#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h6t s LYS 4 N 0.00 2.61 0.26 1.20 2.20 -1.26 -5.08 119.74 119.67 3h6t s LYS 4 Ca 0.00 -0.80 -0.30 0.00 -0.36 0.00 0.00 55.97 54.51 3h6t s LYS 4 Cb 0.00 -2.57 -0.10 0.00 -1.51 0.00 0.00 37.83 33.64 3h6t s LYS 4 CO 0.00 0.55 1.49 0.99 -0.36 0.00 0.00 175.35 178.02 3h6t s THR 5 N -1.30 2.47 -0.07 3.43 2.01 -1.26 -4.81 115.64 116.12 3h6t s THR 5 Ca 0.26 0.40 -0.28 0.00 0.31 0.00 0.00 61.69 62.37 3h6t s THR 5 Cb -0.12 -3.26 -0.02 0.00 0.01 0.00 0.00 72.50 69.12 3h6t s THR 5 CO 0.18 0.06 0.93 -0.69 -0.69 0.00 0.00 174.62 174.41 3h6t s VAL 6 N -0.03 4.87 -0.34 3.82 1.01 0.41 -4.91 120.40 125.23 3h6t s VAL 6 Ca 0.60 1.91 -0.24 0.00 0.00 0.00 0.00 61.98 64.25 3h6t s VAL 6 Cb -0.44 -4.25 0.01 0.00 0.00 0.00 0.00 36.38 31.70 3h6t s VAL 6 CO 0.45 0.10 0.82 -0.69 0.00 0.00 0.00 175.10 175.78 3h6t s VAL 7 N 1.48 4.73 -0.31 2.92 1.01 -1.26 -0.70 120.40 128.26 3h6t s VAL 7 Ca 0.47 1.10 -0.08 0.00 0.00 0.00 0.00 61.98 63.47 3h6t s VAL 7 Cb -0.19 -4.21 0.01 0.00 0.00 0.00 0.00 36.38 31.99 3h6t s VAL 7 CO 0.21 -0.36 0.12 -0.69 0.00 0.00 0.00 175.10 174.38 3h6t s VAL 8 N 3.11 4.27 -0.00 2.92 1.01 -0.30 -1.26 120.40 130.15 3h6t s VAL 8 Ca 0.33 -0.63 -0.19 0.00 0.00 0.00 0.00 61.98 61.49 3h6t s VAL 8 Cb -0.13 -3.22 -0.05 0.00 0.00 0.00 0.00 36.38 32.97 3h6t s VAL 8 CO 0.15 0.03 0.55 0.28 0.00 0.00 0.00 175.10 176.11 3h6t s THR 9 N 1.54 4.93 0.20 3.92 -1.32 -0.08 -0.31 115.64 124.52 3h6t s THR 9 Ca 0.03 1.15 -0.00 0.00 -1.21 0.00 0.00 61.69 61.66 3h6t s THR 9 Cb -0.17 -3.88 0.00 0.00 -1.51 0.00 0.00 72.50 66.94 3h6t s THR 9 CO 0.04 0.45 0.27 1.07 -2.21 0.00 0.00 174.62 174.24 3h6t n THR 10 N 2.54 0.00 -4.07 5.08 5.66 -0.69 -2.48 114.28 120.32 3h6t n THR 10 Ca -0.08 -1.09 -0.13 0.00 -3.05 0.00 0.00 64.05 59.70 3h6t n THR 10 Cb 0.51 0.65 -0.13 0.00 -1.55 0.00 0.00 70.33 69.81 3h6t n THR 10 CO 0.00 0.00 0.00 -0.51 -3.05 0.00 0.00 175.07 171.51 3h6t s ILE 11 N -2.67 0.40 -0.70 1.09 2.07 -1.26 -1.05 121.20 119.08 3h6t s ILE 11 Ca 0.18 -0.70 -0.27 0.00 -1.41 0.00 0.00 60.65 58.45 3h6t s ILE 11 Cb -0.00 -0.43 0.02 0.00 0.13 0.00 0.00 42.46 42.18 3h6t s ILE 11 CO 0.13 -0.21 1.35 -0.76 -1.91 0.00 0.00 174.94 173.54 3h6t s LEU 12 N -0.97 3.21 -0.18 8.50 1.43 -1.26 -4.32 118.68 125.09 3h6t s LEU 12 Ca -0.06 -0.26 -0.05 0.00 -1.03 0.00 0.00 54.13 52.72 3h6t s LEU 12 Cb -0.07 -2.64 0.09 0.00 0.03 0.00 0.00 46.19 43.61 3h6t s LEU 12 CO 0.00 -1.87 0.35 -0.70 0.23 0.00 0.00 176.35 174.36 3h6t s GLU 13 N 5.83 0.26 0.31 1.70 2.56 -0.59 -4.99 118.70 123.78 3h6t s GLU 13 Ca 0.41 0.83 -0.29 0.00 0.00 0.00 0.00 54.97 55.92 3h6t s GLU 13 Cb -0.09 0.03 -0.10 0.00 2.00 0.00 0.00 34.13 35.97 3h6t s GLU 13 CO 0.17 -0.34 1.22 -1.12 -0.56 0.00 0.00 175.26 174.63 3h6t s SER 14 N 2.53 6.98 -0.37 -1.70 0.01 -1.26 -0.48 113.70 119.41 3h6t s SER 14 Ca 0.02 2.51 0.07 0.00 1.31 0.00 0.00 55.95 59.85 3h6t s SER 14 Cb -0.13 -2.64 0.62 0.00 0.21 0.00 0.00 66.02 64.09 3h6t s SER 14 CO -0.12 -0.37 1.73 -0.81 0.41 0.00 0.00 173.24 174.08 3h6t n PRO 15 N 1.01 2.36 -0.03 12.44 -0.04 -1.26 -4.92 135.00 144.56 3h6t n PRO 15 Ca -0.00 -3.08 -0.12 0.00 -0.04 0.00 0.00 63.50 60.26 3h6t n PRO 15 Cb 0.43 -2.05 -0.10 0.00 -0.04 0.00 0.00 33.50 31.74 3h6t n PRO 15 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 3h6t h TYR 16 N 1.28 -0.05 -3.18 0.54 0.05 -1.12 -1.32 116.97 113.18 3h6t h TYR 16 Ca 0.42 -0.00 -0.30 0.00 0.05 0.00 0.00 58.73 58.89 3h6t h TYR 16 Cb 2.33 0.01 -0.36 0.00 1.01 0.00 0.00 36.73 39.73 3h6t h TYR 16 CO 1.32 0.62 -0.66 0.08 -1.05 0.00 0.00 178.16 178.48 3h6t s VAL 17 N -3.01 -0.19 0.05 -2.88 1.01 -0.64 -0.88 120.40 113.86 3h6t s VAL 17 Ca -0.16 0.34 -0.02 0.00 0.00 0.00 0.00 61.98 62.14 3h6t s VAL 17 Cb -0.01 -0.25 -0.03 0.00 0.00 0.00 0.00 36.38 36.09 3h6t s VAL 17 CO 0.59 0.14 0.00 -0.04 0.00 0.00 0.00 175.10 175.80 3h6t s MET 18 N 2.06 0.63 0.02 2.72 -1.94 -0.40 -1.54 119.30 120.85 3h6t s MET 18 Ca 0.01 -1.15 -0.22 0.00 -1.71 0.00 0.00 55.69 52.62 3h6t s MET 18 Cb -0.12 0.22 -0.06 0.00 2.01 0.00 0.00 34.83 36.89 3h6t s MET 18 CO -0.05 -0.13 0.65 -1.64 -0.01 0.00 0.00 175.02 173.84 3h6t s MET 19 N -3.78 4.37 0.65 2.03 -1.94 -1.26 -1.42 119.30 117.96 3h6t s MET 19 Ca 0.05 0.85 -0.17 0.00 -1.71 0.00 0.00 55.69 54.72 3h6t s MET 19 Cb 0.07 -3.34 -0.01 0.00 2.01 0.00 0.00 34.83 33.56 3h6t s MET 19 CO -0.10 0.37 1.20 0.15 -0.01 0.00 0.00 175.02 176.63 3h6t s LYS 20 N -0.25 2.67 0.58 2.03 1.02 -0.62 -4.87 119.74 120.30 3h6t s LYS 20 Ca 0.33 1.76 0.36 0.00 0.02 0.00 0.00 55.97 58.44 3h6t s LYS 20 Cb -0.19 -1.90 1.97 0.00 -0.52 0.00 0.00 37.83 37.19 3h6t s LYS 20 CO 0.19 -1.43 2.11 1.57 -0.92 0.00 0.00 175.35 176.88 3h6t h LYS 21 N 0.39 0.00 -0.12 1.68 2.10 -1.96 -1.50 116.57 117.16 3h6t h LYS 21 Ca -0.49 0.00 -0.09 0.00 -2.00 0.00 0.00 60.65 58.07 3h6t h LYS 21 Cb 1.29 0.00 -0.07 0.00 -0.90 0.00 0.00 32.23 32.55 3h6t h LYS 21 CO 0.53 0.00 -0.55 0.27 -2.00 0.00 0.00 179.45 177.70 3h6t n ASN 22 N -2.83 2.22 0.20 7.07 6.94 -1.26 -4.80 115.26 122.80 3h6t n ASN 22 Ca -0.02 -3.88 0.12 0.00 -0.02 0.00 0.00 54.58 50.78 3h6t n ASN 22 Cb 0.12 -0.50 0.69 0.00 -2.36 0.00 0.00 39.78 37.73 3h6t n ASN 22 CO 0.00 0.00 0.00 1.12 -1.03 0.00 0.00 177.26 177.35 3h6t h HIS 23 N 1.19 0.00 -0.55 -2.53 2.07 -1.55 -2.63 115.15 111.15 3h6t h HIS 23 Ca 0.06 0.00 0.09 0.00 -2.85 0.00 0.00 60.37 57.66 3h6t h HIS 23 Cb 1.09 0.00 -0.03 0.00 2.57 0.00 0.00 27.41 31.04 3h6t h HIS 23 CO 0.77 0.00 0.37 1.49 -3.07 0.00 0.00 177.93 177.49 3h6t h GLU 24 N 0.00 0.38 -0.60 5.12 4.81 -1.87 -0.12 114.58 122.30 3h6t h GLU 24 Ca 0.06 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.27 3h6t h GLU 24 Cb 0.26 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.56 3h6t h GLU 24 CO -0.00 0.25 0.00 -1.33 -0.73 0.00 0.00 179.01 177.20 3h6t n MET 25 N -4.47 2.78 -4.42 1.92 2.81 -0.99 -4.93 117.12 109.82 3h6t n MET 25 Ca 0.09 -2.14 -0.25 0.00 -1.81 0.00 0.00 57.70 53.58 3h6t n MET 25 Cb 0.34 -1.62 -0.09 0.00 -0.71 0.00 0.00 33.22 31.13 3h6t n MET 25 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 3h6t s LEU 26 N -1.31 2.89 0.09 4.03 1.43 -0.06 -5.14 118.68 120.62 3h6t s LEU 26 Ca 0.39 -1.08 0.01 0.00 -1.03 0.00 0.00 54.13 52.42 3h6t s LEU 26 Cb 0.23 -1.21 -0.04 0.00 0.03 0.00 0.00 46.19 45.20 3h6t s LEU 26 CO 0.22 -0.24 -0.06 -1.61 0.23 0.00 0.00 176.35 174.88 3h6t s GLU 27 N -3.68 0.79 5.77 1.70 2.02 -1.26 -4.81 118.70 119.23 3h6t s GLU 27 Ca 0.34 -1.29 0.00 0.00 0.02 0.00 0.00 54.97 54.04 3h6t s GLU 27 Cb 0.01 -0.17 0.00 0.00 0.10 0.00 0.00 34.13 34.07 3h6t s GLU 27 CO 0.18 -0.02 0.00 0.41 0.02 0.00 0.00 175.26 175.85 3h6t n GLY 28 N 0.06 2.97 0.28 -1.39 0.00 -1.26 -2.34 105.19 103.52 3h6t n GLY 28 Ca -0.13 -0.30 0.18 0.00 0.00 0.00 0.00 46.02 45.76 3h6t n GLY 28 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 3h6t h ASN 29 N 7.39 0.00 0.54 1.61 2.35 -1.93 -3.07 115.58 122.47 3h6t h ASN 29 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 3h6t h ASN 29 Cb 0.00 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.37 3h6t h ASN 29 CO 0.00 0.00 0.00 -1.84 -1.65 0.00 0.00 177.43 173.94 3h6t n GLU 30 N -3.10 0.16 0.22 0.81 0.28 -0.99 -2.39 120.64 115.64 3h6t n GLU 30 Ca 0.00 0.45 0.09 0.00 -0.16 0.00 0.00 57.16 57.55 3h6t n GLU 30 Cb 0.30 -1.85 0.47 0.00 1.43 0.00 0.00 31.44 31.79 3h6t n GLU 30 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 3h6t h ARG 31 N 0.00 0.00 -6.20 3.44 3.08 -1.64 -3.46 114.38 109.59 3h6t h ARG 31 Ca 0.00 0.00 -0.56 0.00 0.07 0.00 0.00 59.98 59.49 3h6t h ARG 31 Cb 0.27 0.00 -0.07 0.00 0.08 0.00 0.00 29.97 30.25 3h6t h ARG 31 CO 0.00 0.25 -0.56 0.71 -1.07 0.00 0.00 179.97 179.29 3h6t s TYR 32 N -3.74 3.12 0.08 3.04 2.02 -1.00 -1.59 117.35 119.27 3h6t s TYR 32 Ca -0.00 -0.05 -0.09 0.00 -0.37 0.00 0.00 57.07 56.56 3h6t s TYR 32 Cb 0.11 -1.48 0.00 0.00 -0.40 0.00 0.00 41.96 40.19 3h6t s TYR 32 CO 0.64 0.52 0.20 -1.83 -1.57 0.00 0.00 175.55 173.52 3h6t s GLU 33 N -3.24 0.84 0.00 -0.62 -1.05 -0.50 -4.86 118.70 109.26 3h6t s GLU 33 Ca 0.31 -0.90 0.00 0.00 -0.15 0.00 0.00 54.97 54.23 3h6t s GLU 33 Cb -0.10 0.34 0.00 0.00 -0.44 0.00 0.00 34.13 33.94 3h6t s GLU 33 CO 0.23 -0.27 0.00 0.41 0.95 0.00 0.00 175.26 176.58 3h6t n GLY 34 N 0.02 3.20 0.39 -3.83 0.00 -1.26 -1.27 105.19 102.43 3h6t n GLY 34 Ca -0.16 -1.78 -0.09 0.00 0.00 0.00 0.00 46.02 44.00 3h6t n GLY 34 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 3h6t h TYR 35 N 0.00 -1.22 -0.05 1.61 5.03 -0.88 0.51 116.97 121.97 3h6t h TYR 35 Ca 0.00 0.08 -0.08 0.00 2.58 0.00 0.00 58.73 61.30 3h6t h TYR 35 Cb 0.00 0.61 -0.01 0.00 1.55 0.00 0.00 36.73 38.87 3h6t h TYR 35 CO 0.00 -0.42 -0.36 0.00 -1.32 0.00 0.00 178.16 176.06 3h6t h VAL 37 N 0.08 1.08 -0.65 0.00 2.07 -1.12 0.96 116.25 118.67 3h6t h VAL 37 Ca 0.01 -0.22 -0.04 0.00 0.82 0.00 0.00 66.70 67.27 3h6t h VAL 37 Cb 0.68 1.03 -0.03 0.00 -1.52 0.00 0.00 31.29 31.45 3h6t h VAL 37 CO 0.05 0.07 0.24 0.44 0.02 0.00 0.00 177.57 178.39 3h6t h ASP 38 N 0.09 0.91 -0.50 0.57 3.32 -0.56 -2.57 116.42 117.69 3h6t h ASP 38 Ca 0.04 -0.18 -0.01 0.00 0.02 0.00 0.00 57.03 56.89 3h6t h ASP 38 Cb 0.06 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.35 3h6t h ASP 38 CO -0.01 0.85 0.26 0.25 -1.72 0.00 0.00 179.24 178.87 3h6t h LEU 39 N 0.92 0.63 -0.72 1.55 5.85 -0.74 -1.81 115.31 121.00 3h6t h LEU 39 Ca 0.21 -0.11 0.04 0.00 0.84 0.00 0.00 57.88 58.87 3h6t h LEU 39 Cb 0.23 -0.16 -0.05 0.00 0.37 0.00 0.00 40.66 41.05 3h6t h LEU 39 CO -0.01 0.56 0.44 0.00 -0.34 0.00 0.00 178.44 179.08 3h6t h ALA 40 N 1.10 0.95 -0.62 1.25 0.00 -0.68 0.25 119.26 121.51 3h6t h ALA 40 Ca 0.17 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 55.09 3h6t h ALA 40 Cb 0.08 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 17.62 3h6t h ALA 40 CO -0.03 0.19 0.39 0.00 0.00 0.00 0.00 179.25 179.81 3h6t h ALA 41 N 1.32 0.81 -0.01 0.00 0.00 -1.04 0.74 119.26 121.08 3h6t h ALA 41 Ca 0.30 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.18 3h6t h ALA 41 Cb 0.07 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.66 3h6t h ALA 41 CO -0.13 0.15 0.00 0.93 0.00 0.00 0.00 179.25 180.20 3h6t h GLU 42 N 0.77 0.02 -0.43 0.00 4.39 -0.43 -1.86 114.58 117.05 3h6t h GLU 42 Ca 0.25 -0.01 0.05 0.00 0.34 0.00 0.00 59.36 59.99 3h6t h GLU 42 Cb -0.00 -0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 28.60 3h6t h GLU 42 CO -0.09 0.30 0.18 0.82 -1.16 0.00 0.00 179.01 179.06 3h6t h ILE 43 N -0.26 0.91 -0.84 3.13 1.08 -0.30 -1.25 117.51 119.98 3h6t h ILE 43 Ca 0.00 -0.13 0.01 0.00 -0.39 0.00 0.00 64.86 64.35 3h6t h ILE 43 Cb 0.29 0.51 -0.04 0.00 -3.07 0.00 0.00 36.82 34.51 3h6t h ILE 43 CO 0.00 0.07 0.55 0.00 -0.69 0.00 0.00 178.15 178.08 3h6t h ALA 44 N 1.26 1.07 -0.30 1.87 0.00 -0.81 -1.11 119.26 121.24 3h6t h ALA 44 Ca 0.19 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 55.00 3h6t h ALA 44 Cb 0.15 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 3h6t h ALA 44 CO -0.17 0.49 0.05 -0.22 0.00 0.00 0.00 179.25 179.39 3h6t h LYS 45 N 1.15 0.49 0.00 0.00 3.64 -0.82 0.16 116.57 121.19 3h6t h LYS 45 Ca 0.31 -0.13 0.00 0.00 -1.27 0.00 0.00 60.65 59.56 3h6t h LYS 45 Cb -0.12 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 31.64 3h6t h LYS 45 CO -0.07 0.59 0.00 0.45 -2.27 0.00 0.00 179.45 178.16 3h6t h HIS 46 N 0.31 0.00 -0.01 1.91 3.86 -1.01 -2.68 115.15 117.53 3h6t h HIS 46 Ca 0.09 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.30 3h6t h HIS 46 Cb 0.34 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.81 3h6t h HIS 46 CO 0.02 0.00 -0.37 0.00 0.86 0.00 0.00 177.93 178.44 3h6t n GLY 48 N 1.18 -0.19 3.07 0.00 0.00 0.41 -5.05 105.19 104.61 3h6t n GLY 48 Ca 0.06 -0.02 -0.09 0.00 0.00 0.00 0.00 46.02 45.97 3h6t n GLY 48 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3h6t s PHE 49 N -3.27 0.53 0.05 1.61 -0.12 -0.40 -4.94 117.98 111.44 3h6t s PHE 49 Ca 0.02 -0.78 -0.08 0.00 -0.05 0.00 0.00 56.93 56.04 3h6t s PHE 49 Cb -0.00 -0.35 -0.05 0.00 -0.63 0.00 0.00 43.02 41.98 3h6t s PHE 49 CO 0.55 -0.23 0.33 0.15 -0.05 0.00 0.00 175.22 175.97 3h6t s LYS 50 N -2.76 3.66 0.17 1.99 1.02 -1.26 -4.58 119.74 117.97 3h6t s LYS 50 Ca -0.02 0.03 -0.01 0.00 0.02 0.00 0.00 55.97 55.99 3h6t s LYS 50 Cb -0.01 -3.02 -0.04 0.00 -0.52 0.00 0.00 37.83 34.24 3h6t s LYS 50 CO -0.05 0.59 0.08 1.52 -0.92 0.00 0.00 175.35 176.58 3h6t s TYR 51 N -1.37 1.04 -0.15 3.18 1.13 -1.26 -0.44 117.35 119.47 3h6t s TYR 51 Ca 0.31 -1.28 -0.00 0.00 -1.41 0.00 0.00 57.07 54.69 3h6t s TYR 51 Cb -0.13 -0.55 0.04 0.00 -1.10 0.00 0.00 41.96 40.21 3h6t s TYR 51 CO 0.18 -0.54 -0.06 0.21 -2.51 0.00 0.00 175.55 172.82 3h6t s LYS 52 N -4.09 1.49 -0.00 -3.49 2.47 0.12 -4.87 119.74 111.37 3h6t s LYS 52 Ca 0.31 -0.43 -0.30 0.00 -1.56 0.00 0.00 55.97 53.99 3h6t s LYS 52 Cb 0.07 -1.87 -0.04 0.00 -1.46 0.00 0.00 37.83 34.53 3h6t s LYS 52 CO 0.07 -0.37 1.11 -0.51 0.16 0.00 0.00 175.35 175.80 3h6t s LEU 53 N 1.65 4.34 -0.07 5.43 1.43 -1.26 -1.15 118.68 129.05 3h6t s LEU 53 Ca 0.02 1.80 0.01 0.00 -1.03 0.00 0.00 54.13 54.93 3h6t s LEU 53 Cb -0.14 -3.57 0.02 0.00 0.03 0.00 0.00 46.19 42.53 3h6t s LEU 53 CO -0.08 -0.42 -0.06 -0.89 0.23 0.00 0.00 176.35 175.12 3h6t s THR 54 N 1.39 0.78 -0.00 5.49 2.01 0.57 -4.85 115.64 121.03 3h6t s THR 54 Ca 0.55 -0.20 -0.30 0.00 0.31 0.00 0.00 61.69 62.04 3h6t s THR 54 Cb -0.24 -0.80 -0.04 0.00 0.01 0.00 0.00 72.50 71.43 3h6t s THR 54 CO 0.26 0.30 1.07 -0.63 -0.69 0.00 0.00 174.62 174.92 3h6t s ILE 55 N 1.26 4.57 0.00 1.82 -1.09 -1.26 -1.71 121.20 124.79 3h6t s ILE 55 Ca -0.05 1.85 -0.37 0.00 -2.23 0.00 0.00 60.65 59.85 3h6t s ILE 55 Cb -0.14 -4.18 -0.15 0.00 -1.58 0.00 0.00 42.46 36.40 3h6t s ILE 55 CO -0.02 0.11 1.54 0.55 -1.23 0.00 0.00 174.94 175.89 3h6t n VAL 56 N 4.06 0.13 -0.22 2.92 3.14 -0.21 -4.89 118.33 123.24 3h6t n VAL 56 Ca 0.08 -0.02 -0.11 0.00 -2.96 0.00 0.00 64.34 61.32 3h6t n VAL 56 Cb 0.49 -1.17 -0.07 0.00 -1.06 0.00 0.00 33.84 32.02 3h6t n VAL 56 CO 0.00 0.00 0.00 1.23 -6.46 0.00 0.00 176.83 171.60 3h6t h GLY 57 N 5.93 -0.75 -0.47 7.55 0.00 -1.92 -2.32 103.07 111.08 3h6t h GLY 57 Ca -0.47 0.68 0.00 0.00 0.00 0.00 0.00 47.33 47.54 3h6t h GLY 57 CO 0.86 -0.10 0.00 2.09 0.00 0.00 0.00 176.54 179.39 3h6t n ASP 58 N -5.37 0.82 -1.79 0.19 5.68 -1.26 -4.92 116.55 109.91 3h6t n ASP 58 Ca -0.00 -1.91 -0.20 0.00 -0.50 0.00 0.00 54.79 52.17 3h6t n ASP 58 Cb 0.33 -0.09 -0.07 0.00 -1.14 0.00 0.00 41.12 40.15 3h6t n ASP 58 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3h6t n GLY 59 N 0.79 1.34 3.65 6.12 0.00 -0.87 -4.97 105.19 111.24 3h6t n GLY 59 Ca 0.07 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.86 3h6t n GLY 59 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3h6t s LYS 60 N -4.05 2.30 -0.14 1.61 1.02 -1.26 -4.97 119.74 114.25 3h6t s LYS 60 Ca 0.00 -1.41 -0.24 0.00 0.02 0.00 0.00 55.97 54.34 3h6t s LYS 60 Cb 0.00 -2.17 -0.21 0.00 -0.52 0.00 0.00 37.83 34.93 3h6t s LYS 60 CO 0.00 0.37 0.59 1.88 -0.92 0.00 0.00 175.35 177.27 3h6t h TYR 61 N 1.89 0.00 0.00 3.18 -1.99 -1.89 -2.39 116.97 115.78 3h6t h TYR 61 Ca -0.44 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.29 3h6t h TYR 61 Cb 1.25 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.98 3h6t h TYR 61 CO 0.68 0.88 0.00 0.41 -0.00 0.00 0.00 178.16 180.14 3h6t n GLY 62 N 1.62 3.20 3.22 3.88 0.00 -1.01 -1.46 105.19 114.65 3h6t n GLY 62 Ca -0.11 -0.22 -0.09 0.00 0.00 0.00 0.00 46.02 45.60 3h6t n GLY 62 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h6t s ALA 63 N 0.00 -0.25 -0.21 4.61 0.00 -1.26 -4.66 121.76 120.00 3h6t s ALA 63 Ca 0.00 -0.61 -0.06 0.00 0.00 0.00 0.00 51.96 51.29 3h6t s ALA 63 Cb 0.00 0.53 -0.03 0.00 0.00 0.00 0.00 23.12 23.63 3h6t s ALA 63 CO 0.00 -0.53 0.04 0.50 0.00 0.00 0.00 175.76 175.76 3h6t s ARG 64 N -3.87 3.70 0.02 0.00 3.52 -1.26 -2.27 118.95 118.80 3h6t s ARG 64 Ca 0.06 -0.47 -0.30 0.00 -0.13 0.00 0.00 55.73 54.89 3h6t s ARG 64 Cb 0.05 -3.18 -0.08 0.00 -1.56 0.00 0.00 34.95 30.17 3h6t s ARG 64 CO -0.10 0.01 1.88 0.34 -0.81 0.00 0.00 175.30 176.62 3h6t s ASP 65 N 1.05 6.50 0.60 -2.12 -1.08 -0.54 -4.85 116.67 116.23 3h6t s ASP 65 Ca 0.03 2.57 0.40 0.00 -0.52 0.00 0.00 52.55 55.03 3h6t s ASP 65 Cb -0.14 -2.53 2.16 0.00 -1.46 0.00 0.00 42.92 40.95 3h6t s ASP 65 CO 0.02 -1.02 2.23 0.00 0.52 0.00 0.00 175.17 176.92 3h6t h ALA 66 N 10.23 1.00 0.00 3.66 0.00 -1.96 0.35 119.26 132.54 3h6t h ALA 66 Ca -0.47 0.00 -0.41 0.00 0.00 0.00 0.00 54.91 54.03 3h6t h ALA 66 Cb 1.22 0.00 -0.07 0.00 0.00 0.00 0.00 17.79 18.94 3h6t h ALA 66 CO 0.94 0.00 -2.45 -0.25 0.00 0.00 0.00 179.25 177.49 3h6t n ASP 67 N -2.92 1.98 0.10 0.00 8.00 -1.26 -4.56 116.55 117.89 3h6t n ASP 67 Ca -0.03 0.06 0.12 0.00 0.71 0.00 0.00 54.79 55.65 3h6t n ASP 67 Cb 0.07 -0.56 0.02 0.00 -0.02 0.00 0.00 41.12 40.63 3h6t n ASP 67 CO 0.00 0.00 0.00 0.71 -0.39 0.00 0.00 177.20 177.52 3h6t h THR 68 N -0.41 0.00 -0.47 -3.53 1.35 -1.96 -3.47 112.91 104.42 3h6t h THR 68 Ca -0.61 -0.95 -0.20 0.00 -0.55 0.00 0.00 66.41 64.10 3h6t h THR 68 Cb 1.75 1.46 -0.08 0.00 -1.73 0.00 0.00 68.15 69.55 3h6t h THR 68 CO -0.23 0.00 -0.18 0.29 -0.25 0.00 0.00 175.52 175.15 3h6t n LYS 69 N -2.63 -0.88 -3.12 4.72 4.76 0.12 -4.99 118.16 116.13 3h6t n LYS 69 Ca 0.00 0.81 -0.39 0.00 -2.87 0.00 0.00 58.31 55.86 3h6t n LYS 69 Cb 0.54 -4.79 -0.06 0.00 -1.84 0.00 0.00 35.03 28.88 3h6t n LYS 69 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 3h6t s ILE 70 N -2.26 4.71 0.11 -0.18 1.01 -1.25 -4.75 121.20 118.59 3h6t s ILE 70 Ca 0.00 1.43 -0.11 0.00 0.00 0.00 0.00 60.65 61.97 3h6t s ILE 70 Cb 0.00 -4.01 -0.06 0.00 0.01 0.00 0.00 42.46 38.40 3h6t s ILE 70 CO 0.00 0.46 0.46 0.26 0.00 0.00 0.00 174.94 176.12 3h6t s TRP 71 N -0.59 3.57 0.00 3.97 0.52 -1.26 -1.47 118.94 123.67 3h6t s TRP 71 Ca 0.33 0.87 0.00 0.00 0.02 0.00 0.00 56.10 57.32 3h6t s TRP 71 Cb -0.20 -2.22 0.00 0.00 -1.15 0.00 0.00 33.47 29.90 3h6t s TRP 71 CO 0.21 0.47 0.00 0.27 0.02 0.00 0.00 176.95 177.92 3h6t n ASN 72 N 0.75 1.93 -0.08 2.95 0.23 -0.96 -4.40 115.26 115.68 3h6t n ASN 72 Ca -0.06 -0.96 0.00 0.00 -0.53 0.00 0.00 54.58 53.03 3h6t n ASN 72 Cb 0.52 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.22 3h6t n ASN 72 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3h6t n GLY 73 N 4.82 0.79 0.34 4.83 0.00 -1.26 -1.04 105.19 113.67 3h6t n GLY 73 Ca 0.00 -0.84 0.00 0.00 0.00 0.00 0.00 46.02 45.18 3h6t n GLY 73 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 3h6t h MET 74 N 0.00 0.94 -0.49 1.61 2.86 -0.70 -1.97 114.93 117.19 3h6t h MET 74 Ca 0.00 -0.07 0.03 0.00 -2.06 0.00 0.00 59.70 57.60 3h6t h MET 74 Cb 0.00 -0.21 -0.03 0.00 0.06 0.00 0.00 31.60 31.42 3h6t h MET 74 CO 0.00 0.64 0.28 0.28 1.06 0.00 0.00 176.91 179.18 3h6t h VAL 75 N 0.97 1.03 -0.79 -2.22 2.07 -1.53 -1.61 116.25 114.16 3h6t h VAL 75 Ca 0.26 -0.19 0.00 0.00 0.82 0.00 0.00 66.70 67.59 3h6t h VAL 75 Cb -0.08 0.43 -0.04 0.00 -1.52 0.00 0.00 31.29 30.08 3h6t h VAL 75 CO -0.05 0.10 0.50 1.23 0.02 0.00 0.00 177.57 179.37 3h6t h GLY 76 N 0.56 1.14 0.20 2.17 0.00 -0.45 0.30 103.07 106.99 3h6t h GLY 76 Ca 0.20 -0.46 0.12 0.00 0.00 0.00 0.00 47.33 47.19 3h6t h GLY 76 CO -0.10 0.44 0.17 0.83 0.00 0.00 0.00 176.54 177.89 3h6t h GLU 77 N 1.08 0.30 0.08 4.80 4.39 -0.61 0.76 114.58 125.38 3h6t h GLU 77 Ca 0.29 -0.02 -0.00 0.00 0.34 0.00 0.00 59.36 59.96 3h6t h GLU 77 Cb -0.07 -0.07 0.00 0.00 -0.10 0.00 0.00 28.75 28.51 3h6t h GLU 77 CO -0.06 0.20 -0.04 -0.07 -1.16 0.00 0.00 179.01 177.88 3h6t h LEU 78 N 0.31 -0.09 -1.07 1.33 3.38 -0.78 0.28 115.31 118.67 3h6t h LEU 78 Ca 0.33 -0.42 0.12 0.00 0.09 0.00 0.00 57.88 58.00 3h6t h LEU 78 Cb 0.49 0.02 -0.08 0.00 0.09 0.00 0.00 40.66 41.18 3h6t h LEU 78 CO -0.39 0.40 0.62 0.58 0.09 0.00 0.00 178.44 179.73 3h6t h VAL 79 N -0.61 0.92 -0.51 1.22 2.07 -0.52 -2.58 116.25 116.23 3h6t h VAL 79 Ca -0.01 -0.33 0.00 0.00 0.82 0.00 0.00 66.70 67.18 3h6t h VAL 79 Cb 0.51 -0.11 0.00 0.00 -1.52 0.00 0.00 31.29 30.16 3h6t h VAL 79 CO 0.02 0.17 0.00 -1.22 0.02 0.00 0.00 177.57 176.56 3h6t n TYR 80 N -4.59 1.58 -1.42 1.57 4.01 0.22 -4.95 117.16 113.58 3h6t n TYR 80 Ca 0.18 -0.57 -0.10 0.00 -0.16 0.00 0.00 57.90 57.25 3h6t n TYR 80 Cb 0.36 -0.36 -0.04 0.00 -0.31 0.00 0.00 39.34 38.99 3h6t n TYR 80 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3h6t n GLY 81 N 0.72 1.01 0.11 2.72 0.00 -0.97 -4.92 105.19 103.86 3h6t n GLY 81 Ca 0.23 -0.54 0.04 0.00 0.00 0.00 0.00 46.02 45.75 3h6t n GLY 81 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3h6t h LYS 82 N 0.00 0.00 -4.97 1.61 1.57 -1.19 -3.47 116.57 110.12 3h6t h LYS 82 Ca -0.22 0.00 -0.32 0.00 -1.87 0.00 0.00 60.65 58.24 3h6t h LYS 82 Cb 0.75 0.00 -0.18 0.00 0.08 0.00 0.00 32.23 32.88 3h6t h LYS 82 CO 0.31 0.22 -0.74 0.00 -0.57 0.00 0.00 179.45 178.68 3h6t s ALA 83 N -3.07 1.10 -0.13 3.86 0.00 -0.98 -4.98 121.76 117.56 3h6t s ALA 83 Ca -0.01 -1.16 0.21 0.00 0.00 0.00 0.00 51.96 51.00 3h6t s ALA 83 Cb 0.09 0.02 -0.18 0.00 0.00 0.00 0.00 23.12 23.05 3h6t s ALA 83 CO 0.79 -0.02 0.69 -0.25 0.00 0.00 0.00 175.76 176.97 3h6t n ASP 84 N 0.63 0.44 -3.53 0.00 8.00 -0.39 -4.54 116.55 117.17 3h6t n ASP 84 Ca -0.17 0.18 -0.16 0.00 0.71 0.00 0.00 54.79 55.36 3h6t n ASP 84 Cb 0.57 1.05 -0.06 0.00 -0.02 0.00 0.00 41.12 42.67 3h6t n ASP 84 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 3h6t s ILE 85 N -3.26 0.00 -0.22 0.53 2.07 -1.05 -4.38 121.20 114.90 3h6t s ILE 85 Ca -0.05 0.00 0.01 0.00 -1.41 0.00 0.00 60.65 59.20 3h6t s ILE 85 Cb 0.11 -1.00 0.03 0.00 0.13 0.00 0.00 42.46 41.73 3h6t s ILE 85 CO 0.84 0.00 -0.14 0.00 -1.91 0.00 0.00 174.94 173.74 3h6t s ALA 86 N -1.23 2.50 -0.46 1.50 0.00 0.58 -0.91 121.76 123.74 3h6t s ALA 86 Ca -0.08 -1.39 0.02 0.00 0.00 0.00 0.00 51.96 50.52 3h6t s ALA 86 Cb -0.00 -1.42 0.12 0.00 0.00 0.00 0.00 23.12 21.82 3h6t s ALA 86 CO 0.07 -0.64 0.21 0.42 0.00 0.00 0.00 175.76 175.82 3h6t s ILE 87 N 1.27 2.69 0.29 0.00 1.01 -1.04 -1.72 121.20 123.70 3h6t s ILE 87 Ca 0.01 -2.84 -0.19 0.00 0.00 0.00 0.00 60.65 57.63 3h6t s ILE 87 Cb -0.15 -2.88 0.06 0.00 0.01 0.00 0.00 42.46 39.49 3h6t s ILE 87 CO -0.09 -0.73 0.87 0.00 0.00 0.00 0.00 174.94 174.99 3h6t s ALA 88 N 0.26 -1.16 -1.37 9.38 0.00 -1.26 -4.62 121.76 122.99 3h6t s ALA 88 Ca 0.14 -0.47 -0.12 0.00 0.00 0.00 0.00 51.96 51.51 3h6t s ALA 88 Cb -0.23 0.72 -0.05 0.00 0.00 0.00 0.00 23.12 23.56 3h6t s ALA 88 CO -0.03 -1.02 2.48 -0.35 0.00 0.00 0.00 175.76 176.84 3h6t n PRO 89 N -0.56 2.95 -3.40 0.00 -0.04 -1.26 -4.64 135.00 128.05 3h6t n PRO 89 Ca -0.06 -2.18 -0.39 0.00 -0.04 0.00 0.00 63.50 60.83 3h6t n PRO 89 Cb 0.60 -2.92 -0.09 0.00 -0.04 0.00 0.00 33.50 31.05 3h6t n PRO 89 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 3h6t s LEU 90 N 0.94 4.07 0.12 1.53 2.96 -1.26 -5.01 118.68 122.02 3h6t s LEU 90 Ca 0.56 0.34 -0.30 0.00 -0.22 0.00 0.00 54.13 54.51 3h6t s LEU 90 Cb 0.15 -2.44 -0.07 0.00 0.50 0.00 0.00 46.19 44.34 3h6t s LEU 90 CO -0.05 -0.15 1.16 -0.89 -1.32 0.00 0.00 176.35 175.10 3h6t s THR 91 N 1.87 3.91 -0.22 3.68 2.01 -1.26 -2.13 115.64 123.50 3h6t s THR 91 Ca 0.16 1.49 -0.29 0.00 0.31 0.00 0.00 61.69 63.35 3h6t s THR 91 Cb -0.15 -3.95 -0.01 0.00 0.01 0.00 0.00 72.50 68.39 3h6t s THR 91 CO 0.09 0.18 1.36 -0.63 -0.69 0.00 0.00 174.62 174.93 3h6t s ILE 92 N 0.45 4.09 0.10 1.82 1.01 -1.02 -4.91 121.20 122.73 3h6t s ILE 92 Ca 0.55 1.27 0.02 0.00 0.00 0.00 0.00 60.65 62.49 3h6t s ILE 92 Cb -0.30 -3.98 -0.04 0.00 0.01 0.00 0.00 42.46 38.16 3h6t s ILE 92 CO 0.32 -0.29 -0.08 0.42 0.00 0.00 0.00 174.94 175.32 3h6t s THR 93 N 4.14 0.78 0.09 2.92 -4.23 -1.26 -4.86 115.64 113.23 3h6t s THR 93 Ca 0.59 -1.80 -0.29 0.00 -1.18 0.00 0.00 61.69 59.01 3h6t s THR 93 Cb -0.21 -1.52 -0.14 0.00 1.34 0.00 0.00 72.50 71.97 3h6t s THR 93 CO 0.21 -0.74 1.65 0.25 -0.54 0.00 0.00 174.62 175.44 3h6t h LEU 94 N 3.22 -0.67 -1.82 4.79 5.85 -1.98 0.13 115.31 124.83 3h6t h LEU 94 Ca -0.36 0.05 0.05 0.00 0.84 0.00 0.00 57.88 58.47 3h6t h LEU 94 Cb 1.18 0.22 -0.02 0.00 0.37 0.00 0.00 40.66 42.41 3h6t h LEU 94 CO 0.60 -0.39 0.23 -0.37 -0.34 0.00 0.00 178.44 178.16 3h6t h VAL 95 N -0.59 0.95 0.06 1.05 -1.51 -2.01 -2.20 116.25 111.99 3h6t h VAL 95 Ca -0.02 -0.08 -0.20 0.00 -1.23 0.00 0.00 66.70 65.17 3h6t h VAL 95 Cb 0.52 0.71 0.02 0.00 -2.13 0.00 0.00 31.29 30.40 3h6t h VAL 95 CO -0.01 0.04 -0.81 0.03 -1.23 0.00 0.00 177.57 175.59 3h6t h ARG 96 N 0.22 0.45 -0.09 5.19 3.08 -1.86 -3.22 114.38 118.15 3h6t h ARG 96 Ca 0.15 -0.56 0.03 0.00 0.07 0.00 0.00 59.98 59.66 3h6t h ARG 96 Cb 0.30 0.18 -0.00 0.00 0.08 0.00 0.00 29.97 30.52 3h6t h ARG 96 CO -0.03 1.21 0.16 0.93 -1.07 0.00 0.00 179.97 181.17 3h6t h GLU 97 N -0.05 0.00 0.00 0.04 4.39 -0.15 0.91 114.58 119.71 3h6t h GLU 97 Ca -0.12 0.00 -0.09 0.00 0.34 0.00 0.00 59.36 59.49 3h6t h GLU 97 Cb 1.54 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 30.17 3h6t h GLU 97 CO 0.16 0.00 -0.42 0.93 -1.16 0.00 0.00 179.01 178.52 3h6t h GLU 98 N 0.00 0.00 0.00 2.33 5.08 -1.45 -3.33 114.58 117.20 3h6t h GLU 98 Ca 0.04 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 3h6t h GLU 98 Cb 0.36 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.61 3h6t h GLU 98 CO -0.00 0.42 -1.40 1.33 -1.00 0.00 0.00 179.01 178.35 3h6t n VAL 99 N -3.77 0.00 -4.21 3.13 0.24 0.10 -5.05 118.33 108.76 3h6t n VAL 99 Ca -0.01 -0.21 -0.12 0.00 -2.04 0.00 0.00 64.34 61.96 3h6t n VAL 99 Cb 0.49 0.30 -0.10 0.00 -1.47 0.00 0.00 33.84 33.06 3h6t n VAL 99 CO 0.00 0.00 0.00 0.27 -2.14 0.00 0.00 176.83 174.96 3h6t s ILE 100 N -2.62 0.41 0.11 1.34 -4.36 0.02 -4.08 121.20 112.01 3h6t s ILE 100 Ca -0.03 -1.96 0.01 0.00 -0.26 0.00 0.00 60.65 58.41 3h6t s ILE 100 Cb 0.06 -2.18 -0.04 0.00 1.25 0.00 0.00 42.46 41.55 3h6t s ILE 100 CO 0.38 -0.38 0.24 -1.81 0.24 0.00 0.00 174.94 173.60 3h6t s ASP 101 N -3.14 6.31 -0.00 4.36 1.01 -0.40 -4.16 116.67 120.64 3h6t s ASP 101 Ca 0.27 0.21 0.04 0.00 0.71 0.00 0.00 52.55 53.77 3h6t s ASP 101 Cb 0.07 -1.91 -0.01 0.00 1.01 0.00 0.00 42.92 42.08 3h6t s ASP 101 CO 0.05 0.11 -0.13 -0.36 0.21 0.00 0.00 175.17 175.05 3h6t s PHE 102 N -1.63 1.16 1.00 4.23 0.08 -1.26 -1.80 117.98 119.76 3h6t s PHE 102 Ca 0.35 -0.23 -0.17 0.00 0.12 0.00 0.00 56.93 56.99 3h6t s PHE 102 Cb -0.12 -0.74 0.23 0.00 -0.57 0.00 0.00 43.02 41.82 3h6t s PHE 102 CO 0.28 -0.01 1.35 -1.54 -0.10 0.00 0.00 175.22 175.20 3h6t s SER 103 N -0.39 2.81 0.68 1.36 1.04 -0.03 -4.95 113.70 114.22 3h6t s SER 103 Ca 0.05 0.16 -0.16 0.00 0.48 0.00 0.00 55.95 56.48 3h6t s SER 103 Cb -0.05 -0.11 0.01 0.00 0.10 0.00 0.00 66.02 65.97 3h6t s SER 103 CO -0.00 -2.92 1.19 -0.54 0.98 0.00 0.00 173.24 171.95 3h6t s LYS 104 N -5.95 2.48 0.44 4.02 3.01 -1.26 -4.58 119.74 117.89 3h6t s LYS 104 Ca 0.76 1.72 -0.26 0.00 -1.01 0.00 0.00 55.97 57.18 3h6t s LYS 104 Cb -0.02 -1.88 -0.09 0.00 -1.01 0.00 0.00 37.83 34.83 3h6t s LYS 104 CO 0.54 -1.56 1.45 -0.35 0.51 0.00 0.00 175.35 175.94 3h6t n PRO 105 N -2.36 2.36 -0.00 -1.68 -0.04 -1.26 -4.56 135.00 127.46 3h6t n PRO 105 Ca 0.13 0.84 0.07 0.00 -0.04 0.00 0.00 63.50 64.50 3h6t n PRO 105 Cb 0.50 -2.65 -0.08 0.00 -0.04 0.00 0.00 33.50 31.23 3h6t n PRO 105 CO 0.00 0.00 0.00 1.97 -0.04 0.00 0.00 175.50 177.43 3h6t n PHE 106 N -0.07 0.00 -3.70 0.54 1.16 0.01 -4.97 117.46 110.44 3h6t n PHE 106 Ca 0.04 0.00 -0.14 0.00 -1.87 0.00 0.00 57.45 55.49 3h6t n PHE 106 Cb 0.41 -0.01 -0.09 0.00 -1.61 0.00 0.00 39.48 38.18 3h6t n PHE 106 CO 0.00 0.00 0.00 1.41 -1.87 0.00 0.00 176.76 176.30 3h6t s MET 107 N -2.38 0.62 0.25 3.97 0.00 -1.25 -5.00 119.30 115.51 3h6t s MET 107 Ca 0.05 0.66 -0.04 0.00 0.00 0.00 0.00 55.69 56.35 3h6t s MET 107 Cb 0.11 0.30 -0.05 0.00 0.00 0.00 0.00 34.83 35.19 3h6t s MET 107 CO 0.59 -0.08 0.50 -1.12 0.00 0.00 0.00 175.02 174.91 3h6t s SER 108 N 0.15 6.45 0.01 1.11 0.01 -1.26 -1.32 113.70 118.85 3h6t s SER 108 Ca -0.01 0.66 -0.29 0.00 1.31 0.00 0.00 55.95 57.62 3h6t s SER 108 Cb -0.04 -2.12 0.10 0.00 0.21 0.00 0.00 66.02 64.18 3h6t s SER 108 CO 0.01 -0.13 1.07 -1.48 0.41 0.00 0.00 173.24 173.12 3h6t s LEU 109 N -3.36 -0.19 0.02 2.44 -0.00 -0.52 -4.77 118.68 112.31 3h6t s LEU 109 Ca 0.43 -0.17 -0.14 0.00 -0.00 0.00 0.00 54.13 54.25 3h6t s LEU 109 Cb -0.11 1.80 0.02 0.00 -0.00 0.00 0.00 46.19 47.90 3h6t s LEU 109 CO 0.28 -0.57 0.30 -0.83 -0.00 0.00 0.00 176.35 175.54 3h6t s GLY 110 N -2.71 -0.13 0.30 -3.48 0.00 -1.26 -1.25 107.32 98.80 3h6t s GLY 110 Ca 0.10 0.11 -0.29 0.00 0.00 0.00 0.00 44.72 44.64 3h6t s GLY 110 CO -0.03 -0.10 1.51 -0.42 0.00 0.00 0.00 173.10 174.06 3h6t s ILE 111 N -2.11 2.26 0.32 0.90 1.01 -1.26 -0.31 121.20 122.01 3h6t s ILE 111 Ca -0.08 0.23 0.06 0.00 0.00 0.00 0.00 60.65 60.86 3h6t s ILE 111 Cb -0.02 -3.15 -0.02 0.00 0.01 0.00 0.00 42.46 39.28 3h6t s ILE 111 CO -0.01 0.04 0.23 -1.54 0.00 0.00 0.00 174.94 173.66 3h6t n SER 112 N 1.77 -0.20 -4.22 3.58 3.41 0.59 -0.13 113.62 118.43 3h6t n SER 112 Ca 0.06 -3.01 -0.31 0.00 -0.26 0.00 0.00 58.87 55.34 3h6t n SER 112 Cb 0.39 1.40 -0.17 0.00 -0.26 0.00 0.00 64.21 65.57 3h6t n SER 112 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 3h6t s ILE 113 N -3.18 1.96 -0.13 -1.33 1.01 -1.26 -2.30 121.20 115.98 3h6t s ILE 113 Ca 0.32 -0.98 -0.00 0.00 0.00 0.00 0.00 60.65 59.99 3h6t s ILE 113 Cb 0.02 -1.68 -0.02 0.00 0.01 0.00 0.00 42.46 40.79 3h6t s ILE 113 CO 0.23 0.54 -0.11 -0.32 0.00 0.00 0.00 174.94 175.28 3h6t s MET 114 N 0.17 3.35 0.12 2.79 -2.45 0.48 -1.03 119.30 122.73 3h6t s MET 114 Ca -0.12 -0.65 0.05 0.00 -1.25 0.00 0.00 55.69 53.71 3h6t s MET 114 Cb -0.16 -2.66 -0.04 0.00 1.25 0.00 0.00 34.83 33.22 3h6t s MET 114 CO 0.06 0.27 -0.11 0.96 1.05 0.00 0.00 175.02 177.25 3h6t s ILE 115 N 0.23 1.15 0.19 10.11 -4.36 -0.48 -0.95 121.20 127.10 3h6t s ILE 115 Ca -0.07 -1.82 -0.30 0.00 -0.26 0.00 0.00 60.65 58.19 3h6t s ILE 115 Cb -0.15 -1.60 -0.08 0.00 1.25 0.00 0.00 42.46 41.88 3h6t s ILE 115 CO 0.05 -0.58 1.13 -0.75 0.24 0.00 0.00 174.94 175.02 3h6t s LYS 116 N -3.11 4.57 0.14 0.37 2.47 -1.26 -0.51 119.74 122.40 3h6t s LYS 116 Ca 0.11 1.78 -0.35 0.00 -1.56 0.00 0.00 55.97 55.95 3h6t s LYS 116 Cb -0.01 -3.25 -0.16 0.00 -1.46 0.00 0.00 37.83 32.95 3h6t s LYS 116 CO 0.01 0.05 1.33 1.63 0.16 0.00 0.00 175.35 178.53 3h6t n LYS 117 N 2.23 1.40 0.00 4.03 5.02 0.64 -1.76 118.16 129.72 3h6t n LYS 117 Ca 0.03 0.50 0.00 0.00 -2.02 0.00 0.00 58.31 56.82 3h6t n LYS 117 Cb 0.45 -2.13 0.00 0.00 -0.02 0.00 0.00 35.03 33.34 3h6t n LYS 117 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3h6t n GLY 118 N 2.48 2.70 3.75 0.72 0.00 -1.26 -4.99 105.19 108.59 3h6t n GLY 118 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 3h6t n GLY 118 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3h6t n THR 119 N -1.68 1.09 -1.55 2.61 -1.04 -0.72 -4.87 114.28 108.12 3h6t n THR 119 Ca 0.00 -0.27 -0.41 0.00 -2.04 0.00 0.00 64.05 61.33 3h6t n THR 119 Cb 0.00 -1.95 -0.01 0.00 -1.82 0.00 0.00 70.33 66.54 3h6t n THR 119 CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 3h6t n PRO 120 N 2.04 2.77 -3.76 -2.82 -0.02 -1.26 -4.85 135.00 127.09 3h6t n PRO 120 Ca 0.08 -2.39 -0.13 0.00 -2.02 0.00 0.00 63.50 59.04 3h6t n PRO 120 Cb 0.37 -3.13 -0.13 0.00 -0.02 0.00 0.00 33.50 30.58 3h6t n PRO 120 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 3h6t s ILE 121 N 3.30 -0.03 0.00 4.25 -1.09 -1.26 -4.99 121.20 121.37 3h6t s ILE 121 Ca 0.52 0.12 0.00 0.00 -2.23 0.00 0.00 60.65 59.06 3h6t s ILE 121 Cb 0.15 -0.28 0.00 0.00 -1.58 0.00 0.00 42.46 40.74 3h6t s ILE 121 CO -0.05 0.05 0.00 -0.62 -1.23 0.00 0.00 174.94 173.08 3h6t n GLU 122 N 3.86 5.37 -3.01 2.79 1.02 -1.26 -4.90 120.64 124.52 3h6t n GLU 122 Ca -0.22 0.00 -0.06 0.00 -0.02 0.00 0.00 57.16 56.86 3h6t n GLU 122 Cb 0.54 -0.58 0.02 0.00 -0.02 0.00 0.00 31.44 31.40 3h6t n GLU 122 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 3h6t n SER 123 N -1.06 -1.61 0.11 1.62 3.41 -1.26 -3.33 113.62 111.50 3h6t n SER 123 Ca 0.00 -2.09 -0.02 0.00 -0.26 0.00 0.00 58.87 56.50 3h6t n SER 123 Cb 0.00 2.67 0.20 0.00 -0.26 0.00 0.00 64.21 66.82 3h6t n SER 123 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3h6t h ALA 124 N 2.00 1.04 -0.30 7.33 0.00 -1.95 -3.08 119.26 124.31 3h6t h ALA 124 Ca -0.24 -0.47 -0.04 0.00 0.00 0.00 0.00 54.91 54.16 3h6t h ALA 124 Cb 0.88 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.58 3h6t h ALA 124 CO 0.30 0.65 0.03 0.93 0.00 0.00 0.00 179.25 181.17 3h6t h GLU 125 N 0.13 0.51 -0.99 0.00 5.08 -1.95 -0.74 114.58 116.61 3h6t h GLU 125 Ca 0.00 -0.14 0.10 0.00 -1.00 0.00 0.00 59.36 58.32 3h6t h GLU 125 Cb 0.94 -0.05 -0.08 0.00 0.50 0.00 0.00 28.75 30.05 3h6t h GLU 125 CO 0.07 0.62 0.62 -0.44 -1.00 0.00 0.00 179.01 178.89 3h6t h ASP 126 N 0.32 0.94 0.30 1.42 3.32 -1.94 -1.42 116.42 119.36 3h6t h ASP 126 Ca 0.09 0.04 -0.01 0.00 0.02 0.00 0.00 57.03 57.16 3h6t h ASP 126 Cb 0.37 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 39.77 3h6t h ASP 126 CO 0.01 0.54 -0.14 -0.07 -1.72 0.00 0.00 179.24 177.85 3h6t h LEU 127 N 1.04 -0.34 -1.19 1.55 3.38 -1.41 -3.26 115.31 115.07 3h6t h LEU 127 Ca 0.47 -0.18 0.17 0.00 0.09 0.00 0.00 57.88 58.42 3h6t h LEU 127 Cb 0.37 0.09 -0.09 0.00 0.09 0.00 0.00 40.66 41.12 3h6t h LEU 127 CO -0.23 0.03 0.61 0.77 0.09 0.00 0.00 178.44 179.70 3h6t h SER 128 N -0.76 0.69 -1.05 -0.43 4.64 -0.71 -2.87 113.55 113.07 3h6t h SER 128 Ca -0.04 0.06 -0.63 0.00 -0.47 0.00 0.00 61.79 60.71 3h6t h SER 128 Cb 0.50 -0.07 -0.26 0.00 -0.31 0.00 0.00 62.40 62.26 3h6t h SER 128 CO 0.07 0.30 0.82 2.29 -0.87 0.00 0.00 176.83 179.44 3h6t n LYS 129 N -4.63 2.56 -3.83 4.77 2.85 -0.57 -4.92 118.16 114.38 3h6t n LYS 129 Ca 0.20 -3.03 -0.06 0.00 -1.05 0.00 0.00 58.31 54.37 3h6t n LYS 129 Cb 0.54 -2.18 0.01 0.00 -0.65 0.00 0.00 35.03 32.76 3h6t n LYS 129 CO 0.00 0.00 0.00 1.14 -0.05 0.00 0.00 177.40 178.49 3h6t s GLN 130 N -3.50 1.79 0.00 -1.58 1.03 -1.09 -5.02 119.66 111.30 3h6t s GLN 130 Ca 0.58 -1.12 0.00 0.00 0.04 0.00 0.00 55.36 54.86 3h6t s GLN 130 Cb 0.46 0.52 0.00 0.00 0.03 0.00 0.00 33.01 34.02 3h6t s GLN 130 CO -0.07 -0.84 0.00 2.41 -2.54 0.00 0.00 175.29 174.26 3h6t n THR 131 N -0.57 0.00 0.30 3.63 -1.04 -1.26 -4.84 114.28 110.50 3h6t n THR 131 Ca -0.06 0.00 0.19 0.00 -2.04 0.00 0.00 64.05 62.14 3h6t n THR 131 Cb 0.60 0.81 0.89 0.00 -1.82 0.00 0.00 70.33 70.81 3h6t n THR 131 CO 0.00 0.00 0.00 -0.08 -0.64 0.00 0.00 175.07 174.35 3h6t h GLU 132 N 0.00 0.00 -4.96 -2.82 4.57 -1.97 -3.38 114.58 106.02 3h6t h GLU 132 Ca 0.00 0.00 -0.67 0.00 -1.18 0.00 0.00 59.36 57.51 3h6t h GLU 132 Cb 0.10 0.00 -0.32 0.00 -0.16 0.00 0.00 28.75 28.38 3h6t h GLU 132 CO 0.00 0.00 -0.77 0.42 -1.18 0.00 0.00 179.01 177.48 3h6t s ILE 133 N -3.84 2.80 0.54 2.32 1.01 -1.26 -4.82 121.20 117.95 3h6t s ILE 133 Ca -0.01 -0.89 -0.08 0.00 0.00 0.00 0.00 60.65 59.67 3h6t s ILE 133 Cb 0.10 -2.34 -0.04 0.00 0.01 0.00 0.00 42.46 40.19 3h6t s ILE 133 CO 0.48 0.32 0.90 0.00 0.00 0.00 0.00 174.94 176.64 3h6t s ALA 134 N 1.35 3.26 -0.19 9.38 0.00 0.17 -4.87 121.76 130.86 3h6t s ALA 134 Ca 0.02 -0.30 -0.24 0.00 0.00 0.00 0.00 51.96 51.44 3h6t s ALA 134 Cb -0.15 -2.82 0.06 0.00 0.00 0.00 0.00 23.12 20.21 3h6t s ALA 134 CO -0.06 -0.49 0.63 1.52 0.00 0.00 0.00 175.76 177.36 3h6t s TYR 135 N -2.92 -0.67 0.00 0.00 -0.85 -1.26 0.08 117.35 111.73 3h6t s TYR 135 Ca 0.51 1.52 0.00 0.00 -0.52 0.00 0.00 57.07 58.58 3h6t s TYR 135 Cb -0.11 0.27 0.00 0.00 0.38 0.00 0.00 41.96 42.50 3h6t s TYR 135 CO 0.48 -0.40 0.00 0.41 -1.52 0.00 0.00 175.55 174.52 3h6t n GLY 136 N 2.26 3.60 2.06 5.49 0.00 -1.16 -4.80 105.19 112.63 3h6t n GLY 136 Ca -0.15 -1.29 -0.13 0.00 0.00 0.00 0.00 46.02 44.44 3h6t n GLY 136 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3h6t n THR 137 N 0.00 0.00 -3.16 2.61 -2.24 -1.26 -1.28 114.28 108.95 3h6t n THR 137 Ca 0.00 -1.55 -0.39 0.00 -2.27 0.00 0.00 64.05 59.84 3h6t n THR 137 Cb 0.00 0.74 -0.06 0.00 -2.10 0.00 0.00 70.33 68.91 3h6t n THR 137 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 3h6t s LEU 138 N 0.00 4.51 0.61 3.22 2.96 -1.26 -2.37 118.68 126.36 3h6t s LEU 138 Ca 0.24 1.35 -0.15 0.00 -0.22 0.00 0.00 54.13 55.35 3h6t s LEU 138 Cb 0.01 -3.03 -0.03 0.00 0.50 0.00 0.00 46.19 43.64 3h6t s LEU 138 CO 0.17 0.20 1.06 -1.81 -1.32 0.00 0.00 176.35 174.64 3h6t s ASP 139 N -0.82 5.68 -1.31 3.68 1.01 -0.25 -3.82 116.67 120.84 3h6t s ASP 139 Ca 0.32 1.79 -0.04 0.00 0.71 0.00 0.00 52.55 55.33 3h6t s ASP 139 Cb -0.20 -2.53 0.02 0.00 1.01 0.00 0.00 42.92 41.22 3h6t s ASP 139 CO 0.21 -1.24 0.26 -1.20 0.21 0.00 0.00 175.17 173.41 3h6t n SER 140 N -2.25 -4.55 -4.41 0.27 7.64 -1.26 -4.83 113.62 104.24 3h6t n SER 140 Ca 0.09 -0.10 -0.28 0.00 1.01 0.00 0.00 58.87 59.59 3h6t n SER 140 Cb 0.53 -3.78 -0.08 0.00 -1.01 0.00 0.00 64.21 59.87 3h6t n SER 140 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 3h6t s GLY 141 N -2.37 2.73 0.25 0.23 0.00 -1.25 -2.41 107.32 104.51 3h6t s GLY 141 Ca 0.18 -1.03 0.12 0.00 0.00 0.00 0.00 44.72 43.99 3h6t s GLY 141 CO 0.22 -1.98 1.51 1.48 0.00 0.00 0.00 173.10 174.33 3h6t h SER 142 N 1.65 0.00 -0.42 1.64 4.64 -1.89 -3.10 113.55 116.07 3h6t h SER 142 Ca -0.39 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 60.89 3h6t h SER 142 Cb 1.29 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.36 3h6t h SER 142 CO 0.65 0.66 0.11 0.74 -0.87 0.00 0.00 176.83 178.12 3h6t h THR 143 N 0.00 1.23 -0.74 2.95 2.02 -1.97 -0.29 112.91 116.11 3h6t h THR 143 Ca -0.01 -0.77 -0.01 0.00 0.77 0.00 0.00 66.41 66.39 3h6t h THR 143 Cb 1.30 0.94 -0.04 0.00 -1.74 0.00 0.00 68.15 68.61 3h6t h THR 143 CO 0.09 0.27 0.44 0.50 0.37 0.00 0.00 175.52 177.18 3h6t h LYS 144 N 0.53 1.02 -0.46 6.66 3.64 -1.74 -2.37 116.57 123.84 3h6t h LYS 144 Ca 0.13 -0.10 -0.00 0.00 -1.27 0.00 0.00 60.65 59.41 3h6t h LYS 144 Cb 0.30 -0.21 -0.02 0.00 -0.41 0.00 0.00 32.23 31.89 3h6t h LYS 144 CO -0.00 0.73 0.27 0.93 -2.27 0.00 0.00 179.45 179.11 3h6t h GLU 145 N 1.02 0.64 -0.50 1.90 4.39 -1.40 -2.27 114.58 118.35 3h6t h GLU 145 Ca 0.27 -0.06 0.10 0.00 0.34 0.00 0.00 59.36 60.00 3h6t h GLU 145 Cb -0.02 -0.13 -0.10 0.00 -0.10 0.00 0.00 28.75 28.40 3h6t h GLU 145 CO -0.05 0.48 -0.28 0.35 -1.16 0.00 0.00 179.01 178.35 3h6t h PHE 146 N 0.62 -0.74 -0.49 4.33 3.57 -0.54 -1.11 116.94 122.58 3h6t h PHE 146 Ca 0.17 0.06 -0.10 0.00 3.53 0.00 0.00 57.97 61.62 3h6t h PHE 146 Cb 0.01 0.40 -0.02 0.00 2.79 0.00 0.00 35.95 39.13 3h6t h PHE 146 CO -0.03 -0.35 -0.10 0.74 -2.23 0.00 0.00 178.31 176.34 3h6t h PHE 147 N -0.16 0.98 0.00 0.41 0.04 -1.27 -1.13 116.94 115.81 3h6t h PHE 147 Ca 0.22 -0.19 0.00 0.00 2.80 0.00 0.00 57.97 60.80 3h6t h PHE 147 Cb 0.52 -0.25 0.00 0.00 2.20 0.00 0.00 35.95 38.42 3h6t h PHE 147 CO -0.55 0.94 0.00 2.89 -0.60 0.00 0.00 178.31 180.99 3h6t n ARG 148 N -4.16 0.01 -0.06 1.51 1.85 -0.83 -2.65 116.66 112.33 3h6t n ARG 148 Ca 0.02 0.13 0.02 0.00 -1.00 0.00 0.00 57.85 57.01 3h6t n ARG 148 Cb 0.38 -1.50 0.05 0.00 -1.05 0.00 0.00 32.46 30.34 3h6t n ARG 148 CO 0.00 0.00 0.00 0.54 -0.01 0.00 0.00 177.63 178.16 3h6t n ARG 149 N -1.50 2.58 -2.93 2.89 3.00 -0.48 -5.02 116.66 115.20 3h6t n ARG 149 Ca 0.05 -1.60 -0.40 0.00 -0.01 0.00 0.00 57.85 55.89 3h6t n ARG 149 Cb 0.25 -1.10 -0.04 0.00 0.00 0.00 0.00 32.46 31.57 3h6t n ARG 149 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08 3h6t s SER 150 N -0.93 7.15 -0.19 0.55 0.15 -0.46 -4.91 113.70 115.05 3h6t s SER 150 Ca 0.08 1.38 0.13 0.00 0.70 0.00 0.00 55.95 58.25 3h6t s SER 150 Cb 0.04 -2.47 -0.21 0.00 -1.71 0.00 0.00 66.02 61.67 3h6t s SER 150 CO 0.06 -0.14 0.00 0.29 1.20 0.00 0.00 173.24 174.65 3h6t n LYS 151 N 3.64 0.90 -1.43 5.44 5.02 -1.26 -3.97 118.16 126.49 3h6t n LYS 151 Ca 0.01 0.02 -0.58 0.00 -2.02 0.00 0.00 58.31 55.74 3h6t n LYS 151 Cb 0.51 -1.47 -0.10 0.00 -0.02 0.00 0.00 35.03 33.95 3h6t n LYS 151 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 3h6t n ILE 152 N -2.79 0.10 -0.08 -0.18 -0.00 -1.26 -4.64 119.36 110.51 3h6t n ILE 152 Ca -0.33 -0.08 -0.02 0.00 -0.00 0.00 0.00 62.75 62.32 3h6t n ILE 152 Cb 1.07 -0.93 -0.01 0.00 -0.00 0.00 0.00 39.64 39.76 3h6t n ILE 152 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 3h6t n ALA 153 N 7.44 -0.10 -0.15 -1.39 0.00 -1.26 -0.86 120.51 124.19 3h6t n ALA 153 Ca 0.44 0.16 -0.04 0.00 0.00 0.00 0.00 53.44 54.01 3h6t n ALA 153 Cb 0.06 -0.04 0.16 0.00 0.00 0.00 0.00 19.45 19.63 3h6t n ALA 153 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 177.50 177.26 3h6t h VAL 154 N 0.00 1.24 -0.04 0.00 3.04 -1.99 -2.71 116.25 115.78 3h6t h VAL 154 Ca 0.04 -0.87 -0.25 0.00 -1.01 0.00 0.00 66.70 64.60 3h6t h VAL 154 Cb 0.08 0.67 0.02 0.00 -2.01 0.00 0.00 31.29 30.05 3h6t h VAL 154 CO -0.18 0.32 -0.95 -0.26 -1.01 0.00 0.00 177.57 175.50 3h6t h PHE 155 N 0.85 1.04 -0.84 3.17 0.04 -1.34 -2.20 116.94 117.66 3h6t h PHE 155 Ca 0.18 -0.53 0.04 0.00 2.80 0.00 0.00 57.97 60.46 3h6t h PHE 155 Cb 0.33 -0.13 -0.05 0.00 2.20 0.00 0.00 35.95 38.30 3h6t h PHE 155 CO 0.02 1.37 0.55 0.22 -0.60 0.00 0.00 178.31 179.87 3h6t h ASP 156 N 0.41 0.88 -0.03 2.17 1.82 -1.46 0.17 116.42 120.39 3h6t h ASP 156 Ca -0.11 -0.01 -0.12 0.00 -0.39 0.00 0.00 57.03 56.40 3h6t h ASP 156 Cb 1.60 -0.20 -0.01 0.00 0.68 0.00 0.00 39.33 41.40 3h6t h ASP 156 CO 0.19 0.60 -0.37 0.50 -1.61 0.00 0.00 179.24 178.55 3h6t h LYS 157 N 1.02 0.53 -0.08 0.28 3.64 -1.45 -2.05 116.57 118.47 3h6t h LYS 157 Ca 0.34 -0.26 -0.13 0.00 -1.27 0.00 0.00 60.65 59.33 3h6t h LYS 157 Cb 0.06 -0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 31.87 3h6t h LYS 157 CO -0.10 0.83 -0.53 0.52 -2.27 0.00 0.00 179.45 177.90 3h6t h MET 158 N 0.45 0.22 -0.27 1.90 2.86 -0.47 -3.13 114.93 116.49 3h6t h MET 158 Ca 0.04 -0.13 -0.09 0.00 -2.06 0.00 0.00 59.70 57.46 3h6t h MET 158 Cb 0.85 0.01 -0.01 0.00 0.06 0.00 0.00 31.60 32.52 3h6t h MET 158 CO 0.07 0.70 -0.20 2.35 1.06 0.00 0.00 176.91 180.89 3h6t h TRP 159 N 0.18 0.72 -0.89 -0.22 2.91 -0.39 -2.27 115.95 115.99 3h6t h TRP 159 Ca 0.00 -0.20 0.09 0.00 1.13 0.00 0.00 58.89 59.92 3h6t h TRP 159 Cb 0.99 -0.16 -0.06 0.00 -0.51 0.00 0.00 29.16 29.42 3h6t h TRP 159 CO 0.02 0.89 0.58 1.15 -1.03 0.00 0.00 178.44 180.05 3h6t h THR 160 N 0.34 0.98 -0.09 2.65 2.02 -1.35 -1.55 112.91 115.91 3h6t h THR 160 Ca 0.05 -0.31 -0.05 0.00 0.77 0.00 0.00 66.41 66.87 3h6t h THR 160 Cb 0.74 -0.00 -0.00 0.00 -1.74 0.00 0.00 68.15 67.15 3h6t h THR 160 CO 0.05 0.16 -0.14 0.22 0.37 0.00 0.00 175.52 176.19 3h6t h TYR 161 N 0.90 0.32 -0.24 3.16 3.20 -1.48 -3.31 116.97 119.51 3h6t h TYR 161 Ca 0.41 -0.11 0.00 0.00 3.14 0.00 0.00 58.73 62.17 3h6t h TYR 161 Cb 0.38 -0.06 -0.01 0.00 1.54 0.00 0.00 36.73 38.58 3h6t h TYR 161 CO -0.00 0.73 0.15 0.52 -1.64 0.00 0.00 178.16 177.92 3h6t h MET 162 N -0.18 0.32 0.00 1.82 2.86 -0.85 -1.88 114.93 117.03 3h6t h MET 162 Ca 0.01 -0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.62 3h6t h MET 162 Cb 0.70 -0.07 0.00 0.00 0.06 0.00 0.00 31.60 32.29 3h6t h MET 162 CO 0.03 0.23 0.00 2.89 1.06 0.00 0.00 176.91 181.13 3h6t n ARG 163 N -4.91 0.02 -0.00 1.72 1.85 -0.64 -3.33 116.66 111.39 3h6t n ARG 163 Ca -0.03 0.33 0.00 0.00 -1.00 0.00 0.00 57.85 57.15 3h6t n ARG 163 Cb 0.04 -1.50 -0.00 0.00 -1.05 0.00 0.00 32.46 29.95 3h6t n ARG 163 CO 0.00 0.00 0.00 0.43 -0.01 0.00 0.00 177.63 178.05 3h6t n SER 164 N -1.46 4.65 -4.70 2.89 7.64 -1.09 -5.07 113.62 116.49 3h6t n SER 164 Ca 0.02 -0.03 -0.41 0.00 1.01 0.00 0.00 58.87 59.46 3h6t n SER 164 Cb 0.09 1.00 0.01 0.00 -1.01 0.00 0.00 64.21 64.31 3h6t n SER 164 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3h6t n ALA 165 N -1.47 1.31 -3.45 -0.43 0.00 -0.73 -5.03 120.51 110.71 3h6t n ALA 165 Ca -0.00 0.28 -0.18 0.00 0.00 0.00 0.00 53.44 53.53 3h6t n ALA 165 Cb 0.00 -2.27 -0.16 0.00 0.00 0.00 0.00 19.45 17.03 3h6t n ALA 165 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 3h6t s GLU 166 N -2.16 0.64 0.87 0.00 0.41 -1.26 -3.80 118.70 113.41 3h6t s GLU 166 Ca 0.60 -0.09 -0.11 0.00 -0.41 0.00 0.00 54.97 54.96 3h6t s GLU 166 Cb -0.52 -0.67 0.12 0.00 -1.78 0.00 0.00 34.13 31.28 3h6t s GLU 166 CO 0.59 -0.04 1.15 -1.25 -0.49 0.00 0.00 175.26 175.22 3h6t s PRO 167 N 0.69 1.33 0.16 0.39 0.04 -1.26 -5.06 135.00 131.28 3h6t s PRO 167 Ca -0.08 1.54 -0.33 0.00 0.04 0.00 0.00 61.00 62.17 3h6t s PRO 167 Cb -0.12 -1.76 -0.17 0.00 0.04 0.00 0.00 34.50 32.49 3h6t s PRO 167 CO -0.00 -2.40 1.00 0.45 0.04 0.00 0.00 177.00 176.08 3h6t n SER 168 N -3.93 0.54 0.02 6.66 2.88 -1.25 -4.87 113.62 113.68 3h6t n SER 168 Ca 0.12 1.15 0.12 0.00 -1.33 0.00 0.00 58.87 58.92 3h6t n SER 168 Cb 0.52 -1.11 0.16 0.00 -0.75 0.00 0.00 64.21 63.03 3h6t n SER 168 CO 0.00 0.00 0.00 0.55 -1.23 0.00 0.00 175.04 174.36 3h6t n VAL 169 N 1.07 0.14 -2.91 2.46 3.14 -1.26 -4.93 118.33 116.03 3h6t n VAL 169 Ca 0.16 -0.13 -0.28 0.00 -2.96 0.00 0.00 64.34 61.13 3h6t n VAL 169 Cb 0.22 0.17 -0.02 0.00 -1.06 0.00 0.00 33.84 33.15 3h6t n VAL 169 CO 0.00 0.00 0.00 -0.36 -6.46 0.00 0.00 176.83 170.01 3h6t s PHE 170 N -3.09 3.52 0.12 1.45 0.08 -1.26 -3.96 117.98 114.83 3h6t s PHE 170 Ca 0.08 0.79 0.04 0.00 0.12 0.00 0.00 56.93 57.95 3h6t s PHE 170 Cb 0.16 -2.25 -0.04 0.00 -0.57 0.00 0.00 43.02 40.31 3h6t s PHE 170 CO 0.74 -0.10 -0.09 0.14 -0.10 0.00 0.00 175.22 175.80 3h6t s VAL 171 N -2.47 1.00 -2.68 -0.44 -7.23 -1.00 -4.99 120.40 102.60 3h6t s VAL 171 Ca 0.47 -1.90 0.23 0.00 -1.81 0.00 0.00 61.98 58.97 3h6t s VAL 171 Cb -0.10 -1.66 0.13 0.00 0.56 0.00 0.00 36.38 35.31 3h6t s VAL 171 CO 0.37 -0.71 1.20 -2.11 -0.31 0.00 0.00 175.10 173.54 3h6t n ARG 172 N 0.08 1.97 -3.84 4.82 1.85 -1.26 -1.09 116.66 119.19 3h6t n ARG 172 Ca -0.12 -1.64 -0.11 0.00 -1.00 0.00 0.00 57.85 54.98 3h6t n ARG 172 Cb 0.60 -1.46 -0.09 0.00 -1.05 0.00 0.00 32.46 30.46 3h6t n ARG 172 CO 0.00 0.00 0.00 0.95 -0.01 0.00 0.00 177.63 178.57 3h6t s THR 173 N -2.11 0.09 0.24 8.89 -4.23 -1.26 -4.81 115.64 112.44 3h6t s THR 173 Ca 0.25 -0.76 -0.06 0.00 -1.18 0.00 0.00 61.69 59.95 3h6t s THR 173 Cb 0.19 -0.72 0.17 0.00 1.34 0.00 0.00 72.50 73.49 3h6t s THR 173 CO 0.38 -0.42 1.81 0.74 -0.54 0.00 0.00 174.62 176.59 3h6t h THR 174 N 3.77 1.25 -0.01 3.99 2.02 -1.95 -1.88 112.91 120.09 3h6t h THR 174 Ca -0.31 -0.77 -0.00 0.00 0.77 0.00 0.00 66.41 66.09 3h6t h THR 174 Cb 1.19 0.33 -0.00 0.00 -1.74 0.00 0.00 68.15 67.93 3h6t h THR 174 CO 0.44 0.32 -0.02 0.00 0.37 0.00 0.00 175.52 176.63 3h6t h ALA 175 N 1.25 1.96 0.04 6.16 0.00 -1.97 -0.23 119.26 126.47 3h6t h ALA 175 Ca 0.26 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.14 3h6t h ALA 175 Cb 0.19 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.97 3h6t h ALA 175 CO -0.02 0.03 -0.02 1.49 0.00 0.00 0.00 179.25 180.73 3h6t h GLU 176 N 0.01 -0.05 -1.00 0.00 4.81 -1.76 -1.53 114.58 115.06 3h6t h GLU 176 Ca 0.00 0.00 0.04 0.00 -0.13 0.00 0.00 59.36 59.28 3h6t h GLU 176 Cb 0.04 0.01 -0.06 0.00 0.63 0.00 0.00 28.75 29.37 3h6t h GLU 176 CO 0.00 0.47 0.65 0.78 -0.73 0.00 0.00 179.01 180.18 3h6t h GLY 177 N -0.59 1.46 0.98 1.92 0.00 -0.99 -0.50 103.07 105.36 3h6t h GLY 177 Ca -0.00 -0.49 -0.09 0.00 0.00 0.00 0.00 47.33 46.74 3h6t h GLY 177 CO 0.01 0.42 -0.12 -2.08 0.00 0.00 0.00 176.54 174.76 3h6t h VAL 178 N 1.25 1.28 -0.65 4.60 2.07 -1.07 -2.30 116.25 121.42 3h6t h VAL 178 Ca 0.40 -1.22 -0.05 0.00 0.82 0.00 0.00 66.70 66.66 3h6t h VAL 178 Cb 0.02 1.26 -0.03 0.00 -1.52 0.00 0.00 31.29 31.02 3h6t h VAL 178 CO -0.13 0.41 0.23 0.00 0.02 0.00 0.00 177.57 178.10 3h6t h ALA 179 N 0.83 0.85 -0.56 1.67 0.00 -0.85 -2.18 119.26 119.02 3h6t h ALA 179 Ca 0.10 -0.19 -0.03 0.00 0.00 0.00 0.00 54.91 54.78 3h6t h ALA 179 Cb 0.65 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.16 3h6t h ALA 179 CO 0.04 0.50 0.23 -0.09 0.00 0.00 0.00 179.25 179.93 3h6t h ARG 180 N 0.93 0.80 -0.01 0.00 2.43 -1.00 -1.90 114.38 115.64 3h6t h ARG 180 Ca 0.21 -0.12 -0.00 0.00 -0.81 0.00 0.00 59.98 59.27 3h6t h ARG 180 Cb 0.25 -0.15 -0.00 0.00 -0.42 0.00 0.00 29.97 29.66 3h6t h ARG 180 CO -0.01 0.65 0.00 0.28 -1.51 0.00 0.00 179.97 179.38 3h6t h VAL 181 N 0.80 1.19 0.00 0.20 2.07 -1.00 -2.12 116.25 117.39 3h6t h VAL 181 Ca 0.19 -0.56 -0.00 0.00 0.82 0.00 0.00 66.70 67.15 3h6t h VAL 181 Cb 0.14 1.55 -0.00 0.00 -1.52 0.00 0.00 31.29 31.47 3h6t h VAL 181 CO -0.02 0.15 -0.00 0.03 0.02 0.00 0.00 177.57 177.75 3h6t h ARG 182 N -0.22 0.00 -0.01 1.57 3.08 -1.13 -3.05 114.38 114.63 3h6t h ARG 182 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3h6t h ARG 182 Cb 0.24 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.29 3h6t h ARG 182 CO 0.00 0.00 -0.48 0.36 -1.07 0.00 0.00 179.97 178.78 3h6t n LYS 183 N -3.09 1.98 -0.02 0.04 2.85 -0.74 -4.54 118.16 114.63 3h6t n LYS 183 Ca -0.02 -0.42 0.13 0.00 -1.05 0.00 0.00 58.31 56.96 3h6t n LYS 183 Cb 0.17 -1.21 0.44 0.00 -0.65 0.00 0.00 35.03 33.77 3h6t n LYS 183 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 177.40 177.78 3h6t n SER 184 N -0.69 1.75 -3.51 -5.58 7.64 -0.81 -4.96 113.62 107.46 3h6t n SER 184 Ca 0.05 -1.61 -0.19 0.00 1.01 0.00 0.00 58.87 58.13 3h6t n SER 184 Cb 0.28 -0.03 0.08 0.00 -1.01 0.00 0.00 64.21 63.53 3h6t n SER 184 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 3h6t n LYS 185 N 0.37 -6.70 -1.04 1.43 5.02 -1.26 -1.97 118.16 114.01 3h6t n LYS 185 Ca 0.18 0.81 -0.01 0.00 -2.02 0.00 0.00 58.31 57.27 3h6t n LYS 185 Cb 0.38 -5.79 -0.01 0.00 -0.02 0.00 0.00 35.03 29.60 3h6t n LYS 185 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3h6t n GLY 186 N -1.38 0.38 0.28 0.72 0.00 -1.26 -4.85 105.19 99.08 3h6t n GLY 186 Ca -0.22 -0.08 0.13 0.00 0.00 0.00 0.00 46.02 45.85 3h6t n GLY 186 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3h6t n LYS 187 N -1.29 0.91 -4.07 1.61 4.76 -0.83 -4.82 118.16 114.44 3h6t n LYS 187 Ca -0.01 -0.56 -0.18 0.00 -2.87 0.00 0.00 58.31 54.68 3h6t n LYS 187 Cb 0.25 -1.49 -0.16 0.00 -1.84 0.00 0.00 35.03 31.79 3h6t n LYS 187 CO 0.00 0.00 0.00 -0.47 -1.37 0.00 0.00 177.40 175.56 3h6t s TYR 188 N -2.47 0.54 0.04 2.13 5.04 -1.26 0.45 117.35 121.83 3h6t s TYR 188 Ca 0.25 -0.11 0.07 0.00 -2.44 0.00 0.00 57.07 54.83 3h6t s TYR 188 Cb 0.19 -0.53 -0.03 0.00 0.35 0.00 0.00 41.96 41.94 3h6t s TYR 188 CO 0.51 -0.15 -0.16 0.00 -1.34 0.00 0.00 175.55 174.41 3h6t s ALA 189 N 0.90 2.68 -0.09 3.97 0.00 0.11 -4.60 121.76 124.73 3h6t s ALA 189 Ca -0.11 -1.18 0.02 0.00 0.00 0.00 0.00 51.96 50.70 3h6t s ALA 189 Cb -0.14 -0.80 -0.02 0.00 0.00 0.00 0.00 23.12 22.16 3h6t s ALA 189 CO -0.01 0.58 -0.15 -0.47 0.00 0.00 0.00 175.76 175.71 3h6t s TYR 190 N -0.97 2.71 -0.44 0.00 5.04 -0.13 -3.00 117.35 120.58 3h6t s TYR 190 Ca 0.16 -0.47 -0.16 0.00 -2.44 0.00 0.00 57.07 54.16 3h6t s TYR 190 Cb -0.11 -1.72 0.04 0.00 0.35 0.00 0.00 41.96 40.52 3h6t s TYR 190 CO 0.06 -0.06 0.37 -0.51 -1.34 0.00 0.00 175.55 174.08 3h6t s LEU 191 N -0.15 5.20 0.21 6.97 1.43 -0.41 -0.39 118.68 131.54 3h6t s LEU 191 Ca -0.01 -0.98 -0.03 0.00 -1.03 0.00 0.00 54.13 52.08 3h6t s LEU 191 Cb -0.14 -2.23 -0.03 0.00 0.03 0.00 0.00 46.19 43.82 3h6t s LEU 191 CO 0.03 -0.56 0.21 -1.48 0.23 0.00 0.00 176.35 174.78 3h6t s LEU 192 N 1.81 0.99 0.28 1.79 2.34 -0.97 -4.41 118.68 120.51 3h6t s LEU 192 Ca 0.07 -1.30 -0.29 0.00 0.06 0.00 0.00 54.13 52.66 3h6t s LEU 192 Cb -0.20 0.67 -0.10 0.00 -0.56 0.00 0.00 46.19 46.01 3h6t s LEU 192 CO 0.10 -0.91 1.31 -1.61 -1.06 0.00 0.00 176.35 174.18 3h6t s GLU 193 N -4.11 4.38 0.33 1.48 2.02 -1.26 -0.30 118.70 121.24 3h6t s GLU 193 Ca 0.36 2.15 0.11 0.00 0.02 0.00 0.00 54.97 57.61 3h6t s GLU 193 Cb 0.05 -3.12 0.92 0.00 0.10 0.00 0.00 34.13 32.09 3h6t s GLU 193 CO 0.12 -0.20 1.73 0.66 0.02 0.00 0.00 175.26 177.59 3h6t h SER 194 N 4.11 0.64 -0.55 -0.19 4.64 -0.97 -1.07 113.55 120.15 3h6t h SER 194 Ca -0.47 0.13 0.07 0.00 -0.47 0.00 0.00 61.79 61.05 3h6t h SER 194 Cb 1.22 0.03 -0.06 0.00 -0.31 0.00 0.00 62.40 63.28 3h6t h SER 194 CO 0.70 0.10 0.23 0.71 -0.87 0.00 0.00 176.83 177.70 3h6t h THR 195 N 0.55 0.86 -0.03 2.95 1.35 -1.86 0.12 112.91 116.85 3h6t h THR 195 Ca 0.64 -0.15 -0.23 0.00 -0.55 0.00 0.00 66.41 66.12 3h6t h THR 195 Cb 1.28 0.37 0.01 0.00 -1.73 0.00 0.00 68.15 68.09 3h6t h THR 195 CO -0.45 0.08 -0.93 0.24 -0.25 0.00 0.00 175.52 174.21 3h6t h MET 196 N 0.44 0.56 0.01 4.72 2.86 -1.60 -2.72 114.93 119.21 3h6t h MET 196 Ca 0.26 -0.57 0.01 0.00 -2.06 0.00 0.00 59.70 57.35 3h6t h MET 196 Cb 0.26 0.15 -0.01 0.00 0.06 0.00 0.00 31.60 32.06 3h6t h MET 196 CO -0.24 1.19 -0.06 -0.97 1.06 0.00 0.00 176.91 177.89 3h6t h ASN 197 N 0.34 -0.16 -0.63 1.22 -0.73 -0.86 -1.89 115.58 112.87 3h6t h ASN 197 Ca -0.09 0.02 0.01 0.00 1.87 0.00 0.00 56.30 58.11 3h6t h ASN 197 Cb 1.56 0.07 -0.03 0.00 0.27 0.00 0.00 38.32 40.19 3h6t h ASN 197 CO 0.17 -0.09 0.42 -0.33 -0.37 0.00 0.00 177.43 177.23 3h6t h GLU 198 N -0.11 0.83 0.14 6.67 5.08 -0.80 -1.69 114.58 124.70 3h6t h GLU 198 Ca 0.02 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.32 3h6t h GLU 198 Cb 0.13 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 29.20 3h6t h GLU 198 CO -0.05 0.55 -0.07 -0.92 -1.00 0.00 0.00 179.01 177.52 3h6t h TYR 199 N 0.85 -0.17 -0.84 4.33 3.20 -1.14 -3.11 116.97 120.09 3h6t h TYR 199 Ca 0.23 -0.00 0.08 0.00 3.14 0.00 0.00 58.73 62.18 3h6t h TYR 199 Cb -0.09 0.06 -0.06 0.00 1.54 0.00 0.00 36.73 38.18 3h6t h TYR 199 CO -0.00 0.15 0.55 0.82 -1.64 0.00 0.00 178.16 178.04 3h6t h ILE 200 N -0.51 1.01 0.00 1.81 1.08 -1.14 -1.20 117.51 118.56 3h6t h ILE 200 Ca -0.02 -0.30 -0.01 0.00 -0.39 0.00 0.00 64.86 64.14 3h6t h ILE 200 Cb 0.40 0.05 -0.00 0.00 -3.07 0.00 0.00 36.82 34.20 3h6t h ILE 200 CO 0.03 0.16 -0.04 -0.08 -0.69 0.00 0.00 178.15 177.53 3h6t h GLU 201 N 0.88 0.00 -0.43 2.37 4.81 -1.27 -1.72 114.58 119.22 3h6t h GLU 201 Ca 0.38 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.61 3h6t h GLU 201 Cb 0.32 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.70 3h6t h GLU 201 CO -0.15 0.04 0.00 1.04 -0.73 0.00 0.00 179.01 179.22 3h6t n GLN 202 N -3.79 2.35 -4.85 1.92 1.13 -0.46 -4.83 117.38 108.86 3h6t n GLN 202 Ca -0.03 -2.06 -0.33 0.00 -1.94 0.00 0.00 57.00 52.64 3h6t n GLN 202 Cb 0.13 -1.48 -0.13 0.00 0.11 0.00 0.00 30.24 28.87 3h6t n GLN 202 CO 0.00 0.00 0.00 1.03 -1.44 0.00 0.00 177.06 176.65 3h6t s ARG 203 N -1.43 2.58 0.72 -1.09 1.81 -0.65 -0.85 118.95 120.05 3h6t s ARG 203 Ca 0.39 -0.67 -0.15 0.00 -1.72 0.00 0.00 55.73 53.57 3h6t s ARG 203 Cb 0.21 -2.42 0.04 0.00 -0.45 0.00 0.00 34.95 32.33 3h6t s ARG 203 CO 0.30 0.61 1.20 0.21 -0.68 0.00 0.00 175.30 176.93 3h6t s LYS 204 N -0.68 2.19 0.00 3.54 2.47 -1.26 -1.42 119.74 124.58 3h6t s LYS 204 Ca 0.10 1.74 0.01 0.00 -1.56 0.00 0.00 55.97 56.27 3h6t s LYS 204 Cb -0.11 -1.84 0.08 0.00 -1.46 0.00 0.00 37.83 34.50 3h6t s LYS 204 CO 0.01 -1.79 0.41 -0.35 0.16 0.00 0.00 175.35 173.79 3h6t n PRO 205 N -2.68 0.31 -3.85 4.03 -0.04 -1.26 -4.96 135.00 126.55 3h6t n PRO 205 Ca 0.13 0.00 -0.25 0.00 -0.04 0.00 0.00 63.50 63.34 3h6t n PRO 205 Cb 0.50 -1.07 0.01 0.00 -0.04 0.00 0.00 33.50 32.90 3h6t n PRO 205 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3h6t n ASP 207 N -2.97 1.79 -4.74 0.00 5.75 -1.26 -5.00 116.55 110.12 3h6t n ASP 207 Ca -0.23 -1.42 -0.22 0.00 -0.01 0.00 0.00 54.79 52.91 3h6t n ASP 207 Cb 0.64 -0.02 -0.06 0.00 -1.03 0.00 0.00 41.12 40.66 3h6t n ASP 207 CO 0.00 0.00 0.00 0.42 -0.11 0.00 0.00 177.20 177.51 3h6t s THR 208 N -0.71 3.81 -0.01 2.12 -4.23 -1.26 -0.26 115.64 115.11 3h6t s THR 208 Ca 0.10 -1.64 -0.06 0.00 -1.18 0.00 0.00 61.69 58.91 3h6t s THR 208 Cb 0.07 -3.11 0.00 0.00 1.34 0.00 0.00 72.50 70.80 3h6t s THR 208 CO 0.10 -0.33 0.13 -0.04 -0.54 0.00 0.00 174.62 173.94 3h6t s MET 209 N -3.79 0.42 -0.24 3.99 -1.94 0.33 -4.71 119.30 113.36 3h6t s MET 209 Ca 0.33 -0.30 -0.19 0.00 -1.71 0.00 0.00 55.69 53.83 3h6t s MET 209 Cb -0.06 0.17 -0.03 0.00 2.01 0.00 0.00 34.83 36.92 3h6t s MET 209 CO 0.23 -0.09 0.55 0.21 -0.01 0.00 0.00 175.02 175.91 3h6t s LYS 210 N -1.12 4.12 -0.03 2.03 2.47 -1.26 -1.38 119.74 124.58 3h6t s LYS 210 Ca -0.12 0.43 0.06 0.00 -1.56 0.00 0.00 55.97 54.77 3h6t s LYS 210 Cb -0.07 -3.62 -0.01 0.00 -1.46 0.00 0.00 37.83 32.67 3h6t s LYS 210 CO 0.01 -0.30 -0.20 0.54 0.16 0.00 0.00 175.35 175.56 3h6t s VAL 211 N 2.13 1.64 0.00 4.02 0.11 -0.20 -5.00 120.40 123.11 3h6t s VAL 211 Ca 0.24 -0.86 0.00 0.00 -2.93 0.00 0.00 61.98 58.43 3h6t s VAL 211 Cb -0.16 -1.38 0.00 0.00 -1.53 0.00 0.00 36.38 33.31 3h6t s VAL 211 CO 0.09 0.47 0.00 0.61 -3.33 0.00 0.00 175.10 172.94 3h6t n GLY 212 N 2.83 -2.06 4.03 6.54 0.00 -1.21 -4.04 105.19 111.28 3h6t n GLY 212 Ca -0.17 -1.58 -0.20 0.00 0.00 0.00 0.00 46.02 44.08 3h6t n GLY 212 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3h6t s GLY 213 N -0.83 1.74 0.41 -0.02 0.00 -1.26 -4.96 107.32 102.40 3h6t s GLY 213 Ca 0.00 -2.08 -0.23 0.00 0.00 0.00 0.00 44.72 42.41 3h6t s GLY 213 CO 0.00 -1.62 1.00 -1.31 0.00 0.00 0.00 173.10 171.17 3h6t s ASN 214 N -4.66 6.84 0.30 1.64 0.01 -1.26 -4.77 114.94 113.04 3h6t s ASN 214 Ca 0.62 1.90 0.17 0.00 -0.71 0.00 0.00 52.86 54.84 3h6t s ASN 214 Cb -0.06 -2.57 0.11 0.00 0.41 0.00 0.00 41.25 39.14 3h6t s ASN 214 CO 0.39 -0.43 1.42 -0.07 -1.51 0.00 0.00 177.10 176.90 3h6t h LEU 215 N 2.33 0.00 0.00 0.60 4.07 -0.83 -3.48 115.31 118.00 3h6t h LEU 215 Ca -0.48 0.00 -0.15 0.00 0.08 0.00 0.00 57.88 57.32 3h6t h LEU 215 Cb 1.20 0.00 -0.03 0.00 1.08 0.00 0.00 40.66 42.91 3h6t h LEU 215 CO 0.62 0.38 0.05 -0.90 -1.08 0.00 0.00 178.44 177.51 3h6t n ASP 216 N -3.16 -1.73 -3.75 -0.43 5.68 -1.26 -4.92 116.55 106.98 3h6t n ASP 216 Ca 0.02 -2.67 -0.21 0.00 -0.50 0.00 0.00 54.79 51.43 3h6t n ASP 216 Cb 0.69 3.01 -0.17 0.00 -1.14 0.00 0.00 41.12 43.51 3h6t n ASP 216 CO 0.00 0.00 0.00 -0.44 -1.33 0.00 0.00 177.20 175.43 3h6t s SER 217 N -3.02 1.21 0.00 -1.12 0.01 -1.26 -4.18 113.70 105.34 3h6t s SER 217 Ca 0.22 -0.02 0.00 0.00 1.31 0.00 0.00 55.95 57.45 3h6t s SER 217 Cb -0.03 -0.31 0.00 0.00 0.21 0.00 0.00 66.02 65.90 3h6t s SER 217 CO 0.16 -0.19 0.00 2.29 0.41 0.00 0.00 173.24 175.91 3h6t n LYS 218 N 4.98 0.00 -3.82 12.44 2.85 -0.38 -5.03 118.16 129.20 3h6t n LYS 218 Ca -0.10 0.00 -0.06 0.00 -1.05 0.00 0.00 58.31 57.10 3h6t n LYS 218 Cb 0.50 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.88 3h6t n LYS 218 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 177.40 177.55 3h6t s GLY 219 N 0.00 0.04 0.08 2.58 0.00 -1.26 -1.44 107.32 107.32 3h6t s GLY 219 Ca 0.00 -0.32 0.01 0.00 0.00 0.00 0.00 44.72 44.41 3h6t s GLY 219 CO 0.00 0.36 0.23 -0.19 0.00 0.00 0.00 173.10 173.50 3h6t s TYR 220 N -2.97 3.51 0.03 1.90 2.02 -0.44 -2.43 117.35 118.98 3h6t s TYR 220 Ca 0.15 0.21 -0.03 0.00 -0.37 0.00 0.00 57.07 57.03 3h6t s TYR 220 Cb -0.04 -1.73 -0.02 0.00 -0.40 0.00 0.00 41.96 39.77 3h6t s TYR 220 CO 0.07 0.57 0.03 0.20 -1.57 0.00 0.00 175.55 174.85 3h6t s GLY 221 N -2.70 0.25 -0.08 0.71 0.00 -0.91 -0.81 107.32 103.79 3h6t s GLY 221 Ca 0.35 -0.67 -0.30 0.00 0.00 0.00 0.00 44.72 44.10 3h6t s GLY 221 CO 0.28 -0.78 1.16 -0.42 0.00 0.00 0.00 173.10 173.34 3h6t s ILE 222 N -2.45 4.38 0.06 0.90 -1.09 -1.26 -4.61 121.20 117.13 3h6t s ILE 222 Ca -0.07 1.69 0.03 0.00 -2.23 0.00 0.00 60.65 60.08 3h6t s ILE 222 Cb -0.02 -4.09 -0.04 0.00 -1.58 0.00 0.00 42.46 36.73 3h6t s ILE 222 CO -0.04 -0.02 0.01 0.00 -1.23 0.00 0.00 174.94 173.66 3h6t s ALA 223 N 2.30 3.31 0.06 9.38 0.00 -0.70 -0.85 121.76 135.26 3h6t s ALA 223 Ca 0.54 -1.05 -0.01 0.00 0.00 0.00 0.00 51.96 51.45 3h6t s ALA 223 Cb -0.23 -1.27 -0.04 0.00 0.00 0.00 0.00 23.12 21.58 3h6t s ALA 223 CO 0.20 0.69 -0.03 0.95 0.00 0.00 0.00 175.76 177.57 3h6t s THR 224 N -1.23 0.27 0.57 0.00 -4.23 -0.74 -0.31 115.64 109.97 3h6t s THR 224 Ca 0.24 -1.83 -0.20 0.00 -1.18 0.00 0.00 61.69 58.72 3h6t s THR 224 Cb -0.12 -1.58 -0.04 0.00 1.34 0.00 0.00 72.50 72.11 3h6t s THR 224 CO 0.16 -0.95 1.25 -2.84 -0.54 0.00 0.00 174.62 171.70 3h6t s PRO 225 N -3.92 3.04 0.18 3.99 0.02 -1.26 -1.27 135.00 135.77 3h6t s PRO 225 Ca 0.09 1.96 -0.33 0.00 0.02 0.00 0.00 61.00 62.74 3h6t s PRO 225 Cb 0.08 -2.05 -0.16 0.00 0.02 0.00 0.00 34.50 32.39 3h6t s PRO 225 CO -0.09 -1.19 1.13 1.63 -0.33 0.00 0.00 177.00 178.16 3h6t n LYS 226 N -1.38 1.11 -1.67 5.54 4.76 -1.26 -1.35 118.16 123.91 3h6t n LYS 226 Ca 0.12 0.40 -0.19 0.00 -2.87 0.00 0.00 58.31 55.77 3h6t n LYS 226 Cb 0.48 -1.87 -0.07 0.00 -1.84 0.00 0.00 35.03 31.73 3h6t n LYS 226 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3h6t n GLY 227 N 1.96 1.52 3.77 0.72 0.00 -1.26 -4.97 105.19 106.93 3h6t n GLY 227 Ca 0.15 -0.10 -0.34 0.00 0.00 0.00 0.00 46.02 45.73 3h6t n GLY 227 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3h6t s SER 228 N -2.70 5.33 0.13 1.61 0.15 -0.46 -4.97 113.70 112.79 3h6t s SER 228 Ca 0.00 2.05 -0.12 0.00 0.70 0.00 0.00 55.95 58.57 3h6t s SER 228 Cb 0.00 -2.56 -0.05 0.00 -1.71 0.00 0.00 66.02 61.70 3h6t s SER 228 CO 0.00 -1.48 1.47 0.77 1.20 0.00 0.00 173.24 175.20 3h6t h SER 229 N 0.41 0.89 -0.26 5.45 4.64 -1.93 -3.15 113.55 119.60 3h6t h SER 229 Ca -0.48 -0.44 0.07 0.00 -0.47 0.00 0.00 61.79 60.47 3h6t h SER 229 Cb 1.25 -0.25 -0.01 0.00 -0.31 0.00 0.00 62.40 63.08 3h6t h SER 229 CO 0.55 1.15 0.19 -0.07 -0.87 0.00 0.00 176.83 177.78 3h6t h LEU 230 N 0.65 0.04 -0.85 5.97 3.38 -1.95 -3.31 115.31 119.25 3h6t h LEU 230 Ca 0.07 0.00 0.11 0.00 0.09 0.00 0.00 57.88 58.15 3h6t h LEU 230 Cb 0.86 -0.01 -0.12 0.00 0.09 0.00 0.00 40.66 41.48 3h6t h LEU 230 CO 0.08 0.03 -0.40 0.61 0.09 0.00 0.00 178.44 178.84 3h6t n GLY 231 N -1.58 -1.95 0.06 0.83 0.00 -1.19 -1.53 105.19 99.83 3h6t n GLY 231 Ca 0.03 0.97 -0.12 0.00 0.00 0.00 0.00 46.02 46.90 3h6t n GLY 231 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 3h6t h ASN 232 N 0.00 -0.03 -0.60 1.61 -1.24 -1.82 -2.62 115.58 110.88 3h6t h ASN 232 Ca 0.23 -0.12 -0.02 0.00 0.71 0.00 0.00 56.30 57.09 3h6t h ASN 232 Cb 0.44 0.01 -0.03 0.00 0.73 0.00 0.00 38.32 39.47 3h6t h ASN 232 CO -0.82 0.10 0.31 0.00 -1.29 0.00 0.00 177.43 175.73 3h6t h ALA 233 N 0.80 0.77 -0.56 1.57 0.00 -1.69 -2.40 119.26 117.75 3h6t h ALA 233 Ca -0.00 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.79 3h6t h ALA 233 Cb 0.16 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.68 3h6t h ALA 233 CO 0.01 0.31 0.37 0.28 0.00 0.00 0.00 179.25 180.21 3h6t h VAL 234 N 0.81 1.15 -0.33 0.00 2.07 -1.26 -0.99 116.25 117.70 3h6t h VAL 234 Ca 0.21 -0.27 -0.12 0.00 0.82 0.00 0.00 66.70 67.33 3h6t h VAL 234 Cb 0.09 0.33 -0.01 0.00 -1.52 0.00 0.00 31.29 30.18 3h6t h VAL 234 CO -0.03 0.14 -0.28 -1.13 0.02 0.00 0.00 177.57 176.29 3h6t h ASN 235 N 0.76 0.82 -0.11 0.57 -0.73 -1.06 -2.28 115.58 113.54 3h6t h ASN 235 Ca 0.20 -0.46 -0.06 0.00 1.87 0.00 0.00 56.30 57.86 3h6t h ASN 235 Cb -0.08 -0.23 -0.02 0.00 0.27 0.00 0.00 38.32 38.27 3h6t h ASN 235 CO -0.04 1.10 -0.10 -0.07 -0.37 0.00 0.00 177.43 177.94 3h6t h LEU 236 N 0.54 0.41 -0.26 0.34 3.38 -0.95 -2.26 115.31 116.51 3h6t h LEU 236 Ca 0.06 -0.10 -0.06 0.00 0.09 0.00 0.00 57.88 57.88 3h6t h LEU 236 Cb 0.85 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.49 3h6t h LEU 236 CO 0.07 0.56 -0.05 0.00 0.09 0.00 0.00 178.44 179.11 3h6t h ALA 237 N 1.49 0.36 -0.83 1.53 0.00 -1.04 -1.74 119.26 119.02 3h6t h ALA 237 Ca 0.08 -0.26 0.02 0.00 0.00 0.00 0.00 54.91 54.74 3h6t h ALA 237 Cb 0.43 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.09 3h6t h ALA 237 CO 0.02 0.15 0.54 0.28 0.00 0.00 0.00 179.25 180.25 3h6t h VAL 238 N 0.25 1.19 -0.54 0.00 2.07 -1.18 0.29 116.25 118.33 3h6t h VAL 238 Ca 0.07 -0.38 -0.04 0.00 0.82 0.00 0.00 66.70 67.18 3h6t h VAL 238 Cb 0.52 -0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 30.26 3h6t h VAL 238 CO 0.02 0.20 0.19 -0.07 0.02 0.00 0.00 177.57 177.94 3h6t h LEU 239 N 1.09 0.76 0.07 2.57 3.38 -1.31 -0.33 115.31 121.54 3h6t h LEU 239 Ca 0.31 -0.19 -0.00 0.00 0.09 0.00 0.00 57.88 58.09 3h6t h LEU 239 Cb -0.08 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.47 3h6t h LEU 239 CO -0.08 0.74 -0.04 0.50 0.09 0.00 0.00 178.44 179.65 3h6t h LYS 240 N 0.73 -0.10 -0.87 1.13 3.64 -0.65 -0.41 116.57 120.05 3h6t h LYS 240 Ca 0.18 0.01 0.06 0.00 -1.27 0.00 0.00 60.65 59.62 3h6t h LYS 240 Cb 0.23 0.02 -0.06 0.00 -0.41 0.00 0.00 32.23 32.02 3h6t h LYS 240 CO -0.01 0.13 0.57 -0.07 -2.27 0.00 0.00 179.45 177.80 3h6t h LEU 241 N -0.31 0.87 -0.06 5.20 3.38 -0.37 -0.74 115.31 123.28 3h6t h LEU 241 Ca -0.01 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 3h6t h LEU 241 Cb 0.27 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 40.83 3h6t h LEU 241 CO 0.02 0.57 0.00 -1.28 0.09 0.00 0.00 178.44 177.84 3h6t h SER 242 N 0.99 0.10 0.39 -0.43 0.87 -0.79 -0.79 113.55 113.91 3h6t h SER 242 Ca 0.37 -0.30 -0.08 0.00 -1.23 0.00 0.00 61.79 60.55 3h6t h SER 242 Cb 0.18 -0.03 -0.01 0.00 -0.44 0.00 0.00 62.40 62.10 3h6t h SER 242 CO -0.13 0.38 -0.38 -0.33 -0.53 0.00 0.00 176.83 175.84 3h6t h GLU 243 N -0.17 0.00 -0.26 2.24 5.08 -0.59 -2.76 114.58 118.12 3h6t h GLU 243 Ca 0.02 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 3h6t h GLU 243 Cb 0.32 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.57 3h6t h GLU 243 CO 0.00 0.38 0.00 1.04 -1.00 0.00 0.00 179.01 179.43 3h6t n GLN 244 N -4.07 1.65 -0.94 2.33 1.13 -0.33 -4.90 117.38 112.25 3h6t n GLN 244 Ca -0.02 -1.00 0.00 0.00 -1.94 0.00 0.00 57.00 54.04 3h6t n GLN 244 Cb 0.41 -1.25 0.00 0.00 0.11 0.00 0.00 30.24 29.51 3h6t n GLN 244 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3h6t n GLY 245 N 0.98 0.73 0.23 1.08 0.00 -1.04 -4.92 105.19 102.25 3h6t n GLY 245 Ca 0.11 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.08 3h6t n GLY 245 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3h6t h LEU 246 N 0.00 0.58 -0.55 0.99 7.12 -1.37 -1.15 115.31 120.93 3h6t h LEU 246 Ca 0.00 -0.00 -0.03 0.00 0.13 0.00 0.00 57.88 57.98 3h6t h LEU 246 Cb 0.04 -0.13 -0.02 0.00 -0.53 0.00 0.00 40.66 40.02 3h6t h LEU 246 CO 0.00 0.41 0.21 -0.07 -0.13 0.00 0.00 178.44 178.86 3h6t h LEU 247 N 0.70 0.77 -0.98 2.25 3.38 -1.81 -1.82 115.31 117.80 3h6t h LEU 247 Ca 0.22 -0.18 -0.03 0.00 0.09 0.00 0.00 57.88 57.98 3h6t h LEU 247 Cb 0.00 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.52 3h6t h LEU 247 CO -0.09 0.74 0.31 -0.78 0.09 0.00 0.00 178.44 178.71 3h6t h ASP 248 N 0.75 0.96 -0.13 -0.43 3.58 -1.81 -1.98 116.42 117.36 3h6t h ASP 248 Ca 0.18 -0.12 0.00 0.00 0.42 0.00 0.00 57.03 57.51 3h6t h ASP 248 Cb 0.22 -0.25 -0.01 0.00 1.72 0.00 0.00 39.33 41.01 3h6t h ASP 248 CO -0.01 0.83 0.08 0.50 -2.88 0.00 0.00 179.24 177.76 3h6t h LYS 249 N 1.04 0.16 -0.15 0.28 3.64 -0.76 -2.47 116.57 118.31 3h6t h LYS 249 Ca 0.25 -0.01 -0.08 0.00 -1.27 0.00 0.00 60.65 59.54 3h6t h LYS 249 Cb 0.16 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 31.93 3h6t h LYS 249 CO -0.03 0.11 -0.26 -0.07 -2.27 0.00 0.00 179.45 176.93 3h6t h LEU 250 N 0.17 0.28 -0.10 5.20 3.38 -1.14 -1.94 115.31 121.16 3h6t h LEU 250 Ca 0.05 -0.09 -0.00 0.00 0.09 0.00 0.00 57.88 57.93 3h6t h LEU 250 Cb -0.01 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 40.66 3h6t h LEU 250 CO -0.02 0.54 0.05 0.50 0.09 0.00 0.00 178.44 179.60 3h6t h LYS 251 N 0.25 0.14 -0.39 1.13 1.63 -1.05 -1.76 116.57 116.52 3h6t h LYS 251 Ca 0.04 -0.02 -0.09 0.00 -0.85 0.00 0.00 60.65 59.72 3h6t h LYS 251 Cb 0.60 -0.02 -0.02 0.00 -0.60 0.00 0.00 32.23 32.19 3h6t h LYS 251 CO 0.04 0.22 -0.14 -0.91 -3.45 0.00 0.00 179.45 175.20 3h6t h ASN 252 N 0.03 0.71 -0.84 4.20 2.35 -1.38 -1.77 115.58 118.88 3h6t h ASN 252 Ca 0.03 -0.22 0.01 0.00 -0.55 0.00 0.00 56.30 55.58 3h6t h ASN 252 Cb 0.12 -0.19 -0.04 0.00 0.05 0.00 0.00 38.32 38.26 3h6t h ASN 252 CO -0.00 0.87 0.55 0.50 -1.65 0.00 0.00 177.43 177.69 3h6t h LYS 253 N 0.64 1.09 0.00 0.81 3.64 -1.04 0.72 116.57 122.43 3h6t h LYS 253 Ca 0.11 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.42 3h6t h LYS 253 Cb 0.61 -0.25 0.00 0.00 -0.41 0.00 0.00 32.23 32.18 3h6t h LYS 253 CO 0.04 0.72 -1.05 0.91 -2.27 0.00 0.00 179.45 177.80 3h6t n TRP 254 N -4.51 0.05 -0.06 1.91 7.02 -0.69 -3.70 117.44 117.46 3h6t n TRP 254 Ca 0.09 0.02 -0.13 0.00 -1.02 0.00 0.00 57.50 56.46 3h6t n TRP 254 Cb 0.02 -0.18 -0.04 0.00 -2.42 0.00 0.00 31.31 28.69 3h6t n TRP 254 CO 0.00 0.00 0.00 0.91 -2.02 0.00 0.00 177.69 176.58 3h6t n TRP 255 N -1.68 0.00 -0.14 -5.99 8.01 -0.68 -4.88 117.44 112.08 3h6t n TRP 255 Ca 0.03 0.00 -0.27 0.00 -1.31 0.00 0.00 57.50 55.95 3h6t n TRP 255 Cb 0.38 -0.47 -0.11 0.00 -2.01 0.00 0.00 31.31 29.11 3h6t n TRP 255 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.69 177.34 3h6t n TYR 256 N -3.84 0.02 -0.04 -5.99 4.01 -1.05 -4.52 117.16 105.74 3h6t n TYR 256 Ca -0.23 0.01 -0.02 0.00 -0.16 0.00 0.00 57.90 57.50 3h6t n TYR 256 Cb 0.56 -1.00 -0.01 0.00 -0.31 0.00 0.00 39.34 38.58 3h6t n TYR 256 CO 0.00 0.00 0.00 -0.44 -0.46 0.00 0.00 176.86 175.96 3h6t h ASP 257 N -0.75 -0.26 -3.14 7.72 5.19 0.27 -3.15 116.42 122.29 3h6t h ASP 257 Ca -0.67 0.04 -0.74 0.00 -0.62 0.00 0.00 57.03 55.04 3h6t h ASP 257 Cb 1.69 0.11 -0.22 0.00 0.18 0.00 0.00 39.33 41.09 3h6t h ASP 257 CO -0.34 -0.04 -0.18 -1.59 -3.12 0.00 0.00 179.24 173.97 3h6t s LYS 258 N -3.33 3.01 0.01 3.56 -2.85 -1.24 -5.01 119.74 113.89 3h6t s LYS 258 Ca -0.02 -1.46 0.01 0.00 -1.00 0.00 0.00 55.97 53.50 3h6t s LYS 258 Cb 0.01 -4.22 -0.01 0.00 -2.06 0.00 0.00 37.83 31.55 3h6t s LYS 258 CO 0.08 -1.26 -0.03 0.20 0.10 0.00 0.00 175.35 174.44 3h6t s GLY 259 N 3.21 0.22 -0.10 0.59 0.00 -1.19 -4.68 107.32 105.37 3h6t s GLY 259 Ca 0.06 -0.37 0.11 0.00 0.00 0.00 0.00 44.72 44.51 3h6t s GLY 259 CO 0.05 -0.40 0.45 1.18 0.00 0.00 0.00 173.10 174.39 3h6t n GLU 260 N 2.27 0.66 -0.66 2.90 1.02 -0.03 -4.48 120.64 122.33 3h6t n GLU 260 Ca -0.18 0.22 -0.04 0.00 -0.02 0.00 0.00 57.16 57.14 3h6t n GLU 260 Cb 0.57 -1.71 -0.06 0.00 -0.02 0.00 0.00 31.44 30.22 3h6t n GLU 260 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3h6t n GLY 262 N 1.86 0.37 0.00 0.00 0.00 -1.26 -5.04 105.19 101.12 3h6t n GLY 262 Ca 0.15 0.67 0.00 0.00 0.00 0.00 0.00 46.02 46.83 3h6t n GLY 262 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76