#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ug7 s SER 2 N 0.00 -1.28 -0.00 1.61 1.04 -1.26 -5.15 113.70 108.66 1ug7 s SER 2 Ca 0.00 -0.63 0.04 0.00 0.48 0.00 0.00 55.95 55.84 1ug7 s SER 2 Cb 0.00 1.84 -0.01 0.00 0.10 0.00 0.00 66.02 67.95 1ug7 s SER 2 CO 0.00 -0.21 -0.13 -0.94 0.98 0.00 0.00 173.24 172.94 1ug7 s SER 3 N 2.04 1.51 0.11 7.02 1.04 -1.26 -5.15 113.70 119.01 1ug7 s SER 3 Ca 0.15 -0.26 0.03 0.00 0.48 0.00 0.00 55.95 56.34 1ug7 s SER 3 Cb -0.06 -0.16 -0.04 0.00 0.10 0.00 0.00 66.02 65.86 1ug7 s SER 3 CO -0.11 0.14 -0.08 -0.83 0.98 0.00 0.00 173.24 173.33 1ug7 s GLY 4 N -0.41 0.86 0.12 7.32 0.00 -1.26 -5.17 107.32 108.79 1ug7 s GLY 4 Ca 0.04 -1.35 0.05 0.00 0.00 0.00 0.00 44.72 43.46 1ug7 s GLY 4 CO -0.00 -1.45 -0.13 -0.45 0.00 0.00 0.00 173.10 171.07 1ug7 s SER 5 N -2.95 1.90 -0.11 1.64 0.15 -1.26 -5.15 113.70 107.92 1ug7 s SER 5 Ca 0.12 -0.85 -0.05 0.00 0.70 0.00 0.00 55.95 55.87 1ug7 s SER 5 Cb 0.03 -0.05 0.05 0.00 -1.71 0.00 0.00 66.02 64.33 1ug7 s SER 5 CO -0.02 -0.19 0.25 -0.55 1.20 0.00 0.00 173.24 173.92 1ug7 s SER 6 N -2.59 -0.24 0.00 5.45 0.15 -1.26 -4.57 113.70 110.64 1ug7 s SER 6 Ca 0.10 0.53 0.00 0.00 0.70 0.00 0.00 55.95 57.28 1ug7 s SER 6 Cb -0.03 0.42 0.00 0.00 -1.71 0.00 0.00 66.02 64.70 1ug7 s SER 6 CO 0.02 -0.17 0.00 0.61 1.20 0.00 0.00 173.24 174.90 1ug7 n GLY 7 N 4.27 3.08 3.34 9.45 0.00 0.27 -5.03 105.19 120.57 1ug7 n GLY 7 Ca -0.25 -1.63 -0.41 0.00 0.00 0.00 0.00 46.02 43.73 1ug7 n GLY 7 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 1ug7 n MET 8 N 0.29 0.18 -2.77 1.61 1.56 -1.25 -4.83 117.12 111.91 1ug7 n MET 8 Ca 0.00 0.07 -0.10 0.00 -0.27 0.00 0.00 57.70 57.40 1ug7 n MET 8 Cb 0.00 -1.20 0.08 0.00 2.15 0.00 0.00 33.22 34.26 1ug7 n MET 8 CO 0.00 0.00 0.00 -1.13 -0.73 0.00 0.00 175.97 174.11 1ug7 n SER 9 N 1.92 -1.93 0.00 6.12 3.41 -1.26 -5.01 113.62 116.87 1ug7 n SER 9 Ca 0.11 -3.46 0.00 0.00 -0.26 0.00 0.00 58.87 55.26 1ug7 n SER 9 Cb 0.43 1.54 0.00 0.00 -0.26 0.00 0.00 64.21 65.91 1ug7 n SER 9 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 1ug7 n GLU 10 N 0.22 0.00 -0.37 4.33 2.13 -1.26 -4.06 120.64 121.63 1ug7 n GLU 10 Ca 0.07 0.00 -0.02 0.00 0.66 0.00 0.00 57.16 57.87 1ug7 n GLU 10 Cb 0.72 0.00 0.03 0.00 0.27 0.00 0.00 31.44 32.46 1ug7 n GLU 10 CO 0.00 0.00 0.00 -0.39 -0.41 0.00 0.00 177.13 176.33 1ug7 h VAL 11 N 0.00 0.01 -0.43 6.31 -1.51 -1.99 0.83 116.25 119.47 1ug7 h VAL 11 Ca 0.00 0.00 -0.00 0.00 -1.23 0.00 0.00 66.70 65.47 1ug7 h VAL 11 Cb 0.00 0.01 -0.02 0.00 -2.13 0.00 0.00 31.29 29.15 1ug7 h VAL 11 CO 0.00 0.00 0.27 0.74 -1.23 0.00 0.00 177.57 177.35 1ug7 h THR 12 N -0.01 1.13 -0.39 7.19 2.02 -1.95 -0.78 112.91 120.11 1ug7 h THR 12 Ca 0.33 -0.28 0.08 0.00 0.77 0.00 0.00 66.41 67.31 1ug7 h THR 12 Cb 0.59 0.54 -0.08 0.00 -1.74 0.00 0.00 68.15 67.47 1ug7 h THR 12 CO -0.97 0.13 -0.11 -0.09 0.37 0.00 0.00 175.52 174.85 1ug7 h ARG 13 N 0.57 -0.02 -0.23 6.66 2.43 0.13 0.14 114.38 124.07 1ug7 h ARG 13 Ca 0.15 0.00 -0.04 0.00 -0.81 0.00 0.00 59.98 59.29 1ug7 h ARG 13 Cb -0.02 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.52 1ug7 h ARG 13 CO -0.03 -0.01 -0.03 1.03 -1.51 0.00 0.00 179.97 179.41 1ug7 h SER 14 N -0.02 0.32 -0.88 -3.80 0.87 0.02 -2.20 113.55 107.85 1ug7 h SER 14 Ca 0.19 -0.05 0.17 0.00 -1.23 0.00 0.00 61.79 60.87 1ug7 h SER 14 Cb 0.31 -0.08 -0.10 0.00 -0.44 0.00 0.00 62.40 62.09 1ug7 h SER 14 CO -0.42 0.40 0.44 0.25 -0.53 0.00 0.00 176.83 176.98 1ug7 h LEU 15 N 0.33 0.49 -1.95 2.23 6.46 0.79 1.20 115.31 124.86 1ug7 h LEU 15 Ca 0.07 0.11 0.06 0.00 -0.12 0.00 0.00 57.88 58.01 1ug7 h LEU 15 Cb 0.28 0.04 -0.01 0.00 -0.73 0.00 0.00 40.66 40.24 1ug7 h LEU 15 CO 0.01 0.16 0.40 -0.07 -0.62 0.00 0.00 178.44 178.32 1ug7 h LEU 16 N 0.57 0.00 0.00 2.25 3.38 -1.05 -0.32 115.31 120.14 1ug7 h LEU 16 Ca 0.51 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.48 1ug7 h LEU 16 Cb 0.81 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.56 1ug7 h LEU 16 CO -0.42 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.11 1ug7 n GLN 17 N -3.30 0.00 -0.29 1.13 1.13 0.41 -2.74 117.38 113.73 1ug7 n GLN 17 Ca 0.03 0.27 0.11 0.00 -1.94 0.00 0.00 57.00 55.46 1ug7 n GLN 17 Cb 0.51 -0.74 0.22 0.00 0.11 0.00 0.00 30.24 30.34 1ug7 n GLN 17 CO 0.00 0.00 0.00 2.89 -1.44 0.00 0.00 177.06 178.51 1ug7 n ARG 18 N -1.57 -0.07 0.10 -1.09 0.00 -0.99 0.18 116.66 113.23 1ug7 n ARG 18 Ca 0.00 1.25 -0.05 0.00 -0.00 0.00 0.00 57.85 59.06 1ug7 n ARG 18 Cb 0.00 -1.96 -0.02 0.00 -0.00 0.00 0.00 32.46 30.47 1ug7 n ARG 18 CO 0.00 0.00 0.00 -1.49 0.00 0.00 0.00 177.63 176.14 1ug7 h TRP 19 N 0.00 -0.32 -1.03 2.89 6.55 -1.23 -0.45 115.95 122.36 1ug7 h TRP 19 Ca 0.48 -0.00 0.27 0.00 0.95 0.00 0.00 58.89 60.58 1ug7 h TRP 19 Cb 0.94 0.12 -0.08 0.00 -0.86 0.00 0.00 29.16 29.27 1ug7 h TRP 19 CO -0.47 -0.18 0.68 0.78 -1.05 0.00 0.00 178.44 178.20 1ug7 h GLY 20 N -0.29 1.01 0.88 1.49 0.00 -0.19 0.38 103.07 106.34 1ug7 h GLY 20 Ca -0.02 -0.18 0.02 0.00 0.00 0.00 0.00 47.33 47.15 1ug7 h GLY 20 CO 0.02 -0.10 0.31 0.00 0.00 0.00 0.00 176.54 176.77 1ug7 h ALA 21 N 1.60 0.66 0.42 3.60 0.00 0.25 0.76 119.26 126.55 1ug7 h ALA 21 Ca 0.57 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.45 1ug7 h ALA 21 Cb 1.54 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 19.18 1ug7 h ALA 21 CO -0.24 0.01 -0.35 0.77 0.00 0.00 0.00 179.25 179.44 1ug7 h SER 22 N 0.61 -0.93 -0.32 0.00 0.02 0.14 -1.33 113.55 111.75 1ug7 h SER 22 Ca 0.21 0.07 0.05 0.00 -0.84 0.00 0.00 61.79 61.28 1ug7 h SER 22 Cb 0.02 0.29 -0.08 0.00 0.14 0.00 0.00 62.40 62.77 1ug7 h SER 22 CO -0.09 -0.48 -0.48 0.25 -1.14 0.00 0.00 176.83 174.88 1ug7 h LEU 23 N -0.75 -1.57 -0.94 5.07 5.85 -1.34 0.34 115.31 121.97 1ug7 h LEU 23 Ca -0.05 0.22 0.09 0.00 0.84 0.00 0.00 57.88 58.98 1ug7 h LEU 23 Cb 0.63 0.66 -0.12 0.00 0.37 0.00 0.00 40.66 42.19 1ug7 h LEU 23 CO -0.00 -0.41 -0.53 0.54 -0.34 0.00 0.00 178.44 177.70 1ug7 n ARG 24 N -5.41 -0.39 -0.09 1.25 1.74 0.25 0.36 116.66 114.37 1ug7 n ARG 24 Ca -0.03 1.43 -0.08 0.00 -0.77 0.00 0.00 57.85 58.40 1ug7 n ARG 24 Cb 0.36 -2.10 -0.00 0.00 -1.02 0.00 0.00 32.46 29.69 1ug7 n ARG 24 CO 0.00 0.00 0.00 -0.09 -1.52 0.00 0.00 177.63 176.02 1ug7 h ARG 25 N 0.00 0.29 -1.08 5.56 2.43 -0.07 -1.14 114.38 120.37 1ug7 h ARG 25 Ca 0.18 -0.02 0.29 0.00 -0.81 0.00 0.00 59.98 59.62 1ug7 h ARG 25 Cb 0.41 -0.07 -0.08 0.00 -0.42 0.00 0.00 29.97 29.82 1ug7 h ARG 25 CO -0.89 0.19 0.73 0.78 -1.51 0.00 0.00 179.97 179.27 1ug7 h GLY 26 N 0.30 0.79 0.99 2.80 0.00 0.39 0.45 103.07 108.78 1ug7 h GLY 26 Ca 0.13 -0.13 -0.23 0.00 0.00 0.00 0.00 47.33 47.10 1ug7 h GLY 26 CO -0.10 -0.10 -0.95 0.00 0.00 0.00 0.00 176.54 175.39 1ug7 h ALA 27 N 1.55 0.02 -0.50 3.60 0.00 0.36 -2.69 119.26 121.60 1ug7 h ALA 27 Ca 0.58 -0.69 0.09 0.00 0.00 0.00 0.00 54.91 54.89 1ug7 h ALA 27 Cb 1.78 0.08 -0.07 0.00 0.00 0.00 0.00 17.79 19.58 1ug7 h ALA 27 CO -0.20 0.52 0.09 -0.44 0.00 0.00 0.00 179.25 179.22 1ug7 h ASP 28 N 0.05 -0.02 0.48 0.00 5.19 0.90 0.23 116.42 123.25 1ug7 h ASP 28 Ca -0.14 0.09 -0.02 0.00 -0.62 0.00 0.00 57.03 56.34 1ug7 h ASP 28 Cb 1.66 0.13 0.00 0.00 0.18 0.00 0.00 39.33 41.30 1ug7 h ASP 28 CO 0.18 0.02 -0.23 -0.26 -3.12 0.00 0.00 179.24 175.83 1ug7 h PHE 29 N 0.22 -0.60 -0.09 4.55 0.04 -1.03 -2.40 116.94 117.64 1ug7 h PHE 29 Ca 0.25 -0.01 0.03 0.00 2.80 0.00 0.00 57.97 61.04 1ug7 h PHE 29 Cb 0.34 0.20 -0.06 0.00 2.20 0.00 0.00 35.95 38.63 1ug7 h PHE 29 CO -0.24 -0.35 -0.48 0.22 -0.60 0.00 0.00 178.31 176.87 1ug7 h ASP 30 N -0.69 -1.50 -0.47 2.17 1.82 -1.07 0.75 116.42 117.42 1ug7 h ASP 30 Ca -0.07 0.18 0.04 0.00 -0.39 0.00 0.00 57.03 56.80 1ug7 h ASP 30 Cb 0.52 0.59 -0.06 0.00 0.68 0.00 0.00 39.33 41.06 1ug7 h ASP 30 CO 0.11 -0.47 -0.29 0.28 -1.61 0.00 0.00 179.24 177.26 1ug7 h SER 31 N -0.57 -1.05 0.12 2.28 0.02 -0.51 -1.78 113.55 112.07 1ug7 h SER 31 Ca 0.05 0.16 -0.00 0.00 -0.84 0.00 0.00 61.79 61.16 1ug7 h SER 31 Cb 0.67 0.46 -0.01 0.00 0.14 0.00 0.00 62.40 63.66 1ug7 h SER 31 CO -0.39 -0.12 -0.20 -0.50 -1.14 0.00 0.00 176.83 174.48 1ug7 h TRP 32 N -0.01 -0.57 0.00 3.45 6.55 -0.94 -3.46 115.95 120.96 1ug7 h TRP 32 Ca 0.08 0.01 0.00 0.00 0.95 0.00 0.00 58.89 59.93 1ug7 h TRP 32 Cb 0.20 0.23 0.00 0.00 -0.86 0.00 0.00 29.16 28.74 1ug7 h TRP 32 CO -0.97 -0.25 0.00 0.41 -1.05 0.00 0.00 178.44 176.58 1ug7 n GLY 33 N -1.20 0.00 2.66 1.49 0.00 0.21 -5.09 105.19 103.26 1ug7 n GLY 33 Ca -0.04 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.67 1ug7 n GLY 33 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1ug7 n GLN 34 N 0.00 3.27 0.18 1.61 1.13 0.14 -4.90 117.38 118.81 1ug7 n GLN 34 Ca 0.00 -4.70 -0.15 0.00 -1.94 0.00 0.00 57.00 50.21 1ug7 n GLN 34 Cb 0.00 -2.32 -0.09 0.00 0.11 0.00 0.00 30.24 27.95 1ug7 n GLN 34 CO 0.00 0.00 0.00 -0.07 -1.44 0.00 0.00 177.06 175.55 1ug7 h LEU 35 N 4.11 -1.32 0.00 1.08 3.38 -1.89 1.01 115.31 121.69 1ug7 h LEU 35 Ca 0.21 0.12 0.00 0.00 0.09 0.00 0.00 57.88 58.30 1ug7 h LEU 35 Cb 0.59 0.46 0.00 0.00 0.09 0.00 0.00 40.66 41.80 1ug7 h LEU 35 CO 0.95 -0.54 0.00 0.55 0.09 0.00 0.00 178.44 179.49 1ug7 n VAL 36 N -5.12 0.00 -0.25 1.22 3.14 -1.26 0.16 118.33 116.22 1ug7 n VAL 36 Ca -0.09 1.42 0.06 0.00 -2.96 0.00 0.00 64.34 62.77 1ug7 n VAL 36 Cb 0.38 -1.94 0.18 0.00 -1.06 0.00 0.00 33.84 31.41 1ug7 n VAL 36 CO 0.00 0.00 0.00 -0.33 -6.46 0.00 0.00 176.83 170.04 1ug7 h GLU 37 N 0.00 0.21 0.17 1.45 5.08 -1.95 -0.94 114.58 118.61 1ug7 h GLU 37 Ca 0.00 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1ug7 h GLU 37 Cb 0.00 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.18 1ug7 h GLU 37 CO 0.00 0.14 -0.31 0.00 -1.00 0.00 0.00 179.01 177.84 1ug7 h ALA 38 N 1.64 -0.89 -0.92 3.43 0.00 0.40 -0.68 119.26 122.24 1ug7 h ALA 38 Ca 0.42 -0.09 0.14 0.00 0.00 0.00 0.00 54.91 55.38 1ug7 h ALA 38 Cb 0.74 0.64 -0.15 0.00 0.00 0.00 0.00 17.79 19.02 1ug7 h ALA 38 CO -0.56 -0.94 -0.39 0.82 0.00 0.00 0.00 179.25 178.18 1ug7 h ILE 39 N -0.51 0.03 -0.58 0.00 2.04 0.25 0.56 117.51 119.30 1ug7 h ILE 39 Ca -0.02 0.00 0.10 0.00 1.00 0.00 0.00 64.86 65.94 1ug7 h ILE 39 Cb 0.48 0.03 -0.11 0.00 -0.74 0.00 0.00 36.82 36.48 1ug7 h ILE 39 CO -0.11 0.00 -0.35 -0.78 0.00 0.00 0.00 178.15 176.91 1ug7 h ASP 40 N -0.04 -1.21 0.01 1.72 3.58 -0.63 0.36 116.42 120.21 1ug7 h ASP 40 Ca 0.31 0.23 0.00 0.00 0.42 0.00 0.00 57.03 57.99 1ug7 h ASP 40 Cb 0.58 0.59 -0.00 0.00 1.72 0.00 0.00 39.33 42.21 1ug7 h ASP 40 CO -0.93 -0.31 -0.03 -0.08 -2.88 0.00 0.00 179.24 175.01 1ug7 h GLU 41 N -0.18 -0.04 -0.23 0.28 4.57 0.16 0.12 114.58 119.26 1ug7 h GLU 41 Ca 0.22 0.00 0.02 0.00 -1.18 0.00 0.00 59.36 58.43 1ug7 h GLU 41 Cb 0.55 0.01 -0.04 0.00 -0.16 0.00 0.00 28.75 29.12 1ug7 h GLU 41 CO -0.67 -0.03 -0.21 1.88 -1.18 0.00 0.00 179.01 178.79 1ug7 h TYR 42 N -0.05 -0.67 -0.47 0.92 0.05 -0.64 0.43 116.97 116.55 1ug7 h TYR 42 Ca -0.00 0.04 0.04 0.00 0.05 0.00 0.00 58.73 58.86 1ug7 h TYR 42 Cb 0.05 0.32 -0.06 0.00 1.01 0.00 0.00 36.73 38.05 1ug7 h TYR 42 CO -0.32 -0.17 -0.28 1.04 -1.05 0.00 0.00 178.16 177.38 1ug7 n GLN 43 N -3.75 -0.21 -0.35 4.88 6.02 0.12 0.16 117.38 124.26 1ug7 n GLN 43 Ca -0.01 1.23 -0.07 0.00 -0.01 0.00 0.00 57.00 58.14 1ug7 n GLN 43 Cb 0.12 -1.82 -0.03 0.00 1.02 0.00 0.00 30.24 29.53 1ug7 n GLN 43 CO 0.00 0.00 0.00 0.82 -1.01 0.00 0.00 177.06 176.87 1ug7 h ILE 44 N 0.00 0.02 -0.98 5.09 5.03 -0.17 1.44 117.51 127.94 1ug7 h ILE 44 Ca 0.08 0.00 0.08 0.00 -0.12 0.00 0.00 64.86 64.90 1ug7 h ILE 44 Cb 0.19 0.02 -0.07 0.00 -3.03 0.00 0.00 36.82 33.93 1ug7 h ILE 44 CO -0.44 0.00 0.62 0.25 -0.68 0.00 0.00 178.15 177.90 1ug7 h LEU 45 N -0.07 0.97 -0.10 1.44 5.85 0.15 0.68 115.31 124.23 1ug7 h LEU 45 Ca 0.23 0.02 0.02 0.00 0.84 0.00 0.00 57.88 59.00 1ug7 h LEU 45 Cb 0.52 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 41.36 1ug7 h LEU 45 CO -0.89 0.58 -0.03 0.00 -0.34 0.00 0.00 178.44 177.77 1ug7 h ALA 46 N 1.48 0.06 -0.20 1.25 0.00 1.15 0.12 119.26 123.11 1ug7 h ALA 46 Ca 0.45 0.04 0.02 0.00 0.00 0.00 0.00 54.91 55.41 1ug7 h ALA 46 Cb 0.28 0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 1ug7 h ALA 46 CO -0.21 -0.49 0.08 0.00 0.00 0.00 0.00 179.25 178.63 1ug7 h ARG 47 N -0.01 0.18 -0.10 0.00 3.08 0.13 -2.64 114.38 115.02 1ug7 h ARG 47 Ca 0.05 -0.01 0.04 0.00 0.07 0.00 0.00 59.98 60.13 1ug7 h ARG 47 Cb 0.08 -0.04 -0.05 0.00 0.08 0.00 0.00 29.97 30.04 1ug7 h ARG 47 CO -0.11 0.12 -0.23 0.45 -1.07 0.00 0.00 179.97 179.13 1ug7 h HIS 48 N 0.19 -0.61 -0.91 3.04 3.86 -0.48 -0.85 115.15 119.38 1ug7 h HIS 48 Ca 0.09 0.03 0.22 0.00 -1.16 0.00 0.00 60.37 59.54 1ug7 h HIS 48 Cb 0.04 0.29 -0.17 0.00 1.06 0.00 0.00 27.41 28.63 1ug7 h HIS 48 CO -0.11 -0.31 -0.07 -0.07 0.86 0.00 0.00 177.93 178.23 1ug7 h LEU 49 N -0.31 -0.58 -0.30 2.43 3.38 -0.44 0.79 115.31 120.28 1ug7 h LEU 49 Ca 0.09 0.26 0.03 0.00 0.09 0.00 0.00 57.88 58.35 1ug7 h LEU 49 Cb 0.44 0.48 -0.03 0.00 0.09 0.00 0.00 40.66 41.65 1ug7 h LEU 49 CO -0.28 -0.29 0.13 1.56 0.09 0.00 0.00 178.44 179.65 1ug7 h GLN 50 N 0.03 0.27 -1.80 1.13 4.20 -0.86 0.16 115.11 118.25 1ug7 h GLN 50 Ca 0.50 -0.02 0.55 0.00 0.06 0.00 0.00 58.65 59.74 1ug7 h GLN 50 Cb 0.91 -0.06 -0.10 0.00 0.30 0.00 0.00 27.48 28.53 1ug7 h GLN 50 CO -0.87 0.18 1.26 -0.22 -0.67 0.00 0.00 178.83 178.51 1ug7 h LYS 51 N 0.28 0.00 0.03 1.46 1.63 0.14 1.73 116.57 121.84 1ug7 h LYS 51 Ca 0.13 -0.00 -0.36 0.00 -0.85 0.00 0.00 60.65 59.57 1ug7 h LYS 51 Cb 0.07 -0.00 -0.05 0.00 -0.60 0.00 0.00 32.23 31.65 1ug7 h LYS 51 CO -0.11 0.00 -2.21 0.39 -3.45 0.00 0.00 179.45 174.07 1ug7 n GLU 52 N -4.18 0.68 0.11 1.90 -0.58 -0.38 -3.02 120.64 115.18 1ug7 n GLU 52 Ca 0.43 0.17 -0.05 0.00 -0.42 0.00 0.00 57.16 57.29 1ug7 n GLU 52 Cb 1.88 -1.61 -0.02 0.00 -0.57 0.00 0.00 31.44 31.12 1ug7 n GLU 52 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1ug7 h ALA 53 N 0.42 -0.64 0.00 0.62 0.00 0.48 -3.19 119.26 116.94 1ug7 h ALA 53 Ca -0.48 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.35 1ug7 h ALA 53 Cb 2.04 0.12 -0.00 0.00 0.00 0.00 0.00 17.79 19.94 1ug7 h ALA 53 CO 0.01 -0.62 -0.04 -0.56 0.00 0.00 0.00 179.25 178.04 1ug7 h GLN 54 N -0.47 0.00 -6.49 0.00 3.07 0.12 -3.47 115.11 107.88 1ug7 h GLN 54 Ca -0.03 0.00 -0.39 0.00 0.09 0.00 0.00 58.65 58.32 1ug7 h GLN 54 Cb 0.23 0.00 0.01 0.00 0.08 0.00 0.00 27.48 27.80 1ug7 h GLN 54 CO 0.05 0.04 -1.03 0.00 0.09 0.00 0.00 178.83 177.98 1ug7 n ALA 55 N -2.18 -2.60 -1.51 0.06 0.00 -1.12 -4.44 120.51 108.72 1ug7 n ALA 55 Ca -0.02 0.08 -0.31 0.00 0.00 0.00 0.00 53.44 53.19 1ug7 n ALA 55 Cb 0.17 -1.56 -0.16 0.00 0.00 0.00 0.00 19.45 17.90 1ug7 n ALA 55 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1ug7 n GLN 56 N -1.45 0.18 -2.77 0.00 6.02 -1.25 0.11 117.38 118.22 1ug7 n GLN 56 Ca -0.18 -0.09 -0.11 0.00 -0.01 0.00 0.00 57.00 56.61 1ug7 n GLN 56 Cb 0.66 -1.78 0.05 0.00 1.02 0.00 0.00 30.24 30.19 1ug7 n GLN 56 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.06 176.77 1ug7 n HIS 57 N 10.23 -1.76 -3.08 1.08 8.25 -1.26 -4.24 115.22 124.45 1ug7 n HIS 57 Ca 0.61 0.62 -0.02 0.00 -0.26 0.00 0.00 57.72 58.67 1ug7 n HIS 57 Cb 0.17 -3.70 0.00 0.00 1.12 0.00 0.00 29.99 27.59 1ug7 n HIS 57 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 1ug7 n ASN 58 N -2.73 -6.92 -3.34 0.41 5.15 0.12 -5.00 115.26 102.96 1ug7 n ASN 58 Ca -0.06 0.64 -0.13 0.00 -0.60 0.00 0.00 54.58 54.43 1ug7 n ASN 58 Cb 0.59 -2.63 -0.07 0.00 -0.53 0.00 0.00 39.78 37.14 1ug7 n ASN 58 CO 0.00 0.00 0.00 0.21 1.40 0.00 0.00 177.26 178.87 1ug7 s ASN 59 N -1.22 0.78 0.00 1.20 2.47 -1.23 -5.08 114.94 111.86 1ug7 s ASN 59 Ca 0.03 -0.91 0.00 0.00 0.42 0.00 0.00 52.86 52.40 1ug7 s ASN 59 Cb -0.00 0.86 0.00 0.00 -1.45 0.00 0.00 41.25 40.65 1ug7 s ASN 59 CO 0.27 -0.31 0.00 -1.54 -3.72 0.00 0.00 177.10 171.79 1ug7 n SER 60 N 4.89 0.00 -0.71 -4.21 3.41 -1.26 -4.52 113.62 111.22 1ug7 n SER 60 Ca 0.05 0.00 0.12 0.00 -0.26 0.00 0.00 58.87 58.78 1ug7 n SER 60 Cb 0.48 0.00 0.18 0.00 -0.26 0.00 0.00 64.21 64.61 1ug7 n SER 60 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1ug7 n GLU 61 N -0.21 1.85 -2.50 4.33 4.71 -1.26 -4.75 120.64 122.81 1ug7 n GLU 61 Ca 0.00 -1.43 -0.23 0.00 -0.01 0.00 0.00 57.16 55.49 1ug7 n GLU 61 Cb 0.00 -1.47 0.05 0.00 -1.01 0.00 0.00 31.44 29.01 1ug7 n GLU 61 CO 0.00 0.00 0.00 -0.06 0.09 0.00 0.00 177.13 177.16 1ug7 s PHE 62 N -2.14 2.90 0.35 -0.32 0.08 -1.26 0.95 117.98 118.55 1ug7 s PHE 62 Ca 0.28 0.17 0.05 0.00 0.12 0.00 0.00 56.93 57.54 1ug7 s PHE 62 Cb 0.20 -2.88 -0.01 0.00 -0.57 0.00 0.00 43.02 39.76 1ug7 s PHE 62 CO 0.38 -1.03 0.51 -0.08 -0.10 0.00 0.00 175.22 174.90 1ug7 s THR 63 N -2.92 4.21 0.19 0.64 -1.32 -1.26 -4.75 115.64 110.42 1ug7 s THR 63 Ca 0.58 -0.86 -0.24 0.00 -1.21 0.00 0.00 61.69 59.96 1ug7 s THR 63 Cb -0.10 -3.49 0.09 0.00 -1.51 0.00 0.00 72.50 67.49 1ug7 s THR 63 CO 0.41 -0.23 1.56 -0.33 -2.21 0.00 0.00 174.62 173.82 1ug7 h GLU 64 N 0.80 -0.09 -0.44 7.08 5.08 -1.99 0.24 114.58 125.26 1ug7 h GLU 64 Ca -0.47 0.01 0.05 0.00 -1.00 0.00 0.00 59.36 57.95 1ug7 h GLU 64 Cb 1.25 0.02 -0.08 0.00 0.50 0.00 0.00 28.75 30.45 1ug7 h GLU 64 CO 0.55 -0.06 -0.49 0.93 -1.00 0.00 0.00 179.01 178.94 1ug7 h GLU 65 N -0.09 -0.28 -0.06 2.33 5.08 -1.99 0.77 114.58 120.34 1ug7 h GLU 65 Ca 0.24 0.02 0.04 0.00 -1.00 0.00 0.00 59.36 58.66 1ug7 h GLU 65 Cb 0.54 0.06 -0.06 0.00 0.50 0.00 0.00 28.75 29.80 1ug7 h GLU 65 CO -0.85 -0.18 -0.39 1.96 -1.00 0.00 0.00 179.01 178.54 1ug7 h GLN 66 N -0.29 -0.49 -0.42 2.33 7.50 -1.38 -1.68 115.11 120.69 1ug7 h GLN 66 Ca 0.08 0.03 0.08 0.00 0.50 0.00 0.00 58.65 59.34 1ug7 h GLN 66 Cb 0.49 0.11 -0.09 0.00 0.05 0.00 0.00 27.48 28.04 1ug7 h GLN 66 CO -0.57 -0.33 -0.34 0.87 -1.50 0.00 0.00 178.83 176.97 1ug7 h LYS 67 N -0.51 -0.24 -0.60 1.46 1.57 0.45 0.68 116.57 119.38 1ug7 h LYS 67 Ca 0.07 0.02 0.06 0.00 -1.87 0.00 0.00 60.65 58.92 1ug7 h LYS 67 Cb 0.62 0.06 -0.08 0.00 0.08 0.00 0.00 32.23 32.90 1ug7 h LYS 67 CO -0.34 -0.16 -0.44 0.87 -0.57 0.00 0.00 179.45 178.81 1ug7 h LYS 68 N -0.25 -0.10 0.25 3.15 1.79 0.13 0.29 116.57 121.84 1ug7 h LYS 68 Ca 0.17 0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.65 1ug7 h LYS 68 Cb 0.55 0.02 -0.02 0.00 -1.58 0.00 0.00 32.23 31.20 1ug7 h LYS 68 CO -0.55 -0.06 -0.27 1.15 -1.08 0.00 0.00 179.45 178.63 1ug7 h THR 69 N -0.10 0.42 -0.98 -0.16 2.02 -0.41 0.35 112.91 114.05 1ug7 h THR 69 Ca 0.10 0.00 0.32 0.00 0.77 0.00 0.00 66.41 67.60 1ug7 h THR 69 Cb 0.36 0.42 -0.18 0.00 -1.74 0.00 0.00 68.15 67.01 1ug7 h THR 69 CO -0.62 0.00 0.22 -0.38 0.37 0.00 0.00 175.52 175.10 1ug7 n ILE 70 N -5.39 -0.41 -0.05 3.11 5.41 0.23 0.15 119.36 122.40 1ug7 n ILE 70 Ca -0.08 2.09 -0.15 0.00 1.00 0.00 0.00 62.75 65.61 1ug7 n ILE 70 Cb 0.30 -3.18 -0.07 0.00 -0.71 0.00 0.00 39.64 35.98 1ug7 n ILE 70 CO 0.00 0.00 0.00 1.23 0.00 0.00 0.00 176.55 177.78 1ug7 h GLY 71 N 0.00 0.60 1.43 7.39 0.00 0.40 -2.96 103.07 109.93 1ug7 h GLY 71 Ca 0.69 -0.74 0.06 0.00 0.00 0.00 0.00 47.33 47.34 1ug7 h GLY 71 CO -0.86 0.66 0.24 0.50 0.00 0.00 0.00 176.54 177.09 1ug7 h LYS 72 N 0.19 0.21 0.04 4.80 1.57 0.35 -1.10 116.57 122.63 1ug7 h LYS 72 Ca -0.00 -0.01 -0.00 0.00 -1.87 0.00 0.00 60.65 58.76 1ug7 h LYS 72 Cb 1.00 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 33.26 1ug7 h LYS 72 CO 0.08 0.14 -0.02 0.82 -0.57 0.00 0.00 179.45 179.90 1ug7 h ILE 73 N 0.21 1.10 -0.54 1.86 2.04 0.32 -2.74 117.51 119.76 1ug7 h ILE 73 Ca 0.16 -0.48 0.08 0.00 1.00 0.00 0.00 64.86 65.62 1ug7 h ILE 73 Cb 0.36 1.42 -0.06 0.00 -0.74 0.00 0.00 36.82 37.80 1ug7 h ILE 73 CO -0.03 0.12 0.19 0.00 0.00 0.00 0.00 178.15 178.44 1ug7 h ALA 74 N 0.68 0.67 -0.60 1.87 0.00 -1.09 -1.66 119.26 119.13 1ug7 h ALA 74 Ca -0.01 0.07 0.11 0.00 0.00 0.00 0.00 54.91 55.09 1ug7 h ALA 74 Cb 0.24 0.05 -0.12 0.00 0.00 0.00 0.00 17.79 17.97 1ug7 h ALA 74 CO 0.01 -0.21 -0.28 1.15 0.00 0.00 0.00 179.25 179.92 1ug7 h THR 75 N 0.37 0.23 -0.20 0.00 2.02 -1.08 0.20 112.91 114.45 1ug7 h THR 75 Ca 0.27 0.00 0.05 0.00 0.77 0.00 0.00 66.41 67.50 1ug7 h THR 75 Cb 0.30 0.23 -0.05 0.00 -1.74 0.00 0.00 68.15 66.89 1ug7 h THR 75 CO -0.27 0.00 -0.13 0.00 0.37 0.00 0.00 175.52 175.48 1ug7 h LEU 77 N -0.13 -1.76 -1.95 0.00 3.38 -0.09 1.10 115.31 115.87 1ug7 h LEU 77 Ca 0.12 0.24 0.47 0.00 0.09 0.00 0.00 57.88 58.80 1ug7 h LEU 77 Cb 0.30 0.74 -0.06 0.00 0.09 0.00 0.00 40.66 41.73 1ug7 h LEU 77 CO -0.28 -0.38 1.19 -0.33 0.09 0.00 0.00 178.44 178.72 1ug7 h GLU 78 N -0.35 0.00 0.00 1.13 5.08 -0.29 0.57 114.58 120.73 1ug7 h GLU 78 Ca 0.10 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.45 1ug7 h GLU 78 Cb 0.58 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.83 1ug7 h GLU 78 CO -0.62 0.00 -0.08 -0.07 -1.00 0.00 0.00 179.01 177.24 1ug7 h LEU 79 N 0.00 0.00 0.14 1.33 3.38 0.14 -2.76 115.31 117.55 1ug7 h LEU 79 Ca 0.77 -0.56 0.01 0.00 0.09 0.00 0.00 57.88 58.19 1ug7 h LEU 79 Cb 3.14 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 43.84 1ug7 h LEU 79 CO -0.01 0.83 -0.48 -0.09 0.09 0.00 0.00 178.44 178.78 1ug7 h ARG 80 N -1.00 -0.70 -0.38 1.13 9.65 0.29 1.47 114.38 124.84 1ug7 h ARG 80 Ca -0.02 0.05 0.08 0.00 -1.10 0.00 0.00 59.98 58.99 1ug7 h ARG 80 Cb 0.62 0.16 -0.08 0.00 -1.39 0.00 0.00 29.97 29.28 1ug7 h ARG 80 CO -0.01 -0.46 -0.14 0.77 2.80 0.00 0.00 179.97 182.92 1ug7 h SER 81 N -0.72 -0.50 -0.22 -3.80 0.02 -0.44 -0.77 113.55 107.11 1ug7 h SER 81 Ca 0.01 0.13 0.01 0.00 -0.84 0.00 0.00 61.79 61.10 1ug7 h SER 81 Cb 0.73 0.29 -0.02 0.00 0.14 0.00 0.00 62.40 63.55 1ug7 h SER 81 CO -0.26 -0.18 0.11 0.00 -1.14 0.00 0.00 176.83 175.36 1ug7 h ALA 82 N 1.26 0.26 -0.79 3.77 0.00 -1.08 -2.25 119.26 120.44 1ug7 h ALA 82 Ca 0.19 0.01 0.15 0.00 0.00 0.00 0.00 54.91 55.26 1ug7 h ALA 82 Cb 0.35 -0.03 -0.15 0.00 0.00 0.00 0.00 17.79 17.97 1ug7 h ALA 82 CO -0.43 -0.30 -0.25 0.00 0.00 0.00 0.00 179.25 178.27 1ug7 h ALA 83 N 1.12 0.39 -0.40 0.00 0.00 0.34 0.81 119.26 121.51 1ug7 h ALA 83 Ca 0.09 0.28 0.07 0.00 0.00 0.00 0.00 54.91 55.36 1ug7 h ALA 83 Cb 0.03 0.69 -0.06 0.00 0.00 0.00 0.00 17.79 18.44 1ug7 h ALA 83 CO -0.07 -0.48 0.01 -0.07 0.00 0.00 0.00 179.25 178.64 1ug7 h LEU 84 N -0.03 -0.15 -0.96 0.00 3.38 -0.69 -0.47 115.31 116.39 1ug7 h LEU 84 Ca 0.36 0.09 0.00 0.00 0.09 0.00 0.00 57.88 58.42 1ug7 h LEU 84 Cb 0.58 0.16 -0.05 0.00 0.09 0.00 0.00 40.66 41.45 1ug7 h LEU 84 CO -0.82 -0.04 0.61 1.56 0.09 0.00 0.00 178.44 179.84 1ug7 h GLN 85 N 0.11 1.28 -6.56 1.13 4.20 0.60 -3.44 115.11 112.44 1ug7 h GLN 85 Ca 0.20 -0.09 -0.54 0.00 0.06 0.00 0.00 58.65 58.28 1ug7 h GLN 85 Cb 0.28 -0.28 0.22 0.00 0.30 0.00 0.00 27.48 28.00 1ug7 h GLN 85 CO -0.33 0.86 -0.95 -1.13 -0.67 0.00 0.00 178.83 176.62 1ug7 n SER 86 N -4.39 -3.21 -0.44 1.46 3.41 0.22 -4.73 113.62 105.94 1ug7 n SER 86 Ca 0.11 0.28 0.36 0.00 -0.26 0.00 0.00 58.87 59.36 1ug7 n SER 86 Cb 0.03 -1.08 0.65 0.00 -0.26 0.00 0.00 64.21 63.55 1ug7 n SER 86 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ug7 h THR 87 N -1.41 0.16 0.00 6.66 1.03 -1.85 -3.43 112.91 114.08 1ug7 h THR 87 Ca -0.44 -0.04 0.00 0.00 -0.01 0.00 0.00 66.41 65.93 1ug7 h THR 87 Cb 1.29 0.04 0.00 0.00 -1.07 0.00 0.00 68.15 68.41 1ug7 h THR 87 CO 0.31 0.02 0.00 0.00 -0.01 0.00 0.00 175.52 175.84 1ug7 n GLN 88 N -4.65 0.00 0.00 0.00 6.02 -1.26 -5.08 117.38 112.42 1ug7 n GLN 88 Ca 0.36 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.35 1ug7 n GLN 88 Cb 1.40 0.00 0.00 0.00 1.02 0.00 0.00 30.24 32.66 1ug7 n GLN 88 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 1ug7 n SER 89 N -2.11 0.00 -0.02 1.08 2.88 -1.26 -4.62 113.62 109.56 1ug7 n SER 89 Ca 0.00 0.00 -0.11 0.00 -1.33 0.00 0.00 58.87 57.43 1ug7 n SER 89 Cb 0.00 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.40 1ug7 n SER 89 CO 0.00 0.00 0.00 1.56 -1.23 0.00 0.00 175.04 175.37 1ug7 h GLN 90 N 0.00 0.16 0.00 -1.46 1.08 -1.97 -3.43 115.11 109.49 1ug7 h GLN 90 Ca 0.00 -0.03 0.00 0.00 -1.45 0.00 0.00 58.65 57.17 1ug7 h GLN 90 Cb 0.00 -0.03 0.00 0.00 -0.05 0.00 0.00 27.48 27.40 1ug7 h GLN 90 CO 0.00 0.24 0.00 -1.91 -0.95 0.00 0.00 178.83 176.21 1ug7 n GLU 91 N -4.93 0.00 0.00 1.46 2.13 -1.26 -5.16 120.64 112.88 1ug7 n GLU 91 Ca -0.05 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.77 1ug7 n GLU 91 Cb 0.10 0.00 0.00 0.00 0.27 0.00 0.00 31.44 31.81 1ug7 n GLU 91 CO 0.00 0.00 0.00 0.39 -0.41 0.00 0.00 177.13 177.11 1ug7 n GLU 92 N 0.00 3.50 -2.59 5.31 -0.58 -1.26 -5.06 120.64 119.96 1ug7 n GLU 92 Ca 0.00 0.00 -0.32 0.00 -0.42 0.00 0.00 57.16 56.42 1ug7 n GLU 92 Cb 0.00 0.00 -0.05 0.00 -0.57 0.00 0.00 31.44 30.82 1ug7 n GLU 92 CO 0.00 0.00 0.00 0.12 -0.48 0.00 0.00 177.13 176.77 1ug7 s PHE 93 N 1.91 3.41 0.00 -0.32 5.36 -1.26 -5.08 117.98 122.00 1ug7 s PHE 93 Ca 0.00 1.46 0.00 0.00 -0.96 0.00 0.00 56.93 57.43 1ug7 s PHE 93 Cb 0.00 -2.77 0.00 0.00 -0.34 0.00 0.00 43.02 39.91 1ug7 s PHE 93 CO 0.00 -0.25 0.00 0.36 -1.46 0.00 0.00 175.22 173.87 1ug7 n LYS 94 N -1.24 1.68 -0.08 10.12 2.85 -1.26 -4.75 118.16 125.47 1ug7 n LYS 94 Ca 0.06 0.00 -0.16 0.00 -1.05 0.00 0.00 58.31 57.16 1ug7 n LYS 94 Cb 0.54 0.00 -0.12 0.00 -0.65 0.00 0.00 35.03 34.80 1ug7 n LYS 94 CO 0.00 0.00 0.00 -0.07 -0.05 0.00 0.00 177.40 177.28 1ug7 h LEU 95 N 0.00 0.00 -0.48 -5.58 3.38 -1.98 -3.18 115.31 107.46 1ug7 h LEU 95 Ca 0.00 -0.76 0.10 0.00 0.09 0.00 0.00 57.88 57.30 1ug7 h LEU 95 Cb 0.00 0.00 -0.10 0.00 0.09 0.00 0.00 40.66 40.65 1ug7 h LEU 95 CO 0.00 1.16 -0.27 1.05 0.09 0.00 0.00 178.44 180.47 1ug7 h GLU 96 N -1.00 -0.15 -0.87 1.13 4.11 -1.97 1.10 114.58 116.92 1ug7 h GLU 96 Ca -0.13 0.01 0.11 0.00 0.07 0.00 0.00 59.36 59.42 1ug7 h GLU 96 Cb 1.07 0.04 -0.06 0.00 0.50 0.00 0.00 28.75 30.29 1ug7 h GLU 96 CO -0.08 -0.10 0.56 0.22 0.07 0.00 0.00 179.01 179.68 1ug7 h ASP 97 N -0.16 0.73 0.47 3.06 1.82 -1.98 0.91 116.42 121.28 1ug7 h ASP 97 Ca 0.22 0.03 -0.02 0.00 -0.39 0.00 0.00 57.03 56.86 1ug7 h ASP 97 Cb 0.51 -0.12 0.00 0.00 0.68 0.00 0.00 39.33 40.40 1ug7 h ASP 97 CO -0.58 0.41 -0.22 0.25 -1.61 0.00 0.00 179.24 177.49 1ug7 h LEU 98 N 0.80 -0.53 -2.32 2.28 5.85 -0.06 -2.93 115.31 118.40 1ug7 h LEU 98 Ca 0.42 0.02 0.00 0.00 0.84 0.00 0.00 57.88 59.16 1ug7 h LEU 98 Cb 0.51 0.14 -0.00 0.00 0.37 0.00 0.00 40.66 41.68 1ug7 h LEU 98 CO -0.18 -0.18 0.23 0.50 -0.34 0.00 0.00 178.44 178.46 1ug7 h LYS 99 N -1.02 0.00 0.00 1.25 1.63 0.13 0.92 116.57 119.49 1ug7 h LYS 99 Ca -0.06 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.74 1ug7 h LYS 99 Cb 0.48 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.11 1ug7 h LYS 99 CO 0.11 0.00 0.00 1.63 -3.45 0.00 0.00 179.45 177.74 1ug7 n LYS 100 N -2.98 0.04 0.00 1.90 5.02 0.31 -0.69 118.16 121.76 1ug7 n LYS 100 Ca -0.02 0.32 0.11 0.00 -2.02 0.00 0.00 58.31 56.70 1ug7 n LYS 100 Cb 0.28 -1.58 0.03 0.00 -0.02 0.00 0.00 35.03 33.74 1ug7 n LYS 100 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1ug7 n LEU 101 N -1.66 1.22 0.01 -0.35 4.77 0.32 -3.86 117.00 117.45 1ug7 n LEU 101 Ca 0.03 -0.47 -0.12 0.00 -0.03 0.00 0.00 56.01 55.42 1ug7 n LEU 101 Cb 0.16 -0.05 -0.08 0.00 -2.33 0.00 0.00 43.42 41.11 1ug7 n LEU 101 CO 0.13 0.26 0.79 -0.08 -1.33 0.00 0.00 177.39 177.16 1ug7 h GLU 102 N 0.83 0.03 -0.05 3.23 4.81 -0.97 -1.22 114.58 121.25 1ug7 h GLU 102 Ca 0.00 -0.01 -0.21 0.00 -0.13 0.00 0.00 59.36 59.01 1ug7 h GLU 102 Cb 0.57 -0.00 0.01 0.00 0.63 0.00 0.00 28.75 29.96 1ug7 h GLU 102 CO 0.00 0.20 -0.79 -1.00 -0.73 0.00 0.00 179.01 176.69 1ug7 h PRO 103 N -0.15 0.62 -0.64 0.92 0.13 -1.74 -3.13 132.00 128.01 1ug7 h PRO 103 Ca 0.01 -0.60 0.12 0.00 -0.87 0.00 0.00 66.00 64.65 1ug7 h PRO 103 Cb 0.18 0.16 -0.09 0.00 0.13 0.00 0.00 31.00 31.38 1ug7 h PRO 103 CO -0.00 1.21 0.18 0.82 -0.23 0.00 0.00 178.00 179.98 1ug7 h ILE 104 N 0.25 0.65 -0.40 -3.56 2.04 -1.66 1.64 117.51 116.47 1ug7 h ILE 104 Ca -0.09 -0.11 0.02 0.00 1.00 0.00 0.00 64.86 65.69 1ug7 h ILE 104 Cb 1.45 0.31 -0.02 0.00 -0.74 0.00 0.00 36.82 37.82 1ug7 h ILE 104 CO 0.16 0.06 0.27 -0.07 0.00 0.00 0.00 178.15 178.56 1ug7 h LEU 105 N 0.32 0.40 0.17 1.44 3.38 -1.25 1.26 115.31 121.03 1ug7 h LEU 105 Ca 0.34 -0.01 -0.30 0.00 0.09 0.00 0.00 57.88 58.00 1ug7 h LEU 105 Cb 0.50 -0.10 0.03 0.00 0.09 0.00 0.00 40.66 41.19 1ug7 h LEU 105 CO -0.40 0.28 -1.28 0.11 0.09 0.00 0.00 178.44 177.24 1ug7 h LYS 106 N 0.47 0.56 -0.64 1.13 1.57 0.07 -3.13 116.57 116.60 1ug7 h LYS 106 Ca 0.16 -0.84 0.00 0.00 -1.87 0.00 0.00 60.65 58.10 1ug7 h LYS 106 Cb 0.05 0.29 0.00 0.00 0.08 0.00 0.00 32.23 32.65 1ug7 h LYS 106 CO -0.04 1.39 0.00 0.09 -0.57 0.00 0.00 179.45 180.32 1ug7 n ASN 107 N -3.81 2.74 -0.14 0.86 3.02 0.51 -4.30 115.26 114.14 1ug7 n ASN 107 Ca -0.15 -2.28 -0.04 0.00 -0.03 0.00 0.00 54.58 52.08 1ug7 n ASN 107 Cb 1.01 -0.46 0.02 0.00 -0.61 0.00 0.00 39.78 39.74 1ug7 n ASN 107 CO 0.00 0.00 0.00 0.40 -2.62 0.00 0.00 177.26 175.04 1ug7 h ILE 108 N 1.94 0.48 0.22 2.41 1.08 0.16 0.65 117.51 124.45 1ug7 h ILE 108 Ca 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.47 1ug7 h ILE 108 Cb 0.93 0.48 -0.02 0.00 -3.07 0.00 0.00 36.82 35.15 1ug7 h ILE 108 CO 0.15 0.00 -0.20 -0.07 -0.69 0.00 0.00 178.15 177.33 1ug7 h LEU 109 N -0.05 -0.54 -3.81 1.44 3.38 -1.84 -2.13 115.31 111.76 1ug7 h LEU 109 Ca 0.22 0.05 -0.30 0.00 0.09 0.00 0.00 57.88 57.93 1ug7 h LEU 109 Cb 0.38 0.18 -0.12 0.00 0.09 0.00 0.00 40.66 41.20 1ug7 h LEU 109 CO -0.49 -0.30 0.20 1.07 0.09 0.00 0.00 178.44 179.01 1ug7 n THR 110 N -5.33 2.86 -3.68 0.22 5.66 -0.50 -4.85 114.28 108.66 1ug7 n THR 110 Ca -0.08 -1.84 -0.38 0.00 -3.05 0.00 0.00 64.05 58.69 1ug7 n THR 110 Cb 0.24 -1.56 -0.12 0.00 -1.55 0.00 0.00 70.33 67.34 1ug7 n THR 110 CO 0.00 0.00 0.00 -0.47 -3.05 0.00 0.00 175.07 171.55 1ug7 s TYR 111 N -1.00 3.18 -0.33 1.09 5.04 0.10 -4.94 117.35 120.50 1ug7 s TYR 111 Ca 0.41 -0.70 -0.02 0.00 -2.44 0.00 0.00 57.07 54.31 1ug7 s TYR 111 Cb 0.26 -2.34 0.11 0.00 0.35 0.00 0.00 41.96 40.35 1ug7 s TYR 111 CO -0.07 -0.50 2.40 0.09 -1.34 0.00 0.00 175.55 176.14 1ug7 n ASN 112 N 4.95 6.33 -0.15 4.32 4.13 -1.26 -4.97 115.26 128.61 1ug7 n ASN 112 Ca -0.14 -3.04 0.00 0.00 1.68 0.00 0.00 54.58 53.08 1ug7 n ASN 112 Cb 0.49 -1.15 0.00 0.00 -1.54 0.00 0.00 39.78 37.58 1ug7 n ASN 112 CO 0.00 0.00 0.00 0.29 0.28 0.00 0.00 177.26 177.83 1ug7 n LYS 113 N 0.75 0.00 -1.97 3.52 5.02 -1.26 -4.95 118.16 119.27 1ug7 n LYS 113 Ca 0.36 0.00 -0.02 0.00 -2.02 0.00 0.00 58.31 56.63 1ug7 n LYS 113 Cb 0.59 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.60 1ug7 n LYS 113 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1ug7 n GLU 114 N -0.29 -0.66 -1.72 1.97 -0.58 -1.26 -4.98 120.64 113.11 1ug7 n GLU 114 Ca 0.00 0.96 -0.39 0.00 -0.42 0.00 0.00 57.16 57.32 1ug7 n GLU 114 Cb 0.00 -2.88 0.04 0.00 -0.57 0.00 0.00 31.44 28.03 1ug7 n GLU 114 CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 1ug7 n PHE 115 N -0.71 2.14 0.35 -0.32 7.35 -1.26 -4.89 117.46 120.11 1ug7 n PHE 115 Ca 0.03 0.44 0.14 0.00 -0.76 0.00 0.00 57.45 57.30 1ug7 n PHE 115 Cb 0.27 -2.34 0.44 0.00 0.35 0.00 0.00 39.48 38.20 1ug7 n PHE 115 CO 0.00 0.00 0.00 -1.00 -0.76 0.00 0.00 176.76 175.00 1ug7 h PRO 116 N 1.44 0.00 -5.22 -7.13 0.13 -1.99 -3.45 132.00 115.78 1ug7 h PRO 116 Ca -0.50 0.00 -0.67 0.00 -0.87 0.00 0.00 66.00 63.96 1ug7 h PRO 116 Cb 1.31 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 32.31 1ug7 h PRO 116 CO 0.57 0.00 -0.52 -0.06 -0.23 0.00 0.00 178.00 177.76 1ug7 s PHE 117 N -3.36 1.91 -0.62 1.56 0.08 -1.26 -5.10 117.98 111.19 1ug7 s PHE 117 Ca 0.05 -0.96 -0.09 0.00 0.12 0.00 0.00 56.93 56.05 1ug7 s PHE 117 Cb 0.08 -1.58 0.16 0.00 -0.57 0.00 0.00 43.02 41.11 1ug7 s PHE 117 CO 0.56 0.20 0.50 -0.51 -0.10 0.00 0.00 175.22 175.88 1ug7 s ASP 118 N -3.84 5.90 -0.02 1.36 1.01 -1.26 -5.02 116.67 114.79 1ug7 s ASP 118 Ca 0.09 -2.42 0.00 0.00 0.71 0.00 0.00 52.55 50.94 1ug7 s ASP 118 Cb 0.02 -2.03 0.02 0.00 1.01 0.00 0.00 42.92 41.94 1ug7 s ASP 118 CO 0.05 -0.57 0.01 0.68 0.21 0.00 0.00 175.17 175.55 1ug7 s VAL 119 N 0.60 0.06 0.37 -1.27 -7.23 -1.26 -5.09 120.40 106.57 1ug7 s VAL 119 Ca 0.12 0.12 -0.25 0.00 -1.81 0.00 0.00 61.98 60.16 1ug7 s VAL 119 Cb -0.20 -0.15 -0.09 0.00 0.56 0.00 0.00 36.38 36.50 1ug7 s VAL 119 CO -0.04 0.10 1.02 -1.10 -0.31 0.00 0.00 175.10 174.77 1ug7 s GLN 120 N 0.83 4.34 0.44 4.82 -0.21 -1.26 -4.86 119.66 123.76 1ug7 s GLN 120 Ca -0.08 1.46 -0.22 0.00 0.02 0.00 0.00 55.36 56.54 1ug7 s GLN 120 Cb -0.11 -2.67 -0.09 0.00 1.00 0.00 0.00 33.01 31.15 1ug7 s GLN 120 CO -0.02 0.03 1.05 -1.25 -2.12 0.00 0.00 175.29 172.98 1ug7 s PRO 121 N -2.29 4.00 -0.17 2.91 0.04 -1.26 -4.44 135.00 133.79 1ug7 s PRO 121 Ca 0.54 1.45 -0.11 0.00 0.04 0.00 0.00 61.00 62.93 1ug7 s PRO 121 Cb -0.21 -2.34 -0.05 0.00 0.04 0.00 0.00 34.50 31.94 1ug7 s PRO 121 CO 0.27 -0.28 0.18 0.42 0.04 0.00 0.00 177.00 177.64 1ug7 s ILE 122 N -1.79 5.39 0.16 0.56 1.01 -1.25 -4.89 121.20 120.38 1ug7 s ILE 122 Ca 0.62 0.31 -0.24 0.00 0.00 0.00 0.00 60.65 61.34 1ug7 s ILE 122 Cb -0.20 -3.51 0.06 0.00 0.01 0.00 0.00 42.46 38.83 1ug7 s ILE 122 CO 0.24 0.46 0.72 -0.55 0.00 0.00 0.00 174.94 175.82 1ug7 s SER 123 N 0.09 -0.41 0.00 3.58 0.15 -1.26 -4.18 113.70 111.68 1ug7 s SER 123 Ca 0.12 -0.21 0.00 0.00 0.70 0.00 0.00 55.95 56.56 1ug7 s SER 123 Cb -0.12 0.58 0.00 0.00 -1.71 0.00 0.00 66.02 64.77 1ug7 s SER 123 CO 0.01 -1.00 0.00 0.61 1.20 0.00 0.00 173.24 174.06 1ug7 n GLY 124 N -0.39 2.46 3.47 9.45 0.00 -1.26 -4.95 105.19 113.97 1ug7 n GLY 124 Ca -0.11 -1.80 -0.37 0.00 0.00 0.00 0.00 46.02 43.74 1ug7 n GLY 124 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1ug7 n PRO 125 N 0.00 2.38 -3.37 1.61 -0.04 -1.26 -4.74 135.00 129.58 1ug7 n PRO 125 Ca 0.00 -2.78 0.02 0.00 -0.04 0.00 0.00 63.50 60.71 1ug7 n PRO 125 Cb 0.00 -3.53 -0.05 0.00 -0.04 0.00 0.00 33.50 29.88 1ug7 n PRO 125 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1ug7 s SER 126 N 5.12 -0.20 0.22 3.54 0.15 -1.26 -5.11 113.70 116.16 1ug7 s SER 126 Ca 0.60 0.29 -0.00 0.00 0.70 0.00 0.00 55.95 57.53 1ug7 s SER 126 Cb 0.04 1.19 -0.04 0.00 -1.71 0.00 0.00 66.02 65.50 1ug7 s SER 126 CO 0.09 -0.04 0.17 -0.44 1.20 0.00 0.00 173.24 174.22 1ug7 s SER 127 N 1.85 0.39 0.00 5.45 0.01 -1.26 -5.02 113.70 115.12 1ug7 s SER 127 Ca -0.03 -1.43 0.00 0.00 1.31 0.00 0.00 55.95 55.80 1ug7 s SER 127 Cb -0.02 0.42 0.00 0.00 0.21 0.00 0.00 66.02 66.62 1ug7 s SER 127 CO -0.15 -0.89 0.00 0.61 0.41 0.00 0.00 173.24 173.22