#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1cng s TRP 5 N 0.00 2.56 0.00 4.41 1.48 -1.26 -4.86 118.94 121.26 1cng s TRP 5 Ca 0.00 1.56 0.00 0.00 -1.06 0.00 0.00 56.10 56.60 1cng s TRP 5 Cb 0.00 -3.12 0.00 0.00 -1.16 0.00 0.00 33.47 29.19 1cng s TRP 5 CO 0.00 -1.80 0.00 0.41 -4.06 0.00 0.00 176.95 171.50 1cng n GLY 6 N -0.84 2.42 0.15 3.67 0.00 0.07 -5.02 105.19 105.64 1cng n GLY 6 Ca 0.10 -0.47 0.08 0.00 0.00 0.00 0.00 46.02 45.72 1cng n GLY 6 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1cng n TYR 7 N 0.00 0.00 -2.52 1.61 4.01 -1.26 -3.75 117.16 115.26 1cng n TYR 7 Ca 0.00 -0.79 -0.24 0.00 -0.16 0.00 0.00 57.90 56.72 1cng n TYR 7 Cb 0.00 -0.13 0.10 0.00 -0.31 0.00 0.00 39.34 39.00 1cng n TYR 7 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 1cng s GLY 8 N -2.43 1.77 0.39 2.72 0.00 -1.26 -4.68 107.32 103.82 1cng s GLY 8 Ca 0.24 -1.57 0.05 0.00 0.00 0.00 0.00 44.72 43.44 1cng s GLY 8 CO 0.02 -1.04 2.04 0.50 0.00 0.00 0.00 173.10 174.61 1cng h LYS 9 N -0.53 0.64 0.00 2.90 1.79 -1.97 0.45 116.57 119.85 1cng h LYS 9 Ca -0.38 -0.04 0.00 0.00 -2.18 0.00 0.00 60.65 58.04 1cng h LYS 9 Cb 1.27 -0.14 0.00 0.00 -1.58 0.00 0.00 32.23 31.78 1cng h LYS 9 CO 0.43 0.43 -0.84 0.72 -1.08 0.00 0.00 179.45 179.12 1cng n HIS 10 N -4.45 0.04 -1.46 -1.35 8.25 -1.26 -4.45 115.22 110.53 1cng n HIS 10 Ca 0.04 0.01 0.00 0.00 -0.26 0.00 0.00 57.72 57.51 1cng n HIS 10 Cb 0.06 -0.16 0.00 0.00 1.12 0.00 0.00 29.99 31.01 1cng n HIS 10 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 1cng n ASN 11 N -1.58 0.04 -2.94 0.41 6.94 -1.10 -4.97 115.26 112.07 1cng n ASN 11 Ca 0.04 -1.50 -0.13 0.00 -0.02 0.00 0.00 54.58 52.97 1cng n ASN 11 Cb 0.35 -0.10 0.11 0.00 -2.36 0.00 0.00 39.78 37.78 1cng n ASN 11 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1cng n GLY 12 N -0.02 -2.18 0.35 4.83 0.00 0.16 -0.76 105.19 107.58 1cng n GLY 12 Ca 0.00 -1.54 0.25 0.00 0.00 0.00 0.00 46.02 44.73 1cng n GLY 12 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1cng h PRO 13 N 0.00 0.30 0.00 1.61 0.11 -1.84 0.38 132.00 132.55 1cng h PRO 13 Ca -0.19 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.90 1cng h PRO 13 Cb 0.55 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 31.60 1cng h PRO 13 CO 0.13 0.20 0.00 0.93 -0.21 0.00 0.00 178.00 179.04 1cng h GLU 14 N 0.31 0.00 0.00 1.05 4.39 -1.94 -2.84 114.58 115.55 1cng h GLU 14 Ca 0.73 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.43 1cng h GLU 14 Cb 1.75 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.40 1cng h GLU 14 CO -0.57 0.00 -1.86 0.72 -1.16 0.00 0.00 179.01 176.14 1cng n HIS 15 N -2.50 0.08 -0.30 4.33 8.25 0.12 -4.60 115.22 120.60 1cng n HIS 15 Ca 0.01 0.02 0.21 0.00 -0.26 0.00 0.00 57.72 57.70 1cng n HIS 15 Cb 0.19 -0.51 0.49 0.00 1.12 0.00 0.00 29.99 31.28 1cng n HIS 15 CO 0.00 0.00 0.00 -1.49 0.64 0.00 0.00 176.34 175.49 1cng h TRP 16 N 0.00 0.65 -0.54 4.41 6.55 -1.46 -2.26 115.95 123.30 1cng h TRP 16 Ca 0.00 0.02 0.15 0.00 0.95 0.00 0.00 58.89 60.01 1cng h TRP 16 Cb 0.97 -0.19 -0.02 0.00 -0.86 0.00 0.00 29.16 29.06 1cng h TRP 16 CO 0.00 0.11 0.39 1.12 -1.05 0.00 0.00 178.44 179.00 1cng h HIS 17 N 0.43 0.04 -0.57 0.49 2.07 -1.79 0.83 115.15 116.66 1cng h HIS 17 Ca 0.55 0.00 -0.02 0.00 -2.85 0.00 0.00 60.37 58.05 1cng h HIS 17 Cb 1.35 -0.01 -0.03 0.00 2.57 0.00 0.00 27.41 31.29 1cng h HIS 17 CO -0.00 0.02 0.27 0.87 -3.07 0.00 0.00 177.93 176.02 1cng h LYS 18 N 0.04 0.80 0.00 5.12 1.57 -1.76 -2.28 116.57 120.06 1cng h LYS 18 Ca 0.26 -0.10 -0.10 0.00 -1.87 0.00 0.00 60.65 58.84 1cng h LYS 18 Cb 0.98 -0.15 -0.02 0.00 0.08 0.00 0.00 32.23 33.12 1cng h LYS 18 CO -0.01 0.62 -2.06 -0.25 -0.57 0.00 0.00 179.45 177.18 1cng n ASP 19 N -4.36 0.25 -3.62 0.86 8.00 -0.80 -4.74 116.55 112.14 1cng n ASP 19 Ca 0.05 0.00 -0.29 0.00 0.71 0.00 0.00 54.79 55.26 1cng n ASP 19 Cb 0.13 1.66 -0.12 0.00 -0.02 0.00 0.00 41.12 42.77 1cng n ASP 19 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 1cng s PHE 20 N -3.15 1.79 0.52 1.24 0.08 0.22 -4.98 117.98 113.70 1cng s PHE 20 Ca -0.08 -2.41 0.25 0.00 0.12 0.00 0.00 56.93 54.81 1cng s PHE 20 Cb 0.11 -1.61 1.38 0.00 -0.57 0.00 0.00 43.02 42.33 1cng s PHE 20 CO 0.84 -0.77 1.99 -1.35 -0.10 0.00 0.00 175.22 175.83 1cng h PRO 21 N 6.30 0.03 0.00 0.24 0.11 -1.65 -0.99 132.00 136.04 1cng h PRO 21 Ca 0.10 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.20 1cng h PRO 21 Cb 0.90 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.01 1cng h PRO 21 CO 0.45 0.02 0.06 1.51 -0.21 0.00 0.00 178.00 179.84 1cng n ILE 22 N -4.38 1.09 0.10 4.15 0.13 -1.26 -1.77 119.36 117.41 1cng n ILE 22 Ca 0.10 0.70 0.19 0.00 -1.10 0.00 0.00 62.75 62.64 1cng n ILE 22 Cb 0.61 -1.70 0.74 0.00 -0.84 0.00 0.00 39.64 38.45 1cng n ILE 22 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 1cng h ALA 23 N 1.82 2.18 -0.60 1.51 0.00 -1.50 0.36 119.26 123.02 1cng h ALA 23 Ca 0.00 -0.01 -0.18 0.00 0.00 0.00 0.00 54.91 54.72 1cng h ALA 23 Cb 0.13 0.03 -0.11 0.00 0.00 0.00 0.00 17.79 17.84 1cng h ALA 23 CO 0.00 -0.51 0.18 1.63 0.00 0.00 0.00 179.25 180.54 1cng n LYS 24 N -4.06 3.26 -0.64 0.00 5.02 -0.73 -4.97 118.16 116.05 1cng n LYS 24 Ca 0.06 -3.06 -0.18 0.00 -2.02 0.00 0.00 58.31 53.11 1cng n LYS 24 Cb 0.50 -2.09 0.15 0.00 -0.02 0.00 0.00 35.03 33.57 1cng n LYS 24 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1cng n GLY 25 N -0.40 -2.59 0.06 0.72 0.00 0.13 -5.00 105.19 98.11 1cng n GLY 25 Ca 0.37 -1.48 -0.07 0.00 0.00 0.00 0.00 46.02 44.83 1cng n GLY 25 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1cng h GLU 26 N 0.00 0.00 -1.98 1.61 4.39 -1.95 -3.38 114.58 113.26 1cng h GLU 26 Ca -0.24 0.00 -0.55 0.00 0.34 0.00 0.00 59.36 58.91 1cng h GLU 26 Cb 0.74 0.00 -0.41 0.00 -0.10 0.00 0.00 28.75 28.98 1cng h GLU 26 CO 0.16 0.92 -0.82 2.89 -1.16 0.00 0.00 179.01 181.00 1cng n ARG 27 N -3.30 2.63 -2.94 2.33 1.85 -1.26 -4.68 116.66 111.28 1cng n ARG 27 Ca -0.03 -4.35 -0.31 0.00 -1.00 0.00 0.00 57.85 52.16 1cng n ARG 27 Cb 0.96 -2.05 -0.04 0.00 -1.05 0.00 0.00 32.46 30.28 1cng n ARG 27 CO 0.00 0.00 0.00 -0.65 -0.01 0.00 0.00 177.63 176.97 1cng s GLN 28 N -3.24 3.85 0.19 2.89 -1.52 -1.26 -2.45 119.66 118.12 1cng s GLN 28 Ca 0.45 0.53 0.08 0.00 -1.95 0.00 0.00 55.36 54.47 1cng s GLN 28 Cb 0.33 -2.40 -0.05 0.00 -0.22 0.00 0.00 33.01 30.67 1cng s GLN 28 CO -0.12 0.02 -0.15 -1.12 -0.25 0.00 0.00 175.29 173.67 1cng s SER 29 N -2.88 2.51 0.93 5.90 0.01 -1.26 -4.64 113.70 114.26 1cng s SER 29 Ca 0.52 -0.99 -0.11 0.00 1.31 0.00 0.00 55.95 56.68 1cng s SER 29 Cb -0.10 -0.13 0.18 0.00 0.21 0.00 0.00 66.02 66.18 1cng s SER 29 CO 0.27 -0.16 1.12 -0.81 0.41 0.00 0.00 173.24 174.07 1cng n PRO 30 N -0.26 -0.89 -4.07 12.44 -0.04 -1.26 -4.63 135.00 136.29 1cng n PRO 30 Ca -0.09 -2.00 -0.09 0.00 -0.04 0.00 0.00 63.50 61.28 1cng n PRO 30 Cb 0.60 -1.08 -0.09 0.00 -0.04 0.00 0.00 33.50 32.89 1cng n PRO 30 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1cng s VAL 31 N -3.41 0.12 0.01 0.52 -7.23 -1.26 0.70 120.40 109.85 1cng s VAL 31 Ca 0.66 -1.72 -0.23 0.00 -1.81 0.00 0.00 61.98 58.88 1cng s VAL 31 Cb -0.02 -1.84 -0.05 0.00 0.56 0.00 0.00 36.38 35.02 1cng s VAL 31 CO 0.46 -0.55 0.69 -0.62 -0.31 0.00 0.00 175.10 174.76 1cng s ASP 32 N -2.99 7.08 -0.47 4.85 2.15 -1.26 -3.41 116.67 122.61 1cng s ASP 32 Ca 0.18 1.29 -0.18 0.00 0.43 0.00 0.00 52.55 54.26 1cng s ASP 32 Cb 0.06 -2.42 0.05 0.00 -0.30 0.00 0.00 42.92 40.32 1cng s ASP 32 CO -0.02 0.02 0.55 -0.63 -0.17 0.00 0.00 175.17 174.92 1cng s ILE 33 N 0.05 4.98 -0.49 4.11 1.01 0.70 -4.93 121.20 126.64 1cng s ILE 33 Ca 0.35 -0.49 -0.25 0.00 0.00 0.00 0.00 60.65 60.27 1cng s ILE 33 Cb -0.19 -4.20 0.03 0.00 0.01 0.00 0.00 42.46 38.11 1cng s ILE 33 CO 0.20 -0.66 0.94 -0.62 0.00 0.00 0.00 174.94 174.79 1cng s ASP 34 N 2.39 6.46 0.58 3.58 -1.08 -1.26 0.09 116.67 127.42 1cng s ASP 34 Ca 0.13 -0.00 0.35 0.00 -0.52 0.00 0.00 52.55 52.51 1cng s ASP 34 Cb -0.19 -2.45 1.68 0.00 -1.46 0.00 0.00 42.92 40.50 1cng s ASP 34 CO 0.12 -1.11 2.11 0.71 0.52 0.00 0.00 175.17 177.53 1cng h THR 35 N 6.07 0.14 0.00 1.71 1.35 -1.95 -1.90 112.91 118.33 1cng h THR 35 Ca -0.25 -0.40 0.00 0.00 -0.55 0.00 0.00 66.41 65.22 1cng h THR 35 Cb 1.07 1.34 0.00 0.00 -1.73 0.00 0.00 68.15 68.83 1cng h THR 35 CO 1.05 0.04 -0.82 0.45 -0.25 0.00 0.00 175.52 175.99 1cng h HIS 36 N 0.00 0.00 0.00 4.73 3.86 -2.03 -3.33 115.15 118.38 1cng h HIS 36 Ca -0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 1cng h HIS 36 Cb 0.34 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.81 1cng h HIS 36 CO 0.00 0.00 -1.57 2.41 0.86 0.00 0.00 177.93 179.63 1cng n THR 37 N -2.50 0.07 -1.98 2.45 -1.04 -0.97 -4.92 114.28 105.39 1cng n THR 37 Ca 0.01 -0.36 -0.42 0.00 -2.04 0.00 0.00 64.05 61.25 1cng n THR 37 Cb 0.51 0.22 -0.03 0.00 -1.82 0.00 0.00 70.33 69.21 1cng n THR 37 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1cng s ALA 38 N -3.35 3.71 -0.29 2.41 0.00 -0.76 -4.85 121.76 118.63 1cng s ALA 38 Ca -0.02 1.33 -0.19 0.00 0.00 0.00 0.00 51.96 53.08 1cng s ALA 38 Cb 0.14 -3.59 -0.01 0.00 0.00 0.00 0.00 23.12 19.65 1cng s ALA 38 CO 0.88 -0.75 0.59 0.21 0.00 0.00 0.00 175.76 176.68 1cng s LYS 39 N 0.67 3.93 0.05 0.00 2.47 -0.49 -4.77 119.74 121.60 1cng s LYS 39 Ca 0.66 0.27 -0.30 0.00 -1.56 0.00 0.00 55.97 55.04 1cng s LYS 39 Cb -0.43 -3.71 -0.08 0.00 -1.46 0.00 0.00 37.83 32.16 1cng s LYS 39 CO 0.35 -0.51 1.63 -0.47 0.16 0.00 0.00 175.35 176.51 1cng s TYR 40 N 2.50 2.40 -0.37 4.03 5.04 -1.26 -0.51 117.35 129.17 1cng s TYR 40 Ca 0.23 0.35 0.03 0.00 -2.44 0.00 0.00 57.07 55.24 1cng s TYR 40 Cb -0.15 -3.93 0.11 0.00 0.35 0.00 0.00 41.96 38.33 1cng s TYR 40 CO 0.11 -3.74 0.10 0.34 -1.34 0.00 0.00 175.55 171.02 1cng s ASP 41 N 2.48 4.77 0.00 4.32 -1.08 0.09 -4.86 116.67 122.39 1cng s ASP 41 Ca 0.73 -2.26 0.05 0.00 -0.52 0.00 0.00 52.55 50.54 1cng s ASP 41 Cb -0.38 -1.66 0.22 0.00 -1.46 0.00 0.00 42.92 39.64 1cng s ASP 41 CO 0.31 -0.38 1.06 -0.81 0.52 0.00 0.00 175.17 175.87 1cng n PRO 42 N 4.13 0.04 0.00 4.34 -0.04 -1.26 -1.47 135.00 140.74 1cng n PRO 42 Ca 0.04 0.32 0.13 0.00 -0.04 0.00 0.00 63.50 63.95 1cng n PRO 42 Cb 0.41 -1.50 0.36 0.00 -0.04 0.00 0.00 33.50 32.73 1cng n PRO 42 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1cng n SER 43 N -1.38 0.83 -4.69 3.54 3.41 -1.26 -4.86 113.62 109.21 1cng n SER 43 Ca 0.02 -0.68 -0.42 0.00 -0.26 0.00 0.00 58.87 57.53 1cng n SER 43 Cb 0.04 0.14 -0.03 0.00 -0.26 0.00 0.00 64.21 64.11 1cng n SER 43 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1cng s LEU 44 N -2.64 4.31 0.61 1.04 1.02 -0.54 -5.01 118.68 117.46 1cng s LEU 44 Ca 0.21 2.04 -0.12 0.00 0.02 0.00 0.00 54.13 56.28 1cng s LEU 44 Cb 0.19 -3.56 -0.04 0.00 0.02 0.00 0.00 46.19 42.79 1cng s LEU 44 CO 0.56 -0.68 1.03 -0.54 0.02 0.00 0.00 176.35 176.74 1cng s LYS 45 N 2.28 3.59 0.59 1.70 1.02 -1.23 -4.97 119.74 122.72 1cng s LYS 45 Ca 0.62 0.83 -0.16 0.00 0.02 0.00 0.00 55.97 57.27 1cng s LYS 45 Cb -0.30 -2.08 -0.04 0.00 -0.52 0.00 0.00 37.83 34.90 1cng s LYS 45 CO 0.25 -0.58 1.07 -1.25 -0.92 0.00 0.00 175.35 173.93 1cng s PRO 46 N -4.91 3.25 0.48 -1.68 0.04 -1.26 -2.72 135.00 128.20 1cng s PRO 46 Ca 0.56 1.31 -0.22 0.00 0.04 0.00 0.00 61.00 62.69 1cng s PRO 46 Cb -0.11 -2.02 -0.07 0.00 0.04 0.00 0.00 34.50 32.34 1cng s PRO 46 CO 0.49 -0.88 1.12 -0.51 0.04 0.00 0.00 177.00 177.26 1cng s LEU 47 N -4.40 3.93 -0.29 -3.56 1.43 -1.26 -1.65 118.68 112.88 1cng s LEU 47 Ca 0.66 2.17 0.02 0.00 -1.03 0.00 0.00 54.13 55.94 1cng s LEU 47 Cb -0.18 -4.38 0.08 0.00 0.03 0.00 0.00 46.19 41.74 1cng s LEU 47 CO 0.35 -0.92 0.01 -0.55 0.23 0.00 0.00 176.35 175.47 1cng s SER 48 N -1.61 4.26 -0.38 2.29 0.15 0.31 -4.88 113.70 113.85 1cng s SER 48 Ca 0.66 -1.63 -0.10 0.00 0.70 0.00 0.00 55.95 55.58 1cng s SER 48 Cb -0.24 -1.31 0.04 0.00 -1.71 0.00 0.00 66.02 62.80 1cng s SER 48 CO 0.29 -0.32 0.20 -0.69 1.20 0.00 0.00 173.24 173.92 1cng s VAL 49 N 1.24 4.35 -0.64 4.45 1.01 -1.26 -0.91 120.40 128.65 1cng s VAL 49 Ca 0.03 -1.01 -0.04 0.00 0.00 0.00 0.00 61.98 60.95 1cng s VAL 49 Cb -0.19 -3.48 0.17 0.00 0.00 0.00 0.00 36.38 32.88 1cng s VAL 49 CO -0.11 -0.27 0.47 -0.44 0.00 0.00 0.00 175.10 174.75 1cng s SER 50 N 1.62 5.39 -0.07 3.32 0.01 -0.30 -4.88 113.70 118.79 1cng s SER 50 Ca 0.01 -2.81 0.13 0.00 1.31 0.00 0.00 55.95 54.59 1cng s SER 50 Cb -0.20 -1.89 0.38 0.00 0.21 0.00 0.00 66.02 64.52 1cng s SER 50 CO 0.05 -0.40 1.31 -1.22 0.41 0.00 0.00 173.24 173.39 1cng n TYR 51 N 3.57 0.62 0.30 2.43 4.01 -1.26 -1.43 117.16 125.39 1cng n TYR 51 Ca 0.08 -0.65 0.17 0.00 -0.16 0.00 0.00 57.90 57.34 1cng n TYR 51 Cb 0.39 -0.14 0.74 0.00 -0.31 0.00 0.00 39.34 40.01 1cng n TYR 51 CO 0.00 0.00 0.00 0.38 -0.46 0.00 0.00 176.86 176.78 1cng h ASP 52 N 1.82 0.00 -0.23 7.72 2.03 -1.90 -2.74 116.42 123.12 1cng h ASP 52 Ca 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 1cng h ASP 52 Cb 1.00 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.50 1cng h ASP 52 CO 0.08 0.00 0.00 1.67 -1.03 0.00 0.00 179.24 179.96 1cng n GLN 53 N -2.91 2.72 -1.89 4.15 -0.06 -1.25 -5.04 117.38 113.11 1cng n GLN 53 Ca 0.00 -2.72 -0.40 0.00 -2.00 0.00 0.00 57.00 51.89 1cng n GLN 53 Cb 0.24 -1.74 0.01 0.00 -4.06 0.00 0.00 30.24 24.70 1cng n GLN 53 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 1cng s ALA 54 N -2.64 3.27 -0.33 1.69 0.00 -1.04 -4.52 121.76 118.20 1cng s ALA 54 Ca 0.38 1.39 0.01 0.00 0.00 0.00 0.00 51.96 53.75 1cng s ALA 54 Cb 0.31 -3.56 0.10 0.00 0.00 0.00 0.00 23.12 19.97 1cng s ALA 54 CO 0.09 -1.06 0.09 0.99 0.00 0.00 0.00 175.76 175.87 1cng s THR 55 N -1.22 1.38 0.41 0.00 2.01 -1.26 -4.93 115.64 112.04 1cng s THR 55 Ca 0.59 -1.78 -0.22 0.00 0.31 0.00 0.00 61.69 60.59 1cng s THR 55 Cb -0.42 -2.03 -0.11 0.00 0.01 0.00 0.00 72.50 69.95 1cng s THR 55 CO 0.54 -0.66 0.95 -0.94 -0.69 0.00 0.00 174.62 173.83 1cng s SER 56 N 1.32 6.98 -0.02 3.53 1.04 -1.26 -0.72 113.70 124.57 1cng s SER 56 Ca 0.11 1.73 -0.02 0.00 0.48 0.00 0.00 55.95 58.25 1cng s SER 56 Cb -0.18 -2.55 -0.01 0.00 0.10 0.00 0.00 66.02 63.38 1cng s SER 56 CO -0.18 -0.33 -0.05 0.18 0.98 0.00 0.00 173.24 173.84 1cng n LEU 57 N -0.43 0.44 -3.84 2.42 4.77 0.48 -4.15 117.00 116.68 1cng n LEU 57 Ca 0.06 0.07 -0.09 0.00 -0.03 0.00 0.00 56.01 56.02 1cng n LEU 57 Cb 0.53 -0.16 -0.04 0.00 -2.33 0.00 0.00 43.42 41.42 1cng n LEU 57 CO 0.39 -0.07 0.29 0.00 -1.33 0.00 0.00 177.39 176.66 1cng s ARG 58 N -2.08 1.52 -0.04 3.23 1.70 -1.22 -0.72 118.95 121.34 1cng s ARG 58 Ca -0.05 -1.01 0.04 0.00 -0.47 0.00 0.00 55.73 54.24 1cng s ARG 58 Cb 0.02 0.52 -0.00 0.00 -0.57 0.00 0.00 34.95 34.92 1cng s ARG 58 CO 0.06 -0.65 -0.16 -1.50 -1.08 0.00 0.00 175.30 171.97 1cng s ILE 59 N -3.93 1.34 0.03 4.99 2.07 -0.25 -0.40 121.20 125.05 1cng s ILE 59 Ca 0.14 -0.68 -0.04 0.00 -1.41 0.00 0.00 60.65 58.65 1cng s ILE 59 Cb -0.02 -1.15 -0.01 0.00 0.13 0.00 0.00 42.46 41.41 1cng s ILE 59 CO 0.03 0.39 0.07 -1.48 -1.91 0.00 0.00 174.94 172.04 1cng s LEU 60 N -0.03 1.88 -0.33 8.50 2.34 -0.37 -0.66 118.68 130.01 1cng s LEU 60 Ca -0.02 -0.47 -0.12 0.00 0.06 0.00 0.00 54.13 53.58 1cng s LEU 60 Cb -0.10 0.49 -0.02 0.00 -0.56 0.00 0.00 46.19 45.99 1cng s LEU 60 CO 0.01 -0.43 0.23 0.21 -1.06 0.00 0.00 176.35 175.31 1cng s ASN 61 N -1.83 6.03 -0.06 1.48 3.84 -0.48 -1.01 114.94 122.91 1cng s ASN 61 Ca -0.09 -0.36 0.20 0.00 0.21 0.00 0.00 52.86 52.82 1cng s ASN 61 Cb -0.04 -2.13 0.69 0.00 -0.55 0.00 0.00 41.25 39.22 1cng s ASN 61 CO -0.02 -0.20 1.59 -0.46 -2.79 0.00 0.00 177.10 175.21 1cng n ASN 62 N 5.09 4.42 0.00 -4.21 0.23 -0.81 -0.87 115.26 119.11 1cng n ASN 62 Ca -0.13 -2.25 0.00 0.00 -0.53 0.00 0.00 54.58 51.67 1cng n ASN 62 Cb 0.50 -0.54 0.00 0.00 -2.08 0.00 0.00 39.78 37.66 1cng n ASN 62 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1cng n GLY 63 N 1.35 3.00 0.00 4.83 0.00 -1.26 -4.77 105.19 108.34 1cng n GLY 63 Ca 0.25 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.27 1cng n GLY 63 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 1cng n HIS 64 N -2.00 0.00 -3.75 1.61 1.44 -1.26 -4.69 115.22 106.57 1cng n HIS 64 Ca 0.00 0.00 -0.01 0.00 -2.01 0.00 0.00 57.72 55.70 1cng n HIS 64 Cb 0.00 0.00 0.01 0.00 0.12 0.00 0.00 29.99 30.12 1cng n HIS 64 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1cng n ALA 65 N -0.83 -1.51 -2.69 1.59 0.00 -1.26 -4.87 120.51 110.93 1cng n ALA 65 Ca 0.00 -0.48 -0.31 0.00 0.00 0.00 0.00 53.44 52.64 1cng n ALA 65 Cb 0.00 0.22 -0.16 0.00 0.00 0.00 0.00 19.45 19.51 1cng n ALA 65 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 1cng s PHE 66 N -3.57 2.38 -0.04 0.00 -0.12 -1.26 -1.93 117.98 113.43 1cng s PHE 66 Ca 0.13 -0.68 0.05 0.00 -0.05 0.00 0.00 56.93 56.38 1cng s PHE 66 Cb -0.01 -1.56 -0.02 0.00 -0.63 0.00 0.00 43.02 40.80 1cng s PHE 66 CO 0.02 -0.19 -0.17 -0.80 -0.05 0.00 0.00 175.22 174.02 1cng s ASN 67 N -0.21 3.80 -0.22 1.98 0.02 -0.18 -4.14 114.94 115.98 1cng s ASN 67 Ca -0.02 -0.26 -0.08 0.00 -1.02 0.00 0.00 52.86 51.48 1cng s ASN 67 Cb -0.13 -0.74 -0.04 0.00 0.02 0.00 0.00 41.25 40.36 1cng s ASN 67 CO 0.03 0.34 0.08 -0.69 0.02 0.00 0.00 177.10 176.88 1cng s VAL 68 N -0.69 4.67 0.05 1.60 1.01 -0.48 -1.23 120.40 125.33 1cng s VAL 68 Ca 0.11 -0.06 0.01 0.00 0.00 0.00 0.00 61.98 62.03 1cng s VAL 68 Cb -0.11 -3.16 -0.04 0.00 0.00 0.00 0.00 36.38 33.08 1cng s VAL 68 CO 0.00 0.38 0.16 -1.61 0.00 0.00 0.00 175.10 174.03 1cng s GLU 69 N 1.09 3.24 0.25 2.72 2.02 0.47 -2.14 118.70 126.35 1cng s GLU 69 Ca 0.05 -0.50 0.11 0.00 0.02 0.00 0.00 54.97 54.64 1cng s GLU 69 Cb -0.14 -2.94 -0.05 0.00 0.10 0.00 0.00 34.13 31.10 1cng s GLU 69 CO 0.04 0.61 -0.19 -0.06 0.02 0.00 0.00 175.26 175.68 1cng s PHE 70 N -1.42 2.11 -0.34 1.61 0.40 -0.46 -0.39 117.98 119.49 1cng s PHE 70 Ca 0.31 -0.41 -0.29 0.00 -0.60 0.00 0.00 56.93 55.95 1cng s PHE 70 Cb -0.13 -0.94 0.01 0.00 0.51 0.00 0.00 43.02 42.48 1cng s PHE 70 CO 0.24 0.59 1.21 0.34 0.70 0.00 0.00 175.22 178.29 1cng s ASP 71 N -3.38 6.74 -0.30 1.36 2.15 0.11 -4.85 116.67 118.50 1cng s ASP 71 Ca 0.27 1.03 0.08 0.00 0.43 0.00 0.00 52.55 54.36 1cng s ASP 71 Cb -0.04 -2.54 0.47 0.00 -0.30 0.00 0.00 42.92 40.51 1cng s ASP 71 CO 0.12 -1.05 1.37 -0.90 -0.17 0.00 0.00 175.17 174.54 1cng n ASP 72 N 7.45 3.33 -0.23 -0.34 5.75 -1.26 -4.62 116.55 126.63 1cng n ASP 72 Ca 0.13 -3.82 0.14 0.00 -0.01 0.00 0.00 54.79 51.24 1cng n ASP 72 Cb 0.47 -0.55 0.58 0.00 -1.03 0.00 0.00 41.12 40.59 1cng n ASP 72 CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55 1cng n SER 73 N -1.00 0.81 -3.91 -1.12 3.41 -1.26 -4.90 113.62 105.66 1cng n SER 73 Ca 0.35 -0.95 -0.09 0.00 -0.26 0.00 0.00 58.87 57.92 1cng n SER 73 Cb 0.90 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.81 1cng n SER 73 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 1cng s GLN 74 N -2.29 1.55 -1.24 4.33 -0.21 -1.26 -5.06 119.66 115.47 1cng s GLN 74 Ca 0.33 -1.11 -0.08 0.00 0.02 0.00 0.00 55.36 54.53 1cng s GLN 74 Cb 0.20 0.51 -0.07 0.00 1.00 0.00 0.00 33.01 34.65 1cng s GLN 74 CO 0.43 -0.66 2.52 -0.25 -2.12 0.00 0.00 175.29 175.21 1cng n ASP 75 N -0.38 6.73 -0.07 5.90 9.92 -1.26 -4.58 116.55 132.82 1cng n ASP 75 Ca -0.04 -2.44 -0.07 0.00 -0.53 0.00 0.00 54.79 51.71 1cng n ASP 75 Cb 0.61 -1.31 -0.05 0.00 -0.64 0.00 0.00 41.12 39.73 1cng n ASP 75 CO 0.00 0.00 0.00 0.11 0.13 0.00 0.00 177.20 177.44 1cng h LYS 76 N 5.68 0.00 -4.74 -1.24 1.57 -1.87 -3.44 116.57 112.53 1cng h LYS 76 Ca 0.67 0.00 -0.69 0.00 -1.87 0.00 0.00 60.65 58.77 1cng h LYS 76 Cb 0.22 0.00 -0.32 0.00 0.08 0.00 0.00 32.23 32.21 1cng h LYS 76 CO 1.60 0.39 -0.68 0.00 -0.57 0.00 0.00 179.45 180.18 1cng s ALA 77 N -2.47 2.86 0.22 3.86 0.00 -1.26 -3.91 121.76 121.06 1cng s ALA 77 Ca -0.11 -1.80 0.07 0.00 0.00 0.00 0.00 51.96 50.11 1cng s ALA 77 Cb 0.00 -2.00 -0.05 0.00 0.00 0.00 0.00 23.12 21.07 1cng s ALA 77 CO 0.30 -1.31 -0.11 0.14 0.00 0.00 0.00 175.76 174.77 1cng s VAL 78 N 1.26 1.64 -0.06 0.00 -7.23 -0.52 -1.36 120.40 114.14 1cng s VAL 78 Ca -0.04 -2.17 0.03 0.00 -1.81 0.00 0.00 61.98 57.99 1cng s VAL 78 Cb -0.20 -2.15 0.00 0.00 0.56 0.00 0.00 36.38 34.60 1cng s VAL 78 CO -0.01 -0.52 -0.16 -0.22 -0.31 0.00 0.00 175.10 173.88 1cng s LEU 79 N -3.34 1.84 0.32 1.32 0.20 -0.02 -1.15 118.68 117.85 1cng s LEU 79 Ca 0.24 -0.36 -0.00 0.00 0.69 0.00 0.00 54.13 54.70 1cng s LEU 79 Cb 0.01 -0.97 -0.01 0.00 -0.43 0.00 0.00 46.19 44.79 1cng s LEU 79 CO 0.08 0.11 0.39 -0.54 -0.29 0.00 0.00 176.35 176.09 1cng s LYS 80 N 0.31 1.77 2.90 1.98 1.02 -0.09 -2.03 119.74 125.61 1cng s LYS 80 Ca -0.10 -1.78 0.00 0.00 0.02 0.00 0.00 55.97 54.11 1cng s LYS 80 Cb -0.14 0.40 0.00 0.00 -0.52 0.00 0.00 37.83 37.57 1cng s LYS 80 CO 0.04 -0.70 0.00 0.41 -0.92 0.00 0.00 175.35 174.17 1cng n GLY 81 N -0.54 -0.32 7.00 -3.33 0.00 -1.26 -0.53 105.19 106.21 1cng n GLY 81 Ca 0.03 -1.05 0.00 0.00 0.00 0.00 0.00 46.02 44.99 1cng n GLY 81 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1cng n GLY 82 N 0.00 2.96 0.44 -0.02 0.00 -0.66 -1.22 105.19 106.69 1cng n GLY 82 Ca 0.00 -0.25 0.11 0.00 0.00 0.00 0.00 46.02 45.88 1cng n GLY 82 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1cng n PRO 83 N 14.00 1.58 -2.99 1.61 -0.04 -1.26 -3.55 135.00 144.35 1cng n PRO 83 Ca 0.00 -0.87 -0.30 0.00 -0.04 0.00 0.00 63.50 62.29 1cng n PRO 83 Cb 0.00 -1.39 -0.03 0.00 -0.04 0.00 0.00 33.50 32.03 1cng n PRO 83 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1cng s LEU 84 N -1.64 3.90 -0.11 1.53 1.43 -0.36 -5.09 118.68 118.34 1cng s LEU 84 Ca 0.33 1.02 0.03 0.00 -1.03 0.00 0.00 54.13 54.49 1cng s LEU 84 Cb 0.17 -3.88 0.00 0.00 0.03 0.00 0.00 46.19 42.51 1cng s LEU 84 CO 0.27 -0.34 -0.23 -1.81 0.23 0.00 0.00 176.35 174.47 1cng s ASP 85 N -3.14 3.08 0.00 2.29 1.01 -1.26 -4.42 116.67 114.23 1cng s ASP 85 Ca 0.49 -0.57 0.00 0.00 0.71 0.00 0.00 52.55 53.18 1cng s ASP 85 Cb -0.10 -1.41 0.00 0.00 1.01 0.00 0.00 42.92 42.41 1cng s ASP 85 CO 0.31 0.13 0.00 0.61 0.21 0.00 0.00 175.17 176.43 1cng n GLY 86 N 3.71 -2.62 3.82 0.21 0.00 -1.26 -4.92 105.19 104.13 1cng n GLY 86 Ca -0.19 -1.67 -0.36 0.00 0.00 0.00 0.00 46.02 43.80 1cng n GLY 86 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1cng s THR 87 N -0.76 5.43 -0.14 2.61 2.01 -1.26 -4.65 115.64 118.88 1cng s THR 87 Ca 0.00 0.19 0.02 0.00 0.31 0.00 0.00 61.69 62.20 1cng s THR 87 Cb 0.00 -3.40 0.00 0.00 0.01 0.00 0.00 72.50 69.11 1cng s THR 87 CO 0.00 0.56 -0.19 -0.31 -0.69 0.00 0.00 174.62 173.99 1cng s TYR 88 N -0.53 2.71 -0.04 4.92 1.51 -0.86 -1.46 117.35 123.60 1cng s TYR 88 Ca 0.12 -1.14 -0.17 0.00 -1.01 0.00 0.00 57.07 54.87 1cng s TYR 88 Cb -0.12 -1.84 -0.05 0.00 -0.11 0.00 0.00 41.96 39.85 1cng s TYR 88 CO 0.02 -0.51 0.48 1.03 -1.11 0.00 0.00 175.55 175.46 1cng s ARG 89 N 0.73 4.18 0.00 -0.62 0.52 -0.14 -0.84 118.95 122.79 1cng s ARG 89 Ca -0.08 0.50 -0.30 0.00 -0.52 0.00 0.00 55.73 55.33 1cng s ARG 89 Cb -0.16 -3.33 -0.05 0.00 0.52 0.00 0.00 34.95 31.93 1cng s ARG 89 CO 0.01 0.42 1.33 -1.17 0.02 0.00 0.00 175.30 175.91 1cng s LEU 90 N -0.24 4.32 -0.11 2.53 2.96 -0.46 -0.88 118.68 126.80 1cng s LEU 90 Ca 0.26 2.05 0.05 0.00 -0.22 0.00 0.00 54.13 56.27 1cng s LEU 90 Cb -0.17 -3.56 -0.10 0.00 0.50 0.00 0.00 46.19 42.86 1cng s LEU 90 CO 0.13 -0.66 -0.04 0.00 -1.32 0.00 0.00 176.35 174.47 1cng n ILE 91 N 4.52 0.67 -3.58 6.68 3.06 -0.39 -4.55 119.36 125.76 1cng n ILE 91 Ca 0.12 -0.33 -0.06 0.00 -2.50 0.00 0.00 62.75 59.98 1cng n ILE 91 Cb 0.44 -0.84 -0.02 0.00 0.54 0.00 0.00 39.64 39.77 1cng n ILE 91 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 1cng s GLN 92 N -2.23 0.71 0.04 9.51 1.03 -1.21 -1.36 119.66 126.14 1cng s GLN 92 Ca -0.10 -0.30 0.02 0.00 0.04 0.00 0.00 55.36 55.02 1cng s GLN 92 Cb 0.03 0.30 -0.02 0.00 0.03 0.00 0.00 33.01 33.35 1cng s GLN 92 CO 0.33 -0.31 -0.07 -0.59 -2.54 0.00 0.00 175.29 172.10 1cng s PHE 93 N -2.90 0.64 0.29 9.60 -0.12 -0.91 -0.51 117.98 124.08 1cng s PHE 93 Ca 0.08 -0.49 -0.07 0.00 -0.05 0.00 0.00 56.93 56.40 1cng s PHE 93 Cb -0.01 -0.39 -0.00 0.00 -0.63 0.00 0.00 43.02 41.99 1cng s PHE 93 CO -0.06 -0.09 0.45 -3.38 -0.05 0.00 0.00 175.22 172.09 1cng s HIS 94 N -1.35 0.74 0.27 3.49 -3.43 -0.74 -1.38 115.29 112.89 1cng s HIS 94 Ca -0.10 -1.04 0.06 0.00 -0.80 0.00 0.00 55.06 53.17 1cng s HIS 94 Cb -0.10 0.01 -0.06 0.00 -1.43 0.00 0.00 32.58 31.01 1cng s HIS 94 CO 0.00 -1.03 -0.04 -0.06 -2.00 0.00 0.00 174.74 171.61 1cng s PHE 95 N -3.57 1.88 -0.02 0.38 0.40 -1.26 -0.62 117.98 115.17 1cng s PHE 95 Ca 0.28 -0.75 0.02 0.00 -0.60 0.00 0.00 56.93 55.88 1cng s PHE 95 Cb 0.00 -1.08 0.00 0.00 0.51 0.00 0.00 43.02 42.45 1cng s PHE 95 CO 0.14 0.21 -0.07 -1.01 0.70 0.00 0.00 175.22 175.19 1cng s HIS 96 N -3.10 0.76 0.22 0.36 3.76 -0.57 -4.73 115.29 112.00 1cng s HIS 96 Ca 0.29 -0.17 -0.10 0.00 -0.15 0.00 0.00 55.06 54.93 1cng s HIS 96 Cb 0.04 -0.55 -0.01 0.00 1.11 0.00 0.00 32.58 33.18 1cng s HIS 96 CO 0.11 -0.07 0.39 1.67 -0.85 0.00 0.00 174.74 175.99 1cng s TRP 97 N 0.16 0.49 0.55 1.40 -2.14 -1.22 -1.36 118.94 116.82 1cng s TRP 97 Ca -0.02 -0.83 0.05 0.00 2.66 0.00 0.00 56.10 57.97 1cng s TRP 97 Cb -0.07 0.03 0.04 0.00 -3.10 0.00 0.00 33.47 30.37 1cng s TRP 97 CO 0.00 -0.89 0.40 0.20 -2.66 0.00 0.00 176.95 174.00 1cng s GLY 98 N -3.03 2.40 0.25 3.67 0.00 -1.16 -0.87 107.32 108.58 1cng s GLY 98 Ca 0.24 -1.20 0.23 0.00 0.00 0.00 0.00 44.72 43.99 1cng s GLY 98 CO 0.08 -1.95 1.27 1.48 0.00 0.00 0.00 173.10 173.97 1cng h SER 99 N 0.74 0.00 -3.92 1.64 4.64 -1.89 -3.39 113.55 111.37 1cng h SER 99 Ca -0.37 -0.04 -0.37 0.00 -0.47 0.00 0.00 61.79 60.54 1cng h SER 99 Cb 1.31 0.00 -0.16 0.00 -0.31 0.00 0.00 62.40 63.24 1cng h SER 99 CO 0.57 0.02 -0.73 -0.76 -0.87 0.00 0.00 176.83 175.06 1cng s LEU 100 N -5.32 2.48 0.42 5.97 2.01 -1.26 -5.05 118.68 117.94 1cng s LEU 100 Ca 0.03 -0.93 0.30 0.00 0.01 0.00 0.00 54.13 53.53 1cng s LEU 100 Cb 0.09 -0.45 1.40 0.00 0.01 0.00 0.00 46.19 47.24 1cng s LEU 100 CO 0.74 -0.25 1.89 0.44 1.01 0.00 0.00 176.35 180.18 1cng h ASP 101 N 3.05 0.00 -0.30 2.29 3.32 -1.92 -2.91 116.42 119.95 1cng h ASP 101 Ca -0.38 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.67 1cng h ASP 101 Cb 1.20 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.75 1cng h ASP 101 CO 0.58 0.00 0.00 0.61 -1.72 0.00 0.00 179.24 178.71 1cng n GLY 102 N -0.52 0.40 3.36 2.75 0.00 -1.26 -3.54 105.19 106.38 1cng n GLY 102 Ca -0.00 -0.33 -0.11 0.00 0.00 0.00 0.00 46.02 45.58 1cng n GLY 102 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1cng s GLN 103 N -1.60 1.14 0.00 1.61 -2.07 -1.10 -4.67 119.66 112.97 1cng s GLN 103 Ca 0.20 -0.65 0.00 0.00 -1.82 0.00 0.00 55.36 53.09 1cng s GLN 103 Cb 0.11 0.51 0.00 0.00 -1.09 0.00 0.00 33.01 32.53 1cng s GLN 103 CO 0.14 -0.47 0.00 0.41 -1.32 0.00 0.00 175.29 174.05 1cng n GLY 104 N -0.27 3.24 3.83 2.60 0.00 -0.96 -2.99 105.19 110.63 1cng n GLY 104 Ca -0.16 -0.44 -0.31 0.00 0.00 0.00 0.00 46.02 45.11 1cng n GLY 104 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1cng s SER 105 N 0.00 5.70 -0.20 1.61 1.04 -0.70 -3.37 113.70 117.78 1cng s SER 105 Ca 0.00 1.62 -0.13 0.00 0.48 0.00 0.00 55.95 57.91 1cng s SER 105 Cb 0.00 -2.50 -0.20 0.00 0.10 0.00 0.00 66.02 63.42 1cng s SER 105 CO 0.00 -1.23 0.11 -0.62 0.98 0.00 0.00 173.24 172.48 1cng n GLU 106 N -2.74 0.64 -2.33 4.02 1.02 -1.26 -4.81 120.64 115.17 1cng n GLU 106 Ca 0.07 0.38 -0.32 0.00 -0.02 0.00 0.00 57.16 57.28 1cng n GLU 106 Cb 0.54 -1.67 -0.02 0.00 -0.02 0.00 0.00 31.44 30.27 1cng n GLU 106 CO 0.00 0.00 0.00 -1.01 1.18 0.00 0.00 177.13 177.30 1cng s HIS 107 N -2.46 3.50 0.09 -0.32 3.76 -1.26 -4.35 115.29 114.24 1cng s HIS 107 Ca -0.29 1.37 0.04 0.00 -0.15 0.00 0.00 55.06 56.03 1cng s HIS 107 Cb 0.08 -2.73 -0.03 0.00 1.11 0.00 0.00 32.58 31.01 1cng s HIS 107 CO 0.63 -0.41 -0.11 0.95 -0.85 0.00 0.00 174.74 174.94 1cng s THR 108 N -2.73 0.97 -0.27 1.30 -4.23 -1.22 -4.68 115.64 104.79 1cng s THR 108 Ca 0.57 -1.50 -0.00 0.00 -1.18 0.00 0.00 61.69 59.57 1cng s THR 108 Cb -0.10 -1.22 0.04 0.00 1.34 0.00 0.00 72.50 72.56 1cng s THR 108 CO 0.37 -0.45 -0.06 -0.69 -0.54 0.00 0.00 174.62 173.25 1cng s VAL 109 N -2.01 2.68 -1.45 2.29 1.01 -0.74 -0.21 120.40 121.96 1cng s VAL 109 Ca 0.02 -1.33 -0.11 0.00 0.00 0.00 0.00 61.98 60.56 1cng s VAL 109 Cb -0.06 -2.48 0.05 0.00 0.00 0.00 0.00 36.38 33.90 1cng s VAL 109 CO 0.01 0.04 1.05 0.47 0.00 0.00 0.00 175.10 176.67 1cng n ASP 110 N 4.58 -5.17 0.00 3.32 8.00 0.11 -0.78 116.55 126.62 1cng n ASP 110 Ca -0.15 -0.68 0.00 0.00 0.71 0.00 0.00 54.79 54.67 1cng n ASP 110 Cb 0.44 -4.38 0.00 0.00 -0.02 0.00 0.00 41.12 37.16 1cng n ASP 110 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1cng n LYS 111 N -4.78 0.00 -2.49 -1.24 4.76 -1.26 -5.00 118.16 108.15 1cng n LYS 111 Ca 0.00 0.00 -0.42 0.00 -2.87 0.00 0.00 58.31 55.02 1cng n LYS 111 Cb 0.55 -2.32 -0.03 0.00 -1.84 0.00 0.00 35.03 31.39 1cng n LYS 111 CO 0.00 0.00 0.00 0.21 -1.37 0.00 0.00 177.40 176.24 1cng s LYS 112 N -0.07 4.48 -0.09 1.97 2.20 0.04 -4.98 119.74 123.29 1cng s LYS 112 Ca 0.00 1.69 -0.04 0.00 -0.36 0.00 0.00 55.97 57.26 1cng s LYS 112 Cb 0.00 -3.36 -0.04 0.00 -1.51 0.00 0.00 37.83 32.92 1cng s LYS 112 CO 0.00 -0.18 0.09 0.15 -0.36 0.00 0.00 175.35 175.05 1cng s LYS 113 N 0.89 3.24 0.40 4.03 1.02 -1.26 -1.80 119.74 126.27 1cng s LYS 113 Ca 0.56 -0.27 0.08 0.00 0.02 0.00 0.00 55.97 56.36 1cng s LYS 113 Cb -0.28 -3.01 0.00 0.00 -0.52 0.00 0.00 37.83 34.02 1cng s LYS 113 CO 0.30 0.73 0.52 0.71 -0.92 0.00 0.00 175.35 176.69 1cng s TYR 114 N -1.01 2.86 0.36 3.18 2.02 -1.26 -4.66 117.35 118.84 1cng s TYR 114 Ca 0.16 -0.37 0.08 0.00 -0.37 0.00 0.00 57.07 56.57 1cng s TYR 114 Cb -0.12 -2.26 0.70 0.00 -0.40 0.00 0.00 41.96 39.88 1cng s TYR 114 CO 0.05 -0.29 1.87 0.00 -1.57 0.00 0.00 175.55 175.61 1cng h ALA 115 N 0.76 1.41 -2.80 3.71 0.00 -1.38 -1.74 119.26 119.22 1cng h ALA 115 Ca -0.41 -0.25 0.08 0.00 0.00 0.00 0.00 54.91 54.33 1cng h ALA 115 Cb 1.27 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.93 1cng h ALA 115 CO 0.48 0.41 0.34 0.00 0.00 0.00 0.00 179.25 180.48 1cng s ALA 116 N -4.63 -1.24 -0.03 0.00 0.00 -1.14 -3.12 121.76 111.60 1cng s ALA 116 Ca -0.05 -0.33 -0.03 0.00 0.00 0.00 0.00 51.96 51.55 1cng s ALA 116 Cb 0.15 0.75 0.01 0.00 0.00 0.00 0.00 23.12 24.03 1cng s ALA 116 CO 0.74 -1.03 0.09 0.00 0.00 0.00 0.00 175.76 175.56 1cng s ALA 117 N -3.18 -0.21 -0.20 0.00 0.00 -0.47 -1.26 121.76 116.45 1cng s ALA 117 Ca 0.14 0.26 -0.05 0.00 0.00 0.00 0.00 51.96 52.30 1cng s ALA 117 Cb -0.04 -0.15 -0.03 0.00 0.00 0.00 0.00 23.12 22.90 1cng s ALA 117 CO 0.07 -0.05 -0.00 -1.17 0.00 0.00 0.00 175.76 174.61 1cng s LEU 118 N 0.11 3.28 -0.23 0.00 2.96 0.40 -1.51 118.68 123.68 1cng s LEU 118 Ca -0.00 -0.18 -0.02 0.00 -0.22 0.00 0.00 54.13 53.70 1cng s LEU 118 Cb -0.01 -1.83 0.02 0.00 0.50 0.00 0.00 46.19 44.87 1cng s LEU 118 CO -0.00 0.08 -0.08 -1.00 -1.32 0.00 0.00 176.35 174.03 1cng s HIS 119 N 0.92 2.99 -0.36 5.38 3.76 0.21 -0.99 115.29 127.19 1cng s HIS 119 Ca 0.01 -1.39 -0.14 0.00 -0.15 0.00 0.00 55.06 53.39 1cng s HIS 119 Cb -0.14 -2.05 -0.00 0.00 1.11 0.00 0.00 32.58 31.49 1cng s HIS 119 CO 0.02 -0.69 0.28 -0.51 -0.85 0.00 0.00 174.74 172.99 1cng s LEU 120 N 1.36 4.69 -0.17 0.89 1.43 -0.34 -1.79 118.68 124.76 1cng s LEU 120 Ca 0.02 -0.54 -0.15 0.00 -1.03 0.00 0.00 54.13 52.43 1cng s LEU 120 Cb -0.15 -2.18 -0.04 0.00 0.03 0.00 0.00 46.19 43.84 1cng s LEU 120 CO -0.05 -0.32 0.34 -0.69 0.23 0.00 0.00 176.35 175.85 1cng s VAL 121 N 1.77 5.26 0.07 -1.59 1.01 0.34 -1.19 120.40 126.07 1cng s VAL 121 Ca 0.07 0.63 0.07 0.00 0.00 0.00 0.00 61.98 62.74 1cng s VAL 121 Cb -0.18 -3.68 -0.03 0.00 0.00 0.00 0.00 36.38 32.50 1cng s VAL 121 CO 0.11 0.34 -0.18 -1.00 0.00 0.00 0.00 175.10 174.37 1cng s HIS 122 N 0.76 1.51 0.00 5.22 3.76 -0.36 -1.26 115.29 124.92 1cng s HIS 122 Ca 0.18 -0.41 0.08 0.00 -0.15 0.00 0.00 55.06 54.76 1cng s HIS 122 Cb -0.14 -0.86 -0.02 0.00 1.11 0.00 0.00 32.58 32.67 1cng s HIS 122 CO 0.06 0.11 -0.24 1.67 -0.85 0.00 0.00 174.74 175.49 1cng s TRP 123 N -1.08 2.17 -0.20 1.40 1.48 -0.06 -1.38 118.94 121.27 1cng s TRP 123 Ca 0.03 -0.41 -0.29 0.00 -1.06 0.00 0.00 56.10 54.38 1cng s TRP 123 Cb -0.09 -1.36 -0.04 0.00 -1.16 0.00 0.00 33.47 30.81 1cng s TRP 123 CO 0.03 0.01 1.91 1.21 -4.06 0.00 0.00 176.95 176.05 1cng s ASN 124 N -0.78 5.98 0.58 -2.66 3.84 0.10 -0.96 114.94 121.04 1cng s ASN 124 Ca 0.10 1.80 0.36 0.00 0.21 0.00 0.00 52.86 55.33 1cng s ASN 124 Cb -0.09 -2.52 1.97 0.00 -0.55 0.00 0.00 41.25 40.05 1cng s ASN 124 CO -0.00 -1.55 2.11 0.71 -2.79 0.00 0.00 177.10 175.57 1cng h THR 125 N 6.54 0.00 0.00 -5.21 1.35 -1.59 -1.93 112.91 112.07 1cng h THR 125 Ca -0.39 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.47 1cng h THR 125 Cb 1.20 0.80 0.00 0.00 -1.73 0.00 0.00 68.15 68.42 1cng h THR 125 CO 0.98 0.00 0.00 0.07 -0.25 0.00 0.00 175.52 176.32 1cng h LYS 127 N 0.00 0.00 -0.20 4.72 2.10 -1.91 -2.67 116.57 118.62 1cng h LYS 127 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1cng h LYS 127 Cb 0.14 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.47 1cng h LYS 127 CO 0.00 0.00 0.00 0.66 -2.00 0.00 0.00 179.45 178.11 1cng n TYR 128 N -2.37 0.25 0.00 0.07 4.01 -0.72 -4.99 117.16 113.40 1cng n TYR 128 Ca 0.01 -0.12 0.00 0.00 -0.16 0.00 0.00 57.90 57.63 1cng n TYR 128 Cb 0.21 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.24 1cng n TYR 128 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1cng n GLY 129 N 1.21 1.42 3.27 2.72 0.00 -1.01 -4.52 105.19 108.29 1cng n GLY 129 Ca 0.17 -0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.09 1cng n GLY 129 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1cng s ASP 130 N 0.00 0.09 0.23 1.61 1.47 -1.26 -5.05 116.67 113.76 1cng s ASP 130 Ca 0.00 -0.80 -0.07 0.00 1.18 0.00 0.00 52.55 52.86 1cng s ASP 130 Cb 0.00 0.39 0.32 0.00 -0.34 0.00 0.00 42.92 43.29 1cng s ASP 130 CO 0.00 -0.81 1.80 0.15 0.68 0.00 0.00 175.17 176.98 1cng h PHE 131 N 2.65 0.71 -0.96 2.11 3.57 -1.95 -2.35 116.94 120.72 1cng h PHE 131 Ca -0.33 0.03 0.11 0.00 3.53 0.00 0.00 57.97 61.31 1cng h PHE 131 Cb 1.21 -0.21 -0.08 0.00 2.79 0.00 0.00 35.95 39.66 1cng h PHE 131 CO 0.41 0.29 0.60 0.78 -2.23 0.00 0.00 178.31 178.17 1cng h GLY 132 N 0.68 1.55 1.23 2.40 0.00 -1.97 -1.94 103.07 105.03 1cng h GLY 132 Ca 0.35 -0.41 -0.25 0.00 0.00 0.00 0.00 47.33 47.03 1cng h GLY 132 CO -0.24 0.17 -0.92 0.50 0.00 0.00 0.00 176.54 176.06 1cng h LYS 133 N 0.97 0.72 -0.97 4.80 1.79 -1.71 -3.31 116.57 118.86 1cng h LYS 133 Ca 0.47 -0.69 0.08 0.00 -2.18 0.00 0.00 60.65 58.33 1cng h LYS 133 Cb 0.42 0.17 -0.07 0.00 -1.58 0.00 0.00 32.23 31.18 1cng h LYS 133 CO -0.25 1.28 0.63 0.00 -1.08 0.00 0.00 179.45 180.02 1cng h ALA 134 N 0.50 1.47 0.00 3.86 0.00 -0.87 -2.06 119.26 122.16 1cng h ALA 134 Ca -0.09 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1cng h ALA 134 Cb 1.56 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 19.08 1cng h ALA 134 CO 0.18 0.36 0.00 1.33 0.00 0.00 0.00 179.25 181.13 1cng n VAL 135 N -4.52 1.07 0.13 0.00 0.24 -0.82 -1.89 118.33 112.54 1cng n VAL 135 Ca 0.16 0.38 0.09 0.00 -2.04 0.00 0.00 64.34 62.92 1cng n VAL 135 Cb 0.23 -1.29 0.26 0.00 -1.47 0.00 0.00 33.84 31.57 1cng n VAL 135 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1cng n GLN 136 N -1.97 2.39 -4.76 7.34 6.02 -0.77 -4.64 117.38 121.00 1cng n GLN 136 Ca 0.01 -2.11 -0.29 0.00 -0.01 0.00 0.00 57.00 54.61 1cng n GLN 136 Cb 0.14 -1.47 -0.14 0.00 1.02 0.00 0.00 30.24 29.79 1cng n GLN 136 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 1cng s GLN 137 N -1.25 1.63 0.56 -1.09 -1.52 -0.79 -5.03 119.66 112.17 1cng s GLN 137 Ca 0.39 -1.11 0.24 0.00 -1.95 0.00 0.00 55.36 52.93 1cng s GLN 137 Cb 0.21 -1.85 1.60 0.00 -0.22 0.00 0.00 33.01 32.75 1cng s GLN 137 CO 0.26 0.47 2.21 -1.00 -0.25 0.00 0.00 175.29 176.98 1cng h PRO 138 N 4.65 0.00 -0.18 2.91 0.13 -1.86 -2.14 132.00 135.51 1cng h PRO 138 Ca -0.46 0.00 -0.13 0.00 -0.87 0.00 0.00 66.00 64.54 1cng h PRO 138 Cb 1.15 0.00 -0.10 0.00 0.13 0.00 0.00 31.00 32.18 1cng h PRO 138 CO 0.43 0.00 -0.54 -0.40 -0.23 0.00 0.00 178.00 177.26 1cng n ASP 139 N -4.12 2.44 0.04 1.44 5.75 -1.26 -4.19 116.55 116.64 1cng n ASP 139 Ca -0.03 -3.87 -0.14 0.00 -0.01 0.00 0.00 54.79 50.74 1cng n ASP 139 Cb 0.10 -0.50 -0.03 0.00 -1.03 0.00 0.00 41.12 39.66 1cng n ASP 139 CO 0.00 0.00 0.00 1.23 -0.11 0.00 0.00 177.20 178.32 1cng h GLY 140 N 1.25 0.59 -2.95 6.12 0.00 -1.28 -3.43 103.07 103.37 1cng h GLY 140 Ca 0.09 -0.90 -0.63 0.00 0.00 0.00 0.00 47.33 45.89 1cng h GLY 140 CO 0.18 0.80 -0.80 1.08 0.00 0.00 0.00 176.54 177.81 1cng s LEU 141 N -8.01 2.48 -0.09 3.11 1.43 -0.02 0.01 118.68 117.57 1cng s LEU 141 Ca -0.07 -0.91 -0.01 0.00 -1.03 0.00 0.00 54.13 52.11 1cng s LEU 141 Cb 0.09 -1.10 0.03 0.00 0.03 0.00 0.00 46.19 45.23 1cng s LEU 141 CO 0.87 0.08 -0.03 0.00 0.23 0.00 0.00 176.35 177.49 1cng s ALA 142 N -1.95 1.00 -0.19 4.21 0.00 -0.48 -0.88 121.76 123.48 1cng s ALA 142 Ca 0.22 -0.33 -0.02 0.00 0.00 0.00 0.00 51.96 51.83 1cng s ALA 142 Cb -0.07 -0.83 -0.01 0.00 0.00 0.00 0.00 23.12 22.22 1cng s ALA 142 CO 0.11 -0.45 -0.08 0.08 0.00 0.00 0.00 175.76 175.42 1cng s VAL 143 N 1.85 3.14 -0.35 0.00 1.01 -0.81 -1.23 120.40 124.02 1cng s VAL 143 Ca 0.05 -0.59 -0.19 0.00 0.00 0.00 0.00 61.98 61.26 1cng s VAL 143 Cb -0.12 -2.39 -0.00 0.00 0.00 0.00 0.00 36.38 33.86 1cng s VAL 143 CO -0.07 0.47 0.54 -0.22 0.00 0.00 0.00 175.10 175.82 1cng s LEU 144 N 1.14 4.33 -0.18 3.92 2.96 -0.34 -1.26 118.68 129.25 1cng s LEU 144 Ca 0.01 0.01 -0.08 0.00 -0.22 0.00 0.00 54.13 53.85 1cng s LEU 144 Cb -0.14 -2.63 -0.04 0.00 0.50 0.00 0.00 46.19 43.88 1cng s LEU 144 CO -0.02 -0.50 0.09 -0.83 -1.32 0.00 0.00 176.35 173.76 1cng s GLY 145 N 1.76 1.96 -0.11 7.98 0.00 0.48 -1.20 107.32 118.20 1cng s GLY 145 Ca 0.20 -0.72 0.02 0.00 0.00 0.00 0.00 44.72 44.21 1cng s GLY 145 CO 0.14 0.05 -0.15 -0.42 0.00 0.00 0.00 173.10 172.72 1cng s ILE 146 N 0.28 1.48 0.38 0.90 1.01 -0.16 -1.50 121.20 123.59 1cng s ILE 146 Ca 0.05 -0.63 -0.22 0.00 0.00 0.00 0.00 60.65 59.86 1cng s ILE 146 Cb -0.12 -1.36 -0.10 0.00 0.01 0.00 0.00 42.46 40.89 1cng s ILE 146 CO -0.00 0.44 0.92 -0.36 0.00 0.00 0.00 174.94 175.93 1cng s PHE 147 N 1.01 3.43 -0.11 3.97 0.08 -1.26 -0.45 117.98 124.65 1cng s PHE 147 Ca -0.06 1.61 0.04 0.00 0.12 0.00 0.00 56.93 58.64 1cng s PHE 147 Cb -0.15 -2.83 0.00 0.00 -0.57 0.00 0.00 43.02 39.47 1cng s PHE 147 CO -0.02 0.01 -0.23 -0.51 -0.10 0.00 0.00 175.22 174.38 1cng s LEU 148 N -2.81 2.06 0.13 -0.37 1.02 -0.39 -1.23 118.68 117.09 1cng s LEU 148 Ca 0.57 -0.55 0.10 0.00 0.02 0.00 0.00 54.13 54.27 1cng s LEU 148 Cb -0.12 -1.38 -0.04 0.00 0.02 0.00 0.00 46.19 44.67 1cng s LEU 148 CO 0.17 0.14 -0.23 -1.59 0.02 0.00 0.00 176.35 174.86 1cng s LYS 149 N 0.45 1.58 -0.10 1.70 -2.85 -0.56 -1.72 119.74 118.24 1cng s LYS 149 Ca -0.16 -1.29 -0.28 0.00 -1.00 0.00 0.00 55.97 53.23 1cng s LYS 149 Cb -0.17 -1.99 -0.02 0.00 -2.06 0.00 0.00 37.83 33.59 1cng s LYS 149 CO 0.07 0.46 0.95 0.08 0.10 0.00 0.00 175.35 177.00 1cng s VAL 150 N -1.14 4.83 0.00 1.79 1.01 -1.26 -1.59 120.40 124.04 1cng s VAL 150 Ca 0.16 1.93 0.00 0.00 0.00 0.00 0.00 61.98 64.07 1cng s VAL 150 Cb -0.10 -4.26 0.00 0.00 0.00 0.00 0.00 36.38 32.02 1cng s VAL 150 CO 0.08 0.05 0.00 0.61 0.00 0.00 0.00 175.10 175.84 1cng n GLY 151 N 3.13 1.38 3.86 4.51 0.00 0.64 -4.88 105.19 113.83 1cng n GLY 151 Ca 0.07 0.33 -0.31 0.00 0.00 0.00 0.00 46.02 46.10 1cng n GLY 151 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1cng s SER 152 N 2.00 6.47 0.48 1.61 1.04 -1.26 -3.84 113.70 120.19 1cng s SER 152 Ca 0.00 1.43 -0.23 0.00 0.48 0.00 0.00 55.95 57.63 1cng s SER 152 Cb 0.00 -2.46 -0.07 0.00 0.10 0.00 0.00 66.02 63.59 1cng s SER 152 CO 0.00 -0.65 1.24 0.00 0.98 0.00 0.00 173.24 174.81 1cng s ALA 153 N -2.78 2.96 -0.41 5.32 0.00 -1.26 -2.40 121.76 123.18 1cng s ALA 153 Ca 0.56 1.09 -0.15 0.00 0.00 0.00 0.00 51.96 53.46 1cng s ALA 153 Cb -0.10 -3.45 0.03 0.00 0.00 0.00 0.00 23.12 19.59 1cng s ALA 153 CO 0.39 -0.89 0.30 0.21 0.00 0.00 0.00 175.76 175.77 1cng s LYS 154 N -2.70 2.96 0.22 0.00 2.47 -1.23 -4.83 119.74 116.63 1cng s LYS 154 Ca 0.65 -1.06 -0.08 0.00 -1.56 0.00 0.00 55.97 53.93 1cng s LYS 154 Cb -0.33 -3.98 0.34 0.00 -1.46 0.00 0.00 37.83 32.40 1cng s LYS 154 CO 0.40 -0.77 1.73 -1.35 0.16 0.00 0.00 175.35 175.52 1cng h PRO 155 N 8.63 0.38 0.00 4.03 0.11 -1.91 -1.97 132.00 141.26 1cng h PRO 155 Ca -0.27 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.82 1cng h PRO 155 Cb 1.12 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.14 1cng h PRO 155 CO 0.74 0.25 0.00 0.41 -0.21 0.00 0.00 178.00 179.19 1cng n GLY 156 N -1.31 -0.96 0.11 -0.55 0.00 -1.26 -2.33 105.19 98.90 1cng n GLY 156 Ca 0.10 0.02 0.11 0.00 0.00 0.00 0.00 46.02 46.26 1cng n GLY 156 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1cng n LEU 157 N -1.76 0.84 -0.34 0.99 7.94 -0.74 -4.40 117.00 119.52 1cng n LEU 157 Ca 0.02 0.32 0.03 0.00 -1.11 0.00 0.00 56.01 55.28 1cng n LEU 157 Cb 0.14 -0.06 0.21 0.00 0.53 0.00 0.00 43.42 44.24 1cng n LEU 157 CO 0.12 -0.18 1.26 -0.61 -1.11 0.00 0.00 177.39 176.87 1cng h GLN 158 N 0.00 1.07 -0.57 1.96 5.75 -1.51 -0.96 115.11 120.85 1cng h GLN 158 Ca -0.00 -0.06 0.05 0.00 -0.15 0.00 0.00 58.65 58.49 1cng h GLN 158 Cb 1.01 -0.24 -0.03 0.00 1.07 0.00 0.00 27.48 29.28 1cng h GLN 158 CO 0.00 0.71 0.38 -0.22 -2.65 0.00 0.00 178.83 177.05 1cng h LYS 159 N 1.10 0.55 0.02 1.69 3.64 -1.78 0.16 116.57 121.96 1cng h LYS 159 Ca 0.41 -0.03 -0.22 0.00 -1.27 0.00 0.00 60.65 59.54 1cng h LYS 159 Cb 0.19 -0.12 0.02 0.00 -0.41 0.00 0.00 32.23 31.90 1cng h LYS 159 CO -0.16 0.36 -0.86 0.28 -2.27 0.00 0.00 179.45 176.80 1cng h VAL 160 N 0.57 1.36 -0.77 2.00 2.07 -1.49 -3.24 116.25 116.74 1cng h VAL 160 Ca 0.24 -2.21 -0.02 0.00 0.82 0.00 0.00 66.70 65.53 1cng h VAL 160 Cb 0.24 2.56 -0.04 0.00 -1.52 0.00 0.00 31.29 32.54 1cng h VAL 160 CO -0.07 0.66 0.41 0.58 0.02 0.00 0.00 177.57 179.18 1cng h VAL 161 N 0.12 1.23 0.00 2.57 2.07 -0.13 -3.02 116.25 119.08 1cng h VAL 161 Ca -0.11 -0.57 -0.04 0.00 0.82 0.00 0.00 66.70 66.79 1cng h VAL 161 Cb 1.55 0.20 -0.01 0.00 -1.52 0.00 0.00 31.29 31.51 1cng h VAL 161 CO 0.17 0.26 -0.18 0.44 0.02 0.00 0.00 177.57 178.27 1cng h ASP 162 N 1.07 0.00 0.19 0.57 3.32 -0.79 -3.05 116.42 117.74 1cng h ASP 162 Ca 0.27 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.32 1cng h ASP 162 Cb 0.03 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.58 1cng h ASP 162 CO -0.04 0.18 -0.24 0.55 -1.72 0.00 0.00 179.24 177.97 1cng n VAL 163 N -3.41 0.00 0.20 -1.35 3.14 -1.14 -4.37 118.33 111.40 1cng n VAL 163 Ca -0.00 -0.15 0.07 0.00 -2.96 0.00 0.00 64.34 61.30 1cng n VAL 163 Cb 0.38 0.46 0.59 0.00 -1.06 0.00 0.00 33.84 34.21 1cng n VAL 163 CO 0.00 0.00 0.00 -0.07 -6.46 0.00 0.00 176.83 170.30 1cng h LEU 164 N 1.43 0.10 -1.38 6.55 3.38 -1.58 -2.16 115.31 121.66 1cng h LEU 164 Ca 0.00 -0.00 0.07 0.00 0.09 0.00 0.00 57.88 58.03 1cng h LEU 164 Cb 0.52 -0.03 -0.05 0.00 0.09 0.00 0.00 40.66 41.20 1cng h LEU 164 CO 0.00 0.08 0.48 0.44 0.09 0.00 0.00 178.44 179.53 1cng h ASP 165 N 0.12 0.66 1.02 -0.43 3.32 -1.82 -2.00 116.42 117.29 1cng h ASP 165 Ca 0.03 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.08 1cng h ASP 165 Cb -0.00 -0.14 -0.00 0.00 0.22 0.00 0.00 39.33 39.41 1cng h ASP 165 CO -0.01 0.43 -0.05 0.28 -1.72 0.00 0.00 179.24 178.17 1cng h SER 166 N 0.75 0.00 -0.74 6.45 0.02 -1.71 -3.25 113.55 115.08 1cng h SER 166 Ca 0.31 0.00 -0.47 0.00 -0.84 0.00 0.00 61.79 60.80 1cng h SER 166 Cb 0.27 0.00 -0.42 0.00 0.14 0.00 0.00 62.40 62.38 1cng h SER 166 CO -0.10 0.05 -0.90 2.30 -1.14 0.00 0.00 176.83 177.03 1cng n ILE 167 N -3.17 2.13 -0.11 3.27 -5.35 -0.77 -4.67 119.36 110.69 1cng n ILE 167 Ca 0.01 -3.90 0.05 0.00 -0.27 0.00 0.00 62.75 58.63 1cng n ILE 167 Cb 0.34 -0.44 0.37 0.00 -1.74 0.00 0.00 39.64 38.16 1cng n ILE 167 CO 0.00 0.00 0.00 0.50 -1.76 0.00 0.00 176.55 175.29 1cng h LYS 168 N 2.36 0.69 -6.16 6.28 3.64 -1.55 -3.41 116.57 118.41 1cng h LYS 168 Ca 0.21 -0.04 -0.57 0.00 -1.27 0.00 0.00 60.65 58.98 1cng h LYS 168 Cb 1.40 -0.15 -0.10 0.00 -0.41 0.00 0.00 32.23 32.96 1cng h LYS 168 CO 0.61 0.45 -0.65 0.95 -2.27 0.00 0.00 179.45 178.54 1cng s THR 169 N -5.62 3.08 0.16 1.00 -4.23 -1.26 -0.65 115.64 108.12 1cng s THR 169 Ca -0.09 -2.00 -0.34 0.00 -1.18 0.00 0.00 61.69 58.08 1cng s THR 169 Cb 0.18 -2.75 -0.14 0.00 1.34 0.00 0.00 72.50 71.13 1cng s THR 169 CO 0.76 -0.33 1.56 1.17 -0.54 0.00 0.00 174.62 177.23 1cng n LYS 170 N -0.88 2.09 0.00 3.99 4.81 -0.18 -2.02 118.16 125.97 1cng n LYS 170 Ca -0.05 0.75 0.00 0.00 -0.87 0.00 0.00 58.31 58.14 1cng n LYS 170 Cb 0.60 -2.51 0.00 0.00 0.02 0.00 0.00 35.03 33.14 1cng n LYS 170 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1cng n GLY 171 N 3.30 3.27 3.77 3.14 0.00 -0.05 -4.47 105.19 114.15 1cng n GLY 171 Ca 0.17 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.81 1cng n GLY 171 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1cng s LYS 172 N -0.91 4.25 0.04 1.61 -0.14 -0.86 -4.86 119.74 118.88 1cng s LYS 172 Ca 0.00 1.71 -0.06 0.00 -1.36 0.00 0.00 55.97 56.26 1cng s LYS 172 Cb 0.00 -2.76 -0.01 0.00 -1.68 0.00 0.00 37.83 33.38 1cng s LYS 172 CO 0.00 -0.11 0.11 -1.54 -0.76 0.00 0.00 175.35 173.05 1cng s SER 173 N -1.22 0.17 0.02 2.83 1.04 -1.26 -1.38 113.70 113.90 1cng s SER 173 Ca 0.54 -0.54 -0.04 0.00 0.48 0.00 0.00 55.95 56.39 1cng s SER 173 Cb -0.28 0.24 -0.01 0.00 0.10 0.00 0.00 66.02 66.07 1cng s SER 173 CO 0.35 -0.53 0.05 0.00 0.98 0.00 0.00 173.24 174.09 1cng s ALA 174 N -2.74 -0.07 0.28 5.32 0.00 0.16 -4.93 121.76 119.78 1cng s ALA 174 Ca -0.04 -0.43 -0.30 0.00 0.00 0.00 0.00 51.96 51.20 1cng s ALA 174 Cb -0.00 0.15 -0.10 0.00 0.00 0.00 0.00 23.12 23.17 1cng s ALA 174 CO -0.05 -0.21 1.43 -0.51 0.00 0.00 0.00 175.76 176.41 1cng s ASP 175 N -1.58 6.64 -0.43 0.00 1.01 -1.26 -1.09 116.67 119.96 1cng s ASP 175 Ca -0.13 2.71 0.06 0.00 0.71 0.00 0.00 52.55 55.90 1cng s ASP 175 Cb -0.07 -2.63 0.20 0.00 1.01 0.00 0.00 42.92 41.43 1cng s ASP 175 CO -0.01 -0.69 0.51 0.33 0.21 0.00 0.00 175.17 175.52 1cng n PHE 176 N 1.91 -1.51 -3.31 4.23 7.35 0.10 -4.76 117.46 121.47 1cng n PHE 176 Ca 0.05 -2.90 -0.21 0.00 -0.76 0.00 0.00 57.45 53.64 1cng n PHE 176 Cb 0.40 0.43 0.00 0.00 0.35 0.00 0.00 39.48 40.66 1cng n PHE 176 CO 0.00 0.00 0.00 0.95 -0.76 0.00 0.00 176.76 176.95 1cng s THR 177 N -0.10 4.10 -1.51 -2.13 -4.23 -1.26 -3.01 115.64 107.50 1cng s THR 177 Ca 0.33 -0.81 -0.04 0.00 -1.18 0.00 0.00 61.69 59.99 1cng s THR 177 Cb 0.09 -3.45 0.01 0.00 1.34 0.00 0.00 72.50 70.49 1cng s THR 177 CO -0.16 -0.23 0.38 0.59 -0.54 0.00 0.00 174.62 174.67 1cng n ASN 178 N -1.80 -5.44 -4.73 3.99 4.13 -1.26 -4.96 115.26 105.19 1cng n ASN 178 Ca 0.00 -0.19 -0.36 0.00 1.68 0.00 0.00 54.58 55.71 1cng n ASN 178 Cb 0.58 -4.46 -0.07 0.00 -1.54 0.00 0.00 39.78 34.29 1cng n ASN 178 CO 0.00 0.00 0.00 0.12 0.28 0.00 0.00 177.26 177.66 1cng s PHE 179 N -3.04 3.47 -0.40 3.10 5.36 -1.26 -5.03 117.98 120.18 1cng s PHE 179 Ca 0.22 0.62 -0.13 0.00 -0.96 0.00 0.00 56.93 56.67 1cng s PHE 179 Cb -0.10 -2.35 0.02 0.00 -0.34 0.00 0.00 43.02 40.25 1cng s PHE 179 CO 0.27 0.24 0.26 0.34 -1.46 0.00 0.00 175.22 174.87 1cng s ASP 180 N 0.45 5.95 0.33 6.13 -1.08 -1.26 -4.43 116.67 122.76 1cng s ASP 180 Ca 0.17 -0.96 0.25 0.00 -0.52 0.00 0.00 52.55 51.49 1cng s ASP 180 Cb -0.13 -2.10 1.17 0.00 -1.46 0.00 0.00 42.92 40.40 1cng s ASP 180 CO 0.04 -0.43 1.75 1.55 0.52 0.00 0.00 175.17 178.61 1cng h PRO 181 N 8.55 0.00 0.00 4.34 0.13 -1.97 -2.74 132.00 140.31 1cng h PRO 181 Ca -0.26 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.86 1cng h PRO 181 Cb 1.11 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.24 1cng h PRO 181 CO 0.71 0.00 -0.02 0.00 -0.23 0.00 0.00 178.00 178.46 1cng h ARG 182 N 0.00 0.00 0.00 0.86 3.08 -1.93 -1.40 114.38 115.00 1cng h ARG 182 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1cng h ARG 182 Cb 0.21 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.26 1cng h ARG 182 CO 0.00 0.02 0.00 0.41 -1.07 0.00 0.00 179.97 179.33 1cng n GLY 183 N -1.02 -1.04 0.84 0.04 0.00 -1.03 -2.84 105.19 100.15 1cng n GLY 183 Ca -0.03 -0.10 0.09 0.00 0.00 0.00 0.00 46.02 45.99 1cng n GLY 183 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1cng n LEU 184 N -1.30 2.84 -4.80 0.99 4.77 -0.53 -4.38 117.00 114.59 1cng n LEU 184 Ca 0.10 -1.28 -0.39 0.00 -0.03 0.00 0.00 56.01 54.41 1cng n LEU 184 Cb 0.18 -0.11 -0.06 0.00 -2.33 0.00 0.00 43.42 41.10 1cng n LEU 184 CO 0.17 0.57 0.33 -0.76 -1.33 0.00 0.00 177.39 176.37 1cng s LEU 185 N -1.40 4.54 0.95 2.23 1.43 -1.13 -4.96 118.68 120.35 1cng s LEU 185 Ca 0.27 1.37 -0.13 0.00 -1.03 0.00 0.00 54.13 54.60 1cng s LEU 185 Cb 0.17 -3.01 0.16 0.00 0.03 0.00 0.00 46.19 43.54 1cng s LEU 185 CO 0.24 0.25 1.15 -2.16 0.23 0.00 0.00 176.35 176.07 1cng s PRO 186 N -1.14 0.78 0.12 1.29 0.04 -1.26 -4.97 135.00 129.86 1cng s PRO 186 Ca 0.31 0.18 -0.16 0.00 0.04 0.00 0.00 61.00 61.37 1cng s PRO 186 Cb -0.20 -1.81 -0.03 0.00 0.04 0.00 0.00 34.50 32.50 1cng s PRO 186 CO 0.21 -2.42 1.60 1.49 0.04 0.00 0.00 177.00 177.92 1cng h GLU 187 N -1.66 0.61 -6.05 4.56 4.81 -1.93 -3.44 114.58 111.49 1cng h GLU 187 Ca -0.49 -0.16 -0.60 0.00 -0.13 0.00 0.00 59.36 57.97 1cng h GLU 187 Cb 1.32 -0.07 -0.05 0.00 0.63 0.00 0.00 28.75 30.58 1cng h GLU 187 CO 0.56 0.67 -0.28 0.45 -0.73 0.00 0.00 179.01 179.68 1cng s SER 188 N -6.01 6.62 -0.18 1.04 0.15 -1.26 -5.00 113.70 109.05 1cng s SER 188 Ca -0.13 0.75 0.16 0.00 0.70 0.00 0.00 55.95 57.42 1cng s SER 188 Cb 0.09 -2.16 0.62 0.00 -1.71 0.00 0.00 66.02 62.86 1cng s SER 188 CO 0.77 0.20 1.52 0.18 1.20 0.00 0.00 173.24 177.11 1cng n LEU 189 N 1.03 4.43 -4.76 3.45 4.77 -1.26 -4.73 117.00 119.92 1cng n LEU 189 Ca -0.09 -2.88 -0.38 0.00 -0.03 0.00 0.00 56.01 52.62 1cng n LEU 189 Cb 0.52 -0.57 0.02 0.00 -2.33 0.00 0.00 43.42 41.07 1cng n LEU 189 CO 0.42 0.68 0.95 -1.81 -1.33 0.00 0.00 177.39 176.29 1cng s ASP 190 N -1.46 5.66 0.26 -1.43 1.01 -1.26 -4.76 116.67 114.69 1cng s ASP 190 Ca 0.45 2.65 -0.15 0.00 0.71 0.00 0.00 52.55 56.22 1cng s ASP 190 Cb 0.35 -2.63 0.00 0.00 1.01 0.00 0.00 42.92 41.65 1cng s ASP 190 CO 0.13 -1.29 0.54 -0.72 0.21 0.00 0.00 175.17 174.03 1cng s TYR 191 N -1.35 0.24 0.13 4.23 -0.85 -1.26 -1.72 117.35 116.77 1cng s TYR 191 Ca 0.67 -0.62 0.10 0.00 -0.52 0.00 0.00 57.07 56.70 1cng s TYR 191 Cb -0.37 0.32 -0.04 0.00 0.38 0.00 0.00 41.96 42.24 1cng s TYR 191 CO 0.45 -1.06 -0.22 -1.58 -1.52 0.00 0.00 175.55 171.62 1cng s TRP 192 N -3.97 2.42 -0.05 -3.49 0.51 0.03 -1.04 118.94 113.35 1cng s TRP 192 Ca 0.20 -0.32 -0.08 0.00 -2.12 0.00 0.00 56.10 53.77 1cng s TRP 192 Cb -0.02 -1.28 0.02 0.00 -0.81 0.00 0.00 33.47 31.37 1cng s TRP 192 CO 0.09 0.38 0.20 -0.08 -0.51 0.00 0.00 176.95 177.03 1cng s THR 193 N -1.17 0.03 0.11 2.01 -1.32 -0.10 -0.69 115.64 114.53 1cng s THR 193 Ca 0.17 -0.26 -0.25 0.00 -1.21 0.00 0.00 61.69 60.13 1cng s THR 193 Cb -0.10 -0.38 0.07 0.00 -1.51 0.00 0.00 72.50 70.58 1cng s THR 193 CO 0.08 -0.15 0.62 -0.72 -2.21 0.00 0.00 174.62 172.25 1cng s TYR 194 N -0.51 -0.56 -0.05 9.09 1.13 -1.08 -1.09 117.35 124.28 1cng s TYR 194 Ca -0.06 0.50 -0.25 0.00 -1.41 0.00 0.00 57.07 55.84 1cng s TYR 194 Cb -0.04 0.53 -0.03 0.00 -1.10 0.00 0.00 41.96 41.32 1cng s TYR 194 CO 0.01 -0.80 0.79 -1.25 -2.51 0.00 0.00 175.55 171.79 1cng s PRO 195 N -3.21 4.47 0.00 -3.49 0.04 -1.26 -1.50 135.00 130.04 1cng s PRO 195 Ca -0.01 1.05 0.00 0.00 0.04 0.00 0.00 61.00 62.07 1cng s PRO 195 Cb -0.01 -3.46 0.00 0.00 0.04 0.00 0.00 34.50 31.08 1cng s PRO 195 CO -0.08 0.01 0.00 0.41 0.04 0.00 0.00 177.00 177.38 1cng n GLY 196 N 3.06 4.66 3.30 0.56 0.00 0.65 -4.82 105.19 112.60 1cng n GLY 196 Ca 0.01 -0.74 -0.20 0.00 0.00 0.00 0.00 46.02 45.10 1cng n GLY 196 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1cng s SER 197 N 1.44 1.69 0.50 1.61 1.04 -1.03 -2.39 113.70 116.57 1cng s SER 197 Ca 0.00 -1.74 -0.20 0.00 0.48 0.00 0.00 55.95 54.49 1cng s SER 197 Cb 0.00 0.55 -0.07 0.00 0.10 0.00 0.00 66.02 66.59 1cng s SER 197 CO 0.00 -1.04 1.10 -0.76 0.98 0.00 0.00 173.24 173.51 1cng s LEU 198 N -3.38 3.84 0.00 2.42 1.43 -0.59 -4.51 118.68 117.89 1cng s LEU 198 Ca 0.39 2.10 0.23 0.00 -1.03 0.00 0.00 54.13 55.82 1cng s LEU 198 Cb 0.03 -4.51 0.48 0.00 0.03 0.00 0.00 46.19 42.21 1cng s LEU 198 CO 0.26 -0.98 1.42 0.35 0.23 0.00 0.00 176.35 177.63 1cng n THR 199 N -1.01 0.38 -4.25 5.49 -2.24 -1.26 -4.47 114.28 106.91 1cng n THR 199 Ca 0.10 -0.63 -0.17 0.00 -2.27 0.00 0.00 64.05 61.08 1cng n THR 199 Cb 0.51 0.90 -0.11 0.00 -2.10 0.00 0.00 70.33 69.54 1cng n THR 199 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1cng s THR 200 N -1.62 1.34 0.59 4.28 -4.23 -1.26 -4.73 115.64 110.00 1cng s THR 200 Ca 0.36 -1.80 -0.18 0.00 -1.18 0.00 0.00 61.69 58.89 1cng s THR 200 Cb 0.21 -1.61 -0.06 0.00 1.34 0.00 0.00 72.50 72.38 1cng s THR 200 CO 0.30 -0.47 0.77 -2.65 -0.54 0.00 0.00 174.62 172.03 1cng n PRO 201 N 0.37 0.72 0.00 3.99 -0.02 -1.26 -0.52 135.00 138.27 1cng n PRO 201 Ca -0.14 0.28 0.03 0.00 -2.02 0.00 0.00 63.50 61.65 1cng n PRO 201 Cb 0.58 -1.96 0.21 0.00 -0.02 0.00 0.00 33.50 32.30 1cng n PRO 201 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 1cng n PRO 202 N -0.60 0.67 -3.13 0.52 -0.04 -1.26 -4.99 135.00 126.18 1cng n PRO 202 Ca 0.13 0.00 -0.22 0.00 -0.04 0.00 0.00 63.50 63.37 1cng n PRO 202 Cb 0.47 -1.16 0.01 0.00 -0.04 0.00 0.00 33.50 32.78 1cng n PRO 202 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1cng n LEU 203 N -0.66 -1.86 -4.77 1.53 4.77 0.32 -4.91 117.00 111.42 1cng n LEU 203 Ca 0.05 -0.28 -0.41 0.00 -0.03 0.00 0.00 56.01 55.34 1cng n LEU 203 Cb 0.02 -2.41 -0.01 0.00 -2.33 0.00 0.00 43.42 38.70 1cng n LEU 203 CO 0.04 0.14 1.11 -0.76 -1.33 0.00 0.00 177.39 176.59 1cng s LEU 204 N -6.44 4.35 -1.29 2.23 1.43 -1.26 -4.40 118.68 113.30 1cng s LEU 204 Ca 0.31 2.94 -0.09 0.00 -1.03 0.00 0.00 54.13 56.27 1cng s LEU 204 Cb -0.16 -3.66 0.16 0.00 0.03 0.00 0.00 46.19 42.57 1cng s LEU 204 CO 0.39 -0.80 1.94 -0.62 0.23 0.00 0.00 176.35 177.49 1cng n GLU 205 N 0.81 3.73 -0.13 1.70 1.02 -1.26 -1.54 120.64 124.96 1cng n GLU 205 Ca 0.02 -3.52 0.04 0.00 -0.02 0.00 0.00 57.16 53.68 1cng n GLU 205 Cb 0.40 -2.89 0.05 0.00 -0.02 0.00 0.00 31.44 28.98 1cng n GLU 205 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1cng s VAL 207 N -1.32 3.63 -0.36 0.00 1.01 -1.00 -0.85 120.40 121.50 1cng s VAL 207 Ca 0.12 -0.50 -0.11 0.00 0.00 0.00 0.00 61.98 61.49 1cng s VAL 207 Cb 0.10 -2.49 0.02 0.00 0.00 0.00 0.00 36.38 34.01 1cng s VAL 207 CO 0.01 0.58 0.19 -0.89 0.00 0.00 0.00 175.10 175.00 1cng s THR 208 N -0.58 4.53 0.02 3.92 2.01 -0.06 -0.25 115.64 125.23 1cng s THR 208 Ca 0.09 -0.83 -0.25 0.00 0.31 0.00 0.00 61.69 61.01 1cng s THR 208 Cb -0.12 -3.50 -0.05 0.00 0.01 0.00 0.00 72.50 68.84 1cng s THR 208 CO 0.02 -0.20 0.76 0.26 -0.69 0.00 0.00 174.62 174.77 1cng s TRP 209 N 1.55 3.70 -0.30 4.92 0.52 -0.56 -1.93 118.94 126.84 1cng s TRP 209 Ca 0.02 1.43 0.01 0.00 0.02 0.00 0.00 56.10 57.59 1cng s TRP 209 Cb -0.19 -2.82 0.09 0.00 -1.15 0.00 0.00 33.47 29.40 1cng s TRP 209 CO 0.06 0.23 0.05 0.42 0.02 0.00 0.00 176.95 177.73 1cng s ILE 210 N 0.14 1.51 -0.27 2.03 1.01 -0.39 -2.64 121.20 122.60 1cng s ILE 210 Ca 0.39 -1.68 -0.10 0.00 0.00 0.00 0.00 60.65 59.26 1cng s ILE 210 Cb -0.20 -2.05 -0.04 0.00 0.01 0.00 0.00 42.46 40.18 1cng s ILE 210 CO 0.22 -0.51 0.14 -0.69 0.00 0.00 0.00 174.94 174.10 1cng s VAL 211 N 1.32 4.90 0.18 2.92 1.01 0.14 -0.39 120.40 130.47 1cng s VAL 211 Ca 0.07 0.02 -0.30 0.00 0.00 0.00 0.00 61.98 61.77 1cng s VAL 211 Cb -0.18 -3.32 -0.08 0.00 0.00 0.00 0.00 36.38 32.80 1cng s VAL 211 CO -0.15 0.28 1.16 -0.76 0.00 0.00 0.00 175.10 175.63 1cng s LEU 212 N 1.70 4.46 0.20 3.92 1.43 -0.56 -0.79 118.68 129.04 1cng s LEU 212 Ca 0.07 2.16 -0.06 0.00 -1.03 0.00 0.00 54.13 55.27 1cng s LEU 212 Cb -0.16 -3.60 0.15 0.00 0.03 0.00 0.00 46.19 42.61 1cng s LEU 212 CO 0.08 -0.31 1.63 0.50 0.23 0.00 0.00 176.35 178.48 1cng h LYS 213 N 5.24 0.87 -5.48 1.70 3.64 -1.68 -3.43 116.57 117.43 1cng h LYS 213 Ca -0.44 -0.33 -0.61 0.00 -1.27 0.00 0.00 60.65 57.99 1cng h LYS 213 Cb 1.21 -0.05 -0.12 0.00 -0.41 0.00 0.00 32.23 32.86 1cng h LYS 213 CO 0.74 0.97 0.13 -2.00 -2.27 0.00 0.00 179.45 177.02 1cng s GLU 214 N -4.73 4.03 0.61 1.90 2.12 -1.26 -5.03 118.70 116.34 1cng s GLU 214 Ca -0.10 0.42 -0.09 0.00 0.36 0.00 0.00 54.97 55.56 1cng s GLU 214 Cb 0.13 -3.68 -0.02 0.00 0.26 0.00 0.00 34.13 30.82 1cng s GLU 214 CO 0.84 -0.46 0.98 -1.25 -0.54 0.00 0.00 175.26 174.83 1cng s PRO 215 N 2.51 3.37 0.18 4.30 0.04 -1.26 -4.70 135.00 139.45 1cng s PRO 215 Ca 0.25 0.50 0.05 0.00 0.04 0.00 0.00 61.00 61.84 1cng s PRO 215 Cb -0.15 -2.15 -0.04 0.00 0.04 0.00 0.00 34.50 32.20 1cng s PRO 215 CO 0.10 -0.60 0.20 0.96 0.04 0.00 0.00 177.00 177.70 1cng s ILE 216 N -3.11 4.76 -0.05 0.56 -4.36 -0.37 -4.93 121.20 113.70 1cng s ILE 216 Ca 0.54 -1.03 -0.03 0.00 -0.26 0.00 0.00 60.65 59.87 1cng s ILE 216 Cb -0.11 -3.47 -0.04 0.00 1.25 0.00 0.00 42.46 40.09 1cng s ILE 216 CO 0.51 -0.17 0.12 -0.44 0.24 0.00 0.00 174.94 175.20 1cng s SER 217 N -3.34 6.04 0.08 4.36 0.01 -1.26 -1.49 113.70 118.09 1cng s SER 217 Ca 0.32 0.30 0.03 0.00 1.31 0.00 0.00 55.95 57.92 1cng s SER 217 Cb -0.10 -1.85 -0.03 0.00 0.21 0.00 0.00 66.02 64.25 1cng s SER 217 CO 0.25 0.33 -0.09 0.68 0.41 0.00 0.00 173.24 174.82 1cng s VAL 218 N -1.14 0.77 0.61 3.43 -7.23 -0.62 -3.48 120.40 112.74 1cng s VAL 218 Ca 0.20 -1.48 -0.10 0.00 -1.81 0.00 0.00 61.98 58.79 1cng s VAL 218 Cb -0.12 -1.14 -0.03 0.00 0.56 0.00 0.00 36.38 35.64 1cng s VAL 218 CO 0.11 -0.53 1.00 -0.94 -0.31 0.00 0.00 175.10 174.43 1cng s SER 219 N -2.21 6.14 0.37 4.85 1.04 -1.20 -0.26 113.70 122.44 1cng s SER 219 Ca 0.01 1.31 0.07 0.00 0.48 0.00 0.00 55.95 57.82 1cng s SER 219 Cb -0.04 -2.37 0.73 0.00 0.10 0.00 0.00 66.02 64.44 1cng s SER 219 CO -0.01 -0.89 1.93 0.77 0.98 0.00 0.00 173.24 176.03 1cng h SER 220 N -0.28 0.39 -0.40 7.02 4.64 -1.94 -1.70 113.55 121.27 1cng h SER 220 Ca -0.44 -0.06 -0.06 0.00 -0.47 0.00 0.00 61.79 60.75 1cng h SER 220 Cb 1.20 -0.10 -0.02 0.00 -0.31 0.00 0.00 62.40 63.17 1cng h SER 220 CO 0.62 0.44 0.04 -0.33 -0.87 0.00 0.00 176.83 176.74 1cng h GLU 221 N 0.41 0.76 -0.22 4.77 3.07 -1.96 0.20 114.58 121.62 1cng h GLU 221 Ca 0.09 -0.18 -0.04 0.00 -0.50 0.00 0.00 59.36 58.73 1cng h GLU 221 Cb 0.25 -0.10 -0.01 0.00 -0.84 0.00 0.00 28.75 28.06 1cng h GLU 221 CO 0.01 0.75 -0.01 1.96 -1.40 0.00 0.00 179.01 180.31 1cng h GLN 222 N 0.72 0.39 -0.09 2.33 4.20 -1.71 -2.81 115.11 118.15 1cng h GLN 222 Ca 0.15 -0.13 -0.11 0.00 0.06 0.00 0.00 58.65 58.62 1cng h GLN 222 Cb 0.38 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 28.12 1cng h GLN 222 CO 0.01 0.59 -0.44 0.28 -0.67 0.00 0.00 178.83 178.60 1cng h VAL 223 N 0.14 1.32 -0.85 -0.54 2.07 -1.06 -2.76 116.25 114.57 1cng h VAL 223 Ca 0.06 -1.57 0.08 0.00 0.82 0.00 0.00 66.70 66.09 1cng h VAL 223 Cb 0.42 1.74 -0.07 0.00 -1.52 0.00 0.00 31.29 31.86 1cng h VAL 223 CO 0.01 0.47 0.51 -0.07 0.02 0.00 0.00 177.57 178.51 1cng h LEU 224 N 0.17 0.76 -1.18 2.57 4.07 -0.48 -1.77 115.31 119.45 1cng h LEU 224 Ca 0.01 0.04 0.02 0.00 0.08 0.00 0.00 57.88 58.03 1cng h LEU 224 Cb 0.84 -0.12 -0.04 0.00 1.08 0.00 0.00 40.66 42.42 1cng h LEU 224 CO 0.07 0.45 0.56 0.11 -1.08 0.00 0.00 178.44 178.54 1cng h LYS 225 N 0.88 1.07 -0.79 1.13 6.56 -1.23 -2.00 116.57 122.18 1cng h LYS 225 Ca 0.40 -0.06 0.02 0.00 -1.06 0.00 0.00 60.65 59.95 1cng h LYS 225 Cb 0.30 -0.24 -0.04 0.00 -0.57 0.00 0.00 32.23 31.68 1cng h LYS 225 CO -0.22 0.71 0.51 0.74 -2.06 0.00 0.00 179.45 179.13 1cng h PHE 226 N 1.10 0.97 0.00 -1.35 -1.00 -1.35 -2.40 116.94 112.91 1cng h PHE 226 Ca 0.32 0.02 0.00 0.00 2.81 0.00 0.00 57.97 61.12 1cng h PHE 226 Cb -0.07 -0.32 0.00 0.00 3.61 0.00 0.00 35.95 39.17 1cng h PHE 226 CO -0.00 0.58 0.00 0.54 -1.61 0.00 0.00 178.31 177.82 1cng n ARG 227 N -4.57 0.05 0.00 1.51 1.74 -0.76 -2.42 116.66 112.21 1cng n ARG 227 Ca 0.09 0.28 0.13 0.00 -0.77 0.00 0.00 57.85 57.57 1cng n ARG 227 Cb 0.06 -1.50 0.37 0.00 -1.02 0.00 0.00 32.46 30.37 1cng n ARG 227 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 1cng n LYS 228 N -1.43 0.63 -1.34 5.56 5.02 -0.90 -4.46 118.16 121.24 1cng n LYS 228 Ca 0.03 -0.36 -0.30 0.00 -2.02 0.00 0.00 58.31 55.66 1cng n LYS 228 Cb 0.11 -1.49 0.10 0.00 -0.02 0.00 0.00 35.03 33.73 1cng n LYS 228 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1cng s LEU 229 N -2.62 2.68 0.05 -0.35 1.02 -1.02 -4.88 118.68 113.56 1cng s LEU 229 Ca 0.22 1.57 0.09 0.00 0.02 0.00 0.00 54.13 56.02 1cng s LEU 229 Cb 0.19 -4.17 -0.03 0.00 0.02 0.00 0.00 46.19 42.20 1cng s LEU 229 CO 0.56 -2.16 -0.26 0.20 0.02 0.00 0.00 176.35 174.71 1cng s ASN 230 N -3.57 3.06 0.04 2.29 0.02 0.18 -0.36 114.94 116.60 1cng s ASN 230 Ca 0.61 -0.59 -0.16 0.00 -1.02 0.00 0.00 52.86 51.71 1cng s ASN 230 Cb -0.16 -0.27 -0.32 0.00 0.02 0.00 0.00 41.25 40.51 1cng s ASN 230 CO 0.56 0.24 1.04 -0.26 0.02 0.00 0.00 177.10 178.70 1cng h PHE 231 N 4.78 0.97 -4.05 2.20 0.04 -1.28 -3.36 116.94 116.24 1cng h PHE 231 Ca -0.46 -0.66 -0.48 0.00 2.80 0.00 0.00 57.97 59.17 1cng h PHE 231 Cb 1.15 -0.06 0.15 0.00 2.20 0.00 0.00 35.95 39.39 1cng h PHE 231 CO 0.49 1.50 0.24 0.54 -0.60 0.00 0.00 178.31 180.48 1cng s ASN 232 N -7.46 3.36 0.57 2.17 4.22 -1.26 -4.32 114.94 112.22 1cng s ASN 232 Ca -0.10 1.48 0.00 0.00 -2.14 0.00 0.00 52.86 52.10 1cng s ASN 232 Cb 0.04 -2.15 0.04 0.00 1.28 0.00 0.00 41.25 40.46 1cng s ASN 232 CO 0.93 -2.71 0.80 -0.83 -2.04 0.00 0.00 177.10 173.25 1cng s GLY 233 N -3.40 1.81 0.34 0.45 0.00 -1.26 -1.01 107.32 104.25 1cng s GLY 233 Ca 0.64 -1.28 -0.29 0.00 0.00 0.00 0.00 44.72 43.79 1cng s GLY 233 CO 0.57 -0.98 1.54 -2.21 0.00 0.00 0.00 173.10 172.02 1cng n GLU 234 N -2.40 2.72 -0.82 2.90 2.13 -1.26 -2.28 120.64 121.62 1cng n GLU 234 Ca 0.08 0.96 0.00 0.00 0.66 0.00 0.00 57.16 58.86 1cng n GLU 234 Cb 0.60 -2.72 0.00 0.00 0.27 0.00 0.00 31.44 29.59 1cng n GLU 234 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1cng n GLY 235 N 1.19 0.86 3.83 8.31 0.00 -1.26 -5.03 105.19 113.10 1cng n GLY 235 Ca 0.04 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.85 1cng n GLY 235 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1cng s GLU 236 N -0.18 2.78 0.39 1.61 2.02 -0.97 -5.07 118.70 119.28 1cng s GLU 236 Ca 0.00 -1.21 -0.27 0.00 0.02 0.00 0.00 54.97 53.51 1cng s GLU 236 Cb 0.00 -2.49 -0.10 0.00 0.10 0.00 0.00 34.13 31.64 1cng s GLU 236 CO 0.00 0.22 1.41 -1.25 0.02 0.00 0.00 175.26 175.66 1cng s PRO 237 N -3.93 4.03 -0.00 0.39 0.04 -1.26 -4.89 135.00 129.38 1cng s PRO 237 Ca 0.38 2.41 -0.30 0.00 0.04 0.00 0.00 61.00 63.52 1cng s PRO 237 Cb -0.06 -2.88 -0.06 0.00 0.04 0.00 0.00 34.50 31.54 1cng s PRO 237 CO 0.26 -0.54 1.46 -2.00 0.04 0.00 0.00 177.00 176.23 1cng s GLU 238 N -2.15 4.25 -0.21 4.56 2.12 -1.26 -4.74 118.70 121.27 1cng s GLU 238 Ca 0.55 2.04 0.00 0.00 0.36 0.00 0.00 54.97 57.92 1cng s GLU 238 Cb -0.43 -3.63 0.05 0.00 0.26 0.00 0.00 34.13 30.38 1cng s GLU 238 CO 0.58 -0.64 -0.06 -1.21 -0.54 0.00 0.00 175.26 173.39 1cng s GLU 239 N 2.66 1.65 0.29 4.30 2.02 -1.26 -5.05 118.70 123.31 1cng s GLU 239 Ca 0.66 -0.86 -0.29 0.00 0.02 0.00 0.00 54.97 54.50 1cng s GLU 239 Cb -0.33 -2.44 -0.10 0.00 0.10 0.00 0.00 34.13 31.37 1cng s GLU 239 CO 0.27 -0.53 1.37 -0.51 0.02 0.00 0.00 175.26 175.88 1cng s LEU 240 N 1.45 4.40 -0.88 1.80 1.43 -1.26 -0.89 118.68 124.73 1cng s LEU 240 Ca -0.04 2.68 -0.24 0.00 -1.03 0.00 0.00 54.13 55.51 1cng s LEU 240 Cb -0.18 -3.64 0.05 0.00 0.03 0.00 0.00 46.19 42.46 1cng s LEU 240 CO -0.07 -0.63 1.31 -0.32 0.23 0.00 0.00 176.35 176.87 1cng s MET 241 N -1.10 3.41 0.05 1.70 -2.45 0.52 -4.64 119.30 116.79 1cng s MET 241 Ca 0.54 -0.88 -0.04 0.00 -1.25 0.00 0.00 55.69 54.06 1cng s MET 241 Cb -0.41 -4.81 -0.02 0.00 1.25 0.00 0.00 34.83 30.84 1cng s MET 241 CO 0.49 -2.10 0.06 0.14 1.05 0.00 0.00 175.02 174.65 1cng s VAL 242 N 4.87 0.16 -1.37 10.11 -7.23 -1.26 -4.51 120.40 121.17 1cng s VAL 242 Ca 0.38 -1.35 -0.06 0.00 -1.81 0.00 0.00 61.98 59.15 1cng s VAL 242 Cb -0.05 -1.14 0.03 0.00 0.56 0.00 0.00 36.38 35.78 1cng s VAL 242 CO 0.00 -0.75 0.92 0.47 -0.31 0.00 0.00 175.10 175.43 1cng n ASP 243 N 0.46 -3.29 -2.88 4.85 8.00 -0.05 -4.87 116.55 118.77 1cng n ASP 243 Ca -0.17 -0.73 -0.33 0.00 0.71 0.00 0.00 54.79 54.27 1cng n ASP 243 Cb 0.60 -4.34 -0.03 0.00 -0.02 0.00 0.00 41.12 37.33 1cng n ASP 243 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 1cng n ASN 244 N -3.00 7.07 -4.16 -2.24 6.94 -1.15 -4.91 115.26 113.82 1cng n ASN 244 Ca -0.14 -3.31 -0.20 0.00 -0.02 0.00 0.00 54.58 50.91 1cng n ASN 244 Cb 0.61 -1.24 -0.13 0.00 -2.36 0.00 0.00 39.78 36.66 1cng n ASN 244 CO 0.00 0.00 0.00 -1.66 -1.03 0.00 0.00 177.26 174.57 1cng s TRP 245 N -2.09 1.26 -0.06 -2.53 1.48 -1.26 -4.64 118.94 111.09 1cng s TRP 245 Ca 0.55 -0.39 -0.12 0.00 -1.06 0.00 0.00 56.10 55.08 1cng s TRP 245 Cb 0.33 -0.73 -0.05 0.00 -1.16 0.00 0.00 33.47 31.86 1cng s TRP 245 CO -0.21 0.05 0.30 0.50 -4.06 0.00 0.00 176.95 173.53 1cng s ARG 246 N -1.37 3.82 0.74 3.25 3.52 -1.26 -4.98 118.95 122.67 1cng s ARG 246 Ca 0.01 0.19 -0.12 0.00 -0.13 0.00 0.00 55.73 55.68 1cng s ARG 246 Cb -0.09 -3.24 0.04 0.00 -1.56 0.00 0.00 34.95 30.10 1cng s ARG 246 CO 0.02 0.64 1.10 -1.25 -0.81 0.00 0.00 175.30 175.00 1cng s PRO 247 N -0.80 2.44 0.36 5.12 0.04 -1.26 -4.69 135.00 136.21 1cng s PRO 247 Ca 0.20 1.23 -0.27 0.00 0.04 0.00 0.00 61.00 62.19 1cng s PRO 247 Cb -0.15 -1.92 -0.12 0.00 0.04 0.00 0.00 34.50 32.36 1cng s PRO 247 CO 0.09 -1.51 1.28 0.00 0.04 0.00 0.00 177.00 176.90 1cng n ALA 248 N -3.18 1.30 -2.75 8.56 0.00 -1.26 -4.37 120.51 118.81 1cng n ALA 248 Ca 0.09 0.33 -0.25 0.00 0.00 0.00 0.00 53.44 53.62 1cng n ALA 248 Cb 0.53 -2.26 -0.06 0.00 0.00 0.00 0.00 19.45 17.66 1cng n ALA 248 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1cng s GLN 249 N -1.97 2.70 0.36 0.00 -1.52 0.22 -4.93 119.66 114.53 1cng s GLN 249 Ca 0.57 -1.05 -0.28 0.00 -1.95 0.00 0.00 55.36 52.65 1cng s GLN 249 Cb -0.55 -2.49 -0.10 0.00 -0.22 0.00 0.00 33.01 29.65 1cng s GLN 249 CO 0.61 0.44 1.39 -1.25 -0.25 0.00 0.00 175.29 176.23 1cng s PRO 250 N -3.33 4.19 0.31 2.91 0.04 -1.26 -4.50 135.00 133.36 1cng s PRO 250 Ca 0.31 2.37 0.09 0.00 0.04 0.00 0.00 61.00 63.80 1cng s PRO 250 Cb -0.09 -2.98 0.50 0.00 0.04 0.00 0.00 34.50 31.97 1cng s PRO 250 CO 0.22 -0.39 1.72 1.25 0.04 0.00 0.00 177.00 179.84 1cng h LEU 251 N 3.11 0.15 0.00 -3.56 5.85 -1.94 -3.45 115.31 115.48 1cng h LEU 251 Ca -0.50 -0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.16 1cng h LEU 251 Cb 1.23 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 42.22 1cng h LEU 251 CO 0.64 0.57 0.00 0.29 -0.34 0.00 0.00 178.44 179.61 1cng n LYS 252 N -4.01 0.00 -2.32 1.25 5.02 -1.26 -3.38 118.16 113.46 1cng n LYS 252 Ca -0.02 0.00 -0.41 0.00 -2.02 0.00 0.00 58.31 55.86 1cng n LYS 252 Cb 0.48 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.50 1cng n LYS 252 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 1cng n ASN 253 N 2.38 6.84 -4.08 4.39 6.94 -1.26 -4.91 115.26 125.55 1cng n ASN 253 Ca 0.00 -3.25 -0.10 0.00 -0.02 0.00 0.00 54.58 51.21 1cng n ASN 253 Cb 0.00 -1.36 -0.11 0.00 -2.36 0.00 0.00 39.78 35.96 1cng n ASN 253 CO 0.00 0.00 0.00 -0.13 -1.03 0.00 0.00 177.26 176.10 1cng s ARG 254 N -1.35 0.58 -0.05 -3.83 0.52 -1.22 -5.12 118.95 108.49 1cng s ARG 254 Ca 0.44 -0.97 0.05 0.00 -0.52 0.00 0.00 55.73 54.73 1cng s ARG 254 Cb 0.14 -0.09 -0.01 0.00 0.52 0.00 0.00 34.95 35.51 1cng s ARG 254 CO -0.04 -0.02 -0.20 -1.14 0.02 0.00 0.00 175.30 173.92 1cng s GLN 255 N -2.61 2.11 -0.17 3.54 2.00 -1.26 -5.03 119.66 118.24 1cng s GLN 255 Ca -0.02 -0.72 -0.16 0.00 -2.00 0.00 0.00 55.36 52.46 1cng s GLN 255 Cb -0.02 -1.80 -0.04 0.00 0.80 0.00 0.00 33.01 31.95 1cng s GLN 255 CO -0.03 0.28 0.39 0.42 -0.50 0.00 0.00 175.29 175.85 1cng s ILE 256 N 0.00 5.22 0.08 -2.34 1.01 -1.26 -4.70 121.20 119.22 1cng s ILE 256 Ca -0.05 0.73 0.03 0.00 0.00 0.00 0.00 60.65 61.35 1cng s ILE 256 Cb -0.13 -3.73 -0.04 0.00 0.01 0.00 0.00 42.46 38.58 1cng s ILE 256 CO 0.03 0.30 0.11 -0.54 0.00 0.00 0.00 174.94 174.84 1cng s LYS 257 N 0.93 2.97 0.00 2.79 -0.14 -0.25 -1.40 119.74 124.65 1cng s LYS 257 Ca 0.20 -0.67 0.06 0.00 -1.36 0.00 0.00 55.97 54.20 1cng s LYS 257 Cb -0.14 -2.77 -0.03 0.00 -1.68 0.00 0.00 37.83 33.21 1cng s LYS 257 CO 0.07 0.57 -0.17 0.00 -0.76 0.00 0.00 175.35 175.06 1cng s ALA 258 N -1.44 2.61 -2.21 5.17 0.00 0.33 -0.92 121.76 125.29 1cng s ALA 258 Ca 0.30 -1.11 0.27 0.00 0.00 0.00 0.00 51.96 51.43 1cng s ALA 258 Cb -0.12 -0.82 0.93 0.00 0.00 0.00 0.00 23.12 23.11 1cng s ALA 258 CO 0.23 0.57 1.67 -1.13 0.00 0.00 0.00 175.76 177.10 1cng n SER 259 N 1.86 1.33 -4.23 0.00 3.41 -0.21 -0.73 113.62 115.05 1cng n SER 259 Ca -0.16 -1.27 -0.13 0.00 -0.26 0.00 0.00 58.87 57.05 1cng n SER 259 Cb 0.52 0.05 -0.10 0.00 -0.26 0.00 0.00 64.21 64.42 1cng n SER 259 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 1cng s PHE 260 N -2.19 1.17 -0.56 7.33 -0.71 -1.26 -4.90 117.98 116.86 1cng s PHE 260 Ca 0.33 -1.02 0.04 0.00 -1.04 0.00 0.00 56.93 55.24 1cng s PHE 260 Cb 0.20 -0.67 0.04 0.00 -1.21 0.00 0.00 43.02 41.38 1cng s PHE 260 CO 0.41 -0.22 0.64 1.17 -1.34 0.00 0.00 175.22 175.88