#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jrs s GLY 2 N 0.00 -0.89 0.00 3.17 0.00 -1.26 -4.77 107.32 103.58 2jrs s GLY 2 Ca 0.00 -1.38 0.00 0.00 0.00 0.00 0.00 44.72 43.34 2jrs s GLY 2 CO 0.00 4.18 0.00 1.42 0.00 0.00 0.00 173.10 178.70 2jrs n HIS 3 N 18.74 0.00 -3.39 1.90 -0.00 -1.26 -3.97 115.22 127.24 2jrs n HIS 3 Ca 0.43 0.00 -0.16 0.00 -0.00 0.00 0.00 57.72 57.98 2jrs n HIS 3 Cb 0.46 0.00 -0.09 0.00 -0.00 0.00 0.00 29.99 30.36 2jrs n HIS 3 CO 0.00 0.00 0.00 -1.01 -0.00 0.00 0.00 176.34 175.33 2jrs s HIS 4 N 0.00 -0.51 -1.53 4.41 4.02 -1.26 -5.06 115.29 115.36 2jrs s HIS 4 Ca 0.00 -0.15 -0.12 0.00 1.02 0.00 0.00 55.06 55.81 2jrs s HIS 4 Cb 0.00 -0.44 -0.01 0.00 -1.02 0.00 0.00 32.58 31.11 2jrs s HIS 4 CO 0.00 -0.93 2.55 1.58 1.02 0.00 0.00 174.74 178.96 2jrs n HIS 5 N 5.29 3.01 -0.44 1.40 -0.00 -1.25 -4.75 115.22 118.48 2jrs n HIS 5 Ca -0.02 -3.03 -0.03 0.00 -0.00 0.00 0.00 57.72 54.65 2jrs n HIS 5 Cb 0.47 -2.50 0.01 0.00 -0.00 0.00 0.00 29.99 27.96 2jrs n HIS 5 CO 0.00 0.00 0.00 -2.39 -0.00 0.00 0.00 176.34 173.95 2jrs n HIS 6 N 4.85 0.29 -2.09 1.57 -0.00 -1.26 -4.86 115.22 113.72 2jrs n HIS 6 Ca 0.64 -1.13 -0.28 0.00 -0.00 0.00 0.00 57.72 56.95 2jrs n HIS 6 Cb 0.32 -0.56 -0.05 0.00 -0.00 0.00 0.00 29.99 29.69 2jrs n HIS 6 CO 0.00 0.00 0.00 -1.58 -0.00 0.00 0.00 176.34 174.76 2jrs s HIS 7 N -0.34 1.91 0.00 -1.40 2.46 -1.26 -4.23 115.29 112.43 2jrs s HIS 7 Ca 0.06 0.47 0.00 0.00 0.47 0.00 0.00 55.06 56.05 2jrs s HIS 7 Cb 0.05 -4.07 0.00 0.00 -0.13 0.00 0.00 32.58 28.42 2jrs s HIS 7 CO 0.00 -1.57 0.13 -2.39 -2.47 0.00 0.00 174.74 168.44 2jrs n HIS 8 N 13.79 0.00 -1.25 3.88 -0.00 -1.26 -5.17 115.22 125.22 2jrs n HIS 8 Ca 0.42 0.00 0.16 0.00 -0.00 0.00 0.00 57.72 58.30 2jrs n HIS 8 Cb 0.47 0.11 -0.06 0.00 -0.00 0.00 0.00 29.99 30.51 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 0.00 -7.49 -4.57 4.39 7.64 -1.26 -4.44 113.62 107.89 2jrs n SER 9 Ca 0.00 0.81 -0.33 0.00 1.01 0.00 0.00 58.87 60.36 2jrs n SER 9 Cb 0.50 -3.98 -0.04 0.00 -1.01 0.00 0.00 64.21 59.67 2jrs n SER 9 CO 0.00 0.00 0.00 -1.38 -3.01 0.00 0.00 175.04 170.65 2jrs s HIS 10 N -2.87 2.18 0.11 1.43 -0.00 -1.26 -4.81 115.29 110.08 2jrs s HIS 10 Ca 0.00 -0.15 -0.20 0.00 -0.00 0.00 0.00 55.06 54.71 2jrs s HIS 10 Cb 0.00 -4.30 -0.08 0.00 -0.00 0.00 0.00 32.58 28.20 2jrs s HIS 10 CO 0.00 -1.64 1.75 1.98 -0.00 0.00 0.00 174.74 176.84 2jrs h MET 11 N 9.82 0.14 0.00 -0.38 1.85 -2.02 -3.34 114.93 120.99 2jrs h MET 11 Ca 0.22 -0.01 0.00 0.00 -0.61 0.00 0.00 59.70 59.30 2jrs h MET 11 Cb 0.96 -0.03 0.00 0.00 0.43 0.00 0.00 31.60 32.96 2jrs h MET 11 CO 1.31 0.09 0.00 0.00 -0.40 0.00 0.00 176.91 177.91 2jrs n ALA 12 N -2.18 -0.29 -1.42 0.39 0.00 -1.26 -4.88 120.51 110.87 2jrs n ALA 12 Ca -0.04 0.00 -0.15 0.00 0.00 0.00 0.00 53.44 53.25 2jrs n ALA 12 Cb 0.05 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.44 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 -1.75 -0.23 -2.77 0.00 0.00 -1.26 -4.96 120.51 109.55 2jrs n ALA 13 Ca 0.00 0.24 -0.32 0.00 0.00 0.00 0.00 53.44 53.36 2jrs n ALA 13 Cb 0.00 -1.82 -0.07 0.00 0.00 0.00 0.00 19.45 17.56 2jrs n ALA 13 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jrs s ALA 14 N -2.25 3.54 -0.14 0.00 0.00 -1.26 -5.11 121.76 116.54 2jrs s ALA 14 Ca 0.00 -0.94 -0.13 0.00 0.00 0.00 0.00 51.96 50.88 2jrs s ALA 14 Cb 0.00 -1.48 -0.05 0.00 0.00 0.00 0.00 23.12 21.59 2jrs s ALA 14 CO 0.00 0.71 0.28 -1.64 0.00 0.00 0.00 175.76 175.11 2jrs s MET 15 N -2.01 4.15 -1.24 0.00 1.00 -1.26 -5.02 119.30 114.92 2jrs s MET 15 Ca 0.25 0.09 -0.15 0.00 0.00 0.00 0.00 55.69 55.88 2jrs s MET 15 Cb -0.12 -3.39 0.13 0.00 0.00 0.00 0.00 34.83 31.46 2jrs s MET 15 CO 0.17 0.33 1.54 0.00 0.00 0.00 0.00 175.02 177.06 2jrs s ALA 16 N 0.19 3.74 -0.36 3.03 0.00 -1.26 -4.88 121.76 122.23 2jrs s ALA 16 Ca 0.17 -3.19 -0.00 0.00 0.00 0.00 0.00 51.96 48.93 2jrs s ALA 16 Cb -0.13 -4.32 0.12 0.00 0.00 0.00 0.00 23.12 18.79 2jrs s ALA 16 CO 0.04 -2.97 0.18 -0.80 0.00 0.00 0.00 175.76 172.21 2jrs s ASN 17 N 3.36 3.53 -0.01 0.00 -0.87 -1.26 -5.03 114.94 114.66 2jrs s ASN 17 Ca 0.47 -2.03 -0.00 0.00 -1.57 0.00 0.00 52.86 49.72 2jrs s ASN 17 Cb -0.00 -0.69 -0.00 0.00 -0.02 0.00 0.00 41.25 40.53 2jrs s ASN 17 CO 0.03 -0.34 0.11 -0.55 -2.57 0.00 0.00 177.10 173.78 2jrs h ASN 18 N 7.43 -0.01 0.00 -1.22 7.08 -2.00 -3.45 115.58 123.41 2jrs h ASN 18 Ca -0.05 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.17 2jrs h ASN 18 Cb 0.98 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 37.22 2jrs h ASN 18 CO 0.41 0.02 0.00 -0.11 -2.08 0.00 0.00 177.43 175.67 2jrs n LEU 19 N -2.19 0.00 0.00 6.14 7.94 -1.26 -0.63 117.00 127.00 2jrs n LEU 19 Ca -0.00 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.90 2jrs n LEU 19 Cb 0.00 0.00 0.00 0.00 0.53 0.00 0.00 43.42 43.95 2jrs n LEU 19 CO 0.00 0.00 0.05 0.00 -1.11 0.00 0.00 177.39 176.33 2jrs n GLN 20 N 0.00 0.00 -0.01 1.96 -0.00 -1.26 -4.76 117.38 113.30 2jrs n GLN 20 Ca 0.00 -0.09 -0.16 0.00 -0.00 0.00 0.00 57.00 56.74 2jrs n GLN 20 Cb 0.00 -0.28 -0.10 0.00 -0.00 0.00 0.00 30.24 29.86 2jrs n GLN 20 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.06 176.84 2jrs h LYS 21 N 0.00 0.40 -2.89 2.61 3.64 -1.19 -3.35 116.57 115.78 2jrs h LYS 21 Ca 0.00 -0.38 -0.64 0.00 -1.27 0.00 0.00 60.65 58.36 2jrs h LYS 21 Cb 0.67 0.09 0.01 0.00 -0.41 0.00 0.00 32.23 32.59 2jrs h LYS 21 CO 0.00 1.03 3.43 0.41 -2.27 0.00 0.00 179.45 182.05 2jrs n GLY 22 N 0.90 4.24 5.53 5.01 0.00 -1.25 -4.89 105.19 114.73 2jrs n GLY 22 Ca -0.09 -1.53 0.00 0.00 0.00 0.00 0.00 46.02 44.40 2jrs n GLY 22 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2jrs n SER 23 N 3.34 0.00 -4.14 1.61 3.41 -1.26 -4.39 113.62 112.19 2jrs n SER 23 Ca 0.75 0.00 -0.23 0.00 -0.26 0.00 0.00 58.87 59.13 2jrs n SER 23 Cb 0.28 0.00 -0.15 0.00 -0.26 0.00 0.00 64.21 64.08 2jrs n SER 23 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2jrs s ALA 24 N -1.00 1.29 0.14 7.33 0.00 -1.26 -4.90 121.76 123.36 2jrs s ALA 24 Ca 0.00 -0.70 0.03 0.00 0.00 0.00 0.00 51.96 51.30 2jrs s ALA 24 Cb 0.00 -0.31 -0.01 0.00 0.00 0.00 0.00 23.12 22.80 2jrs s ALA 24 CO 0.00 0.31 0.12 0.41 0.00 0.00 0.00 175.76 176.59 2jrs n GLY 25 N 2.58 3.57 3.67 0.00 0.00 -1.26 -5.09 105.19 108.66 2jrs n GLY 25 Ca -0.15 -1.76 -0.47 0.00 0.00 0.00 0.00 46.02 43.64 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 -0.26 2.12 -3.84 1.61 -0.02 -1.26 -4.45 135.00 128.90 2jrs n PRO 26 Ca 0.03 0.77 -0.36 0.00 -2.02 0.00 0.00 63.50 61.91 2jrs n PRO 26 Cb 0.25 -2.55 -0.06 0.00 -0.02 0.00 0.00 33.50 31.13 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 1.46 3.50 -0.11 -0.52 1.75 -1.10 -4.84 119.30 119.44 2jrs s MET 27 Ca 0.81 -0.10 0.01 0.00 -1.25 0.00 0.00 55.69 55.17 2jrs s MET 27 Cb -0.69 -3.17 -0.01 0.00 2.84 0.00 0.00 34.83 33.80 2jrs s MET 27 CO 0.41 0.74 -0.16 0.50 -0.65 0.00 0.00 175.02 175.86 2jrs s ARG 28 N -1.23 3.21 0.01 4.11 3.52 -1.26 -0.71 118.95 126.60 2jrs s ARG 28 Ca 0.19 -0.74 0.02 0.00 -0.13 0.00 0.00 55.73 55.06 2jrs s ARG 28 Cb -0.13 -2.52 -0.04 0.00 -1.56 0.00 0.00 34.95 30.71 2jrs s ARG 28 CO 0.08 0.24 0.01 -0.51 -0.81 0.00 0.00 175.30 174.31 2jrs s LEU 29 N 0.24 3.54 -0.39 -0.88 1.43 0.28 -3.31 118.68 119.59 2jrs s LEU 29 Ca -0.11 -0.01 -0.16 0.00 -1.03 0.00 0.00 54.13 52.81 2jrs s LEU 29 Cb -0.16 -2.06 0.01 0.00 0.03 0.00 0.00 46.19 44.01 2jrs s LEU 29 CO 0.06 0.27 0.39 -0.47 0.23 0.00 0.00 176.35 176.83 2jrs s TYR 30 N -1.12 3.19 -0.39 0.29 5.04 0.83 -0.64 117.35 124.55 2jrs s TYR 30 Ca 0.21 -0.29 -0.09 0.00 -2.44 0.00 0.00 57.07 54.45 2jrs s TYR 30 Cb -0.12 -2.78 0.06 0.00 0.35 0.00 0.00 41.96 39.47 2jrs s TYR 30 CO 0.12 -0.60 0.22 0.08 -1.34 0.00 0.00 175.55 174.03 2jrs s VAL 31 N 2.04 4.30 -0.46 3.14 1.01 0.42 -0.84 120.40 130.01 2jrs s VAL 31 Ca 0.11 -1.17 -0.02 0.00 0.00 0.00 0.00 61.98 60.89 2jrs s VAL 31 Cb -0.17 -3.52 0.12 0.00 0.00 0.00 0.00 36.38 32.81 2jrs s VAL 31 CO 0.12 -0.37 0.25 -0.83 0.00 0.00 0.00 175.10 174.28 2jrs s GLY 32 N 1.82 2.12 0.00 4.51 0.00 0.57 -1.04 107.32 115.30 2jrs s GLY 32 Ca 0.02 -2.72 0.00 0.00 0.00 0.00 0.00 44.72 42.01 2jrs s GLY 32 CO 0.04 1.04 0.07 -1.26 0.00 0.00 0.00 173.10 172.99 2jrs n SER 33 N 4.29 0.00 -4.50 1.64 2.88 -1.01 -1.21 113.62 115.71 2jrs n SER 33 Ca 0.00 -0.26 -0.43 0.00 -1.33 0.00 0.00 58.87 56.86 2jrs n SER 33 Cb 0.40 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.84 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 4.43 -1.36 2.46 1.43 0.43 -4.85 118.68 121.22 2jrs s LEU 34 Ca 0.00 -1.93 -0.15 0.00 -1.03 0.00 0.00 54.13 51.02 2jrs s LEU 34 Cb 0.00 -2.47 0.00 0.00 0.03 0.00 0.00 46.19 43.75 2jrs s LEU 34 CO 0.00 -1.20 2.23 0.00 0.23 0.00 0.00 176.35 177.60 2jrs n HIS 35 N 7.41 3.20 -0.87 0.29 1.44 -1.26 -4.12 115.22 121.31 2jrs n HIS 35 Ca 0.30 -2.80 0.00 0.00 -2.01 0.00 0.00 57.72 53.21 2jrs n HIS 35 Cb 0.49 -2.42 0.00 0.00 0.12 0.00 0.00 29.99 28.18 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 6.13 0.00 0.00 -1.40 7.35 -1.26 -4.61 117.46 123.67 2jrs n PHE 36 Ca 0.53 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 57.22 2jrs n PHE 36 Cb 0.38 -1.81 0.00 0.00 0.35 0.00 0.00 39.48 38.40 2jrs n PHE 36 CO 0.00 0.00 0.00 0.27 -0.76 0.00 0.00 176.76 176.27 2jrs n ASN 37 N -0.52 3.25 -4.74 -2.13 6.94 -1.26 -5.06 115.26 111.75 2jrs n ASN 37 Ca 0.00 0.00 -0.41 0.00 -0.02 0.00 0.00 54.58 54.15 2jrs n ASN 37 Cb 0.43 0.04 -0.03 0.00 -2.36 0.00 0.00 39.78 37.86 2jrs n ASN 37 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 2jrs s ILE 38 N -1.79 2.97 0.36 1.53 1.01 -1.26 -5.03 121.20 118.99 2jrs s ILE 38 Ca 0.00 0.79 0.08 0.00 0.00 0.00 0.00 60.65 61.52 2jrs s ILE 38 Cb 0.00 -3.50 -0.04 0.00 0.01 0.00 0.00 42.46 38.93 2jrs s ILE 38 CO 0.00 0.11 0.21 0.42 0.00 0.00 0.00 174.94 175.68 2jrs s THR 39 N 0.20 3.02 0.30 2.92 -4.23 -1.26 -4.94 115.64 111.65 2jrs s THR 39 Ca 0.59 -1.58 0.00 0.00 -1.18 0.00 0.00 61.69 59.52 2jrs s THR 39 Cb -0.39 -3.03 0.18 0.00 1.34 0.00 0.00 72.50 70.60 2jrs s THR 39 CO 0.39 -0.14 1.87 -0.33 -0.54 0.00 0.00 174.62 175.87 2jrs h GLU 40 N 1.40 0.79 -0.21 3.99 3.07 -1.97 -1.58 114.58 120.08 2jrs h GLU 40 Ca -0.44 -0.14 -0.08 0.00 -0.50 0.00 0.00 59.36 58.20 2jrs h GLU 40 Cb 1.25 -0.13 -0.01 0.00 -0.84 0.00 0.00 28.75 29.02 2jrs h GLU 40 CO 0.62 0.69 -0.23 0.38 -1.40 0.00 0.00 179.01 179.06 2jrs h ASP 41 N 0.77 0.38 -0.26 1.42 3.04 -2.00 -1.48 116.42 118.29 2jrs h ASP 41 Ca 0.18 -0.12 -0.07 0.00 -3.24 0.00 0.00 57.03 53.78 2jrs h ASP 41 Cb 0.22 -0.10 -0.01 0.00 -1.04 0.00 0.00 39.33 38.41 2jrs h ASP 41 CO -0.01 0.62 -0.11 -0.03 -2.04 0.00 0.00 179.24 177.67 2jrs h MET 42 N 0.34 0.54 0.16 4.15 4.05 -1.83 -2.50 114.93 119.85 2jrs h MET 42 Ca 0.05 -0.23 0.02 0.00 -0.28 0.00 0.00 59.70 59.26 2jrs h MET 42 Cb 0.60 -0.02 -0.03 0.00 -0.80 0.00 0.00 31.60 31.35 2jrs h MET 42 CO 0.04 0.79 -0.30 -0.07 0.23 0.00 0.00 176.91 177.60 2jrs h LEU 43 N 0.27 -0.85 -1.52 3.39 3.38 -0.97 -2.33 115.31 116.69 2jrs h LEU 43 Ca 0.06 0.09 -0.02 0.00 0.09 0.00 0.00 57.88 58.10 2jrs h LEU 43 Cb 0.62 0.32 -0.02 0.00 0.09 0.00 0.00 40.66 41.67 2jrs h LEU 43 CO 0.04 -0.40 0.09 0.08 0.09 0.00 0.00 178.44 178.34 2jrs h ARG 44 N -0.54 0.41 -0.81 1.13 0.11 -1.34 0.75 114.38 114.08 2jrs h ARG 44 Ca 0.02 -0.05 0.10 0.00 0.10 0.00 0.00 59.98 60.15 2jrs h ARG 44 Cb 0.55 -0.08 -0.06 0.00 1.11 0.00 0.00 29.97 31.50 2jrs h ARG 44 CO -0.15 0.36 0.53 0.78 0.10 0.00 0.00 179.97 181.59 2jrs h GLY 45 N 0.59 1.08 0.07 0.08 0.00 -0.95 0.55 103.07 104.48 2jrs h GLY 45 Ca 0.10 -0.31 -0.15 0.00 0.00 0.00 0.00 47.33 46.97 2jrs h GLY 45 CO -0.01 0.18 -0.78 -2.22 0.00 0.00 0.00 176.54 173.71 2jrs h ILE 46 N 0.75 1.28 0.06 2.60 2.04 -0.88 -3.42 117.51 119.94 2jrs h ILE 46 Ca 0.37 -2.27 -0.26 0.00 1.00 0.00 0.00 64.86 63.70 2jrs h ILE 46 Cb 0.44 2.75 -0.02 0.00 -0.74 0.00 0.00 36.82 39.24 2jrs h ILE 46 CO -0.14 0.48 -1.27 -0.26 0.00 0.00 0.00 178.15 176.95 2jrs h PHE 47 N -0.91 0.22 -0.66 1.37 -1.00 -0.82 -3.37 116.94 111.77 2jrs h PHE 47 Ca -0.21 -0.16 -0.02 0.00 2.81 0.00 0.00 57.97 60.39 2jrs h PHE 47 Cb 1.24 -0.01 -0.03 0.00 3.61 0.00 0.00 35.95 40.76 2jrs h PHE 47 CO 0.17 1.16 0.34 1.49 -1.61 0.00 0.00 178.31 179.85 2jrs h GLU 48 N 0.03 0.94 0.00 1.51 4.81 -1.09 -2.45 114.58 118.33 2jrs h GLU 48 Ca -0.13 -0.13 0.00 0.00 -0.13 0.00 0.00 59.36 58.97 2jrs h GLU 48 Cb 1.91 -0.17 0.00 0.00 0.63 0.00 0.00 28.75 31.11 2jrs h GLU 48 CO 0.15 0.73 0.56 -1.35 -0.73 0.00 0.00 179.01 178.37 2jrs h PRO 49 N 0.91 0.00 0.08 0.92 0.11 -1.76 0.11 132.00 132.37 2jrs h PRO 49 Ca 0.23 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.33 2jrs h PRO 49 Cb 0.09 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.20 2jrs h PRO 49 CO -0.03 0.00 -0.04 0.74 -0.21 0.00 0.00 178.00 178.46 2jrs h PHE 50 N 0.00 -0.10 0.00 0.65 0.04 -1.70 -3.44 116.94 112.38 2jrs h PHE 50 Ca 0.00 -0.00 -0.10 0.00 2.80 0.00 0.00 57.97 60.67 2jrs h PHE 50 Cb 1.12 0.03 -0.08 0.00 2.20 0.00 0.00 35.95 39.22 2jrs h PHE 50 CO 0.00 0.40 -0.08 0.41 -0.60 0.00 0.00 178.31 178.44 2jrs n GLY 51 N 0.42 0.25 1.42 -1.45 0.00 -0.52 -4.90 105.19 100.40 2jrs n GLY 51 Ca -0.08 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 45.87 2jrs n GLY 51 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jrs n ARG 52 N -0.65 -3.94 -5.19 1.61 1.74 0.25 -3.75 116.66 106.74 2jrs n ARG 52 Ca -0.12 2.98 -0.32 0.00 -0.77 0.00 0.00 57.85 59.62 2jrs n ARG 52 Cb 0.69 -3.49 -0.16 0.00 -1.02 0.00 0.00 32.46 28.48 2jrs n ARG 52 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 2jrs s ILE 53 N -4.06 2.21 -0.13 0.55 1.01 -1.26 -1.84 121.20 117.68 2jrs s ILE 53 Ca 0.00 -1.00 -0.11 0.00 0.00 0.00 0.00 60.65 59.54 2jrs s ILE 53 Cb 0.00 -1.83 -0.09 0.00 0.01 0.00 0.00 42.46 40.55 2jrs s ILE 53 CO 0.00 0.56 0.19 -0.33 0.00 0.00 0.00 174.94 175.36 2jrs h GLU 54 N 6.25 0.00 -2.84 2.79 4.39 -1.31 -3.45 114.58 120.41 2jrs h GLU 54 Ca -0.29 0.00 -0.13 0.00 0.34 0.00 0.00 59.36 59.28 2jrs h GLU 54 Cb 1.19 0.00 -0.25 0.00 -0.10 0.00 0.00 28.75 29.60 2jrs h GLU 54 CO 0.48 0.35 -0.30 -1.54 -1.16 0.00 0.00 179.01 176.84 2jrs s SER 55 N -5.88 -0.39 -0.28 1.42 1.04 -1.13 -5.05 113.70 103.43 2jrs s SER 55 Ca -0.10 0.74 -0.07 0.00 0.48 0.00 0.00 55.95 57.00 2jrs s SER 55 Cb 0.00 0.73 -0.00 0.00 0.10 0.00 0.00 66.02 66.85 2jrs s SER 55 CO 0.27 -0.14 0.08 -0.63 0.98 0.00 0.00 173.24 173.80 2jrs s ILE 56 N 0.39 4.07 -0.34 -1.02 1.01 -1.26 -0.88 121.20 123.17 2jrs s ILE 56 Ca -0.02 -0.54 -0.13 0.00 0.00 0.00 0.00 60.65 59.96 2jrs s ILE 56 Cb -0.04 -3.04 -0.02 0.00 0.01 0.00 0.00 42.46 39.38 2jrs s ILE 56 CO -0.02 0.15 0.26 -1.10 0.00 0.00 0.00 174.94 174.24 2jrs s GLN 57 N 1.53 3.55 -0.14 2.79 -0.21 0.65 -5.00 119.66 122.83 2jrs s GLN 57 Ca 0.04 -0.57 -0.12 0.00 0.02 0.00 0.00 55.36 54.73 2jrs s GLN 57 Cb -0.17 -3.80 -0.05 0.00 1.00 0.00 0.00 33.01 30.00 2jrs s GLN 57 CO 0.03 -0.44 0.25 -1.17 -2.12 0.00 0.00 175.29 171.84 2jrs s LEU 58 N 1.79 4.30 -0.64 2.90 2.96 -1.26 0.12 118.68 128.85 2jrs s LEU 58 Ca 0.07 0.52 -0.20 0.00 -0.22 0.00 0.00 54.13 54.30 2jrs s LEU 58 Cb -0.17 -2.30 0.10 0.00 0.50 0.00 0.00 46.19 44.32 2jrs s LEU 58 CO 0.11 0.20 0.82 -0.32 -1.32 0.00 0.00 176.35 175.84 2jrs s MET 59 N -0.05 3.11 0.06 1.98 -2.45 -0.34 -4.91 119.30 116.69 2jrs s MET 59 Ca 0.16 -1.20 0.04 0.00 -1.25 0.00 0.00 55.69 53.44 2jrs s MET 59 Cb -0.13 -4.29 -0.03 0.00 1.25 0.00 0.00 34.83 31.63 2jrs s MET 59 CO 0.04 -1.65 -0.12 0.00 1.05 0.00 0.00 175.02 174.34 2jrs s MET 60 N 3.11 0.75 -0.81 4.11 0.23 -1.26 -2.90 119.30 122.54 2jrs s MET 60 Ca 0.16 -0.87 -0.25 0.00 -1.03 0.00 0.00 55.69 53.70 2jrs s MET 60 Cb -0.20 -0.70 -0.07 0.00 -1.53 0.00 0.00 34.83 32.33 2jrs s MET 60 CO 0.06 0.16 2.07 -0.51 -2.03 0.00 0.00 175.02 174.77 2jrs s ASP 61 N -1.60 4.82 0.00 -1.18 1.01 1.00 -4.76 116.67 115.97 2jrs s ASP 61 Ca -0.03 -0.24 0.00 0.00 0.71 0.00 0.00 52.55 52.99 2jrs s ASP 61 Cb -0.10 -2.55 0.00 0.00 1.01 0.00 0.00 42.92 41.29 2jrs s ASP 61 CO 0.02 -2.96 0.87 -1.20 0.21 0.00 0.00 175.17 172.11 2jrs n SER 62 N 15.01 0.00 0.02 0.27 7.64 -1.26 0.91 113.62 136.21 2jrs n SER 62 Ca 0.38 0.38 -0.19 0.00 1.01 0.00 0.00 58.87 60.46 2jrs n SER 62 Cb 0.47 -0.38 -0.11 0.00 -1.01 0.00 0.00 64.21 63.18 2jrs n SER 62 CO 0.00 0.00 0.00 -0.08 -3.01 0.00 0.00 175.04 171.95 2jrs h GLU 63 N 0.00 0.48 0.00 1.43 4.57 -1.96 -3.39 114.58 115.71 2jrs h GLU 63 Ca 0.00 -0.55 0.00 0.00 -1.18 0.00 0.00 59.36 57.63 2jrs h GLU 63 Cb 0.15 0.17 0.00 0.00 -0.16 0.00 0.00 28.75 28.90 2jrs h GLU 63 CO 0.00 1.19 0.00 0.25 -1.18 0.00 0.00 179.01 179.27 2jrs n THR 64 N -4.09 0.07 -1.37 0.32 -2.24 -0.34 -5.01 114.28 101.62 2jrs n THR 64 Ca -0.11 -0.49 -0.10 0.00 -2.27 0.00 0.00 64.05 61.07 2jrs n THR 64 Cb 0.76 1.04 -0.04 0.00 -2.10 0.00 0.00 70.33 69.99 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 -0.03 1.10 3.91 3.38 0.00 0.26 -5.01 105.19 108.79 2jrs n GLY 65 Ca 0.00 -0.54 -0.32 0.00 0.00 0.00 0.00 46.02 45.16 2jrs n GLY 65 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2jrs s ARG 66 N -3.01 3.43 -0.08 1.61 1.81 -1.17 -4.89 118.95 116.65 2jrs s ARG 66 Ca 0.00 -0.39 -0.24 0.00 -1.72 0.00 0.00 55.73 53.38 2jrs s ARG 66 Cb 0.00 -3.06 -0.03 0.00 -0.45 0.00 0.00 34.95 31.41 2jrs s ARG 66 CO 0.00 0.64 0.74 -1.12 -0.68 0.00 0.00 175.30 174.87 2jrs s SER 67 N -2.26 7.00 0.14 0.23 0.01 -1.26 -0.00 113.70 117.56 2jrs s SER 67 Ca 0.32 1.21 0.24 0.00 1.31 0.00 0.00 55.95 59.03 2jrs s SER 67 Cb -0.13 -2.43 0.42 0.00 0.21 0.00 0.00 66.02 64.09 2jrs s SER 67 CO 0.24 -0.17 1.39 0.11 0.41 0.00 0.00 173.24 175.23 2jrs h LYS 68 N 6.86 0.00 0.00 12.44 1.57 -1.89 -3.47 116.57 132.08 2jrs h LYS 68 Ca -0.39 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.39 2jrs h LYS 68 Cb 1.19 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.50 2jrs h LYS 68 CO 0.76 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 180.05 2jrs n GLY 69 N 1.33 0.88 3.18 3.86 0.00 -1.26 -5.02 105.19 108.15 2jrs n GLY 69 Ca 0.04 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.97 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 0.25 -0.02 1.61 -0.85 -1.26 -0.43 117.35 114.65 2jrs s TYR 70 Ca 0.00 -0.70 -0.08 0.00 -0.52 0.00 0.00 57.07 55.77 2jrs s TYR 70 Cb 0.00 -0.14 0.01 0.00 0.38 0.00 0.00 41.96 42.21 2jrs s TYR 70 CO 0.00 -0.51 0.17 0.20 -1.52 0.00 0.00 175.55 173.89 2jrs s GLY 71 N -2.88 -0.02 -0.38 5.49 0.00 -0.21 -1.20 107.32 108.13 2jrs s GLY 71 Ca 0.06 0.07 -0.14 0.00 0.00 0.00 0.00 44.72 44.70 2jrs s GLY 71 CO -0.11 -0.06 0.29 -1.36 0.00 0.00 0.00 173.10 171.86 2jrs s PHE 72 N -1.03 3.23 -0.23 1.90 0.40 0.32 -0.43 117.98 122.15 2jrs s PHE 72 Ca -0.11 -0.37 -0.11 0.00 -0.60 0.00 0.00 56.93 55.74 2jrs s PHE 72 Cb -0.06 -2.57 -0.05 0.00 0.51 0.00 0.00 43.02 40.85 2jrs s PHE 72 CO 0.02 -0.49 0.18 0.42 0.70 0.00 0.00 175.22 176.05 2jrs s ILE 73 N 1.75 5.35 -0.29 0.64 1.01 0.19 -0.25 121.20 129.60 2jrs s ILE 73 Ca 0.06 0.24 -0.11 0.00 0.00 0.00 0.00 60.65 60.85 2jrs s ILE 73 Cb -0.18 -3.52 -0.03 0.00 0.01 0.00 0.00 42.46 38.74 2jrs s ILE 73 CO 0.11 0.36 0.18 -0.89 0.00 0.00 0.00 174.94 174.69 2jrs s THR 74 N 0.92 5.05 0.11 2.92 2.01 -0.06 -0.56 115.64 126.05 2jrs s THR 74 Ca 0.09 -0.05 -0.01 0.00 0.31 0.00 0.00 61.69 62.04 2jrs s THR 74 Cb -0.13 -3.47 -0.04 0.00 0.01 0.00 0.00 72.50 68.87 2jrs s THR 74 CO 0.03 0.18 0.29 -0.36 -0.69 0.00 0.00 174.62 174.07 2jrs s PHE 75 N 1.71 3.50 0.24 4.92 0.40 0.11 -0.93 117.98 127.93 2jrs s PHE 75 Ca 0.06 0.31 0.13 0.00 -0.60 0.00 0.00 56.93 56.83 2jrs s PHE 75 Cb -0.16 -1.81 0.46 0.00 0.51 0.00 0.00 43.02 42.02 2jrs s PHE 75 CO 0.09 0.51 1.65 1.03 0.70 0.00 0.00 175.22 179.21 2jrs h SER 76 N 2.70 0.00 -3.60 1.36 0.87 -1.52 -2.91 113.55 110.45 2jrs h SER 76 Ca -0.46 0.00 -0.67 0.00 -1.23 0.00 0.00 61.79 59.42 2jrs h SER 76 Cb 1.17 0.00 -0.28 0.00 -0.44 0.00 0.00 62.40 62.85 2jrs h SER 76 CO 0.73 0.54 -0.81 -0.62 -0.53 0.00 0.00 176.83 176.14 2jrs s ASP 77 N -6.73 3.67 0.01 6.23 2.15 -1.25 -4.57 116.67 116.19 2jrs s ASP 77 Ca -0.01 -0.38 -0.25 0.00 0.43 0.00 0.00 52.55 52.34 2jrs s ASP 77 Cb 0.12 -1.27 -0.18 0.00 -0.30 0.00 0.00 42.92 41.29 2jrs s ASP 77 CO 0.74 0.22 1.35 -1.28 -0.17 0.00 0.00 175.17 176.03 2jrs h SER 78 N 6.31 -0.09 -0.57 -0.34 0.87 -1.84 -2.88 113.55 115.02 2jrs h SER 78 Ca -0.30 -0.31 0.06 0.00 -1.23 0.00 0.00 61.79 60.02 2jrs h SER 78 Cb 1.20 0.02 -0.03 0.00 -0.44 0.00 0.00 62.40 63.15 2jrs h SER 78 CO 0.51 0.27 0.38 -0.33 -0.53 0.00 0.00 176.83 177.13 2jrs h GLU 79 N -0.46 0.52 -0.44 2.24 3.07 -1.96 -1.33 114.58 116.23 2jrs h GLU 79 Ca -0.01 -0.03 0.03 0.00 -0.50 0.00 0.00 59.36 58.85 2jrs h GLU 79 Cb 0.39 -0.12 -0.04 0.00 -0.84 0.00 0.00 28.75 28.15 2jrs h GLU 79 CO 0.02 0.34 0.23 0.00 -1.40 0.00 0.00 179.01 178.20 2jrs h ALA 81 N 1.22 0.74 -0.40 0.00 0.00 -1.05 0.11 119.26 119.89 2jrs h ALA 81 Ca 0.19 -0.25 -0.07 0.00 0.00 0.00 0.00 54.91 54.78 2jrs h ALA 81 Cb 0.08 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 2jrs h ALA 81 CO -0.12 0.49 -0.03 -0.22 0.00 0.00 0.00 179.25 179.37 2jrs h LYS 82 N 0.82 0.65 0.02 0.00 3.64 -1.11 -0.92 116.57 119.66 2jrs h LYS 82 Ca 0.17 -0.17 -0.00 0.00 -1.27 0.00 0.00 60.65 59.38 2jrs h LYS 82 Cb 0.41 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.15 2jrs h LYS 82 CO 0.01 0.69 -0.01 -0.22 -2.27 0.00 0.00 179.45 177.65 2jrs h LYS 83 N 0.61 -0.02 -0.85 1.90 3.64 -0.86 -2.66 116.57 118.33 2jrs h LYS 83 Ca 0.12 0.00 0.16 0.00 -1.27 0.00 0.00 60.65 59.66 2jrs h LYS 83 Cb 0.43 0.00 -0.10 0.00 -0.41 0.00 0.00 32.23 32.15 2jrs h LYS 83 CO 0.02 0.58 0.41 0.00 -2.27 0.00 0.00 179.45 178.19 2jrs h ALA 84 N 0.32 1.29 0.38 5.00 0.00 -0.65 0.08 119.26 125.67 2jrs h ALA 84 Ca -0.00 0.11 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 2jrs h ALA 84 Cb 0.61 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.42 2jrs h ALA 84 CO 0.00 -0.16 -0.31 1.25 0.00 0.00 0.00 179.25 180.03 2jrs h LEU 85 N 0.55 -0.82 -1.52 0.00 6.46 -1.24 -0.57 115.31 118.17 2jrs h LEU 85 Ca 0.48 0.06 0.16 0.00 -0.12 0.00 0.00 57.88 58.47 2jrs h LEU 85 Cb 0.74 0.27 -0.06 0.00 -0.73 0.00 0.00 40.66 40.88 2jrs h LEU 85 CO -0.40 -0.46 0.54 -0.08 -0.62 0.00 0.00 178.44 177.42 2jrs h GLU 86 N -0.70 0.44 0.09 1.25 4.22 -0.69 0.24 114.58 119.44 2jrs h GLU 86 Ca -0.03 -0.03 -0.31 0.00 0.08 0.00 0.00 59.36 59.07 2jrs h GLU 86 Cb 0.61 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.74 2jrs h GLU 86 CO -0.02 0.29 -1.66 1.96 -2.18 0.00 0.00 179.01 177.40 2jrs h GLN 87 N 0.45 0.20 -0.01 1.92 1.08 -0.90 -3.38 115.11 114.47 2jrs h GLN 87 Ca 0.41 -0.34 0.00 0.00 -1.45 0.00 0.00 58.65 57.27 2jrs h GLN 87 Cb 0.92 0.13 0.00 0.00 -0.05 0.00 0.00 27.48 28.47 2jrs h GLN 87 CO -0.15 1.01 -0.53 1.28 -0.95 0.00 0.00 178.83 179.49 2jrs n LEU 88 N -3.37 1.29 -4.55 1.46 4.77 -0.24 -4.76 117.00 111.59 2jrs n LEU 88 Ca -0.20 -0.65 -0.36 0.00 -0.03 0.00 0.00 56.01 54.77 2jrs n LEU 88 Cb 1.04 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 42.10 2jrs n LEU 88 CO 0.48 0.26 1.89 0.21 -1.33 0.00 0.00 177.39 178.90 2jrs s ASN 89 N -2.22 4.65 0.00 -1.43 3.84 0.79 -1.34 114.94 119.23 2jrs s ASN 89 Ca 0.11 0.84 0.00 0.00 0.21 0.00 0.00 52.86 54.01 2jrs s ASN 89 Cb 0.13 -2.51 0.00 0.00 -0.55 0.00 0.00 41.25 38.32 2jrs s ASN 89 CO 0.53 -2.77 0.00 0.61 -2.79 0.00 0.00 177.10 172.68 2jrs n GLY 90 N 5.95 0.53 3.73 1.21 0.00 0.78 -4.95 105.19 112.43 2jrs n GLY 90 Ca 0.32 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.93 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 3.15 -0.50 1.61 5.36 -0.45 -4.14 117.98 121.02 2jrs s PHE 91 Ca 0.00 0.92 -0.27 0.00 -0.96 0.00 0.00 56.93 56.62 2jrs s PHE 91 Cb 0.00 -3.76 -0.03 0.00 -0.34 0.00 0.00 43.02 38.89 2jrs s PHE 91 CO 0.00 -2.64 1.92 -1.21 -1.46 0.00 0.00 175.22 171.83 2jrs s GLU 92 N 0.63 2.79 -0.16 10.12 2.02 -1.26 0.33 118.70 133.18 2jrs s GLU 92 Ca 0.64 1.00 -0.01 0.00 0.02 0.00 0.00 54.97 56.61 2jrs s GLU 92 Cb -0.40 -4.35 -0.01 0.00 0.10 0.00 0.00 34.13 29.47 2jrs s GLU 92 CO 0.34 -2.51 -0.10 -1.17 0.02 0.00 0.00 175.26 171.84 2jrs s LEU 93 N 8.78 2.80 -1.89 1.80 2.96 0.47 -4.56 118.68 129.04 2jrs s LEU 93 Ca 0.76 -0.33 0.00 0.00 -0.22 0.00 0.00 54.13 54.34 2jrs s LEU 93 Cb -0.17 -1.66 0.00 0.00 0.50 0.00 0.00 46.19 44.87 2jrs s LEU 93 CO 0.26 0.12 0.00 0.00 -1.32 0.00 0.00 176.35 175.41 2jrs n ALA 94 N 3.85 -0.43 0.00 5.97 0.00 -1.26 -1.84 120.51 126.81 2jrs n ALA 94 Ca -0.18 0.25 0.00 0.00 0.00 0.00 0.00 53.44 53.51 2jrs n ALA 94 Cb 0.52 -1.97 0.00 0.00 0.00 0.00 0.00 19.45 18.00 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 -0.59 2.85 3.41 0.00 0.00 -1.26 -5.01 105.19 104.59 2jrs n GLY 95 Ca -0.21 0.00 -0.32 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 -0.95 2.34 0.19 1.61 0.52 -0.77 -5.00 118.95 116.88 2jrs s ARG 96 Ca 0.00 -0.79 -0.33 0.00 -0.52 0.00 0.00 55.73 54.09 2jrs s ARG 96 Cb 0.00 -2.24 -0.14 0.00 0.52 0.00 0.00 34.95 33.09 2jrs s ARG 96 CO 0.00 0.60 1.47 -2.30 0.02 0.00 0.00 175.30 175.09 2jrs n PRO 97 N 2.36 1.98 -3.43 3.54 -0.02 -1.26 -0.39 135.00 137.77 2jrs n PRO 97 Ca -0.17 0.71 -0.39 0.00 -2.02 0.00 0.00 63.50 61.63 2jrs n PRO 97 Cb 0.52 -2.41 -0.09 0.00 -0.02 0.00 0.00 33.50 31.49 2jrs n PRO 97 CO 0.00 0.00 0.00 1.41 1.98 0.00 0.00 175.50 178.89 2jrs s MET 98 N 0.28 3.94 -0.83 -0.52 1.75 0.15 -4.70 119.30 119.38 2jrs s MET 98 Ca 0.75 -0.09 -0.21 0.00 -1.25 0.00 0.00 55.69 54.88 2jrs s MET 98 Cb -0.70 -3.68 0.10 0.00 2.84 0.00 0.00 34.83 33.39 2jrs s MET 98 CO 0.44 -0.29 1.10 0.15 -0.65 0.00 0.00 175.02 175.77 2jrs s LYS 99 N 2.00 3.39 -0.35 4.11 1.02 -0.35 -0.15 119.74 129.42 2jrs s LYS 99 Ca 0.13 -1.30 -0.12 0.00 0.02 0.00 0.00 55.97 54.70 2jrs s LYS 99 Cb -0.16 -4.67 0.00 0.00 -0.52 0.00 0.00 37.83 32.48 2jrs s LYS 99 CO 0.10 -1.84 0.22 0.08 -0.92 0.00 0.00 175.35 172.99 2jrs s VAL 100 N 3.53 4.95 -0.04 3.17 1.01 -1.25 -0.32 120.40 131.45 2jrs s VAL 100 Ca 0.30 -0.47 -0.02 0.00 0.00 0.00 0.00 61.98 61.79 2jrs s VAL 100 Cb -0.09 -3.62 0.03 0.00 0.00 0.00 0.00 36.38 32.70 2jrs s VAL 100 CO -0.01 -0.08 0.09 -0.83 0.00 0.00 0.00 175.10 174.27 2jrs s GLY 101 N 1.65 0.01 -0.68 4.51 0.00 -0.02 -4.72 107.32 108.07 2jrs s GLY 101 Ca 0.05 0.48 -0.26 0.00 0.00 0.00 0.00 44.72 44.99 2jrs s GLY 101 CO 0.08 0.77 2.25 -2.38 0.00 0.00 0.00 173.10 173.82 2jrs s HIS 102 N 0.96 1.30 -0.24 1.90 -3.43 -1.26 -0.12 115.29 114.40 2jrs s HIS 102 Ca -0.08 1.45 -0.09 0.00 -0.80 0.00 0.00 55.06 55.55 2jrs s HIS 102 Cb -0.10 -3.68 0.01 0.00 -1.43 0.00 0.00 32.58 27.38 2jrs s HIS 102 CO -0.04 -2.04 0.20 0.28 -2.00 0.00 0.00 174.74 171.14 2jrs n VAL 103 N 8.13 -7.16 -2.24 -5.38 0.31 -1.21 -4.76 118.33 106.02 2jrs n VAL 103 Ca 0.38 0.97 -0.33 0.00 -0.01 0.00 0.00 64.34 65.35 2jrs n VAL 103 Cb 0.49 -5.10 -0.04 0.00 -0.91 0.00 0.00 33.84 28.28 2jrs n VAL 103 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 2jrs s THR 104 N -1.54 3.72 -0.01 2.52 -1.32 -1.25 -4.65 115.64 113.11 2jrs s THR 104 Ca 0.10 -1.11 -0.01 0.00 -1.21 0.00 0.00 61.69 59.46 2jrs s THR 104 Cb -0.02 -4.70 -0.00 0.00 -1.51 0.00 0.00 72.50 66.27 2jrs s THR 104 CO 0.53 -1.34 -0.02 -0.62 -2.21 0.00 0.00 174.62 170.96 2jrs n GLU 105 N 8.44 0.03 0.00 7.08 -0.58 -1.26 -4.96 120.64 129.39 2jrs n GLU 105 Ca 0.44 0.15 0.00 0.00 -0.42 0.00 0.00 57.16 57.34 2jrs n GLU 105 Cb 0.47 -0.70 0.00 0.00 -0.57 0.00 0.00 31.44 30.64 2jrs n GLU 105 CO 0.00 0.00 0.00 -2.13 -0.48 0.00 0.00 177.13 174.52 2jrs n ARG 106 N -2.50 0.00 -1.69 3.49 3.00 -1.26 -4.90 116.66 112.80 2jrs n ARG 106 Ca -0.01 0.00 -0.51 0.00 -0.00 0.00 0.00 57.85 57.34 2jrs n ARG 106 Cb 0.02 0.00 -0.05 0.00 0.00 0.00 0.00 32.46 32.43 2jrs n ARG 106 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.63 180.04 2jrs n THR 107 N 0.00 0.52 1.66 5.15 -1.04 -1.26 -5.33 114.28 113.97 2jrs n THR 107 Ca 0.00 -0.10 0.13 0.00 -2.04 0.00 0.00 64.05 62.05 2jrs n THR 107 Cb 0.00 -1.72 0.79 0.00 -1.82 0.00 0.00 70.33 67.57 2jrs n THR 107 CO 0.00 0.00 0.00 -0.67 -0.64 0.00 0.00 175.07 173.76