#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1n0t s VAL 6 N 0.00 4.34 -0.36 12.58 1.01 -0.22 -4.88 120.40 132.87 1n0t s VAL 6 Ca 0.00 1.78 -0.19 0.00 0.00 0.00 0.00 61.98 63.57 1n0t s VAL 6 Cb 0.00 -4.14 0.00 0.00 0.00 0.00 0.00 36.38 32.24 1n0t s VAL 6 CO 0.00 0.19 0.56 -0.69 0.00 0.00 0.00 175.10 175.16 1n0t s VAL 7 N 0.61 4.97 -0.24 2.92 1.01 -1.26 -1.34 120.40 127.06 1n0t s VAL 7 Ca 0.53 0.40 -0.10 0.00 0.00 0.00 0.00 61.98 62.81 1n0t s VAL 7 Cb -0.26 -4.01 -0.05 0.00 0.00 0.00 0.00 36.38 32.06 1n0t s VAL 7 CO 0.30 -0.27 0.15 -0.69 0.00 0.00 0.00 175.10 174.59 1n0t s VAL 8 N 2.51 5.26 -0.14 2.92 1.01 -0.44 -0.34 120.40 131.17 1n0t s VAL 8 Ca 0.21 0.14 -0.07 0.00 0.00 0.00 0.00 61.98 62.26 1n0t s VAL 8 Cb -0.15 -3.45 -0.04 0.00 0.00 0.00 0.00 36.38 32.74 1n0t s VAL 8 CO 0.14 0.35 0.10 0.28 0.00 0.00 0.00 175.10 175.97 1n0t s THR 9 N 1.06 5.12 0.17 3.92 -1.32 0.56 0.01 115.64 125.16 1n0t s THR 9 Ca 0.07 0.07 0.01 0.00 -1.21 0.00 0.00 61.69 60.63 1n0t s THR 9 Cb -0.14 -3.26 -0.00 0.00 -1.51 0.00 0.00 72.50 67.60 1n0t s THR 9 CO 0.04 0.55 0.21 1.07 -2.21 0.00 0.00 174.62 174.28 1n0t n THR 10 N 2.65 0.00 -4.02 5.08 5.66 -0.33 -2.24 114.28 121.08 1n0t n THR 10 Ca -0.18 -0.99 -0.13 0.00 -3.05 0.00 0.00 64.05 59.69 1n0t n THR 10 Cb 0.54 0.57 -0.13 0.00 -1.55 0.00 0.00 70.33 69.75 1n0t n THR 10 CO 0.00 0.00 0.00 -0.51 -3.05 0.00 0.00 175.07 171.51 1n0t s ILE 11 N -2.64 0.24 -0.76 1.09 2.07 -1.26 -0.50 121.20 119.45 1n0t s ILE 11 Ca 0.16 -0.33 -0.26 0.00 -1.41 0.00 0.00 60.65 58.82 1n0t s ILE 11 Cb -0.00 -0.25 -0.01 0.00 0.13 0.00 0.00 42.46 42.34 1n0t s ILE 11 CO 0.12 -0.06 1.70 -0.76 -1.91 0.00 0.00 174.94 174.02 1n0t s LEU 12 N -0.41 3.26 -0.08 8.50 1.43 -1.26 -4.26 118.68 125.86 1n0t s LEU 12 Ca -0.02 -0.30 -0.04 0.00 -1.03 0.00 0.00 54.13 52.74 1n0t s LEU 12 Cb -0.03 -2.55 0.04 0.00 0.03 0.00 0.00 46.19 43.68 1n0t s LEU 12 CO -0.00 -2.23 0.19 -0.70 0.23 0.00 0.00 176.35 173.84 1n0t s GLU 13 N 6.48 0.13 0.22 1.70 2.56 -0.74 -4.97 118.70 124.08 1n0t s GLU 13 Ca 0.58 0.46 -0.29 0.00 0.00 0.00 0.00 54.97 55.72 1n0t s GLU 13 Cb -0.09 -0.16 -0.09 0.00 2.00 0.00 0.00 34.13 35.80 1n0t s GLU 13 CO 0.11 -0.18 0.92 -1.12 -0.56 0.00 0.00 175.26 174.42 1n0t s SER 14 N 1.36 7.60 -0.40 -1.70 0.01 -1.26 -0.29 113.70 119.02 1n0t s SER 14 Ca -0.08 1.90 0.06 0.00 1.31 0.00 0.00 55.95 59.14 1n0t s SER 14 Cb -0.11 -2.59 0.67 0.00 0.21 0.00 0.00 66.02 64.19 1n0t s SER 14 CO -0.07 0.16 1.83 -0.81 0.41 0.00 0.00 173.24 174.76 1n0t n PRO 15 N 1.57 2.53 0.01 12.44 -0.04 -1.26 -4.94 135.00 145.30 1n0t n PRO 15 Ca -0.02 -3.05 -0.11 0.00 -0.04 0.00 0.00 63.50 60.28 1n0t n PRO 15 Cb 0.47 -2.14 -0.09 0.00 -0.04 0.00 0.00 33.50 31.71 1n0t n PRO 15 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 1n0t h TYR 16 N 1.37 -0.11 -3.30 0.54 0.05 -0.98 0.12 116.97 114.66 1n0t h TYR 16 Ca 0.50 -0.00 -0.32 0.00 0.05 0.00 0.00 58.73 58.95 1n0t h TYR 16 Cb 2.59 0.04 -0.36 0.00 1.01 0.00 0.00 36.73 40.00 1n0t h TYR 16 CO 1.45 0.42 -0.70 0.08 -1.05 0.00 0.00 178.16 178.36 1n0t s VAL 17 N -3.19 -0.13 0.02 -2.88 1.01 0.01 -0.82 120.40 114.42 1n0t s VAL 17 Ca -0.14 0.34 -0.04 0.00 0.00 0.00 0.00 61.98 62.14 1n0t s VAL 17 Cb -0.00 -0.18 -0.01 0.00 0.00 0.00 0.00 36.38 36.19 1n0t s VAL 17 CO 0.52 0.14 0.07 -0.04 0.00 0.00 0.00 175.10 175.80 1n0t s MET 18 N 1.86 0.49 -0.01 2.72 -1.94 0.20 -1.79 119.30 120.82 1n0t s MET 18 Ca 0.00 -0.63 -0.23 0.00 -1.71 0.00 0.00 55.69 53.12 1n0t s MET 18 Cb -0.12 0.19 -0.05 0.00 2.01 0.00 0.00 34.83 36.86 1n0t s MET 18 CO -0.04 -0.11 0.70 -1.64 -0.01 0.00 0.00 175.02 173.92 1n0t s MET 19 N -1.99 4.43 0.76 2.03 -1.94 -1.26 -0.62 119.30 120.71 1n0t s MET 19 Ca -0.10 0.91 -0.15 0.00 -1.71 0.00 0.00 55.69 54.64 1n0t s MET 19 Cb -0.05 -3.39 0.06 0.00 2.01 0.00 0.00 34.83 33.45 1n0t s MET 19 CO -0.02 0.21 1.24 0.15 -0.01 0.00 0.00 175.02 176.59 1n0t s LYS 20 N 0.28 1.87 0.41 2.03 1.02 -0.56 -4.89 119.74 119.90 1n0t s LYS 20 Ca 0.36 1.86 0.11 0.00 0.02 0.00 0.00 55.97 58.33 1n0t s LYS 20 Cb -0.19 -1.79 0.93 0.00 -0.52 0.00 0.00 37.83 36.26 1n0t s LYS 20 CO 0.20 -2.06 1.96 -0.22 -0.92 0.00 0.00 175.35 174.30 1n0t h LYS 21 N -0.50 0.51 -0.48 1.68 3.64 -1.95 -2.06 116.57 117.40 1n0t h LYS 21 Ca -0.48 -0.03 -0.10 0.00 -1.27 0.00 0.00 60.65 58.77 1n0t h LYS 21 Cb 1.31 -0.12 -0.06 0.00 -0.41 0.00 0.00 32.23 32.95 1n0t h LYS 21 CO 0.48 0.34 0.09 0.27 -2.27 0.00 0.00 179.45 178.36 1n0t n ASN 22 N -4.48 4.30 -0.30 4.20 6.94 -1.26 -4.76 115.26 119.89 1n0t n ASN 22 Ca 0.11 -3.18 0.22 0.00 -0.02 0.00 0.00 54.58 51.70 1n0t n ASN 22 Cb 0.34 -0.65 0.51 0.00 -2.36 0.00 0.00 39.78 37.62 1n0t n ASN 22 CO 0.00 0.00 0.00 1.12 -1.03 0.00 0.00 177.26 177.35 1n0t h HIS 23 N 2.30 0.63 -0.12 -2.53 2.07 -1.65 -1.95 115.15 113.90 1n0t h HIS 23 Ca 0.12 0.02 0.03 0.00 -2.85 0.00 0.00 60.37 57.70 1n0t h HIS 23 Cb 1.87 -0.19 -0.00 0.00 2.57 0.00 0.00 27.41 31.66 1n0t h HIS 23 CO 0.93 0.09 0.28 0.93 -3.07 0.00 0.00 177.93 177.10 1n0t h GLU 24 N 0.41 0.00 -0.62 5.12 5.08 -1.86 0.30 114.58 123.01 1n0t h GLU 24 Ca 0.56 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.92 1n0t h GLU 24 Cb 1.41 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.66 1n0t h GLU 24 CO -0.26 0.00 0.00 -1.33 -1.00 0.00 0.00 179.01 176.42 1n0t n MET 25 N -3.27 2.58 -4.36 2.33 2.81 -0.73 -4.96 117.12 111.52 1n0t n MET 25 Ca 0.00 -2.44 -0.25 0.00 -1.81 0.00 0.00 57.70 53.21 1n0t n MET 25 Cb 0.37 -1.53 -0.09 0.00 -0.71 0.00 0.00 33.22 31.26 1n0t n MET 25 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 1n0t s LEU 26 N -1.12 2.96 0.15 4.03 1.43 0.11 -5.14 118.68 121.09 1n0t s LEU 26 Ca 0.45 -1.01 0.09 0.00 -1.03 0.00 0.00 54.13 52.63 1n0t s LEU 26 Cb 0.24 -1.32 -0.04 0.00 0.03 0.00 0.00 46.19 45.10 1n0t s LEU 26 CO 0.32 -0.23 -0.21 -1.61 0.23 0.00 0.00 176.35 174.85 1n0t s GLU 27 N -3.71 1.29 2.03 1.70 2.02 -1.26 -4.81 118.70 115.97 1n0t s GLU 27 Ca 0.35 -1.36 0.00 0.00 0.02 0.00 0.00 54.97 53.98 1n0t s GLU 27 Cb 0.00 -1.49 0.00 0.00 0.10 0.00 0.00 34.13 32.74 1n0t s GLU 27 CO 0.19 0.32 0.00 0.41 0.02 0.00 0.00 175.26 176.20 1n0t n GLY 28 N 0.55 2.10 0.32 -1.39 0.00 -1.26 -1.84 105.19 103.67 1n0t n GLY 28 Ca -0.15 -0.23 0.17 0.00 0.00 0.00 0.00 46.02 45.81 1n0t n GLY 28 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1n0t h ASN 29 N 2.18 0.00 0.31 1.61 2.35 -1.92 -2.33 115.58 117.78 1n0t h ASN 29 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1n0t h ASN 29 Cb 0.00 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.37 1n0t h ASN 29 CO 0.00 0.00 0.00 -0.62 -1.65 0.00 0.00 177.43 175.16 1n0t n GLU 30 N -3.67 0.21 0.20 0.81 -0.58 -0.77 -2.51 120.64 114.33 1n0t n GLU 30 Ca -0.01 0.14 0.13 0.00 -0.42 0.00 0.00 57.16 57.01 1n0t n GLU 30 Cb 0.21 -1.50 0.33 0.00 -0.57 0.00 0.00 31.44 29.91 1n0t n GLU 30 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1n0t h ARG 31 N 0.00 0.00 -6.37 3.49 3.08 -1.52 -3.45 114.38 109.61 1n0t h ARG 31 Ca 0.00 0.00 -0.61 0.00 0.07 0.00 0.00 59.98 59.44 1n0t h ARG 31 Cb 0.16 0.00 -0.12 0.00 0.08 0.00 0.00 29.97 30.09 1n0t h ARG 31 CO 0.00 0.00 -0.68 0.71 -1.07 0.00 0.00 179.97 178.93 1n0t s TYR 32 N -3.28 2.77 0.05 3.04 2.02 -1.05 -1.50 117.35 119.40 1n0t s TYR 32 Ca 0.06 -0.17 -0.06 0.00 -0.37 0.00 0.00 57.07 56.54 1n0t s TYR 32 Cb 0.07 -1.34 -0.01 0.00 -0.40 0.00 0.00 41.96 40.28 1n0t s TYR 32 CO 0.62 0.52 0.10 -1.83 -1.57 0.00 0.00 175.55 173.39 1n0t s GLU 33 N -2.92 0.64 0.00 -0.62 -1.05 0.21 -4.86 118.70 110.10 1n0t s GLU 33 Ca 0.27 -0.84 0.00 0.00 -0.15 0.00 0.00 54.97 54.25 1n0t s GLU 33 Cb -0.09 0.25 0.00 0.00 -0.44 0.00 0.00 34.13 33.85 1n0t s GLU 33 CO 0.17 -0.16 0.00 0.41 0.95 0.00 0.00 175.26 176.63 1n0t n GLY 34 N 0.54 2.70 0.20 -3.83 0.00 -1.26 -0.63 105.19 102.91 1n0t n GLY 34 Ca -0.18 -1.66 -0.08 0.00 0.00 0.00 0.00 46.02 44.10 1n0t n GLY 34 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1n0t h TYR 35 N 0.00 -0.36 0.00 1.61 5.03 -0.24 -0.38 116.97 122.62 1n0t h TYR 35 Ca 0.00 0.03 -0.02 0.00 2.58 0.00 0.00 58.73 61.31 1n0t h TYR 35 Cb 0.00 0.19 -0.00 0.00 1.55 0.00 0.00 36.73 38.47 1n0t h TYR 35 CO 0.00 -0.21 -0.12 0.00 -1.32 0.00 0.00 178.16 176.51 1n0t h VAL 37 N 0.00 1.27 -0.33 0.00 2.07 -1.25 0.16 116.25 118.17 1n0t h VAL 37 Ca -0.00 -1.90 -0.15 0.00 0.82 0.00 0.00 66.70 65.47 1n0t h VAL 37 Cb 0.65 1.87 -0.00 0.00 -1.52 0.00 0.00 31.29 32.29 1n0t h VAL 37 CO 0.02 0.61 -0.37 0.44 0.02 0.00 0.00 177.57 178.28 1n0t h ASP 38 N 0.58 0.91 -0.78 0.57 3.32 -0.74 -2.79 116.42 117.49 1n0t h ASP 38 Ca -0.03 -0.48 -0.03 0.00 0.02 0.00 0.00 57.03 56.51 1n0t h ASP 38 Cb 1.34 -0.26 -0.04 0.00 0.22 0.00 0.00 39.33 40.59 1n0t h ASP 38 CO 0.15 1.20 0.39 0.25 -1.72 0.00 0.00 179.24 179.51 1n0t h LEU 39 N 0.63 1.01 -0.42 1.55 5.85 -0.92 -1.48 115.31 121.53 1n0t h LEU 39 Ca 0.05 -0.13 -0.00 0.00 0.84 0.00 0.00 57.88 58.64 1n0t h LEU 39 Cb 0.96 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 41.71 1n0t h LEU 39 CO 0.09 0.85 0.25 0.00 -0.34 0.00 0.00 178.44 179.29 1n0t h ALA 40 N 1.20 0.54 -0.78 1.25 0.00 -0.93 0.21 119.26 120.75 1n0t h ALA 40 Ca 0.27 -0.07 0.02 0.00 0.00 0.00 0.00 54.91 55.14 1n0t h ALA 40 Cb 0.10 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.68 1n0t h ALA 40 CO -0.04 0.04 0.50 0.00 0.00 0.00 0.00 179.25 179.76 1n0t h ALA 41 N 1.11 1.01 -0.01 0.00 0.00 -1.18 0.86 119.26 121.04 1n0t h ALA 41 Ca 0.15 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 1n0t h ALA 41 Cb 0.02 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 17.53 1n0t h ALA 41 CO -0.03 0.33 0.00 0.93 0.00 0.00 0.00 179.25 180.49 1n0t h GLU 42 N 0.99 0.02 -0.20 0.00 4.39 -0.84 -0.80 114.58 118.13 1n0t h GLU 42 Ca 0.30 -0.00 0.03 0.00 0.34 0.00 0.00 59.36 60.02 1n0t h GLU 42 Cb -0.03 -0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 28.59 1n0t h GLU 42 CO -0.09 0.21 0.04 0.82 -1.16 0.00 0.00 179.01 178.82 1n0t h ILE 43 N -0.18 0.91 -0.84 3.13 1.08 -0.66 -0.74 117.51 120.21 1n0t h ILE 43 Ca 0.00 -0.04 -0.02 0.00 -0.39 0.00 0.00 64.86 64.41 1n0t h ILE 43 Cb 0.20 0.78 -0.04 0.00 -3.07 0.00 0.00 36.82 34.69 1n0t h ILE 43 CO -0.00 0.02 0.44 0.00 -0.69 0.00 0.00 178.15 177.92 1n0t h ALA 44 N 1.15 1.19 0.25 1.87 0.00 -0.77 0.13 119.26 123.07 1n0t h ALA 44 Ca 0.09 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 1n0t h ALA 44 Cb 0.09 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 17.54 1n0t h ALA 44 CO -0.12 0.64 -0.12 -0.22 0.00 0.00 0.00 179.25 179.42 1n0t h LYS 45 N 1.18 -0.32 -0.14 0.00 3.64 -0.75 0.43 116.57 120.61 1n0t h LYS 45 Ca 0.29 0.02 -0.05 0.00 -1.27 0.00 0.00 60.65 59.65 1n0t h LYS 45 Cb 0.06 0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 31.94 1n0t h LYS 45 CO -0.04 -0.09 -0.13 0.45 -2.27 0.00 0.00 179.45 177.36 1n0t h HIS 46 N -0.51 0.23 0.00 1.91 3.86 -0.92 -2.84 115.15 116.88 1n0t h HIS 46 Ca -0.03 -0.03 -0.06 0.00 -1.16 0.00 0.00 60.37 59.09 1n0t h HIS 46 Cb 0.38 -0.07 -0.01 0.00 1.06 0.00 0.00 27.41 28.77 1n0t h HIS 46 CO -0.01 0.36 -1.01 0.00 0.86 0.00 0.00 177.93 178.13 1n0t n GLY 48 N 1.24 0.59 3.17 0.00 0.00 0.15 -5.05 105.19 105.29 1n0t n GLY 48 Ca -0.03 -0.30 -0.10 0.00 0.00 0.00 0.00 46.02 45.59 1n0t n GLY 48 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1n0t s PHE 49 N -3.03 0.08 0.14 1.61 -0.71 -0.92 -5.06 117.98 110.09 1n0t s PHE 49 Ca 0.02 -0.30 -0.10 0.00 -1.04 0.00 0.00 56.93 55.51 1n0t s PHE 49 Cb -0.00 -0.05 -0.06 0.00 -1.21 0.00 0.00 43.02 41.70 1n0t s PHE 49 CO 0.06 -0.41 0.47 0.15 -1.34 0.00 0.00 175.22 174.15 1n0t s LYS 50 N -2.52 3.81 0.16 1.99 1.02 -1.26 -4.67 119.74 118.27 1n0t s LYS 50 Ca -0.05 0.25 -0.05 0.00 0.02 0.00 0.00 55.97 56.14 1n0t s LYS 50 Cb -0.01 -2.88 -0.03 0.00 -0.52 0.00 0.00 37.83 34.39 1n0t s LYS 50 CO -0.04 0.47 0.18 1.52 -0.92 0.00 0.00 175.35 176.56 1n0t s TYR 51 N -1.55 0.70 -0.09 3.18 1.13 -1.26 -1.06 117.35 118.40 1n0t s TYR 51 Ca 0.39 -1.05 0.00 0.00 -1.41 0.00 0.00 57.07 55.00 1n0t s TYR 51 Cb -0.13 -0.29 0.02 0.00 -1.10 0.00 0.00 41.96 40.46 1n0t s TYR 51 CO 0.20 -0.64 -0.07 0.21 -2.51 0.00 0.00 175.55 172.73 1n0t s LYS 52 N -4.03 1.39 -0.07 -3.49 2.47 -0.45 -4.89 119.74 110.67 1n0t s LYS 52 Ca 0.24 -0.23 -0.27 0.00 -1.56 0.00 0.00 55.97 54.15 1n0t s LYS 52 Cb 0.05 -1.42 -0.03 0.00 -1.46 0.00 0.00 37.83 34.98 1n0t s LYS 52 CO 0.03 -0.20 0.87 -0.51 0.16 0.00 0.00 175.35 175.70 1n0t s LEU 53 N 1.48 4.30 -0.03 5.43 1.43 -1.26 -1.33 118.68 128.70 1n0t s LEU 53 Ca 0.00 1.41 0.04 0.00 -1.03 0.00 0.00 54.13 54.54 1n0t s LEU 53 Cb -0.13 -3.35 -0.00 0.00 0.03 0.00 0.00 46.19 42.73 1n0t s LEU 53 CO -0.05 -0.26 -0.14 0.42 0.23 0.00 0.00 176.35 176.55 1n0t s THR 54 N 1.28 1.13 -0.05 5.49 -4.23 0.10 -4.86 115.64 114.50 1n0t s THR 54 Ca 0.44 -0.57 -0.26 0.00 -1.18 0.00 0.00 61.69 60.13 1n0t s THR 54 Cb -0.19 -0.97 -0.03 0.00 1.34 0.00 0.00 72.50 72.65 1n0t s THR 54 CO 0.21 0.33 0.81 -0.63 -0.54 0.00 0.00 174.62 174.80 1n0t s ILE 55 N -0.01 4.97 -0.00 2.99 -1.09 -1.26 -1.19 121.20 125.60 1n0t s ILE 55 Ca -0.01 1.68 -0.36 0.00 -2.23 0.00 0.00 60.65 59.74 1n0t s ILE 55 Cb -0.09 -4.15 -0.14 0.00 -1.58 0.00 0.00 42.46 36.50 1n0t s ILE 55 CO 0.01 0.20 1.64 0.55 -1.23 0.00 0.00 174.94 176.10 1n0t n VAL 56 N 3.91 0.21 -0.17 2.92 3.14 0.35 -4.88 118.33 123.81 1n0t n VAL 56 Ca 0.02 -0.04 -0.13 0.00 -2.96 0.00 0.00 64.34 61.23 1n0t n VAL 56 Cb 0.51 -1.41 -0.10 0.00 -1.06 0.00 0.00 33.84 31.78 1n0t n VAL 56 CO 0.00 0.00 0.00 1.23 -6.46 0.00 0.00 176.83 171.60 1n0t h GLY 57 N 6.73 -1.00 -0.09 7.55 0.00 -1.93 -1.85 103.07 112.48 1n0t h GLY 57 Ca -0.47 0.73 0.00 0.00 0.00 0.00 0.00 47.33 47.59 1n0t h GLY 57 CO 0.89 -0.10 0.00 2.09 0.00 0.00 0.00 176.54 179.42 1n0t n ASP 58 N -5.34 0.57 -2.63 0.19 5.68 -1.26 -4.90 116.55 108.86 1n0t n ASP 58 Ca -0.03 -1.71 -0.18 0.00 -0.50 0.00 0.00 54.79 52.37 1n0t n ASP 58 Cb 0.33 -0.05 0.00 0.00 -1.14 0.00 0.00 41.12 40.26 1n0t n ASP 58 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1n0t n GLY 59 N 0.82 -0.50 3.70 6.12 0.00 -0.70 -4.94 105.19 109.69 1n0t n GLY 59 Ca 0.10 0.03 -0.23 0.00 0.00 0.00 0.00 46.02 45.92 1n0t n GLY 59 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1n0t s LYS 60 N -5.27 2.31 -0.15 1.61 -0.14 -1.26 -5.05 119.74 111.79 1n0t s LYS 60 Ca 0.10 -1.57 -0.13 0.00 -1.36 0.00 0.00 55.97 53.00 1n0t s LYS 60 Cb -0.05 -2.12 -0.09 0.00 -1.68 0.00 0.00 37.83 33.89 1n0t s LYS 60 CO 0.12 0.14 0.07 1.88 -0.76 0.00 0.00 175.35 176.80 1n0t h TYR 61 N 1.63 0.00 0.00 3.18 -1.99 -1.92 -2.73 116.97 115.14 1n0t h TYR 61 Ca -0.44 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.29 1n0t h TYR 61 Cb 1.25 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.98 1n0t h TYR 61 CO 0.65 0.51 0.00 0.41 -0.00 0.00 0.00 178.16 179.73 1n0t n GLY 62 N 1.60 1.49 3.05 3.88 0.00 -1.26 -1.44 105.19 112.50 1n0t n GLY 62 Ca -0.13 0.28 -0.10 0.00 0.00 0.00 0.00 46.02 46.07 1n0t n GLY 62 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n0t s ALA 63 N 0.00 -0.03 -0.26 4.61 0.00 -1.25 -4.92 121.76 119.91 1n0t s ALA 63 Ca 0.00 -0.48 -0.09 0.00 0.00 0.00 0.00 51.96 51.39 1n0t s ALA 63 Cb 0.00 0.16 -0.04 0.00 0.00 0.00 0.00 23.12 23.24 1n0t s ALA 63 CO 0.00 -0.21 0.13 0.50 0.00 0.00 0.00 175.76 176.18 1n0t s ARG 64 N -1.77 3.85 0.04 0.00 3.52 -1.26 -1.39 118.95 121.94 1n0t s ARG 64 Ca -0.13 -0.38 -0.30 0.00 -0.13 0.00 0.00 55.73 54.80 1n0t s ARG 64 Cb -0.07 -3.49 -0.08 0.00 -1.56 0.00 0.00 34.95 29.76 1n0t s ARG 64 CO -0.01 -0.12 1.78 0.34 -0.81 0.00 0.00 175.30 176.48 1n0t s ASP 65 N 1.52 6.54 0.43 -2.12 -1.08 -0.70 -4.85 116.67 116.41 1n0t s ASP 65 Ca 0.06 2.53 0.29 0.00 -0.52 0.00 0.00 52.55 54.91 1n0t s ASP 65 Cb -0.15 -2.55 1.56 0.00 -1.46 0.00 0.00 42.92 40.33 1n0t s ASP 65 CO 0.07 -0.97 1.88 0.00 0.52 0.00 0.00 175.17 176.67 1n0t h ALA 66 N 9.40 1.01 0.00 3.66 0.00 -1.96 0.69 119.26 132.06 1n0t h ALA 66 Ca -0.45 0.00 -0.18 0.00 0.00 0.00 0.00 54.91 54.28 1n0t h ALA 66 Cb 1.21 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.97 1n0t h ALA 66 CO 0.94 -0.01 -1.55 -0.25 0.00 0.00 0.00 179.25 178.38 1n0t n ASP 67 N -2.51 1.86 0.20 0.00 8.00 -1.26 -4.61 116.55 118.23 1n0t n ASP 67 Ca -0.02 0.32 0.10 0.00 0.71 0.00 0.00 54.79 55.89 1n0t n ASP 67 Cb 0.05 -0.73 0.19 0.00 -0.02 0.00 0.00 41.12 40.61 1n0t n ASP 67 CO 0.00 0.00 0.00 0.71 -0.39 0.00 0.00 177.20 177.52 1n0t h THR 68 N -0.93 0.28 -1.23 -3.53 1.35 -1.96 -3.47 112.91 103.42 1n0t h THR 68 Ca -0.27 -1.32 -0.35 0.00 -0.55 0.00 0.00 66.41 63.92 1n0t h THR 68 Cb 1.19 2.07 -0.11 0.00 -1.73 0.00 0.00 68.15 69.57 1n0t h THR 68 CO -0.16 0.15 -0.35 0.29 -0.25 0.00 0.00 175.52 175.20 1n0t n LYS 69 N -3.15 -1.24 -3.54 4.72 5.02 0.24 -4.98 118.16 115.23 1n0t n LYS 69 Ca 0.03 1.04 -0.37 0.00 -2.02 0.00 0.00 58.31 56.98 1n0t n LYS 69 Cb 0.56 -5.32 -0.06 0.00 -0.02 0.00 0.00 35.03 30.19 1n0t n LYS 69 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1n0t s ILE 70 N -2.69 5.20 0.02 -0.18 1.01 -1.25 -4.75 121.20 118.56 1n0t s ILE 70 Ca 0.00 0.68 -0.24 0.00 0.00 0.00 0.00 60.65 61.09 1n0t s ILE 70 Cb 0.00 -3.66 -0.05 0.00 0.01 0.00 0.00 42.46 38.76 1n0t s ILE 70 CO 0.00 0.49 0.72 0.26 0.00 0.00 0.00 174.94 176.41 1n0t s TRP 71 N -0.37 3.71 0.28 3.97 0.52 -1.26 -1.73 118.94 124.07 1n0t s TRP 71 Ca 0.21 1.39 0.04 0.00 0.02 0.00 0.00 56.10 57.75 1n0t s TRP 71 Cb -0.15 -2.77 0.04 0.00 -1.15 0.00 0.00 33.47 29.44 1n0t s TRP 71 CO 0.09 0.28 0.30 0.27 0.02 0.00 0.00 176.95 177.90 1n0t n ASN 72 N 2.86 1.45 0.00 2.95 0.23 -0.48 -4.23 115.26 118.04 1n0t n ASN 72 Ca -0.03 -1.85 0.00 0.00 -0.53 0.00 0.00 54.58 52.17 1n0t n ASN 72 Cb 0.50 -0.12 0.00 0.00 -2.08 0.00 0.00 39.78 38.09 1n0t n ASN 72 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1n0t n GLY 73 N 1.62 0.96 0.31 4.83 0.00 -1.26 -1.62 105.19 110.03 1n0t n GLY 73 Ca 0.04 -0.78 0.01 0.00 0.00 0.00 0.00 46.02 45.28 1n0t n GLY 73 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 1n0t h MET 74 N 0.00 0.74 -0.16 1.61 2.86 -0.92 -1.14 114.93 117.92 1n0t h MET 74 Ca 0.00 -0.08 -0.01 0.00 -2.06 0.00 0.00 59.70 57.55 1n0t h MET 74 Cb 0.00 -0.15 -0.01 0.00 0.06 0.00 0.00 31.60 31.50 1n0t h MET 74 CO 0.00 0.57 0.07 0.28 1.06 0.00 0.00 176.91 178.89 1n0t h VAL 75 N 0.75 1.14 -0.81 -2.22 2.07 -1.58 -2.26 116.25 113.34 1n0t h VAL 75 Ca 0.19 -0.42 0.04 0.00 0.82 0.00 0.00 66.70 67.33 1n0t h VAL 75 Cb 0.06 1.12 -0.05 0.00 -1.52 0.00 0.00 31.29 30.89 1n0t h VAL 75 CO -0.03 0.13 0.51 1.23 0.02 0.00 0.00 177.57 179.43 1n0t h GLY 76 N 0.12 1.18 2.00 2.17 0.00 -0.78 -0.71 103.07 107.06 1n0t h GLY 76 Ca 0.06 -0.38 -0.01 0.00 0.00 0.00 0.00 47.33 47.00 1n0t h GLY 76 CO -0.01 0.30 -0.03 0.83 0.00 0.00 0.00 176.54 177.64 1n0t h GLU 77 N 0.97 0.00 0.01 4.80 5.08 -0.81 -1.81 114.58 122.82 1n0t h GLU 77 Ca 0.33 0.00 -0.10 0.00 -1.00 0.00 0.00 59.36 58.60 1n0t h GLU 77 Cb 0.06 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.30 1n0t h GLU 77 CO -0.13 0.03 -0.51 -0.07 -1.00 0.00 0.00 179.01 177.32 1n0t h LEU 78 N 0.00 0.04 -1.41 1.33 3.38 -0.60 0.35 115.31 118.40 1n0t h LEU 78 Ca -0.00 -0.83 0.00 0.00 0.09 0.00 0.00 57.88 57.14 1n0t h LEU 78 Cb 0.08 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 40.82 1n0t h LEU 78 CO 0.00 1.21 0.00 -0.37 0.09 0.00 0.00 178.44 179.37 1n0t h VAL 79 N -0.94 0.00 -0.55 1.22 -1.51 -1.14 -2.55 116.25 110.79 1n0t h VAL 79 Ca -0.13 -0.43 0.00 0.00 -1.23 0.00 0.00 66.70 64.91 1n0t h VAL 79 Cb 1.16 1.37 0.00 0.00 -2.13 0.00 0.00 31.29 31.70 1n0t h VAL 79 CO -0.06 0.00 0.00 -1.22 -1.23 0.00 0.00 177.57 175.06 1n0t n TYR 80 N -2.92 0.72 -2.28 5.19 4.01 -0.70 -4.99 117.16 116.19 1n0t n TYR 80 Ca 0.01 -0.41 -0.07 0.00 -0.16 0.00 0.00 57.90 57.26 1n0t n TYR 80 Cb 0.28 -0.01 0.00 0.00 -0.31 0.00 0.00 39.34 39.30 1n0t n TYR 80 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1n0t n GLY 81 N 1.38 0.15 0.06 2.72 0.00 -0.96 -4.96 105.19 103.58 1n0t n GLY 81 Ca 0.20 -0.54 0.07 0.00 0.00 0.00 0.00 46.02 45.75 1n0t n GLY 81 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1n0t n LYS 82 N -1.76 0.64 -4.04 1.61 4.81 0.12 -4.96 118.16 114.58 1n0t n LYS 82 Ca -0.07 -0.03 -0.08 0.00 -0.87 0.00 0.00 58.31 57.26 1n0t n LYS 82 Cb 0.56 -1.65 -0.11 0.00 0.02 0.00 0.00 35.03 33.86 1n0t n LYS 82 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1n0t s ALA 83 N -3.26 0.33 -0.13 3.14 0.00 -0.68 -5.00 121.76 116.15 1n0t s ALA 83 Ca -0.06 -0.88 0.19 0.00 0.00 0.00 0.00 51.96 51.21 1n0t s ALA 83 Cb 0.11 0.20 -0.19 0.00 0.00 0.00 0.00 23.12 23.24 1n0t s ALA 83 CO 0.85 -0.25 0.63 -0.25 0.00 0.00 0.00 175.76 176.75 1n0t n ASP 84 N 0.91 0.52 -3.58 0.00 8.00 0.54 -4.51 116.55 118.43 1n0t n ASP 84 Ca -0.19 0.22 -0.16 0.00 0.71 0.00 0.00 54.79 55.37 1n0t n ASP 84 Cb 0.58 0.72 -0.07 0.00 -0.02 0.00 0.00 41.12 42.33 1n0t n ASP 84 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 1n0t s ILE 85 N -3.01 0.00 -0.18 0.53 2.07 -0.99 -4.35 121.20 115.27 1n0t s ILE 85 Ca -0.05 -0.02 -0.01 0.00 -1.41 0.00 0.00 60.65 59.16 1n0t s ILE 85 Cb 0.09 -0.97 -0.01 0.00 0.13 0.00 0.00 42.46 41.71 1n0t s ILE 85 CO 0.83 -0.01 -0.11 0.00 -1.91 0.00 0.00 174.94 173.74 1n0t s ALA 86 N -0.53 2.64 -0.40 1.50 0.00 0.11 -0.33 121.76 124.75 1n0t s ALA 86 Ca -0.06 -1.06 0.04 0.00 0.00 0.00 0.00 51.96 50.87 1n0t s ALA 86 Cb -0.02 -1.40 0.11 0.00 0.00 0.00 0.00 23.12 21.81 1n0t s ALA 86 CO 0.06 -0.13 0.12 0.42 0.00 0.00 0.00 175.76 176.23 1n0t s ILE 87 N 0.98 2.24 0.22 0.00 1.01 -0.95 -1.72 121.20 122.98 1n0t s ILE 87 Ca -0.01 -2.59 -0.23 0.00 0.00 0.00 0.00 60.65 57.82 1n0t s ILE 87 Cb -0.15 -2.63 0.04 0.00 0.01 0.00 0.00 42.46 39.74 1n0t s ILE 87 CO -0.01 -0.68 0.85 0.00 0.00 0.00 0.00 174.94 175.10 1n0t s ALA 88 N 0.56 -1.42 -1.01 9.38 0.00 -1.26 -4.62 121.76 123.39 1n0t s ALA 88 Ca 0.13 -0.13 -0.09 0.00 0.00 0.00 0.00 51.96 51.87 1n0t s ALA 88 Cb -0.21 0.74 -0.07 0.00 0.00 0.00 0.00 23.12 23.58 1n0t s ALA 88 CO -0.06 -1.04 2.20 -0.35 0.00 0.00 0.00 175.76 176.50 1n0t n PRO 89 N -0.48 2.24 -3.33 0.00 -0.04 -1.26 -4.58 135.00 127.55 1n0t n PRO 89 Ca -0.05 -1.67 -0.41 0.00 -0.04 0.00 0.00 63.50 61.32 1n0t n PRO 89 Cb 0.60 -2.61 -0.09 0.00 -0.04 0.00 0.00 33.50 31.36 1n0t n PRO 89 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 1n0t s LEU 90 N 0.38 4.43 0.24 1.53 2.96 -1.26 -4.99 118.68 121.97 1n0t s LEU 90 Ca 0.47 -0.18 -0.30 0.00 -0.22 0.00 0.00 54.13 53.89 1n0t s LEU 90 Cb 0.12 -2.44 -0.10 0.00 0.50 0.00 0.00 46.19 44.27 1n0t s LEU 90 CO -0.02 -0.41 1.38 -0.89 -1.32 0.00 0.00 176.35 175.09 1n0t s THR 91 N 2.18 2.88 -0.35 3.68 2.01 -1.26 -1.23 115.64 123.54 1n0t s THR 91 Ca 0.15 0.74 -0.29 0.00 0.31 0.00 0.00 61.69 62.60 1n0t s THR 91 Cb -0.16 -3.47 0.01 0.00 0.01 0.00 0.00 72.50 68.89 1n0t s THR 91 CO 0.12 0.12 1.18 -0.63 -0.69 0.00 0.00 174.62 174.73 1n0t s ILE 92 N -0.04 4.29 0.14 1.82 1.01 -0.17 -4.86 121.20 123.39 1n0t s ILE 92 Ca 0.57 1.43 0.04 0.00 0.00 0.00 0.00 60.65 62.70 1n0t s ILE 92 Cb -0.40 -4.36 -0.04 0.00 0.01 0.00 0.00 42.46 37.67 1n0t s ILE 92 CO 0.42 -0.61 -0.10 0.42 0.00 0.00 0.00 174.94 175.07 1n0t s THR 93 N 4.16 1.14 0.11 2.92 -4.23 -1.26 -4.76 115.64 113.72 1n0t s THR 93 Ca 0.50 -2.04 -0.29 0.00 -1.18 0.00 0.00 61.69 58.68 1n0t s THR 93 Cb -0.13 -1.82 -0.10 0.00 1.34 0.00 0.00 72.50 71.79 1n0t s THR 93 CO 0.22 -0.75 1.61 0.25 -0.54 0.00 0.00 174.62 175.42 1n0t h LEU 94 N 2.82 -0.97 -1.46 4.79 5.85 -1.97 0.99 115.31 125.35 1n0t h LEU 94 Ca -0.37 0.10 0.06 0.00 0.84 0.00 0.00 57.88 58.51 1n0t h LEU 94 Cb 1.19 0.36 -0.04 0.00 0.37 0.00 0.00 40.66 42.54 1n0t h LEU 94 CO 0.63 -0.44 0.43 -0.37 -0.34 0.00 0.00 178.44 178.35 1n0t h VAL 95 N -0.61 1.02 0.01 1.05 -1.51 -2.00 -1.70 116.25 112.50 1n0t h VAL 95 Ca 0.01 -0.23 -0.25 0.00 -1.23 0.00 0.00 66.70 65.00 1n0t h VAL 95 Cb 0.61 0.29 0.01 0.00 -2.13 0.00 0.00 31.29 30.08 1n0t h VAL 95 CO -0.16 0.12 -1.01 0.03 -1.23 0.00 0.00 177.57 175.32 1n0t h ARG 96 N 0.67 0.58 0.00 5.19 3.08 -1.89 -3.10 114.38 118.92 1n0t h ARG 96 Ca 0.27 -0.64 0.00 0.00 0.07 0.00 0.00 59.98 59.69 1n0t h ARG 96 Cb 0.23 0.18 0.00 0.00 0.08 0.00 0.00 29.97 30.46 1n0t h ARG 96 CO -0.08 1.24 0.00 1.49 -1.07 0.00 0.00 179.97 181.55 1n0t h GLU 97 N 0.33 0.00 0.00 0.04 4.57 -0.05 -0.99 114.58 118.48 1n0t h GLU 97 Ca -0.11 0.00 -0.08 0.00 -1.18 0.00 0.00 59.36 57.99 1n0t h GLU 97 Cb 1.66 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 30.24 1n0t h GLU 97 CO 0.19 0.00 -0.37 0.93 -1.18 0.00 0.00 179.01 178.58 1n0t h GLU 98 N 0.00 0.00 0.00 1.92 5.08 -1.25 -3.35 114.58 116.98 1n0t h GLU 98 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1n0t h GLU 98 Cb 0.26 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.51 1n0t h GLU 98 CO 0.00 0.37 -1.15 1.33 -1.00 0.00 0.00 179.01 178.55 1n0t n VAL 99 N -3.27 0.00 -4.25 3.13 0.24 -0.77 -5.05 118.33 108.36 1n0t n VAL 99 Ca 0.02 -0.22 -0.14 0.00 -2.04 0.00 0.00 64.34 61.95 1n0t n VAL 99 Cb 0.62 0.47 -0.10 0.00 -1.47 0.00 0.00 33.84 33.37 1n0t n VAL 99 CO 0.00 0.00 0.00 0.27 -2.14 0.00 0.00 176.83 174.96 1n0t s ILE 100 N -2.41 0.15 -0.03 1.34 -4.36 -0.45 -4.35 121.20 111.09 1n0t s ILE 100 Ca -0.02 -2.00 -0.00 0.00 -0.26 0.00 0.00 60.65 58.37 1n0t s ILE 100 Cb 0.06 -2.53 -0.04 0.00 1.25 0.00 0.00 42.46 41.20 1n0t s ILE 100 CO 0.36 0.00 0.02 -1.81 0.24 0.00 0.00 174.94 173.75 1n0t s ASP 101 N -3.24 5.30 -0.03 4.36 1.01 0.81 -4.27 116.67 120.62 1n0t s ASP 101 Ca 0.39 0.09 0.07 0.00 0.71 0.00 0.00 52.55 53.80 1n0t s ASP 101 Cb 0.06 -1.46 -0.02 0.00 1.01 0.00 0.00 42.92 42.51 1n0t s ASP 101 CO 0.15 0.32 -0.23 -0.36 0.21 0.00 0.00 175.17 175.25 1n0t s PHE 102 N -1.04 2.43 0.93 4.23 0.40 -1.26 -1.36 117.98 122.31 1n0t s PHE 102 Ca 0.18 -0.38 -0.13 0.00 -0.60 0.00 0.00 56.93 56.00 1n0t s PHE 102 Cb -0.12 -1.54 0.15 0.00 0.51 0.00 0.00 43.02 42.03 1n0t s PHE 102 CO 0.08 0.01 1.16 -1.54 0.70 0.00 0.00 175.22 175.63 1n0t s SER 103 N -0.62 3.38 0.69 1.36 1.04 -0.13 -4.95 113.70 114.47 1n0t s SER 103 Ca 0.10 0.84 -0.15 0.00 0.48 0.00 0.00 55.95 57.22 1n0t s SER 103 Cb -0.10 -1.33 0.02 0.00 0.10 0.00 0.00 66.02 64.70 1n0t s SER 103 CO -0.00 -2.62 1.15 -0.54 0.98 0.00 0.00 173.24 172.21 1n0t s LYS 104 N -5.39 2.52 0.10 4.02 -0.14 -1.26 -4.52 119.74 115.07 1n0t s LYS 104 Ca 0.65 1.57 -0.36 0.00 -1.36 0.00 0.00 55.97 56.47 1n0t s LYS 104 Cb -0.13 -1.90 -0.17 0.00 -1.68 0.00 0.00 37.83 33.96 1n0t s LYS 104 CO 0.53 -1.50 1.30 -2.30 -0.76 0.00 0.00 175.35 172.62 1n0t n PRO 105 N -2.50 1.13 -0.00 -1.68 -0.02 -1.26 -4.68 135.00 125.99 1n0t n PRO 105 Ca 0.12 0.41 0.10 0.00 -2.02 0.00 0.00 63.50 62.10 1n0t n PRO 105 Cb 0.51 -2.02 -0.12 0.00 -0.02 0.00 0.00 33.50 31.85 1n0t n PRO 105 CO 0.00 0.00 0.00 1.97 1.98 0.00 0.00 175.50 179.45 1n0t n PHE 106 N 2.31 0.00 -3.69 6.00 1.16 -0.08 -4.92 117.46 118.23 1n0t n PHE 106 Ca 0.18 0.00 -0.12 0.00 -1.87 0.00 0.00 57.45 55.64 1n0t n PHE 106 Cb 0.20 -0.01 -0.09 0.00 -1.61 0.00 0.00 39.48 37.97 1n0t n PHE 106 CO 0.00 0.00 0.00 1.41 -1.87 0.00 0.00 176.76 176.30 1n0t s MET 107 N -2.96 0.55 0.09 3.97 0.00 -1.24 -4.97 119.30 114.73 1n0t s MET 107 Ca 0.07 0.79 0.01 0.00 0.00 0.00 0.00 55.69 56.57 1n0t s MET 107 Cb 0.16 0.18 -0.04 0.00 0.00 0.00 0.00 34.83 35.13 1n0t s MET 107 CO 0.85 -0.10 0.19 -1.12 0.00 0.00 0.00 175.02 174.83 1n0t s SER 108 N 0.74 6.10 0.28 1.11 0.01 -1.26 -0.94 113.70 119.74 1n0t s SER 108 Ca -0.04 0.16 -0.15 0.00 1.31 0.00 0.00 55.95 57.23 1n0t s SER 108 Cb -0.05 -1.80 0.06 0.00 0.21 0.00 0.00 66.02 64.44 1n0t s SER 108 CO -0.05 0.14 0.76 0.00 0.41 0.00 0.00 173.24 174.50 1n0t n LEU 109 N 0.15 0.00 -3.67 2.44 -0.00 -0.76 -4.88 117.00 110.28 1n0t n LEU 109 Ca -0.06 -1.93 -0.00 0.00 -0.00 0.00 0.00 56.01 54.02 1n0t n LEU 109 Cb 0.52 3.05 -0.01 0.00 -0.00 0.00 0.00 43.42 46.98 1n0t n LEU 109 CO 0.49 -0.64 0.94 -0.83 -0.00 0.00 0.00 177.39 177.35 1n0t s GLY 110 N -2.94 -0.35 0.16 1.47 0.00 -1.26 -1.58 107.32 102.81 1n0t s GLY 110 Ca 0.16 0.48 -0.31 0.00 0.00 0.00 0.00 44.72 45.05 1n0t s GLY 110 CO 0.09 0.15 1.44 -0.42 0.00 0.00 0.00 173.10 174.35 1n0t s ILE 111 N -2.71 3.00 0.24 0.90 1.01 -1.26 0.23 121.20 122.61 1n0t s ILE 111 Ca 0.14 0.75 0.01 0.00 0.00 0.00 0.00 60.65 61.54 1n0t s ILE 111 Cb 0.03 -3.48 -0.05 0.00 0.01 0.00 0.00 42.46 38.97 1n0t s ILE 111 CO -0.02 0.07 0.09 -0.94 0.00 0.00 0.00 174.94 174.15 1n0t s SER 112 N 0.94 0.96 -0.18 3.58 1.04 0.12 -0.08 113.70 120.07 1n0t s SER 112 Ca 0.65 -1.36 -0.06 0.00 0.48 0.00 0.00 55.95 55.66 1n0t s SER 112 Cb -0.40 0.21 -0.03 0.00 0.10 0.00 0.00 66.02 65.90 1n0t s SER 112 CO 0.33 -0.74 0.02 -0.63 0.98 0.00 0.00 173.24 173.20 1n0t s ILE 113 N -3.84 4.26 -0.20 -1.02 1.01 -1.26 -1.13 121.20 119.02 1n0t s ILE 113 Ca 0.37 -0.22 -0.05 0.00 0.00 0.00 0.00 60.65 60.75 1n0t s ILE 113 Cb 0.08 -2.91 -0.02 0.00 0.01 0.00 0.00 42.46 39.61 1n0t s ILE 113 CO 0.12 0.45 -0.02 -0.32 0.00 0.00 0.00 174.94 175.18 1n0t s MET 114 N 0.64 3.55 0.22 2.79 -2.45 0.46 -2.21 119.30 122.31 1n0t s MET 114 Ca 0.01 -0.55 0.08 0.00 -1.25 0.00 0.00 55.69 53.98 1n0t s MET 114 Cb -0.14 -3.04 -0.05 0.00 1.25 0.00 0.00 34.83 32.85 1n0t s MET 114 CO 0.02 -0.03 -0.15 0.96 1.05 0.00 0.00 175.02 176.87 1n0t s ILE 115 N 1.09 1.87 -0.02 10.11 -4.36 -0.89 -1.18 121.20 127.83 1n0t s ILE 115 Ca 0.02 -2.25 -0.27 0.00 -0.26 0.00 0.00 60.65 57.90 1n0t s ILE 115 Cb -0.14 -2.12 -0.04 0.00 1.25 0.00 0.00 42.46 41.41 1n0t s ILE 115 CO 0.01 -0.54 0.84 -0.75 0.24 0.00 0.00 174.94 174.73 1n0t s LYS 116 N -3.62 4.51 -0.02 0.37 2.20 -1.26 -1.38 119.74 120.53 1n0t s LYS 116 Ca 0.24 1.15 -0.38 0.00 -0.36 0.00 0.00 55.97 56.63 1n0t s LYS 116 Cb -0.01 -3.44 -0.16 0.00 -1.51 0.00 0.00 37.83 32.71 1n0t s LYS 116 CO 0.09 0.05 1.48 1.63 -0.36 0.00 0.00 175.35 178.23 1n0t n LYS 117 N 3.67 1.21 0.00 4.03 5.02 -0.10 -1.52 118.16 130.47 1n0t n LYS 117 Ca 0.02 0.44 0.00 0.00 -2.02 0.00 0.00 58.31 56.75 1n0t n LYS 117 Cb 0.51 -2.10 0.00 0.00 -0.02 0.00 0.00 35.03 33.42 1n0t n LYS 117 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1n0t n GLY 118 N 3.07 1.72 3.71 0.72 0.00 -1.26 -5.01 105.19 108.15 1n0t n GLY 118 Ca 0.21 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.80 1n0t n GLY 118 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1n0t n THR 119 N -0.22 0.02 -0.98 2.61 -1.04 -0.58 -4.87 114.28 109.23 1n0t n THR 119 Ca 0.00 -0.00 -0.25 0.00 -2.04 0.00 0.00 64.05 61.75 1n0t n THR 119 Cb 0.00 -1.97 -0.05 0.00 -1.82 0.00 0.00 70.33 66.49 1n0t n THR 119 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 1n0t n PRO 120 N 4.05 2.59 -4.08 -2.82 -0.04 -1.26 -4.81 135.00 128.63 1n0t n PRO 120 Ca 0.16 -1.57 -0.19 0.00 -0.04 0.00 0.00 63.50 61.87 1n0t n PRO 120 Cb 0.35 -2.44 -0.16 0.00 -0.04 0.00 0.00 33.50 31.21 1n0t n PRO 120 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1n0t s ILE 121 N 2.39 0.39 0.00 0.52 -1.09 -1.26 -4.99 121.20 117.15 1n0t s ILE 121 Ca 0.55 -0.04 0.00 0.00 -2.23 0.00 0.00 60.65 58.93 1n0t s ILE 121 Cb 0.17 -0.44 0.00 0.00 -1.58 0.00 0.00 42.46 40.62 1n0t s ILE 121 CO -0.03 0.19 0.16 -0.62 -1.23 0.00 0.00 174.94 173.40 1n0t n GLU 122 N 4.03 3.41 -3.82 2.79 1.02 -1.26 -4.95 120.64 121.86 1n0t n GLU 122 Ca -0.26 -0.16 -0.06 0.00 -0.02 0.00 0.00 57.16 56.67 1n0t n GLU 122 Cb 0.51 -0.61 -0.00 0.00 -0.02 0.00 0.00 31.44 31.32 1n0t n GLU 122 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 1n0t s SER 123 N -0.53 -0.12 0.41 1.62 1.04 -1.26 -2.59 113.70 112.26 1n0t s SER 123 Ca 0.00 -0.69 0.15 0.00 0.48 0.00 0.00 55.95 55.89 1n0t s SER 123 Cb 0.00 0.65 0.87 0.00 0.10 0.00 0.00 66.02 67.63 1n0t s SER 123 CO 0.00 -1.24 1.90 0.00 0.98 0.00 0.00 173.24 174.88 1n0t h ALA 124 N 2.00 1.47 -0.32 5.32 0.00 -1.92 -2.53 119.26 123.27 1n0t h ALA 124 Ca -0.25 -0.27 -0.04 0.00 0.00 0.00 0.00 54.91 54.35 1n0t h ALA 124 Cb 1.24 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.97 1n0t h ALA 124 CO 0.30 0.36 0.03 0.93 0.00 0.00 0.00 179.25 180.88 1n0t h GLU 125 N 0.00 0.55 -0.73 0.00 5.08 -1.95 -1.52 114.58 116.02 1n0t h GLU 125 Ca -0.00 -0.16 0.09 0.00 -1.00 0.00 0.00 59.36 58.28 1n0t h GLU 125 Cb 0.53 -0.06 -0.07 0.00 0.50 0.00 0.00 28.75 29.66 1n0t h GLU 125 CO 0.04 0.66 0.38 -0.44 -1.00 0.00 0.00 179.01 178.65 1n0t h ASP 126 N 0.37 0.53 -0.12 1.42 3.32 -1.85 -2.17 116.42 117.91 1n0t h ASP 126 Ca 0.10 0.05 -0.01 0.00 0.02 0.00 0.00 57.03 57.19 1n0t h ASP 126 Cb 0.39 -0.05 -0.01 0.00 0.22 0.00 0.00 39.33 39.89 1n0t h ASP 126 CO 0.01 0.31 0.05 -0.07 -1.72 0.00 0.00 179.24 177.82 1n0t h LEU 127 N 0.66 0.17 -1.70 1.55 3.38 -1.30 -3.10 115.31 114.97 1n0t h LEU 127 Ca 0.35 -0.16 0.05 0.00 0.09 0.00 0.00 57.88 58.21 1n0t h LEU 127 Cb 0.33 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 41.01 1n0t h LEU 127 CO -0.25 0.29 0.29 0.77 0.09 0.00 0.00 178.44 179.64 1n0t h SER 128 N 0.04 0.33 -0.08 -0.43 4.64 -0.78 -2.38 113.55 114.89 1n0t h SER 128 Ca 0.04 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.36 1n0t h SER 128 Cb 0.17 -0.07 0.00 0.00 -0.31 0.00 0.00 62.40 62.19 1n0t h SER 128 CO -0.00 0.22 0.00 0.29 -0.87 0.00 0.00 176.83 176.47 1n0t n LYS 129 N -4.48 1.33 -4.17 4.77 5.02 -0.86 -4.90 118.16 114.87 1n0t n LYS 129 Ca 0.05 -0.50 -0.12 0.00 -2.02 0.00 0.00 58.31 55.72 1n0t n LYS 129 Cb 0.23 -1.33 -0.09 0.00 -0.02 0.00 0.00 35.03 33.82 1n0t n LYS 129 CO 0.00 0.00 0.00 1.14 -0.52 0.00 0.00 177.40 178.02 1n0t s GLN 130 N -1.90 1.31 0.00 1.97 1.03 -0.90 -5.06 119.66 116.11 1n0t s GLN 130 Ca 0.29 -1.59 0.00 0.00 0.04 0.00 0.00 55.36 54.10 1n0t s GLN 130 Cb 0.14 0.31 0.00 0.00 0.03 0.00 0.00 33.01 33.50 1n0t s GLN 130 CO 0.23 -0.46 0.00 2.41 -2.54 0.00 0.00 175.29 174.93 1n0t n THR 131 N -0.32 0.00 -0.18 3.63 -1.04 -1.26 -4.80 114.28 110.32 1n0t n THR 131 Ca 0.02 -0.07 0.06 0.00 -2.04 0.00 0.00 64.05 62.01 1n0t n THR 131 Cb 0.65 0.54 0.34 0.00 -1.82 0.00 0.00 70.33 70.04 1n0t n THR 131 CO 0.00 0.00 0.00 -0.08 -0.64 0.00 0.00 175.07 174.35 1n0t h GLU 132 N 0.00 0.76 -4.50 -2.82 4.81 -1.97 -3.34 114.58 107.51 1n0t h GLU 132 Ca 0.00 -0.05 -0.72 0.00 -0.13 0.00 0.00 59.36 58.47 1n0t h GLU 132 Cb 0.00 -0.17 -0.24 0.00 0.63 0.00 0.00 28.75 28.97 1n0t h GLU 132 CO 0.00 0.50 -0.46 0.42 -0.73 0.00 0.00 179.01 178.74 1n0t s ILE 133 N -5.69 4.82 0.63 2.32 1.01 -1.26 -4.88 121.20 118.15 1n0t s ILE 133 Ca -0.10 -0.91 -0.15 0.00 0.00 0.00 0.00 60.65 59.50 1n0t s ILE 133 Cb 0.19 -3.75 -0.02 0.00 0.01 0.00 0.00 42.46 38.89 1n0t s ILE 133 CO 0.77 -0.34 1.07 0.00 0.00 0.00 0.00 174.94 176.44 1n0t s ALA 134 N 1.58 2.65 -0.15 9.38 0.00 -0.12 -4.82 121.76 130.29 1n0t s ALA 134 Ca 0.03 0.37 -0.16 0.00 0.00 0.00 0.00 51.96 52.20 1n0t s ALA 134 Cb -0.20 -3.24 0.04 0.00 0.00 0.00 0.00 23.12 19.72 1n0t s ALA 134 CO 0.07 -1.01 0.44 1.52 0.00 0.00 0.00 175.76 176.78 1n0t s TYR 135 N -2.54 -0.46 0.00 0.00 -0.85 -1.26 0.33 117.35 112.56 1n0t s TYR 135 Ca 0.63 1.10 0.00 0.00 -0.52 0.00 0.00 57.07 58.28 1n0t s TYR 135 Cb -0.17 0.17 0.00 0.00 0.38 0.00 0.00 41.96 42.34 1n0t s TYR 135 CO 0.41 -0.26 0.00 0.41 -1.52 0.00 0.00 175.55 174.59 1n0t n GLY 136 N 2.63 3.47 1.96 5.49 0.00 -0.88 -4.76 105.19 113.09 1n0t n GLY 136 Ca -0.14 -1.18 -0.09 0.00 0.00 0.00 0.00 46.02 44.60 1n0t n GLY 136 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1n0t n THR 137 N 0.00 0.00 -2.05 2.61 -2.24 -1.22 -1.25 114.28 110.13 1n0t n THR 137 Ca 0.00 -1.11 -0.35 0.00 -2.27 0.00 0.00 64.05 60.32 1n0t n THR 137 Cb 0.00 0.66 0.03 0.00 -2.10 0.00 0.00 70.33 68.91 1n0t n THR 137 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1n0t s LEU 138 N 0.00 3.65 0.00 3.22 1.43 -1.26 -1.75 118.68 123.96 1n0t s LEU 138 Ca 0.18 2.25 0.05 0.00 -1.03 0.00 0.00 54.13 55.59 1n0t s LEU 138 Cb -0.00 -4.59 0.30 0.00 0.03 0.00 0.00 46.19 41.93 1n0t s LEU 138 CO 0.13 -1.49 0.84 -0.90 0.23 0.00 0.00 176.35 175.17 1n0t n ASP 139 N -1.64 0.00 -3.58 2.29 3.85 0.31 -4.60 116.55 113.18 1n0t n ASP 139 Ca 0.12 -1.03 -0.08 0.00 -0.71 0.00 0.00 54.79 53.10 1n0t n ASP 139 Cb 0.50 0.00 -0.04 0.00 -1.35 0.00 0.00 41.12 40.23 1n0t n ASP 139 CO 0.00 0.00 0.00 -0.94 -1.01 0.00 0.00 177.20 175.25 1n0t s SER 140 N -1.56 -0.26 0.00 -1.12 1.04 -1.26 -5.08 113.70 105.45 1n0t s SER 140 Ca 0.08 0.21 0.00 0.00 0.48 0.00 0.00 55.95 56.72 1n0t s SER 140 Cb 0.03 0.23 0.00 0.00 0.10 0.00 0.00 66.02 66.39 1n0t s SER 140 CO 0.06 -0.30 0.00 0.61 0.98 0.00 0.00 173.24 174.59 1n0t n GLY 141 N 0.42 1.47 0.25 7.32 0.00 -1.26 -4.76 105.19 108.63 1n0t n GLY 141 Ca -0.06 -2.13 0.02 0.00 0.00 0.00 0.00 46.02 43.84 1n0t n GLY 141 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1n0t h SER 142 N 0.00 0.29 0.27 1.61 4.64 -1.98 -1.33 113.55 117.05 1n0t h SER 142 Ca 0.00 -0.06 -0.01 0.00 -0.47 0.00 0.00 61.79 61.25 1n0t h SER 142 Cb 0.00 -0.07 0.00 0.00 -0.31 0.00 0.00 62.40 62.02 1n0t h SER 142 CO 0.00 0.42 -0.13 0.74 -0.87 0.00 0.00 176.83 176.99 1n0t h THR 143 N 0.29 0.77 -0.39 2.95 2.02 -1.95 0.13 112.91 116.74 1n0t h THR 143 Ca 0.06 -0.34 0.02 0.00 0.77 0.00 0.00 66.41 66.91 1n0t h THR 143 Cb 0.35 0.97 -0.02 0.00 -1.74 0.00 0.00 68.15 67.71 1n0t h THR 143 CO 0.02 0.07 0.23 0.50 0.37 0.00 0.00 175.52 176.71 1n0t h LYS 144 N -0.54 0.45 -0.17 6.66 3.64 -1.78 -1.89 116.57 122.95 1n0t h LYS 144 Ca -0.04 -0.03 -0.03 0.00 -1.27 0.00 0.00 60.65 59.29 1n0t h LYS 144 Cb 0.40 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 32.11 1n0t h LYS 144 CO 0.06 0.30 -0.02 0.93 -2.27 0.00 0.00 179.45 178.45 1n0t h GLU 145 N 0.47 0.24 0.73 1.90 4.39 -1.16 -0.30 114.58 120.86 1n0t h GLU 145 Ca 0.15 -0.04 -0.03 0.00 0.34 0.00 0.00 59.36 59.78 1n0t h GLU 145 Cb -0.00 -0.04 0.00 0.00 -0.10 0.00 0.00 28.75 28.61 1n0t h GLU 145 CO -0.07 0.29 -0.39 0.35 -1.16 0.00 0.00 179.01 178.03 1n0t h PHE 146 N 0.24 -1.02 -0.61 4.33 3.57 0.09 -1.42 116.94 122.11 1n0t h PHE 146 Ca 0.06 -0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.53 1n0t h PHE 146 Cb 0.21 0.35 -0.03 0.00 2.79 0.00 0.00 35.95 39.27 1n0t h PHE 146 CO 0.00 -0.61 0.35 0.74 -2.23 0.00 0.00 178.31 176.56 1n0t h PHE 147 N -1.04 0.83 -0.52 0.41 0.04 -1.26 0.30 116.94 115.70 1n0t h PHE 147 Ca -0.10 -0.01 0.14 0.00 2.80 0.00 0.00 57.97 60.80 1n0t h PHE 147 Cb 0.81 -0.27 -0.02 0.00 2.20 0.00 0.00 35.95 38.67 1n0t h PHE 147 CO -0.05 0.59 0.37 -0.09 -0.60 0.00 0.00 178.31 178.52 1n0t h ARG 148 N 0.83 0.04 0.00 1.51 2.43 -0.91 -2.93 114.38 115.35 1n0t h ARG 148 Ca 0.22 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.38 1n0t h ARG 148 Cb 0.02 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.56 1n0t h ARG 148 CO -0.04 0.03 -1.51 0.54 -1.51 0.00 0.00 179.97 177.48 1n0t n ARG 149 N -4.40 0.56 -1.63 0.20 1.74 -0.55 -5.01 116.66 107.57 1n0t n ARG 149 Ca 0.09 -0.11 -0.49 0.00 -0.77 0.00 0.00 57.85 56.57 1n0t n ARG 149 Cb 0.56 -1.29 -0.05 0.00 -1.02 0.00 0.00 32.46 30.67 1n0t n ARG 149 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 1n0t n SER 150 N -1.90 2.30 -1.24 0.55 2.88 0.10 -4.84 113.62 111.47 1n0t n SER 150 Ca -0.02 1.11 0.10 0.00 -1.33 0.00 0.00 58.87 58.72 1n0t n SER 150 Cb 0.32 -1.30 0.29 0.00 -0.75 0.00 0.00 64.21 62.77 1n0t n SER 150 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 1n0t n LYS 151 N 2.86 2.67 -3.03 -1.46 5.02 -1.26 -4.24 118.16 118.73 1n0t n LYS 151 Ca 0.17 -2.36 -0.40 0.00 -2.02 0.00 0.00 58.31 53.70 1n0t n LYS 151 Cb 0.24 -1.56 -0.05 0.00 -0.02 0.00 0.00 35.03 33.64 1n0t n LYS 151 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1n0t s ILE 152 N -1.27 4.99 0.18 -0.18 -1.09 -1.26 -4.93 121.20 117.65 1n0t s ILE 152 Ca 0.44 1.40 -0.22 0.00 -2.23 0.00 0.00 60.65 60.04 1n0t s ILE 152 Cb 0.24 -4.03 0.11 0.00 -1.58 0.00 0.00 42.46 37.19 1n0t s ILE 152 CO 0.28 0.13 1.58 0.00 -1.23 0.00 0.00 174.94 175.70 1n0t h ALA 153 N 7.19 -0.12 -0.74 9.38 0.00 -1.97 0.76 119.26 133.76 1n0t h ALA 153 Ca -0.34 0.16 0.07 0.00 0.00 0.00 0.00 54.91 54.80 1n0t h ALA 153 Cb 1.16 0.86 -0.05 0.00 0.00 0.00 0.00 17.79 19.76 1n0t h ALA 153 CO 0.79 -0.72 0.49 0.28 0.00 0.00 0.00 179.25 180.08 1n0t h VAL 154 N -0.17 1.01 0.16 0.00 2.07 -1.99 0.17 116.25 117.50 1n0t h VAL 154 Ca 0.23 -0.26 -0.28 0.00 0.82 0.00 0.00 66.70 67.20 1n0t h VAL 154 Cb 0.56 0.18 0.01 0.00 -1.52 0.00 0.00 31.29 30.52 1n0t h VAL 154 CO -0.71 0.14 -1.37 -0.26 0.02 0.00 0.00 177.57 175.39 1n0t h PHE 155 N 0.76 0.60 -0.36 1.57 0.04 -1.38 -2.97 116.94 115.21 1n0t h PHE 155 Ca 0.32 -0.44 -0.06 0.00 2.80 0.00 0.00 57.97 60.60 1n0t h PHE 155 Cb 0.28 -0.02 -0.02 0.00 2.20 0.00 0.00 35.95 38.39 1n0t h PHE 155 CO -0.00 1.53 -0.02 0.22 -0.60 0.00 0.00 178.31 179.44 1n0t h ASP 156 N -0.17 0.54 -0.36 2.17 3.58 0.60 0.57 116.42 123.35 1n0t h ASP 156 Ca -0.27 -0.11 -0.02 0.00 0.42 0.00 0.00 57.03 57.05 1n0t h ASP 156 Cb 1.87 -0.14 -0.02 0.00 1.72 0.00 0.00 39.33 42.76 1n0t h ASP 156 CO 0.14 0.63 0.16 0.50 -2.88 0.00 0.00 179.24 177.78 1n0t h LYS 157 N 0.55 0.53 -0.56 0.28 3.64 -0.77 -0.58 116.57 119.66 1n0t h LYS 157 Ca 0.11 -0.08 -0.03 0.00 -1.27 0.00 0.00 60.65 59.38 1n0t h LYS 157 Cb 0.37 -0.09 -0.03 0.00 -0.41 0.00 0.00 32.23 32.08 1n0t h LYS 157 CO 0.01 0.49 0.22 0.52 -2.27 0.00 0.00 179.45 178.42 1n0t h MET 158 N 0.44 0.81 0.42 1.90 2.86 -1.19 -1.95 114.93 118.22 1n0t h MET 158 Ca 0.12 -0.12 -0.02 0.00 -2.06 0.00 0.00 59.70 57.62 1n0t h MET 158 Cb 0.14 -0.14 0.00 0.00 0.06 0.00 0.00 31.60 31.66 1n0t h MET 158 CO -0.01 0.67 -0.20 2.35 1.06 0.00 0.00 176.91 180.77 1n0t h TRP 159 N 0.80 -0.52 -0.71 -0.22 -0.00 -0.29 -0.37 115.95 114.64 1n0t h TRP 159 Ca 0.19 -0.01 0.13 0.00 -0.00 0.00 0.00 58.89 59.20 1n0t h TRP 159 Cb 0.16 0.17 -0.09 0.00 -0.00 0.00 0.00 29.16 29.40 1n0t h TRP 159 CO 0.01 -0.22 0.24 1.79 -0.00 0.00 0.00 178.44 180.26 1n0t h THR 160 N -0.78 0.65 0.35 2.65 1.35 -0.98 -0.39 112.91 115.75 1n0t h THR 160 Ca -0.06 -0.13 -0.01 0.00 -0.55 0.00 0.00 66.41 65.66 1n0t h THR 160 Cb 0.53 0.23 -0.01 0.00 -1.73 0.00 0.00 68.15 67.18 1n0t h THR 160 CO 0.09 0.07 -0.27 0.22 -0.25 0.00 0.00 175.52 175.38 1n0t h TYR 161 N 0.38 -0.73 -0.96 4.73 3.20 -1.20 -1.65 116.97 120.74 1n0t h TYR 161 Ca 0.38 -0.00 0.30 0.00 3.14 0.00 0.00 58.73 62.56 1n0t h TYR 161 Cb 0.58 0.27 -0.15 0.00 1.54 0.00 0.00 36.73 38.97 1n0t h TYR 161 CO -0.20 -0.38 0.43 0.52 -1.64 0.00 0.00 178.16 176.89 1n0t h MET 162 N -0.59 0.22 -0.04 1.82 2.86 -0.39 0.22 114.93 119.02 1n0t h MET 162 Ca -0.05 -0.01 -0.16 0.00 -2.06 0.00 0.00 59.70 57.42 1n0t h MET 162 Cb 0.49 -0.05 -0.01 0.00 0.06 0.00 0.00 31.60 32.09 1n0t h MET 162 CO 0.01 0.15 -0.68 -0.09 1.06 0.00 0.00 176.91 177.36 1n0t h ARG 163 N 0.23 0.19 -0.14 1.72 9.65 -0.89 -3.19 114.38 121.96 1n0t h ARG 163 Ca 0.68 -0.15 0.00 0.00 -1.10 0.00 0.00 59.98 59.41 1n0t h ARG 163 Cb 1.54 0.03 0.00 0.00 -1.39 0.00 0.00 29.97 30.15 1n0t h ARG 163 CO -0.66 0.80 0.00 -1.13 2.80 0.00 0.00 179.97 181.77 1n0t n SER 164 N -3.80 2.82 -4.78 -3.80 3.41 0.09 -4.97 113.62 102.59 1n0t n SER 164 Ca -0.02 -1.91 -0.37 0.00 -0.26 0.00 0.00 58.87 56.31 1n0t n SER 164 Cb 0.67 -0.08 -0.04 0.00 -0.26 0.00 0.00 64.21 64.50 1n0t n SER 164 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1n0t s ALA 165 N -1.85 3.09 -0.02 7.33 0.00 0.54 -5.05 121.76 125.79 1n0t s ALA 165 Ca 0.33 0.72 -0.00 0.00 0.00 0.00 0.00 51.96 53.01 1n0t s ALA 165 Cb 0.21 -3.28 0.03 0.00 0.00 0.00 0.00 23.12 20.08 1n0t s ALA 165 CO 0.31 -0.24 0.03 -1.21 0.00 0.00 0.00 175.76 174.65 1n0t s GLU 166 N -2.49 -0.03 1.31 0.00 2.02 -1.26 -4.16 118.70 114.09 1n0t s GLU 166 Ca 0.58 0.19 -0.21 0.00 0.02 0.00 0.00 54.97 55.55 1n0t s GLU 166 Cb -0.23 -0.24 0.33 0.00 0.10 0.00 0.00 34.13 34.09 1n0t s GLU 166 CO 0.28 -0.16 1.03 -2.14 0.02 0.00 0.00 175.26 174.29 1n0t s PRO 167 N 1.05 -2.10 0.37 0.39 0.02 -1.26 -5.06 135.00 128.41 1n0t s PRO 167 Ca -0.09 0.00 -0.28 0.00 0.02 0.00 0.00 61.00 60.65 1n0t s PRO 167 Cb -0.13 -1.49 -0.11 0.00 0.02 0.00 0.00 34.50 32.80 1n0t s PRO 167 CO -0.03 -4.31 1.46 0.45 -0.33 0.00 0.00 177.00 174.24 1n0t n SER 168 N -5.20 3.62 -0.97 2.53 2.88 -1.26 -4.89 113.62 110.33 1n0t n SER 168 Ca 0.13 1.22 0.12 0.00 -1.33 0.00 0.00 58.87 59.02 1n0t n SER 168 Cb 0.60 -1.60 0.22 0.00 -0.75 0.00 0.00 64.21 62.68 1n0t n SER 168 CO 0.00 0.00 0.00 1.33 -1.23 0.00 0.00 175.04 175.14 1n0t n VAL 169 N 0.45 0.26 -3.63 2.46 0.24 -1.26 -4.94 118.33 111.90 1n0t n VAL 169 Ca 0.02 -0.58 -0.32 0.00 -2.04 0.00 0.00 64.34 61.42 1n0t n VAL 169 Cb 0.38 1.04 -0.05 0.00 -1.47 0.00 0.00 33.84 33.75 1n0t n VAL 169 CO 0.00 0.00 0.00 -0.36 -2.14 0.00 0.00 176.83 174.33 1n0t s PHE 170 N -1.74 3.50 0.19 6.34 0.08 -1.26 -3.38 117.98 121.71 1n0t s PHE 170 Ca 0.34 0.64 0.09 0.00 0.12 0.00 0.00 56.93 58.12 1n0t s PHE 170 Cb 0.21 -2.07 -0.04 0.00 -0.57 0.00 0.00 43.02 40.55 1n0t s PHE 170 CO 0.31 0.44 -0.17 0.14 -0.10 0.00 0.00 175.22 175.83 1n0t s VAL 171 N -1.61 1.89 0.00 -0.44 -7.23 -0.72 -4.90 120.40 107.40 1n0t s VAL 171 Ca 0.39 -2.07 0.08 0.00 -1.81 0.00 0.00 61.98 58.58 1n0t s VAL 171 Cb -0.12 -1.97 -0.23 0.00 0.56 0.00 0.00 36.38 34.62 1n0t s VAL 171 CO 0.22 -0.41 0.84 0.08 -0.31 0.00 0.00 175.10 175.53 1n0t h ARG 172 N 2.92 0.04 -5.09 4.82 -0.00 -1.95 0.89 114.38 116.00 1n0t h ARG 172 Ca -0.41 -0.07 -0.38 0.00 -0.00 0.00 0.00 59.98 59.13 1n0t h ARG 172 Cb 1.22 0.03 -0.14 0.00 -0.00 0.00 0.00 29.97 31.07 1n0t h ARG 172 CO 0.55 0.73 -0.66 0.95 -0.00 0.00 0.00 179.97 181.54 1n0t s THR 173 N -2.63 1.06 0.09 0.08 -4.23 -1.26 -4.74 115.64 104.02 1n0t s THR 173 Ca -0.04 -2.04 -0.20 0.00 -1.18 0.00 0.00 61.69 58.23 1n0t s THR 173 Cb 0.08 -2.29 -0.09 0.00 1.34 0.00 0.00 72.50 71.54 1n0t s THR 173 CO 0.82 -0.37 1.64 0.74 -0.54 0.00 0.00 174.62 176.91 1n0t h THR 174 N 2.50 1.16 -0.78 3.99 2.02 -2.00 -2.26 112.91 117.53 1n0t h THR 174 Ca -0.38 -0.47 0.13 0.00 0.77 0.00 0.00 66.41 66.45 1n0t h THR 174 Cb 1.22 1.12 -0.05 0.00 -1.74 0.00 0.00 68.15 68.69 1n0t h THR 174 CO 0.64 0.15 0.52 0.00 0.37 0.00 0.00 175.52 177.20 1n0t h ALA 175 N 0.92 1.95 -0.34 6.16 0.00 -1.99 -1.25 119.26 124.72 1n0t h ALA 175 Ca 0.06 0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.87 1n0t h ALA 175 Cb 0.17 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1n0t h ALA 175 CO -0.01 -0.15 -0.18 1.49 0.00 0.00 0.00 179.25 180.40 1n0t h GLU 176 N 0.56 0.72 -0.14 0.00 4.81 -1.85 -1.14 114.58 117.54 1n0t h GLU 176 Ca 0.38 -0.32 -0.01 0.00 -0.13 0.00 0.00 59.36 59.28 1n0t h GLU 176 Cb 0.69 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 30.05 1n0t h GLU 176 CO -0.14 0.93 0.06 0.78 -0.73 0.00 0.00 179.01 179.91 1n0t h GLY 177 N 0.50 0.23 1.15 1.92 0.00 -0.73 0.99 103.07 107.13 1n0t h GLY 177 Ca 0.07 -0.13 -0.01 0.00 0.00 0.00 0.00 47.33 47.26 1n0t h GLY 177 CO 0.05 0.12 0.45 -2.08 0.00 0.00 0.00 176.54 175.09 1n0t h VAL 178 N 0.08 1.23 -0.15 4.60 2.07 -1.26 -1.48 116.25 121.34 1n0t h VAL 178 Ca 0.05 -0.57 -0.20 0.00 0.82 0.00 0.00 66.70 66.80 1n0t h VAL 178 Cb 0.17 0.13 0.00 0.00 -1.52 0.00 0.00 31.29 30.07 1n0t h VAL 178 CO -0.00 0.26 -0.71 0.00 0.02 0.00 0.00 177.57 177.14 1n0t h ALA 179 N 1.37 0.47 -0.22 1.67 0.00 -1.05 -2.38 119.26 119.13 1n0t h ALA 179 Ca 0.29 -0.58 -0.03 0.00 0.00 0.00 0.00 54.91 54.59 1n0t h ALA 179 Cb 0.01 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 1n0t h ALA 179 CO -0.05 0.71 0.01 -0.09 0.00 0.00 0.00 179.25 179.83 1n0t h ARG 180 N 0.46 0.31 -0.04 0.00 2.43 -0.34 0.29 114.38 117.50 1n0t h ARG 180 Ca -0.03 -0.05 -0.02 0.00 -0.81 0.00 0.00 59.98 59.07 1n0t h ARG 180 Cb 1.30 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 30.80 1n0t h ARG 180 CO 0.14 0.33 -0.07 0.28 -1.51 0.00 0.00 179.97 179.14 1n0t h VAL 181 N 0.31 1.43 0.00 0.20 2.07 -1.15 -1.85 116.25 117.26 1n0t h VAL 181 Ca 0.07 -1.39 -0.03 0.00 0.82 0.00 0.00 66.70 66.17 1n0t h VAL 181 Cb 0.20 2.27 -0.00 0.00 -1.52 0.00 0.00 31.29 32.24 1n0t h VAL 181 CO 0.00 0.38 -0.14 0.03 0.02 0.00 0.00 177.57 177.86 1n0t h ARG 182 N -0.41 0.00 -0.01 1.57 3.08 -1.01 -3.13 114.38 114.48 1n0t h ARG 182 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1n0t h ARG 182 Cb 0.65 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.70 1n0t h ARG 182 CO 0.02 0.14 -0.50 1.63 -1.07 0.00 0.00 179.97 180.19 1n0t n LYS 183 N -3.59 1.58 -0.12 0.04 5.02 0.05 -4.45 118.16 116.70 1n0t n LYS 183 Ca -0.01 -0.57 0.03 0.00 -2.02 0.00 0.00 58.31 55.74 1n0t n LYS 183 Cb 0.27 -1.30 0.10 0.00 -0.02 0.00 0.00 35.03 34.08 1n0t n LYS 183 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 1n0t n SER 184 N -0.53 1.20 -4.08 4.39 7.64 -0.70 -4.92 113.62 116.63 1n0t n SER 184 Ca 0.06 -2.01 -0.30 0.00 1.01 0.00 0.00 58.87 57.63 1n0t n SER 184 Cb 0.33 -0.16 -0.03 0.00 -1.01 0.00 0.00 64.21 63.34 1n0t n SER 184 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1n0t n LYS 185 N 0.13 -3.06 -0.97 1.43 5.02 -1.26 -1.23 118.16 118.22 1n0t n LYS 185 Ca 0.07 0.37 0.00 0.00 -2.02 0.00 0.00 58.31 56.73 1n0t n LYS 185 Cb 0.19 -4.64 0.00 0.00 -0.02 0.00 0.00 35.03 30.57 1n0t n LYS 185 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1n0t n GLY 186 N -1.85 0.71 1.25 0.72 0.00 -1.26 -4.91 105.19 99.85 1n0t n GLY 186 Ca -0.18 0.00 0.11 0.00 0.00 0.00 0.00 46.02 45.95 1n0t n GLY 186 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1n0t n LYS 187 N -2.56 2.67 -3.77 1.61 4.76 -0.36 -4.87 118.16 115.64 1n0t n LYS 187 Ca 0.00 -2.52 -0.14 0.00 -2.87 0.00 0.00 58.31 52.77 1n0t n LYS 187 Cb 0.00 -1.53 -0.15 0.00 -1.84 0.00 0.00 35.03 31.50 1n0t n LYS 187 CO 0.00 0.00 0.00 -0.47 -1.37 0.00 0.00 177.40 175.56 1n0t s TYR 188 N -1.12 -0.04 -0.01 2.13 5.04 -1.25 -0.94 117.35 121.15 1n0t s TYR 188 Ca 0.45 0.26 0.05 0.00 -2.44 0.00 0.00 57.07 55.38 1n0t s TYR 188 Cb 0.24 -0.17 -0.03 0.00 0.35 0.00 0.00 41.96 42.35 1n0t s TYR 188 CO 0.32 -0.11 -0.15 0.00 -1.34 0.00 0.00 175.55 174.27 1n0t s ALA 189 N 1.04 2.68 -0.09 3.97 0.00 0.15 -4.54 121.76 124.97 1n0t s ALA 189 Ca -0.08 -1.06 0.04 0.00 0.00 0.00 0.00 51.96 50.85 1n0t s ALA 189 Cb -0.12 -0.90 -0.01 0.00 0.00 0.00 0.00 23.12 22.09 1n0t s ALA 189 CO -0.04 0.57 -0.21 -0.47 0.00 0.00 0.00 175.76 175.61 1n0t s TYR 190 N -0.83 2.59 -0.23 0.00 5.04 -0.32 -2.08 117.35 121.52 1n0t s TYR 190 Ca 0.13 -0.82 -0.17 0.00 -2.44 0.00 0.00 57.07 53.78 1n0t s TYR 190 Cb -0.11 -1.70 -0.03 0.00 0.35 0.00 0.00 41.96 40.47 1n0t s TYR 190 CO 0.03 -0.28 0.44 -0.51 -1.34 0.00 0.00 175.55 173.89 1n0t s LEU 191 N 0.14 4.11 0.29 6.97 2.01 -0.38 -0.41 118.68 131.41 1n0t s LEU 191 Ca -0.11 0.51 -0.13 0.00 0.01 0.00 0.00 54.13 54.41 1n0t s LEU 191 Cb -0.16 -2.57 0.01 0.00 0.01 0.00 0.00 46.19 43.48 1n0t s LEU 191 CO 0.06 -0.16 0.57 -1.48 1.01 0.00 0.00 176.35 176.35 1n0t s LEU 192 N 1.73 0.26 0.14 1.79 2.34 -0.29 -4.62 118.68 120.04 1n0t s LEU 192 Ca 0.20 -0.98 -0.32 0.00 0.06 0.00 0.00 54.13 53.09 1n0t s LEU 192 Cb -0.15 2.08 -0.12 0.00 -0.56 0.00 0.00 46.19 47.44 1n0t s LEU 192 CO 0.09 -1.29 1.77 -0.62 -1.06 0.00 0.00 176.35 175.24 1n0t n GLU 193 N -0.45 2.67 -0.35 1.48 1.02 -1.26 0.10 120.64 123.85 1n0t n GLU 193 Ca -0.03 0.97 0.17 0.00 -0.02 0.00 0.00 57.16 58.25 1n0t n GLU 193 Cb 0.61 -2.83 0.38 0.00 -0.02 0.00 0.00 31.44 29.58 1n0t n GLU 193 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 1n0t h SER 194 N 7.73 0.68 -0.54 1.62 4.64 -0.53 -1.82 113.55 125.33 1n0t h SER 194 Ca -0.45 0.13 0.07 0.00 -0.47 0.00 0.00 61.79 61.07 1n0t h SER 194 Cb 1.22 0.02 -0.06 0.00 -0.31 0.00 0.00 62.40 63.28 1n0t h SER 194 CO 0.94 0.13 0.22 0.71 -0.87 0.00 0.00 176.83 177.96 1n0t h THR 195 N 0.60 0.85 -0.28 2.95 1.35 -1.90 0.16 112.91 116.64 1n0t h THR 195 Ca 0.64 -0.14 -0.14 0.00 -0.55 0.00 0.00 66.41 66.21 1n0t h THR 195 Cb 1.19 0.39 -0.01 0.00 -1.73 0.00 0.00 68.15 68.00 1n0t h THR 195 CO -0.46 0.08 -0.40 -0.03 -0.25 0.00 0.00 175.52 174.46 1n0t h MET 196 N 0.42 0.67 0.13 4.72 -1.53 -1.72 -1.58 114.93 116.03 1n0t h MET 196 Ca 0.26 -0.35 -0.01 0.00 -3.44 0.00 0.00 59.70 56.16 1n0t h MET 196 Cb 0.26 0.01 0.00 0.00 -0.55 0.00 0.00 31.60 31.32 1n0t h MET 196 CO -0.24 0.95 -0.06 -0.97 0.14 0.00 0.00 176.91 176.74 1n0t h ASN 197 N 0.55 -0.14 -0.36 1.39 -0.73 -0.91 -0.76 115.58 114.62 1n0t h ASN 197 Ca 0.05 -0.06 -0.02 0.00 1.87 0.00 0.00 56.30 58.14 1n0t h ASN 197 Cb 0.93 0.04 -0.02 0.00 0.27 0.00 0.00 38.32 39.54 1n0t h ASN 197 CO 0.08 -0.04 0.18 -0.33 -0.37 0.00 0.00 177.43 176.95 1n0t h GLU 198 N -0.24 0.56 -0.11 6.67 5.08 -0.66 -2.03 114.58 123.86 1n0t h GLU 198 Ca -0.02 -0.07 -0.04 0.00 -1.00 0.00 0.00 59.36 58.24 1n0t h GLU 198 Cb 0.19 -0.11 -0.00 0.00 0.50 0.00 0.00 28.75 29.33 1n0t h GLU 198 CO 0.03 0.46 -0.09 -0.92 -1.00 0.00 0.00 179.01 177.48 1n0t h TYR 199 N 0.56 0.30 -0.32 4.33 3.20 -0.99 -3.19 116.97 120.86 1n0t h TYR 199 Ca 0.14 -0.09 -0.04 0.00 3.14 0.00 0.00 58.73 61.88 1n0t h TYR 199 Cb 0.09 -0.06 -0.02 0.00 1.54 0.00 0.00 36.73 38.28 1n0t h TYR 199 CO 0.00 0.66 0.03 0.82 -1.64 0.00 0.00 178.16 178.03 1n0t h ILE 200 N -0.14 1.18 0.00 1.81 1.08 -0.92 -1.78 117.51 118.73 1n0t h ILE 200 Ca 0.02 -0.68 -0.00 0.00 -0.39 0.00 0.00 64.86 63.81 1n0t h ILE 200 Cb 0.60 0.90 -0.00 0.00 -3.07 0.00 0.00 36.82 35.25 1n0t h ILE 200 CO 0.02 0.24 -0.02 -0.08 -0.69 0.00 0.00 178.15 177.62 1n0t h GLU 201 N 0.47 0.00 -0.65 2.37 4.81 -1.36 -1.27 114.58 118.96 1n0t h GLU 201 Ca 0.11 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.34 1n0t h GLU 201 Cb 0.27 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.65 1n0t h GLU 201 CO 0.00 0.02 0.00 1.04 -0.73 0.00 0.00 179.01 179.34 1n0t n GLN 202 N -3.31 3.40 -4.66 1.92 1.13 -0.67 -4.79 117.38 110.40 1n0t n GLN 202 Ca -0.02 -2.79 -0.30 0.00 -1.94 0.00 0.00 57.00 51.95 1n0t n GLN 202 Cb 0.13 -1.77 -0.13 0.00 0.11 0.00 0.00 30.24 28.58 1n0t n GLN 202 CO 0.00 0.00 0.00 1.03 -1.44 0.00 0.00 177.06 176.65 1n0t s ARG 203 N -1.60 1.87 0.73 -1.09 1.81 -0.48 -0.19 118.95 120.00 1n0t s ARG 203 Ca 0.49 -1.09 -0.14 0.00 -1.72 0.00 0.00 55.73 53.26 1n0t s ARG 203 Cb 0.30 -2.08 0.04 0.00 -0.45 0.00 0.00 34.95 32.76 1n0t s ARG 203 CO 0.26 0.51 1.18 0.15 -0.68 0.00 0.00 175.30 176.72 1n0t s LYS 204 N -1.54 2.18 0.00 3.54 1.02 -1.26 -0.66 119.74 123.02 1n0t s LYS 204 Ca 0.14 1.65 0.00 0.00 0.02 0.00 0.00 55.97 57.78 1n0t s LYS 204 Cb -0.10 -1.85 0.00 0.00 -0.52 0.00 0.00 37.83 35.36 1n0t s LYS 204 CO 0.05 -1.78 0.47 -0.35 -0.92 0.00 0.00 175.35 172.82 1n0t n PRO 205 N -2.81 0.79 -3.83 -1.68 -0.04 -1.26 -4.94 135.00 121.22 1n0t n PRO 205 Ca 0.13 0.00 -0.25 0.00 -0.04 0.00 0.00 63.50 63.33 1n0t n PRO 205 Cb 0.51 -1.31 0.01 0.00 -0.04 0.00 0.00 33.50 32.66 1n0t n PRO 205 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1n0t n ASP 207 N -2.95 2.34 -4.33 0.00 5.68 -1.26 -4.99 116.55 111.05 1n0t n ASP 207 Ca -0.27 -2.10 -0.17 0.00 -0.50 0.00 0.00 54.79 51.75 1n0t n ASP 207 Cb 0.67 -0.11 -0.10 0.00 -1.14 0.00 0.00 41.12 40.44 1n0t n ASP 207 CO 0.00 0.00 0.00 0.42 -1.33 0.00 0.00 177.20 176.29 1n0t s THR 208 N -1.17 1.44 -0.03 2.12 -4.23 -1.26 -0.92 115.64 111.59 1n0t s THR 208 Ca 0.10 -2.12 -0.27 0.00 -1.18 0.00 0.00 61.69 58.21 1n0t s THR 208 Cb 0.06 -2.11 0.06 0.00 1.34 0.00 0.00 72.50 71.86 1n0t s THR 208 CO 0.05 -0.54 0.60 0.00 -0.54 0.00 0.00 174.62 174.19 1n0t s MET 209 N -3.73 1.01 0.05 3.99 0.23 -0.48 -4.59 119.30 115.78 1n0t s MET 209 Ca 0.23 0.11 -0.22 0.00 -1.03 0.00 0.00 55.69 54.78 1n0t s MET 209 Cb 0.02 0.47 -0.06 0.00 -1.53 0.00 0.00 34.83 33.73 1n0t s MET 209 CO 0.06 -0.32 0.66 0.21 -2.03 0.00 0.00 175.02 173.60 1n0t s LYS 210 N -1.45 4.38 0.03 3.16 2.20 -1.26 -2.10 119.74 124.69 1n0t s LYS 210 Ca -0.10 0.88 0.02 0.00 -0.36 0.00 0.00 55.97 56.40 1n0t s LYS 210 Cb -0.01 -3.32 -0.02 0.00 -1.51 0.00 0.00 37.83 32.98 1n0t s LYS 210 CO 0.07 0.43 -0.06 0.14 -0.36 0.00 0.00 175.35 175.57 1n0t s VAL 211 N -0.48 0.44 0.02 4.02 -7.23 -0.94 -5.02 120.40 111.21 1n0t s VAL 211 Ca 0.33 -0.82 0.00 0.00 -1.81 0.00 0.00 61.98 59.68 1n0t s VAL 211 Cb -0.20 -0.48 0.00 0.00 0.56 0.00 0.00 36.38 36.26 1n0t s VAL 211 CO 0.20 -0.27 0.00 0.61 -0.31 0.00 0.00 175.10 175.33 1n0t n GLY 212 N 1.88 -2.06 3.93 2.32 0.00 -1.07 -4.04 105.19 106.16 1n0t n GLY 212 Ca -0.20 -1.48 -0.28 0.00 0.00 0.00 0.00 46.02 44.05 1n0t n GLY 212 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1n0t s GLY 213 N -4.94 1.73 0.52 -0.02 0.00 -1.26 -4.87 107.32 98.49 1n0t s GLY 213 Ca 0.00 -1.14 -0.19 0.00 0.00 0.00 0.00 44.72 43.38 1n0t s GLY 213 CO 0.00 -0.50 1.07 -1.31 0.00 0.00 0.00 173.10 172.36 1n0t s ASN 214 N -4.77 6.04 0.25 1.64 0.01 -1.26 -4.78 114.94 112.07 1n0t s ASN 214 Ca 0.69 1.98 0.20 0.00 -0.71 0.00 0.00 52.86 55.02 1n0t s ASN 214 Cb -0.06 -2.56 0.07 0.00 0.41 0.00 0.00 41.25 39.11 1n0t s ASN 214 CO 0.50 -0.99 1.22 -0.07 -1.51 0.00 0.00 177.10 176.25 1n0t h LEU 215 N 1.24 0.00 0.00 0.60 4.07 -0.82 -3.48 115.31 116.93 1n0t h LEU 215 Ca -0.49 0.00 -0.16 0.00 0.08 0.00 0.00 57.88 57.31 1n0t h LEU 215 Cb 1.23 0.00 -0.04 0.00 1.08 0.00 0.00 40.66 42.94 1n0t h LEU 215 CO 0.58 0.22 -0.08 -0.90 -1.08 0.00 0.00 178.44 177.18 1n0t n ASP 216 N -2.94 -0.79 -3.79 -0.43 5.75 -1.26 -4.93 116.55 108.16 1n0t n ASP 216 Ca -0.01 -2.08 -0.17 0.00 -0.01 0.00 0.00 54.79 52.52 1n0t n ASP 216 Cb 0.64 1.47 -0.16 0.00 -1.03 0.00 0.00 41.12 42.04 1n0t n ASP 216 CO 0.00 0.00 0.00 -0.44 -0.11 0.00 0.00 177.20 176.65 1n0t s SER 217 N -2.24 0.44 0.34 -1.12 0.01 -1.26 -4.19 113.70 105.68 1n0t s SER 217 Ca 0.16 -0.00 -0.00 0.00 1.31 0.00 0.00 55.95 57.42 1n0t s SER 217 Cb -0.01 -0.18 0.00 0.00 0.21 0.00 0.00 66.02 66.04 1n0t s SER 217 CO 0.12 -0.12 0.45 0.29 0.41 0.00 0.00 173.24 174.38 1n0t n LYS 218 N 4.29 0.64 -3.87 12.44 5.02 -0.62 -5.01 118.16 131.06 1n0t n LYS 218 Ca -0.24 -2.79 -0.10 0.00 -2.02 0.00 0.00 58.31 53.16 1n0t n LYS 218 Cb 0.50 2.63 -0.08 0.00 -0.02 0.00 0.00 35.03 38.06 1n0t n LYS 218 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 1n0t s GLY 219 N -3.13 0.08 -0.04 0.72 0.00 -1.26 -1.83 107.32 101.86 1n0t s GLY 219 Ca 0.30 -0.47 -0.10 0.00 0.00 0.00 0.00 44.72 44.45 1n0t s GLY 219 CO 0.21 -0.65 0.27 -0.19 0.00 0.00 0.00 173.10 172.75 1n0t s TYR 220 N -3.14 3.64 0.07 1.90 2.02 -0.11 -1.00 117.35 120.73 1n0t s TYR 220 Ca -0.01 0.71 0.01 0.00 -0.37 0.00 0.00 57.07 57.42 1n0t s TYR 220 Cb 0.02 -2.08 -0.03 0.00 -0.40 0.00 0.00 41.96 39.46 1n0t s TYR 220 CO -0.07 0.67 -0.06 0.20 -1.57 0.00 0.00 175.55 174.72 1n0t s GLY 221 N -1.23 0.58 0.16 0.71 0.00 -0.37 -0.91 107.32 106.27 1n0t s GLY 221 Ca 0.22 -1.09 -0.28 0.00 0.00 0.00 0.00 44.72 43.56 1n0t s GLY 221 CO 0.11 -1.18 0.87 -0.42 0.00 0.00 0.00 173.10 172.47 1n0t s ILE 222 N -2.92 4.35 0.05 0.90 1.01 -1.26 -4.48 121.20 118.85 1n0t s ILE 222 Ca 0.02 1.91 0.07 0.00 0.00 0.00 0.00 60.65 62.65 1n0t s ILE 222 Cb 0.01 -4.24 -0.03 0.00 0.01 0.00 0.00 42.46 38.20 1n0t s ILE 222 CO -0.04 0.45 -0.16 0.00 0.00 0.00 0.00 174.94 175.18 1n0t s ALA 223 N -0.75 2.69 0.04 9.38 0.00 -0.70 -0.95 121.76 131.48 1n0t s ALA 223 Ca 0.40 -1.19 -0.05 0.00 0.00 0.00 0.00 51.96 51.12 1n0t s ALA 223 Cb -0.24 -0.79 -0.01 0.00 0.00 0.00 0.00 23.12 22.07 1n0t s ALA 223 CO 0.29 0.59 0.09 0.95 0.00 0.00 0.00 175.76 177.67 1n0t s THR 224 N -0.98 0.14 0.76 0.00 -4.23 -0.47 -0.72 115.64 110.15 1n0t s THR 224 Ca 0.16 -1.18 -0.11 0.00 -1.18 0.00 0.00 61.69 59.37 1n0t s THR 224 Cb -0.11 -1.01 0.05 0.00 1.34 0.00 0.00 72.50 72.78 1n0t s THR 224 CO 0.07 -0.65 1.10 -2.16 -0.54 0.00 0.00 174.62 172.43 1n0t s PRO 225 N -2.88 2.29 0.31 3.99 0.04 -1.26 -0.13 135.00 137.35 1n0t s PRO 225 Ca -0.03 1.25 -0.29 0.00 0.04 0.00 0.00 61.00 61.97 1n0t s PRO 225 Cb 0.00 -1.90 -0.13 0.00 0.04 0.00 0.00 34.50 32.52 1n0t s PRO 225 CO -0.06 -1.63 1.33 1.63 0.04 0.00 0.00 177.00 178.31 1n0t n LYS 226 N -3.33 2.12 -0.90 4.56 4.76 -1.26 -1.44 118.16 122.66 1n0t n LYS 226 Ca 0.10 0.75 0.00 0.00 -2.87 0.00 0.00 58.31 56.28 1n0t n LYS 226 Cb 0.53 -2.35 0.00 0.00 -1.84 0.00 0.00 35.03 31.36 1n0t n LYS 226 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1n0t n GLY 227 N 1.20 0.62 3.70 0.72 0.00 -1.26 -4.99 105.19 105.19 1n0t n GLY 227 Ca 0.07 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.69 1n0t n GLY 227 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1n0t n SER 228 N -0.08 2.41 -0.00 1.61 2.88 -0.52 -4.87 113.62 115.05 1n0t n SER 228 Ca 0.00 1.04 0.15 0.00 -1.33 0.00 0.00 58.87 58.73 1n0t n SER 228 Cb 0.04 -1.51 0.74 0.00 -0.75 0.00 0.00 64.21 62.73 1n0t n SER 228 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 1n0t n SER 229 N -0.19 0.02 -0.01 -3.46 3.41 -1.26 -3.08 113.62 109.05 1n0t n SER 229 Ca 0.08 -0.10 0.01 0.00 -0.26 0.00 0.00 58.87 58.61 1n0t n SER 229 Cb 0.42 -0.30 -0.12 0.00 -0.26 0.00 0.00 64.21 63.95 1n0t n SER 229 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1n0t n LEU 230 N -1.30 0.37 -0.39 1.04 4.77 -1.26 -4.64 117.00 115.59 1n0t n LEU 230 Ca 0.14 0.16 -0.11 0.00 -0.03 0.00 0.00 56.01 56.17 1n0t n LEU 230 Cb 0.25 0.16 -0.10 0.00 -2.33 0.00 0.00 43.42 41.40 1n0t n LEU 230 CO 0.24 0.17 0.48 1.23 -1.33 0.00 0.00 177.39 178.18 1n0t h GLY 231 N 3.90 -0.92 0.88 -0.72 0.00 -1.90 -0.70 103.07 103.61 1n0t h GLY 231 Ca -0.21 0.81 -0.01 0.00 0.00 0.00 0.00 47.33 47.92 1n0t h GLY 231 CO 0.02 0.00 -0.11 -0.57 0.00 0.00 0.00 176.54 175.89 1n0t h ASN 232 N -0.02 -0.25 -0.52 0.19 -0.73 -1.82 -2.35 115.58 110.08 1n0t h ASN 232 Ca 0.15 -0.08 0.07 0.00 1.87 0.00 0.00 56.30 58.30 1n0t h ASN 232 Cb 0.40 0.07 -0.06 0.00 0.27 0.00 0.00 38.32 39.00 1n0t h ASN 232 CO -0.89 -0.07 0.21 0.00 -0.37 0.00 0.00 177.43 176.31 1n0t h ALA 233 N 0.33 0.65 -0.44 1.57 0.00 -1.78 -1.68 119.26 117.91 1n0t h ALA 233 Ca -0.03 0.06 0.03 0.00 0.00 0.00 0.00 54.91 54.97 1n0t h ALA 233 Cb 0.32 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.09 1n0t h ALA 233 CO 0.05 -0.18 0.23 0.28 0.00 0.00 0.00 179.25 179.64 1n0t h VAL 234 N 0.41 0.99 -0.15 0.00 2.07 -1.10 -0.34 116.25 118.13 1n0t h VAL 234 Ca 0.25 -0.16 0.01 0.00 0.82 0.00 0.00 66.70 67.62 1n0t h VAL 234 Cb 0.24 0.49 -0.01 0.00 -1.52 0.00 0.00 31.29 30.48 1n0t h VAL 234 CO -0.23 0.08 0.05 -1.13 0.02 0.00 0.00 177.57 176.37 1n0t h ASN 235 N 0.47 0.07 -0.26 0.57 -1.24 -0.94 -1.16 115.58 113.07 1n0t h ASN 235 Ca 0.19 0.01 -0.03 0.00 0.71 0.00 0.00 56.30 57.18 1n0t h ASN 235 Cb 0.07 0.00 -0.02 0.00 0.73 0.00 0.00 38.32 39.11 1n0t h ASN 235 CO -0.12 0.06 0.08 -0.07 -1.29 0.00 0.00 177.43 176.10 1n0t h LEU 236 N 0.13 0.45 -0.38 0.34 3.38 -0.97 -2.30 115.31 115.95 1n0t h LEU 236 Ca 0.06 -0.06 -0.12 0.00 0.09 0.00 0.00 57.88 57.85 1n0t h LEU 236 Cb 0.03 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.66 1n0t h LEU 236 CO -0.06 0.45 -0.24 0.00 0.09 0.00 0.00 178.44 178.68 1n0t h ALA 237 N 1.61 0.54 -0.29 1.53 0.00 -0.56 -1.35 119.26 120.75 1n0t h ALA 237 Ca 0.12 -0.39 0.01 0.00 0.00 0.00 0.00 54.91 54.65 1n0t h ALA 237 Cb 0.19 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 1n0t h ALA 237 CO -0.00 0.54 0.16 0.28 0.00 0.00 0.00 179.25 180.22 1n0t h VAL 238 N 0.64 1.01 -0.53 0.00 2.07 -0.86 0.26 116.25 118.84 1n0t h VAL 238 Ca 0.08 -0.11 -0.00 0.00 0.82 0.00 0.00 66.70 67.48 1n0t h VAL 238 Cb 0.81 0.66 -0.03 0.00 -1.52 0.00 0.00 31.29 31.21 1n0t h VAL 238 CO 0.07 0.06 0.32 -0.07 0.02 0.00 0.00 177.57 177.97 1n0t h LEU 239 N 0.33 0.64 -0.49 2.57 3.38 -1.32 -1.57 115.31 118.86 1n0t h LEU 239 Ca 0.12 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.03 1n0t h LEU 239 Cb 0.01 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.58 1n0t h LEU 239 CO -0.07 0.51 0.32 0.50 0.09 0.00 0.00 178.44 179.80 1n0t h LYS 240 N 0.71 0.65 -0.90 1.13 3.64 -0.84 -0.96 116.57 120.01 1n0t h LYS 240 Ca 0.19 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.52 1n0t h LYS 240 Cb -0.01 -0.15 -0.04 0.00 -0.41 0.00 0.00 32.23 31.62 1n0t h LYS 240 CO -0.04 0.43 0.52 -0.07 -2.27 0.00 0.00 179.45 178.03 1n0t h LEU 241 N 0.66 1.09 -0.39 5.20 3.38 -0.61 0.28 115.31 124.93 1n0t h LEU 241 Ca 0.18 -0.08 -0.07 0.00 0.09 0.00 0.00 57.88 58.00 1n0t h LEU 241 Cb -0.07 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.39 1n0t h LEU 241 CO -0.04 0.85 -0.03 -1.13 0.09 0.00 0.00 178.44 178.18 1n0t h ASN 242 N 1.24 0.71 0.46 -0.43 -1.24 -0.96 -0.56 115.58 114.80 1n0t h ASN 242 Ca 0.32 -0.33 -0.06 0.00 0.71 0.00 0.00 56.30 56.94 1n0t h ASN 242 Cb -0.02 -0.19 -0.01 0.00 0.73 0.00 0.00 38.32 38.83 1n0t h ASN 242 CO -0.06 0.87 -0.27 -0.33 -1.29 0.00 0.00 177.43 176.35 1n0t h GLU 243 N 0.54 0.00 -0.01 6.67 5.08 -0.77 -1.50 114.58 124.59 1n0t h GLU 243 Ca 0.11 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.47 1n0t h GLU 243 Cb 0.52 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.77 1n0t h GLU 243 CO 0.03 0.27 -0.02 1.04 -1.00 0.00 0.00 179.01 179.32 1n0t n GLN 244 N -3.84 1.26 -0.93 2.33 6.02 0.05 -4.91 117.38 117.36 1n0t n GLN 244 Ca -0.02 -0.50 0.00 0.00 -0.01 0.00 0.00 57.00 56.48 1n0t n GLN 244 Cb 0.36 -1.49 0.00 0.00 1.02 0.00 0.00 30.24 30.13 1n0t n GLN 244 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1n0t n GLY 245 N 1.13 0.77 0.31 1.08 0.00 -0.57 -4.94 105.19 102.98 1n0t n GLY 245 Ca 0.20 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.14 1n0t n GLY 245 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1n0t h LEU 246 N 0.00 1.02 -0.67 0.99 7.12 -1.32 -1.80 115.31 120.66 1n0t h LEU 246 Ca 0.00 -0.28 -0.01 0.00 0.13 0.00 0.00 57.88 57.72 1n0t h LEU 246 Cb 0.00 -0.27 -0.03 0.00 -0.53 0.00 0.00 40.66 39.83 1n0t h LEU 246 CO 0.00 1.06 0.37 -0.07 -0.13 0.00 0.00 178.44 179.67 1n0t h LEU 247 N 0.96 0.83 -0.74 2.25 3.38 -1.83 0.31 115.31 120.48 1n0t h LEU 247 Ca 0.18 -0.09 -0.12 0.00 0.09 0.00 0.00 57.88 57.93 1n0t h LEU 247 Cb 0.52 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 1n0t h LEU 247 CO 0.03 0.68 -0.38 0.44 0.09 0.00 0.00 178.44 179.30 1n0t h ASP 248 N 0.91 0.55 -0.62 -0.43 3.32 -1.86 -1.58 116.42 116.71 1n0t h ASP 248 Ca 0.23 -0.23 -0.05 0.00 0.02 0.00 0.00 57.03 57.00 1n0t h ASP 248 Cb 0.03 -0.15 -0.03 0.00 0.22 0.00 0.00 39.33 39.40 1n0t h ASP 248 CO -0.04 0.88 0.18 0.50 -1.72 0.00 0.00 179.24 179.04 1n0t h LYS 249 N 0.44 0.98 -0.30 3.56 3.64 -0.75 -1.45 116.57 122.68 1n0t h LYS 249 Ca 0.04 -0.22 -0.13 0.00 -1.27 0.00 0.00 60.65 59.08 1n0t h LYS 249 Cb 0.86 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 32.53 1n0t h LYS 249 CO 0.07 0.87 -0.33 -0.07 -2.27 0.00 0.00 179.45 177.72 1n0t h LEU 250 N 0.90 0.69 0.40 5.20 3.38 -0.75 -1.22 115.31 123.91 1n0t h LEU 250 Ca 0.20 -0.28 -0.02 0.00 0.09 0.00 0.00 57.88 57.87 1n0t h LEU 250 Cb 0.32 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.88 1n0t h LEU 250 CO -0.00 0.97 -0.19 0.50 0.09 0.00 0.00 178.44 179.80 1n0t h LYS 251 N 0.56 -0.52 -0.91 1.13 1.63 -1.05 -2.06 116.57 115.35 1n0t h LYS 251 Ca 0.06 0.04 0.08 0.00 -0.85 0.00 0.00 60.65 59.98 1n0t h LYS 251 Cb 0.84 0.12 -0.07 0.00 -0.60 0.00 0.00 32.23 32.52 1n0t h LYS 251 CO 0.07 -0.29 0.56 -0.97 -3.45 0.00 0.00 179.45 175.37 1n0t h ASN 252 N -0.65 0.86 0.35 4.20 -1.24 -1.23 -0.86 115.58 117.01 1n0t h ASN 252 Ca -0.06 0.03 -0.01 0.00 0.71 0.00 0.00 56.30 56.97 1n0t h ASN 252 Cb 0.48 -0.15 -0.00 0.00 0.73 0.00 0.00 38.32 39.38 1n0t h ASN 252 CO 0.09 0.52 -0.19 0.50 -1.29 0.00 0.00 177.43 177.06 1n0t h LYS 253 N 0.98 -0.49 0.00 6.67 3.64 -1.04 -0.50 116.57 125.83 1n0t h LYS 253 Ca 0.41 0.03 -0.00 0.00 -1.27 0.00 0.00 60.65 59.83 1n0t h LYS 253 Cb 0.27 0.11 -0.00 0.00 -0.41 0.00 0.00 32.23 32.20 1n0t h LYS 253 CO -0.21 -0.33 -0.01 -1.49 -2.27 0.00 0.00 179.45 175.15 1n0t h TRP 254 N -0.51 0.00 0.01 1.91 4.06 -1.18 -2.65 115.95 117.60 1n0t h TRP 254 Ca -0.04 0.00 -0.40 0.00 2.06 0.00 0.00 58.89 60.51 1n0t h TRP 254 Cb 0.41 0.00 -0.06 0.00 -1.00 0.00 0.00 29.16 28.51 1n0t h TRP 254 CO -0.07 0.01 -2.28 0.91 -3.56 0.00 0.00 178.44 173.45 1n0t n TRP 255 N -3.10 0.30 -0.09 0.49 8.01 -0.35 -4.65 117.44 118.05 1n0t n TRP 255 Ca 0.04 0.10 -0.18 0.00 -1.31 0.00 0.00 57.50 56.15 1n0t n TRP 255 Cb 0.53 -1.03 -0.06 0.00 -2.01 0.00 0.00 31.31 28.73 1n0t n TRP 255 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.69 177.34 1n0t n TYR 256 N -3.89 0.00 -0.21 -5.99 4.01 -0.42 -3.79 117.16 106.88 1n0t n TYR 256 Ca -0.46 0.00 0.20 0.00 -0.16 0.00 0.00 57.90 57.48 1n0t n TYR 256 Cb 0.91 -0.64 0.55 0.00 -0.31 0.00 0.00 39.34 39.84 1n0t n TYR 256 CO 0.00 0.00 0.00 -0.44 -0.46 0.00 0.00 176.86 175.96 1n0t h ASP 257 N -0.75 0.33 -0.62 7.72 3.32 -1.16 0.69 116.42 125.95 1n0t h ASP 257 Ca -0.38 0.03 0.00 0.00 0.02 0.00 0.00 57.03 56.70 1n0t h ASP 257 Cb 1.26 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 40.78 1n0t h ASP 257 CO -0.23 0.14 0.00 0.29 -1.72 0.00 0.00 179.24 177.72 1n0t n LYS 258 N -4.47 4.39 -1.34 3.56 5.02 -1.00 -4.98 118.16 119.34 1n0t n LYS 258 Ca 0.18 -3.06 -0.29 0.00 -2.02 0.00 0.00 58.31 53.12 1n0t n LYS 258 Cb 0.70 -2.11 0.15 0.00 -0.02 0.00 0.00 35.03 33.76 1n0t n LYS 258 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 1n0t s GLY 259 N -0.84 1.57 0.00 0.72 0.00 0.24 -4.98 107.32 104.03 1n0t s GLY 259 Ca 0.54 -0.41 0.00 0.00 0.00 0.00 0.00 44.72 44.84 1n0t s GLY 259 CO 0.20 0.16 0.71 1.18 0.00 0.00 0.00 173.10 175.36 1n0t n GLU 260 N -3.96 1.36 0.00 2.90 1.02 0.73 -5.04 120.64 117.65 1n0t n GLU 260 Ca 0.06 -0.95 0.00 0.00 -0.02 0.00 0.00 57.16 56.25 1n0t n GLU 260 Cb 0.58 -0.77 0.00 0.00 -0.02 0.00 0.00 31.44 31.23 1n0t n GLU 260 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31