.79 2jrs n MET 11 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2jrs n ALA 12 N 1.19 0.00 -0.79 -5.12 0.00 -1.26 -4.78 120.51 109.75 2jrs n ALA 12 Ca -0.18 -0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.26 2jrs n ALA 12 Cb 0.29 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.74 2jrs n ALA 12 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jrs n ALA 13 N -0.92 0.00 -0.01 0.00 0.00 -1.26 -0.70 120.51 117.63 2jrs n ALA 13 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.45 2jrs n ALA 13 Cb 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.33 2jrs n ALA 13 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jrs n ALA 14 N 2.90 2.09 1.31 0.00 0.00 -1.26 -4.14 120.51 121.40 2jrs n ALA 14 Ca 0.00 -0.72 0.05 0.00 0.00 0.00 0.00 53.44 52.78 2jrs n ALA 14 Cb 0.00 -0.72 0.19 0.00 0.00 0.00 0.00 19.45 18.92 2jrs n ALA 14 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 2jrs n MET 15 N -2.68 1.53 -2.62 0.00 0.00 0.13 -4.58 117.12 108.90 2jrs n MET 15 Ca -0.13 -0.82 -0.42 0.00 0.00 0.00 0.00 57.70 56.32 2jrs n MET 15 Cb 0.83 -1.23 -0.02 0.00 0.00 0.00 0.00 33.22 32.80 2jrs n MET 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2jrs s ALA 16 N -1.73 2.96 -0.27 3.04 0.00 -1.26 -4.32 121.76 120.18 2jrs s ALA 16 Ca 0.20 -2.50 -0.04 0.00 0.00 0.00 0.00 51.96 49.62 2jrs s ALA 16 Cb 0.10 -4.48 0.01 0.00 0.00 0.00 0.00 23.12 18.75 2jrs s ALA 16 CO 0.15 -3.45 0.16 0.09 0.00 0.00 0.00 175.76 172.71 2jrs n ASN 17 N 8.39 -6.71 -4.69 0.00 3.02 -1.26 -4.96 115.26 109.05 2jrs n ASN 17 Ca 0.35 0.89 -0.42 0.00 -0.03 0.00 0.00 54.58 55.37 2jrs n ASN 17 Cb 0.49 -4.42 -0.03 0.00 -0.61 0.00 0.00 39.78 35.22 2jrs n ASN 17 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2jrs s ASN 18 N -1.62 7.19 -0.16 6.41 4.22 -1.26 -4.94 114.94 124.78 2jrs s ASN 18 Ca 0.07 1.69 -0.14 0.00 -2.14 0.00 0.00 52.86 52.34 2jrs s ASN 18 Cb -0.02 -2.56 -0.23 0.00 1.28 0.00 0.00 41.25 39.72 2jrs s ASN 18 CO 0.61 -0.46 0.30 -0.11 -2.04 0.00 0.00 177.10 175.41 2jrs n LEU 19 N 4.74 2.28 -4.50 3.54 7.94 -1.26 -4.68 117.00 125.06 2jrs n LEU 19 Ca 0.09 0.31 -0.42 0.00 -1.11 0.00 0.00 56.01 54.88 2jrs n LEU 19 Cb 0.48 -1.05 -0.03 0.00 0.53 0.00 0.00 43.42 43.35 2jrs n LEU 19 CO 0.53 0.59 1.20 -1.58 -1.11 0.00 0.00 177.39 177.02 2jrs s GLN 20 N -2.47 3.56 -0.27 1.96 -0.44 -1.26 -4.91 119.66 115.83 2jrs s GLN 20 Ca -0.25 -1.39 -0.34 0.00 -2.50 0.00 0.00 55.36 50.88 2jrs s GLN 20 Cb 0.06 -5.06 0.17 0.00 -1.64 0.00 0.00 33.01 26.55 2jrs s GLN 20 CO 0.69 -1.98 1.34 0.21 0.50 0.00 0.00 175.29 176.05 2jrs s LYS 21 N 3.86 0.09 -1.08 1.67 2.20 -1.26 -5.08 119.74 120.14 2jrs s LYS 21 Ca 0.38 -0.01 -0.25 0.00 -0.36 0.00 0.00 55.97 55.73 2jrs s LYS 21 Cb -0.03 0.04 -0.15 0.00 -1.51 0.00 0.00 37.83 36.18 2jrs s LYS 21 CO -0.08 -0.04 2.06 0.20 -0.36 0.00 0.00 175.35 177.14 2jrs s GLY 22 N -1.58 -0.53 -0.28 5.54 0.00 -1.26 -4.91 107.32 104.30 2jrs s GLY 22 Ca 0.10 -1.67 -0.14 0.00 0.00 0.00 0.00 44.72 43.01 2jrs s GLY 22 CO -0.05 3.96 0.33 -0.45 0.00 0.00 0.00 173.10 176.89 2jrs s SER 23 N 7.95 6.19 0.14 1.64 0.15 -1.26 -5.07 113.70 123.44 2jrs s SER 23 Ca 0.77 0.18 -0.26 0.00 0.70 0.00 0.00 55.95 57.33 2jrs s SER 23 Cb -0.04 -2.19 -0.07 0.00 -1.71 0.00 0.00 66.02 62.01 2jrs s SER 23 CO 0.14 -0.16 0.80 0.00 1.20 0.00 0.00 173.24 175.22 2jrs s ALA 24 N 1.99 3.40 0.00 5.45 0.00 -1.26 -4.46 121.76 126.88 2jrs s ALA 24 Ca 0.13 0.38 0.00 0.00 0.00 0.00 0.00 51.96 52.47 2jrs s ALA 24 Cb -0.16 -3.02 0.00 0.00 0.00 0.00 0.00 23.12 19.95 2jrs s ALA 24 CO 0.10 0.21 0.00 0.41 0.00 0.00 0.00 175.76 176.48 2jrs n GLY 25 N 1.82 2.22 3.74 0.00 0.00 -1.26 -5.08 105.19 106.64 2jrs n GLY 25 Ca -0.04 -0.66 -0.41 0.00 0.00 0.00 0.00 46.02 44.91 2jrs n GLY 25 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2jrs s PRO 26 N 0.00 4.39 -0.11 1.61 0.02 -1.26 -2.00 135.00 137.65 2jrs s PRO 26 Ca 0.00 2.06 0.00 0.00 0.02 0.00 0.00 61.00 63.08 2jrs s PRO 26 Cb 0.00 -3.19 -0.02 0.00 0.02 0.00 0.00 34.50 31.31 2jrs s PRO 26 CO 0.00 -0.25 -0.12 1.41 -0.33 0.00 0.00 177.00 177.72 2jrs s MET 27 N -0.20 3.17 -0.33 5.54 1.75 -0.99 -4.88 119.30 123.37 2jrs s MET 27 Ca 0.56 -0.65 -0.13 0.00 -1.25 0.00 0.00 55.69 54.22 2jrs s MET 27 Cb -0.37 -2.61 -0.02 0.00 2.84 0.00 0.00 34.83 34.67 2jrs s MET 27 CO 0.39 0.35 0.24 0.50 -0.65 0.00 0.00 175.02 175.85 2jrs s ARG 28 N -0.00 3.59 -0.06 4.11 3.52 -1.26 -1.23 118.95 127.62 2jrs s ARG 28 Ca -0.03 -0.56 -0.05 0.00 -0.13 0.00 0.00 55.73 54.95 2jrs s ARG 28 Cb -0.14 -3.78 -0.04 0.00 -1.56 0.00 0.00 34.95 29.43 2jrs s ARG 28 CO 0.04 -0.40 0.18 -0.51 -0.81 0.00 0.00 175.30 173.80 2jrs s LEU 29 N 1.75 4.38 -0.27 -0.88 1.43 0.52 -4.09 118.68 121.52 2jrs s LEU 29 Ca 0.07 0.44 -0.13 0.00 -1.03 0.00 0.00 54.13 53.48 2jrs s LEU 29 Cb -0.17 -2.38 -0.04 0.00 0.03 0.00 0.00 46.19 43.63 2jrs s LEU 29 CO 0.11 0.33 0.29 -0.47 0.23 0.00 0.00 176.35 176.83 2jrs s TYR 30 N -1.18 3.24 -0.27 0.29 5.04 0.92 -0.97 117.35 124.41 2jrs s TYR 30 Ca 0.22 0.28 -0.01 0.00 -2.44 0.00 0.00 57.07 55.11 2jrs s TYR 30 Cb -0.12 -2.48 0.04 0.00 0.35 0.00 0.00 41.96 39.74 2jrs s TYR 30 CO 0.12 -0.19 -0.04 0.08 -1.34 0.00 0.00 175.55 174.18 2jrs s VAL 31 N 1.91 2.90 -0.35 3.14 1.01 -0.28 -1.14 120.40 127.59 2jrs s VAL 31 Ca 0.11 -1.22 -0.00 0.00 0.00 0.00 0.00 61.98 60.87 2jrs s VAL 31 Cb -0.16 -2.57 0.13 0.00 0.00 0.00 0.00 36.38 33.77 2jrs s VAL 31 CO 0.10 0.05 0.18 -0.83 0.00 0.00 0.00 175.10 174.60 2jrs s GLY 32 N 1.28 0.99 0.00 4.51 0.00 -0.39 -0.56 107.32 113.15 2jrs s GLY 32 Ca -0.03 -1.84 0.00 0.00 0.00 0.00 0.00 44.72 42.85 2jrs s GLY 32 CO -0.03 1.90 0.10 -1.14 0.00 0.00 0.00 173.10 173.93 2jrs n SER 33 N 4.29 0.00 -4.85 1.64 3.41 -0.95 -4.09 113.62 113.07 2jrs n SER 33 Ca 0.06 -0.20 -0.32 0.00 -0.26 0.00 0.00 58.87 58.15 2jrs n SER 33 Cb 0.38 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 64.27 2jrs n SER 33 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2jrs s LEU 34 N 0.00 4.02 -0.65 1.04 1.43 -0.32 -4.94 118.68 119.26 2jrs s LEU 34 Ca 0.00 1.34 0.05 0.00 -1.03 0.00 0.00 54.13 54.49 2jrs s LEU 34 Cb 0.00 -4.15 0.20 0.00 0.03 0.00 0.00 46.19 42.26 2jrs s LEU 34 CO 0.00 -0.25 0.56 0.00 0.23 0.00 0.00 176.35 176.90 2jrs n HIS 35 N -0.48 2.89 -4.37 0.29 1.44 -1.26 -4.41 115.22 109.32 2jrs n HIS 35 Ca 0.04 -4.16 -0.38 0.00 -2.01 0.00 0.00 57.72 51.21 2jrs n HIS 35 Cb 0.53 -0.52 -0.06 0.00 0.12 0.00 0.00 29.99 30.06 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 1.67 -1.41 0.03 -1.40 7.35 -1.26 -4.54 117.46 117.89 2jrs n PHE 36 Ca 0.24 0.72 0.00 0.00 -0.76 0.00 0.00 57.45 57.65 2jrs n PHE 36 Cb 0.39 -2.48 0.00 0.00 0.35 0.00 0.00 39.48 37.74 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 -2.61 -0.39 -4.71 -2.13 4.05 -1.26 -5.11 115.26 103.10 2jrs n ASN 37 Ca 0.02 0.11 -0.42 0.00 0.45 0.00 0.00 54.58 54.74 2jrs n ASN 37 Cb 0.51 0.66 -0.03 0.00 1.23 0.00 0.00 39.78 42.15 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 2.55 0.45 -1.44 1.09 -1.26 -5.00 121.20 115.58 2jrs s ILE 38 Ca 0.00 0.27 0.07 0.00 -1.10 0.00 0.00 60.65 59.89 2jrs s ILE 38 Cb 0.00 -3.17 -0.00 0.00 -1.06 0.00 0.00 42.46 38.23 2jrs s ILE 38 CO 0.00 0.01 0.42 0.42 -0.10 0.00 0.00 174.94 175.69 2jrs s THR 39 N 1.82 2.48 0.32 2.92 -4.23 -1.26 -4.94 115.64 112.76 2jrs s THR 39 Ca 0.74 -1.33 0.06 0.00 -1.18 0.00 0.00 61.69 59.99 2jrs s THR 39 Cb -0.45 -2.81 0.08 0.00 1.34 0.00 0.00 72.50 70.67 2jrs s THR 39 CO 0.33 0.00 1.77 -0.33 -0.54 0.00 0.00 174.62 175.85 2jrs h GLU 40 N 0.91 0.30 -0.69 3.99 5.08 -1.97 -2.11 114.58 120.09 2jrs h GLU 40 Ca -0.40 -0.11 -0.06 0.00 -1.00 0.00 0.00 59.36 57.79 2jrs h GLU 40 Cb 1.27 -0.02 -0.03 0.00 0.50 0.00 0.00 28.75 30.47 2jrs h GLU 40 CO 0.56 0.56 0.19 -0.44 -1.00 0.00 0.00 179.01 178.88 2jrs h ASP 41 N 0.27 1.01 0.21 1.42 3.32 -1.99 -0.28 116.42 120.38 2jrs h ASP 41 Ca 0.04 -0.20 -0.01 0.00 0.02 0.00 0.00 57.03 56.88 2jrs h ASP 41 Cb 0.64 -0.26 0.00 0.00 0.22 0.00 0.00 39.33 39.93 2jrs h ASP 41 CO 0.05 0.96 -0.10 0.24 -1.72 0.00 0.00 179.24 178.66 2jrs h MET 42 N 1.03 -0.27 -0.17 3.56 2.86 -1.85 -2.30 114.93 117.78 2jrs h MET 42 Ca 0.22 0.02 0.05 0.00 -2.06 0.00 0.00 59.70 57.92 2jrs h MET 42 Cb 0.33 0.06 -0.05 0.00 0.06 0.00 0.00 31.60 32.00 2jrs h MET 42 CO -0.00 -0.07 -0.13 -0.07 1.06 0.00 0.00 176.91 177.69 2jrs h LEU 43 N -0.43 -0.42 -0.48 1.22 3.38 -1.29 -2.17 115.31 115.11 2jrs h LEU 43 Ca -0.03 0.09 0.10 0.00 0.09 0.00 0.00 57.88 58.13 2jrs h LEU 43 Cb 0.33 0.21 -0.09 0.00 0.09 0.00 0.00 40.66 41.20 2jrs h LEU 43 CO 0.05 -0.17 -0.13 -0.09 0.09 0.00 0.00 178.44 178.19 2jrs h ARG 44 N -0.14 -0.01 -0.01 1.13 2.43 -1.02 0.69 114.38 117.46 2jrs h ARG 44 Ca 0.11 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.28 2jrs h ARG 44 Cb 0.29 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 29.85 2jrs h ARG 44 CO -0.26 -0.00 0.00 0.78 -1.51 0.00 0.00 179.97 178.98 2jrs h GLY 45 N -0.01 0.00 1.19 2.80 0.00 -0.90 0.44 103.07 106.59 2jrs h GLY 45 Ca 0.23 0.00 -0.33 0.00 0.00 0.00 0.00 47.33 47.23 2jrs h GLY 45 CO -0.50 0.00 -1.56 -2.22 0.00 0.00 0.00 176.54 172.26 2jrs h ILE 46 N 0.00 1.16 0.02 2.60 1.08 -0.44 -3.39 117.51 118.53 2jrs h ILE 46 Ca 0.00 -2.71 -0.27 0.00 -0.39 0.00 0.00 64.86 61.50 2jrs h ILE 46 Cb 0.01 2.87 -0.04 0.00 -3.07 0.00 0.00 36.82 36.60 2jrs h ILE 46 CO -0.00 0.84 -1.44 -0.26 -0.69 0.00 0.00 178.15 176.60 2jrs h PHE 47 N 0.11 0.06 -0.92 1.37 -1.00 -0.53 -3.37 116.94 112.65 2jrs h PHE 47 Ca -0.27 -0.04 0.08 0.00 2.81 0.00 0.00 57.97 60.55 2jrs h PHE 47 Cb 2.09 -0.00 -0.06 0.00 3.61 0.00 0.00 35.95 41.58 2jrs h PHE 47 CO 0.10 1.06 0.59 0.93 -1.61 0.00 0.00 178.31 179.38 2jrs h GLU 48 N 0.01 0.96 -0.36 1.51 5.08 -1.03 0.31 114.58 121.06 2jrs h GLU 48 Ca -0.18 -0.06 0.11 0.00 -1.00 0.00 0.00 59.36 58.22 2jrs h GLU 48 Cb 1.93 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 30.94 2jrs h GLU 48 CO 0.11 0.64 0.72 -1.35 -1.00 0.00 0.00 179.01 178.12 2jrs h PRO 49 N 0.99 0.00 0.04 2.33 0.11 -1.78 -0.94 132.00 132.75 2jrs h PRO 49 Ca 0.41 0.00 -0.35 0.00 0.11 0.00 0.00 66.00 66.17 2jrs h PRO 49 Cb 0.29 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 31.36 2jrs h PRO 49 CO -0.17 0.00 -1.96 1.19 -0.21 0.00 0.00 178.00 176.85 2jrs n PHE 50 N -3.12 0.73 -3.64 0.65 3.72 0.05 -5.05 117.46 110.80 2jrs n PHE 50 Ca 0.07 0.22 -0.05 0.00 -0.05 0.00 0.00 57.45 57.64 2jrs n PHE 50 Cb 0.86 -1.09 -0.07 0.00 -0.94 0.00 0.00 39.48 38.24 2jrs n PHE 50 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 2jrs s GLY 51 N -5.52 0.14 0.27 1.37 0.00 -0.36 -4.76 107.32 98.47 2jrs s GLY 51 Ca -0.30 3.15 -0.31 0.00 0.00 0.00 0.00 44.72 47.27 2jrs s GLY 51 CO 0.63 1.85 1.56 -2.13 0.00 0.00 0.00 173.10 175.02 2jrs n ARG 52 N 1.77 2.53 -3.52 2.90 0.63 -1.26 -3.87 116.66 115.84 2jrs n ARG 52 Ca -0.11 0.90 -0.38 0.00 -0.92 0.00 0.00 57.85 57.35 2jrs n ARG 52 Cb 0.57 -2.66 -0.06 0.00 0.45 0.00 0.00 32.46 30.76 2jrs n ARG 52 CO 0.00 0.00 0.00 0.42 -2.51 0.00 0.00 177.63 175.54 2jrs s ILE 53 N 0.10 5.11 -0.09 5.15 1.09 -1.26 -3.03 121.20 128.27 2jrs s ILE 53 Ca 0.66 0.77 -0.10 0.00 -1.10 0.00 0.00 60.65 60.88 2jrs s ILE 53 Cb -0.54 -3.69 -0.28 0.00 -1.06 0.00 0.00 42.46 36.89 2jrs s ILE 53 CO 0.47 0.54 0.50 -0.33 -0.10 0.00 0.00 174.94 176.01 2jrs h GLU 54 N 5.15 0.31 -2.71 2.79 4.39 -1.13 -3.48 114.58 119.90 2jrs h GLU 54 Ca -0.50 -0.53 -0.12 0.00 0.34 0.00 0.00 59.36 58.55 2jrs h GLU 54 Cb 1.21 0.20 -0.26 0.00 -0.10 0.00 0.00 28.75 29.79 2jrs h GLU 54 CO 0.64 1.25 -0.30 0.45 -1.16 0.00 0.00 179.01 179.89 2jrs s SER 55 N -7.14 -0.47 -0.09 1.42 0.15 -1.17 -5.03 113.70 101.37 2jrs s SER 55 Ca -0.20 0.84 0.04 0.00 0.70 0.00 0.00 55.95 57.32 2jrs s SER 55 Cb 0.06 0.75 -0.01 0.00 -1.71 0.00 0.00 66.02 65.11 2jrs s SER 55 CO 0.80 -0.18 -0.20 -0.63 1.20 0.00 0.00 173.24 174.23 2jrs s ILE 56 N 1.11 2.46 -0.07 6.45 1.01 -1.26 -0.48 121.20 130.42 2jrs s ILE 56 Ca -0.07 -0.90 -0.02 0.00 0.00 0.00 0.00 60.65 59.66 2jrs s ILE 56 Cb -0.07 -1.95 0.03 0.00 0.01 0.00 0.00 42.46 40.48 2jrs s ILE 56 CO -0.09 0.56 0.04 -1.58 0.00 0.00 0.00 174.94 173.86 2jrs s GLN 57 N 0.02 0.25 0.12 2.79 2.00 -0.37 -5.02 119.66 119.45 2jrs s GLN 57 Ca -0.07 0.20 -0.04 0.00 -2.00 0.00 0.00 55.36 53.45 2jrs s GLN 57 Cb -0.15 -0.87 -0.05 0.00 0.80 0.00 0.00 33.01 32.74 2jrs s GLN 57 CO 0.05 -0.36 0.34 -0.51 -0.50 0.00 0.00 175.29 174.31 2jrs s LEU 58 N 2.07 4.29 -0.38 3.68 1.43 -1.26 0.05 118.68 128.55 2jrs s LEU 58 Ca 0.05 0.52 -0.20 0.00 -1.03 0.00 0.00 54.13 53.47 2jrs s LEU 58 Cb -0.13 -3.22 0.01 0.00 0.03 0.00 0.00 46.19 42.88 2jrs s LEU 58 CO -0.05 0.08 0.58 -0.04 0.23 0.00 0.00 176.35 177.16 2jrs s MET 59 N -2.60 3.49 -0.04 1.70 -1.94 -0.22 -4.95 119.30 114.75 2jrs s MET 59 Ca 0.39 -0.21 -0.10 0.00 -1.71 0.00 0.00 55.69 54.06 2jrs s MET 59 Cb -0.12 -3.87 0.02 0.00 2.01 0.00 0.00 34.83 32.87 2jrs s MET 59 CO 0.25 -0.80 0.23 0.00 -0.01 0.00 0.00 175.02 174.69 2jrs s MET 60 N 2.60 0.45 -0.26 2.03 0.23 -1.26 -1.46 119.30 121.64 2jrs s MET 60 Ca 0.21 -0.02 0.02 0.00 -1.03 0.00 0.00 55.69 54.87 2jrs s MET 60 Cb -0.15 0.20 0.06 0.00 -1.53 0.00 0.00 34.83 33.42 2jrs s MET 60 CO 0.16 -0.10 -0.08 -0.51 -2.03 0.00 0.00 175.02 172.45 2jrs s ASP 61 N -0.72 4.30 0.43 -1.18 1.01 -1.26 -4.85 116.67 114.40 2jrs s ASP 61 Ca -0.08 -1.38 0.15 0.00 0.71 0.00 0.00 52.55 51.95 2jrs s ASP 61 Cb -0.04 -1.45 1.05 0.00 1.01 0.00 0.00 42.92 43.49 2jrs s ASP 61 CO 0.02 -0.22 1.95 -1.28 0.21 0.00 0.00 175.17 175.85 2jrs h SER 62 N 7.81 0.37 -0.93 0.27 0.87 -1.95 0.93 113.55 120.92 2jrs h SER 62 Ca -0.18 0.02 0.06 0.00 -1.23 0.00 0.00 61.79 60.46 2jrs h SER 62 Cb 1.05 -0.06 -0.06 0.00 -0.44 0.00 0.00 62.40 62.89 2jrs h SER 62 CO 0.45 0.21 0.61 -0.33 -0.53 0.00 0.00 176.83 177.24 2jrs h GLU 63 N 0.41 1.06 0.00 2.24 4.39 -2.00 -3.44 114.58 117.23 2jrs h GLU 63 Ca 0.33 -0.06 0.00 0.00 0.34 0.00 0.00 59.36 59.96 2jrs h GLU 63 Cb 0.72 -0.24 0.00 0.00 -0.10 0.00 0.00 28.75 29.13 2jrs h GLU 63 CO -0.10 0.70 0.00 -2.37 -1.16 0.00 0.00 179.01 176.08 2jrs n THR 64 N -4.48 0.00 0.13 1.13 5.66 -0.75 -5.00 114.28 110.97 2jrs n THR 64 Ca 0.14 0.00 0.03 0.00 -3.05 0.00 0.00 64.05 61.17 2jrs n THR 64 Cb 0.18 0.00 0.43 0.00 -1.55 0.00 0.00 70.33 69.39 2jrs n THR 64 CO 0.00 0.00 0.00 1.23 -3.05 0.00 0.00 175.07 173.25 2jrs h GLY 65 N 0.00 0.24 0.00 1.09 0.00 -1.24 -3.46 103.07 99.70 2jrs h GLY 65 Ca 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 47.33 47.20 2jrs h GLY 65 CO 0.00 0.12 0.00 0.54 0.00 0.00 0.00 176.54 177.20 2jrs n ARG 66 N -4.33 0.00 -3.36 4.80 1.74 0.10 -4.31 116.66 111.31 2jrs n ARG 66 Ca -0.01 0.00 0.02 0.00 -0.77 0.00 0.00 57.85 57.09 2jrs n ARG 66 Cb 0.22 0.00 -0.03 0.00 -1.02 0.00 0.00 32.46 31.63 2jrs n ARG 66 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 2jrs s SER 67 N 0.00 -0.80 0.00 0.55 0.15 -1.26 -4.09 113.70 108.25 2jrs s SER 67 Ca 0.00 0.86 0.28 0.00 0.70 0.00 0.00 55.95 57.79 2jrs s SER 67 Cb 0.00 1.82 1.09 0.00 -1.71 0.00 0.00 66.02 67.22 2jrs s SER 67 CO 0.00 -0.15 1.78 0.29 1.20 0.00 0.00 173.24 176.36 2jrs n LYS 68 N 5.24 0.68 -0.75 5.44 5.02 -0.53 -4.84 118.16 128.41 2jrs n LYS 68 Ca -0.08 -0.28 0.00 0.00 -2.02 0.00 0.00 58.31 55.93 2jrs n LYS 68 Cb 0.52 -1.49 0.00 0.00 -0.02 0.00 0.00 35.03 34.03 2jrs n LYS 68 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2jrs n GLY 69 N 1.31 0.79 3.08 0.72 0.00 -1.26 -4.93 105.19 104.90 2jrs n GLY 69 Ca 0.13 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.98 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 -2.96 0.90 0.14 1.61 1.13 -1.26 -1.18 117.35 115.73 2jrs s TYR 70 Ca 0.00 -0.35 -0.13 0.00 -1.41 0.00 0.00 57.07 55.18 2jrs s TYR 70 Cb 0.00 -0.54 0.02 0.00 -1.10 0.00 0.00 41.96 40.34 2jrs s TYR 70 CO 0.00 -0.01 0.35 0.20 -2.51 0.00 0.00 175.55 173.58 2jrs s GLY 71 N -1.08 -0.00 -0.18 5.49 0.00 0.27 -1.05 107.32 110.76 2jrs s GLY 71 Ca -0.02 -0.38 -0.07 0.00 0.00 0.00 0.00 44.72 44.25 2jrs s GLY 71 CO 0.01 -0.52 0.04 -1.36 0.00 0.00 0.00 173.10 171.26 2jrs s PHE 72 N -3.86 3.18 -0.12 1.90 0.08 0.11 -1.12 117.98 118.14 2jrs s PHE 72 Ca 0.07 -0.06 -0.01 0.00 0.12 0.00 0.00 56.93 57.06 2jrs s PHE 72 Cb 0.02 -2.06 -0.02 0.00 -0.57 0.00 0.00 43.02 40.39 2jrs s PHE 72 CO -0.08 0.06 -0.09 0.42 -0.10 0.00 0.00 175.22 175.44 2jrs s ILE 73 N 0.48 3.45 -0.23 0.64 1.01 -0.14 -1.24 121.20 125.16 2jrs s ILE 73 Ca 0.02 -0.53 -0.03 0.00 0.00 0.00 0.00 60.65 60.10 2jrs s ILE 73 Cb -0.13 -2.46 0.00 0.00 0.01 0.00 0.00 42.46 39.89 2jrs s ILE 73 CO 0.01 0.53 -0.04 -0.89 0.00 0.00 0.00 174.94 174.56 2jrs s THR 74 N 0.04 3.28 0.11 2.92 2.01 0.37 -0.35 115.64 124.02 2jrs s THR 74 Ca -0.03 -0.64 0.00 0.00 0.31 0.00 0.00 61.69 61.34 2jrs s THR 74 Cb -0.14 -2.54 -0.04 0.00 0.01 0.00 0.00 72.50 69.79 2jrs s THR 74 CO 0.04 0.35 0.27 -0.36 -0.69 0.00 0.00 174.62 174.23 2jrs s PHE 75 N 1.44 3.50 -0.90 4.92 0.40 -0.37 -0.53 117.98 126.45 2jrs s PHE 75 Ca 0.04 0.25 0.14 0.00 -0.60 0.00 0.00 56.93 56.76 2jrs s PHE 75 Cb -0.15 -1.77 0.59 0.00 0.51 0.00 0.00 43.02 42.20 2jrs s PHE 75 CO -0.03 0.52 1.43 0.43 0.70 0.00 0.00 175.22 178.27 2jrs n SER 76 N -0.12 0.11 -4.11 1.36 7.64 -1.17 -2.35 113.62 114.99 2jrs n SER 76 Ca -0.05 0.53 -0.08 0.00 1.01 0.00 0.00 58.87 60.28 2jrs n SER 76 Cb 0.52 -0.55 -0.10 0.00 -1.01 0.00 0.00 64.21 63.07 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 -3.21 0.51 -0.11 6.43 2.15 -1.26 -4.14 116.67 117.04 2jrs s ASP 77 Ca 0.05 -1.04 -0.01 0.00 0.43 0.00 0.00 52.55 51.98 2jrs s ASP 77 Cb 0.08 0.21 -0.25 0.00 -0.30 0.00 0.00 42.92 42.66 2jrs s ASP 77 CO 0.24 -0.61 0.38 -1.20 -0.17 0.00 0.00 175.17 173.81 2jrs n SER 78 N 0.06 1.75 0.13 -0.34 7.64 -0.85 -3.53 113.62 118.49 2jrs n SER 78 Ca -0.12 0.22 -0.24 0.00 1.01 0.00 0.00 58.87 59.74 2jrs n SER 78 Cb 0.62 -0.58 -0.15 0.00 -1.01 0.00 0.00 64.21 63.08 2jrs n SER 78 CO 0.00 0.00 0.00 -0.33 -3.01 0.00 0.00 175.04 171.70 2jrs h GLU 79 N 0.05 0.57 -0.84 1.43 5.08 -1.98 -0.31 114.58 118.58 2jrs h GLU 79 Ca -0.41 -0.91 0.04 0.00 -1.00 0.00 0.00 59.36 57.08 2jrs h GLU 79 Cb 2.03 0.33 -0.05 0.00 0.50 0.00 0.00 28.75 31.55 2jrs h GLU 79 CO 0.07 1.43 0.53 0.00 -1.00 0.00 0.00 179.01 180.04 2jrs h ALA 81 N 1.37 0.27 -0.64 0.00 0.00 -1.66 -2.01 119.26 116.59 2jrs h ALA 81 Ca 0.35 -0.34 0.07 0.00 0.00 0.00 0.00 54.91 54.99 2jrs h ALA 81 Cb 0.07 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 17.76 2jrs h ALA 81 CO -0.14 0.17 0.42 -0.22 0.00 0.00 0.00 179.25 179.49 2jrs h LYS 82 N 0.10 0.57 -0.03 0.00 3.64 -0.69 -0.61 116.57 119.55 2jrs h LYS 82 Ca 0.03 -0.03 -0.23 0.00 -1.27 0.00 0.00 60.65 59.14 2jrs h LYS 82 Cb 0.70 -0.13 0.01 0.00 -0.41 0.00 0.00 32.23 32.40 2jrs h LYS 82 CO 0.04 0.38 -0.93 -0.22 -2.27 0.00 0.00 179.45 176.45 2jrs h LYS 83 N 0.59 0.57 -0.60 1.90 3.64 -0.85 -2.63 116.57 119.18 2jrs h LYS 83 Ca 0.28 -0.57 0.11 0.00 -1.27 0.00 0.00 60.65 59.21 2jrs h LYS 83 Cb 0.35 0.15 -0.04 0.00 -0.41 0.00 0.00 32.23 32.28 2jrs h LYS 83 CO -0.09 1.19 0.41 0.00 -2.27 0.00 0.00 179.45 178.69 2jrs h ALA 84 N 0.62 2.09 0.39 5.00 0.00 -0.49 -2.23 119.26 124.64 2jrs h ALA 84 Ca -0.09 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 2jrs h ALA 84 Cb 1.56 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.29 2jrs h ALA 84 CO 0.17 -0.24 -0.19 1.25 0.00 0.00 0.00 179.25 180.25 2jrs h LEU 85 N 0.35 -0.44 -2.12 0.00 6.46 -0.95 -0.60 115.31 118.00 2jrs h LEU 85 Ca 0.28 -0.12 0.00 0.00 -0.12 0.00 0.00 57.88 57.92 2jrs h LEU 85 Cb 0.64 0.11 0.00 0.00 -0.73 0.00 0.00 40.66 40.69 2jrs h LEU 85 CO -0.07 -0.10 0.00 1.05 -0.62 0.00 0.00 178.44 178.70 2jrs h GLU 86 N -0.81 0.00 0.02 1.25 -0.00 -1.09 0.31 114.58 114.26 2jrs h GLU 86 Ca -0.05 0.00 -0.35 0.00 -0.00 0.00 0.00 59.36 58.95 2jrs h GLU 86 Cb 0.53 0.00 -0.05 0.00 -0.00 0.00 0.00 28.75 29.24 2jrs h GLU 86 CO 0.09 0.00 -1.99 1.04 -0.00 0.00 0.00 179.01 178.15 2jrs n GLN 87 N -2.97 0.62 0.08 1.06 1.13 -0.88 -4.64 117.38 111.78 2jrs n GLN 87 Ca -0.01 0.35 0.12 0.00 -1.94 0.00 0.00 57.00 55.52 2jrs n GLN 87 Cb 0.17 -1.63 0.08 0.00 0.11 0.00 0.00 30.24 28.97 2jrs n GLN 87 CO 0.00 0.00 0.00 -0.07 -1.44 0.00 0.00 177.06 175.55 2jrs h LEU 88 N -0.63 0.00 -8.25 1.08 3.38 -0.93 -3.38 115.31 106.57 2jrs h LEU 88 Ca -0.51 -0.13 -0.35 0.00 0.09 0.00 0.00 57.88 56.98 2jrs h LEU 88 Cb 1.64 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 42.33 2jrs h LEU 88 CO -0.20 0.06 0.90 0.21 0.09 0.00 0.00 178.44 179.50 2jrs s ASN 89 N -4.75 5.32 0.00 -0.43 3.84 0.08 -1.07 114.94 117.93 2jrs s ASN 89 Ca 0.03 -0.63 0.00 0.00 0.21 0.00 0.00 52.86 52.47 2jrs s ASN 89 Cb 0.12 -2.56 0.00 0.00 -0.55 0.00 0.00 41.25 38.26 2jrs s ASN 89 CO 0.76 -2.55 0.00 0.61 -2.79 0.00 0.00 177.10 173.13 2jrs n GLY 90 N 6.69 1.66 3.66 1.21 0.00 0.59 -4.89 105.19 114.11 2jrs n GLY 90 Ca 0.36 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.96 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 -1.76 1.48 -0.90 1.61 5.36 -0.23 -4.29 117.98 119.24 2jrs s PHE 91 Ca 0.00 -0.30 -0.25 0.00 -0.96 0.00 0.00 56.93 55.43 2jrs s PHE 91 Cb 0.00 -4.17 0.03 0.00 -0.34 0.00 0.00 43.02 38.55 2jrs s PHE 91 CO 0.00 -5.16 1.44 -1.21 -1.46 0.00 0.00 175.22 168.83 2jrs s GLU 92 N 4.28 3.36 -0.10 10.12 2.02 -1.26 -0.11 118.70 137.01 2jrs s GLU 92 Ca 0.85 -0.71 -0.12 0.00 0.02 0.00 0.00 54.97 55.00 2jrs s GLU 92 Cb -0.41 -4.91 -0.05 0.00 0.10 0.00 0.00 34.13 28.86 2jrs s GLU 92 CO 0.39 -2.28 0.28 -1.17 0.02 0.00 0.00 175.26 172.49 2jrs s LEU 93 N 5.69 4.35 -2.03 1.80 2.96 0.15 -4.12 118.68 127.49 2jrs s LEU 93 Ca 0.45 0.63 0.00 0.00 -0.22 0.00 0.00 54.13 54.98 2jrs s LEU 93 Cb -0.04 -2.34 0.00 0.00 0.50 0.00 0.00 46.19 44.31 2jrs s LEU 93 CO 0.00 0.26 0.00 0.00 -1.32 0.00 0.00 176.35 175.29 2jrs n ALA 94 N 2.59 -0.44 -0.83 5.97 0.00 -1.26 -0.89 120.51 125.65 2jrs n ALA 94 Ca -0.15 0.27 0.00 0.00 0.00 0.00 0.00 53.44 53.56 2jrs n ALA 94 Cb 0.53 -2.11 0.00 0.00 0.00 0.00 0.00 19.45 17.87 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 -0.64 0.79 3.25 0.00 0.00 -1.26 -5.04 105.19 102.29 2jrs n GLY 95 Ca -0.22 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.49 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 -0.17 2.30 0.20 1.61 0.52 -0.07 -5.02 118.95 118.32 2jrs s ARG 96 Ca 0.00 -0.86 -0.32 0.00 -0.52 0.00 0.00 55.73 54.03 2jrs s ARG 96 Cb 0.00 -2.02 -0.12 0.00 0.52 0.00 0.00 34.95 33.34 2jrs s ARG 96 CO 0.00 0.40 1.75 -0.35 0.02 0.00 0.00 175.30 177.12 2jrs n PRO 97 N 2.85 2.80 -3.54 3.54 -0.04 -1.26 0.30 135.00 139.65 2jrs n PRO 97 Ca -0.17 1.01 -0.37 0.00 -0.04 0.00 0.00 63.50 63.93 2jrs n PRO 97 Cb 0.52 -2.87 -0.09 0.00 -0.04 0.00 0.00 33.50 31.02 2jrs n PRO 97 CO 0.00 0.00 0.00 1.41 -0.04 0.00 0.00 175.50 176.87 2jrs s MET 98 N 1.41 4.11 -0.62 0.54 1.75 0.84 -4.82 119.30 122.50 2jrs s MET 98 Ca 0.76 -0.07 -0.23 0.00 -1.25 0.00 0.00 55.69 54.90 2jrs s MET 98 Cb -0.50 -3.54 0.06 0.00 2.84 0.00 0.00 34.83 33.69 2jrs s MET 98 CO 0.33 0.01 0.92 0.15 -0.65 0.00 0.00 175.02 175.77 2jrs s LYS 99 N 1.20 3.16 -0.41 4.11 1.02 -1.26 -0.30 119.74 127.27 2jrs s LYS 99 Ca 0.12 -0.71 -0.02 0.00 0.02 0.00 0.00 55.97 55.38 2jrs s LYS 99 Cb -0.14 -4.17 0.11 0.00 -0.52 0.00 0.00 37.83 33.10 2jrs s LYS 99 CO 0.06 -1.67 0.19 0.08 -0.92 0.00 0.00 175.35 173.08 2jrs s VAL 100 N 3.87 3.11 0.10 3.17 1.01 -1.25 -1.27 120.40 129.14 2jrs s VAL 100 Ca 0.23 -2.16 0.02 0.00 0.00 0.00 0.00 61.98 60.07 2jrs s VAL 100 Cb -0.16 -3.15 -0.04 0.00 0.00 0.00 0.00 36.38 33.02 2jrs s VAL 100 CO 0.12 -0.68 -0.06 -0.83 0.00 0.00 0.00 175.10 173.65 2jrs s GLY 101 N 1.59 0.80 0.55 4.51 0.00 -0.29 -4.43 107.32 110.05 2jrs s GLY 101 Ca 0.09 -1.37 -0.18 0.00 0.00 0.00 0.00 44.72 43.26 2jrs s GLY 101 CO -0.05 -1.46 1.08 -2.38 0.00 0.00 0.00 173.10 170.28 2jrs s HIS 102 N -3.62 2.86 -0.97 1.90 -3.43 -1.26 -0.06 115.29 110.71 2jrs s HIS 102 Ca 0.13 1.55 -0.26 0.00 -0.80 0.00 0.00 55.06 55.68 2jrs s HIS 102 Cb 0.05 -3.12 -0.15 0.00 -1.43 0.00 0.00 32.58 27.92 2jrs s HIS 102 CO -0.04 -1.22 2.18 0.08 -2.00 0.00 0.00 174.74 173.74 2jrs s VAL 103 N -2.10 3.14 -0.55 -5.38 1.01 -1.26 -4.81 120.40 110.45 2jrs s VAL 103 Ca 0.68 -0.19 0.04 0.00 0.00 0.00 0.00 61.98 62.51 2jrs s VAL 103 Cb -0.19 -3.72 0.15 0.00 0.00 0.00 0.00 36.38 32.62 2jrs s VAL 103 CO 0.29 -0.28 0.34 -0.89 0.00 0.00 0.00 175.10 174.56 2jrs s THR 104 N 14.62 2.16 0.06 3.92 2.01 -1.26 -4.96 115.64 132.19 2jrs s THR 104 Ca 0.82 -3.37 0.01 0.00 0.31 0.00 0.00 61.69 59.46 2jrs s THR 104 Cb -0.08 -2.47 -0.25 0.00 0.01 0.00 0.00 72.50 69.71 2jrs s THR 104 CO 0.11 -0.93 1.07 1.05 -0.69 0.00 0.00 174.62 175.22 2jrs h GLU 105 N 6.11 0.15 -4.82 4.92 4.11 -2.03 -3.44 114.58 119.59 2jrs h GLU 105 Ca 0.05 -0.26 -0.68 0.00 0.07 0.00 0.00 59.36 58.54 2jrs h GLU 105 Cb 0.86 0.10 -0.18 0.00 0.50 0.00 0.00 28.75 30.02 2jrs h GLU 105 CO 0.61 1.05 -0.35 0.50 0.07 0.00 0.00 179.01 180.90 2jrs s ARG 106 N -2.66 3.42 -0.06 1.06 3.52 -1.26 -4.93 118.95 118.04 2jrs s ARG 106 Ca -0.04 -0.60 -0.05 0.00 -0.13 0.00 0.00 55.73 54.92 2jrs s ARG 106 Cb 0.08 -3.84 -0.02 0.00 -1.56 0.00 0.00 34.95 29.61 2jrs s ARG 106 CO 0.85 -0.56 -0.09 0.25 -0.81 0.00 0.00 175.30 174.93 2jrs n THR 107 N 5.21 0.51 -0.01 4.11 -2.24 -1.26 -5.27 114.28 115.33 2jrs n THR 107 Ca -0.10 0.39 0.00 0.00 -2.27 0.00 0.00 64.05 62.07 2jrs n THR 107 Cb 0.49 -1.81 0.00 0.00 -2.10 0.00 0.00 70.33 66.91 2jrs n THR 107 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83