#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1oh1 s SER 2 N 0.00 6.25 0.67 1.61 0.01 -1.26 -5.02 113.70 115.96 1oh1 s SER 2 Ca 0.00 -0.75 -0.15 0.00 1.31 0.00 0.00 55.95 56.35 1oh1 s SER 2 Cb 0.00 -2.55 0.01 0.00 0.21 0.00 0.00 66.02 63.69 1oh1 s SER 2 CO 0.00 -1.72 1.14 -0.04 0.41 0.00 0.00 173.24 173.03 1oh1 s MET 3 N 5.37 2.67 -0.49 12.44 1.00 -1.26 -4.53 119.30 134.49 1oh1 s MET 3 Ca 0.36 1.52 -0.01 0.00 0.00 0.00 0.00 55.69 57.57 1oh1 s MET 3 Cb -0.07 -1.92 -0.01 0.00 0.00 0.00 0.00 34.83 32.83 1oh1 s MET 3 CO 0.08 -1.38 0.46 0.39 0.00 0.00 0.00 175.02 174.57 1oh1 n GLU 4 N -2.39 -0.91 -3.10 2.03 1.02 -1.26 -5.07 120.64 110.96 1oh1 n GLU 4 Ca 0.11 1.03 0.02 0.00 -0.02 0.00 0.00 57.16 58.31 1oh1 n GLU 4 Cb 0.51 -4.16 -0.00 0.00 -0.02 0.00 0.00 31.44 27.77 1oh1 n GLU 4 CO 0.00 0.00 0.00 -1.14 1.18 0.00 0.00 177.13 177.17 1oh1 s GLN 5 N -3.14 0.56 -0.41 3.49 0.74 -1.11 -4.84 119.66 114.95 1oh1 s GLN 5 Ca 0.04 0.01 -0.11 0.00 0.05 0.00 0.00 55.36 55.35 1oh1 s GLN 5 Cb -0.01 0.11 0.01 0.00 1.10 0.00 0.00 33.01 34.23 1oh1 s GLN 5 CO 0.47 -0.87 0.52 0.34 -0.55 0.00 0.00 175.29 175.20 1oh1 n PHE 6 N 4.57 -2.90 -3.40 1.67 7.35 0.98 -4.97 117.46 120.76 1oh1 n PHE 6 Ca 0.08 1.16 -0.44 0.00 -0.76 0.00 0.00 57.45 57.49 1oh1 n PHE 6 Cb 0.58 -3.71 -0.06 0.00 0.35 0.00 0.00 39.48 36.64 1oh1 n PHE 6 CO 0.00 0.00 0.00 -1.21 -0.76 0.00 0.00 176.76 174.79 1oh1 s GLU 7 N -2.47 2.91 -0.40 -4.13 8.01 -0.20 -5.00 118.70 117.42 1oh1 s GLU 7 Ca 0.18 -1.87 -0.10 0.00 0.01 0.00 0.00 54.97 53.19 1oh1 s GLU 7 Cb -0.05 -4.19 0.05 0.00 -4.31 0.00 0.00 34.13 25.64 1oh1 s GLU 7 CO 0.65 -1.28 0.24 -0.51 0.01 0.00 0.00 175.26 174.37 1oh1 s LEU 8 N 1.26 4.96 0.03 1.80 1.43 -1.25 -0.15 118.68 126.76 1oh1 s LEU 8 Ca 0.07 -1.24 0.09 0.00 -1.03 0.00 0.00 54.13 52.01 1oh1 s LEU 8 Cb -0.26 -2.02 -0.03 0.00 0.03 0.00 0.00 46.19 43.92 1oh1 s LEU 8 CO -0.00 -0.47 -0.25 -0.36 0.23 0.00 0.00 176.35 175.49 1oh1 s PHE 9 N 1.50 2.35 -0.12 0.29 0.08 0.19 -5.01 117.98 117.26 1oh1 s PHE 9 Ca 0.02 -0.40 -0.01 0.00 0.12 0.00 0.00 56.93 56.66 1oh1 s PHE 9 Cb -0.21 -1.42 0.03 0.00 -0.57 0.00 0.00 43.02 40.85 1oh1 s PHE 9 CO 0.05 0.11 -0.02 -1.12 -0.10 0.00 0.00 175.22 174.13 1oh1 s SER 10 N -1.14 2.15 0.80 1.36 0.01 -1.26 -0.21 113.70 115.42 1oh1 s SER 10 Ca 0.12 -0.35 -0.12 0.00 1.31 0.00 0.00 55.95 56.91 1oh1 s SER 10 Cb -0.10 -0.65 0.07 0.00 0.21 0.00 0.00 66.02 65.55 1oh1 s SER 10 CO 0.02 -0.19 1.10 0.27 0.41 0.00 0.00 173.24 174.85 1oh1 s ILE 11 N 1.83 2.99 0.22 1.44 -4.36 -0.64 -2.93 121.20 119.74 1oh1 s ILE 11 Ca 0.03 0.32 -0.03 0.00 -0.26 0.00 0.00 60.65 60.72 1oh1 s ILE 11 Cb -0.14 -3.10 0.02 0.00 1.25 0.00 0.00 42.46 40.49 1oh1 s ILE 11 CO -0.07 -0.42 1.61 0.44 0.24 0.00 0.00 174.94 176.75 1oh1 h ASP 12 N -1.08 0.68 -6.85 4.36 3.32 -1.88 0.17 116.42 115.15 1oh1 h ASP 12 Ca -0.47 -0.27 -0.57 0.00 0.02 0.00 0.00 57.03 55.73 1oh1 h ASP 12 Cb 1.27 -0.19 -0.15 0.00 0.22 0.00 0.00 39.33 40.49 1oh1 h ASP 12 CO 0.60 0.95 -0.94 1.17 -1.72 0.00 0.00 179.24 179.31 1oh1 n LYS 13 N -4.07 -1.89 0.00 3.56 0.00 -1.26 -4.15 118.16 110.35 1oh1 n LYS 13 Ca -0.01 0.22 0.00 0.00 0.00 0.00 0.00 58.31 58.52 1oh1 n LYS 13 Cb 0.47 -3.98 0.00 0.00 0.00 0.00 0.00 35.03 31.53 1oh1 n LYS 13 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.40 178.59 1oh1 n PHE 14 N -4.51 0.00 -1.15 5.64 3.72 -1.26 -4.86 117.46 115.04 1oh1 n PHE 14 Ca -0.32 0.00 -0.08 0.00 -0.05 0.00 0.00 57.45 57.00 1oh1 n PHE 14 Cb 0.69 0.00 0.06 0.00 -0.94 0.00 0.00 39.48 39.29 1oh1 n PHE 14 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 176.76 177.88 1oh1 n LYS 15 N 0.00 -0.58 -1.73 -1.08 4.81 -1.26 -4.98 118.16 113.34 1oh1 n LYS 15 Ca 0.00 -0.56 -0.01 0.00 -0.87 0.00 0.00 58.31 56.88 1oh1 n LYS 15 Cb 0.00 -0.39 -0.01 0.00 0.02 0.00 0.00 35.03 34.65 1oh1 n LYS 15 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1oh1 h ASN 17 N 0.78 -0.31 -4.21 0.00 -1.24 -1.96 -3.44 115.58 105.20 1oh1 h ASN 17 Ca -0.09 0.02 -0.52 0.00 0.71 0.00 0.00 56.30 56.42 1oh1 h ASN 17 Cb 0.20 0.09 0.13 0.00 0.73 0.00 0.00 38.32 39.47 1oh1 h ASN 17 CO 0.01 -0.20 0.36 -0.55 -1.29 0.00 0.00 177.43 175.76 1oh1 s SER 18 N -2.58 4.51 0.15 1.15 0.15 -1.26 -4.65 113.70 111.17 1oh1 s SER 18 Ca -0.05 2.14 0.00 0.00 0.70 0.00 0.00 55.95 58.74 1oh1 s SER 18 Cb 0.01 -2.56 0.00 0.00 -1.71 0.00 0.00 66.02 61.75 1oh1 s SER 18 CO 0.15 -2.04 0.00 -1.84 1.20 0.00 0.00 173.24 170.71 1oh1 n GLU 19 N -2.79 -4.29 0.00 5.44 0.28 -1.26 -4.82 120.64 113.19 1oh1 n GLU 19 Ca 0.12 3.16 0.00 0.00 -0.16 0.00 0.00 57.16 60.28 1oh1 n GLU 19 Cb 0.51 -3.32 0.00 0.00 1.43 0.00 0.00 31.44 30.07 1oh1 n GLU 19 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1oh1 n ALA 20 N 1.46 0.00 -0.58 -1.84 0.00 -1.26 -4.99 120.51 113.30 1oh1 n ALA 20 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1oh1 n ALA 20 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1oh1 n ALA 20 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1oh1 n LYS 21 N 0.00 0.00 -0.24 0.00 3.00 -1.26 -0.32 118.16 119.34 1oh1 n LYS 21 Ca 0.00 0.31 0.22 0.00 -0.00 0.00 0.00 58.31 58.85 1oh1 n LYS 21 Cb 0.00 -1.21 0.57 0.00 0.00 0.00 0.00 35.03 34.38 1oh1 n LYS 21 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 177.40 177.50 1oh1 h TYR 22 N 0.00 0.42 0.40 5.64 -0.00 -1.94 0.17 116.97 121.67 1oh1 h TYR 22 Ca 0.00 0.01 -0.02 0.00 -0.00 0.00 0.00 58.73 58.72 1oh1 h TYR 22 Cb 0.00 -0.13 0.00 0.00 -0.00 0.00 0.00 36.73 36.61 1oh1 h TYR 22 CO -0.01 0.09 -0.19 -0.92 -0.00 0.00 0.00 178.16 177.14 1oh1 h TYR 23 N 0.30 -0.50 -0.73 0.10 3.20 -1.72 -1.12 116.97 116.50 1oh1 h TYR 23 Ca 0.48 -0.01 0.03 0.00 3.14 0.00 0.00 58.73 62.37 1oh1 h TYR 23 Cb 1.37 0.16 -0.05 0.00 1.54 0.00 0.00 36.73 39.76 1oh1 h TYR 23 CO -0.00 -0.31 0.46 1.37 -1.64 0.00 0.00 178.16 178.04 1oh1 h LEU 24 N -0.54 0.76 -2.10 2.82 8.10 0.02 0.22 115.31 124.59 1oh1 h LEU 24 Ca -0.05 -0.00 0.03 0.00 0.11 0.00 0.00 57.88 57.96 1oh1 h LEU 24 Cb 0.41 -0.17 -0.00 0.00 -0.44 0.00 0.00 40.66 40.46 1oh1 h LEU 24 CO 0.09 0.53 0.07 0.78 -4.11 0.00 0.00 178.44 175.80 1oh1 h ASN 25 N 0.90 0.00 0.00 0.17 4.21 -0.64 0.18 115.58 120.41 1oh1 h ASN 25 Ca 0.29 0.00 -0.07 0.00 1.21 0.00 0.00 56.30 57.74 1oh1 h ASN 25 Cb 0.01 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 37.20 1oh1 h ASN 25 CO -0.11 0.00 -1.49 -0.38 -1.29 0.00 0.00 177.43 174.16 1oh1 n ILE 26 N -4.34 0.25 -0.07 2.81 -0.00 -0.43 -4.82 119.36 112.76 1oh1 n ILE 26 Ca -0.01 -0.28 -0.07 0.00 -0.00 0.00 0.00 62.75 62.40 1oh1 n ILE 26 Cb 0.18 -0.17 -0.10 0.00 -0.00 0.00 0.00 39.64 39.55 1oh1 n ILE 26 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 1oh1 n ILE 27 N -2.03 0.92 -1.65 1.39 3.06 0.71 -4.96 119.36 116.80 1oh1 n ILE 27 Ca -0.07 -0.56 -0.42 0.00 -2.50 0.00 0.00 62.75 59.20 1oh1 n ILE 27 Cb 0.47 -0.67 -0.03 0.00 0.54 0.00 0.00 39.64 39.96 1oh1 n ILE 27 CO 0.00 0.00 0.00 -0.70 -2.50 0.00 0.00 176.55 173.35 1oh1 s GLU 28 N -2.32 3.06 0.00 9.51 2.12 0.63 -4.31 118.70 127.39 1oh1 s GLU 28 Ca -0.07 1.91 0.00 0.00 0.36 0.00 0.00 54.97 57.16 1oh1 s GLU 28 Cb 0.04 -4.37 0.00 0.00 0.26 0.00 0.00 34.13 30.06 1oh1 s GLU 28 CO 0.54 -2.18 0.00 0.41 -0.54 0.00 0.00 175.26 173.48 1oh1 n GLY 29 N 5.75 0.44 2.99 -1.50 0.00 -0.23 -4.94 105.19 107.69 1oh1 n GLY 29 Ca 0.30 -1.77 -0.26 0.00 0.00 0.00 0.00 46.02 44.29 1oh1 n GLY 29 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1oh1 s GLU 30 N 0.00 1.76 0.50 1.61 1.03 -1.25 -0.68 118.70 121.67 1oh1 s GLU 30 Ca 0.00 -0.39 -0.22 0.00 0.03 0.00 0.00 54.97 54.39 1oh1 s GLU 30 Cb 0.00 -1.59 -0.06 0.00 -0.80 0.00 0.00 34.13 31.67 1oh1 s GLU 30 CO 0.00 -0.11 1.24 -1.58 -1.33 0.00 0.00 175.26 173.48 1oh1 s TRP 31 N 1.15 2.63 0.31 4.83 0.52 -0.54 -4.91 118.94 122.93 1oh1 s TRP 31 Ca -0.05 1.47 0.00 0.00 0.02 0.00 0.00 56.10 57.54 1oh1 s TRP 31 Cb -0.14 -3.54 0.00 0.00 -1.15 0.00 0.00 33.47 28.64 1oh1 s TRP 31 CO -0.02 -2.06 0.00 0.72 0.02 0.00 0.00 176.95 175.60 1oh1 n HIS 32 N -0.75 -2.39 -1.45 -1.98 8.25 -1.26 -4.02 115.22 111.62 1oh1 n HIS 32 Ca 0.09 1.29 -0.30 0.00 -0.26 0.00 0.00 57.72 58.53 1oh1 n HIS 32 Cb 0.47 -2.28 0.23 0.00 1.12 0.00 0.00 29.99 29.53 1oh1 n HIS 32 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 1oh1 n PRO 33 N -1.63 -2.34 -2.61 -0.41 -0.04 -1.26 -4.96 135.00 121.75 1oh1 n PRO 33 Ca 0.00 -1.90 -0.34 0.00 -0.04 0.00 0.00 63.50 61.21 1oh1 n PRO 33 Cb 0.15 -1.53 0.00 0.00 -0.04 0.00 0.00 33.50 32.08 1oh1 n PRO 33 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 1oh1 n GLN 34 N -4.41 4.07 -0.76 0.54 6.02 -1.26 -4.71 117.38 116.87 1oh1 n GLN 34 Ca 0.16 -4.55 -0.01 0.00 -0.01 0.00 0.00 57.00 52.59 1oh1 n GLN 34 Cb 0.59 -2.34 0.20 0.00 1.02 0.00 0.00 30.24 29.71 1oh1 n GLN 34 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.06 175.80 1oh1 n ASP 35 N -0.25 2.23 -2.73 1.08 9.92 -1.26 -4.74 116.55 120.81 1oh1 n ASP 35 Ca 0.42 -3.84 -0.05 0.00 -0.53 0.00 0.00 54.79 50.78 1oh1 n ASP 35 Cb 0.35 -0.59 0.03 0.00 -0.64 0.00 0.00 41.12 40.27 1oh1 n ASP 35 CO 0.00 0.00 0.00 -0.11 0.13 0.00 0.00 177.20 177.22 1oh1 n LEU 36 N -1.12 -2.61 0.00 0.64 7.94 -1.26 -4.99 117.00 115.60 1oh1 n LEU 36 Ca 0.28 -2.43 0.00 0.00 -1.11 0.00 0.00 56.01 52.75 1oh1 n LEU 36 Cb 0.90 0.71 0.00 0.00 0.53 0.00 0.00 43.42 45.55 1oh1 n LEU 36 CO 0.11 1.74 0.00 0.59 -1.11 0.00 0.00 177.39 178.71 1oh1 n ASN 37 N 2.37 0.00 -1.41 1.96 3.02 -1.26 -4.31 115.26 115.63 1oh1 n ASN 37 Ca 0.12 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.67 1oh1 n ASN 37 Cb 0.62 -0.03 0.00 0.00 -0.61 0.00 0.00 39.78 39.75 1oh1 n ASN 37 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1oh1 n ASP 38 N 0.22 -1.89 -2.69 6.41 2.03 -1.26 -5.11 116.55 114.26 1oh1 n ASP 38 Ca 0.00 0.00 -0.02 0.00 0.52 0.00 0.00 54.79 55.29 1oh1 n ASP 38 Cb 0.00 -0.94 0.12 0.00 -0.72 0.00 0.00 41.12 39.57 1oh1 n ASP 38 CO 0.00 0.00 0.00 -1.54 -1.92 0.00 0.00 177.20 173.74 1oh1 n SER 39 N 0.00 -1.04 -1.47 1.67 3.41 -1.26 -4.80 113.62 110.14 1oh1 n SER 39 Ca 0.00 -2.20 0.00 0.00 -0.26 0.00 0.00 58.87 56.41 1oh1 n SER 39 Cb 0.00 0.53 0.00 0.00 -0.26 0.00 0.00 64.21 64.48 1oh1 n SER 39 CO 0.00 0.00 0.00 -0.81 -0.16 0.00 0.00 175.04 174.07 1oh1 n PRO 40 N -1.40 3.45 -3.67 4.33 -0.05 -1.26 -0.01 135.00 136.40 1oh1 n PRO 40 Ca -0.14 0.00 -0.39 0.00 -0.05 0.00 0.00 63.50 62.92 1oh1 n PRO 40 Cb 0.87 0.00 -0.10 0.00 -0.05 0.00 0.00 33.50 34.22 1oh1 n PRO 40 CO 0.00 0.00 0.00 -1.17 -0.05 0.00 0.00 175.50 174.28 1oh1 s LEU 41 N 0.00 5.43 -0.16 1.53 2.96 -1.26 -1.04 118.68 126.15 1oh1 s LEU 41 Ca 0.00 -1.94 -0.00 0.00 -0.22 0.00 0.00 54.13 51.97 1oh1 s LEU 41 Cb 0.00 -1.92 -0.00 0.00 0.50 0.00 0.00 46.19 44.77 1oh1 s LEU 41 CO 0.00 -0.61 -0.13 -1.59 -1.32 0.00 0.00 176.35 172.70 1oh1 s LYS 42 N 1.26 3.27 -0.02 1.98 0.00 0.79 -1.46 119.74 125.55 1oh1 s LYS 42 Ca 0.07 -0.72 0.04 0.00 0.00 0.00 0.00 55.97 55.36 1oh1 s LYS 42 Cb -0.24 -2.68 -0.01 0.00 0.00 0.00 0.00 37.83 34.89 1oh1 s LYS 42 CO -0.02 0.01 -0.15 0.12 0.00 0.00 0.00 175.35 175.31 1oh1 s PHE 43 N 0.84 1.41 0.48 1.78 2.19 0.14 -0.64 117.98 124.19 1oh1 s PHE 43 Ca -0.04 -0.32 0.00 0.00 0.33 0.00 0.00 56.93 56.90 1oh1 s PHE 43 Cb -0.15 -0.94 0.00 0.00 -1.31 0.00 0.00 43.02 40.62 1oh1 s PHE 43 CO -0.00 -0.07 0.01 1.51 1.83 0.00 0.00 175.22 178.49 1oh1 n ILE 44 N 2.91 0.00 -5.11 3.12 0.13 0.71 -1.07 119.36 120.05 1oh1 n ILE 44 Ca -0.16 -2.27 -0.32 0.00 -1.10 0.00 0.00 62.75 58.90 1oh1 n ILE 44 Cb 0.54 0.45 -0.16 0.00 -0.84 0.00 0.00 39.64 39.63 1oh1 n ILE 44 CO 0.00 0.00 0.00 -0.76 2.80 0.00 0.00 176.55 178.59 1oh1 s LEU 45 N 0.00 2.30 0.00 9.51 1.43 -1.26 -1.62 118.68 129.04 1oh1 s LEU 45 Ca 0.01 -0.43 0.00 0.00 -1.03 0.00 0.00 54.13 52.68 1oh1 s LEU 45 Cb -0.00 -1.45 0.00 0.00 0.03 0.00 0.00 46.19 44.77 1oh1 s LEU 45 CO 0.00 0.24 0.00 -0.24 0.23 0.00 0.00 176.35 176.59 1oh1 n SER 46 N 2.96 0.00 0.00 2.29 2.88 0.61 -4.88 113.62 117.48 1oh1 n SER 46 Ca -0.18 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.36 1oh1 n SER 46 Cb 0.52 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.98 1oh1 n SER 46 CO 0.00 0.00 0.00 0.41 -1.23 0.00 0.00 175.04 174.22 1oh1 n THR 47 N 0.00 0.00 -3.24 2.46 -1.04 -1.26 -4.68 114.28 106.53 1oh1 n THR 47 Ca 0.00 0.00 -0.23 0.00 -2.04 0.00 0.00 64.05 61.78 1oh1 n THR 47 Cb 0.00 0.00 0.01 0.00 -1.82 0.00 0.00 70.33 68.52 1oh1 n THR 47 CO 0.00 0.00 0.00 -1.20 -0.64 0.00 0.00 175.07 173.23 1oh1 n SER 48 N -2.93 -4.80 0.00 8.00 7.64 -1.26 -3.27 113.62 117.00 1oh1 n SER 48 Ca 0.00 -0.36 0.00 0.00 1.01 0.00 0.00 58.87 59.52 1oh1 n SER 48 Cb 0.00 -3.92 0.00 0.00 -1.01 0.00 0.00 64.21 59.28 1oh1 n SER 48 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 1oh1 n ASP 49 N -2.42 0.00 -0.75 6.43 8.00 -1.26 -1.98 116.55 124.58 1oh1 n ASP 49 Ca -0.05 0.00 0.03 0.00 0.71 0.00 0.00 54.79 55.48 1oh1 n ASP 49 Cb 0.57 0.00 0.20 0.00 -0.02 0.00 0.00 41.12 41.87 1oh1 n ASP 49 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1oh1 n ASP 50 N 2.56 2.36 -1.40 -2.24 8.00 -1.26 -5.11 116.55 119.46 1oh1 n ASP 50 Ca 0.00 -3.62 0.18 0.00 0.71 0.00 0.00 54.79 52.07 1oh1 n ASP 50 Cb 0.00 -0.55 -0.06 0.00 -0.02 0.00 0.00 41.12 40.49 1oh1 n ASP 50 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1oh1 n SER 51 N -1.11 -8.27 -0.07 -2.24 7.64 -0.84 -4.80 113.62 103.94 1oh1 n SER 51 Ca 0.24 0.75 -0.05 0.00 1.01 0.00 0.00 58.87 60.82 1oh1 n SER 51 Cb 0.83 -4.37 -0.16 0.00 -1.01 0.00 0.00 64.21 59.50 1oh1 n SER 51 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 1oh1 n ASP 52 N -4.32 0.06 -4.46 6.43 2.03 -1.21 -4.93 116.55 110.15 1oh1 n ASP 52 Ca -0.01 0.03 -0.33 0.00 0.52 0.00 0.00 54.79 54.99 1oh1 n ASP 52 Cb 0.67 1.17 -0.13 0.00 -0.72 0.00 0.00 41.12 42.11 1oh1 n ASP 52 CO 0.00 0.00 0.00 -0.31 -1.92 0.00 0.00 177.20 174.97 1oh1 s TYR 53 N -2.76 2.87 -0.26 -0.67 2.02 -1.15 -1.33 117.35 116.07 1oh1 s TYR 53 Ca -0.09 -0.36 0.03 0.00 -0.37 0.00 0.00 57.07 56.28 1oh1 s TYR 53 Cb 0.08 -1.81 0.06 0.00 -0.40 0.00 0.00 41.96 39.89 1oh1 s TYR 53 CO 0.85 -0.01 -0.11 0.42 -1.57 0.00 0.00 175.55 175.13 1oh1 s ILE 54 N -0.03 2.16 -0.55 2.71 1.01 0.49 -4.02 121.20 122.97 1oh1 s ILE 54 Ca -0.02 -1.63 -0.27 0.00 0.00 0.00 0.00 60.65 58.73 1oh1 s ILE 54 Cb -0.14 -2.27 0.00 0.00 0.01 0.00 0.00 42.46 40.06 1oh1 s ILE 54 CO 0.03 -0.03 1.59 0.00 0.00 0.00 0.00 174.94 176.54 1oh1 h LYS 56 N 12.36 0.50 -3.25 0.00 3.11 -1.87 -3.46 116.57 123.96 1oh1 h LYS 56 Ca -0.28 -0.63 -0.14 0.00 -2.81 0.00 0.00 60.65 56.80 1oh1 h LYS 56 Cb 1.12 0.20 -0.21 0.00 -1.00 0.00 0.00 32.23 32.33 1oh1 h LYS 56 CO 1.17 1.25 -0.39 -0.47 -2.81 0.00 0.00 179.45 178.20 1oh1 s TYR 57 N -3.02 -0.11 -0.03 1.91 6.14 -1.12 -5.06 117.35 116.05 1oh1 s TYR 57 Ca -0.12 0.19 0.03 0.00 0.64 0.00 0.00 57.07 57.81 1oh1 s TYR 57 Cb 0.04 0.04 0.00 0.00 0.42 0.00 0.00 41.96 42.46 1oh1 s TYR 57 CO 0.87 -0.29 -0.10 0.96 0.64 0.00 0.00 175.55 177.63 1oh1 s ILE 58 N -1.04 0.86 -0.38 3.14 -0.00 -1.26 -1.14 121.20 121.37 1oh1 s ILE 58 Ca -0.11 -0.39 0.03 0.00 -0.00 0.00 0.00 60.65 60.18 1oh1 s ILE 58 Cb -0.05 -0.77 0.11 0.00 -0.00 0.00 0.00 42.46 41.74 1oh1 s ILE 58 CO 0.02 0.27 0.12 0.21 -0.00 0.00 0.00 174.94 175.56 1oh1 s ASN 59 N 0.27 4.45 0.38 4.36 3.84 0.88 -4.80 114.94 124.32 1oh1 s ASN 59 Ca -0.05 -2.28 0.06 0.00 0.21 0.00 0.00 52.86 50.80 1oh1 s ASN 59 Cb -0.10 -1.44 0.75 0.00 -0.55 0.00 0.00 41.25 39.91 1oh1 s ASN 59 CO 0.01 -0.35 1.98 0.71 -2.79 0.00 0.00 177.10 176.66 1oh1 h THR 60 N 6.25 1.15 -0.85 -5.21 1.35 -1.93 0.11 112.91 113.78 1oh1 h THR 60 Ca -0.06 -0.46 0.00 0.00 -0.55 0.00 0.00 66.41 65.34 1oh1 h THR 60 Cb 0.99 0.71 -0.04 0.00 -1.73 0.00 0.00 68.15 68.07 1oh1 h THR 60 CO 0.54 0.18 0.53 -0.08 -0.25 0.00 0.00 175.52 176.44 1oh1 h GLU 61 N 0.52 1.14 -0.43 4.72 4.22 -1.93 -0.68 114.58 122.14 1oh1 h GLU 61 Ca 0.13 -0.09 -0.07 0.00 0.08 0.00 0.00 59.36 59.41 1oh1 h GLU 61 Cb 0.11 -0.24 -0.04 0.00 0.50 0.00 0.00 28.75 29.08 1oh1 h GLU 61 CO -0.01 0.78 0.05 1.58 -2.18 0.00 0.00 179.01 179.23 1oh1 n HIS 62 N -4.46 1.50 -4.08 0.92 -0.00 -1.19 -4.96 115.22 102.94 1oh1 n HIS 62 Ca 0.09 -1.00 -0.34 0.00 0.46 0.00 0.00 57.72 56.93 1oh1 n HIS 62 Cb 0.04 -0.45 -0.06 0.00 -0.12 0.00 0.00 29.99 29.40 1oh1 n HIS 62 CO 0.00 0.00 0.00 1.63 0.46 0.00 0.00 176.34 178.43 1oh1 n LYS 63 N -0.30 -1.56 -4.42 1.57 4.01 -0.26 -4.94 118.16 112.26 1oh1 n LYS 63 Ca 0.28 0.16 -0.23 0.00 -0.51 0.00 0.00 58.31 58.02 1oh1 n LYS 63 Cb 1.07 -4.76 -0.10 0.00 -0.51 0.00 0.00 35.03 30.73 1oh1 n LYS 63 CO 0.00 0.00 0.00 -1.14 -1.11 0.00 0.00 177.40 175.15 1oh1 s GLN 64 N -6.74 1.52 0.03 1.97 0.74 0.34 -4.08 119.66 113.44 1oh1 s GLN 64 Ca 0.66 -1.65 0.02 0.00 0.05 0.00 0.00 55.36 54.44 1oh1 s GLN 64 Cb -0.38 -1.58 -0.02 0.00 1.10 0.00 0.00 33.01 32.13 1oh1 s GLN 64 CO 0.81 0.30 -0.08 -0.48 -0.55 0.00 0.00 175.29 175.29 1oh1 s LEU 65 N -3.23 2.18 -0.32 3.68 -0.00 -0.92 -0.08 118.68 119.99 1oh1 s LEU 65 Ca 0.25 -0.42 0.03 0.00 -0.00 0.00 0.00 54.13 54.00 1oh1 s LEU 65 Cb -0.05 -0.24 0.09 0.00 -0.00 0.00 0.00 46.19 46.00 1oh1 s LEU 65 CO 0.11 -0.11 0.03 -0.89 -0.00 0.00 0.00 176.35 175.49 1oh1 s THR 66 N -0.98 2.08 0.02 5.48 2.01 -0.29 -2.11 115.64 121.85 1oh1 s THR 66 Ca -0.05 -2.10 0.03 0.00 0.31 0.00 0.00 61.69 59.88 1oh1 s THR 66 Cb -0.08 -2.48 -0.01 0.00 0.01 0.00 0.00 72.50 69.94 1oh1 s THR 66 CO 0.00 -0.50 -0.10 -1.48 -0.69 0.00 0.00 174.62 171.85 1oh1 s LEU 67 N 1.03 2.10 -0.06 4.42 0.05 -0.62 -2.51 118.68 123.09 1oh1 s LEU 67 Ca 0.07 -0.31 0.03 0.00 0.05 0.00 0.00 54.13 53.97 1oh1 s LEU 67 Cb -0.19 -0.43 -0.03 0.00 -2.05 0.00 0.00 46.19 43.50 1oh1 s LEU 67 CO -0.09 0.03 -0.12 -0.72 -0.55 0.00 0.00 176.35 174.90 1oh1 s TYR 68 N -0.59 2.78 -0.01 3.48 1.13 0.04 0.22 117.35 124.39 1oh1 s TYR 68 Ca 0.00 -0.13 -0.24 0.00 -1.41 0.00 0.00 57.07 55.30 1oh1 s TYR 68 Cb -0.06 -1.67 -0.05 0.00 -1.10 0.00 0.00 41.96 39.09 1oh1 s TYR 68 CO 0.00 0.21 0.71 1.21 -2.51 0.00 0.00 175.55 175.17 1oh1 s ASN 69 N -0.69 7.07 -0.40 -0.18 3.84 0.58 -0.38 114.94 124.77 1oh1 s ASN 69 Ca 0.10 1.28 0.05 0.00 0.21 0.00 0.00 52.86 54.50 1oh1 s ASN 69 Cb -0.11 -2.43 0.46 0.00 -0.55 0.00 0.00 41.25 38.63 1oh1 s ASN 69 CO 0.01 -0.03 1.49 1.17 -2.79 0.00 0.00 177.10 176.95 1oh1 n LYS 70 N 3.24 3.06 -0.01 0.43 4.81 -0.44 -3.30 118.16 125.95 1oh1 n LYS 70 Ca -0.03 -3.76 0.07 0.00 -0.87 0.00 0.00 58.31 53.73 1oh1 n LYS 70 Cb 0.51 -2.21 -0.10 0.00 0.02 0.00 0.00 35.03 33.24 1oh1 n LYS 70 CO 0.00 0.00 0.00 -1.71 1.17 0.00 0.00 177.40 176.86 1oh1 n ASN 71 N -0.84 1.54 0.00 3.14 5.15 -1.26 -4.95 115.26 118.04 1oh1 n ASN 71 Ca 0.48 -0.15 0.00 0.00 -0.60 0.00 0.00 54.58 54.31 1oh1 n ASN 71 Cb 0.89 1.53 0.00 0.00 -0.53 0.00 0.00 39.78 41.67 1oh1 n ASN 71 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 1oh1 n ASN 72 N -1.87 0.00 0.05 1.20 2.85 -1.26 -5.10 115.26 111.12 1oh1 n ASN 72 Ca -0.02 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.45 1oh1 n ASN 72 Cb 0.34 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.36 1oh1 n ASN 72 CO 0.00 0.00 0.00 -0.24 -2.11 0.00 0.00 177.26 174.91 1oh1 n SER 73 N -0.86 -0.22 -2.79 1.20 2.88 -1.26 -5.09 113.62 107.47 1oh1 n SER 73 Ca 0.00 0.16 -0.01 0.00 -1.33 0.00 0.00 58.87 57.69 1oh1 n SER 73 Cb 0.00 0.32 0.01 0.00 -0.75 0.00 0.00 64.21 63.79 1oh1 n SER 73 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 1oh1 s SER 74 N -3.85 -0.60 -0.31 -3.46 1.04 -1.26 -4.88 113.70 100.38 1oh1 s SER 74 Ca 0.00 -0.48 0.02 0.00 0.48 0.00 0.00 55.95 55.96 1oh1 s SER 74 Cb 0.00 0.77 0.08 0.00 0.10 0.00 0.00 66.02 66.97 1oh1 s SER 74 CO 0.00 -0.05 0.00 -0.51 0.98 0.00 0.00 173.24 173.67 1oh1 s ILE 75 N 1.49 2.52 -0.28 -1.02 2.07 -1.21 -1.47 121.20 123.31 1oh1 s ILE 75 Ca 0.19 -1.86 -0.16 0.00 -1.41 0.00 0.00 60.65 57.42 1oh1 s ILE 75 Cb 0.05 -2.62 -0.03 0.00 0.13 0.00 0.00 42.46 39.99 1oh1 s ILE 75 CO -0.11 -0.30 0.41 -0.69 -1.91 0.00 0.00 174.94 172.34 1oh1 s VAL 76 N 1.08 5.14 0.02 4.00 1.01 0.87 -0.31 120.40 132.20 1oh1 s VAL 76 Ca 0.00 0.60 0.05 0.00 0.00 0.00 0.00 61.98 62.63 1oh1 s VAL 76 Cb -0.20 -3.75 -0.03 0.00 0.00 0.00 0.00 36.38 32.40 1oh1 s VAL 76 CO -0.05 0.10 -0.13 0.27 0.00 0.00 0.00 175.10 175.29 1oh1 s ILE 77 N 2.14 3.16 -0.34 2.22 -4.36 0.13 -0.25 121.20 123.91 1oh1 s ILE 77 Ca 0.16 -0.98 0.02 0.00 -0.26 0.00 0.00 60.65 59.60 1oh1 s ILE 77 Cb -0.16 -2.34 0.09 0.00 1.25 0.00 0.00 42.46 41.30 1oh1 s ILE 77 CO 0.10 0.38 0.05 -1.61 0.24 0.00 0.00 174.94 174.10 1oh1 s GLU 78 N -1.36 1.73 -0.04 0.37 2.02 -0.71 -1.58 118.70 119.12 1oh1 s GLU 78 Ca 0.15 -1.76 0.05 0.00 0.02 0.00 0.00 54.97 53.43 1oh1 s GLU 78 Cb -0.11 -3.22 -0.01 0.00 0.10 0.00 0.00 34.13 30.90 1oh1 s GLU 78 CO 0.06 -0.89 -0.19 0.96 0.02 0.00 0.00 175.26 175.22 1oh1 s ILE 79 N 0.99 1.58 -0.19 -1.63 -4.36 -0.90 -1.25 121.20 115.43 1oh1 s ILE 79 Ca 0.07 -0.80 -0.03 0.00 -0.26 0.00 0.00 60.65 59.62 1oh1 s ILE 79 Cb -0.20 -1.34 -0.02 0.00 1.25 0.00 0.00 42.46 42.15 1oh1 s ILE 79 CO -0.07 0.45 -0.05 0.12 0.24 0.00 0.00 174.94 175.63 1oh1 s PHE 80 N -0.06 2.95 -0.55 1.37 5.36 -0.98 -2.17 117.98 123.91 1oh1 s PHE 80 Ca -0.03 -0.69 -0.03 0.00 -0.96 0.00 0.00 56.93 55.23 1oh1 s PHE 80 Cb -0.12 -2.03 0.14 0.00 -0.34 0.00 0.00 43.02 40.68 1oh1 s PHE 80 CO 0.02 -0.34 0.36 0.42 -1.46 0.00 0.00 175.22 174.22 1oh1 s ILE 81 N 0.99 3.53 0.00 3.12 1.09 -1.26 -2.51 121.20 126.16 1oh1 s ILE 81 Ca 0.00 -2.70 0.00 0.00 -1.10 0.00 0.00 60.65 56.85 1oh1 s ILE 81 Cb -0.15 -3.34 0.00 0.00 -1.06 0.00 0.00 42.46 37.91 1oh1 s ILE 81 CO 0.00 -0.82 0.00 -2.65 -0.10 0.00 0.00 174.94 171.38 1oh1 n PRO 82 N 3.81 0.00 -0.60 2.79 -0.02 -1.26 -4.58 135.00 135.13 1oh1 n PRO 82 Ca 0.05 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.53 1oh1 n PRO 82 Cb 0.39 -0.05 0.00 0.00 -0.02 0.00 0.00 33.50 33.82 1oh1 n PRO 82 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 1oh1 n ASN 83 N -0.20 0.00 -3.17 2.55 5.15 -1.26 -4.86 115.26 113.46 1oh1 n ASN 83 Ca 0.00 0.00 -0.21 0.00 -0.60 0.00 0.00 54.58 53.77 1oh1 n ASN 83 Cb 0.00 0.00 -0.00 0.00 -0.53 0.00 0.00 39.78 39.25 1oh1 n ASN 83 CO 0.00 0.00 0.00 -0.90 1.40 0.00 0.00 177.26 177.76 1oh1 n ASP 84 N 0.00 -3.84 -3.15 1.20 5.75 -1.26 -2.25 116.55 113.00 1oh1 n ASP 84 Ca 0.00 -0.27 -0.06 0.00 -0.01 0.00 0.00 54.79 54.45 1oh1 n ASP 84 Cb 0.00 -3.19 0.02 0.00 -1.03 0.00 0.00 41.12 36.93 1oh1 n ASP 84 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 1oh1 n ASN 85 N -2.21 -7.33 -3.58 -1.12 4.13 -1.26 -4.94 115.26 98.95 1oh1 n ASN 85 Ca -0.04 -0.32 -0.12 0.00 1.68 0.00 0.00 54.58 55.78 1oh1 n ASN 85 Cb 0.56 -5.18 -0.06 0.00 -1.54 0.00 0.00 39.78 33.56 1oh1 n ASN 85 CO 0.00 0.00 0.00 -1.59 0.28 0.00 0.00 177.26 175.95 1oh1 s LYS 86 N -3.55 0.70 -0.19 3.52 -2.85 -0.96 -3.92 119.74 112.49 1oh1 s LYS 86 Ca 0.16 0.30 -0.26 0.00 -1.00 0.00 0.00 55.97 55.17 1oh1 s LYS 86 Cb -0.02 0.33 0.07 0.00 -2.06 0.00 0.00 37.83 36.15 1oh1 s LYS 86 CO 0.75 -0.19 0.69 -1.50 0.10 0.00 0.00 175.35 175.20 1oh1 s ILE 87 N -0.80 0.00 -0.02 3.79 2.07 0.57 -4.13 121.20 122.67 1oh1 s ILE 87 Ca -0.03 -0.01 0.07 0.00 -1.41 0.00 0.00 60.65 59.28 1oh1 s ILE 87 Cb -0.01 -0.98 -0.02 0.00 0.13 0.00 0.00 42.46 41.57 1oh1 s ILE 87 CO 0.02 -0.00 -0.24 -1.48 -1.91 0.00 0.00 174.94 171.33 1oh1 s LEU 88 N -0.14 2.04 -0.11 8.50 0.05 -1.05 -0.74 118.68 127.23 1oh1 s LEU 88 Ca -0.04 -0.43 0.03 0.00 0.05 0.00 0.00 54.13 53.75 1oh1 s LEU 88 Cb -0.03 -1.22 0.00 0.00 -2.05 0.00 0.00 46.19 42.89 1oh1 s LEU 88 CO 0.04 0.29 -0.23 -0.22 -0.55 0.00 0.00 176.35 175.68 1oh1 s LEU 89 N -0.52 2.08 0.05 1.48 0.20 0.61 -2.31 118.68 120.27 1oh1 s LEU 89 Ca 0.08 -0.57 0.07 0.00 0.69 0.00 0.00 54.13 54.41 1oh1 s LEU 89 Cb -0.09 -1.40 -0.03 0.00 -0.43 0.00 0.00 46.19 44.23 1oh1 s LEU 89 CO -0.01 0.12 -0.17 -0.89 -0.29 0.00 0.00 176.35 175.12 1oh1 s THR 90 N 0.53 2.85 0.08 3.68 2.01 -0.38 -1.01 115.64 123.40 1oh1 s THR 90 Ca -0.14 -1.21 0.06 0.00 0.31 0.00 0.00 61.69 60.70 1oh1 s THR 90 Cb -0.17 -2.22 -0.04 0.00 0.01 0.00 0.00 72.50 70.08 1oh1 s THR 90 CO 0.05 0.30 -0.07 -0.51 -0.69 0.00 0.00 174.62 173.70 1oh1 s ILE 91 N -0.96 3.58 0.19 1.82 2.07 -1.26 -1.74 121.20 124.90 1oh1 s ILE 91 Ca 0.15 -1.09 -0.22 0.00 -1.41 0.00 0.00 60.65 58.08 1oh1 s ILE 91 Cb -0.11 -2.66 0.06 0.00 0.13 0.00 0.00 42.46 39.88 1oh1 s ILE 91 CO 0.06 0.18 0.63 -0.04 -1.91 0.00 0.00 174.94 173.86 1oh1 s MET 92 N -2.05 1.40 -0.07 3.50 -1.94 0.65 0.15 119.30 120.96 1oh1 s MET 92 Ca 0.21 -0.61 0.01 0.00 -1.71 0.00 0.00 55.69 53.59 1oh1 s MET 92 Cb -0.11 0.59 0.02 0.00 2.01 0.00 0.00 34.83 37.34 1oh1 s MET 92 CO 0.13 -0.62 -0.05 -0.80 -0.01 0.00 0.00 175.02 173.67 1oh1 s ASN 93 N -2.79 1.44 0.40 3.03 -0.87 -1.24 -0.09 114.94 114.82 1oh1 s ASN 93 Ca 0.04 -0.18 0.07 0.00 -1.57 0.00 0.00 52.86 51.22 1oh1 s ASN 93 Cb -0.02 -0.58 0.81 0.00 -0.02 0.00 0.00 41.25 41.43 1oh1 s ASN 93 CO -0.08 -0.08 2.00 0.74 -2.57 0.00 0.00 177.10 177.12 1oh1 h THR 94 N 6.15 1.13 -0.47 1.60 2.02 -1.64 -2.63 112.91 119.08 1oh1 h THR 94 Ca -0.31 -0.39 -0.32 0.00 0.77 0.00 0.00 66.41 66.15 1oh1 h THR 94 Cb 1.15 0.72 -0.23 0.00 -1.74 0.00 0.00 68.15 68.05 1oh1 h THR 94 CO 0.42 0.15 -0.45 -0.62 0.37 0.00 0.00 175.52 175.39 1oh1 n GLU 95 N -4.41 2.59 0.00 6.66 -0.58 -1.26 -5.06 120.64 118.58 1oh1 n GLU 95 Ca 0.02 -3.65 0.00 0.00 -0.42 0.00 0.00 57.16 53.11 1oh1 n GLU 95 Cb 0.13 -1.99 0.00 0.00 -0.57 0.00 0.00 31.44 29.01 1oh1 n GLU 95 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1oh1 n ALA 96 N -0.93 0.00 -2.60 0.62 0.00 -0.99 -5.06 120.51 111.54 1oh1 n ALA 96 Ca 0.36 0.00 -0.27 0.00 0.00 0.00 0.00 53.44 53.52 1oh1 n ALA 96 Cb 0.88 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 20.22 1oh1 n ALA 96 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1oh1 s LEU 97 N 0.00 2.83 0.00 0.00 1.02 -1.26 -4.38 118.68 116.89 1oh1 s LEU 97 Ca 0.00 -1.36 0.00 0.00 0.02 0.00 0.00 54.13 52.79 1oh1 s LEU 97 Cb 0.00 -0.88 0.00 0.00 0.02 0.00 0.00 46.19 45.33 1oh1 s LEU 97 CO 0.00 -0.44 0.00 0.61 0.02 0.00 0.00 176.35 176.54 1oh1 n GLY 98 N -0.94 2.36 3.25 -3.19 0.00 -1.26 -3.61 105.19 101.79 1oh1 n GLY 98 Ca -0.05 0.01 -0.23 0.00 0.00 0.00 0.00 46.02 45.75 1oh1 n GLY 98 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1oh1 n THR 99 N 0.00 -2.95 0.07 2.61 -2.24 0.12 -4.91 114.28 106.98 1oh1 n THR 99 Ca 0.00 0.22 0.00 0.00 -2.27 0.00 0.00 64.05 62.00 1oh1 n THR 99 Cb 0.00 -3.12 0.00 0.00 -2.10 0.00 0.00 70.33 65.11 1oh1 n THR 99 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1oh1 n SER 100 N 0.43 -1.21 0.10 3.42 7.64 -1.26 -5.08 113.62 117.66 1oh1 n SER 100 Ca -0.05 0.28 -0.04 0.00 1.01 0.00 0.00 58.87 60.07 1oh1 n SER 100 Cb 0.58 1.42 -0.02 0.00 -1.01 0.00 0.00 64.21 65.18 1oh1 n SER 100 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 1oh1 h PRO 101 N 0.00 -0.24 -4.33 1.43 0.13 -1.94 -3.50 132.00 123.55 1oh1 h PRO 101 Ca 0.00 0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.15 1oh1 h PRO 101 Cb 0.00 0.05 0.00 0.00 0.13 0.00 0.00 31.00 31.18 1oh1 h PRO 101 CO 0.00 -0.16 -0.95 0.54 -0.23 0.00 0.00 178.00 177.20 1oh1 n ARG 102 N -2.76 -5.54 -3.98 0.86 3.00 -1.25 -5.03 116.66 101.95 1oh1 n ARG 102 Ca -0.03 3.93 -0.34 0.00 -0.01 0.00 0.00 57.85 61.40 1oh1 n ARG 102 Cb 0.10 -4.25 -0.15 0.00 0.00 0.00 0.00 32.46 28.16 1oh1 n ARG 102 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 177.63 179.04 1oh1 s MET 103 N -0.67 3.09 -0.56 5.56 1.75 -0.18 -4.92 119.30 123.36 1oh1 s MET 103 Ca 0.00 -0.80 -0.12 0.00 -1.25 0.00 0.00 55.69 53.52 1oh1 s MET 103 Cb 0.00 -2.88 0.14 0.00 2.84 0.00 0.00 34.83 34.93 1oh1 s MET 103 CO 0.00 -0.27 0.47 0.99 -0.65 0.00 0.00 175.02 175.56 1oh1 s THR 104 N 1.37 4.75 -0.13 10.11 2.01 -1.26 -0.28 115.64 132.21 1oh1 s THR 104 Ca 0.04 -1.89 -0.08 0.00 0.31 0.00 0.00 61.69 60.07 1oh1 s THR 104 Cb -0.15 -4.06 -0.04 0.00 0.01 0.00 0.00 72.50 68.26 1oh1 s THR 104 CO -0.06 -0.86 0.15 -0.36 -0.69 0.00 0.00 174.62 172.80 1oh1 s PHE 105 N 1.15 3.56 -0.05 4.92 0.40 0.08 -4.95 117.98 123.08 1oh1 s PHE 105 Ca 0.08 0.50 0.04 0.00 -0.60 0.00 0.00 56.93 56.95 1oh1 s PHE 105 Cb -0.24 -2.00 -0.02 0.00 0.51 0.00 0.00 43.02 41.26 1oh1 s PHE 105 CO -0.01 0.63 -0.16 0.96 0.70 0.00 0.00 175.22 177.35 1oh1 s ILE 106 N -0.72 2.93 -0.95 0.64 -4.36 -1.26 -0.31 121.20 117.17 1oh1 s ILE 106 Ca 0.14 -0.77 -0.24 0.00 -0.26 0.00 0.00 60.65 59.51 1oh1 s ILE 106 Cb -0.12 -2.14 -0.08 0.00 1.25 0.00 0.00 42.46 41.37 1oh1 s ILE 106 CO 0.03 0.59 2.02 -0.75 0.24 0.00 0.00 174.94 177.07 1oh1 s LYS 107 N -0.67 2.32 0.00 0.37 2.47 -1.25 -4.10 119.74 118.88 1oh1 s LYS 107 Ca 0.10 -0.37 0.00 0.00 -1.56 0.00 0.00 55.97 54.15 1oh1 s LYS 107 Cb -0.11 -5.06 0.00 0.00 -1.46 0.00 0.00 37.83 31.21 1oh1 s LYS 107 CO 0.01 -3.78 0.00 0.72 0.16 0.00 0.00 175.35 172.45 1oh1 n HIS 108 N 15.08 0.00 0.23 4.03 8.25 -1.26 -4.62 115.22 136.93 1oh1 n HIS 108 Ca 0.42 0.00 0.02 0.00 -0.26 0.00 0.00 57.72 57.90 1oh1 n HIS 108 Cb 0.46 -1.46 0.11 0.00 1.12 0.00 0.00 29.99 30.22 1oh1 n HIS 108 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61