#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1oqm s GLU 2 N 0.00 3.40 0.72 -2.82 2.12 -1.26 -0.60 118.70 120.26 1oqm s GLU 2 Ca 0.00 -0.12 -0.04 0.00 0.36 0.00 0.00 54.97 55.18 1oqm s GLU 2 Cb 0.00 -3.94 0.11 0.00 0.26 0.00 0.00 34.13 30.55 1oqm s GLU 2 CO 0.00 -1.13 1.00 -0.51 -0.54 0.00 0.00 175.26 174.08 1oqm s LEU 3 N 3.31 2.96 0.30 2.70 1.43 -0.33 -4.98 118.68 124.07 1oqm s LEU 3 Ca 0.30 -0.07 0.06 0.00 -1.03 0.00 0.00 54.13 53.40 1oqm s LEU 3 Cb -0.12 -2.39 -0.02 0.00 0.03 0.00 0.00 46.19 43.69 1oqm s LEU 3 CO 0.23 -1.81 0.38 0.42 0.23 0.00 0.00 176.35 175.80 1oqm s THR 4 N -3.20 4.31 0.25 5.49 -4.23 -1.26 -4.82 115.64 112.18 1oqm s THR 4 Ca 0.65 -1.11 -0.03 0.00 -1.18 0.00 0.00 61.69 60.01 1oqm s THR 4 Cb -0.07 -3.48 0.22 0.00 1.34 0.00 0.00 72.50 70.51 1oqm s THR 4 CO 0.45 -0.23 1.76 0.50 -0.54 0.00 0.00 174.62 176.56 1oqm h LYS 5 N 1.10 0.56 -0.12 3.99 3.64 -1.99 -1.03 116.57 122.73 1oqm h LYS 5 Ca -0.47 -0.03 -0.12 0.00 -1.27 0.00 0.00 60.65 58.75 1oqm h LYS 5 Cb 1.25 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 32.93 1oqm h LYS 5 CO 0.57 0.37 -0.46 0.00 -2.27 0.00 0.00 179.45 177.66 1oqm h LYS 7 N 0.24 0.44 0.18 0.00 3.11 -1.62 -1.81 116.57 117.11 1oqm h LYS 7 Ca 0.02 -0.11 -0.01 0.00 -2.81 0.00 0.00 60.65 57.73 1oqm h LYS 7 Cb 0.90 -0.05 0.00 0.00 -1.00 0.00 0.00 32.23 32.08 1oqm h LYS 7 CO 0.07 0.55 -0.09 0.28 -2.81 0.00 0.00 179.45 177.46 1oqm h VAL 8 N 0.26 0.86 -0.84 2.00 2.07 -1.07 -2.15 116.25 117.38 1oqm h VAL 8 Ca 0.08 -0.15 0.15 0.00 0.82 0.00 0.00 66.70 67.60 1oqm h VAL 8 Cb 0.32 0.95 -0.06 0.00 -1.52 0.00 0.00 31.29 30.97 1oqm h VAL 8 CO 0.00 0.03 0.55 0.28 0.02 0.00 0.00 177.57 178.46 1oqm h SER 9 N -0.31 0.54 0.83 0.57 0.02 -0.94 -0.97 113.55 113.29 1oqm h SER 9 Ca -0.02 0.03 -0.16 0.00 -0.84 0.00 0.00 61.79 60.80 1oqm h SER 9 Cb 0.24 -0.07 -0.02 0.00 0.14 0.00 0.00 62.40 62.69 1oqm h SER 9 CO 0.04 0.28 -0.74 0.45 -1.14 0.00 0.00 176.83 175.71 1oqm h HIS 10 N 0.57 0.00 0.00 3.45 -0.00 -1.05 -3.30 115.15 114.82 1oqm h HIS 10 Ca 0.42 0.00 -0.09 0.00 -0.00 0.00 0.00 60.37 60.70 1oqm h HIS 10 Cb 0.78 0.00 -0.01 0.00 -0.00 0.00 0.00 27.41 28.18 1oqm h HIS 10 CO -0.00 0.74 -0.49 0.00 -0.00 0.00 0.00 177.93 178.18 1oqm h ALA 11 N 1.26 0.73 -0.78 2.45 0.00 -0.53 -3.35 119.26 119.03 1oqm h ALA 11 Ca -0.01 -0.38 -0.42 0.00 0.00 0.00 0.00 54.91 54.10 1oqm h ALA 11 Cb 1.36 -0.04 -0.24 0.00 0.00 0.00 0.00 17.79 18.87 1oqm h ALA 11 CO 0.10 0.51 0.38 0.44 0.00 0.00 0.00 179.25 180.68 1oqm n ILE 12 N -3.16 3.01 -0.06 0.00 -5.35 -0.88 -4.68 119.36 108.25 1oqm n ILE 12 Ca 0.01 -2.36 0.01 0.00 -0.27 0.00 0.00 62.75 60.14 1oqm n ILE 12 Cb 0.70 -0.50 0.32 0.00 -1.74 0.00 0.00 39.64 38.42 1oqm n ILE 12 CO 0.00 0.00 0.00 0.11 -1.76 0.00 0.00 176.55 174.90 1oqm h LYS 13 N 1.12 0.66 0.00 6.28 1.79 -1.71 -2.04 116.57 122.66 1oqm h LYS 13 Ca 0.49 -0.08 0.00 0.00 -2.18 0.00 0.00 60.65 58.88 1oqm h LYS 13 Cb 2.25 -0.13 0.00 0.00 -1.58 0.00 0.00 32.23 32.77 1oqm h LYS 13 CO 0.90 0.52 0.00 -3.47 -1.08 0.00 0.00 179.45 176.32 1oqm n ASP 14 N -4.38 0.20 -0.00 0.86 -0.08 -1.26 -0.76 116.55 111.13 1oqm n ASP 14 Ca 0.04 0.57 0.10 0.00 -1.51 0.00 0.00 54.79 53.99 1oqm n ASP 14 Cb 0.13 -0.61 -0.12 0.00 2.34 0.00 0.00 41.12 42.86 1oqm n ASP 14 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1oqm n ILE 15 N -1.75 0.00 -1.68 5.18 3.06 -0.77 -4.81 119.36 118.59 1oqm n ILE 15 Ca 0.01 -0.02 -0.42 0.00 -2.50 0.00 0.00 62.75 59.82 1oqm n ILE 15 Cb 0.09 0.99 -0.03 0.00 0.54 0.00 0.00 39.64 41.23 1oqm n ILE 15 CO 0.00 0.00 0.00 -0.62 -2.50 0.00 0.00 176.55 173.43 1oqm s ASP 16 N -2.98 6.42 0.00 9.51 2.15 0.06 -1.46 116.67 130.38 1oqm s ASP 16 Ca 0.08 2.74 0.00 0.00 0.43 0.00 0.00 52.55 55.79 1oqm s ASP 16 Cb 0.16 -2.55 0.00 0.00 -0.30 0.00 0.00 42.92 40.23 1oqm s ASP 16 CO 0.85 -1.04 0.00 0.61 -0.17 0.00 0.00 175.17 175.42 1oqm n GLY 17 N 4.40 2.91 3.68 2.66 0.00 0.59 -4.98 105.19 114.45 1oqm n GLY 17 Ca 0.19 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.78 1oqm n GLY 17 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1oqm n TYR 18 N -2.00 2.57 -1.46 1.61 9.36 -0.53 -0.56 117.16 126.15 1oqm n TYR 18 Ca 0.00 -0.15 -0.16 0.00 3.32 0.00 0.00 57.90 60.91 1oqm n TYR 18 Cb 0.00 -2.73 -0.07 0.00 -0.63 0.00 0.00 39.34 35.91 1oqm n TYR 18 CO 0.00 0.00 0.00 0.94 0.22 0.00 0.00 176.86 178.02 1oqm n GLN 19 N 5.91 -1.21 -0.72 2.98 -0.06 -1.26 -2.33 117.38 120.69 1oqm n GLN 19 Ca 0.19 1.05 0.00 0.00 -2.00 0.00 0.00 57.00 56.23 1oqm n GLN 19 Cb 0.37 -5.26 0.00 0.00 -4.06 0.00 0.00 30.24 21.29 1oqm n GLN 19 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1oqm n GLY 20 N -0.82 0.97 3.66 1.69 0.00 0.28 -5.01 105.19 105.96 1oqm n GLY 20 Ca -0.16 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.46 1oqm n GLY 20 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1oqm s ILE 21 N -3.48 5.03 0.74 -0.61 -1.09 -0.98 -4.87 121.20 115.94 1oqm s ILE 21 Ca 0.00 1.15 -0.06 0.00 -2.23 0.00 0.00 60.65 59.51 1oqm s ILE 21 Cb 0.00 -3.93 0.09 0.00 -1.58 0.00 0.00 42.46 37.04 1oqm s ILE 21 CO 0.00 0.12 1.04 -0.94 -1.23 0.00 0.00 174.94 173.94 1oqm s SER 22 N 1.18 4.50 0.26 3.58 1.04 -1.26 -0.30 113.70 122.71 1oqm s SER 22 Ca 0.28 0.25 -0.01 0.00 0.48 0.00 0.00 55.95 56.94 1oqm s SER 22 Cb -0.16 -0.77 0.35 0.00 0.10 0.00 0.00 66.02 65.54 1oqm s SER 22 CO 0.10 -1.79 1.76 -0.07 0.98 0.00 0.00 173.24 174.22 1oqm h LEU 23 N -0.70 0.73 -0.46 2.42 3.38 -1.94 -1.42 115.31 117.31 1oqm h LEU 23 Ca -0.43 -0.18 -0.07 0.00 0.09 0.00 0.00 57.88 57.29 1oqm h LEU 23 Cb 1.29 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.83 1oqm h LEU 23 CO 0.53 0.81 0.03 -0.07 0.09 0.00 0.00 178.44 179.83 1oqm h LEU 24 N 0.70 0.77 -0.57 1.67 4.07 -1.91 0.13 115.31 120.17 1oqm h LEU 24 Ca 0.13 -0.29 -0.02 0.00 0.08 0.00 0.00 57.88 57.79 1oqm h LEU 24 Cb 0.47 -0.21 -0.03 0.00 1.08 0.00 0.00 40.66 41.98 1oqm h LEU 24 CO 0.02 0.87 0.28 -0.33 -1.08 0.00 0.00 178.44 178.21 1oqm h GLU 25 N 0.65 0.82 -0.52 1.13 5.08 -1.83 -1.84 114.58 118.07 1oqm h GLU 25 Ca 0.13 -0.12 -0.08 0.00 -1.00 0.00 0.00 59.36 58.30 1oqm h GLU 25 Cb 0.46 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.54 1oqm h GLU 25 CO 0.02 0.66 0.00 -1.49 -1.00 0.00 0.00 179.01 177.20 1oqm h TRP 26 N 0.78 1.00 -0.86 4.33 4.06 -0.99 0.16 115.95 124.43 1oqm h TRP 26 Ca 0.20 -0.17 0.09 0.00 2.06 0.00 0.00 58.89 61.07 1oqm h TRP 26 Cb 0.10 -0.26 -0.07 0.00 -1.00 0.00 0.00 29.16 27.93 1oqm h TRP 26 CO -0.00 0.92 0.51 0.00 -3.56 0.00 0.00 178.44 176.30 1oqm h ALA 27 N 0.95 1.22 -0.10 1.49 0.00 -0.57 0.23 119.26 122.47 1oqm h ALA 27 Ca 0.15 0.02 -0.03 0.00 0.00 0.00 0.00 54.91 55.05 1oqm h ALA 27 Cb 0.52 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.14 1oqm h ALA 27 CO 0.03 0.15 -0.06 0.00 0.00 0.00 0.00 179.25 179.37 1oqm h VAL 29 N -0.14 1.11 -0.22 0.00 2.07 -0.12 -2.99 116.25 115.95 1oqm h VAL 29 Ca 0.02 -0.26 -0.06 0.00 0.82 0.00 0.00 66.70 67.23 1oqm h VAL 29 Cb 0.53 0.67 -0.01 0.00 -1.52 0.00 0.00 31.29 30.96 1oqm h VAL 29 CO 0.02 0.11 -0.11 -0.07 0.02 0.00 0.00 177.57 177.54 1oqm h LEU 30 N 0.44 0.33 -0.01 2.57 3.38 -0.60 0.48 115.31 121.90 1oqm h LEU 30 Ca 0.12 -0.07 -0.00 0.00 0.09 0.00 0.00 57.88 58.02 1oqm h LEU 30 Cb 0.00 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 40.66 1oqm h LEU 30 CO -0.02 0.48 0.01 0.15 0.09 0.00 0.00 178.44 179.14 1oqm h PHE 31 N 0.33 0.02 0.00 1.13 3.57 -1.35 -0.37 116.94 120.27 1oqm h PHE 31 Ca 0.07 -0.00 -0.09 0.00 3.53 0.00 0.00 57.97 61.47 1oqm h PHE 31 Cb 0.40 -0.01 -0.01 0.00 2.79 0.00 0.00 35.95 39.12 1oqm h PHE 31 CO 0.01 0.15 -0.44 0.45 -2.23 0.00 0.00 178.31 176.26 1oqm h HIS 32 N -0.12 0.00 -0.00 0.41 3.86 -1.37 0.35 115.15 118.28 1oqm h HIS 32 Ca 0.00 0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.20 1oqm h HIS 32 Cb 0.14 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.61 1oqm h HIS 32 CO -0.03 0.44 -0.04 1.15 0.86 0.00 0.00 177.93 180.31 1oqm h THR 33 N 0.00 1.59 0.00 2.45 2.02 -0.69 -3.41 112.91 114.87 1oqm h THR 33 Ca -0.00 -1.79 0.00 0.00 0.77 0.00 0.00 66.41 65.38 1oqm h THR 33 Cb 0.97 2.80 0.00 0.00 -1.74 0.00 0.00 68.15 70.18 1oqm h THR 33 CO 0.06 0.47 0.00 -1.54 0.37 0.00 0.00 175.52 174.88 1oqm n SER 34 N -4.69 0.47 -1.58 4.18 3.41 -0.17 -4.91 113.62 110.32 1oqm n SER 34 Ca -0.09 -1.09 -0.16 0.00 -0.26 0.00 0.00 58.87 57.27 1oqm n SER 34 Cb 0.39 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.31 1oqm n SER 34 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1oqm n GLY 35 N -0.04 0.46 2.49 5.00 0.00 0.12 -1.78 105.19 111.44 1oqm n GLY 35 Ca 0.00 -0.24 -0.18 0.00 0.00 0.00 0.00 46.02 45.60 1oqm n GLY 35 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1oqm n TYR 36 N -3.43 -0.14 -3.07 1.61 4.01 -1.22 -4.73 117.16 110.18 1oqm n TYR 36 Ca -0.18 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 57.14 1oqm n TYR 36 Cb 0.60 -3.16 -0.06 0.00 -0.31 0.00 0.00 39.34 36.40 1oqm n TYR 36 CO 0.00 0.00 0.00 0.34 -0.46 0.00 0.00 176.86 176.74 1oqm s ASP 37 N -2.71 6.41 0.22 7.72 -1.08 -0.74 -1.18 116.67 125.32 1oqm s ASP 37 Ca 0.00 0.02 0.19 0.00 -0.52 0.00 0.00 52.55 52.24 1oqm s ASP 37 Cb 0.00 -2.34 0.90 0.00 -1.46 0.00 0.00 42.92 40.02 1oqm s ASP 37 CO 0.00 -0.70 1.58 0.35 0.52 0.00 0.00 175.17 176.93 1oqm n THR 38 N 5.75 1.06 -0.13 1.71 -2.24 0.23 -2.30 114.28 118.35 1oqm n THR 38 Ca -0.00 0.45 0.06 0.00 -2.27 0.00 0.00 64.05 62.29 1oqm n THR 38 Cb 0.48 -1.40 0.15 0.00 -2.10 0.00 0.00 70.33 67.46 1oqm n THR 38 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1oqm n GLN 39 N -2.08 2.71 -1.74 -0.78 6.02 -1.26 -4.06 117.38 116.18 1oqm n GLN 39 Ca 0.01 -2.01 -0.42 0.00 -0.01 0.00 0.00 57.00 54.57 1oqm n GLN 39 Cb 0.12 -1.27 -0.02 0.00 1.02 0.00 0.00 30.24 30.09 1oqm n GLN 39 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1oqm n ALA 40 N 0.55 2.64 -3.79 -1.58 0.00 -0.97 -4.76 120.51 112.60 1oqm n ALA 40 Ca 0.12 0.38 -0.25 0.00 0.00 0.00 0.00 53.44 53.68 1oqm n ALA 40 Cb 0.42 -2.48 -0.17 0.00 0.00 0.00 0.00 19.45 17.22 1oqm n ALA 40 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1oqm s VAL 41 N 0.18 0.58 -0.07 0.00 1.01 -1.26 -1.01 120.40 119.83 1oqm s VAL 41 Ca 0.66 -0.23 0.03 0.00 0.00 0.00 0.00 61.98 62.43 1oqm s VAL 41 Cb -0.49 -0.84 0.01 0.00 0.00 0.00 0.00 36.38 35.06 1oqm s VAL 41 CO 0.46 0.10 -0.14 -0.69 0.00 0.00 0.00 175.10 174.83 1oqm s VAL 42 N 1.87 1.30 0.25 2.92 1.01 -0.70 -4.98 120.40 122.07 1oqm s VAL 42 Ca 0.03 -0.58 -0.14 0.00 0.00 0.00 0.00 61.98 61.28 1oqm s VAL 42 Cb -0.14 -1.16 -0.08 0.00 0.00 0.00 0.00 36.38 34.99 1oqm s VAL 42 CO -0.07 0.39 0.66 0.20 0.00 0.00 0.00 175.10 176.28 1oqm s ASN 43 N 0.55 6.80 0.00 3.32 -0.87 -1.26 -0.18 114.94 123.30 1oqm s ASN 43 Ca -0.14 1.19 0.00 0.00 -1.57 0.00 0.00 52.86 52.34 1oqm s ASN 43 Cb -0.16 -2.33 0.00 0.00 -0.02 0.00 0.00 41.25 38.74 1oqm s ASN 43 CO 0.04 -0.08 0.00 -0.67 -2.57 0.00 0.00 177.10 173.82 1oqm n ASP 44 N 0.07 0.00 -2.70 -1.22 -0.08 0.41 -4.92 116.55 108.10 1oqm n ASP 44 Ca 0.00 0.00 -0.05 0.00 -1.51 0.00 0.00 54.79 53.24 1oqm n ASP 44 Cb 0.52 -0.41 0.05 0.00 2.34 0.00 0.00 41.12 43.63 1oqm n ASP 44 CO 0.00 0.00 0.00 -0.46 0.12 0.00 0.00 177.20 176.86 1oqm n ASN 45 N -2.50 -2.05 0.00 1.67 0.23 -1.26 -4.88 115.26 106.47 1oqm n ASN 45 Ca 0.00 -2.06 0.00 0.00 -0.53 0.00 0.00 54.58 51.99 1oqm n ASN 45 Cb 0.00 1.13 0.00 0.00 -2.08 0.00 0.00 39.78 38.83 1oqm n ASN 45 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1oqm n GLY 46 N 2.09 0.66 3.20 4.83 0.00 -1.26 -5.05 105.19 109.67 1oqm n GLY 46 Ca 0.09 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.01 1oqm n GLY 46 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1oqm s SER 47 N -2.77 0.23 -0.01 1.61 1.04 -1.26 -5.02 113.70 107.52 1oqm s SER 47 Ca 0.00 -1.19 0.03 0.00 0.48 0.00 0.00 55.95 55.28 1oqm s SER 47 Cb 0.00 0.34 -0.01 0.00 0.10 0.00 0.00 66.02 66.45 1oqm s SER 47 CO 0.00 -0.78 -0.11 -0.89 0.98 0.00 0.00 173.24 172.44 1oqm s THR 48 N -4.06 0.86 -0.10 2.02 2.01 -1.26 -0.45 115.64 114.67 1oqm s THR 48 Ca 0.26 -0.48 -0.02 0.00 0.31 0.00 0.00 61.69 61.77 1oqm s THR 48 Cb 0.07 -0.72 -0.03 0.00 0.01 0.00 0.00 72.50 71.82 1oqm s THR 48 CO 0.04 0.24 -0.03 -1.61 -0.69 0.00 0.00 174.62 172.57 1oqm s GLU 49 N -0.27 3.14 -0.01 4.92 2.02 0.75 -0.90 118.70 128.35 1oqm s GLU 49 Ca 0.04 -0.48 0.08 0.00 0.02 0.00 0.00 54.97 54.63 1oqm s GLU 49 Cb -0.04 -2.78 -0.02 0.00 0.10 0.00 0.00 34.13 31.39 1oqm s GLU 49 CO -0.00 0.55 -0.25 0.71 0.02 0.00 0.00 175.26 176.28 1oqm s TYR 50 N -0.47 2.35 0.00 1.61 1.51 0.54 -1.72 117.35 121.17 1oqm s TYR 50 Ca 0.08 -0.42 0.00 0.00 -1.01 0.00 0.00 57.07 55.72 1oqm s TYR 50 Cb -0.12 -1.49 0.00 0.00 -0.11 0.00 0.00 41.96 40.24 1oqm s TYR 50 CO 0.02 0.00 0.00 0.41 -1.11 0.00 0.00 175.55 174.88 1oqm n GLY 51 N 2.30 -1.53 0.28 0.71 0.00 -0.18 -1.32 105.19 105.45 1oqm n GLY 51 Ca -0.16 -1.21 0.07 0.00 0.00 0.00 0.00 46.02 44.71 1oqm n GLY 51 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1oqm h LEU 52 N 0.00 -0.03 -0.47 0.99 5.85 -1.70 -0.90 115.31 119.05 1oqm h LEU 52 Ca 0.00 0.16 0.00 0.00 0.84 0.00 0.00 57.88 58.88 1oqm h LEU 52 Cb 0.00 0.23 0.00 0.00 0.37 0.00 0.00 40.66 41.26 1oqm h LEU 52 CO 0.00 -0.08 -0.22 0.49 -0.34 0.00 0.00 178.44 178.29 1oqm n PHE 53 N -5.19 0.00 -3.70 1.25 3.72 -1.26 -4.18 117.46 108.10 1oqm n PHE 53 Ca 0.16 0.00 -0.26 0.00 -0.05 0.00 0.00 57.45 57.30 1oqm n PHE 53 Cb 0.51 -0.13 0.03 0.00 -0.94 0.00 0.00 39.48 38.95 1oqm n PHE 53 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 1oqm n GLN 54 N -0.66 -2.83 -2.54 -1.08 1.13 -0.34 -4.91 117.38 106.15 1oqm n GLN 54 Ca 0.13 0.53 -0.42 0.00 -1.94 0.00 0.00 57.00 55.30 1oqm n GLN 54 Cb 0.34 -4.67 -0.03 0.00 0.11 0.00 0.00 30.24 25.98 1oqm n GLN 54 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 1oqm s ILE 55 N -3.62 4.40 0.35 5.09 1.01 -0.44 -4.37 121.20 123.63 1oqm s ILE 55 Ca 0.24 1.71 -0.19 0.00 0.00 0.00 0.00 60.65 62.41 1oqm s ILE 55 Cb -0.08 -4.10 -0.10 0.00 0.01 0.00 0.00 42.46 38.20 1oqm s ILE 55 CO 0.84 0.09 0.84 -0.55 0.00 0.00 0.00 174.94 176.16 1oqm s SER 56 N 1.15 6.93 0.00 3.58 0.15 -1.26 -0.34 113.70 123.91 1oqm s SER 56 Ca 0.55 1.51 0.30 0.00 0.70 0.00 0.00 55.95 59.01 1oqm s SER 56 Cb -0.25 -2.47 1.43 0.00 -1.71 0.00 0.00 66.02 63.02 1oqm s SER 56 CO 0.26 -0.23 1.96 -0.90 1.20 0.00 0.00 173.24 175.53 1oqm n ASP 57 N -0.26 0.69 -0.24 5.45 5.75 -0.08 -2.68 116.55 125.17 1oqm n ASP 57 Ca 0.04 -1.11 -0.06 0.00 -0.01 0.00 0.00 54.79 53.65 1oqm n ASP 57 Cb 0.53 -0.01 0.05 0.00 -1.03 0.00 0.00 41.12 40.65 1oqm n ASP 57 CO 0.00 0.00 0.00 -0.09 -0.11 0.00 0.00 177.20 177.00 1oqm h ARG 58 N 1.04 0.96 0.00 0.11 2.43 -1.83 -3.41 114.38 113.69 1oqm h ARG 58 Ca 0.00 -0.13 0.00 0.00 -0.81 0.00 0.00 59.98 59.04 1oqm h ARG 58 Cb 0.27 -0.18 0.00 0.00 -0.42 0.00 0.00 29.97 29.64 1oqm h ARG 58 CO 0.00 0.75 -0.01 1.19 -1.51 0.00 0.00 179.97 180.38 1oqm n PHE 59 N -4.48 0.00 -0.07 2.20 3.72 -1.26 -4.35 117.46 113.23 1oqm n PHE 59 Ca 0.05 0.00 -0.22 0.00 -0.05 0.00 0.00 57.45 57.23 1oqm n PHE 59 Cb 0.11 0.00 -0.12 0.00 -0.94 0.00 0.00 39.48 38.53 1oqm n PHE 59 CO 0.00 0.00 0.00 0.91 -0.05 0.00 0.00 176.76 177.62 1oqm n TRP 60 N -0.07 0.79 -4.36 1.38 7.02 -1.09 -0.32 117.44 120.79 1oqm n TRP 60 Ca 0.00 0.22 -0.20 0.00 -1.02 0.00 0.00 57.50 56.50 1oqm n TRP 60 Cb 0.00 -1.09 -0.10 0.00 -2.42 0.00 0.00 31.31 27.69 1oqm n TRP 60 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1oqm s LYS 62 N -3.40 4.18 0.55 0.00 2.20 -0.19 -4.46 119.74 118.62 1oqm s LYS 62 Ca 0.22 0.07 0.05 0.00 -0.36 0.00 0.00 55.97 55.95 1oqm s LYS 62 Cb -0.03 -3.50 0.04 0.00 -1.51 0.00 0.00 37.83 32.83 1oqm s LYS 62 CO 0.08 0.08 0.37 -1.54 -0.36 0.00 0.00 175.35 173.98 1oqm s SER 63 N 0.84 4.58 0.16 1.43 1.04 -1.26 -0.93 113.70 119.55 1oqm s SER 63 Ca 0.16 -1.30 0.22 0.00 0.48 0.00 0.00 55.95 55.50 1oqm s SER 63 Cb -0.14 0.48 -0.06 0.00 0.10 0.00 0.00 66.02 66.40 1oqm s SER 63 CO 0.06 -1.11 0.94 -1.54 0.98 0.00 0.00 173.24 172.57 1oqm n SER 64 N -1.74 0.73 0.17 7.02 3.41 -1.26 -3.04 113.62 118.91 1oqm n SER 64 Ca -0.04 0.28 0.13 0.00 -0.26 0.00 0.00 58.87 58.99 1oqm n SER 64 Cb 0.65 0.64 0.31 0.00 -0.26 0.00 0.00 64.21 65.55 1oqm n SER 64 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 1oqm h GLU 65 N 0.00 0.00 -1.30 4.33 4.81 -2.02 -3.37 114.58 117.03 1oqm h GLU 65 Ca -0.02 0.00 -0.43 0.00 -0.13 0.00 0.00 59.36 58.79 1oqm h GLU 65 Cb 1.05 0.00 -0.31 0.00 0.63 0.00 0.00 28.75 30.13 1oqm h GLU 65 CO 0.00 0.00 -0.91 0.34 -0.73 0.00 0.00 179.01 177.72 1oqm n PHE 66 N -2.73 -1.25 0.25 0.92 7.35 -1.24 -4.99 117.46 115.77 1oqm n PHE 66 Ca 0.04 -3.02 0.08 0.00 -0.76 0.00 0.00 57.45 53.79 1oqm n PHE 66 Cb 0.46 0.31 0.63 0.00 0.35 0.00 0.00 39.48 41.24 1oqm n PHE 66 CO 0.00 0.00 0.00 -1.35 -0.76 0.00 0.00 176.76 174.65 1oqm h PRO 67 N 3.70 0.00 0.00 -7.13 0.11 -1.72 -2.61 132.00 124.36 1oqm h PRO 67 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 1oqm h PRO 67 Cb 0.96 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.07 1oqm h PRO 67 CO 0.40 0.06 0.00 -1.91 -0.21 0.00 0.00 178.00 176.34 1oqm n GLU 68 N -4.38 0.39 -1.35 1.05 2.13 -1.26 -4.90 120.64 112.32 1oqm n GLU 68 Ca -0.03 0.05 -0.38 0.00 0.66 0.00 0.00 57.16 57.47 1oqm n GLU 68 Cb 0.14 -1.50 0.04 0.00 0.27 0.00 0.00 31.44 30.39 1oqm n GLU 68 CO 0.00 0.00 0.00 0.45 -0.41 0.00 0.00 177.13 177.17 1oqm n SER 69 N -1.26 -1.85 0.31 4.31 2.88 -0.98 -4.83 113.62 112.20 1oqm n SER 69 Ca 0.12 0.65 0.19 0.00 -1.33 0.00 0.00 58.87 58.51 1oqm n SER 69 Cb 0.18 -1.10 1.02 0.00 -0.75 0.00 0.00 64.21 63.56 1oqm n SER 69 CO 0.00 0.00 0.00 -0.08 -1.23 0.00 0.00 175.04 173.73 1oqm h GLU 70 N -0.03 0.00 -6.98 -1.46 4.57 -1.76 -3.46 114.58 105.46 1oqm h GLU 70 Ca -0.45 0.00 -0.58 0.00 -1.18 0.00 0.00 59.36 57.16 1oqm h GLU 70 Cb 1.39 0.00 -0.12 0.00 -0.16 0.00 0.00 28.75 29.86 1oqm h GLU 70 CO 0.44 0.02 -0.93 -1.71 -1.18 0.00 0.00 179.01 175.65 1oqm n ASN 71 N -3.30 -1.23 -0.21 1.04 4.05 -1.04 -4.78 115.26 109.80 1oqm n ASN 71 Ca -0.02 -1.21 0.12 0.00 0.45 0.00 0.00 54.58 53.92 1oqm n ASN 71 Cb 0.13 -1.48 0.43 0.00 1.23 0.00 0.00 39.78 40.09 1oqm n ASN 71 CO 0.00 0.00 0.00 0.40 -3.05 0.00 0.00 177.26 174.61 1oqm h ILE 72 N -1.93 0.85 0.00 -1.44 2.04 -0.51 0.22 117.51 116.75 1oqm h ILE 72 Ca -0.64 -0.20 0.00 0.00 1.00 0.00 0.00 64.86 65.02 1oqm h ILE 72 Cb 1.31 0.21 0.00 0.00 -0.74 0.00 0.00 36.82 37.61 1oqm h ILE 72 CO 0.58 0.11 0.00 0.00 0.00 0.00 0.00 178.15 178.84 1oqm n GLY 74 N 0.90 -0.37 3.39 0.00 0.00 0.07 -4.94 105.19 104.24 1oqm n GLY 74 Ca 0.05 0.11 -0.16 0.00 0.00 0.00 0.00 46.02 46.02 1oqm n GLY 74 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1oqm s ILE 75 N -3.31 0.03 0.24 -0.61 2.07 -1.26 -5.06 121.20 113.28 1oqm s ILE 75 Ca 0.08 -0.21 -0.30 0.00 -1.41 0.00 0.00 60.65 58.82 1oqm s ILE 75 Cb -0.01 -0.81 -0.09 0.00 0.13 0.00 0.00 42.46 41.68 1oqm s ILE 75 CO 0.62 -0.11 1.12 -0.55 -1.91 0.00 0.00 174.94 174.11 1oqm s SER 76 N -1.13 7.22 0.54 4.50 0.15 -1.26 -1.03 113.70 122.69 1oqm s SER 76 Ca -0.11 2.23 0.21 0.00 0.70 0.00 0.00 55.95 58.97 1oqm s SER 76 Cb -0.03 -2.62 1.44 0.00 -1.71 0.00 0.00 66.02 63.11 1oqm s SER 76 CO 0.07 -0.21 2.17 0.00 1.20 0.00 0.00 173.24 176.47 1oqm h ASP 78 N 0.00 0.00 0.76 0.00 3.32 -1.91 0.81 116.42 119.40 1oqm h ASP 78 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1oqm h ASP 78 Cb 0.03 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.58 1oqm h ASP 78 CO 0.00 0.01 0.00 0.29 -1.72 0.00 0.00 179.24 177.83 1oqm n LYS 79 N -3.21 0.04 -0.16 3.56 4.76 -0.53 -2.28 118.16 120.33 1oqm n LYS 79 Ca -0.02 0.18 0.11 0.00 -2.87 0.00 0.00 58.31 55.71 1oqm n LYS 79 Cb 0.15 -1.56 0.26 0.00 -1.84 0.00 0.00 35.03 32.03 1oqm n LYS 79 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 1oqm n LEU 80 N -1.63 2.93 -1.02 -0.35 4.77 0.28 -4.18 117.00 117.79 1oqm n LEU 80 Ca 0.05 -1.26 0.08 0.00 -0.03 0.00 0.00 56.01 54.85 1oqm n LEU 80 Cb 0.25 -0.22 0.28 0.00 -2.33 0.00 0.00 43.42 41.40 1oqm n LEU 80 CO 0.20 0.63 0.73 0.18 -1.33 0.00 0.00 177.39 177.80 1oqm n LEU 81 N 1.14 4.11 0.00 2.23 4.77 -0.97 -3.52 117.00 124.77 1oqm n LEU 81 Ca 0.18 -2.97 -0.24 0.00 -0.03 0.00 0.00 56.01 52.95 1oqm n LEU 81 Cb 0.52 -0.55 -0.04 0.00 -2.33 0.00 0.00 43.42 41.02 1oqm n LEU 81 CO 0.15 0.67 -0.14 -0.90 -1.33 0.00 0.00 177.39 175.84 1oqm n ASP 82 N -0.32 2.92 -0.62 -1.43 5.68 -1.26 -4.52 116.55 117.00 1oqm n ASP 82 Ca 0.22 -2.64 0.07 0.00 -0.50 0.00 0.00 54.79 51.94 1oqm n ASP 82 Cb 0.92 0.21 0.22 0.00 -1.14 0.00 0.00 41.12 41.33 1oqm n ASP 82 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 1oqm n ASP 83 N -1.36 1.82 -4.36 -1.12 8.00 -1.26 -4.70 116.55 113.56 1oqm n ASP 83 Ca -0.13 -1.91 -0.45 0.00 0.71 0.00 0.00 54.79 53.01 1oqm n ASP 83 Cb 0.48 -0.20 -0.07 0.00 -0.02 0.00 0.00 41.12 41.32 1oqm n ASP 83 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1oqm s GLU 84 N -1.61 2.98 0.00 -1.24 2.02 -1.26 -4.95 118.70 114.65 1oqm s GLU 84 Ca 0.26 -1.46 0.29 0.00 0.02 0.00 0.00 54.97 54.08 1oqm s GLU 84 Cb 0.14 -4.19 1.28 0.00 0.10 0.00 0.00 34.13 31.46 1oqm s GLU 84 CO 0.19 -1.12 1.88 1.28 0.02 0.00 0.00 175.26 177.51 1oqm n LEU 85 N 5.22 0.52 -0.31 1.80 4.32 -1.26 -4.21 117.00 123.07 1oqm n LEU 85 Ca -0.13 -0.04 -0.05 0.00 -0.02 0.00 0.00 56.01 55.78 1oqm n LEU 85 Cb 0.43 -0.15 0.08 0.00 -1.62 0.00 0.00 43.42 42.15 1oqm n LEU 85 CO 0.49 0.09 1.13 0.44 -1.22 0.00 0.00 177.39 178.32 1oqm h ASP 86 N 0.67 1.10 0.74 -1.43 5.19 -1.92 -0.33 116.42 120.44 1oqm h ASP 86 Ca 0.00 -0.12 -0.19 0.00 -0.62 0.00 0.00 57.03 56.10 1oqm h ASP 86 Cb 0.34 -0.28 -0.02 0.00 0.18 0.00 0.00 39.33 39.55 1oqm h ASP 86 CO 0.00 0.91 -0.86 -2.24 -3.12 0.00 0.00 179.24 173.93 1oqm h ASP 87 N 1.20 0.10 -0.47 6.45 3.04 -1.93 -2.07 116.42 122.75 1oqm h ASP 87 Ca 0.29 -0.08 -0.03 0.00 -3.24 0.00 0.00 57.03 53.97 1oqm h ASP 87 Cb 0.09 -0.03 -0.02 0.00 -1.04 0.00 0.00 39.33 38.33 1oqm h ASP 87 CO -0.04 0.91 0.16 0.44 -2.04 0.00 0.00 179.24 178.67 1oqm h ASP 88 N 0.04 0.67 -0.44 4.15 3.45 -1.70 -2.04 116.42 120.55 1oqm h ASP 88 Ca -0.02 -0.19 -0.03 0.00 0.43 0.00 0.00 57.03 57.21 1oqm h ASP 88 Cb 1.50 -0.18 -0.02 0.00 -0.56 0.00 0.00 39.33 40.07 1oqm h ASP 88 CO 0.12 0.69 0.15 0.40 -1.57 0.00 0.00 179.24 179.03 1oqm h ILE 89 N 0.62 1.22 -0.62 0.35 2.04 -1.02 -0.22 117.51 119.88 1oqm h ILE 89 Ca 0.15 -0.70 0.01 0.00 1.00 0.00 0.00 64.86 65.32 1oqm h ILE 89 Cb 0.24 0.84 -0.03 0.00 -0.74 0.00 0.00 36.82 37.13 1oqm h ILE 89 CO -0.01 0.25 0.41 0.00 0.00 0.00 0.00 178.15 178.80 1oqm h ALA 90 N 1.00 0.78 -0.56 1.87 0.00 -1.28 0.65 119.26 121.73 1oqm h ALA 90 Ca 0.14 -0.05 -0.11 0.00 0.00 0.00 0.00 54.91 54.90 1oqm h ALA 90 Cb 0.24 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 1oqm h ALA 90 CO -0.01 0.22 -0.07 0.00 0.00 0.00 0.00 179.25 179.39 1oqm h ALA 92 N 0.99 1.24 -0.74 0.00 0.00 -0.37 -1.14 119.26 119.22 1oqm h ALA 92 Ca 0.15 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 1oqm h ALA 92 Cb 0.63 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 18.14 1oqm h ALA 92 CO 0.04 0.55 0.33 0.87 0.00 0.00 0.00 179.25 181.04 1oqm h LYS 93 N 0.88 1.08 -0.59 0.00 1.57 -0.61 0.39 116.57 119.28 1oqm h LYS 93 Ca 0.20 -0.17 -0.08 0.00 -1.87 0.00 0.00 60.65 58.73 1oqm h LYS 93 Cb 0.21 -0.19 -0.02 0.00 0.08 0.00 0.00 32.23 32.31 1oqm h LYS 93 CO -0.01 0.85 0.05 0.87 -0.57 0.00 0.00 179.45 180.64 1oqm h LYS 94 N 1.07 0.99 -0.26 3.15 1.57 -0.91 0.61 116.57 122.78 1oqm h LYS 94 Ca 0.25 -0.27 -0.01 0.00 -1.87 0.00 0.00 60.65 58.75 1oqm h LYS 94 Cb 0.15 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.34 1oqm h LYS 94 CO -0.03 0.94 0.12 0.82 -0.57 0.00 0.00 179.45 180.73 1oqm h ILE 95 N 0.92 1.16 -0.39 1.86 2.04 -0.33 0.02 117.51 122.79 1oqm h ILE 95 Ca 0.18 -0.46 0.00 0.00 1.00 0.00 0.00 64.86 65.58 1oqm h ILE 95 Cb 0.47 0.98 -0.02 0.00 -0.74 0.00 0.00 36.82 37.51 1oqm h ILE 95 CO 0.02 0.16 0.26 -0.07 0.00 0.00 0.00 178.15 178.51 1oqm h LEU 96 N 0.28 0.45 -0.86 1.44 3.38 -0.58 0.49 115.31 119.91 1oqm h LEU 96 Ca 0.09 -0.01 -0.09 0.00 0.09 0.00 0.00 57.88 57.96 1oqm h LEU 96 Cb 0.14 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.76 1oqm h LEU 96 CO -0.01 0.33 -0.11 0.00 0.09 0.00 0.00 178.44 178.74 1oqm h ALA 97 N 1.14 1.04 0.00 1.53 0.00 -0.68 -2.42 119.26 119.86 1oqm h ALA 97 Ca 0.14 -0.31 -0.16 0.00 0.00 0.00 0.00 54.91 54.58 1oqm h ALA 97 Cb -0.06 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 1oqm h ALA 97 CO -0.03 0.58 -0.95 0.82 0.00 0.00 0.00 179.25 179.68 1oqm h ILE 98 N 0.67 0.94 0.00 0.00 2.04 -0.79 -3.43 117.51 116.94 1oqm h ILE 98 Ca 0.12 -2.06 -0.33 0.00 1.00 0.00 0.00 64.86 63.59 1oqm h ILE 98 Cb 0.57 2.13 -0.06 0.00 -0.74 0.00 0.00 36.82 38.72 1oqm h ILE 98 CO 0.04 0.32 -2.25 1.17 0.00 0.00 0.00 178.15 177.43 1oqm n LYS 99 N -4.49 0.64 0.00 2.37 4.81 0.16 -5.08 118.16 116.57 1oqm n LYS 99 Ca -0.25 0.11 0.00 0.00 -0.87 0.00 0.00 58.31 57.30 1oqm n LYS 99 Cb 0.59 -1.44 0.00 0.00 0.02 0.00 0.00 35.03 34.20 1oqm n LYS 99 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1oqm n GLY 100 N 2.37 1.58 0.33 3.14 0.00 -0.29 -4.68 105.19 107.65 1oqm n GLY 100 Ca -0.38 -2.06 0.18 0.00 0.00 0.00 0.00 46.02 43.77 1oqm n GLY 100 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1oqm h ILE 101 N 0.00 0.28 0.00 -0.61 6.09 -1.87 -2.08 117.51 119.32 1oqm h ILE 101 Ca 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.49 1oqm h ILE 101 Cb 0.00 0.90 0.00 0.00 0.47 0.00 0.00 36.82 38.19 1oqm h ILE 101 CO 0.00 0.00 0.00 0.47 -3.07 0.00 0.00 178.15 175.55 1oqm n ASP 102 N -3.47 0.22 -0.29 2.19 10.43 -1.26 -1.08 116.55 123.28 1oqm n ASP 102 Ca -0.01 0.59 0.01 0.00 2.57 0.00 0.00 54.79 57.94 1oqm n ASP 102 Cb 0.20 -0.62 0.21 0.00 1.84 0.00 0.00 41.12 42.74 1oqm n ASP 102 CO 0.00 0.00 0.00 0.22 -1.07 0.00 0.00 177.20 176.35 1oqm h TYR 103 N 0.00 1.07 -2.70 1.24 3.20 -1.68 -3.34 116.97 114.76 1oqm h TYR 103 Ca 0.00 0.03 -0.62 0.00 3.14 0.00 0.00 58.73 61.28 1oqm h TYR 103 Cb 0.08 -0.36 -0.14 0.00 1.54 0.00 0.00 36.73 37.86 1oqm h TYR 103 CO 0.00 0.64 0.59 -1.58 -1.64 0.00 0.00 178.16 176.17 1oqm s TRP 104 N -5.94 2.65 0.60 -3.82 0.51 -0.25 -4.91 118.94 107.79 1oqm s TRP 104 Ca -0.12 -0.44 0.30 0.00 -2.12 0.00 0.00 56.10 53.72 1oqm s TRP 104 Cb 0.18 -4.29 1.69 0.00 -0.81 0.00 0.00 33.47 30.25 1oqm s TRP 104 CO 0.80 -1.65 2.10 0.87 -0.51 0.00 0.00 176.95 178.55 1oqm h LYS 105 N 9.58 0.00 0.00 4.98 1.57 -1.84 -2.34 116.57 128.52 1oqm h LYS 105 Ca -0.28 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.47 1oqm h LYS 105 Cb 1.07 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.38 1oqm h LYS 105 CO 1.18 0.00 -0.11 0.00 -0.57 0.00 0.00 179.45 179.95 1oqm h ALA 106 N 1.74 0.96 -0.04 3.86 0.00 -1.92 -3.38 119.26 120.48 1oqm h ALA 106 Ca 0.08 -0.10 0.01 0.00 0.00 0.00 0.00 54.91 54.90 1oqm h ALA 106 Cb 0.50 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 1oqm h ALA 106 CO -0.00 0.13 -0.21 -0.92 0.00 0.00 0.00 179.25 178.25 1oqm h TYR 107 N 0.00 -0.62 0.06 0.00 3.20 -1.75 -1.00 116.97 116.85 1oqm h TYR 107 Ca -0.00 0.02 0.01 0.00 3.14 0.00 0.00 58.73 61.90 1oqm h TYR 107 Cb 0.88 0.28 -0.04 0.00 1.54 0.00 0.00 36.73 39.39 1oqm h TYR 107 CO 0.00 -0.21 -0.42 -0.22 -1.64 0.00 0.00 178.16 175.67 1oqm h LYS 108 N -0.23 -0.55 -0.34 1.82 3.64 -1.80 0.29 116.57 119.39 1oqm h LYS 108 Ca 0.01 0.04 -0.09 0.00 -1.27 0.00 0.00 60.65 59.34 1oqm h LYS 108 Cb 0.27 0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 32.20 1oqm h LYS 108 CO -0.16 -0.37 -0.17 -1.00 -2.27 0.00 0.00 179.45 175.48 1oqm h PRO 109 N -0.57 0.62 0.00 1.90 0.13 -1.77 -3.29 132.00 129.02 1oqm h PRO 109 Ca 0.00 -0.21 0.00 0.00 -0.87 0.00 0.00 66.00 64.92 1oqm h PRO 109 Cb 0.59 -0.05 0.00 0.00 0.13 0.00 0.00 31.00 31.67 1oqm h PRO 109 CO -0.25 0.76 -1.76 -1.33 -0.23 0.00 0.00 178.00 175.19 1oqm n MET 110 N -4.15 0.58 -1.11 0.86 2.81 -0.38 -4.65 117.12 111.08 1oqm n MET 110 Ca 0.01 -0.15 0.02 0.00 -1.81 0.00 0.00 57.70 55.76 1oqm n MET 110 Cb 0.38 -1.48 0.13 0.00 -0.71 0.00 0.00 33.22 31.54 1oqm n MET 110 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1oqm n SER 112 N -0.64 0.56 -3.98 0.00 7.64 -1.24 -4.89 113.62 111.08 1oqm n SER 112 Ca 0.18 0.07 -0.11 0.00 1.01 0.00 0.00 58.87 60.02 1oqm n SER 112 Cb 0.84 0.94 -0.07 0.00 -1.01 0.00 0.00 64.21 64.92 1oqm n SER 112 CO 0.00 0.00 0.00 -1.83 -3.01 0.00 0.00 175.04 170.20 1oqm s GLU 113 N -3.34 1.47 -1.19 1.43 -1.05 -1.26 -4.93 118.70 109.82 1oqm s GLU 113 Ca -0.01 -1.45 -0.10 0.00 -0.15 0.00 0.00 54.97 53.26 1oqm s GLU 113 Cb 0.12 0.40 -0.02 0.00 -0.44 0.00 0.00 34.13 34.19 1oqm s GLU 113 CO 0.82 -0.57 0.77 1.63 0.95 0.00 0.00 175.26 178.86 1oqm n LYS 114 N -0.37 -2.73 -0.00 -4.83 5.02 -1.26 -4.92 118.16 109.08 1oqm n LYS 114 Ca 0.00 0.59 -0.08 0.00 -2.02 0.00 0.00 58.31 56.80 1oqm n LYS 114 Cb 0.63 -4.82 -0.13 0.00 -0.02 0.00 0.00 35.03 30.69 1oqm n LYS 114 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 1oqm h LEU 115 N -1.72 0.00 -1.72 -0.35 3.38 -1.93 -3.37 115.31 109.60 1oqm h LEU 115 Ca -0.64 0.00 0.10 0.00 0.09 0.00 0.00 57.88 57.44 1oqm h LEU 115 Cb 1.35 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 42.07 1oqm h LEU 115 CO 0.51 0.98 0.38 -0.08 0.09 0.00 0.00 178.44 180.32 1oqm h GLU 116 N 0.00 0.31 0.00 1.13 4.57 -1.96 -1.19 114.58 117.43 1oqm h GLU 116 Ca -0.22 -0.02 -0.00 0.00 -1.18 0.00 0.00 59.36 57.94 1oqm h GLU 116 Cb 1.94 -0.07 -0.00 0.00 -0.16 0.00 0.00 28.75 30.46 1oqm h GLU 116 CO 0.09 0.20 -0.01 -0.56 -1.18 0.00 0.00 179.01 177.55 1oqm h GLN 117 N 0.32 0.00 -0.00 1.92 3.07 -1.98 -2.21 115.11 116.22 1oqm h GLN 117 Ca 0.26 0.00 0.00 0.00 0.09 0.00 0.00 58.65 59.00 1oqm h GLN 117 Cb 0.60 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.16 1oqm h GLN 117 CO -0.06 0.01 -0.03 0.91 0.09 0.00 0.00 178.83 179.75 1oqm n TRP 118 N -3.17 0.00 -2.24 0.06 7.02 -0.45 -4.90 117.44 113.76 1oqm n TRP 118 Ca -0.02 0.00 -0.40 0.00 -1.02 0.00 0.00 57.50 56.06 1oqm n TRP 118 Cb 0.14 -0.07 -0.02 0.00 -2.42 0.00 0.00 31.31 28.94 1oqm n TRP 118 CO 0.00 0.00 0.00 0.50 -2.02 0.00 0.00 177.69 176.17 1oqm s ARG 119 N -2.16 4.32 -0.21 -0.99 3.52 -0.83 -4.74 118.95 117.85 1oqm s ARG 119 Ca 0.39 2.03 -0.07 0.00 -0.13 0.00 0.00 55.73 57.95 1oqm s ARG 119 Cb 0.21 -2.98 -0.03 0.00 -1.56 0.00 0.00 34.95 30.59 1oqm s ARG 119 CO 0.40 -0.15 0.05 0.00 -0.81 0.00 0.00 175.30 174.79 1oqm n GLU 121 N 4.25 0.12 -2.07 0.00 -0.58 -1.26 -4.92 120.64 116.18 1oqm n GLU 121 Ca -0.16 -0.02 -0.42 0.00 -0.42 0.00 0.00 57.16 56.13 1oqm n GLU 121 Cb 0.52 -1.52 -0.03 0.00 -0.57 0.00 0.00 31.44 29.84 1oqm n GLU 121 CO 0.00 0.00 0.00 0.21 -0.48 0.00 0.00 177.13 176.86 1oqm s LYS 122 N -3.09 4.21 0.00 3.49 2.20 -1.26 -5.25 119.74 120.04 1oqm s LYS 122 Ca 0.06 2.13 0.02 0.00 -0.36 0.00 0.00 55.97 57.82 1oqm s LYS 122 Cb 0.16 -3.79 0.11 0.00 -1.51 0.00 0.00 37.83 32.79 1oqm s LYS 122 CO 0.84 -0.75 0.60 -2.30 -0.36 0.00 0.00 175.35 173.38