#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 3.09 0.79 -2.82 2.02 -1.26 -0.86 118.70 119.65 1oqm s GLU 2 Ca 0.00 -1.08 -0.11 0.00 0.02 0.00 0.00 54.97 53.81 1oqm s GLU 2 Cb 0.00 -4.17 0.08 0.00 0.10 0.00 0.00 34.13 30.14 1oqm s GLU 2 CO 0.00 -1.36 1.14 -0.51 0.02 0.00 0.00 175.26 174.55 1oqm s LEU 3 N 2.66 2.61 0.40 1.80 1.43 -0.31 -4.98 118.68 122.29 1oqm s LEU 3 Ca 0.13 0.64 0.06 0.00 -1.03 0.00 0.00 54.13 53.94 1oqm s LEU 3 Cb -0.21 -3.15 0.00 0.00 0.03 0.00 0.00 46.19 42.87 1oqm s LEU 3 CO 0.09 -1.88 0.56 0.42 0.23 0.00 0.00 176.35 175.78 1oqm s THR 4 N -3.50 3.44 0.14 5.49 -4.23 -1.26 -4.80 115.64 110.91 1oqm s THR 4 Ca 0.62 -0.92 -0.18 0.00 -1.18 0.00 0.00 61.69 60.03 1oqm s THR 4 Cb -0.10 -3.19 -0.02 0.00 1.34 0.00 0.00 72.50 70.53 1oqm s THR 4 CO 0.48 -0.08 1.74 0.50 -0.54 0.00 0.00 174.62 176.72 1oqm h LYS 5 N 0.65 0.17 -0.70 3.99 3.64 -1.98 -0.54 116.57 121.79 1oqm h LYS 5 Ca -0.43 -0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 58.92 1oqm h LYS 5 Cb 1.27 -0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 33.02 1oqm h LYS 5 CO 0.50 0.11 0.36 0.00 -2.27 0.00 0.00 179.45 178.14 1oqm h LYS 7 N 0.97 0.30 0.02 0.00 1.57 -1.87 -0.73 116.57 116.83 1oqm h LYS 7 Ca 0.24 -0.02 0.02 0.00 -1.87 0.00 0.00 60.65 59.02 1oqm h LYS 7 Cb 0.09 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.31 1oqm h LYS 7 CO -0.03 0.21 -0.10 0.28 -0.57 0.00 0.00 179.45 179.23 1oqm h VAL 8 N 0.30 0.74 -0.46 0.50 2.07 -0.77 0.14 116.25 118.77 1oqm h VAL 8 Ca 0.08 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.68 1oqm h VAL 8 Cb -0.03 0.74 -0.07 0.00 -1.52 0.00 0.00 31.29 30.42 1oqm h VAL 8 CO -0.02 0.00 0.07 0.28 0.02 0.00 0.00 177.57 177.92 1oqm h SER 9 N -0.19 -0.05 -0.05 0.57 0.02 -0.64 -1.33 113.55 111.88 1oqm h SER 9 Ca 0.03 0.09 -0.00 0.00 -0.84 0.00 0.00 61.79 61.07 1oqm h SER 9 Cb 0.23 0.13 -0.00 0.00 0.14 0.00 0.00 62.40 62.90 1oqm h SER 9 CO -0.09 0.01 0.01 -0.74 -1.14 0.00 0.00 176.83 174.88 1oqm h HIS 10 N 0.19 0.08 -0.54 3.45 6.17 -0.94 -3.09 115.15 120.49 1oqm h HIS 10 Ca 0.23 -0.01 0.05 0.00 0.71 0.00 0.00 60.37 61.35 1oqm h HIS 10 Cb 0.31 -0.02 -0.03 0.00 2.52 0.00 0.00 27.41 30.19 1oqm h HIS 10 CO -0.24 0.26 0.36 0.00 0.71 0.00 0.00 177.93 179.02 1oqm h ALA 11 N 0.81 1.80 -0.65 5.26 0.00 -0.46 -2.70 119.26 123.33 1oqm h ALA 11 Ca 0.02 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1oqm h ALA 11 Cb 0.22 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.86 1oqm h ALA 11 CO -0.00 0.12 0.00 0.44 0.00 0.00 0.00 179.25 179.81 1oqm n ILE 12 N -4.47 1.93 -0.33 0.00 -5.35 -0.55 -4.65 119.36 105.94 1oqm n ILE 12 Ca 0.07 -1.22 0.12 0.00 -0.27 0.00 0.00 62.75 61.44 1oqm n ILE 12 Cb 0.19 0.09 0.24 0.00 -1.74 0.00 0.00 39.64 38.42 1oqm n ILE 12 CO 0.00 0.00 0.00 0.29 -1.76 0.00 0.00 176.55 175.08 1oqm n LYS 13 N 1.09 -0.08 0.10 6.28 5.02 -1.02 -0.49 118.16 129.06 1oqm n LYS 13 Ca 0.26 1.42 0.20 0.00 -2.02 0.00 0.00 58.31 58.17 1oqm n LYS 13 Cb 0.92 -2.21 0.74 0.00 -0.02 0.00 0.00 35.03 34.46 1oqm n LYS 13 CO 0.00 0.00 0.00 -0.44 -0.52 0.00 0.00 177.40 176.44 1oqm h ASP 14 N 0.00 0.00 0.57 4.39 5.19 -1.86 -0.75 116.42 123.96 1oqm h ASP 14 Ca 0.54 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.95 1oqm h ASP 14 Cb 1.04 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.55 1oqm h ASP 14 CO -0.90 0.00 -0.42 0.00 -3.12 0.00 0.00 179.24 174.80 1oqm n ILE 15 N -3.62 0.00 -1.68 0.35 3.06 0.35 -4.89 119.36 112.94 1oqm n ILE 15 Ca 0.07 -0.00 -0.46 0.00 -2.50 0.00 0.00 62.75 59.86 1oqm n ILE 15 Cb 0.64 0.13 -0.04 0.00 0.54 0.00 0.00 39.64 40.91 1oqm n ILE 15 CO 0.00 0.00 0.00 -0.67 -2.50 0.00 0.00 176.55 173.38 1oqm n ASP 16 N -1.49 3.45 0.00 9.51 2.03 -0.29 -2.27 116.55 127.49 1oqm n ASP 16 Ca 0.06 1.01 0.00 0.00 0.52 0.00 0.00 54.79 56.38 1oqm n ASP 16 Cb 0.34 -1.43 0.00 0.00 -0.72 0.00 0.00 41.12 39.31 1oqm n ASP 16 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1oqm n GLY 17 N 4.01 2.89 3.67 0.27 0.00 -0.16 -5.02 105.19 110.86 1oqm n GLY 17 Ca 0.20 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.75 1oqm n GLY 17 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1oqm n TYR 18 N -0.07 2.29 -1.39 1.61 4.02 -0.96 0.38 117.16 123.05 1oqm n TYR 18 Ca 0.00 0.15 -0.13 0.00 -0.01 0.00 0.00 57.90 57.91 1oqm n TYR 18 Cb 0.00 -2.60 -0.06 0.00 -0.02 0.00 0.00 39.34 36.67 1oqm n TYR 18 CO 0.00 0.00 0.00 0.94 -1.01 0.00 0.00 176.86 176.79 1oqm n GLN 19 N 4.84 -1.23 -1.08 -0.72 -0.06 -1.26 -2.43 117.38 115.43 1oqm n GLN 19 Ca 0.19 0.95 -0.03 0.00 -2.00 0.00 0.00 57.00 56.11 1oqm n GLN 19 Cb 0.29 -5.14 -0.01 0.00 -4.06 0.00 0.00 30.24 21.31 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 -0.73 0.59 3.71 1.69 0.00 0.16 -5.01 105.19 105.59 1oqm n GLY 20 Ca -0.13 -0.43 -0.37 0.00 0.00 0.00 0.00 46.02 45.08 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 -1.98 5.24 0.59 -0.61 -1.09 -1.02 -4.91 121.20 117.42 1oqm s ILE 21 Ca 0.00 0.69 -0.01 0.00 -2.23 0.00 0.00 60.65 59.10 1oqm s ILE 21 Cb 0.00 -3.71 0.04 0.00 -1.58 0.00 0.00 42.46 37.22 1oqm s ILE 21 CO 0.00 0.33 0.84 -0.94 -1.23 0.00 0.00 174.94 173.93 1oqm s SER 22 N 0.71 5.14 0.48 3.58 1.04 -1.26 -0.99 113.70 122.41 1oqm s SER 22 Ca 0.19 0.09 0.18 0.00 0.48 0.00 0.00 55.95 56.89 1oqm s SER 22 Cb -0.14 -0.90 1.18 0.00 0.10 0.00 0.00 66.02 66.26 1oqm s SER 22 CO 0.07 -1.27 2.04 -0.07 0.98 0.00 0.00 173.24 174.99 1oqm h LEU 23 N -0.10 0.00 -0.25 2.42 3.38 -1.95 -1.92 115.31 116.89 1oqm h LEU 23 Ca -0.42 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.47 1oqm h LEU 23 Cb 1.30 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.04 1oqm h LEU 23 CO 0.54 0.14 -0.15 -0.07 0.09 0.00 0.00 178.44 178.99 1oqm h LEU 24 N 0.00 0.56 -0.93 1.67 3.38 -1.90 -0.56 115.31 117.53 1oqm h LEU 24 Ca -0.00 -0.43 -0.03 0.00 0.09 0.00 0.00 57.88 57.52 1oqm h LEU 24 Cb 0.28 -0.16 -0.04 0.00 0.09 0.00 0.00 40.66 40.83 1oqm h LEU 24 CO 0.02 0.87 0.41 -0.33 0.09 0.00 0.00 178.44 179.50 1oqm h GLU 25 N 0.26 1.17 -0.34 1.13 5.08 -1.79 -2.27 114.58 117.83 1oqm h GLU 25 Ca 0.05 -0.16 -0.15 0.00 -1.00 0.00 0.00 59.36 58.10 1oqm h GLU 25 Cb 0.67 -0.22 -0.00 0.00 0.50 0.00 0.00 28.75 29.69 1oqm h GLU 25 CO 0.04 0.89 -0.39 -1.49 -1.00 0.00 0.00 179.01 177.06 1oqm h TRP 26 N 1.17 1.05 -0.93 4.33 4.06 -1.24 0.20 115.95 124.58 1oqm h TRP 26 Ca 0.29 -0.33 0.04 0.00 2.06 0.00 0.00 58.89 60.95 1oqm h TRP 26 Cb 0.09 -0.22 -0.06 0.00 -1.00 0.00 0.00 29.16 27.98 1oqm h TRP 26 CO 0.01 1.14 0.60 0.00 -3.56 0.00 0.00 178.44 176.63 1oqm h ALA 27 N 0.73 1.24 0.12 1.49 0.00 -0.93 0.23 119.26 122.14 1oqm h ALA 27 Ca 0.05 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 1oqm h ALA 27 Cb 0.98 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.46 1oqm h ALA 27 CO 0.09 0.45 -0.06 0.00 0.00 0.00 0.00 179.25 179.73 1oqm h VAL 29 N -0.58 0.83 -0.11 0.00 2.07 -0.26 -2.76 116.25 115.44 1oqm h VAL 29 Ca -0.02 -0.08 -0.09 0.00 0.82 0.00 0.00 66.70 67.33 1oqm h VAL 29 Cb 0.46 0.56 -0.01 0.00 -1.52 0.00 0.00 31.29 30.77 1oqm h VAL 29 CO 0.03 0.05 -0.35 -0.07 0.02 0.00 0.00 177.57 177.25 1oqm h LEU 30 N 0.25 0.22 -0.34 2.57 3.38 -0.59 0.53 115.31 121.33 1oqm h LEU 30 Ca 0.19 -0.08 -0.01 0.00 0.09 0.00 0.00 57.88 58.07 1oqm h LEU 30 Cb 0.21 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 40.88 1oqm h LEU 30 CO -0.23 0.56 0.17 0.15 0.09 0.00 0.00 178.44 179.18 1oqm h PHE 31 N 0.19 0.48 0.00 1.13 3.57 -1.18 -0.58 116.94 120.55 1oqm h PHE 31 Ca 0.02 -0.02 -0.10 0.00 3.53 0.00 0.00 57.97 61.40 1oqm h PHE 31 Cb 0.71 -0.15 -0.01 0.00 2.79 0.00 0.00 35.95 39.28 1oqm h PHE 31 CO 0.01 0.41 -0.49 0.45 -2.23 0.00 0.00 178.31 176.46 1oqm h HIS 32 N 0.41 0.00 0.03 0.41 3.86 -1.25 0.61 115.15 119.23 1oqm h HIS 32 Ca 0.12 0.00 -0.10 0.00 -1.16 0.00 0.00 60.37 59.23 1oqm h HIS 32 Cb 0.10 0.00 0.01 0.00 1.06 0.00 0.00 27.41 28.58 1oqm h HIS 32 CO -0.02 0.49 -0.40 1.15 0.86 0.00 0.00 177.93 180.01 1oqm h THR 33 N 0.00 1.56 0.00 2.45 2.02 -0.57 -3.42 112.91 114.95 1oqm h THR 33 Ca -0.00 -2.17 0.00 0.00 0.77 0.00 0.00 66.41 65.00 1oqm h THR 33 Cb 0.98 2.95 0.00 0.00 -1.74 0.00 0.00 68.15 70.33 1oqm h THR 33 CO 0.06 0.60 0.00 -1.54 0.37 0.00 0.00 175.52 175.01 1oqm n SER 34 N -4.39 0.25 -1.37 4.18 3.41 -0.25 -4.91 113.62 110.54 1oqm n SER 34 Ca -0.11 -1.13 -0.18 0.00 -0.26 0.00 0.00 58.87 57.20 1oqm n SER 34 Cb 0.60 0.00 -0.08 0.00 -0.26 0.00 0.00 64.21 64.48 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 -0.06 1.71 2.28 5.00 0.00 0.20 -0.84 105.19 113.48 1oqm n GLY 35 Ca 0.00 -0.03 -0.09 0.00 0.00 0.00 0.00 46.02 45.90 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 -2.36 0.00 -2.97 1.61 4.01 -1.24 -4.70 117.16 111.51 1oqm n TYR 36 Ca -0.18 0.00 -0.43 0.00 -0.16 0.00 0.00 57.90 57.13 1oqm n TYR 36 Cb 0.65 -1.84 -0.05 0.00 -0.31 0.00 0.00 39.34 37.79 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 -2.88 6.33 0.39 7.72 -1.08 -0.02 -1.16 116.67 125.97 1oqm s ASP 37 Ca 0.00 -0.41 0.27 0.00 -0.52 0.00 0.00 52.55 51.90 1oqm s ASP 37 Cb 0.00 -2.38 1.37 0.00 -1.46 0.00 0.00 42.92 40.45 1oqm s ASP 37 CO 0.00 -1.03 1.83 0.71 0.52 0.00 0.00 175.17 177.21 1oqm h THR 38 N 5.96 0.00 -0.47 1.71 1.35 -1.32 -2.27 112.91 117.87 1oqm h THR 38 Ca -0.26 -0.11 0.00 0.00 -0.55 0.00 0.00 66.41 65.49 1oqm h THR 38 Cb 1.08 0.81 0.00 0.00 -1.73 0.00 0.00 68.15 68.31 1oqm h THR 38 CO 1.01 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 176.28 1oqm n GLN 39 N -2.48 3.16 -1.69 4.72 6.02 -1.26 -4.00 117.38 121.84 1oqm n GLN 39 Ca -0.01 -2.56 -0.44 0.00 -0.01 0.00 0.00 57.00 53.99 1oqm n GLN 39 Cb 0.12 -1.62 -0.04 0.00 1.02 0.00 0.00 30.24 29.72 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 0.63 2.05 -3.90 -1.58 0.00 -0.86 -4.74 120.51 112.11 1oqm n ALA 40 Ca 0.20 0.39 -0.29 0.00 0.00 0.00 0.00 53.44 53.74 1oqm n ALA 40 Cb 0.70 -2.48 -0.16 0.00 0.00 0.00 0.00 19.45 17.51 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 1.61 1.25 -0.07 0.00 1.01 -1.26 -0.45 120.40 122.48 1oqm s VAL 41 Ca 0.79 -0.87 0.02 0.00 0.00 0.00 0.00 61.98 61.92 1oqm s VAL 41 Cb -0.57 -1.48 0.02 0.00 0.00 0.00 0.00 36.38 34.34 1oqm s VAL 41 CO 0.37 0.01 -0.10 -0.69 0.00 0.00 0.00 175.10 174.69 1oqm s VAL 42 N 1.55 1.02 0.19 2.92 1.01 -0.29 -4.97 120.40 121.84 1oqm s VAL 42 Ca -0.02 -0.39 -0.25 0.00 0.00 0.00 0.00 61.98 61.32 1oqm s VAL 42 Cb -0.17 -0.96 -0.08 0.00 0.00 0.00 0.00 36.38 35.17 1oqm s VAL 42 CO -0.07 0.34 0.80 0.20 0.00 0.00 0.00 175.10 176.37 1oqm s ASN 43 N 0.88 7.38 0.00 3.32 -0.87 -1.26 0.23 114.94 124.62 1oqm s ASN 43 Ca -0.11 1.67 0.00 0.00 -1.57 0.00 0.00 52.86 52.85 1oqm s ASN 43 Cb -0.15 -2.51 0.00 0.00 -0.02 0.00 0.00 41.25 38.57 1oqm s ASN 43 CO 0.01 0.16 0.00 -0.67 -2.57 0.00 0.00 177.10 174.03 1oqm n ASP 44 N 1.40 0.00 -4.22 -1.22 -0.08 -0.13 -4.94 116.55 107.36 1oqm n ASP 44 Ca -0.04 0.00 -0.42 0.00 -1.51 0.00 0.00 54.79 52.82 1oqm n ASP 44 Cb 0.49 0.00 -0.06 0.00 2.34 0.00 0.00 41.12 43.89 1oqm n ASP 44 CO 0.00 0.00 0.00 0.20 0.12 0.00 0.00 177.20 177.52 1oqm s ASN 45 N -0.22 5.97 0.00 1.67 0.01 -1.26 -4.58 114.94 116.53 1oqm s ASN 45 Ca 0.00 -2.52 0.00 0.00 -0.71 0.00 0.00 52.86 49.63 1oqm s ASN 45 Cb 0.00 -2.04 0.00 0.00 0.41 0.00 0.00 41.25 39.62 1oqm s ASN 45 CO 0.00 -0.55 0.00 0.61 -1.51 0.00 0.00 177.10 175.65 1oqm n GLY 46 N 4.09 2.95 3.77 0.66 0.00 -1.26 -5.03 105.19 110.38 1oqm n GLY 46 Ca 0.05 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.75 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 0.76 4.19 -0.01 1.61 1.04 -1.26 -5.05 113.70 114.98 1oqm s SER 47 Ca 0.00 -1.59 0.04 0.00 0.48 0.00 0.00 55.95 54.88 1oqm s SER 47 Cb 0.00 0.47 -0.01 0.00 0.10 0.00 0.00 66.02 66.58 1oqm s SER 47 CO 0.00 -0.87 -0.13 -0.89 0.98 0.00 0.00 173.24 172.34 1oqm s THR 48 N -2.86 1.02 -0.08 2.02 2.01 -1.26 -0.95 115.64 115.55 1oqm s THR 48 Ca 0.10 -0.55 0.00 0.00 0.31 0.00 0.00 61.69 61.56 1oqm s THR 48 Cb 0.01 -0.85 -0.03 0.00 0.01 0.00 0.00 72.50 71.65 1oqm s THR 48 CO 0.06 0.29 -0.07 -1.61 -0.69 0.00 0.00 174.62 172.60 1oqm s GLU 49 N -0.31 2.83 -0.04 4.92 2.02 0.13 -1.22 118.70 127.03 1oqm s GLU 49 Ca 0.05 -0.55 0.06 0.00 0.02 0.00 0.00 54.97 54.55 1oqm s GLU 49 Cb -0.05 -2.61 -0.01 0.00 0.10 0.00 0.00 34.13 31.56 1oqm s GLU 49 CO -0.00 0.62 -0.22 0.71 0.02 0.00 0.00 175.26 176.39 1oqm s TYR 50 N -0.70 2.10 0.00 1.61 1.51 0.69 -1.14 117.35 121.43 1oqm s TYR 50 Ca 0.11 -0.56 0.00 0.00 -1.01 0.00 0.00 57.07 55.60 1oqm s TYR 50 Cb -0.11 -1.38 0.00 0.00 -0.11 0.00 0.00 41.96 40.35 1oqm s TYR 50 CO 0.02 -0.15 0.00 0.41 -1.11 0.00 0.00 175.55 174.71 1oqm n GLY 51 N 2.90 -1.25 0.29 0.71 0.00 0.40 -1.75 105.19 106.51 1oqm n GLY 51 Ca -0.17 -1.14 0.10 0.00 0.00 0.00 0.00 46.02 44.80 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 -0.05 -0.15 0.99 5.85 -1.69 0.37 115.31 120.62 1oqm h LEU 52 Ca 0.00 0.18 0.00 0.00 0.84 0.00 0.00 57.88 58.90 1oqm h LEU 52 Cb 0.00 0.26 0.00 0.00 0.37 0.00 0.00 40.66 41.29 1oqm h LEU 52 CO 0.00 -0.13 -0.34 0.49 -0.34 0.00 0.00 178.44 178.13 1oqm n PHE 53 N -5.23 0.00 -3.57 1.25 3.72 -1.26 -4.31 117.46 108.06 1oqm n PHE 53 Ca 0.18 0.00 -0.24 0.00 -0.05 0.00 0.00 57.45 57.34 1oqm n PHE 53 Cb 0.59 -0.24 0.05 0.00 -0.94 0.00 0.00 39.48 38.94 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 -1.22 -2.72 -2.69 -1.08 1.13 0.12 -4.96 117.38 105.97 1oqm n GLN 54 Ca 0.08 0.62 -0.41 0.00 -1.94 0.00 0.00 57.00 55.35 1oqm n GLN 54 Cb 0.33 -4.93 -0.04 0.00 0.11 0.00 0.00 30.24 25.72 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 -3.51 4.53 0.15 5.09 1.01 -0.71 -4.35 121.20 123.40 1oqm s ILE 55 Ca 0.31 1.99 -0.21 0.00 0.00 0.00 0.00 60.65 62.74 1oqm s ILE 55 Cb -0.08 -4.27 -0.08 0.00 0.01 0.00 0.00 42.46 38.04 1oqm s ILE 55 CO 0.81 0.25 0.68 -0.55 0.00 0.00 0.00 174.94 176.13 1oqm s SER 56 N 0.38 7.16 0.00 3.58 0.15 -1.26 -0.22 113.70 123.49 1oqm s SER 56 Ca 0.49 1.42 0.31 0.00 0.70 0.00 0.00 55.95 58.88 1oqm s SER 56 Cb -0.23 -2.42 1.86 0.00 -1.71 0.00 0.00 66.02 63.52 1oqm s SER 56 CO 0.30 0.18 2.20 -0.90 1.20 0.00 0.00 173.24 176.22 1oqm n ASP 57 N 1.38 0.00 -0.05 5.45 5.75 -0.36 -2.24 116.55 126.48 1oqm n ASP 57 Ca -0.07 -0.95 -0.12 0.00 -0.01 0.00 0.00 54.79 53.64 1oqm n ASP 57 Cb 0.50 -0.01 -0.07 0.00 -1.03 0.00 0.00 41.12 40.51 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 0.00 0.29 0.00 0.11 2.43 -1.82 -3.42 114.38 111.97 1oqm h ARG 58 Ca 0.00 -0.12 0.00 0.00 -0.81 0.00 0.00 59.98 59.05 1oqm h ARG 58 Cb 0.01 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.55 1oqm h ARG 58 CO 0.00 0.59 -0.66 1.19 -1.51 0.00 0.00 179.97 179.58 1oqm n PHE 59 N -4.68 0.00 -0.05 2.20 3.72 -1.25 -4.12 117.46 113.28 1oqm n PHE 59 Ca -0.06 0.00 -0.19 0.00 -0.05 0.00 0.00 57.45 57.15 1oqm n PHE 59 Cb 0.27 0.00 -0.13 0.00 -0.94 0.00 0.00 39.48 38.68 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 -1.32 0.74 -4.33 1.38 7.02 -0.95 -0.97 117.44 119.01 1oqm n TRP 60 Ca 0.00 0.17 -0.17 0.00 -1.02 0.00 0.00 57.50 56.47 1oqm n TRP 60 Cb 0.22 -1.10 -0.10 0.00 -2.42 0.00 0.00 31.31 27.90 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 -3.79 4.04 0.31 0.00 2.20 0.10 -4.37 119.74 118.23 1oqm s LYS 62 Ca 0.26 -0.29 0.01 0.00 -0.36 0.00 0.00 55.97 55.58 1oqm s LYS 62 Cb 0.04 -3.42 0.01 0.00 -1.51 0.00 0.00 37.83 32.95 1oqm s LYS 62 CO 0.07 0.14 0.08 -1.13 -0.36 0.00 0.00 175.35 174.15 1oqm n SER 63 N 4.00 2.60 0.23 1.43 3.41 -1.26 -0.59 113.62 123.45 1oqm n SER 63 Ca -0.16 -2.28 0.14 0.00 -0.26 0.00 0.00 58.87 56.32 1oqm n SER 63 Cb 0.52 0.14 0.42 0.00 -0.26 0.00 0.00 64.21 65.03 1oqm n SER 63 CO 0.00 0.00 0.00 -1.28 -0.16 0.00 0.00 175.04 173.60 1oqm h SER 64 N 0.63 0.00 0.20 4.04 0.87 -1.99 -3.35 113.55 113.94 1oqm h SER 64 Ca -0.24 0.00 -0.35 0.00 -1.23 0.00 0.00 61.79 59.97 1oqm h SER 64 Cb 0.77 0.00 -0.05 0.00 -0.44 0.00 0.00 62.40 62.68 1oqm h SER 64 CO 0.39 0.00 -2.08 -0.62 -0.53 0.00 0.00 176.83 174.00 1oqm n GLU 65 N -3.00 0.68 -3.16 2.24 4.71 -1.26 -4.70 120.64 116.15 1oqm n GLU 65 Ca 0.03 0.19 -0.39 0.00 -0.01 0.00 0.00 57.16 56.97 1oqm n GLU 65 Cb 0.41 -1.66 -0.01 0.00 -1.01 0.00 0.00 31.44 29.17 1oqm n GLU 65 CO 0.00 0.00 0.00 1.19 0.09 0.00 0.00 177.13 178.41 1oqm n PHE 66 N -3.12 2.92 0.32 -0.32 3.72 -1.26 -4.85 117.46 114.87 1oqm n PHE 66 Ca -0.30 -3.11 0.20 0.00 -0.05 0.00 0.00 57.45 54.19 1oqm n PHE 66 Cb 1.07 -1.14 1.07 0.00 -0.94 0.00 0.00 39.48 39.53 1oqm n PHE 66 CO 0.00 0.00 0.00 -1.35 -0.05 0.00 0.00 176.76 175.36 1oqm h PRO 67 N 5.31 0.00 -0.07 -1.08 0.11 -1.84 -0.81 132.00 133.62 1oqm h PRO 67 Ca 0.20 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.31 1oqm h PRO 67 Cb 0.66 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.77 1oqm h PRO 67 CO 1.18 0.01 0.00 -0.85 -0.21 0.00 0.00 178.00 178.13 1oqm n GLU 68 N -3.28 1.56 -1.72 1.05 0.00 -1.26 -4.90 120.64 112.09 1oqm n GLU 68 Ca -0.03 -0.83 -0.42 0.00 0.00 0.00 0.00 57.16 55.88 1oqm n GLU 68 Cb 0.11 -1.44 -0.01 0.00 0.00 0.00 0.00 31.44 30.11 1oqm n GLU 68 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.13 177.58 1oqm n SER 69 N 0.02 3.01 0.14 -1.84 2.88 -0.31 -4.85 113.62 112.67 1oqm n SER 69 Ca 0.18 1.21 0.12 0.00 -1.33 0.00 0.00 58.87 59.06 1oqm n SER 69 Cb 0.30 -1.52 0.48 0.00 -0.75 0.00 0.00 64.21 62.72 1oqm n SER 69 CO 0.00 0.00 0.00 -0.33 -1.23 0.00 0.00 175.04 173.48 1oqm h GLU 70 N 2.72 0.00 -6.76 -1.46 3.07 -1.72 -3.46 114.58 106.98 1oqm h GLU 70 Ca -0.47 0.00 -0.55 0.00 -0.50 0.00 0.00 59.36 57.83 1oqm h GLU 70 Cb 1.27 0.00 -0.04 0.00 -0.84 0.00 0.00 28.75 29.14 1oqm h GLU 70 CO 0.63 0.00 -0.97 -1.71 -1.40 0.00 0.00 179.01 175.57 1oqm n ASN 71 N -2.31 -2.64 -0.27 1.42 4.05 -0.83 -4.79 115.26 109.90 1oqm n ASN 71 Ca 0.03 -1.19 0.12 0.00 0.45 0.00 0.00 54.58 53.99 1oqm n ASN 71 Cb 0.28 -2.23 0.39 0.00 1.23 0.00 0.00 39.78 39.45 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 -2.18 0.82 0.00 -1.44 2.04 -0.96 0.69 117.51 116.48 1oqm h ILE 72 Ca -0.68 -0.23 0.00 0.00 1.00 0.00 0.00 64.86 64.95 1oqm h ILE 72 Cb 1.39 0.09 0.00 0.00 -0.74 0.00 0.00 36.82 37.56 1oqm h ILE 72 CO 0.57 0.12 0.00 0.00 0.00 0.00 0.00 178.15 178.84 1oqm n GLY 74 N 1.07 -0.35 3.29 0.00 0.00 0.23 -4.96 105.19 104.47 1oqm n GLY 74 Ca 0.15 0.14 -0.14 0.00 0.00 0.00 0.00 46.02 46.16 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 -3.52 0.04 0.20 -0.61 2.07 -1.26 -5.07 121.20 113.05 1oqm s ILE 75 Ca 0.12 -0.37 -0.30 0.00 -1.41 0.00 0.00 60.65 58.69 1oqm s ILE 75 Cb -0.06 -0.67 -0.08 0.00 0.13 0.00 0.00 42.46 41.78 1oqm s ILE 75 CO 0.79 -0.20 1.21 -0.55 -1.91 0.00 0.00 174.94 174.27 1oqm s SER 76 N -1.20 7.07 0.56 4.50 0.15 -1.26 -0.72 113.70 122.79 1oqm s SER 76 Ca -0.12 2.27 0.25 0.00 0.70 0.00 0.00 55.95 59.05 1oqm s SER 76 Cb -0.04 -2.61 1.51 0.00 -1.71 0.00 0.00 66.02 63.16 1oqm s SER 76 CO 0.05 -0.38 2.09 0.00 1.20 0.00 0.00 173.24 176.20 1oqm h ASP 78 N 0.00 0.00 0.68 0.00 3.32 -1.91 0.44 116.42 118.95 1oqm h ASP 78 Ca 0.11 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.16 1oqm h ASP 78 Cb 0.52 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.07 1oqm h ASP 78 CO -0.00 0.00 0.00 0.29 -1.72 0.00 0.00 179.24 177.81 1oqm n LYS 79 N -3.09 0.01 -0.11 3.56 4.01 -0.26 -1.77 118.16 120.52 1oqm n LYS 79 Ca -0.01 0.18 0.12 0.00 -0.51 0.00 0.00 58.31 58.09 1oqm n LYS 79 Cb 0.20 -1.52 0.24 0.00 -0.51 0.00 0.00 35.03 33.45 1oqm n LYS 79 CO 0.00 0.00 0.00 1.28 -1.11 0.00 0.00 177.40 177.57 1oqm n LEU 80 N -1.54 2.85 -0.95 -0.35 4.77 0.15 -4.00 117.00 117.92 1oqm n LEU 80 Ca 0.05 -1.14 0.08 0.00 -0.03 0.00 0.00 56.01 54.97 1oqm n LEU 80 Cb 0.23 -0.14 0.23 0.00 -2.33 0.00 0.00 43.42 41.41 1oqm n LEU 80 CO 0.18 0.57 0.70 0.18 -1.33 0.00 0.00 177.39 177.69 1oqm n LEU 81 N 1.13 3.48 0.00 2.23 4.77 -0.73 -3.60 117.00 124.27 1oqm n LEU 81 Ca 0.17 -2.12 -0.07 0.00 -0.03 0.00 0.00 56.01 53.96 1oqm n LEU 81 Cb 0.53 -0.36 0.01 0.00 -2.33 0.00 0.00 43.42 41.27 1oqm n LEU 81 CO 0.15 0.81 0.05 -0.90 -1.33 0.00 0.00 177.39 176.16 1oqm n ASP 82 N 0.81 1.20 -0.31 -1.43 5.68 -1.26 -4.49 116.55 116.76 1oqm n ASP 82 Ca 0.17 -1.51 0.13 0.00 -0.50 0.00 0.00 54.79 53.09 1oqm n ASP 82 Cb 0.56 -0.05 0.36 0.00 -1.14 0.00 0.00 41.12 40.86 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 -2.23 1.21 -4.45 -1.12 9.92 -1.26 -4.71 116.55 113.91 1oqm n ASP 83 Ca 0.01 -1.05 -0.44 0.00 -0.53 0.00 0.00 54.79 52.79 1oqm n ASP 83 Cb 0.18 0.14 -0.03 0.00 -0.64 0.00 0.00 41.12 40.77 1oqm n ASP 83 CO 0.00 0.00 0.00 -1.61 0.13 0.00 0.00 177.20 175.72 1oqm s GLU 84 N -2.42 3.42 0.00 -1.24 8.01 -1.26 -4.92 118.70 120.29 1oqm s GLU 84 Ca 0.26 -1.45 0.21 0.00 0.01 0.00 0.00 54.97 54.00 1oqm s GLU 84 Cb 0.19 -4.68 1.02 0.00 -4.31 0.00 0.00 34.13 26.35 1oqm s GLU 84 CO 0.49 -1.78 1.67 1.28 0.01 0.00 0.00 175.26 176.94 1oqm n LEU 85 N 6.91 0.00 -0.37 1.80 7.99 -1.26 -4.15 117.00 127.91 1oqm n LEU 85 Ca 0.14 0.34 0.02 0.00 -0.01 0.00 0.00 56.01 56.50 1oqm n LEU 85 Cb 0.48 -0.34 0.17 0.00 -0.11 0.00 0.00 43.42 43.62 1oqm n LEU 85 CO 0.55 -0.10 1.27 0.44 -1.51 0.00 0.00 177.39 178.04 1oqm h ASP 86 N 0.00 1.05 0.62 -1.43 3.45 -1.91 -1.11 116.42 117.09 1oqm h ASP 86 Ca 0.00 0.01 -0.16 0.00 0.43 0.00 0.00 57.03 57.31 1oqm h ASP 86 Cb 0.24 -0.22 -0.02 0.00 -0.56 0.00 0.00 39.33 38.78 1oqm h ASP 86 CO 0.00 0.67 -0.72 -2.24 -1.57 0.00 0.00 179.24 175.38 1oqm h ASP 87 N 1.19 0.10 -0.48 6.45 3.04 -1.93 -2.29 116.42 122.49 1oqm h ASP 87 Ca 0.43 -0.07 -0.02 0.00 -3.24 0.00 0.00 57.03 54.14 1oqm h ASP 87 Cb 0.15 -0.03 -0.02 0.00 -1.04 0.00 0.00 39.33 38.39 1oqm h ASP 87 CO -0.17 0.78 0.23 0.44 -2.04 0.00 0.00 179.24 178.48 1oqm h ASP 88 N 0.05 0.63 -0.40 4.15 3.45 -1.60 -1.38 116.42 121.32 1oqm h ASP 88 Ca -0.01 -0.13 -0.01 0.00 0.43 0.00 0.00 57.03 57.31 1oqm h ASP 88 Cb 1.27 -0.16 -0.02 0.00 -0.56 0.00 0.00 39.33 39.86 1oqm h ASP 88 CO 0.10 0.58 0.22 0.40 -1.57 0.00 0.00 179.24 178.97 1oqm h ILE 89 N 0.63 1.15 -0.65 0.35 2.04 -1.16 0.76 117.51 120.63 1oqm h ILE 89 Ca 0.16 -0.40 -0.02 0.00 1.00 0.00 0.00 64.86 65.61 1oqm h ILE 89 Cb 0.12 0.69 -0.03 0.00 -0.74 0.00 0.00 36.82 36.86 1oqm h ILE 89 CO -0.02 0.16 0.34 0.00 0.00 0.00 0.00 178.15 178.63 1oqm h ALA 90 N 1.07 1.37 -0.28 1.87 0.00 -1.16 -0.11 119.26 122.03 1oqm h ALA 90 Ca 0.14 -0.11 -0.14 0.00 0.00 0.00 0.00 54.91 54.80 1oqm h ALA 90 Cb 0.06 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.59 1oqm h ALA 90 CO -0.02 0.51 -0.36 0.00 0.00 0.00 0.00 179.25 179.38 1oqm h ALA 92 N 0.68 1.35 -0.84 0.00 0.00 -0.32 -1.77 119.26 118.36 1oqm h ALA 92 Ca 0.03 -0.03 0.01 0.00 0.00 0.00 0.00 54.91 54.92 1oqm h ALA 92 Cb 0.94 -0.33 -0.04 0.00 0.00 0.00 0.00 17.79 18.36 1oqm h ALA 92 CO 0.08 0.49 0.55 0.87 0.00 0.00 0.00 179.25 181.25 1oqm h LYS 93 N 1.21 1.09 -0.34 0.00 1.57 -0.85 0.12 116.57 119.37 1oqm h LYS 93 Ca 0.41 -0.07 -0.12 0.00 -1.87 0.00 0.00 60.65 59.01 1oqm h LYS 93 Cb 0.08 -0.25 -0.01 0.00 0.08 0.00 0.00 32.23 32.13 1oqm h LYS 93 CO -0.15 0.72 -0.27 0.87 -0.57 0.00 0.00 179.45 180.06 1oqm h LYS 94 N 1.12 0.69 -0.53 3.15 1.57 -1.13 -1.16 116.57 120.28 1oqm h LYS 94 Ca 0.31 -0.29 -0.08 0.00 -1.87 0.00 0.00 60.65 58.72 1oqm h LYS 94 Cb -0.11 -0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.16 1oqm h LYS 94 CO -0.07 0.88 0.02 0.82 -0.57 0.00 0.00 179.45 180.53 1oqm h ILE 95 N 0.59 1.26 -0.84 1.86 2.04 -0.65 -1.63 117.51 120.15 1oqm h ILE 95 Ca 0.08 -1.07 -0.03 0.00 1.00 0.00 0.00 64.86 64.84 1oqm h ILE 95 Cb 0.76 0.91 -0.04 0.00 -0.74 0.00 0.00 36.82 37.71 1oqm h ILE 95 CO 0.06 0.38 0.40 -0.07 0.00 0.00 0.00 178.15 178.92 1oqm h LEU 96 N 0.79 1.10 -0.55 1.44 3.38 -0.60 0.35 115.31 121.22 1oqm h LEU 96 Ca 0.15 -0.14 -0.09 0.00 0.09 0.00 0.00 57.88 57.89 1oqm h LEU 96 Cb 0.50 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 1oqm h LEU 96 CO 0.02 0.93 -0.45 0.00 0.09 0.00 0.00 178.44 179.03 1oqm h ALA 97 N 1.21 0.84 0.00 1.53 0.00 -1.06 -2.76 119.26 119.02 1oqm h ALA 97 Ca 0.29 -0.41 -0.28 0.00 0.00 0.00 0.00 54.91 54.51 1oqm h ALA 97 Cb 0.13 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 17.80 1oqm h ALA 97 CO -0.04 0.56 -1.93 -0.89 0.00 0.00 0.00 179.25 176.95 1oqm n ILE 98 N -3.40 1.50 -0.10 0.00 5.41 -0.63 -4.81 119.36 117.35 1oqm n ILE 98 Ca 0.01 -0.18 -0.19 0.00 1.00 0.00 0.00 62.75 63.38 1oqm n ILE 98 Cb 0.61 -2.06 -0.12 0.00 -0.71 0.00 0.00 39.64 37.36 1oqm n ILE 98 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 176.55 177.72 1oqm n LYS 99 N -4.32 0.67 0.00 0.38 3.00 0.94 -5.09 118.16 113.75 1oqm n LYS 99 Ca -0.38 0.19 0.00 0.00 -0.00 0.00 0.00 58.31 58.11 1oqm n LYS 99 Cb 0.74 -1.57 0.00 0.00 0.00 0.00 0.00 35.03 34.20 1oqm n LYS 99 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1oqm n GLY 100 N 2.15 0.98 0.37 3.14 0.00 0.51 -4.66 105.19 107.68 1oqm n GLY 100 Ca -0.43 -2.05 0.19 0.00 0.00 0.00 0.00 46.02 43.73 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 0.46 0.00 -0.61 6.09 -1.86 -2.13 117.51 119.46 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 0.73 0.00 0.00 0.47 0.00 0.00 36.82 38.02 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 -3.85 0.00 -0.32 2.19 10.43 -1.26 -1.30 116.55 122.44 1oqm n ASP 102 Ca 0.06 0.49 0.08 0.00 2.57 0.00 0.00 54.79 57.99 1oqm n ASP 102 Cb 0.51 -0.50 0.28 0.00 1.84 0.00 0.00 41.12 43.26 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 1.03 -2.67 1.24 3.20 -1.68 -3.32 116.97 114.78 1oqm h TYR 103 Ca 0.00 0.03 -0.59 0.00 3.14 0.00 0.00 58.73 61.31 1oqm h TYR 103 Cb 0.20 -0.33 -0.11 0.00 1.54 0.00 0.00 36.73 38.03 1oqm h TYR 103 CO 0.00 0.43 0.76 -1.58 -1.64 0.00 0.00 178.16 176.14 1oqm s TRP 104 N -5.86 2.54 0.58 -3.82 0.51 -0.42 -4.90 118.94 107.57 1oqm s TRP 104 Ca -0.11 -0.22 0.40 0.00 -2.12 0.00 0.00 56.10 54.05 1oqm s TRP 104 Cb 0.22 -4.40 2.18 0.00 -0.81 0.00 0.00 33.47 30.65 1oqm s TRP 104 CO 0.80 -1.76 2.30 0.87 -0.51 0.00 0.00 176.95 178.65 1oqm h LYS 105 N 9.70 0.00 0.00 4.98 1.57 -1.84 -2.41 116.57 128.57 1oqm h LYS 105 Ca -0.28 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.44 1oqm h LYS 105 Cb 1.06 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.36 1oqm h LYS 105 CO 1.20 0.01 -0.30 0.00 -0.57 0.00 0.00 179.45 179.79 1oqm h ALA 106 N 1.99 0.86 0.11 3.86 0.00 -1.91 -3.39 119.26 120.78 1oqm h ALA 106 Ca -0.00 -0.28 0.01 0.00 0.00 0.00 0.00 54.91 54.65 1oqm h ALA 106 Cb 0.08 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 17.77 1oqm h ALA 106 CO 0.00 0.38 -0.53 -0.92 0.00 0.00 0.00 179.25 178.18 1oqm h TYR 107 N 0.00 -1.54 0.48 0.00 3.20 -1.76 -0.45 116.97 116.90 1oqm h TYR 107 Ca -0.00 0.04 -0.02 0.00 3.14 0.00 0.00 58.73 61.89 1oqm h TYR 107 Cb 1.07 0.66 0.00 0.00 1.54 0.00 0.00 36.73 40.00 1oqm h TYR 107 CO 0.00 -0.60 -0.23 -0.22 -1.64 0.00 0.00 178.16 175.47 1oqm h LYS 108 N -0.75 -0.62 -0.37 1.82 3.64 -1.80 -1.01 116.57 117.48 1oqm h LYS 108 Ca -0.00 0.04 -0.12 0.00 -1.27 0.00 0.00 60.65 59.30 1oqm h LYS 108 Cb 0.76 0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 32.71 1oqm h LYS 108 CO -0.30 -0.35 -0.24 -1.00 -2.27 0.00 0.00 179.45 175.28 1oqm h PRO 109 N -0.78 0.74 0.00 1.90 0.13 -1.78 -3.32 132.00 128.89 1oqm h PRO 109 Ca -0.07 -0.31 -0.03 0.00 -0.87 0.00 0.00 66.00 64.73 1oqm h PRO 109 Cb 0.56 -0.03 -0.01 0.00 0.13 0.00 0.00 31.00 31.65 1oqm h PRO 109 CO 0.11 0.91 -1.81 -1.33 -0.23 0.00 0.00 178.00 175.66 1oqm n MET 110 N -4.10 0.65 -1.59 0.86 2.81 -0.18 -4.63 117.12 110.94 1oqm n MET 110 Ca -0.00 -0.11 -0.04 0.00 -1.81 0.00 0.00 57.70 55.74 1oqm n MET 110 Cb 0.44 -1.59 0.09 0.00 -0.71 0.00 0.00 33.22 31.45 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 -0.59 2.42 -3.60 0.00 7.64 -1.24 -4.90 113.62 113.35 1oqm n SER 112 Ca 0.22 -1.82 -0.05 0.00 1.01 0.00 0.00 58.87 58.23 1oqm n SER 112 Cb 0.88 -0.13 -0.00 0.00 -1.01 0.00 0.00 64.21 63.95 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 -1.74 1.49 -1.18 1.43 -1.05 -1.26 -5.01 118.70 111.37 1oqm s GLU 113 Ca 0.34 -0.87 -0.16 0.00 -0.15 0.00 0.00 54.97 54.13 1oqm s GLU 113 Cb 0.20 0.48 -0.01 0.00 -0.44 0.00 0.00 34.13 34.35 1oqm s GLU 113 CO 0.29 -0.69 0.74 1.63 0.95 0.00 0.00 175.26 178.19 1oqm n LYS 114 N -0.52 -1.85 0.08 -4.83 5.02 -1.26 -4.90 118.16 109.89 1oqm n LYS 114 Ca -0.05 0.48 -0.00 0.00 -2.02 0.00 0.00 58.31 56.72 1oqm n LYS 114 Cb 0.60 -4.34 -0.05 0.00 -0.02 0.00 0.00 35.03 31.22 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 -1.85 0.00 -1.55 -0.35 3.38 -1.95 -3.36 115.31 109.63 1oqm h LEU 115 Ca -0.65 0.00 0.05 0.00 0.09 0.00 0.00 57.88 57.36 1oqm h LEU 115 Cb 1.36 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 42.08 1oqm h LEU 115 CO 0.51 0.61 0.36 -0.08 0.09 0.00 0.00 178.44 179.92 1oqm h GLU 116 N 0.00 0.55 0.00 1.13 4.57 -1.96 0.29 114.58 119.16 1oqm h GLU 116 Ca -0.09 -0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.06 1oqm h GLU 116 Cb 1.54 -0.12 0.00 0.00 -0.16 0.00 0.00 28.75 30.01 1oqm h GLU 116 CO 0.06 0.36 0.00 -0.56 -1.18 0.00 0.00 179.01 177.70 1oqm h GLN 117 N 0.57 0.00 -0.14 1.92 3.07 -1.98 -2.14 115.11 116.41 1oqm h GLN 117 Ca 0.23 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.97 1oqm h GLN 117 Cb 0.19 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.75 1oqm h GLN 117 CO -0.06 0.00 0.00 0.91 0.09 0.00 0.00 178.83 179.77 1oqm n TRP 118 N -3.04 0.17 -2.69 0.06 7.02 0.09 -4.89 117.44 114.17 1oqm n TRP 118 Ca -0.02 -0.09 -0.39 0.00 -1.02 0.00 0.00 57.50 55.99 1oqm n TRP 118 Cb 0.16 0.00 -0.06 0.00 -2.42 0.00 0.00 31.31 28.99 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 -1.83 4.64 -0.35 -0.99 3.52 -0.81 -4.79 118.95 118.34 1oqm s ARG 119 Ca 0.32 1.49 -0.29 0.00 -0.13 0.00 0.00 55.73 57.12 1oqm s ARG 119 Cb 0.17 -3.01 0.02 0.00 -1.56 0.00 0.00 34.95 30.57 1oqm s ARG 119 CO 0.26 0.30 1.16 0.00 -0.81 0.00 0.00 175.30 176.21 1oqm h GLU 121 N 8.71 0.28 -2.20 0.00 4.39 -1.96 -3.47 114.58 120.33 1oqm h GLU 121 Ca -0.23 -0.35 -0.32 0.00 0.34 0.00 0.00 59.36 58.81 1oqm h GLU 121 Cb 1.07 0.11 0.01 0.00 -0.10 0.00 0.00 28.75 29.84 1oqm h GLU 121 CO 1.06 1.08 0.23 1.17 -1.16 0.00 0.00 179.01 181.38 1oqm n LYS 122 N -3.63 0.00 0.00 2.33 0.00 -1.26 -5.23 118.16 110.36 1oqm n LYS 122 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.25 1oqm n LYS 122 Cb 0.88 -0.55 0.00 0.00 0.00 0.00 0.00 35.03 35.36 1oqm n LYS 122 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.40 175.10