#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 3.03 2.60 -5.12 0.00 -1.26 -4.83 105.19 99.61 2jrs n GLY 2 Ca 0.00 -1.35 -0.10 0.00 0.00 0.00 0.00 46.02 44.57 2jrs n GLY 2 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2jrs n HIS 3 N 8.19 -1.40 -1.71 1.61 -0.00 -1.26 -5.07 115.22 115.58 2jrs n HIS 3 Ca 0.50 -1.68 -0.41 0.00 -0.00 0.00 0.00 57.72 56.13 2jrs n HIS 3 Cb 0.42 0.48 -0.02 0.00 -0.00 0.00 0.00 29.99 30.87 2jrs n HIS 3 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06 2jrs n HIS 4 N -0.43 3.12 0.00 4.41 -0.00 -1.26 -4.84 115.22 116.22 2jrs n HIS 4 Ca -0.01 -2.46 0.00 0.00 -0.00 0.00 0.00 57.72 55.25 2jrs n HIS 4 Cb 0.44 -2.31 0.00 0.00 -0.00 0.00 0.00 29.99 28.12 2jrs n HIS 4 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06 2jrs n HIS 5 N 7.63 0.00 -2.12 4.41 -0.00 -1.26 -4.58 115.22 119.30 2jrs n HIS 5 Ca 0.50 0.00 -0.29 0.00 -0.00 0.00 0.00 57.72 57.93 2jrs n HIS 5 Cb 0.41 0.00 -0.05 0.00 -0.00 0.00 0.00 29.99 30.35 2jrs n HIS 5 CO 0.00 0.00 0.00 -1.01 -0.00 0.00 0.00 176.34 175.33 2jrs s HIS 6 N 0.00 1.93 -0.68 4.41 0.09 -1.26 -4.91 115.29 114.86 2jrs s HIS 6 Ca 0.00 0.40 -0.26 0.00 -0.00 0.00 0.00 55.06 55.20 2jrs s HIS 6 Cb 0.00 -4.12 -0.01 0.00 -0.00 0.00 0.00 32.58 28.45 2jrs s HIS 6 CO 0.00 -1.69 1.68 -3.38 -0.00 0.00 0.00 174.74 171.36 2jrs s HIS 7 N 9.55 1.88 -0.36 1.40 -3.43 -1.26 -4.97 115.29 118.09 2jrs s HIS 7 Ca 0.67 0.48 -0.24 0.00 -0.80 0.00 0.00 55.06 55.17 2jrs s HIS 7 Cb -0.05 -4.26 0.01 0.00 -1.43 0.00 0.00 32.58 26.85 2jrs s HIS 7 CO 0.00 -2.19 0.83 -3.38 -2.00 0.00 0.00 174.74 168.01 2jrs s HIS 8 N 8.04 3.10 0.68 0.38 -3.43 -1.26 -5.05 115.29 117.75 2jrs s HIS 8 Ca 0.57 0.64 -0.12 0.00 -0.80 0.00 0.00 55.06 55.35 2jrs s HIS 8 Cb -0.10 -3.49 0.16 0.00 -1.43 0.00 0.00 32.58 27.72 2jrs s HIS 8 CO 0.16 -0.76 0.93 0.45 -2.00 0.00 0.00 174.74 173.52 2jrs n SER 9 N 6.54 0.07 -4.05 7.38 2.88 -1.26 -5.12 113.62 120.07 2jrs n SER 9 Ca 0.04 -1.34 -0.10 0.00 -1.33 0.00 0.00 58.87 56.15 2jrs n SER 9 Cb 0.48 -0.71 -0.07 0.00 -0.75 0.00 0.00 64.21 63.16 2jrs n SER 9 CO 0.00 0.00 0.00 -1.38 -1.23 0.00 0.00 175.04 172.43 2jrs s HIS 10 N -3.02 0.60 0.16 0.66 -3.43 -1.26 -5.13 115.29 103.87 2jrs s HIS 10 Ca 0.52 -0.92 -0.31 0.00 -0.80 0.00 0.00 55.06 53.55 2jrs s HIS 10 Cb -0.01 -0.08 -0.11 0.00 -1.43 0.00 0.00 32.58 30.95 2jrs s HIS 10 CO 0.37 -0.83 1.76 -1.64 -2.00 0.00 0.00 174.74 172.40 2jrs s MET 11 N -4.05 4.14 -0.16 -0.38 1.00 -1.26 -4.91 119.30 113.69 2jrs s MET 11 Ca 0.26 2.58 0.16 0.00 0.00 0.00 0.00 55.69 58.69 2jrs s MET 11 Cb 0.02 -3.35 0.34 0.00 0.00 0.00 0.00 34.83 31.84 2jrs s MET 11 CO 0.08 -0.79 1.18 0.00 0.00 0.00 0.00 175.02 175.49 2jrs n ALA 12 N 4.86 2.81 -3.11 3.03 0.00 -1.26 -4.98 120.51 121.87 2jrs n ALA 12 Ca 0.17 -2.86 -0.14 0.00 0.00 0.00 0.00 53.44 50.61 2jrs n ALA 12 Cb 0.37 -0.38 0.07 0.00 0.00 0.00 0.00 19.45 19.51 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 -1.26 -1.87 -1.63 0.00 0.00 -1.26 -4.70 120.51 109.78 2jrs n ALA 13 Ca 0.17 0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.62 2jrs n ALA 13 Cb 0.67 -3.21 0.00 0.00 0.00 0.00 0.00 19.45 16.91 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 -3.36 -2.41 -1.78 0.00 0.00 -1.26 -4.98 120.51 106.72 2jrs n ALA 14 Ca -0.17 0.30 -0.37 0.00 0.00 0.00 0.00 53.44 53.19 2jrs n ALA 14 Cb 0.63 -1.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.03 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 -1.37 4.40 -0.53 0.00 1.00 -1.26 -5.01 119.30 116.53 2jrs s MET 15 Ca 0.00 1.46 -0.22 0.00 0.00 0.00 0.00 55.69 56.94 2jrs s MET 15 Cb 0.00 -2.72 0.05 0.00 0.00 0.00 0.00 34.83 32.16 2jrs s MET 15 CO 0.00 0.08 0.79 0.00 0.00 0.00 0.00 175.02 175.89 2jrs s ALA 16 N -1.59 3.27 0.48 3.03 0.00 -1.26 -5.05 121.76 120.63 2jrs s ALA 16 Ca 0.53 -1.48 -0.08 0.00 0.00 0.00 0.00 51.96 50.93 2jrs s ALA 16 Cb -0.22 -3.55 -0.05 0.00 0.00 0.00 0.00 23.12 19.30 2jrs s ALA 16 CO 0.27 -2.21 0.82 -0.80 0.00 0.00 0.00 175.76 173.85 2jrs s ASN 17 N 2.78 6.36 -1.09 0.00 -0.87 -1.26 -4.46 114.94 116.40 2jrs s ASN 17 Ca 0.23 1.10 -0.11 0.00 -1.57 0.00 0.00 52.86 52.51 2jrs s ASN 17 Cb -0.16 -2.32 -0.05 0.00 -0.02 0.00 0.00 41.25 38.71 2jrs s ASN 17 CO 0.16 -0.56 0.87 -3.20 -2.57 0.00 0.00 177.10 171.80 2jrs n ASN 18 N -1.96 -5.91 0.05 -1.22 5.15 -1.26 -4.94 115.26 105.17 2jrs n ASN 18 Ca 0.02 -0.81 -0.14 0.00 -0.60 0.00 0.00 54.58 53.05 2jrs n ASN 18 Cb 0.54 -4.58 -0.14 0.00 -0.53 0.00 0.00 39.78 35.08 2jrs n ASN 18 CO 0.00 0.00 0.00 0.25 1.40 0.00 0.00 177.26 178.91 2jrs h LEU 19 N -1.40 0.27 0.00 1.20 6.46 -2.04 -3.47 115.31 116.34 2jrs h LEU 19 Ca -0.63 -0.38 0.00 0.00 -0.12 0.00 0.00 57.88 56.75 2jrs h LEU 19 Cb 1.33 -0.09 0.00 0.00 -0.73 0.00 0.00 40.66 41.17 2jrs h LEU 19 CO 0.46 1.32 0.00 0.00 -0.62 0.00 0.00 178.44 179.60 2jrs n GLN 20 N -3.37 2.86 -2.03 1.25 -0.00 -1.26 -5.01 117.38 109.81 2jrs n GLN 20 Ca -0.14 0.00 -0.40 0.00 -0.00 0.00 0.00 57.00 56.46 2jrs n GLN 20 Cb 1.03 0.00 -0.03 0.00 -0.00 0.00 0.00 30.24 31.24 2jrs n GLN 20 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.06 177.21 2jrs s LYS 21 N 2.57 2.84 -0.78 2.61 1.02 -1.26 -4.90 119.74 121.85 2jrs s LYS 21 Ca 0.00 0.86 -0.24 0.00 0.02 0.00 0.00 55.97 56.60 2jrs s LYS 21 Cb 0.00 -4.33 -0.15 0.00 -0.52 0.00 0.00 37.83 32.83 2jrs s LYS 21 CO 0.00 -2.46 2.40 0.41 -0.92 0.00 0.00 175.35 174.77 2jrs n GLY 22 N 5.60 -0.15 2.61 -3.33 0.00 -1.26 -4.86 105.19 103.80 2jrs n GLY 22 Ca 0.21 0.35 -0.26 0.00 0.00 0.00 0.00 46.02 46.31 2jrs n GLY 22 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2jrs s SER 23 N 9.99 2.50 0.00 1.61 1.04 -1.26 -5.00 113.70 122.57 2jrs s SER 23 Ca 0.98 -0.70 0.00 0.00 0.48 0.00 0.00 55.95 56.72 2jrs s SER 23 Cb -0.23 -0.26 0.00 0.00 0.10 0.00 0.00 66.02 65.63 2jrs s SER 23 CO 0.16 -0.36 0.00 0.00 0.98 0.00 0.00 173.24 174.02 2jrs n ALA 24 N 5.27 0.75 -0.99 5.32 0.00 -1.26 -5.12 120.51 124.48 2jrs n ALA 24 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.37 2jrs n ALA 24 Cb 0.48 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.93 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 -0.48 2.69 3.70 0.00 0.00 -1.26 -4.62 105.19 105.22 2jrs n GLY 25 Ca 0.00 0.30 -0.42 0.00 0.00 0.00 0.00 46.02 45.90 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 4.33 -0.17 1.61 0.04 -1.26 -3.50 135.00 136.05 2jrs s PRO 26 Ca 0.00 1.91 -0.07 0.00 0.04 0.00 0.00 61.00 62.88 2jrs s PRO 26 Cb 0.00 -3.46 -0.04 0.00 0.04 0.00 0.00 34.50 31.04 2jrs s PRO 26 CO 0.00 -0.47 0.08 1.41 0.04 0.00 0.00 177.00 178.06 2jrs s MET 27 N 1.84 3.90 -0.29 4.56 1.75 -0.87 -4.86 119.30 125.33 2jrs s MET 27 Ca 0.62 -0.30 -0.10 0.00 -1.25 0.00 0.00 55.69 54.66 2jrs s MET 27 Cb -0.31 -3.22 -0.03 0.00 2.84 0.00 0.00 34.83 34.11 2jrs s MET 27 CO 0.27 0.36 0.15 0.50 -0.65 0.00 0.00 175.02 175.65 2jrs s ARG 28 N 0.14 3.67 0.08 4.11 3.52 -1.26 -0.56 118.95 128.65 2jrs s ARG 28 Ca 0.06 -0.49 0.02 0.00 -0.13 0.00 0.00 55.73 55.18 2jrs s ARG 28 Cb -0.12 -3.56 -0.04 0.00 -1.56 0.00 0.00 34.95 29.67 2jrs s ARG 28 CO 0.00 -0.27 0.15 -0.51 -0.81 0.00 0.00 175.30 173.87 2jrs s LEU 29 N 1.68 4.09 -0.16 -0.88 1.43 0.42 -3.88 118.68 121.38 2jrs s LEU 29 Ca 0.06 0.12 -0.06 0.00 -1.03 0.00 0.00 54.13 53.23 2jrs s LEU 29 Cb -0.16 -2.72 -0.04 0.00 0.03 0.00 0.00 46.19 43.30 2jrs s LEU 29 CO 0.08 0.16 0.03 -0.47 0.23 0.00 0.00 176.35 176.37 2jrs s TYR 30 N -1.48 3.18 -0.27 0.29 5.04 1.00 -0.76 117.35 124.36 2jrs s TYR 30 Ca 0.32 -0.01 0.01 0.00 -2.44 0.00 0.00 57.07 54.95 2jrs s TYR 30 Cb -0.12 -2.00 0.07 0.00 0.35 0.00 0.00 41.96 40.26 2jrs s TYR 30 CO 0.25 0.15 -0.01 0.08 -1.34 0.00 0.00 175.55 174.69 2jrs s VAL 31 N 0.17 1.53 -0.50 3.14 1.01 0.04 -0.82 120.40 124.97 2jrs s VAL 31 Ca 0.02 -1.44 0.03 0.00 0.00 0.00 0.00 61.98 60.59 2jrs s VAL 31 Cb -0.13 -1.92 0.14 0.00 0.00 0.00 0.00 36.38 34.47 2jrs s VAL 31 CO 0.01 -0.29 0.28 -0.83 0.00 0.00 0.00 175.10 174.27 2jrs s GLY 32 N 1.35 2.09 0.00 4.51 0.00 -0.67 -0.74 107.32 113.87 2jrs s GLY 32 Ca 0.00 -2.98 0.00 0.00 0.00 0.00 0.00 44.72 41.74 2jrs s GLY 32 CO -0.10 1.31 0.14 -1.14 0.00 0.00 0.00 173.10 173.32 2jrs n SER 33 N 3.18 -0.08 -4.91 1.64 3.41 -0.88 -4.44 113.62 111.54 2jrs n SER 33 Ca 0.09 -0.29 -0.28 0.00 -0.26 0.00 0.00 58.87 58.14 2jrs n SER 33 Cb 0.34 0.02 0.05 0.00 -0.26 0.00 0.00 64.21 64.37 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 2.94 -0.42 1.04 1.43 0.07 -4.79 118.68 118.95 2jrs s LEU 34 Ca 0.00 0.75 0.04 0.00 -1.03 0.00 0.00 54.13 53.90 2jrs s LEU 34 Cb 0.00 -3.48 0.17 0.00 0.03 0.00 0.00 46.19 42.91 2jrs s LEU 34 CO 0.00 -1.39 0.37 -1.38 0.23 0.00 0.00 176.35 174.18 2jrs s HIS 35 N -3.23 0.81 0.00 0.29 -3.43 -1.26 -4.58 115.29 103.89 2jrs s HIS 35 Ca 0.58 -2.13 0.00 0.00 -0.80 0.00 0.00 55.06 52.70 2jrs s HIS 35 Cb -0.11 -0.80 0.00 0.00 -1.43 0.00 0.00 32.58 30.25 2jrs s HIS 35 CO 0.47 -0.87 0.00 0.34 -2.00 0.00 0.00 174.74 172.68 2jrs n PHE 36 N 2.90 0.00 -2.78 0.38 7.35 -1.26 -4.63 117.46 119.42 2jrs n PHE 36 Ca 0.28 0.00 -0.11 0.00 -0.76 0.00 0.00 57.45 56.86 2jrs n PHE 36 Cb 0.48 -1.25 0.03 0.00 0.35 0.00 0.00 39.48 39.09 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 0.73 0.73 -3.87 -2.13 5.15 -1.26 -5.04 115.26 109.57 2jrs n ASN 37 Ca 0.00 -2.79 -0.23 0.00 -0.60 0.00 0.00 54.58 50.97 2jrs n ASN 37 Cb 0.22 -0.25 -0.17 0.00 -0.53 0.00 0.00 39.78 39.05 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 -2.41 0.64 0.24 -1.44 -1.09 -1.26 -4.94 121.20 110.94 2jrs s ILE 38 Ca 0.29 -0.12 0.07 0.00 -2.23 0.00 0.00 60.65 58.67 2jrs s ILE 38 Cb 0.42 -0.69 -0.04 0.00 -1.58 0.00 0.00 42.46 40.57 2jrs s ILE 38 CO -0.01 0.27 0.12 0.42 -1.23 0.00 0.00 174.94 174.52 2jrs s THR 39 N 1.34 4.14 0.48 2.92 -4.23 -1.26 -5.00 115.64 114.03 2jrs s THR 39 Ca -0.04 -1.49 0.20 0.00 -1.18 0.00 0.00 61.69 59.18 2jrs s THR 39 Cb -0.14 -3.20 0.37 0.00 1.34 0.00 0.00 72.50 70.87 2jrs s THR 39 CO -0.03 -0.30 1.97 -0.33 -0.54 0.00 0.00 174.62 175.39 2jrs h GLU 40 N 1.81 0.20 -0.64 3.99 5.08 -1.99 -1.75 114.58 121.28 2jrs h GLU 40 Ca -0.47 -0.01 -0.03 0.00 -1.00 0.00 0.00 59.36 57.85 2jrs h GLU 40 Cb 1.23 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 30.41 2jrs h GLU 40 CO 0.61 0.13 0.29 -0.44 -1.00 0.00 0.00 179.01 178.60 2jrs h ASP 41 N 0.21 0.85 0.44 1.42 3.32 -1.98 0.11 116.42 120.78 2jrs h ASP 41 Ca 0.29 -0.14 -0.02 0.00 0.02 0.00 0.00 57.03 57.18 2jrs h ASP 41 Cb 0.87 -0.22 0.00 0.00 0.22 0.00 0.00 39.33 40.20 2jrs h ASP 41 CO -0.05 0.76 -0.21 0.24 -1.72 0.00 0.00 179.24 178.25 2jrs h MET 42 N 0.89 -0.57 0.25 3.56 2.86 -1.73 -1.84 114.93 118.35 2jrs h MET 42 Ca 0.22 0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.90 2jrs h MET 42 Cb 0.14 0.13 -0.02 0.00 0.06 0.00 0.00 31.60 31.91 2jrs h MET 42 CO -0.02 -0.29 -0.27 -0.07 1.06 0.00 0.00 176.91 177.32 2jrs h LEU 43 N -0.79 -0.72 -0.48 1.22 3.38 -1.46 -2.39 115.31 114.07 2jrs h LEU 43 Ca -0.06 0.07 0.09 0.00 0.09 0.00 0.00 57.88 58.06 2jrs h LEU 43 Cb 0.55 0.25 -0.07 0.00 0.09 0.00 0.00 40.66 41.47 2jrs h LEU 43 CO 0.10 -0.38 0.07 -0.09 0.09 0.00 0.00 178.44 178.22 2jrs h ARG 44 N -0.55 0.19 -0.02 1.13 2.43 -0.83 0.99 114.38 117.71 2jrs h ARG 44 Ca -0.00 -0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.13 2jrs h ARG 44 Cb 0.52 -0.04 -0.00 0.00 -0.42 0.00 0.00 29.97 30.02 2jrs h ARG 44 CO -0.07 0.12 -0.09 0.78 -1.51 0.00 0.00 179.97 179.20 2jrs h GLY 45 N 0.19 0.03 1.02 2.80 0.00 -1.18 0.35 103.07 106.28 2jrs h GLY 45 Ca 0.24 -0.01 -0.33 0.00 0.00 0.00 0.00 47.33 47.22 2jrs h GLY 45 CO -0.35 0.01 -1.58 -2.22 0.00 0.00 0.00 176.54 172.41 2jrs h ILE 46 N 0.03 1.11 0.01 2.60 2.04 -0.68 -3.40 117.51 119.22 2jrs h ILE 46 Ca 0.01 -2.58 -0.26 0.00 1.00 0.00 0.00 64.86 63.02 2jrs h ILE 46 Cb 0.18 2.90 -0.04 0.00 -0.74 0.00 0.00 36.82 39.13 2jrs h ILE 46 CO 0.01 0.82 -1.43 -0.26 0.00 0.00 0.00 178.15 177.30 2jrs h PHE 47 N 0.08 0.06 -0.88 1.37 -1.00 -0.68 -3.37 116.94 112.51 2jrs h PHE 47 Ca -0.30 -0.04 0.10 0.00 2.81 0.00 0.00 57.97 60.54 2jrs h PHE 47 Cb 2.09 -0.00 -0.07 0.00 3.61 0.00 0.00 35.95 41.57 2jrs h PHE 47 CO 0.12 1.05 0.53 0.93 -1.61 0.00 0.00 178.31 179.33 2jrs h GLU 48 N 0.01 0.85 -1.06 1.51 5.08 -1.05 -0.96 114.58 118.95 2jrs h GLU 48 Ca -0.18 -0.05 0.41 0.00 -1.00 0.00 0.00 59.36 58.54 2jrs h GLU 48 Cb 1.92 -0.19 -0.17 0.00 0.50 0.00 0.00 28.75 30.82 2jrs h GLU 48 CO 0.11 0.56 0.60 -1.35 -1.00 0.00 0.00 179.01 177.94 2jrs h PRO 49 N 0.88 0.07 0.13 2.33 0.11 -1.79 -1.54 132.00 132.19 2jrs h PRO 49 Ca 0.42 -0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.52 2jrs h PRO 49 Cb 0.37 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 31.46 2jrs h PRO 49 CO -0.24 0.04 -0.06 0.74 -0.21 0.00 0.00 178.00 178.27 2jrs h PHE 50 N 0.07 -0.16 -2.16 0.65 0.04 -1.44 -3.48 116.94 110.45 2jrs h PHE 50 Ca 0.83 -0.00 -0.04 0.00 2.80 0.00 0.00 57.97 61.56 2jrs h PHE 50 Cb 2.22 0.05 -0.22 0.00 2.20 0.00 0.00 35.95 40.21 2jrs h PHE 50 CO -0.01 0.09 -0.01 0.20 -0.60 0.00 0.00 178.31 177.99 2jrs s GLY 51 N -3.43 -0.53 -0.01 -1.45 0.00 -0.58 -4.81 107.32 96.52 2jrs s GLY 51 Ca -0.07 2.02 -0.33 0.00 0.00 0.00 0.00 44.72 46.34 2jrs s GLY 51 CO 0.24 1.90 1.84 -2.13 0.00 0.00 0.00 173.10 174.95 2jrs n ARG 52 N 3.52 2.34 -2.71 2.90 0.00 -1.25 -3.98 116.66 117.47 2jrs n ARG 52 Ca -0.17 0.85 -0.41 0.00 -0.00 0.00 0.00 57.85 58.12 2jrs n ARG 52 Cb 0.57 -2.71 -0.05 0.00 0.00 0.00 0.00 32.46 30.27 2jrs n ARG 52 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.63 178.05 2jrs s ILE 53 N 3.47 4.40 -0.19 5.15 1.09 -1.26 -1.34 121.20 132.52 2jrs s ILE 53 Ca 0.89 2.03 -0.21 0.00 -1.10 0.00 0.00 60.65 62.26 2jrs s ILE 53 Cb -0.63 -4.30 -0.19 0.00 -1.06 0.00 0.00 42.46 36.28 2jrs s ILE 53 CO 0.47 0.33 0.28 -0.33 -0.10 0.00 0.00 174.94 175.59 2jrs h GLU 54 N 5.39 0.00 -2.83 2.79 4.39 -1.04 -3.47 114.58 119.81 2jrs h GLU 54 Ca -0.43 0.00 -0.13 0.00 0.34 0.00 0.00 59.36 59.14 2jrs h GLU 54 Cb 1.21 0.00 -0.24 0.00 -0.10 0.00 0.00 28.75 29.62 2jrs h GLU 54 CO 0.71 0.89 -0.28 -1.12 -1.16 0.00 0.00 179.01 178.06 2jrs s SER 55 N -6.61 -0.38 -0.03 1.42 0.01 -1.22 -5.04 113.70 101.85 2jrs s SER 55 Ca -0.25 0.73 0.06 0.00 1.31 0.00 0.00 55.95 57.80 2jrs s SER 55 Cb 0.04 0.75 -0.02 0.00 0.21 0.00 0.00 66.02 66.99 2jrs s SER 55 CO 0.57 -0.14 -0.19 -0.63 0.41 0.00 0.00 173.24 173.25 2jrs s ILE 56 N 0.15 2.64 -0.18 1.44 1.01 -1.26 -1.33 121.20 123.66 2jrs s ILE 56 Ca -0.00 -0.93 -0.04 0.00 0.00 0.00 0.00 60.65 59.68 2jrs s ILE 56 Cb -0.03 -2.00 0.06 0.00 0.01 0.00 0.00 42.46 40.50 2jrs s ILE 56 CO 0.01 0.56 0.06 -1.58 0.00 0.00 0.00 174.94 173.98 2jrs s GLN 57 N -0.76 0.40 0.08 2.79 2.00 -0.05 -5.02 119.66 119.10 2jrs s GLN 57 Ca 0.11 -0.27 -0.00 0.00 -2.00 0.00 0.00 55.36 53.20 2jrs s GLN 57 Cb -0.10 -1.97 -0.04 0.00 0.80 0.00 0.00 33.01 31.69 2jrs s GLN 57 CO 0.00 -0.65 0.24 -0.51 -0.50 0.00 0.00 175.29 173.87 2jrs s LEU 58 N 1.98 4.35 -0.24 3.68 1.02 -1.26 -0.13 118.68 128.07 2jrs s LEU 58 Ca 0.00 0.29 -0.16 0.00 0.02 0.00 0.00 54.13 54.28 2jrs s LEU 58 Cb -0.17 -2.99 -0.04 0.00 0.02 0.00 0.00 46.19 43.02 2jrs s LEU 58 CO -0.08 0.14 0.41 -0.04 0.02 0.00 0.00 176.35 176.80 2jrs s MET 59 N -2.62 4.09 -0.08 1.70 -1.94 -0.23 -4.97 119.30 115.24 2jrs s MET 59 Ca 0.35 0.15 -0.18 0.00 -1.71 0.00 0.00 55.69 54.31 2jrs s MET 59 Cb -0.13 -3.61 0.04 0.00 2.01 0.00 0.00 34.83 33.14 2jrs s MET 59 CO 0.28 -0.20 0.43 0.00 -0.01 0.00 0.00 175.02 175.52 2jrs s MET 60 N 1.82 0.67 -0.21 2.03 0.23 -1.26 -1.22 119.30 121.37 2jrs s MET 60 Ca 0.18 0.22 -0.01 0.00 -1.03 0.00 0.00 55.69 55.05 2jrs s MET 60 Cb -0.15 0.31 0.02 0.00 -1.53 0.00 0.00 34.83 33.48 2jrs s MET 60 CO 0.09 -0.16 -0.13 0.34 -2.03 0.00 0.00 175.02 173.13 2jrs s ASP 61 N -0.65 3.71 0.30 -1.18 2.15 -0.37 -4.88 116.67 115.74 2jrs s ASP 61 Ca -0.07 -0.66 0.26 0.00 0.43 0.00 0.00 52.55 52.50 2jrs s ASP 61 Cb -0.03 -1.58 0.94 0.00 -0.30 0.00 0.00 42.92 41.94 2jrs s ASP 61 CO 0.04 -0.04 1.76 -1.28 -0.17 0.00 0.00 175.17 175.48 2jrs h SER 62 N 7.99 0.00 0.00 -0.34 0.87 -1.96 0.31 113.55 120.42 2jrs h SER 62 Ca -0.41 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.15 2jrs h SER 62 Cb 1.13 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.09 2jrs h SER 62 CO 0.61 0.00 0.00 -0.62 -0.53 0.00 0.00 176.83 176.29 2jrs n GLU 63 N -2.43 0.00 -0.31 2.24 -0.58 -1.26 -4.88 120.64 113.42 2jrs n GLU 63 Ca 0.03 0.50 0.00 0.00 -0.42 0.00 0.00 57.16 57.27 2jrs n GLU 63 Cb 0.32 -1.17 0.00 0.00 -0.57 0.00 0.00 31.44 30.03 2jrs n GLU 63 CO 0.00 0.00 0.00 -2.37 -0.48 0.00 0.00 177.13 174.28 2jrs n THR 64 N -1.99 0.00 -0.01 2.62 5.66 -1.25 -4.92 114.28 114.38 2jrs n THR 64 Ca 0.00 0.00 -0.10 0.00 -3.05 0.00 0.00 64.05 60.90 2jrs n THR 64 Cb 0.00 0.00 -0.14 0.00 -1.55 0.00 0.00 70.33 68.64 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 0.03 0.00 1.09 0.00 -1.88 -3.50 103.07 98.81 2jrs h GLY 65 Ca 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 47.33 47.25 2jrs h GLY 65 CO 0.00 0.07 0.00 0.54 0.00 0.00 0.00 176.54 177.15 2jrs n ARG 66 N -3.11 0.00 -2.03 4.80 1.74 0.11 -4.49 116.66 113.68 2jrs n ARG 66 Ca -0.17 0.00 -0.41 0.00 -0.77 0.00 0.00 57.85 56.50 2jrs n ARG 66 Cb 1.04 0.00 -0.03 0.00 -1.02 0.00 0.00 32.46 32.46 2jrs n ARG 66 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 2jrs s SER 67 N -4.00 5.62 0.28 0.55 0.01 -1.26 -1.24 113.70 113.65 2jrs s SER 67 Ca 0.00 0.86 -0.02 0.00 1.31 0.00 0.00 55.95 58.09 2jrs s SER 67 Cb 0.00 -2.53 0.39 0.00 0.21 0.00 0.00 66.02 64.09 2jrs s SER 67 CO 0.00 -2.01 1.88 0.11 0.41 0.00 0.00 173.24 173.63 2jrs h LYS 68 N 13.80 0.99 0.00 12.44 1.57 -1.39 -3.41 116.57 140.57 2jrs h LYS 68 Ca -0.30 -0.14 0.00 0.00 -1.87 0.00 0.00 60.65 58.35 2jrs h LYS 68 Cb 1.16 -0.18 0.00 0.00 0.08 0.00 0.00 32.23 33.29 2jrs h LYS 68 CO 1.12 0.77 0.00 0.41 -0.57 0.00 0.00 179.45 181.17 2jrs n GLY 69 N -1.09 1.20 3.16 3.86 0.00 -1.25 -4.94 105.19 106.13 2jrs n GLY 69 Ca 0.06 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.89 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 1.23 0.11 1.61 1.13 -1.26 -0.75 117.35 117.42 2jrs s TYR 70 Ca 0.00 -0.40 -0.11 0.00 -1.41 0.00 0.00 57.07 55.14 2jrs s TYR 70 Cb 0.00 -0.71 0.01 0.00 -1.10 0.00 0.00 41.96 40.16 2jrs s TYR 70 CO 0.00 0.05 0.27 0.20 -2.51 0.00 0.00 175.55 173.56 2jrs s GLY 71 N -1.44 -0.03 -0.06 5.49 0.00 0.08 -1.07 107.32 110.30 2jrs s GLY 71 Ca -0.00 -0.42 0.03 0.00 0.00 0.00 0.00 44.72 44.33 2jrs s GLY 71 CO 0.02 -0.62 -0.13 -1.36 0.00 0.00 0.00 173.10 171.01 2jrs s PHE 72 N -3.84 2.74 -0.11 1.90 0.40 0.82 -0.78 117.98 119.10 2jrs s PHE 72 Ca 0.05 -0.18 0.02 0.00 -0.60 0.00 0.00 56.93 56.22 2jrs s PHE 72 Cb 0.04 -1.66 0.01 0.00 0.51 0.00 0.00 43.02 41.92 2jrs s PHE 72 CO -0.11 0.17 -0.17 0.42 0.70 0.00 0.00 175.22 176.23 2jrs s ILE 73 N -0.64 1.62 -0.30 0.64 1.01 0.06 -0.87 121.20 122.72 2jrs s ILE 73 Ca 0.09 -0.72 -0.12 0.00 0.00 0.00 0.00 60.65 59.91 2jrs s ILE 73 Cb -0.11 -1.46 -0.04 0.00 0.01 0.00 0.00 42.46 40.86 2jrs s ILE 73 CO 0.01 0.46 0.23 -0.89 0.00 0.00 0.00 174.94 174.75 2jrs s THR 74 N 0.92 5.28 0.07 2.92 2.01 -0.44 -0.44 115.64 125.96 2jrs s THR 74 Ca -0.07 0.07 -0.00 0.00 0.31 0.00 0.00 61.69 61.99 2jrs s THR 74 Cb -0.15 -3.62 -0.04 0.00 0.01 0.00 0.00 72.50 68.70 2jrs s THR 74 CO -0.01 0.14 0.22 -0.36 -0.69 0.00 0.00 174.62 173.92 2jrs s PHE 75 N 1.79 3.52 -0.31 4.92 0.40 0.28 -0.39 117.98 128.18 2jrs s PHE 75 Ca 0.08 0.27 0.27 0.00 -0.60 0.00 0.00 56.93 56.95 2jrs s PHE 75 Cb -0.16 -1.78 0.81 0.00 0.51 0.00 0.00 43.02 42.40 2jrs s PHE 75 CO 0.11 0.58 1.77 1.03 0.70 0.00 0.00 175.22 179.40 2jrs h SER 76 N 3.04 0.00 -3.07 1.36 0.87 -1.51 -2.32 113.55 111.92 2jrs h SER 76 Ca -0.45 0.00 -0.62 0.00 -1.23 0.00 0.00 61.79 59.49 2jrs h SER 76 Cb 1.16 0.00 -0.12 0.00 -0.44 0.00 0.00 62.40 63.01 2jrs h SER 76 CO 0.76 0.00 -0.66 -0.62 -0.53 0.00 0.00 176.83 175.78 2jrs s ASP 77 N -5.61 4.86 -0.18 6.23 -1.08 -1.26 -4.31 116.67 115.32 2jrs s ASP 77 Ca 0.05 -0.31 -0.18 0.00 -0.52 0.00 0.00 52.55 51.60 2jrs s ASP 77 Cb 0.08 -1.08 -0.06 0.00 -1.46 0.00 0.00 42.92 40.40 2jrs s ASP 77 CO 0.59 0.12 -0.34 -1.54 0.52 0.00 0.00 175.17 174.52 2jrs n SER 78 N 0.15 1.92 -0.23 -0.34 3.41 -1.23 -3.46 113.62 113.84 2jrs n SER 78 Ca -0.10 0.33 -0.08 0.00 -0.26 0.00 0.00 58.87 58.75 2jrs n SER 78 Cb 0.54 -0.73 0.04 0.00 -0.26 0.00 0.00 64.21 63.80 2jrs n SER 78 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 2jrs h GLU 79 N -0.98 1.11 -0.09 4.33 5.08 -1.98 -0.72 114.58 121.33 2jrs h GLU 79 Ca -0.01 -0.31 -0.02 0.00 -1.00 0.00 0.00 59.36 58.03 2jrs h GLU 79 Cb 0.99 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 30.11 2jrs h GLU 79 CO -0.01 1.02 -0.02 0.00 -1.00 0.00 0.00 179.01 179.01 2jrs h ALA 81 N 1.85 0.75 -0.24 0.00 0.00 -1.46 -0.74 119.26 119.43 2jrs h ALA 81 Ca 0.03 -0.56 0.05 0.00 0.00 0.00 0.00 54.91 54.43 2jrs h ALA 81 Cb 0.13 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 17.79 2jrs h ALA 81 CO 0.00 0.74 -0.09 0.87 0.00 0.00 0.00 179.25 180.77 2jrs h LYS 82 N 0.24 -0.04 -0.66 0.00 6.56 -0.03 0.20 116.57 122.84 2jrs h LYS 82 Ca -0.01 0.00 -0.06 0.00 -1.06 0.00 0.00 60.65 59.52 2jrs h LYS 82 Cb 1.17 0.01 -0.03 0.00 -0.57 0.00 0.00 32.23 32.81 2jrs h LYS 82 CO 0.10 -0.03 0.17 -0.22 -2.06 0.00 0.00 179.45 177.41 2jrs h LYS 83 N -0.04 1.05 -0.89 3.15 3.64 -1.32 -1.82 116.57 120.34 2jrs h LYS 83 Ca 0.12 -0.25 0.11 0.00 -1.27 0.00 0.00 60.65 59.37 2jrs h LYS 83 Cb 0.23 -0.14 -0.08 0.00 -0.41 0.00 0.00 32.23 31.83 2jrs h LYS 83 CO -0.27 0.93 0.52 0.00 -2.27 0.00 0.00 179.45 178.36 2jrs h ALA 84 N 1.07 1.31 0.60 5.00 0.00 -0.67 0.25 119.26 126.80 2jrs h ALA 84 Ca 0.21 0.04 -0.03 0.00 0.00 0.00 0.00 54.91 55.13 2jrs h ALA 84 Cb 0.35 -0.13 0.01 0.00 0.00 0.00 0.00 17.79 18.01 2jrs h ALA 84 CO 0.00 0.10 -0.29 1.25 0.00 0.00 0.00 179.25 180.32 2jrs h LEU 85 N 0.82 -0.68 -1.70 0.00 6.46 -0.61 -2.42 115.31 117.18 2jrs h LEU 85 Ca 0.44 0.02 0.00 0.00 -0.12 0.00 0.00 57.88 58.23 2jrs h LEU 85 Cb 0.46 0.18 0.00 0.00 -0.73 0.00 0.00 40.66 40.57 2jrs h LEU 85 CO -0.28 -0.41 0.00 1.05 -0.62 0.00 0.00 178.44 178.18 2jrs h GLU 86 N -0.94 0.00 0.16 1.25 4.11 -1.13 -2.36 114.58 115.67 2jrs h GLU 86 Ca -0.08 0.00 -0.34 0.00 0.07 0.00 0.00 59.36 59.01 2jrs h GLU 86 Cb 0.61 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.87 2jrs h GLU 86 CO 0.13 0.00 -1.70 0.37 0.07 0.00 0.00 179.01 177.89 2jrs h GLN 87 N 0.00 0.34 0.00 1.06 5.75 -0.54 -3.40 115.11 118.32 2jrs h GLN 87 Ca 0.00 -0.59 0.00 0.00 -0.15 0.00 0.00 58.65 57.91 2jrs h GLN 87 Cb 0.29 0.22 0.00 0.00 1.07 0.00 0.00 27.48 29.06 2jrs h GLN 87 CO 0.00 1.28 -1.15 1.28 -2.65 0.00 0.00 178.83 177.59 2jrs n LEU 88 N -3.67 0.66 -4.58 -2.39 4.77 -0.91 -4.70 117.00 106.18 2jrs n LEU 88 Ca -0.26 -0.22 -0.22 0.00 -0.03 0.00 0.00 56.01 55.28 2jrs n LEU 88 Cb 1.03 -0.05 -0.08 0.00 -2.33 0.00 0.00 43.42 41.98 2jrs n LEU 88 CO 0.48 0.13 1.31 0.54 -1.33 0.00 0.00 177.39 178.51 2jrs s ASN 89 N -3.56 4.29 0.00 -1.43 2.20 -0.91 -0.88 114.94 114.65 2jrs s ASN 89 Ca 0.04 -1.26 0.00 0.00 -0.94 0.00 0.00 52.86 50.70 2jrs s ASN 89 Cb 0.15 -2.59 0.00 0.00 -2.00 0.00 0.00 41.25 36.81 2jrs s ASN 89 CO 0.84 -3.84 0.00 0.61 -2.94 0.00 0.00 177.10 171.77 2jrs n GLY 90 N 6.04 0.66 3.74 0.45 0.00 0.96 -4.86 105.19 112.18 2jrs n GLY 90 Ca 0.43 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 46.04 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 0.00 3.04 -0.60 1.61 5.36 -0.06 -4.35 117.98 122.99 2jrs s PHE 91 Ca 0.00 1.05 -0.26 0.00 -0.96 0.00 0.00 56.93 56.76 2jrs s PHE 91 Cb 0.00 -3.80 0.04 0.00 -0.34 0.00 0.00 43.02 38.92 2jrs s PHE 91 CO 0.00 -2.59 1.10 -1.21 -1.46 0.00 0.00 175.22 171.06 2jrs s GLU 92 N -0.37 3.38 -0.21 10.12 2.02 -1.26 0.97 118.70 133.36 2jrs s GLU 92 Ca 0.59 -0.06 -0.09 0.00 0.02 0.00 0.00 54.97 55.43 2jrs s GLU 92 Cb -0.41 -4.06 -0.05 0.00 0.10 0.00 0.00 34.13 29.71 2jrs s GLU 92 CO 0.43 -1.68 0.11 -1.17 0.02 0.00 0.00 175.26 172.97 2jrs s LEU 93 N 4.65 4.01 -2.00 1.80 2.96 0.10 -4.33 118.68 125.87 2jrs s LEU 93 Ca 0.36 0.13 0.00 0.00 -0.22 0.00 0.00 54.13 54.40 2jrs s LEU 93 Cb -0.10 -2.04 0.00 0.00 0.50 0.00 0.00 46.19 44.55 2jrs s LEU 93 CO 0.21 0.14 0.00 0.00 -1.32 0.00 0.00 176.35 175.38 2jrs n ALA 94 N 3.78 -0.38 -0.71 5.97 0.00 -1.26 -1.25 120.51 126.66 2jrs n ALA 94 Ca -0.16 0.28 0.00 0.00 0.00 0.00 0.00 53.44 53.56 2jrs n ALA 94 Cb 0.52 -2.02 0.00 0.00 0.00 0.00 0.00 19.45 17.95 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 -0.66 0.63 2.92 0.00 0.00 -1.26 -5.06 105.19 101.76 2jrs n GLY 95 Ca -0.21 -0.16 -0.18 0.00 0.00 0.00 0.00 46.02 45.47 2jrs n GLY 95 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2jrs s ARG 96 N -0.52 0.65 0.38 1.61 3.52 -0.38 -5.05 118.95 119.16 2jrs s ARG 96 Ca 0.00 -0.14 -0.26 0.00 -0.13 0.00 0.00 55.73 55.20 2jrs s ARG 96 Cb 0.00 -0.66 -0.11 0.00 -1.56 0.00 0.00 34.95 32.61 2jrs s ARG 96 CO 0.00 0.01 1.11 -0.35 -0.81 0.00 0.00 175.30 175.27 2jrs n PRO 97 N 3.57 1.61 -3.49 5.12 -0.04 -1.26 0.02 135.00 140.53 2jrs n PRO 97 Ca -0.20 0.57 -0.41 0.00 -0.04 0.00 0.00 63.50 63.42 2jrs n PRO 97 Cb 0.54 -2.13 -0.10 0.00 -0.04 0.00 0.00 33.50 31.76 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 -1.95 3.42 -0.71 0.54 1.75 0.27 -4.76 119.30 117.87 2jrs s MET 98 Ca 0.60 -0.66 -0.21 0.00 -1.25 0.00 0.00 55.69 54.18 2jrs s MET 98 Cb -0.57 -3.84 0.09 0.00 2.84 0.00 0.00 34.83 33.35 2jrs s MET 98 CO 0.59 -0.52 0.95 0.15 -0.65 0.00 0.00 175.02 175.54 2jrs s LYS 99 N 1.79 3.20 -0.20 4.11 1.02 -1.26 -0.03 119.74 128.37 2jrs s LYS 99 Ca 0.07 -1.13 -0.08 0.00 0.02 0.00 0.00 55.97 54.85 2jrs s LYS 99 Cb -0.17 -4.38 -0.04 0.00 -0.52 0.00 0.00 37.83 32.71 2jrs s LYS 99 CO 0.11 -1.76 0.07 0.08 -0.92 0.00 0.00 175.35 172.93 2jrs s VAL 100 N 3.50 4.74 0.10 3.17 1.01 -1.26 -1.67 120.40 129.98 2jrs s VAL 100 Ca 0.22 -0.05 -0.12 0.00 0.00 0.00 0.00 61.98 62.03 2jrs s VAL 100 Cb -0.16 -3.16 0.02 0.00 0.00 0.00 0.00 36.38 33.08 2jrs s VAL 100 CO 0.05 0.42 0.29 -0.83 0.00 0.00 0.00 175.10 175.03 2jrs s GLY 101 N 0.68 -0.08 0.62 4.51 0.00 0.00 -4.65 107.32 108.41 2jrs s GLY 101 Ca 0.04 -0.32 -0.15 0.00 0.00 0.00 0.00 44.72 44.29 2jrs s GLY 101 CO 0.02 -0.54 1.08 -2.38 0.00 0.00 0.00 173.10 171.28 2jrs s HIS 102 N -3.68 2.84 -0.65 1.90 -3.43 -1.26 -0.00 115.29 111.01 2jrs s HIS 102 Ca 0.03 1.52 -0.26 0.00 -0.80 0.00 0.00 55.06 55.56 2jrs s HIS 102 Cb 0.03 -3.07 -0.12 0.00 -1.43 0.00 0.00 32.58 28.00 2jrs s HIS 102 CO -0.11 -1.35 2.43 0.28 -2.00 0.00 0.00 174.74 173.99 2jrs n VAL 103 N -2.23 -0.05 -1.68 -5.38 0.31 -1.25 -4.75 118.33 103.30 2jrs n VAL 103 Ca 0.09 -0.64 -0.09 0.00 -0.01 0.00 0.00 64.34 63.69 2jrs n VAL 103 Cb 0.52 -2.27 0.06 0.00 -0.91 0.00 0.00 33.84 31.25 2jrs n VAL 103 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 2jrs n THR 104 N 8.18 0.00 -3.29 2.52 -2.24 -1.26 -5.11 114.28 113.07 2jrs n THR 104 Ca 0.44 -0.41 -0.19 0.00 -2.27 0.00 0.00 64.05 61.62 2jrs n THR 104 Cb 0.46 -1.62 -0.01 0.00 -2.10 0.00 0.00 70.33 67.06 2jrs n THR 104 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2jrs s GLU 105 N -3.77 2.72 -0.05 -0.78 2.02 -1.26 -4.97 118.70 112.62 2jrs s GLU 105 Ca 0.25 -1.35 -0.04 0.00 0.02 0.00 0.00 54.97 53.85 2jrs s GLU 105 Cb -0.01 -2.60 0.01 0.00 0.10 0.00 0.00 34.13 31.64 2jrs s GLU 105 CO 0.17 -0.20 0.08 -2.13 0.02 0.00 0.00 175.26 173.19 2jrs n ARG 106 N -1.70 -3.95 -3.00 1.61 3.00 -1.26 -4.94 116.66 106.42 2jrs n ARG 106 Ca 0.05 3.00 -0.43 0.00 -0.00 0.00 0.00 57.85 60.48 2jrs n ARG 106 Cb 0.60 -3.99 -0.06 0.00 0.00 0.00 0.00 32.46 29.01 2jrs n ARG 106 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.63 178.62 2jrs s THR 107 N -0.49 4.70 -1.42 5.15 2.01 -1.26 -5.28 115.64 119.04 2jrs s THR 107 Ca -0.09 0.35 0.00 0.00 0.31 0.00 0.00 61.69 62.26 2jrs s THR 107 Cb 0.01 -4.29 0.00 0.00 0.01 0.00 0.00 72.50 68.23 2jrs s THR 107 CO 0.24 -0.68 0.35 -0.67 -0.69 0.00 0.00 174.62 173.18