#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 0.39 3.74 3.03 0.00 -1.26 -5.08 105.19 106.01 2jrs n GLY 2 Ca 0.00 -1.38 -0.41 0.00 0.00 0.00 0.00 46.02 44.22 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 -2.85 2.99 0.31 1.61 -3.43 -1.26 -5.02 115.29 107.64 2jrs s HIS 3 Ca 0.00 0.93 -0.06 0.00 -0.80 0.00 0.00 55.06 55.13 2jrs s HIS 3 Cb 0.00 -3.87 -0.05 0.00 -1.43 0.00 0.00 32.58 27.23 2jrs s HIS 3 CO 0.00 -2.91 0.59 -1.01 -2.00 0.00 0.00 174.74 169.41 2jrs s HIS 4 N 0.17 3.47 0.12 0.38 3.76 -1.26 -5.05 115.29 116.88 2jrs s HIS 4 Ca 0.61 0.71 -0.30 0.00 -0.15 0.00 0.00 55.06 55.93 2jrs s HIS 4 Cb -0.43 -2.16 -0.06 0.00 1.11 0.00 0.00 32.58 31.04 2jrs s HIS 4 CO 0.42 0.13 1.01 -1.01 -0.85 0.00 0.00 174.74 174.44 2jrs s HIS 5 N -2.12 3.74 -0.27 1.40 3.76 -1.26 -5.03 115.29 115.50 2jrs s HIS 5 Ca 0.45 1.72 -0.25 0.00 -0.15 0.00 0.00 55.06 56.83 2jrs s HIS 5 Cb -0.11 -3.13 0.12 0.00 1.11 0.00 0.00 32.58 30.57 2jrs s HIS 5 CO 0.30 -0.07 0.99 -3.38 -0.85 0.00 0.00 174.74 171.73 2jrs s HIS 6 N 0.06 -0.50 -2.00 1.40 -0.00 -1.26 -5.04 115.29 107.95 2jrs s HIS 6 Ca 0.48 1.20 0.03 0.00 -0.00 0.00 0.00 55.06 56.77 2jrs s HIS 6 Cb -0.25 0.36 0.17 0.00 -0.00 0.00 0.00 32.58 32.86 2jrs s HIS 6 CO 0.31 -0.26 0.67 1.58 -0.00 0.00 0.00 174.74 177.04 2jrs n HIS 7 N 2.13 0.00 -3.08 0.38 -0.00 -1.26 -4.82 115.22 108.58 2jrs n HIS 7 Ca -0.13 0.00 -0.13 0.00 -0.00 0.00 0.00 57.72 57.46 2jrs n HIS 7 Cb 0.56 0.00 0.06 0.00 -0.00 0.00 0.00 29.99 30.61 2jrs n HIS 7 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.34 177.92 2jrs n HIS 8 N -0.58 -1.67 -2.55 1.57 -0.00 -1.26 -4.95 115.22 105.78 2jrs n HIS 8 Ca 0.02 0.69 -0.42 0.00 0.46 0.00 0.00 57.72 58.48 2jrs n HIS 8 Cb 0.01 -4.20 -0.03 0.00 -0.12 0.00 0.00 29.99 25.65 2jrs n HIS 8 CO 0.00 0.00 0.00 0.45 0.46 0.00 0.00 176.34 177.25 2jrs s SER 9 N -3.88 6.33 -0.94 0.26 0.15 -1.26 -4.94 113.70 109.43 2jrs s SER 9 Ca 0.06 -0.03 -0.25 0.00 0.70 0.00 0.00 55.95 56.43 2jrs s SER 9 Cb -0.03 -2.55 -0.08 0.00 -1.71 0.00 0.00 66.02 61.65 2jrs s SER 9 CO 0.53 -1.61 2.03 -1.38 1.20 0.00 0.00 173.24 174.01 2jrs s HIS 10 N 5.30 1.69 -0.08 3.44 0.00 -1.26 -4.60 115.29 119.78 2jrs s HIS 10 Ca 0.42 0.92 0.12 0.00 -3.00 0.00 0.00 55.06 53.51 2jrs s HIS 10 Cb -0.08 -3.90 0.22 0.00 -4.00 0.00 0.00 32.58 24.82 2jrs s HIS 10 CO 0.22 -1.58 1.11 -1.33 -1.00 0.00 0.00 174.74 172.16 2jrs n MET 11 N 8.73 0.75 -1.19 -0.38 2.00 -1.26 -4.92 117.12 120.84 2jrs n MET 11 Ca 0.42 -2.07 -0.21 0.00 0.00 0.00 0.00 57.70 55.85 2jrs n MET 11 Cb 0.46 -1.02 -0.12 0.00 0.00 0.00 0.00 33.22 32.54 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 -0.71 6.61 0.30 3.04 0.00 -1.26 -4.28 120.51 124.21 2jrs n ALA 12 Ca 0.10 -2.45 0.11 0.00 0.00 0.00 0.00 53.44 51.21 2jrs n ALA 12 Cb 0.72 -2.48 -0.02 0.00 0.00 0.00 0.00 19.45 17.67 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 2.32 2.99 0.29 0.00 0.00 -1.26 -4.06 120.51 120.78 2jrs n ALA 13 Ca 0.51 -0.37 0.17 0.00 0.00 0.00 0.00 53.44 53.76 2jrs n ALA 13 Cb 0.71 -0.98 0.85 0.00 0.00 0.00 0.00 19.45 20.03 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 2.26 1.08 -0.57 0.00 0.00 -2.04 -3.46 119.26 116.53 2jrs h ALA 14 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2jrs h ALA 14 Cb 0.87 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.65 2jrs h ALA 14 CO 0.00 0.05 0.00 -1.33 0.00 0.00 0.00 179.25 177.97 2jrs n MET 15 N -3.25 0.00 -1.97 0.00 2.00 -1.26 -4.83 117.12 107.81 2jrs n MET 15 Ca -0.01 0.00 -0.42 0.00 0.00 0.00 0.00 57.70 57.27 2jrs n MET 15 Cb 0.22 0.00 -0.02 0.00 0.00 0.00 0.00 33.22 33.42 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 -0.76 3.68 0.05 3.04 0.00 -1.26 -5.01 121.76 121.51 2jrs s ALA 16 Ca 0.00 1.36 -0.26 0.00 0.00 0.00 0.00 51.96 53.05 2jrs s ALA 16 Cb 0.00 -3.58 0.07 0.00 0.00 0.00 0.00 23.12 19.60 2jrs s ALA 16 CO 0.00 -0.77 0.63 0.54 0.00 0.00 0.00 175.76 176.16 2jrs s ASN 17 N 0.64 -0.60 -0.76 0.00 2.20 -1.26 -5.12 114.94 110.05 2jrs s ASN 17 Ca 0.63 0.34 -0.19 0.00 -0.94 0.00 0.00 52.86 52.70 2jrs s ASN 17 Cb -0.43 0.56 0.12 0.00 -2.00 0.00 0.00 41.25 39.50 2jrs s ASN 17 CO 0.39 -0.78 0.94 0.20 -2.94 0.00 0.00 177.10 174.91 2jrs s ASN 18 N -1.98 6.41 -0.02 3.54 -0.87 -1.26 -4.88 114.94 115.88 2jrs s ASN 18 Ca -0.05 -1.68 -0.21 0.00 -1.57 0.00 0.00 52.86 49.35 2jrs s ASN 18 Cb -0.01 -2.36 -0.24 0.00 -0.02 0.00 0.00 41.25 38.63 2jrs s ASN 18 CO -0.02 -1.13 1.06 0.25 -2.57 0.00 0.00 177.10 174.70 2jrs h LEU 19 N 10.28 0.43 -5.45 0.60 5.85 -2.01 -3.29 115.31 121.70 2jrs h LEU 19 Ca -0.08 -0.78 -0.74 0.00 0.84 0.00 0.00 57.88 57.11 2jrs h LEU 19 Cb 1.05 -0.13 -0.24 0.00 0.37 0.00 0.00 40.66 41.71 2jrs h LEU 19 CO 1.09 1.16 1.12 0.00 -0.34 0.00 0.00 178.44 181.47 2jrs n GLN 20 N -4.30 3.87 -1.55 1.25 10.64 -1.26 -4.99 117.38 121.04 2jrs n GLN 20 Ca -0.10 -3.76 -0.39 0.00 -1.83 0.00 0.00 57.00 50.92 2jrs n GLN 20 Cb 0.63 -2.36 -0.04 0.00 -0.86 0.00 0.00 30.24 27.60 2jrs n GLN 20 CO 0.00 0.00 0.00 1.17 -1.83 0.00 0.00 177.06 176.40 2jrs n LYS 21 N 0.07 1.10 -0.14 2.61 4.81 -1.24 -0.86 118.16 124.51 2jrs n LYS 21 Ca 0.52 0.10 0.00 0.00 -0.87 0.00 0.00 58.31 58.06 2jrs n LYS 21 Cb 0.29 -3.18 0.00 0.00 0.02 0.00 0.00 35.03 32.15 2jrs n LYS 21 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2jrs n GLY 22 N 6.05 1.83 1.47 3.14 0.00 -1.26 -4.81 105.19 111.60 2jrs n GLY 22 Ca 0.39 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.41 2jrs n GLY 22 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2jrs n SER 23 N 0.00 -7.91 0.07 1.61 7.64 -0.04 -4.67 113.62 110.32 2jrs n SER 23 Ca 0.00 1.10 -0.03 0.00 1.01 0.00 0.00 58.87 60.94 2jrs n SER 23 Cb 0.00 -4.00 -0.07 0.00 -1.01 0.00 0.00 64.21 59.13 2jrs n SER 23 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2jrs h ALA 24 N 2.04 0.56 -2.22 -0.43 0.00 -1.87 -3.47 119.26 113.87 2jrs h ALA 24 Ca 0.00 -0.84 -0.38 0.00 0.00 0.00 0.00 54.91 53.69 2jrs h ALA 24 Cb 0.00 0.03 -0.14 0.00 0.00 0.00 0.00 17.79 17.68 2jrs h ALA 24 CO 0.00 1.05 -0.71 0.20 0.00 0.00 0.00 179.25 179.78 2jrs s GLY 25 N -4.70 1.27 0.40 0.00 0.00 -1.26 -5.15 107.32 97.87 2jrs s GLY 25 Ca 0.01 -1.59 -0.24 0.00 0.00 0.00 0.00 44.72 42.89 2jrs s GLY 25 CO 0.80 -1.67 1.04 2.56 0.00 0.00 0.00 173.10 175.83 2jrs s PRO 26 N -3.72 4.18 -0.24 2.90 0.04 -1.26 -4.76 135.00 132.14 2jrs s PRO 26 Ca 0.20 1.49 -0.08 0.00 0.04 0.00 0.00 61.00 62.66 2jrs s PRO 26 Cb 0.02 -2.54 -0.04 0.00 0.04 0.00 0.00 34.50 31.98 2jrs s PRO 26 CO 0.04 -0.12 0.10 1.41 0.04 0.00 0.00 177.00 178.47 2jrs s MET 27 N -2.49 3.81 -0.11 4.56 1.75 0.82 -4.93 119.30 122.70 2jrs s MET 27 Ca 0.58 -0.41 -0.08 0.00 -1.25 0.00 0.00 55.69 54.53 2jrs s MET 27 Cb -0.22 -3.37 -0.04 0.00 2.84 0.00 0.00 34.83 34.04 2jrs s MET 27 CO 0.27 -0.07 0.16 0.50 -0.65 0.00 0.00 175.02 175.23 2jrs s ARG 28 N 1.33 3.49 -0.10 4.11 3.52 -1.26 -0.45 118.95 129.58 2jrs s ARG 28 Ca 0.06 -0.09 0.04 0.00 -0.13 0.00 0.00 55.73 55.60 2jrs s ARG 28 Cb -0.15 -3.20 0.00 0.00 -1.56 0.00 0.00 34.95 30.05 2jrs s ARG 28 CO 0.05 0.77 -0.23 -0.51 -0.81 0.00 0.00 175.30 174.57 2jrs s LEU 29 N -1.02 2.04 -0.39 -0.88 1.43 0.59 -4.52 118.68 115.93 2jrs s LEU 29 Ca 0.16 -0.53 -0.20 0.00 -1.03 0.00 0.00 54.13 52.52 2jrs s LEU 29 Cb -0.12 -1.35 0.01 0.00 0.03 0.00 0.00 46.19 44.76 2jrs s LEU 29 CO 0.05 0.14 0.62 -0.47 0.23 0.00 0.00 176.35 176.92 2jrs s TYR 30 N 0.41 3.12 -0.51 0.29 5.04 0.16 -0.76 117.35 125.10 2jrs s TYR 30 Ca -0.18 0.16 -0.12 0.00 -2.44 0.00 0.00 57.07 54.49 2jrs s TYR 30 Cb -0.18 -3.20 0.13 0.00 0.35 0.00 0.00 41.96 39.06 2jrs s TYR 30 CO 0.08 -0.72 0.42 0.08 -1.34 0.00 0.00 175.55 174.08 2jrs s VAL 31 N 2.72 4.68 -0.76 3.14 1.01 0.23 -0.24 120.40 131.18 2jrs s VAL 31 Ca 0.23 -1.68 -0.08 0.00 0.00 0.00 0.00 61.98 60.45 2jrs s VAL 31 Cb -0.14 -4.04 0.20 0.00 0.00 0.00 0.00 36.38 32.39 2jrs s VAL 31 CO 0.16 -0.82 0.65 -0.83 0.00 0.00 0.00 175.10 174.26 2jrs s GLY 32 N 3.07 2.65 0.00 4.51 0.00 0.58 -0.69 107.32 117.44 2jrs s GLY 32 Ca 0.05 -3.36 0.00 0.00 0.00 0.00 0.00 44.72 41.41 2jrs s GLY 32 CO 0.01 1.19 0.19 -1.26 0.00 0.00 0.00 173.10 173.24 2jrs n SER 33 N 3.61 -0.14 -4.59 1.64 2.88 0.50 -3.53 113.62 113.99 2jrs n SER 33 Ca 0.12 -0.39 -0.42 0.00 -1.33 0.00 0.00 58.87 56.86 2jrs n SER 33 Cb 0.42 0.04 -0.03 0.00 -0.75 0.00 0.00 64.21 63.90 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 3.46 0.00 2.46 1.43 0.65 -4.86 118.68 121.83 2jrs s LEU 34 Ca 0.00 1.00 -0.03 0.00 -1.03 0.00 0.00 54.13 54.07 2jrs s LEU 34 Cb 0.00 -3.27 -0.12 0.00 0.03 0.00 0.00 46.19 42.83 2jrs s LEU 34 CO 0.00 -1.84 2.59 1.41 0.23 0.00 0.00 176.35 178.74 2jrs n HIS 35 N 10.70 0.00 -1.40 0.29 8.25 -1.26 -3.97 115.22 127.83 2jrs n HIS 35 Ca 0.21 -1.15 -0.14 0.00 -0.26 0.00 0.00 57.72 56.39 2jrs n HIS 35 Cb 0.48 -0.97 -0.06 0.00 1.12 0.00 0.00 29.99 30.56 2jrs n HIS 35 CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 2jrs n PHE 36 N 2.02 0.00 0.00 4.41 3.72 -1.26 -4.61 117.46 121.73 2jrs n PHE 36 Ca 0.19 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.59 2jrs n PHE 36 Cb 0.65 -2.91 0.00 0.00 -0.94 0.00 0.00 39.48 36.28 2jrs n PHE 36 CO 0.00 0.00 0.00 0.27 -0.05 0.00 0.00 176.76 176.98 2jrs n ASN 37 N -1.16 0.00 -4.73 4.37 6.94 -1.26 -4.86 115.26 114.56 2jrs n ASN 37 Ca -0.14 0.00 -0.42 0.00 -0.02 0.00 0.00 54.58 54.01 2jrs n ASN 37 Cb 0.60 0.00 -0.03 0.00 -2.36 0.00 0.00 39.78 38.00 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 -1.00 2.12 0.41 1.53 -1.09 -1.26 -5.01 121.20 116.89 2jrs s ILE 38 Ca 0.00 0.09 0.07 0.00 -2.23 0.00 0.00 60.65 58.59 2jrs s ILE 38 Cb 0.00 -3.06 -0.06 0.00 -1.58 0.00 0.00 42.46 37.76 2jrs s ILE 38 CO 0.00 0.01 0.10 0.42 -1.23 0.00 0.00 174.94 174.24 2jrs s THR 39 N 0.76 2.20 0.50 2.92 -4.23 -1.26 -4.83 115.64 111.70 2jrs s THR 39 Ca 0.70 -1.85 0.20 0.00 -1.18 0.00 0.00 61.69 59.57 2jrs s THR 39 Cb -0.48 -2.98 0.27 0.00 1.34 0.00 0.00 72.50 70.64 2jrs s THR 39 CO 0.37 -0.02 2.12 1.05 -0.54 0.00 0.00 174.62 177.61 2jrs h GLU 40 N 1.60 0.00 -0.96 3.99 4.11 -1.98 -2.21 114.58 119.13 2jrs h GLU 40 Ca -0.43 0.00 -0.00 0.00 0.07 0.00 0.00 59.36 58.99 2jrs h GLU 40 Cb 1.25 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 30.45 2jrs h GLU 40 CO 0.74 0.07 0.58 -0.44 0.07 0.00 0.00 179.01 180.03 2jrs h ASP 41 N 0.00 1.15 0.27 3.06 5.19 -1.98 0.25 116.42 124.36 2jrs h ASP 41 Ca -0.00 -0.07 -0.01 0.00 -0.62 0.00 0.00 57.03 56.33 2jrs h ASP 41 Cb 0.14 -0.29 0.00 0.00 0.18 0.00 0.00 39.33 39.36 2jrs h ASP 41 CO 0.01 0.88 -0.13 0.24 -3.12 0.00 0.00 179.24 177.12 2jrs h MET 42 N 1.32 -0.35 0.22 3.56 2.86 -1.81 -0.85 114.93 119.89 2jrs h MET 42 Ca 0.34 0.02 0.01 0.00 -2.06 0.00 0.00 59.70 58.01 2jrs h MET 42 Cb -0.06 0.08 -0.03 0.00 0.06 0.00 0.00 31.60 31.65 2jrs h MET 42 CO -0.06 -0.05 -0.28 -0.07 1.06 0.00 0.00 176.91 177.50 2jrs h LEU 43 N -0.64 -0.77 -0.70 1.22 3.38 -1.43 -2.08 115.31 114.29 2jrs h LEU 43 Ca -0.04 0.08 0.15 0.00 0.09 0.00 0.00 57.88 58.16 2jrs h LEU 43 Cb 0.46 0.28 -0.11 0.00 0.09 0.00 0.00 40.66 41.37 2jrs h LEU 43 CO 0.06 -0.39 0.10 -0.09 0.09 0.00 0.00 178.44 178.21 2jrs h ARG 44 N -0.56 0.19 -0.33 1.13 2.43 -0.54 0.25 114.38 116.95 2jrs h ARG 44 Ca 0.00 -0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.16 2jrs h ARG 44 Cb 0.54 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 30.03 2jrs h ARG 44 CO -0.10 0.13 0.20 0.78 -1.51 0.00 0.00 179.97 179.47 2jrs h GLY 45 N 0.20 0.48 0.85 2.80 0.00 -0.71 0.55 103.07 107.24 2jrs h GLY 45 Ca 0.38 -0.19 -0.35 0.00 0.00 0.00 0.00 47.33 47.17 2jrs h GLY 45 CO -0.53 0.18 -1.79 -2.22 0.00 0.00 0.00 176.54 172.19 2jrs h ILE 46 N 0.46 0.88 0.02 2.60 2.04 -0.47 -3.39 117.51 119.64 2jrs h ILE 46 Ca 0.12 -2.48 -0.21 0.00 1.00 0.00 0.00 64.86 63.30 2jrs h ILE 46 Cb -0.01 2.72 -0.02 0.00 -0.74 0.00 0.00 36.82 38.77 2jrs h ILE 46 CO -0.02 0.86 -0.95 -0.26 0.00 0.00 0.00 178.15 177.78 2jrs h PHE 47 N 0.08 0.18 -0.48 1.37 -1.00 -0.47 -3.34 116.94 113.28 2jrs h PHE 47 Ca -0.36 -0.11 0.09 0.00 2.81 0.00 0.00 57.97 60.40 2jrs h PHE 47 Cb 2.08 -0.01 -0.08 0.00 3.61 0.00 0.00 35.95 41.54 2jrs h PHE 47 CO 0.10 0.99 0.00 1.49 -1.61 0.00 0.00 178.31 179.28 2jrs h GLU 48 N 0.05 0.11 -1.27 1.51 4.22 -1.02 0.03 114.58 118.21 2jrs h GLU 48 Ca -0.04 -0.01 0.37 0.00 0.08 0.00 0.00 59.36 59.76 2jrs h GLU 48 Cb 1.63 -0.03 -0.05 0.00 0.50 0.00 0.00 28.75 30.80 2jrs h GLU 48 CO 0.14 0.07 1.00 -1.35 -2.18 0.00 0.00 179.01 176.69 2jrs h PRO 49 N 0.12 0.00 0.04 0.92 0.11 -1.78 -0.93 132.00 130.48 2jrs h PRO 49 Ca 0.24 0.00 -0.14 0.00 0.11 0.00 0.00 66.00 66.21 2jrs h PRO 49 Cb 0.35 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.46 2jrs h PRO 49 CO -0.40 0.00 -0.72 0.74 -0.21 0.00 0.00 178.00 177.42 2jrs h PHE 50 N 0.00 0.17 -1.58 0.65 0.04 -1.22 -3.49 116.94 111.50 2jrs h PHE 50 Ca 0.60 -0.12 0.07 0.00 2.80 0.00 0.00 57.97 61.32 2jrs h PHE 50 Cb 2.60 -0.01 -0.23 0.00 2.20 0.00 0.00 35.95 40.51 2jrs h PHE 50 CO 0.00 1.28 0.52 0.20 -0.60 0.00 0.00 178.31 179.71 2jrs s GLY 51 N -4.56 -0.27 -0.16 -1.45 0.00 -0.35 -4.80 107.32 95.73 2jrs s GLY 51 Ca -0.21 2.06 -0.29 0.00 0.00 0.00 0.00 44.72 46.28 2jrs s GLY 51 CO 0.70 1.11 1.81 -1.60 0.00 0.00 0.00 173.10 175.11 2jrs s ARG 52 N -0.98 3.76 0.30 2.90 3.00 -1.26 -4.05 118.95 122.63 2jrs s ARG 52 Ca -0.02 1.96 -0.29 0.00 -1.00 0.00 0.00 55.73 56.38 2jrs s ARG 52 Cb -0.01 -4.12 -0.10 0.00 0.00 0.00 0.00 34.95 30.72 2jrs s ARG 52 CO 0.01 -1.35 1.33 0.42 0.00 0.00 0.00 175.30 175.71 2jrs s ILE 53 N 5.57 2.76 -0.12 4.11 1.09 -1.26 -4.55 121.20 128.80 2jrs s ILE 53 Ca 0.81 0.73 -0.13 0.00 -1.10 0.00 0.00 60.65 60.96 2jrs s ILE 53 Cb -0.31 -3.46 -0.11 0.00 -1.06 0.00 0.00 42.46 37.52 2jrs s ILE 53 CO 0.33 0.16 0.32 -0.33 -0.10 0.00 0.00 174.94 175.32 2jrs h GLU 54 N 3.88 0.00 -2.76 2.79 4.39 -1.12 -3.49 114.58 118.27 2jrs h GLU 54 Ca -0.48 0.00 -0.12 0.00 0.34 0.00 0.00 59.36 59.10 2jrs h GLU 54 Cb 1.22 0.00 -0.24 0.00 -0.10 0.00 0.00 28.75 29.64 2jrs h GLU 54 CO 0.69 0.44 -0.24 -1.54 -1.16 0.00 0.00 179.01 177.20 2jrs s SER 55 N -5.85 -0.41 -0.03 1.42 1.04 -1.22 -4.99 113.70 103.65 2jrs s SER 55 Ca -0.09 0.78 0.06 0.00 0.48 0.00 0.00 55.95 57.18 2jrs s SER 55 Cb -0.01 0.80 -0.02 0.00 0.10 0.00 0.00 66.02 66.88 2jrs s SER 55 CO 0.30 -0.17 -0.20 -0.63 0.98 0.00 0.00 173.24 173.53 2jrs s ILE 56 N 0.11 2.62 -0.11 -1.02 1.01 -1.26 -0.33 121.20 122.21 2jrs s ILE 56 Ca -0.01 -0.93 -0.00 0.00 0.00 0.00 0.00 60.65 59.71 2jrs s ILE 56 Cb -0.03 -1.99 0.02 0.00 0.01 0.00 0.00 42.46 40.48 2jrs s ILE 56 CO 0.01 0.56 -0.08 -1.58 0.00 0.00 0.00 174.94 173.85 2jrs s GLN 57 N -0.75 1.56 -0.16 2.79 2.00 0.11 -4.99 119.66 120.22 2jrs s GLN 57 Ca 0.11 -0.28 -0.13 0.00 -2.00 0.00 0.00 55.36 53.06 2jrs s GLN 57 Cb -0.10 -1.57 -0.05 0.00 0.80 0.00 0.00 33.01 32.09 2jrs s GLN 57 CO 0.00 -0.23 0.27 -0.51 -0.50 0.00 0.00 175.29 174.32 2jrs s LEU 58 N 1.58 4.25 -0.58 3.68 1.43 -1.26 -0.61 118.68 127.16 2jrs s LEU 58 Ca 0.03 0.48 -0.20 0.00 -1.03 0.00 0.00 54.13 53.41 2jrs s LEU 58 Cb -0.13 -2.33 0.09 0.00 0.03 0.00 0.00 46.19 43.84 2jrs s LEU 58 CO -0.07 0.12 0.74 -0.04 0.23 0.00 0.00 176.35 177.33 2jrs s MET 59 N 0.39 3.08 0.22 1.70 -1.94 -0.75 -5.01 119.30 117.00 2jrs s MET 59 Ca 0.15 -1.11 0.01 0.00 -1.71 0.00 0.00 55.69 53.04 2jrs s MET 59 Cb -0.13 -4.22 -0.04 0.00 2.01 0.00 0.00 34.83 32.46 2jrs s MET 59 CO 0.03 -1.52 0.38 -1.64 -0.01 0.00 0.00 175.02 172.26 2jrs s MET 60 N 2.97 3.48 -0.47 2.03 -1.94 -1.26 -1.12 119.30 122.99 2jrs s MET 60 Ca 0.15 -0.48 -0.28 0.00 -1.71 0.00 0.00 55.69 53.37 2jrs s MET 60 Cb -0.21 -2.85 0.00 0.00 2.01 0.00 0.00 34.83 33.78 2jrs s MET 60 CO 0.09 0.40 1.51 -0.51 -0.01 0.00 0.00 175.02 176.49 2jrs s ASP 61 N -3.45 6.10 0.29 3.03 1.11 -0.41 -4.77 116.67 118.58 2jrs s ASP 61 Ca 0.37 0.66 0.20 0.00 0.18 0.00 0.00 52.55 53.96 2jrs s ASP 61 Cb -0.10 -2.54 1.07 0.00 1.07 0.00 0.00 42.92 42.42 2jrs s ASP 61 CO 0.30 -1.65 1.62 -1.54 1.18 0.00 0.00 175.17 175.07 2jrs n SER 62 N 9.65 0.53 0.09 0.27 3.41 -1.26 0.90 113.62 127.21 2jrs n SER 62 Ca 0.16 0.73 -0.02 0.00 -0.26 0.00 0.00 58.87 59.49 2jrs n SER 62 Cb 0.49 -0.81 0.23 0.00 -0.26 0.00 0.00 64.21 63.86 2jrs n SER 62 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 2jrs h GLU 63 N 0.00 0.24 0.00 4.33 4.57 -1.99 -3.42 114.58 118.31 2jrs h GLU 63 Ca 0.00 -0.11 0.00 0.00 -1.18 0.00 0.00 59.36 58.07 2jrs h GLU 63 Cb 0.03 -0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.62 2jrs h GLU 63 CO 0.00 0.61 0.00 0.25 -1.18 0.00 0.00 179.01 178.69 2jrs n THR 64 N -4.04 0.00 0.00 0.32 -2.24 -0.75 -5.06 114.28 102.52 2jrs n THR 64 Ca -0.01 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.77 2jrs n THR 64 Cb 0.47 -0.43 0.00 0.00 -2.10 0.00 0.00 70.33 68.27 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 1.10 1.16 0.00 3.38 0.00 0.26 -5.04 105.19 106.04 2jrs n GLY 65 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 0.00 1.47 -4.71 1.61 5.12 -1.24 -4.70 116.66 114.21 2jrs n ARG 66 Ca 0.00 0.00 -0.33 0.00 -1.93 0.00 0.00 57.85 55.59 2jrs n ARG 66 Cb 0.00 0.00 -0.14 0.00 -1.16 0.00 0.00 32.46 31.16 2jrs n ARG 66 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 2jrs s SER 67 N -1.00 4.17 0.00 0.55 0.15 -1.26 -1.29 113.70 115.03 2jrs s SER 67 Ca 0.00 -0.28 0.29 0.00 0.70 0.00 0.00 55.95 56.66 2jrs s SER 67 Cb 0.00 -1.61 1.28 0.00 -1.71 0.00 0.00 66.02 63.99 2jrs s SER 67 CO 0.00 0.18 1.92 0.29 1.20 0.00 0.00 173.24 176.83 2jrs n LYS 68 N 3.45 0.32 -0.22 5.44 5.02 -0.28 -4.78 118.16 127.11 2jrs n LYS 68 Ca -0.18 -0.05 0.00 0.00 -2.02 0.00 0.00 58.31 56.06 2jrs n LYS 68 Cb 0.53 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 34.04 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 1.37 0.78 3.25 0.72 0.00 -1.26 -4.98 105.19 105.08 2jrs n GLY 69 Ca 0.11 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.02 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 -2.17 -0.07 0.12 1.61 1.13 -1.26 -0.25 117.35 116.46 2jrs s TYR 70 Ca 0.00 -0.14 -0.13 0.00 -1.41 0.00 0.00 57.07 55.39 2jrs s TYR 70 Cb 0.00 0.09 0.02 0.00 -1.10 0.00 0.00 41.96 40.97 2jrs s TYR 70 CO 0.00 -0.54 0.32 0.20 -2.51 0.00 0.00 175.55 173.02 2jrs s GLY 71 N -2.31 -0.03 -0.05 5.49 0.00 0.13 -1.81 107.32 108.74 2jrs s GLY 71 Ca -0.02 -0.38 0.04 0.00 0.00 0.00 0.00 44.72 44.36 2jrs s GLY 71 CO -0.06 -0.55 -0.16 -1.36 0.00 0.00 0.00 173.10 170.97 2jrs s PHE 72 N -3.85 2.66 0.04 1.90 0.40 0.22 -0.60 117.98 118.75 2jrs s PHE 72 Ca 0.06 -0.25 0.08 0.00 -0.60 0.00 0.00 56.93 56.22 2jrs s PHE 72 Cb 0.03 -1.63 -0.03 0.00 0.51 0.00 0.00 43.02 41.90 2jrs s PHE 72 CO -0.09 0.11 -0.23 0.42 0.70 0.00 0.00 175.22 176.13 2jrs s ILE 73 N -0.61 1.86 -0.09 0.64 1.01 0.06 0.08 121.20 124.15 2jrs s ILE 73 Ca 0.09 -1.25 0.03 0.00 0.00 0.00 0.00 60.65 59.51 2jrs s ILE 73 Cb -0.11 -1.60 -0.02 0.00 0.01 0.00 0.00 42.46 40.74 2jrs s ILE 73 CO 0.01 0.29 -0.17 -0.89 0.00 0.00 0.00 174.94 174.18 2jrs s THR 74 N -0.78 2.78 0.07 2.92 2.01 0.55 -0.30 115.64 122.89 2jrs s THR 74 Ca 0.09 -0.79 0.07 0.00 0.31 0.00 0.00 61.69 61.37 2jrs s THR 74 Cb -0.09 -2.11 -0.03 0.00 0.01 0.00 0.00 72.50 70.28 2jrs s THR 74 CO 0.02 0.56 -0.19 -0.36 -0.69 0.00 0.00 174.62 173.95 2jrs s PHE 75 N -0.08 1.67 -1.51 4.92 0.08 0.40 -0.44 117.98 123.02 2jrs s PHE 75 Ca -0.03 -0.40 0.13 0.00 0.12 0.00 0.00 56.93 56.75 2jrs s PHE 75 Cb -0.14 -0.95 0.48 0.00 -0.57 0.00 0.00 43.02 41.84 2jrs s PHE 75 CO 0.04 0.13 1.36 0.43 -0.10 0.00 0.00 175.22 177.08 2jrs n SER 76 N 1.45 3.18 -3.54 1.36 7.64 -1.26 -0.13 113.62 122.32 2jrs n SER 76 Ca -0.19 -2.21 -0.22 0.00 1.01 0.00 0.00 58.87 57.27 2jrs n SER 76 Cb 0.54 -0.43 -0.15 0.00 -1.01 0.00 0.00 64.21 63.16 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 -0.84 1.90 0.36 6.43 -1.08 -1.26 -4.60 116.67 117.58 2jrs s ASP 77 Ca 0.35 -0.46 0.10 0.00 -0.52 0.00 0.00 52.55 52.02 2jrs s ASP 77 Cb 0.21 0.09 0.69 0.00 -1.46 0.00 0.00 42.92 42.45 2jrs s ASP 77 CO 0.19 -0.34 1.84 0.28 0.52 0.00 0.00 175.17 177.65 2jrs h SER 78 N 8.36 0.16 0.56 -0.34 0.02 -1.86 -2.81 113.55 117.65 2jrs h SER 78 Ca -0.16 -0.05 -0.03 0.00 -0.84 0.00 0.00 61.79 60.71 2jrs h SER 78 Cb 1.14 -0.04 0.01 0.00 0.14 0.00 0.00 62.40 63.64 2jrs h SER 78 CO 0.30 0.44 -0.27 -0.33 -1.14 0.00 0.00 176.83 175.82 2jrs h GLU 79 N 0.15 -0.73 -0.89 3.45 5.08 -1.96 0.47 114.58 120.15 2jrs h GLU 79 Ca 0.02 0.05 0.05 0.00 -1.00 0.00 0.00 59.36 58.48 2jrs h GLU 79 Cb 0.56 0.17 -0.05 0.00 0.50 0.00 0.00 28.75 29.92 2jrs h GLU 79 CO 0.04 -0.42 0.58 0.00 -1.00 0.00 0.00 179.01 178.21 2jrs h ALA 81 N 1.50 0.91 -0.57 0.00 0.00 -1.43 0.36 119.26 120.03 2jrs h ALA 81 Ca 0.37 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 55.08 2jrs h ALA 81 Cb 0.12 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.61 2jrs h ALA 81 CO -0.13 0.55 0.36 -0.22 0.00 0.00 0.00 179.25 179.82 2jrs h LYS 82 N 1.00 0.77 -0.17 0.00 3.64 -0.08 -1.38 116.57 120.34 2jrs h LYS 82 Ca 0.23 -0.06 -0.02 0.00 -1.27 0.00 0.00 60.65 59.53 2jrs h LYS 82 Cb 0.24 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 31.89 2jrs h LYS 82 CO -0.01 0.53 0.03 -0.22 -2.27 0.00 0.00 179.45 177.50 2jrs h LYS 83 N 0.77 0.29 -0.28 1.90 3.64 -1.07 -0.79 116.57 121.02 2jrs h LYS 83 Ca 0.21 -0.08 0.07 0.00 -1.27 0.00 0.00 60.65 59.58 2jrs h LYS 83 Cb -0.06 -0.03 -0.07 0.00 -0.41 0.00 0.00 32.23 31.66 2jrs h LYS 83 CO -0.04 0.45 -0.18 0.00 -2.27 0.00 0.00 179.45 177.41 2jrs h ALA 84 N 0.82 0.02 0.05 5.00 0.00 -0.79 0.28 119.26 124.65 2jrs h ALA 84 Ca 0.05 0.10 0.02 0.00 0.00 0.00 0.00 54.91 55.09 2jrs h ALA 84 Cb 0.30 0.40 -0.03 0.00 0.00 0.00 0.00 17.79 18.46 2jrs h ALA 84 CO 0.00 -0.58 -0.21 1.25 0.00 0.00 0.00 179.25 179.71 2jrs h LEU 85 N -0.15 -0.62 -1.87 0.00 6.46 -1.20 0.02 115.31 117.95 2jrs h LEU 85 Ca 0.15 0.08 -0.02 0.00 -0.12 0.00 0.00 57.88 57.97 2jrs h LEU 85 Cb 0.38 0.25 -0.00 0.00 -0.73 0.00 0.00 40.66 40.55 2jrs h LEU 85 CO -0.37 -0.29 -0.11 -0.08 -0.62 0.00 0.00 178.44 176.97 2jrs h GLU 86 N -0.37 0.00 0.11 1.25 4.57 -0.53 0.41 114.58 120.02 2jrs h GLU 86 Ca 0.04 0.00 -0.35 0.00 -1.18 0.00 0.00 59.36 57.87 2jrs h GLU 86 Cb 0.42 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 28.99 2jrs h GLU 86 CO -0.16 0.11 -1.93 1.96 -1.18 0.00 0.00 179.01 177.81 2jrs h GLN 87 N 0.00 0.23 0.00 1.92 7.50 -0.75 -3.40 115.11 120.60 2jrs h GLN 87 Ca -0.00 -0.39 -0.10 0.00 0.50 0.00 0.00 58.65 58.66 2jrs h GLN 87 Cb 0.22 0.15 -0.02 0.00 0.05 0.00 0.00 27.48 27.87 2jrs h GLN 87 CO 0.01 1.10 -1.43 1.28 -1.50 0.00 0.00 178.83 178.29 2jrs n LEU 88 N -3.41 0.67 -4.56 1.46 4.77 -0.03 -4.54 117.00 111.37 2jrs n LEU 88 Ca -0.29 0.28 -0.39 0.00 -0.03 0.00 0.00 56.01 55.58 2jrs n LEU 88 Cb 1.05 0.05 -0.03 0.00 -2.33 0.00 0.00 43.42 42.16 2jrs n LEU 88 CO 0.44 0.04 1.59 0.21 -1.33 0.00 0.00 177.39 178.34 2jrs s ASN 89 N -5.44 5.35 0.00 -1.43 2.47 0.12 -0.84 114.94 115.17 2jrs s ASN 89 Ca -0.03 0.42 0.00 0.00 0.42 0.00 0.00 52.86 53.67 2jrs s ASN 89 Cb 0.10 -2.53 0.00 0.00 -1.45 0.00 0.00 41.25 37.37 2jrs s ASN 89 CO 0.82 -2.30 0.00 0.61 -3.72 0.00 0.00 177.10 172.51 2jrs n GLY 90 N 5.66 1.82 3.69 1.21 0.00 0.15 -4.87 105.19 112.85 2jrs n GLY 90 Ca 0.20 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.80 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 -2.07 2.88 -0.98 1.61 5.36 -0.02 -4.50 117.98 120.25 2jrs s PHE 91 Ca 0.00 0.83 -0.23 0.00 -0.96 0.00 0.00 56.93 56.56 2jrs s PHE 91 Cb 0.00 -3.66 0.03 0.00 -0.34 0.00 0.00 43.02 39.05 2jrs s PHE 91 CO 0.00 -2.45 1.54 -1.21 -1.46 0.00 0.00 175.22 171.65 2jrs s GLU 92 N 2.31 3.37 0.04 10.12 2.02 -1.26 -0.13 118.70 135.17 2jrs s GLU 92 Ca 0.64 -0.92 -0.29 0.00 0.02 0.00 0.00 54.97 54.43 2jrs s GLU 92 Cb -0.32 -5.25 -0.04 0.00 0.10 0.00 0.00 34.13 28.62 2jrs s GLU 92 CO 0.27 -2.44 0.92 -1.17 0.02 0.00 0.00 175.26 172.87 2jrs s LEU 93 N 6.02 4.42 -1.80 1.80 2.96 -0.39 -3.35 118.68 128.34 2jrs s LEU 93 Ca 0.50 1.64 0.00 0.00 -0.22 0.00 0.00 54.13 56.05 2jrs s LEU 93 Cb -0.02 -3.49 0.00 0.00 0.50 0.00 0.00 46.19 43.18 2jrs s LEU 93 CO -0.07 -0.15 0.00 0.00 -1.32 0.00 0.00 176.35 174.81 2jrs n ALA 94 N 3.38 -0.42 -2.26 5.97 0.00 -1.26 -2.19 120.51 123.73 2jrs n ALA 94 Ca 0.03 0.23 -0.05 0.00 0.00 0.00 0.00 53.44 53.65 2jrs n ALA 94 Cb 0.50 -1.97 0.00 0.00 0.00 0.00 0.00 19.45 17.99 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 -0.85 0.31 3.60 0.00 0.00 -1.21 -5.05 105.19 101.98 2jrs n GLY 95 Ca -0.21 -0.64 -0.08 0.00 0.00 0.00 0.00 46.02 45.09 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 -4.50 0.70 0.01 1.61 3.52 -0.93 -5.07 118.95 114.29 2jrs s ARG 96 Ca 0.03 1.15 -0.37 0.00 -0.13 0.00 0.00 55.73 56.41 2jrs s ARG 96 Cb -0.01 0.17 -0.16 0.00 -1.56 0.00 0.00 34.95 33.38 2jrs s ARG 96 CO 0.04 -0.14 1.46 -2.30 -0.81 0.00 0.00 175.30 173.55 2jrs n PRO 97 N 4.05 1.26 -3.54 5.12 -0.02 -1.26 -1.26 135.00 139.35 2jrs n PRO 97 Ca -0.19 0.46 -0.39 0.00 -2.02 0.00 0.00 63.50 61.35 2jrs n PRO 97 Cb 0.58 -2.13 -0.11 0.00 -0.02 0.00 0.00 33.50 31.83 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 1.24 3.75 -0.53 -0.52 1.75 0.82 -4.80 119.30 121.01 2jrs s MET 98 Ca 0.87 -0.43 -0.22 0.00 -1.25 0.00 0.00 55.69 54.66 2jrs s MET 98 Cb -0.95 -3.73 0.05 0.00 2.84 0.00 0.00 34.83 33.04 2jrs s MET 98 CO 0.50 -0.31 0.81 0.15 -0.65 0.00 0.00 175.02 175.52 2jrs s LYS 99 N 1.78 3.25 -0.49 4.11 1.02 -1.23 -0.68 119.74 127.50 2jrs s LYS 99 Ca 0.07 -0.51 -0.09 0.00 0.02 0.00 0.00 55.97 55.46 2jrs s LYS 99 Cb -0.17 -4.07 0.13 0.00 -0.52 0.00 0.00 37.83 33.20 2jrs s LYS 99 CO 0.11 -1.38 0.36 0.08 -0.92 0.00 0.00 175.35 173.60 2jrs s VAL 100 N 3.42 4.22 0.29 3.17 1.01 -1.26 -0.30 120.40 130.94 2jrs s VAL 100 Ca 0.24 -1.88 0.08 0.00 0.00 0.00 0.00 61.98 60.42 2jrs s VAL 100 Cb -0.15 -3.77 -0.03 0.00 0.00 0.00 0.00 36.38 32.42 2jrs s VAL 100 CO 0.16 -0.79 0.19 -0.83 0.00 0.00 0.00 175.10 173.83 2jrs s GLY 101 N 2.55 1.64 0.00 4.51 0.00 0.67 -4.63 107.32 112.06 2jrs s GLY 101 Ca 0.07 -1.59 0.00 0.00 0.00 0.00 0.00 44.72 43.20 2jrs s GLY 101 CO -0.01 -1.58 0.26 1.42 0.00 0.00 0.00 173.10 173.19 2jrs n HIS 102 N -1.20 0.00 -2.70 1.90 8.25 -1.26 0.40 115.22 120.61 2jrs n HIS 102 Ca -0.05 0.00 -0.07 0.00 -0.26 0.00 0.00 57.72 57.34 2jrs n HIS 102 Cb 0.59 0.00 0.03 0.00 1.12 0.00 0.00 29.99 31.74 2jrs n HIS 102 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 2jrs n VAL 103 N -0.36 1.10 -4.08 1.59 0.31 -1.26 -0.34 118.33 115.29 2jrs n VAL 103 Ca 0.00 -3.06 0.03 0.00 -0.01 0.00 0.00 64.34 61.30 2jrs n VAL 103 Cb 0.00 0.78 -0.01 0.00 -0.91 0.00 0.00 33.84 33.71 2jrs n VAL 103 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 2jrs n THR 104 N -0.22 0.00 0.00 2.52 -1.04 -1.26 -4.85 114.28 109.43 2jrs n THR 104 Ca 0.09 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.10 2jrs n THR 104 Cb 0.81 -0.08 0.00 0.00 -1.82 0.00 0.00 70.33 69.25 2jrs n THR 104 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 2jrs n GLU 105 N -1.95 0.00 -3.09 -2.82 -0.58 -1.26 -4.72 120.64 106.21 2jrs n GLU 105 Ca 0.00 0.00 -0.45 0.00 -0.42 0.00 0.00 57.16 56.30 2jrs n GLU 105 Cb 0.10 0.00 -0.04 0.00 -0.57 0.00 0.00 31.44 30.93 2jrs n GLU 105 CO 0.00 0.00 0.00 1.03 -0.48 0.00 0.00 177.13 177.68 2jrs s ARG 106 N 0.00 3.05 0.13 3.49 0.52 -1.26 -4.72 118.95 120.16 2jrs s ARG 106 Ca 0.00 -1.30 0.00 0.00 -0.52 0.00 0.00 55.73 53.91 2jrs s ARG 106 Cb 0.00 -4.27 0.00 0.00 0.52 0.00 0.00 34.95 31.20 2jrs s ARG 106 CO 0.00 -1.56 0.00 2.41 0.02 0.00 0.00 175.30 176.17 2jrs n THR 107 N 5.57 0.94 -0.58 0.02 -1.04 -1.26 -4.74 114.28 113.18 2jrs n THR 107 Ca -0.09 0.31 0.00 0.00 -2.04 0.00 0.00 64.05 62.23 2jrs n THR 107 Cb 0.43 -1.39 0.00 0.00 -1.82 0.00 0.00 70.33 67.55 2jrs n THR 107 CO 0.00 0.00 0.00 -0.90 -0.64 0.00 0.00 175.07 173.53