#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 0.82 3.72 -5.12 0.00 -1.26 -4.93 105.19 98.42 2jrs n GLY 2 Ca 0.00 -0.58 -0.42 0.00 0.00 0.00 0.00 46.02 45.02 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 11.76 3.44 -0.45 1.61 0.00 -1.26 -5.01 115.29 125.38 2jrs s HIS 3 Ca 0.70 1.31 0.03 0.00 -3.00 0.00 0.00 55.06 54.10 2jrs s HIS 3 Cb 0.00 -3.43 0.13 0.00 -4.00 0.00 0.00 32.58 25.29 2jrs s HIS 3 CO 0.15 -1.29 0.22 -3.38 -1.00 0.00 0.00 174.74 169.44 2jrs s HIS 4 N 0.90 2.49 0.13 0.38 0.00 -1.26 -5.11 115.29 112.82 2jrs s HIS 4 Ca 0.58 -2.67 0.03 0.00 -3.00 0.00 0.00 55.06 50.00 2jrs s HIS 4 Cb -0.30 -2.26 -0.04 0.00 -4.00 0.00 0.00 32.58 25.98 2jrs s HIS 4 CO 0.30 -0.79 0.21 -1.01 -1.00 0.00 0.00 174.74 172.45 2jrs s HIS 5 N 0.27 3.36 -0.55 0.38 0.09 -1.26 -5.04 115.29 112.55 2jrs s HIS 5 Ca 0.16 0.09 0.24 0.00 -0.00 0.00 0.00 55.06 55.56 2jrs s HIS 5 Cb -0.24 -1.63 0.50 0.00 -0.00 0.00 0.00 32.58 31.21 2jrs s HIS 5 CO -0.02 0.53 1.63 1.25 -0.00 0.00 0.00 174.74 178.12 2jrs h HIS 6 N 2.47 0.00 -0.67 1.40 6.17 -2.00 -3.44 115.15 119.07 2jrs h HIS 6 Ca -0.48 0.00 -0.16 0.00 0.71 0.00 0.00 60.37 60.45 2jrs h HIS 6 Cb 1.19 0.00 -0.01 0.00 2.52 0.00 0.00 27.41 31.10 2jrs h HIS 6 CO 0.56 0.00 0.46 -3.38 0.71 0.00 0.00 177.93 176.28 2jrs s HIS 7 N -3.18 1.33 0.00 5.26 -3.43 -1.26 -4.46 115.29 109.55 2jrs s HIS 7 Ca 0.08 1.54 0.00 0.00 -0.80 0.00 0.00 55.06 55.88 2jrs s HIS 7 Cb 0.08 -3.64 0.00 0.00 -1.43 0.00 0.00 32.58 27.59 2jrs s HIS 7 CO 0.65 -1.76 0.71 0.72 -2.00 0.00 0.00 174.74 173.06 2jrs n HIS 8 N 16.87 0.00 0.49 0.38 8.25 -1.26 -4.93 115.22 135.02 2jrs n HIS 8 Ca 0.43 0.00 0.02 0.00 -0.26 0.00 0.00 57.72 57.91 2jrs n HIS 8 Cb 0.46 0.03 0.11 0.00 1.12 0.00 0.00 29.99 31.71 2jrs n HIS 8 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 2jrs n SER 9 N 0.00 2.29 0.00 0.41 7.64 -1.26 -4.89 113.62 117.80 2jrs n SER 9 Ca 0.00 -2.25 0.00 0.00 1.01 0.00 0.00 58.87 57.63 2jrs n SER 9 Cb 0.60 -0.55 0.00 0.00 -1.01 0.00 0.00 64.21 63.26 2jrs n SER 9 CO 0.00 0.00 0.00 1.57 -3.01 0.00 0.00 175.04 173.60 2jrs n HIS 10 N 0.17 0.00 -1.63 1.43 -0.00 -1.26 -4.91 115.22 109.02 2jrs n HIS 10 Ca 0.08 0.00 -0.43 0.00 -0.00 0.00 0.00 57.72 57.37 2jrs n HIS 10 Cb 0.51 0.00 -0.03 0.00 -0.00 0.00 0.00 29.99 30.47 2jrs n HIS 10 CO 0.00 0.00 0.00 -1.33 -0.00 0.00 0.00 176.34 175.01 2jrs n MET 11 N 0.00 2.42 -1.75 1.57 2.00 -1.26 -4.92 117.12 115.18 2jrs n MET 11 Ca 0.00 0.79 -0.02 0.00 0.00 0.00 0.00 57.70 58.47 2jrs n MET 11 Cb 0.00 -3.13 0.00 0.00 0.00 0.00 0.00 33.22 30.10 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 9.62 -0.23 -2.27 3.04 0.00 -1.26 -5.00 120.51 124.40 2jrs n ALA 12 Ca 0.25 -0.28 -0.43 0.00 0.00 0.00 0.00 53.44 52.98 2jrs n ALA 12 Cb 0.43 0.22 0.00 0.00 0.00 0.00 0.00 19.45 20.10 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 -2.53 4.75 -0.25 0.00 0.00 -1.26 -4.84 120.51 116.37 2jrs n ALA 13 Ca -0.03 -4.03 0.06 0.00 0.00 0.00 0.00 53.44 49.44 2jrs n ALA 13 Cb 0.12 -3.35 0.19 0.00 0.00 0.00 0.00 19.45 16.40 2jrs n ALA 13 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jrs h ALA 14 N 6.51 0.99 0.15 0.00 0.00 -1.97 -2.33 119.26 122.61 2jrs h ALA 14 Ca 0.46 0.16 -0.01 0.00 0.00 0.00 0.00 54.91 55.53 2jrs h ALA 14 Cb 0.73 0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.73 2jrs h ALA 14 CO 1.62 -0.33 -0.07 1.98 0.00 0.00 0.00 179.25 182.45 2jrs h MET 15 N 0.29 -0.19 0.00 0.00 -1.53 -2.05 -3.48 114.93 107.97 2jrs h MET 15 Ca 0.42 0.01 0.00 0.00 -3.44 0.00 0.00 59.70 56.70 2jrs h MET 15 Cb 0.72 0.04 0.00 0.00 -0.55 0.00 0.00 31.60 31.82 2jrs h MET 15 CO -0.50 -0.02 0.00 0.00 0.14 0.00 0.00 176.91 176.53 2jrs n ALA 16 N -2.25 0.00 -0.48 0.39 0.00 -0.88 -5.11 120.51 112.19 2jrs n ALA 16 Ca -0.09 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.35 2jrs n ALA 16 Cb 0.15 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.60 2jrs n ALA 16 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 2jrs n ASN 17 N -0.49 0.00 0.00 0.00 2.85 -1.26 -4.71 115.26 111.65 2jrs n ASN 17 Ca 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.47 2jrs n ASN 17 Cb 0.00 0.16 0.00 0.00 1.24 0.00 0.00 39.78 41.18 2jrs n ASN 17 CO 0.00 0.00 0.00 0.59 -2.11 0.00 0.00 177.26 175.74 2jrs n ASN 18 N -1.48 0.00 -4.45 1.20 4.13 -1.26 -4.46 115.26 108.94 2jrs n ASN 18 Ca 0.00 0.00 -0.44 0.00 1.68 0.00 0.00 54.58 55.82 2jrs n ASN 18 Cb 0.00 0.00 -0.02 0.00 -1.54 0.00 0.00 39.78 38.22 2jrs n ASN 18 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 2jrs s LEU 19 N 0.00 5.11 -0.87 3.41 1.43 -1.26 -4.98 118.68 121.52 2jrs s LEU 19 Ca 0.00 -2.16 -0.22 0.00 -1.03 0.00 0.00 54.13 50.72 2jrs s LEU 19 Cb 0.00 -2.39 0.09 0.00 0.03 0.00 0.00 46.19 43.91 2jrs s LEU 19 CO 0.00 -1.02 1.19 -1.58 0.23 0.00 0.00 176.35 175.17 2jrs s GLN 20 N 2.49 3.45 -0.10 1.70 0.74 -1.26 -4.68 119.66 122.00 2jrs s GLN 20 Ca 0.33 -1.24 -0.05 0.00 0.05 0.00 0.00 55.36 54.46 2jrs s GLN 20 Cb -0.05 -4.81 -0.04 0.00 1.10 0.00 0.00 33.01 29.21 2jrs s GLN 20 CO -0.09 -1.93 -0.13 1.63 -0.55 0.00 0.00 175.29 174.22 2jrs n LYS 21 N 7.70 0.22 -1.85 1.67 5.02 -1.26 -4.89 118.16 124.77 2jrs n LYS 21 Ca 0.18 0.09 -0.32 0.00 -2.02 0.00 0.00 58.31 56.25 2jrs n LYS 21 Cb 0.49 -0.88 -0.06 0.00 -0.02 0.00 0.00 35.03 34.56 2jrs n LYS 21 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2jrs n GLY 22 N 2.40 1.35 0.38 0.72 0.00 -1.26 -4.74 105.19 104.04 2jrs n GLY 22 Ca -0.20 -0.81 -0.14 0.00 0.00 0.00 0.00 46.02 44.86 2jrs n GLY 22 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 2jrs h SER 23 N 9.29 -0.78 0.00 1.61 0.87 -1.99 -3.43 113.55 119.13 2jrs h SER 23 Ca 0.27 0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.85 2jrs h SER 23 Cb 0.88 0.20 0.00 0.00 -0.44 0.00 0.00 62.40 63.04 2jrs h SER 23 CO 1.40 -0.40 0.00 0.00 -0.53 0.00 0.00 176.83 177.30 2jrs n ALA 24 N -2.70 0.00 0.00 6.23 0.00 -1.26 -5.11 120.51 117.67 2jrs n ALA 24 Ca -0.12 -0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.21 2jrs n ALA 24 Cb 0.37 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.82 2jrs n ALA 24 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2jrs n GLY 25 N 1.95 0.39 3.66 0.00 0.00 -1.26 -5.03 105.19 104.91 2jrs n GLY 25 Ca 0.00 0.46 -0.42 0.00 0.00 0.00 0.00 46.02 46.06 2jrs n GLY 25 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2jrs s PRO 26 N 0.00 4.18 -0.20 1.61 0.04 -1.26 -4.48 135.00 134.89 2jrs s PRO 26 Ca 0.00 2.26 -0.11 0.00 0.04 0.00 0.00 61.00 63.19 2jrs s PRO 26 Cb 0.00 -3.96 -0.05 0.00 0.04 0.00 0.00 34.50 30.53 2jrs s PRO 26 CO 0.00 -0.84 0.18 1.41 0.04 0.00 0.00 177.00 177.79 2jrs s MET 27 N 3.92 4.18 -0.17 4.56 1.75 -0.32 -4.90 119.30 128.33 2jrs s MET 27 Ca 0.76 -0.14 -0.04 0.00 -1.25 0.00 0.00 55.69 55.01 2jrs s MET 27 Cb -0.35 -3.45 -0.02 0.00 2.84 0.00 0.00 34.83 33.85 2jrs s MET 27 CO 0.32 0.23 -0.04 0.50 -0.65 0.00 0.00 175.02 175.38 2jrs s ARG 28 N 0.54 3.63 -0.03 4.11 3.52 -1.26 -0.61 118.95 128.84 2jrs s ARG 28 Ca 0.10 -0.54 -0.04 0.00 -0.13 0.00 0.00 55.73 55.13 2jrs s ARG 28 Cb -0.12 -2.93 -0.04 0.00 -1.56 0.00 0.00 34.95 30.30 2jrs s ARG 28 CO 0.01 0.18 0.17 -0.51 -0.81 0.00 0.00 175.30 174.34 2jrs s LEU 29 N 0.53 4.37 -0.39 -0.88 1.43 0.42 -4.13 118.68 120.04 2jrs s LEU 29 Ca -0.03 0.37 -0.07 0.00 -1.03 0.00 0.00 54.13 53.37 2jrs s LEU 29 Cb -0.14 -2.51 0.07 0.00 0.03 0.00 0.00 46.19 43.64 2jrs s LEU 29 CO 0.03 0.29 0.20 -0.47 0.23 0.00 0.00 176.35 176.62 2jrs s TYR 30 N -1.27 3.34 -0.60 0.29 5.04 0.95 -1.54 117.35 123.57 2jrs s TYR 30 Ca 0.25 -1.63 -0.16 0.00 -2.44 0.00 0.00 57.07 53.09 2jrs s TYR 30 Cb -0.12 -2.76 0.15 0.00 0.35 0.00 0.00 41.96 39.57 2jrs s TYR 30 CO 0.16 -0.83 0.56 0.08 -1.34 0.00 0.00 175.55 174.18 2jrs s VAL 31 N 1.37 5.27 -0.59 3.14 1.01 0.57 -0.72 120.40 130.45 2jrs s VAL 31 Ca 0.02 -1.66 0.01 0.00 0.00 0.00 0.00 61.98 60.36 2jrs s VAL 31 Cb -0.22 -4.37 0.15 0.00 0.00 0.00 0.00 36.38 31.94 2jrs s VAL 31 CO 0.01 -0.91 0.36 -0.83 0.00 0.00 0.00 175.10 173.74 2jrs s GLY 32 N 3.34 2.54 0.00 4.51 0.00 0.02 0.19 107.32 117.92 2jrs s GLY 32 Ca 0.06 -3.35 0.00 0.00 0.00 0.00 0.00 44.72 41.43 2jrs s GLY 32 CO 0.01 1.06 0.19 -1.14 0.00 0.00 0.00 173.10 173.22 2jrs n SER 33 N 3.11 -0.18 -4.72 1.64 3.41 -0.44 -4.38 113.62 112.06 2jrs n SER 33 Ca 0.08 -0.38 -0.40 0.00 -0.26 0.00 0.00 58.87 57.91 2jrs n SER 33 Cb 0.34 0.06 -0.05 0.00 -0.26 0.00 0.00 64.21 64.30 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 4.33 -1.49 1.04 1.43 0.05 -4.94 118.68 119.09 2jrs s LEU 34 Ca 0.00 1.18 -0.10 0.00 -1.03 0.00 0.00 54.13 54.18 2jrs s LEU 34 Cb 0.00 -3.06 0.01 0.00 0.03 0.00 0.00 46.19 43.17 2jrs s LEU 34 CO 0.00 -0.09 2.58 0.00 0.23 0.00 0.00 176.35 179.06 2jrs n HIS 35 N 3.67 2.74 -0.72 0.29 1.44 -1.26 -4.29 115.22 117.09 2jrs n HIS 35 Ca -0.02 -2.98 0.00 0.00 -2.01 0.00 0.00 57.72 52.71 2jrs n HIS 35 Cb 0.51 -2.31 0.00 0.00 0.12 0.00 0.00 29.99 28.32 2jrs n HIS 35 CO 0.00 0.00 0.00 1.19 -2.81 0.00 0.00 176.34 174.72 2jrs n PHE 36 N 3.71 0.00 -2.73 -1.40 3.72 -1.26 -4.72 117.46 114.78 2jrs n PHE 36 Ca 0.66 0.00 -0.07 0.00 -0.05 0.00 0.00 57.45 57.98 2jrs n PHE 36 Cb 0.28 -1.61 0.06 0.00 -0.94 0.00 0.00 39.48 37.27 2jrs n PHE 36 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 176.76 175.00 2jrs n ASN 37 N -0.05 -2.54 -3.87 4.37 5.15 -1.26 -4.79 115.26 112.27 2jrs n ASN 37 Ca 0.00 -3.01 -0.26 0.00 -0.60 0.00 0.00 54.58 50.70 2jrs n ASN 37 Cb 0.34 1.62 -0.17 0.00 -0.53 0.00 0.00 39.78 41.04 2jrs n ASN 37 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 2jrs s ILE 38 N 0.55 0.91 0.47 -1.44 -1.09 -1.26 -5.14 121.20 114.21 2jrs s ILE 38 Ca 0.30 -0.29 -0.02 0.00 -2.23 0.00 0.00 60.65 58.41 2jrs s ILE 38 Cb 0.23 -1.00 -0.01 0.00 -1.58 0.00 0.00 42.46 40.10 2jrs s ILE 38 CO -0.21 0.28 0.72 0.42 -1.23 0.00 0.00 174.94 174.93 2jrs s THR 39 N 1.75 4.19 0.50 2.92 -4.23 -1.26 -4.99 115.64 114.52 2jrs s THR 39 Ca 0.04 -0.29 0.15 0.00 -1.18 0.00 0.00 61.69 60.41 2jrs s THR 39 Cb -0.13 -3.57 0.24 0.00 1.34 0.00 0.00 72.50 70.38 2jrs s THR 39 CO -0.08 -0.46 2.10 -0.33 -0.54 0.00 0.00 174.62 175.31 2jrs h GLU 40 N 0.30 0.01 -0.14 3.99 5.08 -1.99 -2.77 114.58 119.06 2jrs h GLU 40 Ca -0.47 -0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 57.87 2jrs h GLU 40 Cb 1.24 -0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.49 2jrs h GLU 40 CO 0.59 0.06 -0.01 0.22 -1.00 0.00 0.00 179.01 178.87 2jrs h ASP 41 N 0.01 0.25 -0.15 1.42 3.58 -1.99 0.57 116.42 120.11 2jrs h ASP 41 Ca 0.00 -0.33 -0.00 0.00 0.42 0.00 0.00 57.03 57.12 2jrs h ASP 41 Cb 0.09 -0.07 -0.01 0.00 1.72 0.00 0.00 39.33 41.07 2jrs h ASP 41 CO 0.01 0.52 0.08 0.24 -2.88 0.00 0.00 179.24 177.20 2jrs h MET 42 N -0.03 0.20 -0.22 0.28 2.86 -1.93 -1.90 114.93 114.20 2jrs h MET 42 Ca 0.04 -0.02 0.05 0.00 -2.06 0.00 0.00 59.70 57.70 2jrs h MET 42 Cb 0.40 -0.04 -0.05 0.00 0.06 0.00 0.00 31.60 31.97 2jrs h MET 42 CO 0.01 0.22 -0.10 -0.07 1.06 0.00 0.00 176.91 178.03 2jrs h LEU 43 N 0.14 -0.33 -0.19 1.22 3.38 -1.45 -2.32 115.31 115.76 2jrs h LEU 43 Ca 0.05 0.08 0.05 0.00 0.09 0.00 0.00 57.88 58.16 2jrs h LEU 43 Cb 0.07 0.19 -0.06 0.00 0.09 0.00 0.00 40.66 40.95 2jrs h LEU 43 CO -0.01 -0.13 -0.21 -0.09 0.09 0.00 0.00 178.44 178.09 2jrs h ARG 44 N -0.07 -0.24 -0.57 1.13 2.43 -0.74 -0.48 114.38 115.84 2jrs h ARG 44 Ca 0.12 0.02 0.15 0.00 -0.81 0.00 0.00 59.98 59.45 2jrs h ARG 44 Cb 0.24 0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 29.82 2jrs h ARG 44 CO -0.26 -0.16 0.40 0.78 -1.51 0.00 0.00 179.97 179.22 2jrs h GLY 45 N -0.24 0.18 1.05 2.80 0.00 -0.98 0.25 103.07 106.12 2jrs h GLY 45 Ca 0.12 -0.05 -0.28 0.00 0.00 0.00 0.00 47.33 47.12 2jrs h GLY 45 CO -0.33 0.02 -1.22 -2.22 0.00 0.00 0.00 176.54 172.79 2jrs h ILE 46 N 0.11 1.36 0.00 2.60 2.04 -0.75 -3.38 117.51 119.50 2jrs h ILE 46 Ca 0.27 -2.61 -0.14 0.00 1.00 0.00 0.00 64.86 63.38 2jrs h ILE 46 Cb 0.93 3.06 -0.02 0.00 -0.74 0.00 0.00 36.82 40.05 2jrs h ILE 46 CO -0.03 0.77 -0.84 -0.26 0.00 0.00 0.00 178.15 177.79 2jrs h PHE 47 N -0.02 0.00 -0.44 1.37 -1.00 -0.24 -3.37 116.94 113.24 2jrs h PHE 47 Ca -0.21 0.00 0.07 0.00 2.81 0.00 0.00 57.97 60.64 2jrs h PHE 47 Cb 1.95 0.00 -0.06 0.00 3.61 0.00 0.00 35.95 41.46 2jrs h PHE 47 CO 0.15 0.63 0.11 0.93 -1.61 0.00 0.00 178.31 178.51 2jrs h GLU 48 N 0.00 0.24 -0.10 1.51 5.08 -0.72 -2.39 114.58 118.21 2jrs h GLU 48 Ca -0.05 -0.01 0.03 0.00 -1.00 0.00 0.00 59.36 58.32 2jrs h GLU 48 Cb 1.52 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 30.71 2jrs h GLU 48 CO 0.07 0.16 0.58 -1.35 -1.00 0.00 0.00 179.01 177.47 2jrs h PRO 49 N 0.25 0.00 0.20 2.33 0.11 -1.78 0.02 132.00 133.12 2jrs h PRO 49 Ca 0.22 0.00 -0.33 0.00 0.11 0.00 0.00 66.00 66.00 2jrs h PRO 49 Cb 0.26 0.00 0.02 0.00 0.11 0.00 0.00 31.00 31.39 2jrs h PRO 49 CO -0.27 0.00 -1.52 0.74 -0.21 0.00 0.00 178.00 176.74 2jrs h PHE 50 N 0.00 0.75 0.00 0.65 0.04 -1.69 -3.49 116.94 113.20 2jrs h PHE 50 Ca 0.05 -0.55 0.00 0.00 2.80 0.00 0.00 57.97 60.27 2jrs h PHE 50 Cb 1.21 -0.03 0.00 0.00 2.20 0.00 0.00 35.95 39.33 2jrs h PHE 50 CO 0.00 1.52 0.00 0.41 -0.60 0.00 0.00 178.31 179.64 2jrs n GLY 51 N 1.72 -0.42 3.51 -1.45 0.00 -0.01 -4.91 105.19 103.63 2jrs n GLY 51 Ca -0.17 0.52 -0.14 0.00 0.00 0.00 0.00 46.02 46.23 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 0.99 0.98 0.16 1.61 3.52 -1.25 -4.85 118.95 120.11 2jrs s ARG 52 Ca 0.00 -0.01 -0.25 0.00 -0.13 0.00 0.00 55.73 55.34 2jrs s ARG 52 Cb 0.00 0.46 -0.08 0.00 -1.56 0.00 0.00 34.95 33.77 2jrs s ARG 52 CO 0.00 -0.36 0.78 0.42 -0.81 0.00 0.00 175.30 175.33 2jrs s ILE 53 N -2.03 4.37 -0.16 4.11 1.09 -1.26 -4.58 121.20 122.74 2jrs s ILE 53 Ca -0.04 1.70 -0.14 0.00 -1.10 0.00 0.00 60.65 61.07 2jrs s ILE 53 Cb -0.00 -4.14 -0.05 0.00 -1.06 0.00 0.00 42.46 37.21 2jrs s ILE 53 CO 0.00 0.52 -0.27 1.21 -0.10 0.00 0.00 174.94 176.31 2jrs n GLU 54 N 1.60 0.47 -3.69 2.79 0.00 -0.49 -4.95 120.64 116.38 2jrs n GLU 54 Ca -0.06 0.33 -0.10 0.00 0.00 0.00 0.00 57.16 57.33 2jrs n GLU 54 Cb 0.49 -1.49 -0.11 0.00 0.00 0.00 0.00 31.44 30.33 2jrs n GLU 54 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.13 177.58 2jrs s SER 55 N -5.73 -0.34 0.07 4.31 0.15 -0.99 -5.02 113.70 106.15 2jrs s SER 55 Ca -0.22 0.84 -0.00 0.00 0.70 0.00 0.00 55.95 57.27 2jrs s SER 55 Cb 0.03 0.86 -0.04 0.00 -1.71 0.00 0.00 66.02 65.16 2jrs s SER 55 CO 0.33 -0.20 0.23 -0.63 1.20 0.00 0.00 173.24 174.16 2jrs s ILE 56 N 1.78 5.37 -0.14 6.45 1.01 -1.26 -0.48 121.20 133.92 2jrs s ILE 56 Ca -0.07 -0.38 -0.10 0.00 0.00 0.00 0.00 60.65 60.10 2jrs s ILE 56 Cb -0.10 -3.64 0.04 0.00 0.01 0.00 0.00 42.46 38.78 2jrs s ILE 56 CO -0.12 0.12 0.35 -1.58 0.00 0.00 0.00 174.94 173.71 2jrs s GLN 57 N -2.57 0.37 -0.02 2.79 2.00 0.51 -4.97 119.66 117.76 2jrs s GLN 57 Ca 0.35 0.60 -0.08 0.00 -2.00 0.00 0.00 55.36 54.23 2jrs s GLN 57 Cb -0.13 0.07 -0.05 0.00 0.80 0.00 0.00 33.01 33.70 2jrs s GLN 57 CO 0.28 -0.11 0.27 -0.51 -0.50 0.00 0.00 175.29 174.72 2jrs s LEU 58 N 0.79 4.39 -0.84 3.68 1.43 -1.26 0.87 118.68 127.75 2jrs s LEU 58 Ca -0.05 0.62 -0.17 0.00 -1.03 0.00 0.00 54.13 53.49 2jrs s LEU 58 Cb -0.06 -2.52 0.15 0.00 0.03 0.00 0.00 46.19 43.79 2jrs s LEU 58 CO -0.06 0.30 0.95 -0.32 0.23 0.00 0.00 176.35 177.45 2jrs s MET 59 N -1.47 3.50 0.52 1.70 -2.45 0.32 -4.86 119.30 116.55 2jrs s MET 59 Ca 0.24 -1.87 0.05 0.00 -1.25 0.00 0.00 55.69 52.86 2jrs s MET 59 Cb -0.14 -4.64 0.02 0.00 1.25 0.00 0.00 34.83 31.32 2jrs s MET 59 CO 0.13 -1.59 0.31 0.00 1.05 0.00 0.00 175.02 174.92 2jrs s MET 60 N 1.96 2.26 0.11 4.11 0.23 -1.26 -0.64 119.30 126.07 2jrs s MET 60 Ca 0.24 -2.03 -0.17 0.00 -1.03 0.00 0.00 55.69 52.70 2jrs s MET 60 Cb -0.10 -2.01 -0.07 0.00 -1.53 0.00 0.00 34.83 31.12 2jrs s MET 60 CO -0.06 -0.49 0.56 0.16 -2.03 0.00 0.00 175.02 173.15 2jrs s ASP 61 N -4.16 6.93 0.00 -1.18 -4.77 -1.26 -4.66 116.67 107.57 2jrs s ASP 61 Ca 0.31 1.16 0.21 0.00 -3.30 0.00 0.00 52.55 50.93 2jrs s ASP 61 Cb -0.01 -2.32 1.25 0.00 -1.09 0.00 0.00 42.92 40.74 2jrs s ASP 61 CO 0.19 0.18 1.80 -1.54 0.70 0.00 0.00 175.17 176.50 2jrs n SER 62 N 1.21 0.00 -0.02 2.11 3.41 -1.26 -1.59 113.62 117.49 2jrs n SER 62 Ca -0.08 -1.35 -0.02 0.00 -0.26 0.00 0.00 58.87 57.17 2jrs n SER 62 Cb 0.51 -0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 64.46 2jrs n SER 62 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2jrs n GLU 63 N -0.82 0.15 -0.00 4.33 1.02 -1.26 -4.69 120.64 119.37 2jrs n GLU 63 Ca 0.16 0.30 0.09 0.00 -0.02 0.00 0.00 57.16 57.69 2jrs n GLU 63 Cb 0.07 -1.02 -0.11 0.00 -0.02 0.00 0.00 31.44 30.37 2jrs n GLU 63 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 2jrs n THR 64 N -3.03 0.00 -2.94 2.62 -2.24 -1.26 -5.02 114.28 102.41 2jrs n THR 64 Ca -0.03 -0.08 -0.11 0.00 -2.27 0.00 0.00 64.05 61.56 2jrs n THR 64 Cb 0.10 0.95 0.06 0.00 -2.10 0.00 0.00 70.33 69.33 2jrs n THR 64 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2jrs n GLY 65 N 1.44 -0.11 0.02 3.38 0.00 -0.62 -5.01 105.19 104.29 2jrs n GLY 65 Ca 0.03 -0.08 0.00 0.00 0.00 0.00 0.00 46.02 45.98 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 -3.07 0.00 0.00 1.61 1.74 -1.26 -4.88 116.66 110.80 2jrs n ARG 66 Ca -0.19 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 56.89 2jrs n ARG 66 Cb 0.61 -0.01 0.00 0.00 -1.02 0.00 0.00 32.46 32.04 2jrs n ARG 66 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 2jrs n SER 67 N -1.31 0.00 -0.40 0.55 2.88 -1.26 -4.71 113.62 109.37 2jrs n SER 67 Ca 0.00 0.00 0.13 0.00 -1.33 0.00 0.00 58.87 57.67 2jrs n SER 67 Cb 0.00 0.00 0.42 0.00 -0.75 0.00 0.00 64.21 63.88 2jrs n SER 67 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 2jrs n LYS 68 N -0.04 1.32 -0.29 -1.46 5.02 0.18 -4.61 118.16 118.28 2jrs n LYS 68 Ca 0.00 -0.81 0.00 0.00 -2.02 0.00 0.00 58.31 55.48 2jrs n LYS 68 Cb 0.00 -1.48 0.00 0.00 -0.02 0.00 0.00 35.03 33.53 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 1.26 0.84 3.28 0.72 0.00 -1.25 -4.97 105.19 105.06 2jrs n GLY 69 Ca 0.15 -0.17 -0.15 0.00 0.00 0.00 0.00 46.02 45.85 2jrs n GLY 69 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2jrs s TYR 70 N -2.00 1.37 -0.15 1.61 2.02 -1.26 -0.77 117.35 118.18 2jrs s TYR 70 Ca 0.00 -0.76 -0.11 0.00 -0.37 0.00 0.00 57.07 55.83 2jrs s TYR 70 Cb 0.00 -0.71 0.04 0.00 -0.40 0.00 0.00 41.96 40.90 2jrs s TYR 70 CO 0.00 0.10 0.37 0.20 -1.57 0.00 0.00 175.55 174.66 2jrs s GLY 71 N -3.21 -0.28 -0.30 0.71 0.00 0.13 -0.52 107.32 103.84 2jrs s GLY 71 Ca 0.19 1.21 -0.08 0.00 0.00 0.00 0.00 44.72 46.04 2jrs s GLY 71 CO 0.03 1.20 0.11 -1.36 0.00 0.00 0.00 173.10 173.07 2jrs s PHE 72 N 0.70 3.16 -0.19 1.90 0.40 0.25 -0.32 117.98 123.88 2jrs s PHE 72 Ca -0.04 -0.84 -0.03 0.00 -0.60 0.00 0.00 56.93 55.42 2jrs s PHE 72 Cb -0.05 -2.29 -0.01 0.00 0.51 0.00 0.00 43.02 41.17 2jrs s PHE 72 CO -0.05 -0.53 -0.05 0.42 0.70 0.00 0.00 175.22 175.71 2jrs s ILE 73 N 1.54 3.50 -0.19 0.64 1.01 -0.59 -0.36 121.20 126.75 2jrs s ILE 73 Ca 0.03 -0.47 -0.10 0.00 0.00 0.00 0.00 60.65 60.11 2jrs s ILE 73 Cb -0.17 -2.56 -0.05 0.00 0.01 0.00 0.00 42.46 39.69 2jrs s ILE 73 CO 0.04 0.45 0.14 -0.89 0.00 0.00 0.00 174.94 174.68 2jrs s THR 74 N 1.06 5.41 0.14 2.92 2.01 0.37 -0.43 115.64 127.12 2jrs s THR 74 Ca 0.01 0.22 0.10 0.00 0.31 0.00 0.00 61.69 62.33 2jrs s THR 74 Cb -0.15 -3.47 -0.04 0.00 0.01 0.00 0.00 72.50 68.85 2jrs s THR 74 CO 0.00 0.46 -0.19 -0.36 -0.69 0.00 0.00 174.62 173.84 2jrs s PHE 75 N 0.19 2.48 0.17 4.92 0.40 0.22 -1.39 117.98 124.96 2jrs s PHE 75 Ca 0.10 -0.29 -0.01 0.00 -0.60 0.00 0.00 56.93 56.12 2jrs s PHE 75 Cb -0.11 -1.29 0.05 0.00 0.51 0.00 0.00 43.02 42.18 2jrs s PHE 75 CO -0.01 0.42 1.42 1.03 0.70 0.00 0.00 175.22 178.79 2jrs h SER 76 N 3.52 0.47 -3.58 1.36 0.87 -1.86 -0.84 113.55 113.48 2jrs h SER 76 Ca -0.49 -0.32 -0.62 0.00 -1.23 0.00 0.00 61.79 59.14 2jrs h SER 76 Cb 1.18 -0.14 -0.15 0.00 -0.44 0.00 0.00 62.40 62.85 2jrs h SER 76 CO 0.47 1.06 -0.51 -0.62 -0.53 0.00 0.00 176.83 176.70 2jrs s ASP 77 N -6.98 6.07 0.32 6.23 2.15 -1.26 -4.52 116.67 118.68 2jrs s ASP 77 Ca -0.05 0.10 0.00 0.00 0.43 0.00 0.00 52.55 53.03 2jrs s ASP 77 Cb 0.10 -2.10 0.53 0.00 -0.30 0.00 0.00 42.92 41.16 2jrs s ASP 77 CO 0.84 0.06 1.97 0.28 -0.17 0.00 0.00 175.17 178.16 2jrs h SER 78 N 7.52 0.82 0.02 -0.34 0.02 -1.84 -2.22 113.55 117.53 2jrs h SER 78 Ca -0.38 -0.03 -0.00 0.00 -0.84 0.00 0.00 61.79 60.54 2jrs h SER 78 Cb 1.17 -0.21 0.00 0.00 0.14 0.00 0.00 62.40 63.50 2jrs h SER 78 CO 0.65 0.62 -0.01 -0.33 -1.14 0.00 0.00 176.83 176.62 2jrs h GLU 79 N 0.96 -0.03 -0.91 3.45 5.08 -1.97 -0.73 114.58 120.43 2jrs h GLU 79 Ca 0.25 0.00 0.12 0.00 -1.00 0.00 0.00 59.36 58.73 2jrs h GLU 79 Cb -0.07 0.01 -0.08 0.00 0.50 0.00 0.00 28.75 29.11 2jrs h GLU 79 CO -0.05 0.52 0.53 0.00 -1.00 0.00 0.00 179.01 179.01 2jrs h ALA 81 N 1.51 0.28 -0.22 0.00 0.00 -1.35 -0.91 119.26 118.57 2jrs h ALA 81 Ca 0.45 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 55.26 2jrs h ALA 81 Cb 0.48 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 2jrs h ALA 81 CO -0.28 -0.19 -0.05 -0.22 0.00 0.00 0.00 179.25 178.52 2jrs h LYS 82 N 0.24 0.33 -0.07 0.00 3.64 -0.12 -0.92 116.57 119.67 2jrs h LYS 82 Ca 0.08 -0.07 -0.02 0.00 -1.27 0.00 0.00 60.65 59.37 2jrs h LYS 82 Cb 0.07 -0.05 -0.00 0.00 -0.41 0.00 0.00 32.23 31.84 2jrs h LYS 82 CO -0.01 0.40 -0.04 -0.22 -2.27 0.00 0.00 179.45 177.31 2jrs h LYS 83 N 0.32 0.16 -0.56 1.90 3.64 -0.39 0.24 116.57 121.89 2jrs h LYS 83 Ca 0.07 -0.07 0.10 0.00 -1.27 0.00 0.00 60.65 59.48 2jrs h LYS 83 Cb 0.30 -0.00 -0.08 0.00 -0.41 0.00 0.00 32.23 32.04 2jrs h LYS 83 CO 0.01 0.54 0.13 0.00 -2.27 0.00 0.00 179.45 177.86 2jrs h ALA 84 N 0.61 0.65 0.30 5.00 0.00 -0.90 -0.13 119.26 124.79 2jrs h ALA 84 Ca 0.02 0.11 -0.00 0.00 0.00 0.00 0.00 54.91 55.04 2jrs h ALA 84 Cb 0.50 0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 2jrs h ALA 84 CO 0.01 -0.29 -0.23 1.25 0.00 0.00 0.00 179.25 179.99 2jrs h LEU 85 N 0.27 -0.61 -1.84 0.00 6.46 -1.11 0.44 115.31 118.92 2jrs h LEU 85 Ca 0.29 0.05 0.06 0.00 -0.12 0.00 0.00 57.88 58.15 2jrs h LEU 85 Cb 0.40 0.20 -0.02 0.00 -0.73 0.00 0.00 40.66 40.51 2jrs h LEU 85 CO -0.36 -0.36 0.24 -0.08 -0.62 0.00 0.00 178.44 177.26 2jrs h GLU 86 N -0.54 0.19 0.06 1.25 4.57 0.29 0.14 114.58 120.55 2jrs h GLU 86 Ca -0.02 -0.01 -0.34 0.00 -1.18 0.00 0.00 59.36 57.80 2jrs h GLU 86 Cb 0.47 -0.04 -0.03 0.00 -0.16 0.00 0.00 28.75 28.98 2jrs h GLU 86 CO -0.01 0.13 -1.93 1.04 -1.18 0.00 0.00 179.01 177.05 2jrs n GLN 87 N -4.47 0.68 0.13 1.92 3.00 -0.14 -4.54 117.38 113.96 2jrs n GLN 87 Ca 0.04 0.33 0.07 0.00 -0.01 0.00 0.00 57.00 57.43 2jrs n GLN 87 Cb 0.27 -1.67 0.03 0.00 0.00 0.00 0.00 30.24 28.87 2jrs n GLN 87 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.06 176.99 2jrs h LEU 88 N -0.31 0.00 -8.73 1.08 3.38 -0.72 -3.41 115.31 106.60 2jrs h LEU 88 Ca -0.45 0.00 -0.52 0.00 0.09 0.00 0.00 57.88 56.99 2jrs h LEU 88 Cb 1.79 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.53 2jrs h LEU 88 CO -0.06 0.24 1.48 0.21 0.09 0.00 0.00 178.44 180.40 2jrs s ASN 89 N -5.93 5.11 0.00 -0.43 3.84 0.02 -0.85 114.94 116.70 2jrs s ASN 89 Ca 0.02 1.18 0.00 0.00 0.21 0.00 0.00 52.86 54.27 2jrs s ASN 89 Cb 0.08 -2.51 0.00 0.00 -0.55 0.00 0.00 41.25 38.26 2jrs s ASN 89 CO 0.75 -2.35 0.00 0.61 -2.79 0.00 0.00 177.10 173.32 2jrs n GLY 90 N 5.78 1.16 3.70 1.21 0.00 0.24 -4.94 105.19 112.35 2jrs n GLY 90 Ca 0.29 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.89 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 -2.10 2.79 -0.63 1.61 5.36 -0.03 -4.41 117.98 120.58 2jrs s PHE 91 Ca 0.00 0.55 -0.22 0.00 -0.96 0.00 0.00 56.93 56.30 2jrs s PHE 91 Cb 0.00 -3.89 0.07 0.00 -0.34 0.00 0.00 43.02 38.86 2jrs s PHE 91 CO 0.00 -3.39 0.91 -2.00 -1.46 0.00 0.00 175.22 169.27 2jrs s GLU 92 N 1.89 3.12 0.00 10.12 2.12 -1.26 0.49 118.70 135.18 2jrs s GLU 92 Ca 0.70 -0.85 0.00 0.00 0.36 0.00 0.00 54.97 55.18 2jrs s GLU 92 Cb -0.40 -4.21 0.00 0.00 0.26 0.00 0.00 34.13 29.78 2jrs s GLU 92 CO 0.31 -1.71 0.00 -0.11 -0.54 0.00 0.00 175.26 173.21 2jrs n LEU 93 N 7.40 1.78 -2.61 2.70 7.94 -0.55 -4.54 117.00 129.12 2jrs n LEU 93 Ca -0.04 0.00 -0.27 0.00 -1.11 0.00 0.00 56.01 54.59 2jrs n LEU 93 Cb 0.45 0.00 -0.07 0.00 0.53 0.00 0.00 43.42 44.33 2jrs n LEU 93 CO 0.63 0.00 1.84 0.00 -1.11 0.00 0.00 177.39 178.74 2jrs n ALA 94 N -1.10 6.57 -1.27 1.96 0.00 -1.26 -4.60 120.51 120.81 2jrs n ALA 94 Ca 0.00 -3.02 -0.09 0.00 0.00 0.00 0.00 53.44 50.33 2jrs n ALA 94 Cb 0.00 -2.36 -0.04 0.00 0.00 0.00 0.00 19.45 17.05 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 1.50 0.97 2.97 0.00 0.00 -1.26 -4.98 105.19 104.39 2jrs n GLY 95 Ca 0.52 -0.13 -0.16 0.00 0.00 0.00 0.00 46.02 46.25 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 -2.60 0.46 0.52 1.61 0.52 -1.26 -5.08 118.95 113.12 2jrs s ARG 96 Ca 0.00 -0.23 -0.23 0.00 -0.52 0.00 0.00 55.73 54.75 2jrs s ARG 96 Cb 0.00 -0.43 -0.06 0.00 0.52 0.00 0.00 34.95 34.98 2jrs s ARG 96 CO 0.00 0.12 1.39 -1.25 0.02 0.00 0.00 175.30 175.58 2jrs s PRO 97 N -0.21 3.27 -0.43 3.54 0.04 -1.26 -1.49 135.00 138.46 2jrs s PRO 97 Ca 0.02 2.31 -0.16 0.00 0.04 0.00 0.00 61.00 63.21 2jrs s PRO 97 Cb -0.03 -2.36 0.03 0.00 0.04 0.00 0.00 34.50 32.18 2jrs s PRO 97 CO -0.00 -1.11 0.36 1.41 0.04 0.00 0.00 177.00 177.70 2jrs s MET 98 N -2.79 3.00 -0.84 4.56 1.75 0.18 -4.81 119.30 120.35 2jrs s MET 98 Ca 0.69 -1.03 -0.20 0.00 -1.25 0.00 0.00 55.69 53.90 2jrs s MET 98 Cb -0.42 -4.02 0.11 0.00 2.84 0.00 0.00 34.83 33.35 2jrs s MET 98 CO 0.51 -0.85 1.07 0.15 -0.65 0.00 0.00 175.02 175.25 2jrs s LYS 99 N 1.80 3.44 -0.42 4.11 -0.14 -1.26 -0.59 119.74 126.69 2jrs s LYS 99 Ca 0.07 -1.47 -0.10 0.00 -1.36 0.00 0.00 55.97 53.10 2jrs s LYS 99 Cb -0.20 -4.72 0.07 0.00 -1.68 0.00 0.00 37.83 31.30 2jrs s LYS 99 CO 0.10 -1.79 0.27 0.08 -0.76 0.00 0.00 175.35 173.25 2jrs s VAL 100 N 3.12 4.43 0.18 3.17 1.01 -1.25 -0.80 120.40 130.26 2jrs s VAL 100 Ca 0.29 -1.27 0.09 0.00 0.00 0.00 0.00 61.98 61.10 2jrs s VAL 100 Cb -0.09 -3.66 -0.04 0.00 0.00 0.00 0.00 36.38 32.59 2jrs s VAL 100 CO -0.04 -0.47 -0.13 -0.83 0.00 0.00 0.00 175.10 173.63 2jrs s GLY 101 N 2.10 1.73 -1.00 4.51 0.00 0.10 -4.63 107.32 110.13 2jrs s GLY 101 Ca 0.03 -1.51 -0.08 0.00 0.00 0.00 0.00 44.72 43.15 2jrs s GLY 101 CO 0.03 -1.54 3.16 -2.39 0.00 0.00 0.00 173.10 172.37 2jrs n HIS 102 N 0.07 1.48 -3.00 1.90 1.44 -1.26 -0.03 115.22 115.82 2jrs n HIS 102 Ca -0.11 -2.45 -0.05 0.00 -2.01 0.00 0.00 57.72 53.10 2jrs n HIS 102 Cb 0.56 -2.13 0.01 0.00 0.12 0.00 0.00 29.99 28.55 2jrs n HIS 102 CO 0.00 0.00 0.00 0.28 -2.81 0.00 0.00 176.34 173.81 2jrs n VAL 103 N 3.20 -7.19 -3.27 0.61 0.31 -1.26 -4.94 118.33 105.80 2jrs n VAL 103 Ca 0.64 1.04 -0.16 0.00 -0.01 0.00 0.00 64.34 65.86 2jrs n VAL 103 Cb 0.48 -5.08 -0.06 0.00 -0.91 0.00 0.00 33.84 28.26 2jrs n VAL 103 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 2jrs s THR 104 N -1.47 -0.35 0.00 2.52 2.01 -1.26 -4.93 115.64 112.16 2jrs s THR 104 Ca 0.07 -1.23 0.00 0.00 0.31 0.00 0.00 61.69 60.84 2jrs s THR 104 Cb -0.01 -0.63 0.00 0.00 0.01 0.00 0.00 72.50 71.87 2jrs s THR 104 CO 0.49 -0.58 0.27 -1.84 -0.69 0.00 0.00 174.62 172.26 2jrs n GLU 105 N 3.81 0.00 -0.19 4.92 0.28 -1.26 -4.92 120.64 123.28 2jrs n GLU 105 Ca 0.16 -0.23 0.00 0.00 -0.16 0.00 0.00 57.16 56.93 2jrs n GLU 105 Cb 0.48 -0.20 0.00 0.00 1.43 0.00 0.00 31.44 33.15 2jrs n GLU 105 CO 0.00 0.00 0.00 -2.13 -0.16 0.00 0.00 177.13 174.84 2jrs n ARG 106 N 0.00 0.00 -0.11 3.44 0.63 -1.26 -4.99 116.66 114.37 2jrs n ARG 106 Ca 0.00 0.00 -0.16 0.00 -0.92 0.00 0.00 57.85 56.77 2jrs n ARG 106 Cb 0.51 0.00 -0.10 0.00 0.45 0.00 0.00 32.46 33.32 2jrs n ARG 106 CO 0.00 0.00 0.00 0.25 -2.51 0.00 0.00 177.63 175.37 2jrs n THR 107 N 0.00 1.25 -1.24 5.15 -2.24 -1.26 -5.29 114.28 110.65 2jrs n THR 107 Ca 0.00 -0.46 0.00 0.00 -2.27 0.00 0.00 64.05 61.32 2jrs n THR 107 Cb 0.28 -1.35 0.00 0.00 -2.10 0.00 0.00 70.33 67.17 2jrs n THR 107 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83