#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gmi s VAL 4 N 0.00 3.88 0.44 0.58 1.01 -1.26 -4.96 120.40 120.08 2gmi s VAL 4 Ca 0.00 1.04 -0.23 0.00 0.00 0.00 0.00 61.98 62.79 2gmi s VAL 4 Cb 0.00 -3.74 -0.11 0.00 0.00 0.00 0.00 36.38 32.53 2gmi s VAL 4 CO 0.00 -0.17 0.84 -2.65 0.00 0.00 0.00 175.10 173.12 2gmi n PRO 5 N 7.11 1.02 -0.24 2.72 -0.02 -1.26 -4.67 135.00 139.65 2gmi n PRO 5 Ca 0.16 0.37 0.02 0.00 -2.02 0.00 0.00 63.50 62.03 2gmi n PRO 5 Cb 0.44 -1.86 0.11 0.00 -0.02 0.00 0.00 33.50 32.17 2gmi n PRO 5 CO 0.00 0.00 0.00 -0.09 1.98 0.00 0.00 175.50 177.39 2gmi h ARG 6 N 1.17 0.04 -0.39 -0.52 2.43 -1.93 -1.14 114.38 114.04 2gmi h ARG 6 Ca -0.43 -0.00 0.05 0.00 -0.81 0.00 0.00 59.98 58.79 2gmi h ARG 6 Cb 1.36 -0.01 -0.05 0.00 -0.42 0.00 0.00 29.97 30.86 2gmi h ARG 6 CO 0.54 0.02 0.11 -0.91 -1.51 0.00 0.00 179.97 178.22 2gmi h ASN 7 N 0.04 0.08 0.54 -3.80 -0.26 -1.90 -1.14 115.58 109.14 2gmi h ASN 7 Ca 0.36 0.05 -0.12 0.00 -0.56 0.00 0.00 56.30 56.04 2gmi h ASN 7 Cb 0.59 0.06 -0.02 0.00 -1.06 0.00 0.00 38.32 37.89 2gmi h ASN 7 CO -0.69 0.08 -0.56 -0.26 -1.06 0.00 0.00 177.43 174.93 2gmi h PHE 8 N 0.25 0.03 -0.25 1.19 0.04 -1.67 -0.17 116.94 116.36 2gmi h PHE 8 Ca 0.18 -0.01 -0.03 0.00 2.80 0.00 0.00 57.97 60.91 2gmi h PHE 8 Cb 0.19 -0.01 -0.01 0.00 2.20 0.00 0.00 35.95 38.33 2gmi h PHE 8 CO -0.17 0.58 0.05 -0.09 -0.60 0.00 0.00 178.31 178.08 2gmi h ARG 9 N 0.02 0.40 -0.82 1.51 1.12 -0.82 -0.71 114.38 115.08 2gmi h ARG 9 Ca -0.01 -0.10 -0.00 0.00 -1.11 0.00 0.00 59.98 58.76 2gmi h ARG 9 Cb 1.00 -0.05 -0.04 0.00 -0.01 0.00 0.00 29.97 30.87 2gmi h ARG 9 CO 0.07 0.52 0.51 -0.07 -3.11 0.00 0.00 179.97 177.89 2gmi h LEU 10 N 0.22 0.98 -1.14 3.80 3.38 -0.99 -1.20 115.31 120.35 2gmi h LEU 10 Ca 0.08 -0.06 -0.05 0.00 0.09 0.00 0.00 57.88 57.94 2gmi h LEU 10 Cb 0.30 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.79 2gmi h LEU 10 CO 0.00 0.74 0.01 -0.07 0.09 0.00 0.00 178.44 179.22 2gmi h LEU 11 N 1.12 0.57 0.13 1.67 3.38 -0.79 0.56 115.31 121.94 2gmi h LEU 11 Ca 0.30 -0.11 -0.01 0.00 0.09 0.00 0.00 57.88 58.15 2gmi h LEU 11 Cb -0.06 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.54 2gmi h LEU 11 CO -0.06 0.63 -0.06 -0.08 0.09 0.00 0.00 178.44 178.97 2gmi h GLU 12 N 0.58 -0.16 0.00 1.13 4.81 -0.30 -2.14 114.58 118.49 2gmi h GLU 12 Ca 0.12 0.01 -0.06 0.00 -0.13 0.00 0.00 59.36 59.30 2gmi h GLU 12 Cb 0.35 0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.76 2gmi h GLU 12 CO 0.01 -0.04 -0.30 0.93 -0.73 0.00 0.00 179.01 178.88 2gmi h GLU 13 N -0.25 0.00 -0.67 1.92 5.08 -0.93 -2.91 114.58 116.82 2gmi h GLU 13 Ca -0.02 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.26 2gmi h GLU 13 Cb 0.20 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.42 2gmi h GLU 13 CO 0.03 0.30 0.09 1.25 -1.00 0.00 0.00 179.01 179.68 2gmi h LEU 14 N 0.00 1.07 0.76 1.33 5.85 -0.51 -1.14 115.31 122.67 2gmi h LEU 14 Ca -0.00 -0.26 -0.03 0.00 0.84 0.00 0.00 57.88 58.42 2gmi h LEU 14 Cb 0.64 -0.28 -0.00 0.00 0.37 0.00 0.00 40.66 41.38 2gmi h LEU 14 CO 0.04 1.06 -0.46 -0.33 -0.34 0.00 0.00 178.44 178.42 2gmi h GLU 15 N 1.04 -1.10 -0.97 1.25 4.39 -1.20 0.08 114.58 118.08 2gmi h GLU 15 Ca 0.20 0.07 0.15 0.00 0.34 0.00 0.00 59.36 60.12 2gmi h GLU 15 Cb 0.46 0.25 -0.09 0.00 -0.10 0.00 0.00 28.75 29.27 2gmi h GLU 15 CO 0.02 -0.73 0.58 0.87 -1.16 0.00 0.00 179.01 178.58 2gmi h LYS 16 N -1.14 0.81 -0.48 2.33 1.57 -1.50 0.21 116.57 118.37 2gmi h LYS 16 Ca -0.10 -0.05 -0.12 0.00 -1.87 0.00 0.00 60.65 58.51 2gmi h LYS 16 Cb 0.91 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 33.02 2gmi h LYS 16 CO 0.11 0.54 -0.18 0.78 -0.57 0.00 0.00 179.45 180.12 2gmi h GLY 17 N 0.83 1.02 1.71 3.86 0.00 -0.92 -1.07 103.07 108.51 2gmi h GLY 17 Ca 0.51 -0.87 -0.17 0.00 0.00 0.00 0.00 47.33 46.81 2gmi h GLY 17 CO -0.32 0.79 -0.95 0.83 0.00 0.00 0.00 176.54 176.89 2gmi h GLU 18 N 0.83 0.00 -0.59 4.80 5.08 0.04 -3.24 114.58 121.49 2gmi h GLU 18 Ca 0.12 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.48 2gmi h GLU 18 Cb 0.74 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.99 2gmi h GLU 18 CO 0.06 0.62 0.00 1.63 -1.00 0.00 0.00 179.01 180.31 2gmi n LYS 19 N -3.18 2.39 -1.35 2.33 4.76 0.63 -4.95 118.16 118.79 2gmi n LYS 19 Ca -0.03 -2.16 -0.12 0.00 -2.87 0.00 0.00 58.31 53.13 2gmi n LYS 19 Cb 0.85 -1.47 -0.05 0.00 -1.84 0.00 0.00 35.03 32.52 2gmi n LYS 19 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2gmi n GLY 20 N 1.46 1.14 3.38 0.72 0.00 -0.76 -4.86 105.19 106.27 2gmi n GLY 20 Ca 0.20 -0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.87 2gmi n GLY 20 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2gmi n PHE 21 N -2.22 1.90 -3.67 1.61 3.72 -0.48 -4.69 117.46 113.63 2gmi n PHE 21 Ca -0.12 -1.37 0.02 0.00 -0.05 0.00 0.00 57.45 55.94 2gmi n PHE 21 Cb 0.61 -2.04 -0.00 0.00 -0.94 0.00 0.00 39.48 37.11 2gmi n PHE 21 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 2gmi s GLY 22 N 6.15 -0.39 0.60 1.37 0.00 -1.26 -4.82 107.32 108.96 2gmi s GLY 22 Ca 0.65 0.66 -0.19 0.00 0.00 0.00 0.00 44.72 45.84 2gmi s GLY 22 CO 0.16 1.18 1.26 2.56 0.00 0.00 0.00 173.10 178.25 2gmi s PRO 23 N -2.23 2.87 0.25 2.90 0.04 -1.26 -4.90 135.00 132.67 2gmi s PRO 23 Ca 0.17 1.96 0.21 0.00 0.04 0.00 0.00 61.00 63.39 2gmi s PRO 23 Cb 0.05 -1.95 0.98 0.00 0.04 0.00 0.00 34.50 33.62 2gmi s PRO 23 CO -0.04 -1.32 1.65 0.39 0.04 0.00 0.00 177.00 177.72 2gmi n GLU 24 N -1.60 0.16 0.17 4.56 -0.58 -1.26 -2.66 120.64 119.43 2gmi n GLU 24 Ca 0.14 0.49 0.14 0.00 -0.42 0.00 0.00 57.16 57.50 2gmi n GLU 24 Cb 0.48 -1.86 0.51 0.00 -0.57 0.00 0.00 31.44 30.00 2gmi n GLU 24 CO 0.00 0.00 0.00 0.66 -0.48 0.00 0.00 177.13 177.31 2gmi h SER 25 N 0.00 0.00 -4.71 1.62 4.64 -1.95 -3.46 113.55 109.69 2gmi h SER 25 Ca 0.00 0.00 -0.25 0.00 -0.47 0.00 0.00 61.79 61.07 2gmi h SER 25 Cb 0.23 0.00 -0.19 0.00 -0.31 0.00 0.00 62.40 62.13 2gmi h SER 25 CO 0.00 0.00 -0.72 0.00 -0.87 0.00 0.00 176.83 175.24 2gmi s SER 27 N -2.18 -0.29 0.01 0.00 0.15 -1.00 -4.78 113.70 105.63 2gmi s SER 27 Ca -0.01 0.41 -0.16 0.00 0.70 0.00 0.00 55.95 56.89 2gmi s SER 27 Cb -0.04 0.52 0.03 0.00 -1.71 0.00 0.00 66.02 64.82 2gmi s SER 27 CO -0.02 -0.28 0.35 -0.72 1.20 0.00 0.00 173.24 173.77 2gmi s TYR 28 N -0.54 -0.20 0.00 3.44 -0.85 -1.26 -0.33 117.35 117.61 2gmi s TYR 28 Ca -0.06 0.22 -0.03 0.00 -0.52 0.00 0.00 57.07 56.67 2gmi s TYR 28 Cb -0.04 0.14 0.01 0.00 0.38 0.00 0.00 41.96 42.45 2gmi s TYR 28 CO 0.02 -0.48 0.16 0.41 -1.52 0.00 0.00 175.55 174.15 2gmi n GLY 29 N 0.87 0.69 3.75 5.49 0.00 -0.48 -4.53 105.19 110.99 2gmi n GLY 29 Ca -0.20 -0.88 -0.40 0.00 0.00 0.00 0.00 46.02 44.55 2gmi n GLY 29 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2gmi s LEU 30 N 0.00 4.60 0.40 0.99 1.43 -1.26 -0.57 118.68 124.27 2gmi s LEU 30 Ca 0.04 2.03 0.14 0.00 -1.03 0.00 0.00 54.13 55.30 2gmi s LEU 30 Cb -0.00 -3.64 0.83 0.00 0.03 0.00 0.00 46.19 43.40 2gmi s LEU 30 CO 0.00 0.06 1.89 0.00 0.23 0.00 0.00 176.35 178.53 2gmi h ALA 31 N 3.99 1.49 -1.98 4.21 0.00 -1.53 -3.41 119.26 122.03 2gmi h ALA 31 Ca -0.46 -0.28 -0.05 0.00 0.00 0.00 0.00 54.91 54.13 2gmi h ALA 31 Cb 1.20 -0.05 -0.20 0.00 0.00 0.00 0.00 17.79 18.75 2gmi h ALA 31 CO 0.67 0.38 0.19 0.16 0.00 0.00 0.00 179.25 180.65 2gmi s ASP 32 N -6.94 -0.67 -0.01 0.00 -4.77 -1.26 -4.97 116.67 98.05 2gmi s ASP 32 Ca -0.03 0.92 0.00 0.00 -3.30 0.00 0.00 52.55 50.15 2gmi s ASP 32 Cb 0.15 0.81 0.03 0.00 -1.09 0.00 0.00 42.92 42.81 2gmi s ASP 32 CO 0.71 -0.49 0.59 -1.54 0.70 0.00 0.00 175.17 175.15 2gmi n SER 33 N 1.44 1.06 -0.07 2.11 3.41 -1.26 -3.94 113.62 116.37 2gmi n SER 33 Ca -0.17 -2.03 -0.06 0.00 -0.26 0.00 0.00 58.87 56.35 2gmi n SER 33 Cb 0.56 -0.46 -0.13 0.00 -0.26 0.00 0.00 64.21 63.92 2gmi n SER 33 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2gmi n ASP 34 N -0.02 0.88 -4.55 4.04 8.00 -1.26 -4.85 116.55 118.79 2gmi n ASP 34 Ca 0.01 0.00 -0.40 0.00 0.71 0.00 0.00 54.79 55.11 2gmi n ASP 34 Cb 0.26 1.04 -0.03 0.00 -0.02 0.00 0.00 41.12 42.37 2gmi n ASP 34 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2gmi s ASP 35 N -4.91 5.88 0.60 -2.24 3.68 -1.25 -4.82 116.67 113.60 2gmi s ASP 35 Ca -0.08 -0.32 0.40 0.00 2.13 0.00 0.00 52.55 54.68 2gmi s ASP 35 Cb 0.06 -2.55 2.10 0.00 -1.45 0.00 0.00 42.92 41.08 2gmi s ASP 35 CO 0.69 -2.01 2.21 -0.29 0.13 0.00 0.00 175.17 175.91 2gmi h ILE 36 N 6.41 0.00 -0.00 4.11 -0.00 -1.93 -0.47 117.51 125.63 2gmi h ILE 36 Ca -0.21 -0.07 0.00 0.00 -0.00 0.00 0.00 64.86 64.57 2gmi h ILE 36 Cb 1.08 0.99 0.00 0.00 -0.00 0.00 0.00 36.82 38.89 2gmi h ILE 36 CO 1.27 0.00 -0.16 0.35 -0.00 0.00 0.00 178.15 179.62 2gmi n THR 37 N -2.95 0.00 -3.80 2.19 -2.24 -1.26 -4.94 114.28 101.28 2gmi n THR 37 Ca -0.02 -0.02 -0.26 0.00 -2.27 0.00 0.00 64.05 61.49 2gmi n THR 37 Cb 0.10 -0.20 0.03 0.00 -2.10 0.00 0.00 70.33 68.16 2gmi n THR 37 CO 0.00 0.00 0.00 0.23 -0.57 0.00 0.00 175.07 174.73 2gmi n MET 38 N -1.33 -5.28 0.09 -0.78 2.81 -0.19 -4.92 117.12 107.53 2gmi n MET 38 Ca 0.09 0.61 -0.22 0.00 -1.81 0.00 0.00 57.70 56.38 2gmi n MET 38 Cb 0.31 -5.33 -0.14 0.00 -0.71 0.00 0.00 33.22 27.34 2gmi n MET 38 CO 0.00 0.00 0.00 1.15 1.51 0.00 0.00 175.97 178.63 2gmi h THR 39 N -2.00 1.39 -3.31 2.03 2.02 -1.81 -3.44 112.91 107.80 2gmi h THR 39 Ca -0.60 -2.53 -0.59 0.00 0.77 0.00 0.00 66.41 63.46 2gmi h THR 39 Cb 1.37 3.01 -0.10 0.00 -1.74 0.00 0.00 68.15 70.68 2gmi h THR 39 CO 0.61 0.74 -0.35 -0.54 0.37 0.00 0.00 175.52 176.36 2gmi s LYS 40 N -2.66 4.24 0.08 6.66 3.01 -1.26 -0.81 119.74 129.00 2gmi s LYS 40 Ca -0.11 0.05 0.06 0.00 -1.01 0.00 0.00 55.97 54.95 2gmi s LYS 40 Cb 0.03 -3.43 -0.03 0.00 -1.01 0.00 0.00 37.83 33.39 2gmi s LYS 40 CO 0.89 0.23 -0.16 -1.58 0.51 0.00 0.00 175.35 175.24 2gmi s TRP 41 N 0.51 1.36 0.13 3.18 0.52 0.26 -1.49 118.94 123.41 2gmi s TRP 41 Ca 0.15 -0.45 0.07 0.00 0.02 0.00 0.00 56.10 55.89 2gmi s TRP 41 Cb -0.13 -0.76 -0.04 0.00 -1.15 0.00 0.00 33.47 31.39 2gmi s TRP 41 CO 0.03 0.09 -0.05 -0.80 0.02 0.00 0.00 176.95 176.25 2gmi s ASN 42 N -1.78 4.63 0.22 2.95 0.01 0.26 -0.38 114.94 120.86 2gmi s ASN 42 Ca 0.00 -0.36 0.01 0.00 -0.71 0.00 0.00 52.86 51.79 2gmi s ASN 42 Cb -0.10 -0.95 -0.05 0.00 0.41 0.00 0.00 41.25 40.56 2gmi s ASN 42 CO 0.03 0.14 0.09 -0.83 -1.51 0.00 0.00 177.10 175.02 2gmi s GLY 43 N -2.52 1.53 -0.01 0.66 0.00 -0.57 -1.39 107.32 105.03 2gmi s GLY 43 Ca 0.24 -1.76 -0.13 0.00 0.00 0.00 0.00 44.72 43.08 2gmi s GLY 43 CO 0.16 -1.52 0.27 -0.51 0.00 0.00 0.00 173.10 171.51 2gmi s THR 44 N -3.87 0.06 -0.12 0.90 -4.23 0.55 -1.33 115.64 107.60 2gmi s THR 44 Ca 0.35 -0.50 -0.04 0.00 -1.18 0.00 0.00 61.69 60.31 2gmi s THR 44 Cb 0.07 -0.56 0.06 0.00 1.34 0.00 0.00 72.50 73.41 2gmi s THR 44 CO 0.11 -0.28 0.24 -0.63 -0.54 0.00 0.00 174.62 173.52 2gmi s ILE 45 N -1.28 -0.37 0.09 2.99 1.01 -0.74 -2.36 121.20 120.54 2gmi s ILE 45 Ca -0.13 0.30 -0.24 0.00 0.00 0.00 0.00 60.65 60.58 2gmi s ILE 45 Cb -0.06 -0.40 -0.07 0.00 0.01 0.00 0.00 42.46 41.94 2gmi s ILE 45 CO 0.03 0.12 0.71 -1.48 0.00 0.00 0.00 174.94 174.33 2gmi s LEU 46 N 2.36 4.51 0.25 2.97 0.05 -1.06 0.55 118.68 128.31 2gmi s LEU 46 Ca 0.01 1.45 -0.29 0.00 0.05 0.00 0.00 54.13 55.36 2gmi s LEU 46 Cb -0.12 -3.16 -0.15 0.00 -2.05 0.00 0.00 46.19 40.71 2gmi s LEU 46 CO -0.08 0.14 0.91 0.61 -0.55 0.00 0.00 176.35 177.38 2gmi n GLY 47 N 2.00 -0.59 3.73 -3.48 0.00 0.30 -4.89 105.19 102.25 2gmi n GLY 47 Ca -0.05 0.35 -0.35 0.00 0.00 0.00 0.00 46.02 45.97 2gmi n GLY 47 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2gmi s PRO 48 N -1.28 2.35 0.44 1.61 0.02 -1.26 -4.12 135.00 132.77 2gmi s PRO 48 Ca 0.62 1.84 -0.25 0.00 0.02 0.00 0.00 61.00 63.23 2gmi s PRO 48 Cb -0.78 -1.85 -0.08 0.00 0.02 0.00 0.00 34.50 31.82 2gmi s PRO 48 CO 0.58 -1.69 1.29 -1.25 -0.33 0.00 0.00 177.00 175.60 2gmi s PRO 49 N -3.71 3.76 -0.49 5.54 0.04 -1.26 -1.30 135.00 137.58 2gmi s PRO 49 Ca 0.77 2.10 -0.10 0.00 0.04 0.00 0.00 61.00 63.81 2gmi s PRO 49 Cb -0.31 -2.59 0.01 0.00 0.04 0.00 0.00 34.50 31.66 2gmi s PRO 49 CO 0.42 -0.65 0.58 0.72 0.04 0.00 0.00 177.00 178.12 2gmi n HIS 50 N -0.23 -3.06 0.00 0.56 8.25 -1.26 -4.85 115.22 114.63 2gmi n HIS 50 Ca 0.06 1.21 0.00 0.00 -0.26 0.00 0.00 57.72 58.73 2gmi n HIS 50 Cb 0.45 -3.89 0.00 0.00 1.12 0.00 0.00 29.99 27.66 2gmi n HIS 50 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 2gmi n SER 51 N -0.78 0.00 0.16 0.41 7.64 -1.26 -4.86 113.62 114.93 2gmi n SER 51 Ca 0.07 0.00 0.01 0.00 1.01 0.00 0.00 58.87 59.96 2gmi n SER 51 Cb 0.45 0.00 0.31 0.00 -1.01 0.00 0.00 64.21 63.96 2gmi n SER 51 CO 0.00 0.00 0.00 0.78 -3.01 0.00 0.00 175.04 172.81 2gmi h ASN 52 N 0.00 0.07 -0.31 6.43 4.21 -1.89 -2.38 115.58 121.70 2gmi h ASN 52 Ca 0.00 -0.02 -0.02 0.00 1.21 0.00 0.00 56.30 57.46 2gmi h ASN 52 Cb 0.00 -0.02 -0.01 0.00 -1.12 0.00 0.00 38.32 37.17 2gmi h ASN 52 CO 0.00 0.45 0.10 0.45 -1.29 0.00 0.00 177.43 177.14 2gmi h HIS 53 N 0.06 0.50 -0.58 1.19 3.86 -1.93 -3.45 115.15 114.79 2gmi h HIS 53 Ca 0.00 -0.05 -0.50 0.00 -1.16 0.00 0.00 60.37 58.67 2gmi h HIS 53 Cb 0.71 -0.14 0.01 0.00 1.06 0.00 0.00 27.41 29.05 2gmi h HIS 53 CO 0.00 0.51 0.28 -1.91 0.86 0.00 0.00 177.93 177.67 2gmi n GLU 54 N -4.69 0.00 -1.27 2.45 2.13 -0.42 -1.82 120.64 117.02 2gmi n GLU 54 Ca -0.02 0.00 -0.01 0.00 0.66 0.00 0.00 57.16 57.79 2gmi n GLU 54 Cb 0.16 -0.88 -0.00 0.00 0.27 0.00 0.00 31.44 31.00 2gmi n GLU 54 CO 0.00 0.00 0.00 -1.71 -0.41 0.00 0.00 177.13 175.01 2gmi n ASN 55 N 1.85 -2.64 -3.86 4.31 5.15 -1.26 -4.86 115.26 113.95 2gmi n ASN 55 Ca 0.16 0.02 -0.13 0.00 -0.60 0.00 0.00 54.58 54.03 2gmi n ASN 55 Cb -0.01 -0.69 -0.14 0.00 -0.53 0.00 0.00 39.78 38.40 2gmi n ASN 55 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2gmi s ARG 56 N -2.57 0.03 -0.34 1.20 1.70 -0.76 -4.93 118.95 113.29 2gmi s ARG 56 Ca 0.00 0.01 -0.21 0.00 -0.47 0.00 0.00 55.73 55.06 2gmi s ARG 56 Cb 0.00 -0.07 0.00 0.00 -0.57 0.00 0.00 34.95 34.31 2gmi s ARG 56 CO 0.00 -0.02 0.68 0.42 -1.08 0.00 0.00 175.30 175.30 2gmi s ILE 57 N 0.15 4.86 -0.32 4.99 1.01 -1.26 0.11 121.20 130.74 2gmi s ILE 57 Ca -0.01 0.75 -0.19 0.00 0.00 0.00 0.00 60.65 61.20 2gmi s ILE 57 Cb -0.02 -4.10 -0.01 0.00 0.01 0.00 0.00 42.46 38.34 2gmi s ILE 57 CO -0.00 -0.30 0.55 -0.31 0.00 0.00 0.00 174.94 174.88 2gmi s TYR 58 N 2.80 3.20 -0.24 3.97 4.12 0.19 -4.92 117.35 126.47 2gmi s TYR 58 Ca 0.27 0.39 -0.16 0.00 0.02 0.00 0.00 57.07 57.58 2gmi s TYR 58 Cb -0.14 -2.92 -0.03 0.00 -1.52 0.00 0.00 41.96 37.34 2gmi s TYR 58 CO 0.14 -0.48 0.43 -1.12 0.02 0.00 0.00 175.55 174.55 2gmi s SER 59 N 1.70 6.39 0.37 2.29 0.01 -1.26 -1.78 113.70 121.40 2gmi s SER 59 Ca 0.21 0.46 0.09 0.00 1.31 0.00 0.00 55.95 58.02 2gmi s SER 59 Cb -0.15 -2.24 -0.07 0.00 0.21 0.00 0.00 66.02 63.77 2gmi s SER 59 CO 0.12 -0.18 -0.04 -0.76 0.41 0.00 0.00 173.24 172.79 2gmi s LEU 60 N 1.88 2.82 -0.13 2.44 1.02 -0.44 -0.38 118.68 125.89 2gmi s LEU 60 Ca 0.19 -1.22 0.02 0.00 0.02 0.00 0.00 54.13 53.13 2gmi s LEU 60 Cb -0.15 -1.03 -0.00 0.00 0.02 0.00 0.00 46.19 45.03 2gmi s LEU 60 CO 0.09 -0.29 -0.19 -0.55 0.02 0.00 0.00 176.35 175.43 2gmi s SER 61 N -3.66 3.45 -0.16 2.29 0.15 0.12 -1.51 113.70 114.38 2gmi s SER 61 Ca 0.34 -0.49 0.01 0.00 0.70 0.00 0.00 55.95 56.51 2gmi s SER 61 Cb 0.04 -1.50 0.02 0.00 -1.71 0.00 0.00 66.02 62.87 2gmi s SER 61 CO 0.17 0.13 -0.19 -0.63 1.20 0.00 0.00 173.24 173.92 2gmi s ILE 62 N 0.54 1.92 -0.41 6.45 1.01 0.49 -1.05 121.20 130.16 2gmi s ILE 62 Ca -0.12 -0.87 -0.14 0.00 0.00 0.00 0.00 60.65 59.53 2gmi s ILE 62 Cb -0.16 -1.74 0.03 0.00 0.01 0.00 0.00 42.46 40.59 2gmi s ILE 62 CO 0.04 0.52 0.28 -0.62 0.00 0.00 0.00 174.94 175.16 2gmi s ASP 63 N 1.18 6.00 -0.74 3.58 2.15 0.10 -0.57 116.67 128.37 2gmi s ASP 63 Ca 0.01 -0.98 -0.17 0.00 0.43 0.00 0.00 52.55 51.84 2gmi s ASP 63 Cb -0.14 -2.12 0.15 0.00 -0.30 0.00 0.00 42.92 40.51 2gmi s ASP 63 CO -0.09 -0.45 0.81 0.00 -0.17 0.00 0.00 175.17 175.27 2gmi n GLY 65 N 4.90 -2.91 0.02 0.00 0.00 -1.26 -4.56 105.19 101.37 2gmi n GLY 65 Ca 0.06 -1.42 0.04 0.00 0.00 0.00 0.00 46.02 44.69 2gmi n GLY 65 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2gmi n PRO 66 N -5.36 0.02 -0.18 1.61 -0.04 -1.26 -1.89 135.00 127.90 2gmi n PRO 66 Ca 0.07 0.41 0.06 0.00 -0.04 0.00 0.00 63.50 63.99 2gmi n PRO 66 Cb 0.57 -1.55 0.15 0.00 -0.04 0.00 0.00 33.50 32.63 2gmi n PRO 66 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 2gmi n ASN 67 N -1.59 2.94 -4.77 3.54 5.15 -1.26 -4.99 115.26 114.28 2gmi n ASN 67 Ca 0.01 -2.05 -0.39 0.00 -0.60 0.00 0.00 54.58 51.55 2gmi n ASN 67 Cb 0.08 -0.24 -0.01 0.00 -0.53 0.00 0.00 39.78 39.08 2gmi n ASN 67 CO 0.00 0.00 0.00 -0.47 1.40 0.00 0.00 177.26 178.19 2gmi s TYR 68 N -1.09 2.97 -1.97 1.20 5.04 -0.79 -0.82 117.35 121.89 2gmi s TYR 68 Ca 0.23 1.49 0.17 0.00 -2.44 0.00 0.00 57.07 56.52 2gmi s TYR 68 Cb 0.13 -3.53 0.50 0.00 0.35 0.00 0.00 41.96 39.40 2gmi s TYR 68 CO 0.15 -1.67 1.41 -0.35 -1.34 0.00 0.00 175.55 173.75 2gmi n PRO 69 N 0.19 2.32 -0.36 4.97 -0.04 -1.26 -4.51 135.00 136.31 2gmi n PRO 69 Ca 0.04 -2.02 -0.03 0.00 -0.04 0.00 0.00 63.50 61.45 2gmi n PRO 69 Cb 0.45 -1.45 0.10 0.00 -0.04 0.00 0.00 33.50 32.56 2gmi n PRO 69 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 2gmi h ASP 70 N 3.26 1.12 -3.18 3.54 5.19 -1.32 -3.35 116.42 121.68 2gmi h ASP 70 Ca 0.00 -0.05 -0.66 0.00 -0.62 0.00 0.00 57.03 55.70 2gmi h ASP 70 Cb 0.76 -0.28 -0.11 0.00 0.18 0.00 0.00 39.33 39.88 2gmi h ASP 70 CO 0.01 0.84 -0.60 -0.44 -3.12 0.00 0.00 179.24 175.93 2gmi s SER 71 N -6.13 5.51 1.02 6.45 0.01 -0.34 -4.70 113.70 115.51 2gmi s SER 71 Ca -0.13 0.10 -0.12 0.00 1.31 0.00 0.00 55.95 57.11 2gmi s SER 71 Cb 0.17 -1.54 0.20 0.00 0.21 0.00 0.00 66.02 65.06 2gmi s SER 71 CO 0.82 0.27 1.08 -2.16 0.41 0.00 0.00 173.24 173.66 2gmi s PRO 72 N -1.68 0.28 0.62 12.44 0.04 -1.26 -4.24 135.00 141.20 2gmi s PRO 72 Ca 0.22 0.81 0.01 0.00 0.04 0.00 0.00 61.00 62.08 2gmi s PRO 72 Cb -0.12 -1.70 0.07 0.00 0.04 0.00 0.00 34.50 32.80 2gmi s PRO 72 CO 0.13 -2.91 0.86 -1.25 0.04 0.00 0.00 177.00 173.87 2gmi s PRO 73 N -4.76 2.19 -0.26 0.56 0.04 -1.26 -4.78 135.00 126.72 2gmi s PRO 73 Ca 0.66 -0.98 -0.09 0.00 0.04 0.00 0.00 61.00 60.63 2gmi s PRO 73 Cb -0.21 -2.44 -0.03 0.00 0.04 0.00 0.00 34.50 31.86 2gmi s PRO 73 CO 0.60 -1.01 0.11 0.15 0.04 0.00 0.00 177.00 176.89 2gmi s LYS 74 N -4.90 3.71 0.23 4.56 1.02 -0.39 -4.90 119.74 119.07 2gmi s LYS 74 Ca 0.61 -0.46 0.05 0.00 0.02 0.00 0.00 55.97 56.19 2gmi s LYS 74 Cb -0.08 -3.45 -0.03 0.00 -0.52 0.00 0.00 37.83 33.75 2gmi s LYS 74 CO 0.41 -0.21 0.34 0.08 -0.92 0.00 0.00 175.35 175.05 2gmi s VAL 75 N 1.66 5.20 -0.29 3.17 1.01 -1.26 0.01 120.40 129.90 2gmi s VAL 75 Ca 0.06 -0.99 -0.14 0.00 0.00 0.00 0.00 61.98 60.91 2gmi s VAL 75 Cb -0.16 -3.81 0.13 0.00 0.00 0.00 0.00 36.38 32.54 2gmi s VAL 75 CO 0.06 -0.30 0.82 -0.89 0.00 0.00 0.00 175.10 174.78 2gmi s THR 76 N -1.96 -0.39 -0.10 3.92 2.01 -0.22 -2.99 115.64 115.91 2gmi s THR 76 Ca 0.34 0.00 -0.30 0.00 0.31 0.00 0.00 61.69 62.04 2gmi s THR 76 Cb -0.09 -1.00 -0.03 0.00 0.01 0.00 0.00 72.50 71.39 2gmi s THR 76 CO 0.29 0.00 1.30 -0.36 -0.69 0.00 0.00 174.62 175.15 2gmi s PHE 77 N 2.10 2.88 -0.13 4.92 0.08 -0.31 0.15 117.98 127.66 2gmi s PHE 77 Ca -0.07 0.97 -0.12 0.00 0.12 0.00 0.00 56.93 57.84 2gmi s PHE 77 Cb -0.07 -3.54 -0.10 0.00 -0.57 0.00 0.00 43.02 38.75 2gmi s PHE 77 CO -0.18 -1.87 0.21 0.82 -0.10 0.00 0.00 175.22 174.10 2gmi h ILE 78 N 5.28 0.60 -3.31 0.64 1.08 -1.03 -3.43 117.51 117.35 2gmi h ILE 78 Ca -0.31 -1.50 -0.53 0.00 -0.39 0.00 0.00 64.86 62.13 2gmi h ILE 78 Cb 1.14 1.19 0.06 0.00 -3.07 0.00 0.00 36.82 36.13 2gmi h ILE 78 CO 0.93 0.20 0.78 -0.44 -0.69 0.00 0.00 178.15 178.93 2gmi s SER 79 N -5.90 6.64 0.40 1.72 0.01 -0.52 -0.23 113.70 115.81 2gmi s SER 79 Ca -0.11 2.66 -0.27 0.00 1.31 0.00 0.00 55.95 59.55 2gmi s SER 79 Cb 0.00 -2.62 -0.10 0.00 0.21 0.00 0.00 66.02 63.51 2gmi s SER 79 CO 0.29 -0.72 1.39 0.29 0.41 0.00 0.00 173.24 174.91 2gmi n LYS 80 N 2.54 2.31 -3.74 12.44 5.02 0.10 -4.52 118.16 132.32 2gmi n LYS 80 Ca 0.08 0.82 -0.08 0.00 -2.02 0.00 0.00 58.31 57.11 2gmi n LYS 80 Cb 0.40 -2.54 0.03 0.00 -0.02 0.00 0.00 35.03 32.90 2gmi n LYS 80 CO 0.00 0.00 0.00 1.51 -0.52 0.00 0.00 177.40 178.39 2gmi n ILE 81 N 0.11 0.00 -3.14 -0.18 3.06 -1.26 -4.50 119.36 113.45 2gmi n ILE 81 Ca 0.04 -0.90 -0.18 0.00 -2.50 0.00 0.00 62.75 59.20 2gmi n ILE 81 Cb 0.39 0.94 -0.06 0.00 0.54 0.00 0.00 39.64 41.45 2gmi n ILE 81 CO 0.00 0.00 0.00 -3.20 -2.50 0.00 0.00 176.55 170.85 2gmi n ASN 82 N -1.49 -1.60 -4.77 9.51 4.05 -1.26 -4.93 115.26 114.78 2gmi n ASN 82 Ca -0.08 -2.60 -0.23 0.00 0.45 0.00 0.00 54.58 52.13 2gmi n ASN 82 Cb 0.58 0.33 -0.06 0.00 1.23 0.00 0.00 39.78 41.87 2gmi n ASN 82 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 177.26 173.45 2gmi s LEU 83 N 0.29 3.31 -0.02 1.20 2.01 -1.26 -4.87 118.68 119.34 2gmi s LEU 83 Ca 0.32 -0.77 -0.15 0.00 0.01 0.00 0.00 54.13 53.54 2gmi s LEU 83 Cb 0.03 -1.81 -0.08 0.00 0.01 0.00 0.00 46.19 44.34 2gmi s LEU 83 CO -0.14 -0.38 0.71 -0.65 1.01 0.00 0.00 176.35 176.89 2gmi h PRO 84 N 1.42 -0.52 0.00 1.29 0.11 -2.00 -3.28 132.00 129.02 2gmi h PRO 84 Ca -0.43 0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.71 2gmi h PRO 84 Cb 1.25 0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.48 2gmi h PRO 84 CO 0.63 -0.35 0.02 0.00 -0.21 0.00 0.00 178.00 178.09 2gmi s VAL 86 N -1.93 2.92 0.06 0.00 0.11 -1.24 -0.19 120.40 120.13 2gmi s VAL 86 Ca 0.00 -0.71 -0.35 0.00 -2.93 0.00 0.00 61.98 58.00 2gmi s VAL 86 Cb 0.00 -2.22 -0.14 0.00 -1.53 0.00 0.00 36.38 32.49 2gmi s VAL 86 CO 0.00 0.53 1.63 -3.20 -3.33 0.00 0.00 175.10 170.72 2gmi n ASN 87 N 3.60 2.90 0.21 3.54 5.15 -0.17 -4.69 115.26 125.79 2gmi n ASN 87 Ca -0.18 1.06 0.14 0.00 -0.60 0.00 0.00 54.58 55.00 2gmi n ASN 87 Cb 0.53 -1.35 0.75 0.00 -0.53 0.00 0.00 39.78 39.18 2gmi n ASN 87 CO 0.00 0.00 0.00 -0.65 1.40 0.00 0.00 177.26 178.01 2gmi h PRO 88 N 6.61 0.00 0.00 1.20 0.11 -1.91 -1.87 132.00 136.15 2gmi h PRO 88 Ca -0.46 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 65.57 2gmi h PRO 88 Cb 1.28 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.37 2gmi h PRO 88 CO 0.89 0.00 -1.26 0.25 -0.21 0.00 0.00 178.00 177.67 2gmi n THR 89 N -2.49 0.26 -0.08 -1.15 -2.24 -1.26 -4.88 114.28 102.45 2gmi n THR 89 Ca -0.02 -0.08 -0.15 0.00 -2.27 0.00 0.00 64.05 61.53 2gmi n THR 89 Cb 0.06 -1.16 -0.11 0.00 -2.10 0.00 0.00 70.33 67.01 2gmi n THR 89 CO 0.00 0.00 0.00 0.71 -0.57 0.00 0.00 175.07 175.21 2gmi h THR 90 N -0.10 1.37 0.00 4.28 1.35 -1.91 -3.48 112.91 114.42 2gmi h THR 90 Ca -0.11 -2.16 0.00 0.00 -0.55 0.00 0.00 66.41 63.59 2gmi h THR 90 Cb 1.13 2.71 0.00 0.00 -1.73 0.00 0.00 68.15 70.26 2gmi h THR 90 CO -0.05 0.46 0.00 0.61 -0.25 0.00 0.00 175.52 176.29 2gmi n GLY 91 N 1.58 0.87 3.77 5.82 0.00 -0.70 -4.72 105.19 111.80 2gmi n GLY 91 Ca -0.15 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.47 2gmi n GLY 91 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2gmi s GLU 92 N -0.39 3.87 -0.30 1.61 2.02 -1.26 -1.16 118.70 123.09 2gmi s GLU 92 Ca 0.00 2.44 -0.21 0.00 0.02 0.00 0.00 54.97 57.22 2gmi s GLU 92 Cb 0.00 -2.78 -0.01 0.00 0.10 0.00 0.00 34.13 31.44 2gmi s GLU 92 CO 0.00 -0.68 0.69 0.08 0.02 0.00 0.00 175.26 175.37 2gmi s VAL 93 N -1.18 4.89 0.33 2.63 1.01 -1.16 -1.00 120.40 125.92 2gmi s VAL 93 Ca 0.57 1.00 -0.28 0.00 0.00 0.00 0.00 61.98 63.28 2gmi s VAL 93 Cb -0.44 -4.05 -0.13 0.00 0.00 0.00 0.00 36.38 31.76 2gmi s VAL 93 CO 0.58 -0.17 1.23 0.00 0.00 0.00 0.00 175.10 176.74 2gmi n GLN 94 N 5.99 1.95 0.00 2.72 1.13 0.74 -4.74 117.38 125.17 2gmi n GLN 94 Ca 0.01 0.68 0.02 0.00 -1.94 0.00 0.00 57.00 55.77 2gmi n GLN 94 Cb 0.49 -2.22 0.09 0.00 0.11 0.00 0.00 30.24 28.70 2gmi n GLN 94 CO 0.00 0.00 0.00 0.25 -1.44 0.00 0.00 177.06 175.87 2gmi n THR 95 N 0.31 1.68 0.25 5.09 -2.24 -1.26 -1.63 114.28 116.48 2gmi n THR 95 Ca 0.06 0.42 0.12 0.00 -2.27 0.00 0.00 64.05 62.38 2gmi n THR 95 Cb 0.35 -1.35 0.16 0.00 -2.10 0.00 0.00 70.33 67.39 2gmi n THR 95 CO 0.00 0.00 0.00 -2.24 -0.57 0.00 0.00 175.07 172.26 2gmi h ASP 96 N 0.00 0.00 -1.87 3.42 -0.00 -1.95 -2.50 116.42 113.52 2gmi h ASP 96 Ca 0.00 -0.01 -0.65 0.00 -0.00 0.00 0.00 57.03 56.37 2gmi h ASP 96 Cb 0.07 0.00 0.05 0.00 -0.00 0.00 0.00 39.33 39.45 2gmi h ASP 96 CO 0.00 0.00 0.59 0.33 -0.00 0.00 0.00 179.24 180.16 2gmi n PHE 97 N -2.90 1.79 -0.33 4.15 7.35 -0.65 -4.49 117.46 122.38 2gmi n PHE 97 Ca 0.03 0.51 0.30 0.00 -0.76 0.00 0.00 57.45 57.53 2gmi n PHE 97 Cb 0.52 -2.41 0.56 0.00 0.35 0.00 0.00 39.48 38.50 2gmi n PHE 97 CO 0.00 0.00 0.00 1.12 -0.76 0.00 0.00 176.76 177.12 2gmi h HIS 98 N 5.16 0.85 -0.14 -5.13 2.07 -1.89 0.27 115.15 116.33 2gmi h HIS 98 Ca -0.47 0.04 -0.22 0.00 -2.85 0.00 0.00 60.37 56.87 2gmi h HIS 98 Cb 1.31 -0.20 0.01 0.00 2.57 0.00 0.00 27.41 31.09 2gmi h HIS 98 CO 0.62 -0.38 -0.78 1.15 -3.07 0.00 0.00 177.93 175.47 2gmi h THR 99 N 0.10 1.29 0.57 6.12 2.02 -1.95 -3.33 112.91 117.73 2gmi h THR 99 Ca 0.82 -2.00 -0.03 0.00 0.77 0.00 0.00 66.41 65.97 2gmi h THR 99 Cb 2.09 2.00 0.01 0.00 -1.74 0.00 0.00 68.15 70.51 2gmi h THR 99 CO -0.71 0.63 -0.27 -0.07 0.37 0.00 0.00 175.52 175.47 2gmi h LEU 100 N 0.51 -0.65-10.39 2.58 3.38 -0.83 -2.82 115.31 107.11 2gmi h LEU 100 Ca -0.05 0.02 -0.48 0.00 0.09 0.00 0.00 57.88 57.46 2gmi h LEU 100 Cb 1.41 0.17 0.13 0.00 0.09 0.00 0.00 40.66 42.45 2gmi h LEU 100 CO 0.16 -0.38 0.28 0.00 0.09 0.00 0.00 178.44 178.59 2gmi s ARG 101 N -4.30 1.49 0.00 1.13 1.70 -0.12 -2.33 118.95 116.52 2gmi s ARG 101 Ca -0.11 0.66 0.00 0.00 -0.47 0.00 0.00 55.73 55.81 2gmi s ARG 101 Cb 0.01 -1.85 0.00 0.00 -0.57 0.00 0.00 34.95 32.54 2gmi s ARG 101 CO 0.33 -2.04 0.00 -0.25 -1.08 0.00 0.00 175.30 172.27 2gmi n ASP 102 N -3.72 0.00 -2.84 -2.89 9.92 -1.26 -4.59 116.55 111.17 2gmi n ASP 102 Ca 0.07 0.00 -0.33 0.00 -0.53 0.00 0.00 54.79 54.00 2gmi n ASP 102 Cb 0.56 -0.01 -0.03 0.00 -0.64 0.00 0.00 41.12 41.01 2gmi n ASP 102 CO 0.00 0.00 0.00 1.87 0.13 0.00 0.00 177.20 179.20 2gmi n TRP 103 N -0.09 -0.07 -4.23 1.24 -0.00 -0.99 -4.97 117.44 108.33 2gmi n TRP 103 Ca 0.00 0.64 -0.17 0.00 -0.00 0.00 0.00 57.50 57.97 2gmi n TRP 103 Cb 0.00 -1.28 -0.11 0.00 -0.00 0.00 0.00 31.31 29.92 2gmi n TRP 103 CO 0.00 0.00 0.00 0.21 -0.00 0.00 0.00 177.69 177.90 2gmi s LYS 104 N -0.42 1.00 0.31 5.87 2.47 -1.26 -4.94 119.74 122.77 2gmi s LYS 104 Ca 0.47 -1.26 0.08 0.00 -1.56 0.00 0.00 55.97 53.71 2gmi s LYS 104 Cb -0.67 -0.80 0.85 0.00 -1.46 0.00 0.00 37.83 35.74 2gmi s LYS 104 CO 0.36 0.14 1.74 -0.09 0.16 0.00 0.00 175.35 177.66 2gmi h ARG 105 N 3.42 0.60 0.00 4.03 2.43 -1.84 0.37 114.38 123.38 2gmi h ARG 105 Ca -0.39 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 58.75 2gmi h ARG 105 Cb 1.19 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 30.61 2gmi h ARG 105 CO 0.53 0.39 0.00 0.00 -1.51 0.00 0.00 179.97 179.38 2gmi h ALA 106 N 1.71 1.00 -2.34 2.80 0.00 -1.96 -3.44 119.26 117.04 2gmi h ALA 106 Ca 0.63 0.00 -0.50 0.00 0.00 0.00 0.00 54.91 55.03 2gmi h ALA 106 Cb 1.15 0.00 0.12 0.00 0.00 0.00 0.00 17.79 19.06 2gmi h ALA 106 CO -0.46 0.00 0.32 0.71 0.00 0.00 0.00 179.25 179.82 2gmi s TYR 107 N -3.60 2.68 0.13 0.00 4.12 0.13 -5.06 117.35 115.76 2gmi s TYR 107 Ca -0.02 1.40 -0.09 0.00 0.02 0.00 0.00 57.07 58.39 2gmi s TYR 107 Cb 0.08 -3.04 -0.01 0.00 -1.52 0.00 0.00 41.96 37.47 2gmi s TYR 107 CO 0.26 -1.79 0.24 0.95 0.02 0.00 0.00 175.55 175.24 2gmi s THR 108 N -2.98 0.10 0.61 -0.71 -4.23 -1.26 -4.98 115.64 102.18 2gmi s THR 108 Ca 0.61 -1.29 0.31 0.00 -1.18 0.00 0.00 61.69 60.14 2gmi s THR 108 Cb -0.16 -1.62 0.37 0.00 1.34 0.00 0.00 72.50 72.42 2gmi s THR 108 CO 0.56 -0.44 2.19 0.24 -0.54 0.00 0.00 174.62 176.62 2gmi h MET 109 N 2.63 0.00 0.11 3.99 2.86 -1.98 0.13 114.93 122.66 2gmi h MET 109 Ca -0.33 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.31 2gmi h MET 109 Cb 1.22 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.88 2gmi h MET 109 CO 0.52 0.00 -0.05 1.49 1.06 0.00 0.00 176.91 179.92 2gmi h GLU 110 N 0.00 -0.14 -0.36 1.72 4.81 -1.99 -1.66 114.58 116.95 2gmi h GLU 110 Ca 0.04 0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.25 2gmi h GLU 110 Cb 0.25 0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.65 2gmi h GLU 110 CO -0.00 0.30 0.09 1.79 -0.73 0.00 0.00 179.01 180.46 2gmi h THR 111 N -0.66 1.17 0.13 0.32 1.35 -1.56 -1.84 112.91 111.82 2gmi h THR 111 Ca -0.02 -0.59 -0.01 0.00 -0.55 0.00 0.00 66.41 65.25 2gmi h THR 111 Cb 0.51 0.80 0.00 0.00 -1.73 0.00 0.00 68.15 67.73 2gmi h THR 111 CO 0.02 0.21 -0.06 0.25 -0.25 0.00 0.00 175.52 175.70 2gmi h LEU 112 N 0.52 -0.15 -0.92 3.87 5.85 -0.75 -0.68 115.31 123.04 2gmi h LEU 112 Ca 0.12 -0.11 -0.03 0.00 0.84 0.00 0.00 57.88 58.70 2gmi h LEU 112 Cb 0.20 0.04 -0.04 0.00 0.37 0.00 0.00 40.66 41.23 2gmi h LEU 112 CO -0.00 0.02 0.35 -0.07 -0.34 0.00 0.00 178.44 178.40 2gmi h LEU 113 N -0.31 1.03 0.65 2.25 3.38 -1.09 -0.22 115.31 121.00 2gmi h LEU 113 Ca -0.02 -0.13 -0.03 0.00 0.09 0.00 0.00 57.88 57.79 2gmi h LEU 113 Cb 0.25 -0.27 0.01 0.00 0.09 0.00 0.00 40.66 40.74 2gmi h LEU 113 CO 0.03 0.88 -0.31 -0.07 0.09 0.00 0.00 178.44 179.06 2gmi h LEU 114 N 1.12 -0.73 -1.80 1.67 3.38 -1.21 0.28 115.31 118.01 2gmi h LEU 114 Ca 0.27 0.03 0.30 0.00 0.09 0.00 0.00 57.88 58.56 2gmi h LEU 114 Cb 0.14 0.19 -0.04 0.00 0.09 0.00 0.00 40.66 41.04 2gmi h LEU 114 CO -0.03 -0.49 0.87 0.44 0.09 0.00 0.00 178.44 179.32 2gmi h ASP 115 N -0.93 0.00 0.89 -0.43 5.19 -1.04 1.92 116.42 122.02 2gmi h ASP 115 Ca -0.09 0.00 -0.22 0.00 -0.62 0.00 0.00 57.03 56.10 2gmi h ASP 115 Cb 0.67 0.00 -0.03 0.00 0.18 0.00 0.00 39.33 40.14 2gmi h ASP 115 CO 0.15 0.00 -1.18 0.25 -3.12 0.00 0.00 179.24 175.34 2gmi h LEU 116 N 0.00 0.00 -0.21 1.55 5.85 -0.51 -3.25 115.31 118.73 2gmi h LEU 116 Ca 0.48 0.00 -0.21 0.00 0.84 0.00 0.00 57.88 59.00 2gmi h LEU 116 Cb 2.22 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 43.24 2gmi h LEU 116 CO -0.01 0.91 -0.93 -0.09 -0.34 0.00 0.00 178.44 177.99 2gmi h ARG 117 N 0.00 0.20 -0.29 1.25 2.43 0.66 -3.23 114.38 115.40 2gmi h ARG 117 Ca -0.10 -0.24 0.07 0.00 -0.81 0.00 0.00 59.98 58.90 2gmi h ARG 117 Cb 1.78 0.07 -0.07 0.00 -0.42 0.00 0.00 29.97 31.33 2gmi h ARG 117 CO 0.10 0.99 -0.22 0.87 -1.51 0.00 0.00 179.97 180.20 2gmi h LYS 118 N 0.11 -0.19 0.00 0.20 1.57 -1.22 0.53 116.57 117.56 2gmi h LYS 118 Ca -0.05 0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 2gmi h LYS 118 Cb 1.57 0.04 0.00 0.00 0.08 0.00 0.00 32.23 33.93 2gmi h LYS 118 CO 0.14 -0.13 0.17 0.39 -0.57 0.00 0.00 179.45 179.46 2gmi n GLU 119 N -5.37 0.09 -2.36 3.15 -0.58 -1.22 -4.09 120.64 110.26 2gmi n GLU 119 Ca 0.00 0.55 -0.26 0.00 -0.42 0.00 0.00 57.16 57.04 2gmi n GLU 119 Cb 0.28 -1.96 0.13 0.00 -0.57 0.00 0.00 31.44 29.32 2gmi n GLU 119 CO 0.00 0.00 0.00 -1.64 -0.48 0.00 0.00 177.13 175.01 2gmi s MET 120 N -3.28 1.37 0.00 3.49 -1.94 0.18 -3.11 119.30 116.01 2gmi s MET 120 Ca -0.01 -0.84 0.00 0.00 -1.71 0.00 0.00 55.69 53.12 2gmi s MET 120 Cb 0.04 -2.17 0.00 0.00 2.01 0.00 0.00 34.83 34.71 2gmi s MET 120 CO 0.12 -1.75 0.00 0.00 -0.01 0.00 0.00 175.02 173.38 2gmi n ALA 121 N -3.14 0.00 -1.21 3.03 0.00 -1.26 -4.23 120.51 113.71 2gmi n ALA 121 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.59 2gmi n ALA 121 Cb 0.60 -0.80 0.00 0.00 0.00 0.00 0.00 19.45 19.25 2gmi n ALA 121 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 2gmi n THR 122 N -1.99 -0.01 -1.11 0.00 5.66 -1.18 -4.19 114.28 111.46 2gmi n THR 122 Ca 0.00 0.00 -0.14 0.00 -3.05 0.00 0.00 64.05 60.86 2gmi n THR 122 Cb 0.00 -0.91 -0.07 0.00 -1.55 0.00 0.00 70.33 67.81 2gmi n THR 122 CO 0.00 0.00 0.00 -2.65 -3.05 0.00 0.00 175.07 169.37 2gmi n PRO 123 N 1.80 0.03 0.00 1.09 -0.02 -1.26 -3.30 135.00 133.35 2gmi n PRO 123 Ca 0.00 -0.82 0.00 0.00 -2.02 0.00 0.00 63.50 60.66 2gmi n PRO 123 Cb 0.00 -2.38 0.00 0.00 -0.02 0.00 0.00 33.50 31.10 2gmi n PRO 123 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2gmi n ALA 124 N 10.95 0.00 0.00 3.55 0.00 -1.26 -4.95 120.51 128.79 2gmi n ALA 124 Ca 0.24 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.68 2gmi n ALA 124 Cb 0.43 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.88 2gmi n ALA 124 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 2gmi n ASN 125 N 0.00 1.10 -0.02 0.00 2.04 -1.21 -5.02 115.26 112.16 2gmi n ASN 125 Ca 0.00 -0.21 0.00 0.00 -0.44 0.00 0.00 54.58 53.93 2gmi n ASN 125 Cb 0.00 0.64 0.00 0.00 -2.53 0.00 0.00 39.78 37.89 2gmi n ASN 125 CO 0.00 0.00 0.00 1.17 -0.44 0.00 0.00 177.26 177.99 2gmi n LYS 126 N -0.75 0.00 -0.06 -3.83 4.81 -1.26 -4.62 118.16 112.45 2gmi n LYS 126 Ca 0.00 0.00 0.01 0.00 -0.87 0.00 0.00 58.31 57.45 2gmi n LYS 126 Cb 0.00 -0.01 0.04 0.00 0.02 0.00 0.00 35.03 35.08 2gmi n LYS 126 CO 0.00 0.00 0.00 1.63 1.17 0.00 0.00 177.40 180.20 2gmi n LYS 127 N 0.02 1.27 0.00 1.64 4.76 -1.26 -4.74 118.16 119.86 2gmi n LYS 127 Ca 0.00 -0.32 0.00 0.00 -2.87 0.00 0.00 58.31 55.12 2gmi n LYS 127 Cb 0.00 -1.23 0.00 0.00 -1.84 0.00 0.00 35.03 31.96 2gmi n LYS 127 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 2gmi n LEU 128 N -0.15 0.00 0.00 -0.35 4.32 -1.26 -4.34 117.00 115.21 2gmi n LEU 128 Ca 0.03 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 56.02 2gmi n LEU 128 Cb 0.16 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 41.96 2gmi n LEU 128 CO 0.02 0.00 0.00 -1.14 -1.22 0.00 0.00 177.39 175.05 2gmi n ARG 129 N 0.00 0.00 -4.04 3.23 0.63 -1.26 -5.17 116.66 110.05 2gmi n ARG 129 Ca 0.00 0.00 -0.33 0.00 -0.92 0.00 0.00 57.85 56.60 2gmi n ARG 129 Cb 0.00 0.00 -0.06 0.00 0.45 0.00 0.00 32.46 32.85 2gmi n ARG 129 CO 0.00 0.00 0.00 -0.65 -2.51 0.00 0.00 177.63 174.47 2gmi s GLN 130 N -0.67 3.18 0.18 -0.14 -1.52 -1.26 -4.83 119.66 114.60 2gmi s GLN 130 Ca 0.00 -0.44 -0.09 0.00 -1.95 0.00 0.00 55.36 52.88 2gmi s GLN 130 Cb 0.00 -2.93 0.07 0.00 -0.22 0.00 0.00 33.01 29.93 2gmi s GLN 130 CO 0.00 0.66 1.65 -1.35 -0.25 0.00 0.00 175.29 176.00 2gmi h PRO 131 N 4.00 1.08 0.00 2.91 0.11 -1.92 -3.47 132.00 134.72 2gmi h PRO 131 Ca -0.49 -0.32 0.00 0.00 0.11 0.00 0.00 66.00 65.30 2gmi h PRO 131 Cb 1.18 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.19 2gmi h PRO 131 CO 0.64 1.03 0.00 1.17 -0.21 0.00 0.00 178.00 180.63 2gmi n LYS 132 N -4.21 0.00 0.00 1.05 4.81 -1.26 -4.81 118.16 113.74 2gmi n LYS 132 Ca 0.03 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.47 2gmi n LYS 132 Cb 0.33 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.38 2gmi n LYS 132 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 2gmi n GLU 133 N 14.00 0.00 -0.31 1.64 1.02 -1.26 -2.86 120.64 132.87 2gmi n GLU 133 Ca 0.00 0.00 0.03 0.00 -0.02 0.00 0.00 57.16 57.17 2gmi n GLU 133 Cb 0.00 0.00 0.16 0.00 -0.02 0.00 0.00 31.44 31.58 2gmi n GLU 133 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2gmi n GLY 134 N 0.00 1.69 3.67 0.62 0.00 -1.26 -4.87 105.19 105.04 2gmi n GLY 134 Ca 0.00 -0.36 -0.42 0.00 0.00 0.00 0.00 46.02 45.24 2gmi n GLY 134 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2gmi s GLU 135 N -1.68 4.19 0.03 1.61 2.02 -1.14 -4.94 118.70 118.80 2gmi s GLU 135 Ca 0.21 2.20 0.06 0.00 0.02 0.00 0.00 54.97 57.46 2gmi s GLU 135 Cb 0.15 -3.88 -0.02 0.00 0.10 0.00 0.00 34.13 30.48 2gmi s GLU 135 CO 0.08 -0.80 -0.18 -0.08 0.02 0.00 0.00 175.26 174.30 2gmi s THR 136 N 3.65 1.41 -2.00 3.63 -1.32 -1.26 0.02 115.64 119.77 2gmi s THR 136 Ca 0.73 -1.03 0.03 0.00 -1.21 0.00 0.00 61.69 60.21 2gmi s THR 136 Cb -0.34 -1.23 0.09 0.00 -1.51 0.00 0.00 72.50 69.51 2gmi s THR 136 CO 0.30 0.17 0.67 0.49 -2.21 0.00 0.00 174.62 174.04