#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3gli s TYR 3 N 0.00 3.46 0.01 7.33 5.04 -1.26 -5.04 117.35 126.90 3gli s TYR 3 Ca 0.00 1.41 0.02 0.00 -2.44 0.00 0.00 57.07 56.06 3gli s TYR 3 Cb 0.00 -3.40 -0.01 0.00 0.35 0.00 0.00 41.96 38.90 3gli s TYR 3 CO 0.00 -1.12 -0.08 -0.65 -1.34 0.00 0.00 175.55 172.36 3gli s GLN 4 N 0.25 0.57 0.42 4.97 -0.21 -1.26 -5.12 119.66 119.27 3gli s GLN 4 Ca 0.54 -0.44 -0.25 0.00 0.02 0.00 0.00 55.36 55.24 3gli s GLN 4 Cb -0.31 -0.49 -0.10 0.00 1.00 0.00 0.00 33.01 33.11 3gli s GLN 4 CO 0.33 0.12 1.15 0.28 -2.12 0.00 0.00 175.29 175.05 3gli n VAL 5 N 2.40 2.53 -0.26 1.09 0.31 -1.26 -4.35 118.33 118.78 3gli n VAL 5 Ca -0.16 -0.50 0.07 0.00 -0.01 0.00 0.00 64.34 63.74 3gli n VAL 5 Cb 0.57 -1.37 0.21 0.00 -0.91 0.00 0.00 33.84 32.34 3gli n VAL 5 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 3gli h LEU 6 N 1.82 -0.01 -0.84 7.52 4.07 -1.97 1.65 115.31 127.53 3gli h LEU 6 Ca -0.46 0.16 0.00 0.00 0.08 0.00 0.00 57.88 57.66 3gli h LEU 6 Cb 1.32 0.22 0.00 0.00 1.08 0.00 0.00 40.66 43.28 3gli h LEU 6 CO 0.58 -0.07 0.30 0.00 -1.08 0.00 0.00 178.44 178.17 3gli n ALA 7 N -2.70 0.62 -0.05 1.53 0.00 -1.26 -0.23 120.51 118.42 3gli n ALA 7 Ca 0.16 0.12 -0.12 0.00 0.00 0.00 0.00 53.44 53.60 3gli n ALA 7 Cb 0.52 -0.78 -0.04 0.00 0.00 0.00 0.00 19.45 19.15 3gli n ALA 7 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 3gli n ARG 8 N -2.03 0.26 -0.26 0.00 0.63 0.53 -4.62 116.66 111.18 3gli n ARG 8 Ca -0.01 0.11 0.02 0.00 -0.92 0.00 0.00 57.85 57.06 3gli n ARG 8 Cb 0.32 -0.94 0.15 0.00 0.45 0.00 0.00 32.46 32.44 3gli n ARG 8 CO 0.00 0.00 0.00 -0.22 -2.51 0.00 0.00 177.63 174.90 3gli h LYS 9 N -0.45 0.60 -0.44 -0.14 3.64 -0.01 -2.78 116.57 116.99 3gli h LYS 9 Ca -0.25 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.09 3gli h LYS 9 Cb 1.10 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 32.79 3gli h LYS 9 CO -0.15 0.40 0.00 0.91 -2.27 0.00 0.00 179.45 178.34 3gli n TRP 10 N -4.86 0.28 -1.68 1.91 7.02 0.68 -4.90 117.44 115.90 3gli n TRP 10 Ca 0.12 -0.11 -0.45 0.00 -1.02 0.00 0.00 57.50 56.03 3gli n TRP 10 Cb 0.30 -0.07 -0.04 0.00 -2.42 0.00 0.00 31.31 29.08 3gli n TRP 10 CO 0.00 0.00 0.00 -2.13 -2.02 0.00 0.00 177.69 173.54 3gli n ARG 11 N 0.00 2.44 -1.68 -0.99 0.63 -1.05 -4.81 116.66 111.20 3gli n ARG 11 Ca 0.05 0.89 -0.45 0.00 -0.92 0.00 0.00 57.85 57.42 3gli n ARG 11 Cb 0.24 -2.74 -0.04 0.00 0.45 0.00 0.00 32.46 30.38 3gli n ARG 11 CO 0.00 0.00 0.00 -2.30 -2.51 0.00 0.00 177.63 172.82 3gli n PRO 12 N 5.38 2.32 -0.00 -0.14 -0.02 -1.26 -4.87 135.00 136.41 3gli n PRO 12 Ca 0.19 0.84 0.05 0.00 -2.02 0.00 0.00 63.50 62.56 3gli n PRO 12 Cb 0.33 -2.64 -0.07 0.00 -0.02 0.00 0.00 33.50 31.09 3gli n PRO 12 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 3gli n GLN 13 N 4.03 1.67 -4.11 -0.52 1.13 -1.26 -4.89 117.38 113.43 3gli n GLN 13 Ca 0.17 -0.06 -0.14 0.00 -1.94 0.00 0.00 57.00 55.03 3gli n GLN 13 Cb 0.31 -1.15 -0.11 0.00 0.11 0.00 0.00 30.24 29.39 3gli n GLN 13 CO 0.00 0.00 0.00 0.95 -1.44 0.00 0.00 177.06 176.57 3gli s THR 14 N -2.44 0.72 0.50 5.09 -4.23 -1.26 -4.92 115.64 109.11 3gli s THR 14 Ca -0.01 -1.24 0.27 0.00 -1.18 0.00 0.00 61.69 59.54 3gli s THR 14 Cb 0.07 -0.86 0.45 0.00 1.34 0.00 0.00 72.50 73.51 3gli s THR 14 CO 0.45 -0.39 1.88 -0.26 -0.54 0.00 0.00 174.62 175.76 3gli h PHE 15 N 4.26 0.16 -0.92 3.99 0.05 -1.88 0.18 116.94 122.78 3gli h PHE 15 Ca -0.37 0.01 0.10 0.00 3.82 0.00 0.00 57.97 61.53 3gli h PHE 15 Cb 1.20 -0.05 -0.07 0.00 2.00 0.00 0.00 35.95 39.03 3gli h PHE 15 CO 0.64 0.04 0.59 0.00 -0.18 0.00 0.00 178.31 179.40 3gli h ALA 16 N 1.58 1.62 -0.47 2.45 0.00 -1.95 -2.92 119.26 119.55 3gli h ALA 16 Ca 0.44 0.00 -0.05 0.00 0.00 0.00 0.00 54.91 55.30 3gli h ALA 16 Cb 1.55 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 19.10 3gli h ALA 16 CO -0.06 0.19 0.06 -0.25 0.00 0.00 0.00 179.25 179.19 3gli n ASP 17 N -4.55 4.41 -4.73 0.00 8.00 0.62 -4.86 116.55 115.44 3gli n ASP 17 Ca 0.16 -2.76 -0.35 0.00 0.71 0.00 0.00 54.79 52.55 3gli n ASP 17 Cb 0.32 -0.66 -0.08 0.00 -0.02 0.00 0.00 41.12 40.68 3gli n ASP 17 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3gli s VAL 18 N -2.33 4.88 -0.17 2.53 1.01 -1.11 -4.54 120.40 120.68 3gli s VAL 18 Ca 0.41 -0.02 -0.17 0.00 0.00 0.00 0.00 61.98 62.19 3gli s VAL 18 Cb 0.32 -3.13 -0.04 0.00 0.00 0.00 0.00 36.38 33.53 3gli s VAL 18 CO 0.11 0.56 0.46 -0.69 0.00 0.00 0.00 175.10 175.54 3gli s VAL 19 N -0.51 5.17 0.00 2.92 1.01 -1.26 -4.93 120.40 122.80 3gli s VAL 19 Ca 0.10 0.87 0.00 0.00 0.00 0.00 0.00 61.98 62.95 3gli s VAL 19 Cb -0.12 -3.79 0.00 0.00 0.00 0.00 0.00 36.38 32.47 3gli s VAL 19 CO 0.02 0.27 0.00 0.61 0.00 0.00 0.00 175.10 176.00 3gli n GLY 20 N 3.62 1.97 1.97 4.51 0.00 -1.26 -4.81 105.19 111.20 3gli n GLY 20 Ca -0.07 -0.45 -0.09 0.00 0.00 0.00 0.00 46.02 45.40 3gli n GLY 20 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3gli n GLN 21 N 8.04 -1.61 0.11 1.61 1.13 -1.26 -4.79 117.38 120.61 3gli n GLN 21 Ca 0.00 0.53 0.17 0.00 -1.94 0.00 0.00 57.00 55.75 3gli n GLN 21 Cb 0.00 -4.84 0.71 0.00 0.11 0.00 0.00 30.24 26.23 3gli n GLN 21 CO 0.00 0.00 0.00 0.93 -1.44 0.00 0.00 177.06 176.55 3gli h GLU 22 N 0.00 0.00 -0.25 -1.09 5.08 -1.95 0.13 114.58 116.51 3gli h GLU 22 Ca -0.20 0.00 -0.14 0.00 -1.00 0.00 0.00 59.36 58.01 3gli h GLU 22 Cb 0.80 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.05 3gli h GLU 22 CO 0.28 0.00 -0.43 1.12 -1.00 0.00 0.00 179.01 178.97 3gli h HIS 23 N 0.00 0.75 0.58 4.33 2.07 -1.99 0.64 115.15 121.53 3gli h HIS 23 Ca 0.15 -0.23 -0.03 0.00 -2.85 0.00 0.00 60.37 57.42 3gli h HIS 23 Cb 0.66 -0.16 0.01 0.00 2.57 0.00 0.00 27.41 30.49 3gli h HIS 23 CO 0.00 0.95 -0.28 0.28 -3.07 0.00 0.00 177.93 175.81 3gli h VAL 24 N 0.50 0.02 -0.73 6.12 2.07 -1.11 -2.36 116.25 120.77 3gli h VAL 24 Ca 0.04 -0.44 0.15 0.00 0.82 0.00 0.00 66.70 67.28 3gli h VAL 24 Cb 0.96 0.03 -0.11 0.00 -1.52 0.00 0.00 31.29 30.65 3gli h VAL 24 CO 0.09 0.00 0.18 -0.07 0.02 0.00 0.00 177.57 177.79 3gli h LEU 25 N -1.20 0.02 0.13 2.57 3.38 -1.43 0.77 115.31 119.55 3gli h LEU 25 Ca -0.08 0.14 0.01 0.00 0.09 0.00 0.00 57.88 58.04 3gli h LEU 25 Cb 0.60 0.19 -0.05 0.00 0.09 0.00 0.00 40.66 41.49 3gli h LEU 25 CO 0.13 -0.03 -0.52 0.74 0.09 0.00 0.00 178.44 178.86 3gli h THR 26 N 0.28 0.00 -0.96 0.22 2.02 -0.88 0.20 112.91 113.79 3gli h THR 26 Ca 0.41 0.00 0.10 0.00 0.77 0.00 0.00 66.41 67.68 3gli h THR 26 Cb 0.68 0.00 -0.08 0.00 -1.74 0.00 0.00 68.15 67.02 3gli h THR 26 CO -0.50 0.00 0.60 0.00 0.37 0.00 0.00 175.52 175.99 3gli h ALA 27 N -0.59 1.39 -0.55 6.16 0.00 -0.70 0.36 119.26 125.35 3gli h ALA 27 Ca -0.01 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3gli h ALA 27 Cb 0.75 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.32 3gli h ALA 27 CO -0.27 0.26 0.00 1.28 0.00 0.00 0.00 179.25 180.51 3gli n LEU 28 N -4.62 0.13 -0.35 0.00 4.77 0.15 -0.26 117.00 116.83 3gli n LEU 28 Ca 0.17 0.79 0.22 0.00 -0.03 0.00 0.00 56.01 57.16 3gli n LEU 28 Cb 0.29 -0.41 0.47 0.00 -2.33 0.00 0.00 43.42 41.44 3gli n LEU 28 CO 0.29 -0.41 1.18 0.00 -1.33 0.00 0.00 177.39 177.12 3gli h ALA 29 N -2.00 2.07 0.23 -1.18 0.00 -0.57 0.22 119.26 118.03 3gli h ALA 29 Ca 0.00 0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.03 3gli h ALA 29 Cb 0.00 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 3gli h ALA 29 CO 0.00 -0.56 -0.23 -0.97 0.00 0.00 0.00 179.25 177.49 3gli h ASN 30 N 0.42 -0.60 0.05 0.00 -1.24 -0.19 -1.02 115.58 112.99 3gli h ASN 30 Ca 0.66 0.06 0.02 0.00 0.71 0.00 0.00 56.30 57.75 3gli h ASN 30 Cb 1.54 0.21 -0.03 0.00 0.73 0.00 0.00 38.32 40.76 3gli h ASN 30 CO -0.43 -0.33 -0.21 1.23 -1.29 0.00 0.00 177.43 176.39 3gli h GLY 31 N -0.49 -0.34 -0.00 1.57 0.00 0.26 0.43 103.07 104.50 3gli h GLY 31 Ca -0.00 0.25 0.17 0.00 0.00 0.00 0.00 47.33 47.74 3gli h GLY 31 CO -0.05 -0.19 0.30 1.41 0.00 0.00 0.00 176.54 178.01 3gli h LEU 32 N -0.36 0.23 -0.20 3.11 3.38 -1.16 0.17 115.31 120.47 3gli h LEU 32 Ca 0.05 0.13 -0.13 0.00 0.09 0.00 0.00 57.88 58.02 3gli h LEU 32 Cb 0.42 0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.28 3gli h LEU 32 CO -0.16 0.04 -0.62 0.28 0.09 0.00 0.00 178.44 178.06 3gli h SER 33 N 0.39 0.00 0.16 -0.43 0.02 -0.55 -2.65 113.55 110.50 3gli h SER 33 Ca 0.46 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.41 3gli h SER 33 Cb 0.76 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.30 3gli h SER 33 CO -0.47 0.62 0.00 0.18 -1.14 0.00 0.00 176.83 176.03 3gli n LEU 34 N -3.34 0.00 -0.28 5.07 4.77 0.15 -4.87 117.00 118.49 3gli n LEU 34 Ca 0.01 0.08 -0.04 0.00 -0.03 0.00 0.00 56.01 56.03 3gli n LEU 34 Cb 0.75 -0.08 -0.02 0.00 -2.33 0.00 0.00 43.42 41.74 3gli n LEU 34 CO 0.42 -0.00 -0.04 0.61 -1.33 0.00 0.00 177.39 177.05 3gli n GLY 35 N 1.05 0.55 3.19 -0.72 0.00 -0.48 -4.95 105.19 103.83 3gli n GLY 35 Ca 0.21 -0.15 -0.44 0.00 0.00 0.00 0.00 46.02 45.65 3gli n GLY 35 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3gli n ARG 36 N -1.32 3.88 -3.82 1.61 1.74 0.46 -4.98 116.66 114.22 3gli n ARG 36 Ca -0.04 -4.50 -0.35 0.00 -0.77 0.00 0.00 57.85 52.19 3gli n ARG 36 Cb 0.32 -2.53 -0.08 0.00 -1.02 0.00 0.00 32.46 29.15 3gli n ARG 36 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 3gli s ILE 37 N -1.91 5.33 0.22 0.55 1.01 -1.26 -4.54 121.20 120.60 3gli s ILE 37 Ca 0.31 0.16 0.00 0.00 0.00 0.00 0.00 60.65 61.12 3gli s ILE 37 Cb -0.04 -3.39 0.04 0.00 0.01 0.00 0.00 42.46 39.08 3gli s ILE 37 CO -0.01 0.50 0.30 1.57 0.00 0.00 0.00 174.94 177.30 3gli n HIS 38 N 3.06 -3.22 0.00 3.97 -0.00 -1.26 -5.05 115.22 112.73 3gli n HIS 38 Ca -0.17 -0.54 0.00 0.00 0.46 0.00 0.00 57.72 57.47 3gli n HIS 38 Cb 0.53 -0.22 0.00 0.00 -0.12 0.00 0.00 29.99 30.18 3gli n HIS 38 CO 0.00 0.00 0.00 -2.39 0.46 0.00 0.00 176.34 174.41 3gli n HIS 39 N -1.80 0.00 -3.68 1.57 1.44 -1.26 -4.90 115.22 106.58 3gli n HIS 39 Ca 0.05 0.00 -0.28 0.00 -2.01 0.00 0.00 57.72 55.48 3gli n HIS 39 Cb 0.18 0.00 -0.16 0.00 0.12 0.00 0.00 29.99 30.13 3gli n HIS 39 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 3gli s ALA 40 N -1.02 1.03 -0.22 1.59 0.00 -1.25 0.99 121.76 122.87 3gli s ALA 40 Ca 0.00 -1.05 -0.05 0.00 0.00 0.00 0.00 51.96 50.86 3gli s ALA 40 Cb 0.00 -1.35 -0.01 0.00 0.00 0.00 0.00 23.12 21.75 3gli s ALA 40 CO 0.00 -1.44 -0.01 0.71 0.00 0.00 0.00 175.76 175.02 3gli s TYR 41 N 1.86 2.99 -0.18 0.00 1.51 0.09 -1.17 117.35 122.45 3gli s TYR 41 Ca 0.05 -0.77 -0.09 0.00 -1.01 0.00 0.00 57.07 55.25 3gli s TYR 41 Cb -0.17 -2.13 -0.05 0.00 -0.11 0.00 0.00 41.96 39.51 3gli s TYR 41 CO -0.20 -0.47 0.11 -1.17 -1.11 0.00 0.00 175.55 172.71 3gli s LEU 42 N 1.45 4.11 -0.15 -1.29 2.96 0.10 0.21 118.68 126.07 3gli s LEU 42 Ca 0.05 0.22 0.02 0.00 -0.22 0.00 0.00 54.13 54.20 3gli s LEU 42 Cb -0.14 -2.05 0.02 0.00 0.50 0.00 0.00 46.19 44.51 3gli s LEU 42 CO -0.01 0.21 -0.20 -0.36 -1.32 0.00 0.00 176.35 174.68 3gli s PHE 43 N 0.15 2.59 0.20 5.38 0.08 0.72 -1.53 117.98 125.57 3gli s PHE 43 Ca 0.08 -1.40 0.08 0.00 0.12 0.00 0.00 56.93 55.80 3gli s PHE 43 Cb -0.11 -1.79 -0.05 0.00 -0.57 0.00 0.00 43.02 40.50 3gli s PHE 43 CO -0.01 -0.68 -0.15 -1.54 -0.10 0.00 0.00 175.22 172.74 3gli s SER 44 N 1.08 2.63 0.00 1.36 1.04 -0.54 -1.55 113.70 117.71 3gli s SER 44 Ca -0.01 -0.99 0.00 0.00 0.48 0.00 0.00 55.95 55.43 3gli s SER 44 Cb -0.14 -0.15 0.00 0.00 0.10 0.00 0.00 66.02 65.83 3gli s SER 44 CO -0.07 -0.14 0.00 0.61 0.98 0.00 0.00 173.24 174.62 3gli n GLY 45 N -0.26 2.04 3.84 7.32 0.00 -1.24 0.90 105.19 117.79 3gli n GLY 45 Ca -0.09 -1.29 -0.31 0.00 0.00 0.00 0.00 46.02 44.34 3gli n GLY 45 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3gli s THR 46 N -1.97 3.87 -0.10 2.61 -4.23 -1.26 -4.36 115.64 110.20 3gli s THR 46 Ca 0.00 0.61 -0.21 0.00 -1.18 0.00 0.00 61.69 60.91 3gli s THR 46 Cb 0.00 -3.47 -0.10 0.00 1.34 0.00 0.00 72.50 70.28 3gli s THR 46 CO 0.00 -0.79 0.63 -2.11 -0.54 0.00 0.00 174.62 171.81 3gli n ARG 47 N -3.08 0.00 -3.15 3.99 0.00 -1.26 -3.28 116.66 109.89 3gli n ARG 47 Ca 0.07 0.00 -0.15 0.00 -0.00 0.00 0.00 57.85 57.77 3gli n ARG 47 Cb 0.55 -0.74 0.06 0.00 -0.00 0.00 0.00 32.46 32.33 3gli n ARG 47 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 3gli n GLY 48 N 1.23 -0.09 0.01 2.89 0.00 -1.26 -4.73 105.19 103.24 3gli n GLY 48 Ca 0.12 -0.05 0.01 0.00 0.00 0.00 0.00 46.02 46.09 3gli n GLY 48 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3gli n VAL 49 N -3.80 0.00 0.00 1.61 0.31 -1.20 -1.86 118.33 113.38 3gli n VAL 49 Ca -0.08 -0.48 0.00 0.00 -0.01 0.00 0.00 64.34 63.78 3gli n VAL 49 Cb 0.57 1.01 0.00 0.00 -0.91 0.00 0.00 33.84 34.51 3gli n VAL 49 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3gli n GLY 50 N 0.85 -0.14 0.00 2.92 0.00 -1.26 -4.95 105.19 102.61 3gli n GLY 50 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3gli n GLY 50 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3gli n LYS 51 N 0.00 0.00 0.00 1.61 5.02 -1.26 -0.79 118.16 122.74 3gli n LYS 51 Ca 0.00 0.52 -0.08 0.00 -2.02 0.00 0.00 58.31 56.73 3gli n LYS 51 Cb 0.00 -1.47 0.08 0.00 -0.02 0.00 0.00 35.03 33.62 3gli n LYS 51 CO 0.00 0.00 0.00 1.15 -0.52 0.00 0.00 177.40 178.03 3gli h THR 52 N 0.00 1.31 -0.42 -0.18 2.02 -1.97 -1.57 112.91 112.10 3gli h THR 52 Ca 0.00 -1.69 0.08 0.00 0.77 0.00 0.00 66.41 65.57 3gli h THR 52 Cb 0.00 1.67 -0.07 0.00 -1.74 0.00 0.00 68.15 68.01 3gli h THR 52 CO 0.00 0.53 -0.04 0.28 0.37 0.00 0.00 175.52 176.66 3gli h SER 53 N 0.44 -0.26 -0.22 4.18 0.02 -1.95 -1.26 113.55 114.49 3gli h SER 53 Ca 0.02 0.11 -0.03 0.00 -0.84 0.00 0.00 61.79 61.06 3gli h SER 53 Cb 1.00 0.21 -0.01 0.00 0.14 0.00 0.00 62.40 63.74 3gli h SER 53 CO 0.09 -0.09 0.04 0.40 -1.14 0.00 0.00 176.83 176.13 3gli h ILE 54 N 0.06 1.22 -0.45 3.27 2.04 -0.64 -2.09 117.51 120.93 3gli h ILE 54 Ca 0.21 -0.74 0.09 0.00 1.00 0.00 0.00 64.86 65.42 3gli h ILE 54 Cb 0.31 1.28 -0.09 0.00 -0.74 0.00 0.00 36.82 37.58 3gli h ILE 54 CO -0.39 0.23 -0.13 0.00 0.00 0.00 0.00 178.15 177.87 3gli h ALA 55 N 0.85 0.27 -0.71 1.87 0.00 -0.74 0.41 119.26 121.22 3gli h ALA 55 Ca 0.07 0.17 0.00 0.00 0.00 0.00 0.00 54.91 55.15 3gli h ALA 55 Cb 0.31 0.37 -0.03 0.00 0.00 0.00 0.00 17.79 18.44 3gli h ALA 55 CO 0.00 -0.47 0.45 0.00 0.00 0.00 0.00 179.25 179.24 3gli h ARG 56 N -0.02 0.94 -0.28 0.00 3.08 -1.16 -0.11 114.38 116.83 3gli h ARG 56 Ca 0.22 -0.07 -0.10 0.00 0.07 0.00 0.00 59.98 60.10 3gli h ARG 56 Cb 0.35 -0.21 -0.01 0.00 0.08 0.00 0.00 29.97 30.18 3gli h ARG 56 CO -0.47 0.64 -0.23 -0.07 -1.07 0.00 0.00 179.97 178.76 3gli h LEU 57 N 0.96 0.54 -0.87 3.04 3.38 0.03 -1.71 115.31 120.68 3gli h LEU 57 Ca 0.26 -0.18 -0.09 0.00 0.09 0.00 0.00 57.88 57.95 3gli h LEU 57 Cb -0.08 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.51 3gli h LEU 57 CO -0.05 0.77 -0.17 0.25 0.09 0.00 0.00 178.44 179.33 3gli h LEU 58 N 0.48 0.65 0.73 1.67 5.85 0.44 -2.53 115.31 122.60 3gli h LEU 58 Ca 0.07 -0.20 -0.03 0.00 0.84 0.00 0.00 57.88 58.56 3gli h LEU 58 Cb 0.66 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 41.52 3gli h LEU 58 CO 0.05 0.83 -0.41 0.00 -0.34 0.00 0.00 178.44 178.56 3gli h ALA 59 N 1.23 -1.25 -0.34 1.25 0.00 -0.72 -2.73 119.26 116.70 3gli h ALA 59 Ca 0.10 -0.23 0.03 0.00 0.00 0.00 0.00 54.91 54.81 3gli h ALA 59 Cb 0.62 0.50 -0.04 0.00 0.00 0.00 0.00 17.79 18.86 3gli h ALA 59 CO 0.04 -1.20 -0.20 1.63 0.00 0.00 0.00 179.25 179.53 3gli n LYS 60 N -5.04 -0.15 -0.35 0.00 5.02 -0.67 -0.50 118.16 116.47 3gli n LYS 60 Ca -0.13 0.86 0.15 0.00 -2.02 0.00 0.00 58.31 57.18 3gli n LYS 60 Cb 0.43 -1.28 0.35 0.00 -0.02 0.00 0.00 35.03 34.52 3gli n LYS 60 CO 0.00 0.00 0.00 0.78 -0.52 0.00 0.00 177.40 177.66 3gli h GLY 61 N 0.00 1.84 1.59 0.72 0.00 -1.45 0.18 103.07 105.96 3gli h GLY 61 Ca 0.05 -0.32 -0.12 0.00 0.00 0.00 0.00 47.33 46.95 3gli h GLY 61 CO -0.32 -0.18 -0.37 1.41 0.00 0.00 0.00 176.54 177.09 3gli h LEU 62 N 0.64 0.48 0.00 3.11 3.38 -0.47 -2.33 115.31 120.12 3gli h LEU 62 Ca 0.61 -0.20 0.00 0.00 0.09 0.00 0.00 57.88 58.39 3gli h LEU 62 Cb 1.09 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.70 3gli h LEU 62 CO -0.44 0.80 -1.05 0.59 0.09 0.00 0.00 178.44 178.43 3gli n ASN 63 N -4.05 0.61 -4.57 -0.43 3.02 0.36 -4.57 115.26 105.63 3gli n ASN 63 Ca -0.01 -0.27 -0.52 0.00 -0.03 0.00 0.00 54.58 53.75 3gli n ASN 63 Cb 0.48 0.85 -0.05 0.00 -0.61 0.00 0.00 39.78 40.44 3gli n ASN 63 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3gli h GLU 65 N 3.92 0.00 0.00 0.00 5.08 -1.95 -0.22 114.58 121.41 3gli h GLU 65 Ca -0.46 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 57.84 3gli h GLU 65 Cb 1.35 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.59 3gli h GLU 65 CO 0.73 0.00 -0.31 1.79 -1.00 0.00 0.00 179.01 180.23 3gli h THR 66 N 0.00 1.08 0.00 1.13 1.35 -1.98 -3.48 112.91 111.01 3gli h THR 66 Ca 0.05 -1.09 0.00 0.00 -0.55 0.00 0.00 66.41 64.82 3gli h THR 66 Cb 0.32 1.61 0.00 0.00 -1.73 0.00 0.00 68.15 68.35 3gli h THR 66 CO -0.00 0.30 0.00 0.61 -0.25 0.00 0.00 175.52 176.18 3gli n GLY 67 N -0.49 -0.51 3.64 5.82 0.00 -0.10 -5.03 105.19 108.53 3gli n GLY 67 Ca -0.02 -1.64 -0.43 0.00 0.00 0.00 0.00 46.02 43.93 3gli n GLY 67 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3gli s ILE 68 N -1.84 4.63 0.18 -0.61 1.01 -1.26 -3.76 121.20 119.54 3gli s ILE 68 Ca 0.00 1.71 0.05 0.00 0.00 0.00 0.00 60.65 62.40 3gli s ILE 68 Cb 0.00 -4.32 -0.05 0.00 0.01 0.00 0.00 42.46 38.11 3gli s ILE 68 CO 0.00 -0.32 -0.08 0.28 0.00 0.00 0.00 174.94 174.82 3gli s THR 69 N 3.34 1.19 -0.16 2.92 -1.32 -0.88 -4.95 115.64 115.78 3gli s THR 69 Ca 0.42 -2.07 0.18 0.00 -1.21 0.00 0.00 61.69 59.01 3gli s THR 69 Cb -0.14 -2.02 -0.07 0.00 -1.51 0.00 0.00 72.50 68.77 3gli s THR 69 CO 0.12 -0.60 0.96 0.00 -2.21 0.00 0.00 174.62 172.88 3gli h ALA 70 N 2.66 0.62 -2.07 11.08 0.00 -1.87 -3.41 119.26 126.28 3gli h ALA 70 Ca -0.37 -0.55 -0.62 0.00 0.00 0.00 0.00 54.91 53.36 3gli h ALA 70 Cb 1.20 0.16 -0.40 0.00 0.00 0.00 0.00 17.79 18.76 3gli h ALA 70 CO 0.64 0.61 -0.42 0.25 0.00 0.00 0.00 179.25 180.33 3gli n THR 71 N -2.86 3.40 -1.71 0.00 -2.24 -1.26 -4.75 114.28 104.87 3gli n THR 71 Ca -0.06 -5.56 -0.43 0.00 -2.27 0.00 0.00 64.05 55.73 3gli n THR 71 Cb 0.74 -1.40 -0.03 0.00 -2.10 0.00 0.00 70.33 67.54 3gli n THR 71 CO 0.00 0.00 0.00 -2.65 -0.57 0.00 0.00 175.07 171.85 3gli n PRO 72 N -0.25 2.44 0.24 -0.78 -0.02 -1.26 -4.94 135.00 130.42 3gli n PRO 72 Ca 0.34 0.87 -0.11 0.00 -2.02 0.00 0.00 63.50 62.59 3gli n PRO 72 Cb 0.40 -2.63 -0.05 0.00 -0.02 0.00 0.00 33.50 31.19 3gli n PRO 72 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3gli n GLY 74 N -1.34 0.96 0.00 0.00 0.00 -1.26 -4.98 105.19 98.57 3gli n GLY 74 Ca -0.08 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 45.89 3gli n GLY 74 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3gli n VAL 75 N -2.07 0.19 -3.88 1.61 0.31 -1.26 -4.49 118.33 108.73 3gli n VAL 75 Ca 0.00 -0.38 -0.21 0.00 -0.01 0.00 0.00 64.34 63.74 3gli n VAL 75 Cb 0.00 1.19 -0.02 0.00 -0.91 0.00 0.00 33.84 34.11 3gli n VAL 75 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3gli h ASP 77 N 1.12 0.37 0.71 0.00 3.32 -1.99 -1.57 116.42 118.37 3gli h ASP 77 Ca -0.51 0.21 -0.03 0.00 0.02 0.00 0.00 57.03 56.71 3gli h ASP 77 Cb 1.23 0.20 0.01 0.00 0.22 0.00 0.00 39.33 40.99 3gli h ASP 77 CO 0.60 -0.22 -0.34 0.78 -1.72 0.00 0.00 179.24 178.34 3gli h ASN 78 N 0.22 -0.80 -0.61 6.45 4.21 -1.93 -2.46 115.58 120.66 3gli h ASN 78 Ca 0.73 0.00 -0.00 0.00 1.21 0.00 0.00 56.30 58.24 3gli h ASN 78 Cb 1.72 0.21 -0.03 0.00 -1.12 0.00 0.00 38.32 39.10 3gli h ASN 78 CO -0.66 -0.49 0.37 0.00 -1.29 0.00 0.00 177.43 175.36 3gli h ARG 80 N 0.82 0.41 0.00 0.00 3.08 -1.38 0.24 114.38 117.55 3gli h ARG 80 Ca 0.22 -0.05 -0.12 0.00 0.07 0.00 0.00 59.98 60.09 3gli h ARG 80 Cb -0.03 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 29.93 3gli h ARG 80 CO -0.04 0.37 -0.59 0.93 -1.07 0.00 0.00 179.97 179.57 3gli h GLU 81 N 0.40 0.00 -0.00 0.04 5.08 -0.92 -2.95 114.58 116.22 3gli h GLU 81 Ca 0.10 0.00 -0.25 0.00 -1.00 0.00 0.00 59.36 58.21 3gli h GLU 81 Cb 0.15 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.41 3gli h GLU 81 CO -0.00 0.59 -1.00 0.82 -1.00 0.00 0.00 179.01 178.41 3gli h ILE 82 N 0.00 1.32 -0.05 3.13 2.04 -0.42 0.17 117.51 123.70 3gli h ILE 82 Ca -0.01 -2.31 0.01 0.00 1.00 0.00 0.00 64.86 63.56 3gli h ILE 82 Cb 1.32 2.38 -0.00 0.00 -0.74 0.00 0.00 36.82 39.78 3gli h ILE 82 CO 0.08 0.71 0.05 -0.08 0.00 0.00 0.00 178.15 178.91 3gli h GLU 83 N 0.34 0.00 -0.13 2.37 4.81 -0.96 -2.50 114.58 118.50 3gli h GLU 83 Ca -0.11 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.12 3gli h GLU 83 Cb 1.65 0.00 0.00 0.00 0.63 0.00 0.00 28.75 31.03 3gli h GLU 83 CO 0.19 0.00 0.00 1.04 -0.73 0.00 0.00 179.01 179.51 3gli n GLN 84 N -3.85 1.37 0.00 1.92 6.02 -1.12 -4.96 117.38 116.76 3gli n GLN 84 Ca -0.02 -1.46 0.00 0.00 -0.01 0.00 0.00 57.00 55.51 3gli n GLN 84 Cb 0.14 -1.22 0.00 0.00 1.02 0.00 0.00 30.24 30.18 3gli n GLN 84 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3gli n GLY 85 N 0.54 1.91 0.00 1.08 0.00 -0.79 -4.79 105.19 103.15 3gli n GLY 85 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.10 3gli n GLY 85 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3gli n ARG 86 N -1.36 0.00 -2.48 1.61 1.74 -0.60 -4.68 116.66 110.89 3gli n ARG 86 Ca 0.00 0.17 -0.43 0.00 -0.77 0.00 0.00 57.85 56.82 3gli n ARG 86 Cb 0.00 -1.51 -0.02 0.00 -1.02 0.00 0.00 32.46 29.91 3gli n ARG 86 CO 0.00 0.00 0.00 0.12 -1.52 0.00 0.00 177.63 176.23 3gli s PHE 87 N -2.29 2.72 0.63 -1.55 5.36 0.51 -4.90 117.98 118.45 3gli s PHE 87 Ca 0.00 0.83 0.32 0.00 -0.96 0.00 0.00 56.93 57.12 3gli s PHE 87 Cb 0.00 -4.12 1.77 0.00 -0.34 0.00 0.00 43.02 40.33 3gli s PHE 87 CO 0.00 -1.52 2.06 0.28 -1.46 0.00 0.00 175.22 174.58 3gli h VAL 88 N 6.13 0.20 -0.15 3.12 2.07 -1.90 -3.12 116.25 122.61 3gli h VAL 88 Ca -0.25 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.27 3gli h VAL 88 Cb 1.08 0.78 0.00 0.00 -1.52 0.00 0.00 31.29 31.63 3gli h VAL 88 CO 1.07 0.00 0.00 0.47 0.02 0.00 0.00 177.57 179.13 3gli n ASP 89 N -3.33 2.90 -4.05 0.57 8.00 -1.26 -4.53 116.55 114.84 3gli n ASP 89 Ca 0.00 -2.65 -0.34 0.00 0.71 0.00 0.00 54.79 52.51 3gli n ASP 89 Cb 0.34 -0.35 -0.09 0.00 -0.02 0.00 0.00 41.12 41.00 3gli n ASP 89 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 3gli s LEU 90 N -2.15 5.21 -0.35 0.64 2.96 -1.18 -1.61 118.68 122.20 3gli s LEU 90 Ca 0.28 -3.39 -0.28 0.00 -0.22 0.00 0.00 54.13 50.52 3gli s LEU 90 Cb 0.22 -1.82 -0.03 0.00 0.50 0.00 0.00 46.19 45.06 3gli s LEU 90 CO 0.07 -0.23 1.99 -0.63 -1.32 0.00 0.00 176.35 176.23 3gli s ILE 91 N -0.84 3.28 -0.33 6.68 1.01 -0.82 -4.90 121.20 125.28 3gli s ILE 91 Ca 0.22 0.26 -0.09 0.00 0.00 0.00 0.00 60.65 61.05 3gli s ILE 91 Cb -0.13 -3.43 0.01 0.00 0.01 0.00 0.00 42.46 38.93 3gli s ILE 91 CO -0.09 -0.31 0.15 -0.70 0.00 0.00 0.00 174.94 173.99 3gli s GLU 92 N 6.29 3.01 -0.21 2.79 2.12 -1.26 -1.18 118.70 130.26 3gli s GLU 92 Ca 0.86 -0.94 -0.10 0.00 0.36 0.00 0.00 54.97 55.15 3gli s GLU 92 Cb -0.24 -3.56 -0.05 0.00 0.26 0.00 0.00 34.13 30.55 3gli s GLU 92 CO 0.32 -0.55 0.14 0.42 -0.54 0.00 0.00 175.26 175.05 3gli s ILE 93 N 1.54 5.39 -1.00 -3.70 1.01 -0.31 -4.95 121.20 119.18 3gli s ILE 93 Ca 0.02 0.20 -0.20 0.00 0.00 0.00 0.00 60.65 60.68 3gli s ILE 93 Cb -0.18 -3.48 0.10 0.00 0.01 0.00 0.00 42.46 38.90 3gli s ILE 93 CO 0.05 0.41 1.31 -0.62 0.00 0.00 0.00 174.94 176.09 3gli s ASP 94 N 0.54 6.61 0.52 3.58 -1.08 -1.26 -1.99 116.67 123.59 3gli s ASP 94 Ca 0.08 -1.88 0.18 0.00 -0.52 0.00 0.00 52.55 50.41 3gli s ASP 94 Cb -0.12 -2.48 1.31 0.00 -1.46 0.00 0.00 42.92 40.17 3gli s ASP 94 CO -0.00 -1.23 2.14 0.00 0.52 0.00 0.00 175.17 176.59 3gli h ALA 95 N 9.07 2.03 0.00 3.66 0.00 -1.51 0.32 119.26 132.82 3gli h ALA 95 Ca 0.20 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.11 3gli h ALA 95 Cb 1.00 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.79 3gli h ALA 95 CO 1.27 -0.06 -0.00 0.00 0.00 0.00 0.00 179.25 180.45 3gli h ALA 96 N 1.97 1.00 0.00 0.00 0.00 -1.73 -3.13 119.26 117.38 3gli h ALA 96 Ca 0.02 -0.00 -0.39 0.00 0.00 0.00 0.00 54.91 54.54 3gli h ALA 96 Cb 0.10 -0.00 -0.07 0.00 0.00 0.00 0.00 17.79 17.82 3gli h ALA 96 CO -0.00 0.00 -2.44 0.45 0.00 0.00 0.00 179.25 177.26 3gli n SER 97 N -3.10 2.03 -3.77 0.00 2.88 -0.09 -4.72 113.62 106.84 3gli n SER 97 Ca 0.02 -0.06 -0.37 0.00 -1.33 0.00 0.00 58.87 57.13 3gli n SER 97 Cb 0.43 -0.46 -0.02 0.00 -0.75 0.00 0.00 64.21 63.41 3gli n SER 97 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 3gli n ARG 98 N -3.38 3.77 0.05 -1.46 1.74 0.93 -4.83 116.66 113.48 3gli n ARG 98 Ca -0.46 -4.61 0.10 0.00 -0.77 0.00 0.00 57.85 52.11 3gli n ARG 98 Cb 0.96 -2.41 -0.07 0.00 -1.02 0.00 0.00 32.46 29.91 3gli n ARG 98 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 3gli n THR 99 N 1.11 0.46 -1.64 0.55 -2.24 -1.19 -4.72 114.28 106.61 3gli n THR 99 Ca 0.28 -0.55 -0.32 0.00 -2.27 0.00 0.00 64.05 61.19 3gli n THR 99 Cb 0.36 -0.25 0.05 0.00 -2.10 0.00 0.00 70.33 68.39 3gli n THR 99 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 3gli s LYS 100 N -3.36 2.89 0.02 -0.78 1.02 -1.26 -2.40 119.74 115.87 3gli s LYS 100 Ca -0.04 1.09 -0.25 0.00 0.02 0.00 0.00 55.97 56.80 3gli s LYS 100 Cb 0.11 -1.98 -0.18 0.00 -0.52 0.00 0.00 37.83 35.26 3gli s LYS 100 CO 0.84 -1.14 1.45 0.28 -0.92 0.00 0.00 175.35 175.86 3gli h VAL 101 N -0.45 1.20 -0.52 3.17 2.07 -1.94 -2.23 116.25 117.56 3gli h VAL 101 Ca -0.45 -0.67 0.10 0.00 0.82 0.00 0.00 66.70 66.51 3gli h VAL 101 Cb 1.22 1.65 -0.09 0.00 -1.52 0.00 0.00 31.29 32.55 3gli h VAL 101 CO 0.56 0.17 -0.02 -0.33 0.02 0.00 0.00 177.57 177.97 3gli h GLU 102 N -0.31 0.10 -0.76 1.57 4.39 -1.98 0.98 114.58 118.57 3gli h GLU 102 Ca -0.00 -0.01 0.12 0.00 0.34 0.00 0.00 59.36 59.82 3gli h GLU 102 Cb 0.30 -0.02 -0.13 0.00 -0.10 0.00 0.00 28.75 28.79 3gli h GLU 102 CO 0.00 0.06 -0.36 -0.44 -1.16 0.00 0.00 179.01 177.12 3gli h ASP 103 N 0.10 -1.28 0.90 1.42 3.32 -1.86 -0.74 116.42 118.28 3gli h ASP 103 Ca 0.26 0.26 0.00 0.00 0.02 0.00 0.00 57.03 57.58 3gli h ASP 103 Cb 0.40 0.65 0.00 0.00 0.22 0.00 0.00 39.33 40.61 3gli h ASP 103 CO -0.45 -0.30 -0.30 0.35 -1.72 0.00 0.00 179.24 176.82 3gli n THR 104 N -5.45 0.19 0.17 0.35 -2.24 0.49 -2.63 114.28 105.16 3gli n THR 104 Ca 0.07 -0.11 0.04 0.00 -2.27 0.00 0.00 64.05 61.77 3gli n THR 104 Cb 0.37 -0.20 0.22 0.00 -2.10 0.00 0.00 70.33 68.62 3gli n THR 104 CO 0.00 0.00 0.00 0.03 -0.57 0.00 0.00 175.07 174.53 3gli h ARG 105 N 0.00 0.00 -0.20 -0.78 3.08 0.23 -1.57 114.38 115.14 3gli h ARG 105 Ca 0.00 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.03 3gli h ARG 105 Cb 0.60 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.64 3gli h ARG 105 CO 0.00 0.45 0.04 -0.44 -1.07 0.00 0.00 179.97 178.94 3gli h ASP 106 N 0.00 0.30 -0.47 7.04 3.32 -1.09 -1.87 116.42 123.66 3gli h ASP 106 Ca -0.00 -0.25 0.09 0.00 0.02 0.00 0.00 57.03 56.88 3gli h ASP 106 Cb 1.10 -0.08 -0.10 0.00 0.22 0.00 0.00 39.33 40.47 3gli h ASP 106 CO 0.06 0.47 -0.34 0.25 -1.72 0.00 0.00 179.24 177.96 3gli h LEU 107 N 0.12 -1.15 -0.71 1.55 7.12 -1.42 -1.23 115.31 119.58 3gli h LEU 107 Ca 0.06 0.21 0.03 0.00 0.13 0.00 0.00 57.88 58.30 3gli h LEU 107 Cb 0.29 0.55 -0.04 0.00 -0.53 0.00 0.00 40.66 40.93 3gli h LEU 107 CO 0.00 -0.32 0.45 -0.07 -0.13 0.00 0.00 178.44 178.37 3gli h LEU 108 N -0.23 0.74 -1.09 2.25 3.38 -1.03 -2.86 115.31 116.46 3gli h LEU 108 Ca 0.19 -0.00 -0.07 0.00 0.09 0.00 0.00 57.88 58.08 3gli h LEU 108 Cb 0.55 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.12 3gli h LEU 108 CO -0.59 0.51 -0.13 0.44 0.09 0.00 0.00 178.44 178.76 3gli h ASP 109 N 0.87 0.48 -0.28 -0.43 3.32 -0.41 -1.59 116.42 118.39 3gli h ASP 109 Ca 0.28 -0.12 0.00 0.00 0.02 0.00 0.00 57.03 57.21 3gli h ASP 109 Cb 0.01 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 39.43 3gli h ASP 109 CO -0.10 0.64 0.00 0.59 -1.72 0.00 0.00 179.24 178.64 3gli n ASN 110 N -4.20 3.00 -0.06 6.45 4.13 -0.90 -3.83 115.26 119.84 3gli n ASN 110 Ca 0.01 -2.37 -0.04 0.00 1.68 0.00 0.00 54.58 53.85 3gli n ASN 110 Cb 0.32 -0.53 -0.03 0.00 -1.54 0.00 0.00 39.78 38.00 3gli n ASN 110 CO 0.00 0.00 0.00 0.58 0.28 0.00 0.00 177.26 178.12 3gli h VAL 111 N 1.88 0.24 -1.72 2.41 2.07 -1.17 -3.36 116.25 116.60 3gli h VAL 111 Ca 0.00 -1.22 0.53 0.00 0.82 0.00 0.00 66.70 66.83 3gli h VAL 111 Cb 1.08 0.49 -0.10 0.00 -1.52 0.00 0.00 31.29 31.24 3gli h VAL 111 CO 0.20 0.08 1.19 0.06 0.02 0.00 0.00 177.57 179.12 3gli h GLN 112 N -1.00 0.01 -6.46 1.57 3.07 -1.70 -3.40 115.11 107.20 3gli h GLN 112 Ca -0.02 -0.00 -0.54 0.00 0.09 0.00 0.00 58.65 58.18 3gli h GLN 112 Cb 0.36 -0.00 0.01 0.00 0.08 0.00 0.00 27.48 27.93 3gli h GLN 112 CO -0.02 0.00 0.73 0.71 0.09 0.00 0.00 178.83 180.35 3gli s TYR 113 N -5.03 3.14 0.88 0.06 4.12 -1.26 -5.00 117.35 114.25 3gli s TYR 113 Ca -0.06 0.98 -0.12 0.00 0.02 0.00 0.00 57.07 57.89 3gli s TYR 113 Cb 0.29 -3.61 0.09 0.00 -1.52 0.00 0.00 41.96 37.20 3gli s TYR 113 CO 0.87 -2.15 0.96 0.00 0.02 0.00 0.00 175.55 175.25 3gli n ALA 114 N 4.50 -1.00 -1.81 3.71 0.00 -1.26 -4.96 120.51 119.69 3gli n ALA 114 Ca 0.12 -0.48 -0.32 0.00 0.00 0.00 0.00 53.44 52.76 3gli n ALA 114 Cb 0.44 -2.10 -0.02 0.00 0.00 0.00 0.00 19.45 17.76 3gli n ALA 114 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3gli s PRO 115 N -4.12 3.78 0.00 0.00 0.04 -1.26 -5.05 135.00 128.39 3gli s PRO 115 Ca 0.67 0.98 0.00 0.00 0.04 0.00 0.00 61.00 62.69 3gli s PRO 115 Cb -0.25 -2.11 0.00 0.00 0.04 0.00 0.00 34.50 32.18 3gli s PRO 115 CO 0.58 -0.41 0.00 0.00 0.04 0.00 0.00 177.00 177.20 3gli n ALA 116 N -1.80 0.00 -0.61 8.56 0.00 -1.26 -4.56 120.51 120.83 3gli n ALA 116 Ca 0.07 0.00 0.09 0.00 0.00 0.00 0.00 53.44 53.60 3gli n ALA 116 Cb 0.54 0.00 0.36 0.00 0.00 0.00 0.00 19.45 20.35 3gli n ALA 116 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 3gli n ARG 117 N 0.00 3.92 -4.51 0.00 0.63 -1.26 -4.95 116.66 110.48 3gli n ARG 117 Ca 0.00 -2.86 -0.29 0.00 -0.92 0.00 0.00 57.85 53.78 3gli n ARG 117 Cb 0.00 -1.96 -0.08 0.00 0.45 0.00 0.00 32.46 30.86 3gli n ARG 117 CO 0.00 0.00 0.00 0.20 -2.51 0.00 0.00 177.63 175.32 3gli s GLY 118 N -0.85 2.66 -0.09 5.14 0.00 -1.26 -5.05 107.32 107.87 3gli s GLY 118 Ca 0.51 -1.44 -0.11 0.00 0.00 0.00 0.00 44.72 43.67 3gli s GLY 118 CO 0.22 -2.09 0.54 -0.09 0.00 0.00 0.00 173.10 171.69 3gli h ARG 119 N 1.45 0.31 -6.85 2.90 2.43 -1.89 -3.44 114.38 109.29 3gli h ARG 119 Ca -0.43 -0.54 -0.69 0.00 -0.81 0.00 0.00 59.98 57.52 3gli h ARG 119 Cb 1.28 0.20 -0.22 0.00 -0.42 0.00 0.00 29.97 30.81 3gli h ARG 119 CO 0.74 1.26 -0.86 -0.06 -1.51 0.00 0.00 179.97 179.54 3gli s PHE 120 N -2.54 2.36 -0.30 2.20 0.08 -1.26 -4.91 117.98 113.61 3gli s PHE 120 Ca -0.19 -0.36 -0.17 0.00 0.12 0.00 0.00 56.93 56.33 3gli s PHE 120 Cb 0.06 -1.29 -0.02 0.00 -0.57 0.00 0.00 43.02 41.20 3gli s PHE 120 CO 0.80 0.32 0.48 0.21 -0.10 0.00 0.00 175.22 176.93 3gli s LYS 121 N -1.97 3.86 -0.33 0.44 2.20 0.16 -4.84 119.74 119.26 3gli s LYS 121 Ca 0.14 0.04 -0.01 0.00 -0.36 0.00 0.00 55.97 55.79 3gli s LYS 121 Cb -0.10 -3.72 0.08 0.00 -1.51 0.00 0.00 37.83 32.58 3gli s LYS 121 CO 0.06 -0.46 0.06 0.08 -0.36 0.00 0.00 175.35 174.73 3gli s VAL 122 N 2.28 2.88 0.17 4.02 1.01 -0.64 -1.24 120.40 128.89 3gli s VAL 122 Ca 0.18 -1.75 -0.30 0.00 0.00 0.00 0.00 61.98 60.11 3gli s VAL 122 Cb -0.16 -2.83 -0.07 0.00 0.00 0.00 0.00 36.38 33.32 3gli s VAL 122 CO 0.11 -0.35 0.96 -0.31 0.00 0.00 0.00 175.10 175.51 3gli s TYR 123 N 1.15 3.88 -0.49 5.22 1.51 -0.40 -1.95 117.35 126.27 3gli s TYR 123 Ca 0.01 1.84 0.03 0.00 -1.01 0.00 0.00 57.07 57.94 3gli s TYR 123 Cb -0.21 -3.03 0.14 0.00 -0.11 0.00 0.00 41.96 38.75 3gli s TYR 123 CO -0.03 0.28 0.29 -1.17 -1.11 0.00 0.00 175.55 173.80 3gli s LEU 124 N -0.55 3.29 -0.14 -1.29 2.96 -0.32 0.36 118.68 122.99 3gli s LEU 124 Ca 0.44 -2.92 -0.29 0.00 -0.22 0.00 0.00 54.13 51.14 3gli s LEU 124 Cb -0.25 -1.22 -0.01 0.00 0.50 0.00 0.00 46.19 45.21 3gli s LEU 124 CO 0.31 -0.23 1.12 -0.63 -1.32 0.00 0.00 176.35 175.61 3gli s ILE 125 N -0.08 4.50 0.08 6.68 1.09 -0.25 -1.16 121.20 132.06 3gli s ILE 125 Ca 0.20 1.81 0.09 0.00 -1.10 0.00 0.00 60.65 61.64 3gli s ILE 125 Cb -0.20 -4.16 -0.03 0.00 -1.06 0.00 0.00 42.46 37.00 3gli s ILE 125 CO -0.04 -0.08 -0.23 -0.62 -0.10 0.00 0.00 174.94 173.88 3gli s ASP 126 N 1.43 2.78 -1.36 3.58 2.15 -0.84 -1.78 116.67 122.62 3gli s ASP 126 Ca 0.51 -0.63 -0.04 0.00 0.43 0.00 0.00 52.55 52.81 3gli s ASP 126 Cb -0.20 -0.20 0.00 0.00 -0.30 0.00 0.00 42.92 42.23 3gli s ASP 126 CO 0.15 0.15 0.54 -0.62 -0.17 0.00 0.00 175.17 175.22 3gli n GLU 127 N 1.41 -4.32 0.22 4.34 -0.58 -0.59 -1.50 120.64 119.61 3gli n GLU 127 Ca -0.18 0.80 0.15 0.00 -0.42 0.00 0.00 57.16 57.51 3gli n GLU 127 Cb 0.53 -5.42 0.72 0.00 -0.57 0.00 0.00 31.44 26.70 3gli n GLU 127 CO 0.00 0.00 0.00 -0.24 -0.48 0.00 0.00 177.13 176.41 3gli h VAL 128 N -1.23 0.00 0.00 2.62 3.04 -1.69 -2.54 116.25 116.45 3gli h VAL 128 Ca -0.47 -0.18 0.00 0.00 -1.01 0.00 0.00 66.70 65.04 3gli h VAL 128 Cb 1.32 0.96 0.00 0.00 -2.01 0.00 0.00 31.29 31.56 3gli h VAL 128 CO 0.50 0.00 0.00 0.00 -1.01 0.00 0.00 177.57 177.06 3gli n HIS 129 N -2.62 0.00 0.71 3.17 1.44 -1.26 -2.76 115.22 113.91 3gli n HIS 129 Ca -0.00 0.00 0.08 0.00 -2.01 0.00 0.00 57.72 55.79 3gli n HIS 129 Cb 0.16 0.00 -0.10 0.00 0.12 0.00 0.00 29.99 30.16 3gli n HIS 129 CO 0.00 0.00 0.00 -1.33 -2.81 0.00 0.00 176.34 172.20 3gli n MET 130 N -0.91 1.12 -1.69 -1.40 2.81 -0.95 -4.86 117.12 111.23 3gli n MET 130 Ca 0.07 -0.02 -0.44 0.00 -1.81 0.00 0.00 57.70 55.49 3gli n MET 130 Cb 0.03 -1.34 -0.03 0.00 -0.71 0.00 0.00 33.22 31.17 3gli n MET 130 CO 0.00 0.00 0.00 1.28 1.51 0.00 0.00 175.97 178.76 3gli n LEU 131 N -1.51 3.40 -4.14 4.03 4.77 -1.11 -4.83 117.00 117.61 3gli n LEU 131 Ca 0.02 1.10 -0.35 0.00 -0.03 0.00 0.00 56.01 56.75 3gli n LEU 131 Cb 0.30 -1.47 0.07 0.00 -2.33 0.00 0.00 43.42 39.99 3gli n LEU 131 CO 0.36 -0.20 -1.04 -1.54 -1.33 0.00 0.00 177.39 173.64 3gli n SER 132 N 3.04 -4.13 -0.13 -1.43 3.41 -1.01 -4.64 113.62 108.74 3gli n SER 132 Ca 0.14 0.16 -0.04 0.00 -0.26 0.00 0.00 58.87 58.87 3gli n SER 132 Cb 0.31 -0.86 0.02 0.00 -0.26 0.00 0.00 64.21 63.42 3gli n SER 132 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 3gli h ARG 133 N -1.26 0.01 -0.33 4.33 2.43 -1.92 -2.08 114.38 115.57 3gli h ARG 133 Ca -0.44 -0.00 -0.04 0.00 -0.81 0.00 0.00 59.98 58.68 3gli h ARG 133 Cb 1.32 -0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.85 3gli h ARG 133 CO 0.27 0.01 0.01 0.45 -1.51 0.00 0.00 179.97 179.20 3gli h HIS 134 N 0.01 0.51 -0.40 2.20 3.86 -1.95 -2.14 115.15 117.25 3gli h HIS 134 Ca 0.20 -0.05 -0.14 0.00 -1.16 0.00 0.00 60.37 59.23 3gli h HIS 134 Cb 0.31 -0.15 -0.01 0.00 1.06 0.00 0.00 27.41 28.61 3gli h HIS 134 CO -0.36 0.50 -0.29 0.77 0.86 0.00 0.00 177.93 179.41 3gli h SER 135 N 0.48 0.90 0.67 2.45 0.02 -1.70 -1.74 113.55 114.62 3gli h SER 135 Ca 0.11 -0.37 -0.03 0.00 -0.84 0.00 0.00 61.79 60.67 3gli h SER 135 Cb 0.30 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 62.58 3gli h SER 135 CO 0.01 1.12 -0.50 -0.26 -1.14 0.00 0.00 176.83 176.06 3gli h PHE 136 N 0.73 -1.34 -0.93 3.45 -1.00 -0.74 -3.05 116.94 114.05 3gli h PHE 136 Ca 0.08 -0.00 0.14 0.00 2.81 0.00 0.00 57.97 61.00 3gli h PHE 136 Cb 0.85 0.50 -0.08 0.00 3.61 0.00 0.00 35.95 40.83 3gli h PHE 136 CO 0.05 -0.71 0.59 -0.91 -1.61 0.00 0.00 178.31 175.73 3gli h ASN 137 N -1.12 0.75 -0.59 2.17 2.35 -1.33 -0.55 115.58 117.27 3gli h ASN 137 Ca -0.09 0.04 0.11 0.00 -0.55 0.00 0.00 56.30 55.82 3gli h ASN 137 Cb 0.93 -0.10 -0.11 0.00 0.05 0.00 0.00 38.32 39.08 3gli h ASN 137 CO 0.03 0.38 -0.26 0.00 -1.65 0.00 0.00 177.43 175.94 3gli h ALA 138 N 1.58 0.15 0.00 -0.83 0.00 -1.23 -1.17 119.26 117.76 3gli h ALA 138 Ca 0.47 0.20 -0.03 0.00 0.00 0.00 0.00 54.91 55.55 3gli h ALA 138 Cb 0.65 0.64 -0.00 0.00 0.00 0.00 0.00 17.79 19.07 3gli h ALA 138 CO -0.23 -0.57 -0.13 -0.07 0.00 0.00 0.00 179.25 178.25 3gli h LEU 139 N -0.11 0.00 -0.65 0.00 3.38 -1.00 -3.32 115.31 113.61 3gli h LEU 139 Ca 0.26 0.00 0.10 0.00 0.09 0.00 0.00 57.88 58.33 3gli h LEU 139 Cb 0.52 0.00 -0.12 0.00 0.09 0.00 0.00 40.66 41.15 3gli h LEU 139 CO -0.65 0.13 -0.40 -0.07 0.09 0.00 0.00 178.44 177.53 3gli h LEU 140 N 0.00 -1.39 -1.10 1.67 3.38 -1.05 0.47 115.31 117.28 3gli h LEU 140 Ca -0.00 0.25 -0.08 0.00 0.09 0.00 0.00 57.88 58.14 3gli h LEU 140 Cb 0.30 0.66 -0.01 0.00 0.09 0.00 0.00 40.66 41.70 3gli h LEU 140 CO 0.02 -0.32 -0.24 0.11 0.09 0.00 0.00 178.44 178.10 3gli h LYS 141 N -0.17 0.34 0.10 1.13 1.79 -1.74 -2.33 116.57 115.70 3gli h LYS 141 Ca 0.22 -0.11 -0.21 0.00 -2.18 0.00 0.00 60.65 58.36 3gli h LYS 141 Cb 0.56 -0.03 0.00 0.00 -1.58 0.00 0.00 32.23 31.19 3gli h LYS 141 CO -0.73 0.56 -1.04 1.15 -1.08 0.00 0.00 179.45 178.31 3gli h THR 142 N 0.30 1.28 -0.38 -0.16 2.02 -1.44 -3.09 112.91 111.44 3gli h THR 142 Ca 0.05 -2.43 0.10 0.00 0.77 0.00 0.00 66.41 64.90 3gli h THR 142 Cb 0.60 2.92 -0.02 0.00 -1.74 0.00 0.00 68.15 69.91 3gli h THR 142 CO 0.04 0.67 0.27 0.25 0.37 0.00 0.00 175.52 177.12 3gli h LEU 143 N -0.46 0.05 0.00 2.58 5.85 -0.07 0.39 115.31 123.65 3gli h LEU 143 Ca -0.22 0.00 -0.23 0.00 0.84 0.00 0.00 57.88 58.27 3gli h LEU 143 Cb 1.60 -0.01 -0.04 0.00 0.37 0.00 0.00 40.66 42.58 3gli h LEU 143 CO 0.06 0.03 -1.30 -0.08 -0.34 0.00 0.00 178.44 176.81 3gli h GLU 144 N 0.06 0.00 -1.42 1.25 4.81 -1.52 -3.42 114.58 114.34 3gli h GLU 144 Ca 0.18 0.00 -0.42 0.00 -0.13 0.00 0.00 59.36 58.99 3gli h GLU 144 Cb 0.64 0.00 -0.40 0.00 0.63 0.00 0.00 28.75 29.62 3gli h GLU 144 CO -0.01 0.68 -1.18 0.39 -0.73 0.00 0.00 179.01 178.15 3gli n GLU 145 N -3.17 1.16 -0.82 1.92 1.02 -0.37 -5.12 120.64 115.26 3gli n GLU 145 Ca -0.08 -3.35 -0.30 0.00 -0.02 0.00 0.00 57.16 53.41 3gli n GLU 145 Cb 0.96 -1.46 0.25 0.00 -0.02 0.00 0.00 31.44 31.17 3gli n GLU 145 CO 0.00 0.00 0.00 -2.14 1.18 0.00 0.00 177.13 176.17 3gli s PRO 146 N -2.87 -1.44 0.35 3.49 0.02 -0.01 -4.86 135.00 129.68 3gli s PRO 146 Ca 0.33 0.20 -0.23 0.00 0.02 0.00 0.00 61.00 61.32 3gli s PRO 146 Cb 0.41 -1.55 -0.10 0.00 0.02 0.00 0.00 34.50 33.29 3gli s PRO 146 CO -0.01 -3.91 0.90 -2.14 -0.33 0.00 0.00 177.00 171.51 3gli s PRO 147 N -5.11 4.37 0.59 5.54 0.02 -1.26 -4.93 135.00 134.22 3gli s PRO 147 Ca 0.69 1.15 0.29 0.00 0.02 0.00 0.00 61.00 63.14 3gli s PRO 147 Cb -0.14 -2.56 1.52 0.00 0.02 0.00 0.00 34.50 33.33 3gli s PRO 147 CO 0.58 0.17 1.94 1.05 -0.33 0.00 0.00 177.00 180.42 3gli h GLU 148 N 2.68 0.00 -0.31 5.54 4.11 -2.00 0.31 114.58 124.91 3gli h GLU 148 Ca -0.48 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.95 3gli h GLU 148 Cb 1.19 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.44 3gli h GLU 148 CO 0.64 0.00 0.00 -2.39 0.07 0.00 0.00 179.01 177.33 3gli n HIS 149 N -3.72 0.40 -4.80 2.06 1.44 -1.26 -4.85 115.22 104.50 3gli n HIS 149 Ca 0.07 -0.20 -0.32 0.00 -2.01 0.00 0.00 57.72 55.26 3gli n HIS 149 Cb 0.59 0.00 -0.13 0.00 0.12 0.00 0.00 29.99 30.57 3gli n HIS 149 CO 0.00 0.00 0.00 0.08 -2.81 0.00 0.00 176.34 173.61 3gli s VAL 150 N -1.60 2.88 -0.04 0.61 1.01 0.11 -0.66 120.40 122.72 3gli s VAL 150 Ca 0.26 -0.97 0.01 0.00 0.00 0.00 0.00 61.98 61.28 3gli s VAL 150 Cb 0.14 -2.16 0.02 0.00 0.00 0.00 0.00 36.38 34.37 3gli s VAL 150 CO 0.19 0.46 -0.05 -0.54 0.00 0.00 0.00 175.10 175.15 3gli s LYS 151 N -1.09 0.81 -0.17 2.72 -0.14 -0.37 -4.80 119.74 116.69 3gli s LYS 151 Ca 0.13 -0.15 -0.04 0.00 -1.36 0.00 0.00 55.97 54.54 3gli s LYS 151 Cb -0.11 -0.79 -0.03 0.00 -1.68 0.00 0.00 37.83 35.22 3gli s LYS 151 CO 0.03 -0.02 -0.02 -0.06 -0.76 0.00 0.00 175.35 174.53 3gli s PHE 152 N 0.64 3.05 -0.24 3.18 2.99 0.28 -1.28 117.98 126.60 3gli s PHE 152 Ca -0.09 -0.32 0.02 0.00 0.00 0.00 0.00 56.93 56.54 3gli s PHE 152 Cb -0.12 -2.01 0.04 0.00 0.00 0.00 0.00 43.02 40.93 3gli s PHE 152 CO 0.00 -0.09 -0.12 -0.51 -0.00 0.00 0.00 175.22 174.50 3gli s LEU 153 N 0.58 3.07 -0.26 -0.37 1.43 0.16 -0.73 118.68 122.56 3gli s LEU 153 Ca -0.02 -1.12 -0.03 0.00 -1.03 0.00 0.00 54.13 51.93 3gli s LEU 153 Cb -0.14 -1.55 0.02 0.00 0.03 0.00 0.00 46.19 44.55 3gli s LEU 153 CO 0.02 -0.13 -0.01 -0.76 0.23 0.00 0.00 176.35 175.70 3gli s LEU 154 N 1.19 3.38 -0.02 1.79 1.43 0.55 -1.09 118.68 125.91 3gli s LEU 154 Ca -0.04 -0.78 0.07 0.00 -1.03 0.00 0.00 54.13 52.34 3gli s LEU 154 Cb -0.18 -1.74 -0.02 0.00 0.03 0.00 0.00 46.19 44.29 3gli s LEU 154 CO -0.07 -0.14 -0.23 0.00 0.23 0.00 0.00 176.35 176.14 3gli s ALA 155 N 1.39 1.89 0.02 4.21 0.00 -0.73 0.26 121.76 128.80 3gli s ALA 155 Ca 0.01 -0.97 -0.28 0.00 0.00 0.00 0.00 51.96 50.72 3gli s ALA 155 Cb -0.17 -0.50 0.07 0.00 0.00 0.00 0.00 23.12 22.52 3gli s ALA 155 CO -0.02 0.44 0.67 -0.08 0.00 0.00 0.00 175.76 176.77 3gli s THR 156 N -0.45 0.00 0.13 0.00 -1.32 -0.60 -1.54 115.64 111.86 3gli s THR 156 Ca 0.06 0.00 -0.03 0.00 -1.21 0.00 0.00 61.69 60.51 3gli s THR 156 Cb -0.10 -1.00 -0.18 0.00 -1.51 0.00 0.00 72.50 69.71 3gli s THR 156 CO -0.00 0.00 1.31 0.74 -2.21 0.00 0.00 174.62 174.45 3gli h THR 157 N 2.64 1.42 -2.18 5.08 2.02 -1.86 -3.29 112.91 116.74 3gli h THR 157 Ca -0.29 -2.50 -0.59 0.00 0.77 0.00 0.00 66.41 63.80 3gli h THR 157 Cb 1.20 2.45 -0.42 0.00 -1.74 0.00 0.00 68.15 69.64 3gli h THR 157 CO 0.38 0.74 -0.65 -0.67 0.37 0.00 0.00 175.52 175.70 3gli n ASP 158 N -3.72 3.46 0.23 4.18 2.03 -1.26 -4.28 116.55 117.19 3gli n ASP 158 Ca -0.06 -3.39 0.16 0.00 0.52 0.00 0.00 54.79 52.02 3gli n ASP 158 Cb 0.84 -0.66 0.74 0.00 -0.72 0.00 0.00 41.12 41.32 3gli n ASP 158 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 3gli h PRO 159 N 4.04 0.00 -0.99 -0.67 0.13 -1.97 -2.04 132.00 130.50 3gli h PRO 159 Ca 0.18 0.00 0.32 0.00 -0.87 0.00 0.00 66.00 65.63 3gli h PRO 159 Cb 0.67 0.00 -0.18 0.00 0.13 0.00 0.00 31.00 31.62 3gli h PRO 159 CO 0.80 0.00 0.19 1.96 -0.23 0.00 0.00 178.00 180.72 3gli h GLN 160 N 0.00 0.01 -0.00 0.86 1.08 -1.97 -2.26 115.11 112.82 3gli h GLN 160 Ca 0.00 -0.00 -0.14 0.00 -1.45 0.00 0.00 58.65 57.06 3gli h GLN 160 Cb 0.27 -0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 27.68 3gli h GLN 160 CO 0.00 0.01 -0.64 0.87 -0.95 0.00 0.00 178.83 178.12 3gli h LYS 161 N 0.01 0.01 -6.80 1.46 1.57 -1.74 -3.44 116.57 107.65 3gli h LYS 161 Ca 0.68 -0.01 -0.53 0.00 -1.87 0.00 0.00 60.65 58.92 3gli h LYS 161 Cb 1.55 0.00 0.07 0.00 0.08 0.00 0.00 32.23 33.94 3gli h LYS 161 CO -0.88 0.65 0.78 -0.51 -0.57 0.00 0.00 179.45 178.93 3gli s LEU 162 N -7.58 4.37 0.29 2.94 1.43 -0.85 -4.95 118.68 114.34 3gli s LEU 162 Ca -0.01 2.79 -0.26 0.00 -1.03 0.00 0.00 54.13 55.62 3gli s LEU 162 Cb 0.12 -3.63 -0.15 0.00 0.03 0.00 0.00 46.19 42.56 3gli s LEU 162 CO 0.77 -0.76 0.64 -2.65 0.23 0.00 0.00 176.35 174.58 3gli n PRO 163 N 1.92 0.55 0.16 1.29 -0.02 -1.26 -4.83 135.00 132.81 3gli n PRO 163 Ca 0.06 0.19 0.13 0.00 -2.02 0.00 0.00 63.50 61.86 3gli n PRO 163 Cb 0.39 -1.37 0.55 0.00 -0.02 0.00 0.00 33.50 33.05 3gli n PRO 163 CO 0.00 0.00 0.00 -0.24 1.98 0.00 0.00 175.50 177.24 3gli h VAL 164 N 1.20 0.00 -0.03 -1.45 3.04 -1.94 -1.64 116.25 115.44 3gli h VAL 164 Ca -0.35 -0.27 -0.17 0.00 -1.01 0.00 0.00 66.70 64.90 3gli h VAL 164 Cb 1.40 1.05 -0.01 0.00 -2.01 0.00 0.00 31.29 31.71 3gli h VAL 164 CO 0.56 0.00 -0.73 0.71 -1.01 0.00 0.00 177.57 177.10 3gli h THR 165 N 0.00 1.45 -0.20 3.17 1.35 -1.99 -0.45 112.91 116.25 3gli h THR 165 Ca 0.00 -2.32 -0.08 0.00 -0.55 0.00 0.00 66.41 63.46 3gli h THR 165 Cb 0.37 2.24 -0.00 0.00 -1.73 0.00 0.00 68.15 69.03 3gli h THR 165 CO 0.00 0.68 -0.20 0.40 -0.25 0.00 0.00 175.52 176.14 3gli h ILE 166 N 0.11 1.33 -0.52 6.82 1.08 -1.67 -3.28 117.51 121.38 3gli h ILE 166 Ca -0.02 -1.37 -0.06 0.00 -0.39 0.00 0.00 64.86 63.02 3gli h ILE 166 Cb 1.29 1.76 -0.02 0.00 -3.07 0.00 0.00 36.82 36.78 3gli h ILE 166 CO 0.11 0.42 0.08 -0.07 -0.69 0.00 0.00 178.15 177.99 3gli h LEU 167 N 0.16 0.83 -1.21 1.44 3.38 -1.28 -1.74 115.31 116.90 3gli h LEU 167 Ca 0.03 -0.26 0.00 0.00 0.09 0.00 0.00 57.88 57.74 3gli h LEU 167 Cb 0.75 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.28 3gli h LEU 167 CO 0.05 0.89 0.22 -1.28 0.09 0.00 0.00 178.44 178.41 3gli h SER 168 N 0.75 0.00 -0.38 -0.43 0.87 -1.14 -1.65 113.55 111.57 3gli h SER 168 Ca 0.16 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.72 3gli h SER 168 Cb 0.41 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.37 3gli h SER 168 CO 0.01 0.00 0.00 0.54 -0.53 0.00 0.00 176.83 176.85 3gli n ARG 169 N -2.23 2.37 -4.43 2.24 1.74 -0.65 -5.01 116.66 110.67 3gli n ARG 169 Ca -0.01 -2.11 -0.22 0.00 -0.77 0.00 0.00 57.85 54.74 3gli n ARG 169 Cb 0.25 -1.40 -0.10 0.00 -1.02 0.00 0.00 32.46 30.19 3gli n ARG 169 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3gli s LEU 171 N -3.45 4.37 -0.11 0.00 1.43 -0.32 -4.94 118.68 115.66 3gli s LEU 171 Ca 0.28 0.96 -0.00 0.00 -1.03 0.00 0.00 54.13 54.34 3gli s LEU 171 Cb 0.01 -2.74 -0.02 0.00 0.03 0.00 0.00 46.19 43.47 3gli s LEU 171 CO 0.12 0.11 -0.09 -1.58 0.23 0.00 0.00 176.35 175.14 3gli s GLN 172 N -0.02 3.18 -0.29 1.70 0.74 -1.26 0.02 119.66 123.73 3gli s GLN 172 Ca 0.27 -0.60 0.01 0.00 0.05 0.00 0.00 55.36 55.09 3gli s GLN 172 Cb -0.16 -2.67 0.08 0.00 1.10 0.00 0.00 33.01 31.36 3gli s GLN 172 CO 0.13 0.40 0.02 -0.06 -0.55 0.00 0.00 175.29 175.23 3gli s PHE 173 N -0.11 2.58 -0.12 1.67 0.08 -0.58 -4.99 117.98 116.51 3gli s PHE 173 Ca 0.00 -2.10 -0.28 0.00 0.12 0.00 0.00 56.93 54.67 3gli s PHE 173 Cb -0.13 -2.00 -0.01 0.00 -0.57 0.00 0.00 43.02 40.30 3gli s PHE 173 CO 0.03 -0.85 0.96 -1.58 -0.10 0.00 0.00 175.22 173.68 3gli s HIS 174 N 1.32 3.49 0.17 0.36 5.65 -1.26 -1.47 115.29 123.56 3gli s HIS 174 Ca 0.04 1.51 -0.26 0.00 0.25 0.00 0.00 55.06 56.59 3gli s HIS 174 Cb -0.18 -3.14 -0.08 0.00 -1.18 0.00 0.00 32.58 28.00 3gli s HIS 174 CO -0.12 -0.22 0.81 -0.51 -0.65 0.00 0.00 174.74 174.05 3gli s LEU 175 N 2.03 4.60 0.59 8.88 1.43 0.26 -4.92 118.68 131.54 3gli s LEU 175 Ca 0.46 1.70 -0.09 0.00 -1.03 0.00 0.00 54.13 55.16 3gli s LEU 175 Cb -0.18 -3.36 -0.03 0.00 0.03 0.00 0.00 46.19 42.65 3gli s LEU 175 CO 0.16 0.18 0.97 -0.54 0.23 0.00 0.00 176.35 177.36 3gli s LYS 176 N -1.07 3.48 0.63 1.70 1.02 -1.26 -4.51 119.74 119.74 3gli s LYS 176 Ca 0.37 0.55 -0.16 0.00 0.02 0.00 0.00 55.97 56.75 3gli s LYS 176 Cb -0.24 -2.16 -0.01 0.00 -0.52 0.00 0.00 37.83 34.90 3gli s LYS 176 CO 0.27 -0.53 1.10 0.00 -0.92 0.00 0.00 175.35 175.28 3gli s ALA 177 N -3.08 2.54 0.02 5.17 0.00 -1.26 -4.87 121.76 120.28 3gli s ALA 177 Ca 0.53 0.55 -0.30 0.00 0.00 0.00 0.00 51.96 52.74 3gli s ALA 177 Cb -0.11 -3.31 -0.04 0.00 0.00 0.00 0.00 23.12 19.67 3gli s ALA 177 CO 0.51 -1.13 1.02 -0.51 0.00 0.00 0.00 175.76 175.65 3gli s LEU 178 N -4.68 4.37 0.35 0.00 1.43 0.32 -4.98 118.68 115.49 3gli s LEU 178 Ca 0.67 1.73 -0.26 0.00 -1.03 0.00 0.00 54.13 55.24 3gli s LEU 178 Cb -0.20 -3.57 -0.13 0.00 0.03 0.00 0.00 46.19 42.32 3gli s LEU 178 CO 0.39 -0.29 1.00 -0.67 0.23 0.00 0.00 176.35 177.01 3gli n ASP 179 N 3.87 1.26 -0.24 2.29 -0.08 -1.26 -4.33 116.55 118.06 3gli n ASP 179 Ca 0.06 1.11 0.02 0.00 -1.51 0.00 0.00 54.79 54.48 3gli n ASP 179 Cb 0.50 -1.32 0.11 0.00 2.34 0.00 0.00 41.12 42.75 3gli n ASP 179 CO 0.00 0.00 0.00 0.58 0.12 0.00 0.00 177.20 177.90 3gli h VAL 180 N 1.79 0.36 0.54 5.18 2.07 -1.93 -1.47 116.25 122.79 3gli h VAL 180 Ca -0.42 -0.02 -0.02 0.00 0.82 0.00 0.00 66.70 67.06 3gli h VAL 180 Cb 1.34 0.30 0.00 0.00 -1.52 0.00 0.00 31.29 31.41 3gli h VAL 180 CO 0.59 0.01 -0.29 -0.08 0.02 0.00 0.00 177.57 177.82 3gli h GLU 181 N 0.05 -0.74 -0.99 1.57 4.57 -1.95 -2.05 114.58 115.03 3gli h GLU 181 Ca 0.36 0.05 0.18 0.00 -1.18 0.00 0.00 59.36 58.77 3gli h GLU 181 Cb 0.59 0.17 -0.18 0.00 -0.16 0.00 0.00 28.75 29.17 3gli h GLU 181 CO -0.66 -0.49 -0.30 1.04 -1.18 0.00 0.00 179.01 177.41 3gli n GLN 182 N -5.43 -0.15 -0.18 1.92 6.02 -0.71 -0.30 117.38 118.56 3gli n GLN 182 Ca -0.12 1.54 -0.03 0.00 -0.01 0.00 0.00 57.00 58.38 3gli n GLN 182 Cb 0.33 -2.29 0.17 0.00 1.02 0.00 0.00 30.24 29.47 3gli n GLN 182 CO 0.00 0.00 0.00 0.82 -1.01 0.00 0.00 177.06 176.87 3gli h ILE 183 N 0.00 1.23 0.25 5.09 2.04 -1.03 -2.90 117.51 122.19 3gli h ILE 183 Ca 0.42 -0.74 -0.01 0.00 1.00 0.00 0.00 64.86 65.53 3gli h ILE 183 Cb 0.67 0.50 0.00 0.00 -0.74 0.00 0.00 36.82 37.25 3gli h ILE 183 CO -1.01 0.29 -0.12 -0.09 0.00 0.00 0.00 178.15 177.22 3gli h ARG 184 N 0.91 -0.33 -0.81 2.37 2.43 0.07 -0.59 114.38 118.43 3gli h ARG 184 Ca 0.21 0.02 0.13 0.00 -0.81 0.00 0.00 59.98 59.53 3gli h ARG 184 Cb 0.21 0.07 -0.14 0.00 -0.42 0.00 0.00 29.97 29.70 3gli h ARG 184 CO -0.02 -0.00 -0.38 1.25 -1.51 0.00 0.00 179.97 179.31 3gli h HIS 185 N -0.96 -1.09 -0.13 2.20 2.76 -1.29 0.49 115.15 117.12 3gli h HIS 185 Ca -0.03 0.09 0.02 0.00 -2.20 0.00 0.00 60.37 58.25 3gli h HIS 185 Cb 0.48 0.60 -0.04 0.00 1.55 0.00 0.00 27.41 29.99 3gli h HIS 185 CO 0.05 -0.40 -0.30 0.37 -1.30 0.00 0.00 177.93 176.35 3gli h GLN 186 N -0.08 -0.27 -0.90 5.26 5.75 -1.58 -1.40 115.11 121.89 3gli h GLN 186 Ca 0.28 0.02 0.22 0.00 -0.15 0.00 0.00 58.65 59.01 3gli h GLN 186 Cb 0.57 0.06 -0.17 0.00 1.07 0.00 0.00 27.48 29.01 3gli h GLN 186 CO -0.85 -0.18 -0.05 -0.07 -2.65 0.00 0.00 178.83 175.03 3gli h LEU 187 N -0.28 -0.54 0.00 -2.39 3.38 0.88 -0.21 115.31 116.15 3gli h LEU 187 Ca 0.03 0.25 0.00 0.00 0.09 0.00 0.00 57.88 58.25 3gli h LEU 187 Cb 0.35 0.47 0.00 0.00 0.09 0.00 0.00 40.66 41.57 3gli h LEU 187 CO -0.27 -0.29 0.00 1.21 0.09 0.00 0.00 178.44 179.18 3gli n GLU 188 N -5.47 0.00 -0.14 1.13 2.13 0.15 -1.63 120.64 116.80 3gli n GLU 188 Ca 0.18 0.44 -0.03 0.00 0.66 0.00 0.00 57.16 58.41 3gli n GLU 188 Cb 0.59 -1.25 -0.02 0.00 0.27 0.00 0.00 31.44 31.02 3gli n GLU 188 CO 0.00 0.00 0.00 1.58 -0.41 0.00 0.00 177.13 178.30 3gli n HIS 189 N -1.54 -0.11 -0.24 4.31 -0.00 -0.56 0.09 115.22 117.17 3gli n HIS 189 Ca 0.00 0.42 -0.05 0.00 0.46 0.00 0.00 57.72 58.55 3gli n HIS 189 Cb 0.00 -0.55 0.05 0.00 -0.12 0.00 0.00 29.99 29.37 3gli n HIS 189 CO 0.00 0.00 0.00 0.82 0.46 0.00 0.00 176.34 177.62 3gli h ILE 190 N 0.00 1.15 0.00 3.57 2.04 -0.84 -0.81 117.51 122.62 3gli h ILE 190 Ca 0.07 -0.30 -0.12 0.00 1.00 0.00 0.00 64.86 65.51 3gli h ILE 190 Cb 0.15 0.20 -0.02 0.00 -0.74 0.00 0.00 36.82 36.41 3gli h ILE 190 CO -0.32 0.16 -0.55 -0.07 0.00 0.00 0.00 178.15 177.37 3gli h LEU 191 N 0.88 0.00 0.74 1.44 3.38 0.62 -1.40 115.31 120.97 3gli h LEU 191 Ca 0.25 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 58.18 3gli h LEU 191 Cb -0.07 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.68 3gli h LEU 191 CO -0.07 0.55 -0.36 0.78 0.09 0.00 0.00 178.44 179.44 3gli h ASN 192 N 0.00 -0.85 -0.89 -0.43 2.35 -0.29 0.24 115.58 115.71 3gli h ASN 192 Ca -0.01 0.03 0.17 0.00 -0.55 0.00 0.00 56.30 55.94 3gli h ASN 192 Cb 1.02 0.22 -0.07 0.00 0.05 0.00 0.00 38.32 39.54 3gli h ASN 192 CO 0.07 -0.60 0.58 -0.33 -1.65 0.00 0.00 177.43 175.50 3gli h GLU 193 N -1.02 0.56 0.00 0.81 4.39 -1.03 0.50 114.58 118.79 3gli h GLU 193 Ca -0.10 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.56 3gli h GLU 193 Cb 0.77 -0.13 0.00 0.00 -0.10 0.00 0.00 28.75 29.29 3gli h GLU 193 CO 0.17 0.37 0.00 0.39 -1.16 0.00 0.00 179.01 178.78 3gli n GLU 194 N -4.55 0.57 -3.41 2.33 -0.58 -0.54 -4.90 120.64 109.56 3gli n GLU 194 Ca 0.18 0.02 -0.18 0.00 -0.42 0.00 0.00 57.16 56.76 3gli n GLU 194 Cb 0.55 -1.50 0.07 0.00 -0.57 0.00 0.00 31.44 29.99 3gli n GLU 194 CO 0.00 0.00 0.00 0.72 -0.48 0.00 0.00 177.13 177.37 3gli n HIS 195 N -1.18 -2.25 -4.91 -0.32 8.25 0.17 -5.03 115.22 109.95 3gli n HIS 195 Ca 0.16 0.86 -0.31 0.00 -0.26 0.00 0.00 57.72 58.16 3gli n HIS 195 Cb 0.17 -4.48 -0.14 0.00 1.12 0.00 0.00 29.99 26.66 3gli n HIS 195 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 3gli s ILE 196 N -3.42 2.62 0.27 1.59 1.01 0.78 -5.03 121.20 119.02 3gli s ILE 196 Ca 0.23 -1.05 -0.29 0.00 0.00 0.00 0.00 60.65 59.53 3gli s ILE 196 Cb -0.04 -2.03 -0.09 0.00 0.01 0.00 0.00 42.46 40.31 3gli s ILE 196 CO 0.75 0.47 1.01 0.00 0.00 0.00 0.00 174.94 177.18 3gli s ALA 197 N -0.78 3.34 -0.04 9.38 0.00 -1.26 -4.46 121.76 127.95 3gli s ALA 197 Ca 0.12 0.72 -0.11 0.00 0.00 0.00 0.00 51.96 52.69 3gli s ALA 197 Cb -0.10 -3.26 0.02 0.00 0.00 0.00 0.00 23.12 19.78 3gli s ALA 197 CO 0.02 0.04 0.26 -3.38 0.00 0.00 0.00 175.76 172.70 3gli s HIS 198 N -1.24 -0.16 -0.22 0.00 -3.43 -1.26 -2.39 115.29 106.59 3gli s HIS 198 Ca 0.44 0.31 -0.09 0.00 -0.80 0.00 0.00 55.06 54.93 3gli s HIS 198 Cb -0.27 0.06 -0.04 0.00 -1.43 0.00 0.00 32.58 30.90 3gli s HIS 198 CO 0.35 -0.29 0.11 -1.21 -2.00 0.00 0.00 174.74 171.69 3gli s GLU 199 N -0.89 3.97 0.23 -0.38 2.02 -1.16 -5.04 118.70 117.45 3gli s GLU 199 Ca -0.10 -0.33 -0.14 0.00 0.02 0.00 0.00 54.97 54.42 3gli s GLU 199 Cb -0.05 -3.38 0.28 0.00 0.10 0.00 0.00 34.13 31.08 3gli s GLU 199 CO 0.02 0.10 1.58 -1.35 0.02 0.00 0.00 175.26 175.63 3gli h PRO 200 N 7.33 -0.04 -0.20 0.39 0.11 -2.00 0.38 132.00 137.97 3gli h PRO 200 Ca -0.38 0.00 0.06 0.00 0.11 0.00 0.00 66.00 65.80 3gli h PRO 200 Cb 1.17 0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.28 3gli h PRO 200 CO 0.66 -0.02 0.15 -0.09 -0.21 0.00 0.00 178.00 178.49 3gli h ARG 201 N -0.04 0.00 -0.48 1.05 9.65 -1.99 -0.05 114.38 122.52 3gli h ARG 201 Ca 0.35 0.00 -0.13 0.00 -1.10 0.00 0.00 59.98 59.10 3gli h ARG 201 Cb 0.59 0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 29.16 3gli h ARG 201 CO -0.84 0.00 -0.21 0.00 2.80 0.00 0.00 179.97 181.72 3gli h ALA 202 N 1.89 0.72 -0.49 2.80 0.00 -1.27 -2.18 119.26 120.73 3gli h ALA 202 Ca 0.10 -0.39 -0.03 0.00 0.00 0.00 0.00 54.91 54.59 3gli h ALA 202 Cb 0.40 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 3gli h ALA 202 CO -0.00 0.67 0.20 -0.07 0.00 0.00 0.00 179.25 180.05 3gli h LEU 203 N 0.84 0.68 -0.62 0.00 3.38 -0.78 -2.47 115.31 116.35 3gli h LEU 203 Ca 0.11 -0.17 0.12 0.00 0.09 0.00 0.00 57.88 58.03 3gli h LEU 203 Cb 0.78 -0.18 -0.09 0.00 0.09 0.00 0.00 40.66 41.27 3gli h LEU 203 CO 0.06 0.66 0.15 1.56 0.09 0.00 0.00 178.44 180.97 3gli h GLN 204 N 0.66 0.28 -0.56 1.13 1.08 -0.81 -1.69 115.11 115.20 3gli h GLN 204 Ca 0.16 -0.02 -0.02 0.00 -1.45 0.00 0.00 58.65 57.32 3gli h GLN 204 Cb 0.19 -0.06 -0.03 0.00 -0.05 0.00 0.00 27.48 27.53 3gli h GLN 204 CO -0.01 0.18 0.25 -0.07 -0.95 0.00 0.00 178.83 178.23 3gli h LEU 205 N 0.28 0.75 0.84 1.46 3.38 -1.06 -2.47 115.31 118.50 3gli h LEU 205 Ca 0.33 -0.14 -0.04 0.00 0.09 0.00 0.00 57.88 58.11 3gli h LEU 205 Cb 0.48 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.04 3gli h LEU 205 CO -0.40 0.69 -0.44 -0.07 0.09 0.00 0.00 178.44 178.31 3gli h LEU 206 N 0.77 -1.07 -0.99 1.67 3.38 -0.95 -0.92 115.31 117.19 3gli h LEU 206 Ca 0.19 0.05 0.31 0.00 0.09 0.00 0.00 57.88 58.52 3gli h LEU 206 Cb 0.15 0.29 -0.15 0.00 0.09 0.00 0.00 40.66 41.04 3gli h LEU 206 CO -0.02 -0.72 0.54 0.00 0.09 0.00 0.00 178.44 178.32 3gli h ALA 207 N -1.37 1.88 0.66 1.53 0.00 -1.29 0.74 119.26 121.42 3gli h ALA 207 Ca -0.11 0.19 -0.03 0.00 0.00 0.00 0.00 54.91 54.96 3gli h ALA 207 Cb 0.92 0.17 0.01 0.00 0.00 0.00 0.00 17.79 18.88 3gli h ALA 207 CO 0.16 -0.55 -0.31 0.00 0.00 0.00 0.00 179.25 178.54 3gli h ARG 208 N 0.32 -0.85 -0.10 0.00 2.47 -1.14 -3.09 114.38 112.00 3gli h ARG 208 Ca 0.72 0.06 0.03 0.00 -1.26 0.00 0.00 59.98 59.52 3gli h ARG 208 Cb 1.61 0.19 -0.00 0.00 -1.65 0.00 0.00 29.97 30.12 3gli h ARG 208 CO -0.61 -0.54 0.11 0.00 0.56 0.00 0.00 179.97 179.48 3gli h ALA 209 N -0.64 1.71 -0.34 0.04 0.00 0.48 0.13 119.26 120.64 3gli h ALA 209 Ca -0.09 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.81 3gli h ALA 209 Cb 0.70 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.48 3gli h ALA 209 CO 0.15 -0.16 0.20 0.00 0.00 0.00 0.00 179.25 179.44 3gli h ALA 210 N 1.88 1.72 -5.85 0.00 0.00 -0.96 -3.47 119.26 112.58 3gli h ALA 210 Ca 0.05 -0.04 -0.38 0.00 0.00 0.00 0.00 54.91 54.54 3gli h ALA 210 Cb 0.26 -0.14 0.12 0.00 0.00 0.00 0.00 17.79 18.03 3gli h ALA 210 CO -0.00 0.25 -0.78 -1.91 0.00 0.00 0.00 179.25 176.82 3gli n GLU 211 N -4.46 -6.23 0.00 0.00 2.13 0.03 -3.04 120.64 109.08 3gli n GLU 211 Ca 0.02 0.76 0.00 0.00 0.66 0.00 0.00 57.16 58.60 3gli n GLU 211 Cb 0.08 -5.64 0.00 0.00 0.27 0.00 0.00 31.44 26.15 3gli n GLU 211 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3gli n GLY 212 N -1.42 1.44 3.15 8.31 0.00 -1.26 -4.99 105.19 110.41 3gli n GLY 212 Ca -0.23 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.46 3gli n GLY 212 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3gli s SER 213 N -1.78 3.44 0.33 1.61 0.15 -1.17 0.12 113.70 116.40 3gli s SER 213 Ca 0.00 -0.68 0.02 0.00 0.70 0.00 0.00 55.95 55.99 3gli s SER 213 Cb 0.00 -1.53 0.58 0.00 -1.71 0.00 0.00 66.02 63.36 3gli s SER 213 CO 0.00 -0.02 1.92 -0.07 1.20 0.00 0.00 173.24 176.26 3gli h LEU 214 N 7.95 0.63 -0.11 3.45 3.38 -1.66 -0.34 115.31 128.62 3gli h LEU 214 Ca -0.43 -0.08 -0.03 0.00 0.09 0.00 0.00 57.88 57.43 3gli h LEU 214 Cb 1.13 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 41.72 3gli h LEU 214 CO 0.62 0.59 -0.05 -0.09 0.09 0.00 0.00 178.44 179.59 3gli h ARG 215 N 0.69 0.23 -0.85 1.13 2.43 -1.70 -1.86 114.38 114.45 3gli h ARG 215 Ca 0.17 -0.10 0.12 0.00 -0.81 0.00 0.00 59.98 59.36 3gli h ARG 215 Cb 0.16 -0.01 -0.08 0.00 -0.42 0.00 0.00 29.97 29.62 3gli h ARG 215 CO -0.01 0.58 0.47 -0.44 -1.51 0.00 0.00 179.97 179.05 3gli h ASP 216 N -0.12 0.62 0.38 -3.80 5.19 -1.75 0.12 116.42 117.06 3gli h ASP 216 Ca 0.03 0.07 -0.01 0.00 -0.62 0.00 0.00 57.03 56.50 3gli h ASP 216 Cb 0.50 -0.04 -0.01 0.00 0.18 0.00 0.00 39.33 39.96 3gli h ASP 216 CO 0.02 0.31 -0.27 0.00 -3.12 0.00 0.00 179.24 176.18 3gli h ALA 217 N 1.51 -0.63 0.00 3.45 0.00 -0.84 -1.69 119.26 121.07 3gli h ALA 217 Ca 0.44 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 55.21 3gli h ALA 217 Cb 0.52 0.35 -0.00 0.00 0.00 0.00 0.00 17.79 18.65 3gli h ALA 217 CO -0.31 -0.87 -0.12 -0.07 0.00 0.00 0.00 179.25 177.88 3gli h LEU 218 N -0.63 0.00 -0.03 0.00 3.38 -0.45 0.15 115.31 117.73 3gli h LEU 218 Ca -0.03 0.00 -0.26 0.00 0.09 0.00 0.00 57.88 57.67 3gli h LEU 218 Cb 0.54 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.30 3gli h LEU 218 CO 0.01 0.12 -1.07 0.28 0.09 0.00 0.00 178.44 177.87 3gli h SER 219 N 0.00 0.73 0.26 -0.43 0.02 -0.42 -1.42 113.55 112.29 3gli h SER 219 Ca -0.00 -0.62 -0.15 0.00 -0.84 0.00 0.00 61.79 60.18 3gli h SER 219 Cb 0.29 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.60 3gli h SER 219 CO 0.02 1.43 -0.60 -0.07 -1.14 0.00 0.00 176.83 176.46 3gli h LEU 220 N 0.29 0.38 0.85 5.07 3.38 -0.50 -1.14 115.31 123.63 3gli h LEU 220 Ca -0.13 -0.22 -0.04 0.00 0.09 0.00 0.00 57.88 57.59 3gli h LEU 220 Cb 1.73 -0.11 0.01 0.00 0.09 0.00 0.00 40.66 42.37 3gli h LEU 220 CO 0.20 0.89 -0.41 0.74 0.09 0.00 0.00 178.44 179.95 3gli h THR 221 N 0.25 0.17 -0.90 0.22 2.02 -0.71 0.76 112.91 114.73 3gli h THR 221 Ca -0.00 -0.00 0.17 0.00 0.77 0.00 0.00 66.41 67.34 3gli h THR 221 Cb 1.12 0.17 -0.07 0.00 -1.74 0.00 0.00 68.15 67.62 3gli h THR 221 CO 0.10 0.00 0.58 -0.78 0.37 0.00 0.00 175.52 175.79 3gli h ASP 222 N -1.14 0.58 -0.48 4.18 1.82 -1.17 0.51 116.42 120.71 3gli h ASP 222 Ca -0.12 0.05 -0.02 0.00 -0.39 0.00 0.00 57.03 56.55 3gli h ASP 222 Cb 0.87 -0.07 -0.02 0.00 0.68 0.00 0.00 39.33 40.79 3gli h ASP 222 CO 0.19 0.27 0.21 -0.61 -1.61 0.00 0.00 179.24 177.69 3gli h GLN 223 N 0.60 0.71 -0.05 0.28 4.15 -0.27 -2.90 115.11 117.63 3gli h GLN 223 Ca 0.46 -0.12 0.02 0.00 0.77 0.00 0.00 58.65 59.78 3gli h GLN 223 Cb 0.87 -0.12 -0.04 0.00 0.21 0.00 0.00 27.48 28.41 3gli h GLN 223 CO -0.21 0.62 -0.33 0.00 -1.93 0.00 0.00 178.83 176.97 3gli h ALA 224 N 1.06 -0.74 -0.93 3.38 0.00 0.55 -2.72 119.26 119.85 3gli h ALA 224 Ca 0.16 -0.04 0.24 0.00 0.00 0.00 0.00 54.91 55.27 3gli h ALA 224 Cb 0.16 0.82 -0.17 0.00 0.00 0.00 0.00 17.79 18.60 3gli h ALA 224 CO -0.02 -0.85 -0.00 0.82 0.00 0.00 0.00 179.25 179.20 3gli h ILE 225 N -0.38 0.10 0.46 0.00 2.04 -1.08 -0.38 117.51 118.29 3gli h ILE 225 Ca 0.01 -0.01 -0.02 0.00 1.00 0.00 0.00 64.86 65.84 3gli h ILE 225 Cb 0.43 0.06 0.00 0.00 -0.74 0.00 0.00 36.82 36.57 3gli h ILE 225 CO -0.25 0.01 -0.23 0.00 0.00 0.00 0.00 178.15 177.67 3gli h ALA 226 N 1.91 -1.15 0.00 1.87 0.00 -1.29 -1.98 119.26 118.61 3gli h ALA 226 Ca 0.54 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.31 3gli h ALA 226 Cb 1.05 0.28 0.00 0.00 0.00 0.00 0.00 17.79 19.11 3gli h ALA 226 CO -0.86 -1.11 0.00 -1.13 0.00 0.00 0.00 179.25 176.14 3gli n SER 227 N -3.76 0.00 -0.05 0.00 3.41 -0.89 -1.36 113.62 110.97 3gli n SER 227 Ca -0.08 -0.37 0.06 0.00 -0.26 0.00 0.00 58.87 58.21 3gli n SER 227 Cb 0.25 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 64.15 3gli n SER 227 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3gli n GLY 228 N -0.32 -0.13 2.48 5.00 0.00 -0.20 -5.00 105.19 107.03 3gli n GLY 228 Ca 0.07 -0.35 -0.13 0.00 0.00 0.00 0.00 46.02 45.62 3gli n GLY 228 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3gli n ASP 229 N -1.10 -4.15 0.00 1.61 -0.08 -0.46 -3.31 116.55 109.06 3gli n ASP 229 Ca 0.03 -0.18 0.00 0.00 -1.51 0.00 0.00 54.79 53.13 3gli n ASP 229 Cb 0.20 -2.98 0.00 0.00 2.34 0.00 0.00 41.12 40.68 3gli n ASP 229 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 3gli n GLY 230 N -1.21 2.34 3.81 0.27 0.00 -0.99 -5.07 105.19 104.34 3gli n GLY 230 Ca -0.05 -0.66 -0.34 0.00 0.00 0.00 0.00 46.02 44.97 3gli n GLY 230 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3gli s GLN 231 N 0.00 3.18 -0.73 1.61 -0.21 -1.21 -4.60 119.66 117.70 3gli s GLN 231 Ca 0.00 -0.41 -0.14 0.00 0.02 0.00 0.00 55.36 54.83 3gli s GLN 231 Cb 0.00 -2.94 0.19 0.00 1.00 0.00 0.00 33.01 31.26 3gli s GLN 231 CO 0.00 0.67 0.68 0.08 -2.12 0.00 0.00 175.29 174.60 3gli s VAL 232 N -1.19 5.42 0.07 1.09 1.01 -1.00 -4.40 120.40 121.41 3gli s VAL 232 Ca 0.22 -2.20 0.03 0.00 0.00 0.00 0.00 61.98 60.04 3gli s VAL 232 Cb -0.12 -4.39 -0.04 0.00 0.00 0.00 0.00 36.38 31.83 3gli s VAL 232 CO 0.13 -0.98 0.06 -0.94 0.00 0.00 0.00 175.10 173.38 3gli s SER 233 N 2.53 5.43 0.31 3.32 1.04 -1.26 -2.96 113.70 122.10 3gli s SER 233 Ca 0.13 -0.03 0.07 0.00 0.48 0.00 0.00 55.95 56.60 3gli s SER 233 Cb -0.16 -1.44 0.79 0.00 0.10 0.00 0.00 66.02 65.31 3gli s SER 233 CO -0.05 0.18 1.75 0.74 0.98 0.00 0.00 173.24 176.84 3gli h THR 234 N 2.70 0.62 0.46 2.02 2.02 -1.94 0.16 112.91 118.95 3gli h THR 234 Ca -0.47 -0.22 -0.01 0.00 0.77 0.00 0.00 66.41 66.47 3gli h THR 234 Cb 1.16 -0.09 -0.01 0.00 -1.74 0.00 0.00 68.15 67.48 3gli h THR 234 CO 0.64 0.12 -0.33 1.56 0.37 0.00 0.00 175.52 177.88 3gli h GLN 235 N 0.65 -0.74 -0.26 6.66 4.20 -1.99 -2.05 115.11 121.57 3gli h GLN 235 Ca 0.60 0.05 -0.06 0.00 0.06 0.00 0.00 58.65 59.29 3gli h GLN 235 Cb 1.03 0.17 -0.01 0.00 0.30 0.00 0.00 27.48 28.98 3gli h GLN 235 CO -0.43 -0.49 -0.09 0.00 -0.67 0.00 0.00 178.83 177.15 3gli h ALA 236 N -0.33 0.37 -0.67 3.87 0.00 -1.46 -2.06 119.26 118.99 3gli h ALA 236 Ca -0.05 -0.29 -0.06 0.00 0.00 0.00 0.00 54.91 54.51 3gli h ALA 236 Cb 0.65 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.32 3gli h ALA 236 CO 0.02 0.20 0.18 0.28 0.00 0.00 0.00 179.25 179.93 3gli h VAL 237 N 0.27 1.25 -0.11 0.00 2.07 -0.79 -1.12 116.25 117.82 3gli h VAL 237 Ca 0.06 -0.91 -0.22 0.00 0.82 0.00 0.00 66.70 66.46 3gli h VAL 237 Cb 0.57 0.55 0.01 0.00 -1.52 0.00 0.00 31.29 30.90 3gli h VAL 237 CO 0.03 0.35 -0.78 0.77 0.02 0.00 0.00 177.57 177.96 3gli h SER 238 N 1.00 0.88 -0.06 0.57 4.64 -1.31 -0.47 113.55 118.80 3gli h SER 238 Ca 0.21 -0.66 -0.05 0.00 -0.47 0.00 0.00 61.79 60.83 3gli h SER 238 Cb 0.33 -0.26 -0.01 0.00 -0.31 0.00 0.00 62.40 62.15 3gli h SER 238 CO -0.00 1.40 -0.08 0.00 -0.87 0.00 0.00 176.83 177.28 3gli h ALA 239 N 0.50 1.50 -0.03 5.18 0.00 -1.20 -0.92 119.26 124.29 3gli h ALA 239 Ca -0.07 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.64 3gli h ALA 239 Cb 1.42 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.11 3gli h ALA 239 CO 0.16 0.36 -0.06 1.98 0.00 0.00 0.00 179.25 181.69 3gli h MET 240 N 0.30 0.10 0.00 0.00 -1.53 -0.90 -3.07 114.93 109.83 3gli h MET 240 Ca 0.06 -0.06 0.00 0.00 -3.44 0.00 0.00 59.70 56.26 3gli h MET 240 Cb 0.33 0.01 0.00 0.00 -0.55 0.00 0.00 31.60 31.39 3gli h MET 240 CO 0.02 0.63 0.00 1.28 0.14 0.00 0.00 176.91 178.97 3gli n LEU 241 N -4.73 0.00 -1.06 3.39 4.77 -0.21 -4.89 117.00 114.26 3gli n LEU 241 Ca -0.08 0.00 -0.13 0.00 -0.03 0.00 0.00 56.01 55.77 3gli n LEU 241 Cb 0.32 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.36 3gli n LEU 241 CO 0.35 0.00 -0.13 0.61 -1.33 0.00 0.00 177.39 176.89 3gli n GLY 242 N 0.68 1.27 3.61 -0.72 0.00 -0.75 -4.75 105.19 104.54 3gli n GLY 242 Ca 0.15 -0.40 -0.42 0.00 0.00 0.00 0.00 46.02 45.35 3gli n GLY 242 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3gli n THR 243 N -2.73 2.26 -3.22 2.61 -1.04 -0.42 -3.46 114.28 108.27 3gli n THR 243 Ca -0.13 -0.50 -0.31 0.00 -2.04 0.00 0.00 64.05 61.06 3gli n THR 243 Cb 0.45 -1.12 -0.05 0.00 -1.82 0.00 0.00 70.33 67.79 3gli n THR 243 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 3gli s LEU 244 N -0.22 4.06 -0.22 -4.42 1.43 -1.26 -4.87 118.68 113.18 3gli s LEU 244 Ca 0.61 1.05 -0.19 0.00 -1.03 0.00 0.00 54.13 54.57 3gli s LEU 244 Cb -0.60 -3.85 -0.03 0.00 0.03 0.00 0.00 46.19 41.74 3gli s LEU 244 CO 0.58 -0.19 0.56 1.51 0.23 0.00 0.00 176.35 179.04 3gli s ASP 245 N -2.56 6.57 0.34 2.29 -4.77 -1.26 -4.99 116.67 112.30 3gli s ASP 245 Ca 0.50 0.68 0.14 0.00 -3.30 0.00 0.00 52.55 50.57 3gli s ASP 245 Cb -0.11 -2.31 1.10 0.00 -1.09 0.00 0.00 42.92 40.52 3gli s ASP 245 CO 0.23 -0.25 1.63 -0.78 0.70 0.00 0.00 175.17 176.70 3gli h ASP 246 N 7.64 0.33 -0.69 2.11 1.82 -2.04 -2.02 116.42 123.56 3gli h ASP 246 Ca -0.31 0.22 0.11 0.00 -0.39 0.00 0.00 57.03 56.66 3gli h ASP 246 Cb 1.14 0.21 -0.12 0.00 0.68 0.00 0.00 39.33 41.25 3gli h ASP 246 CO 0.75 -0.24 -0.38 -0.78 -1.61 0.00 0.00 179.24 176.97 3gli h ASP 247 N 0.19 -1.35 -1.00 2.28 1.82 -2.02 -3.12 116.42 113.23 3gli h ASP 247 Ca 0.74 0.25 0.14 0.00 -0.39 0.00 0.00 57.03 57.77 3gli h ASP 247 Cb 1.75 0.66 -0.09 0.00 0.68 0.00 0.00 39.33 42.33 3gli h ASP 247 CO -0.68 -0.31 0.62 -0.61 -1.61 0.00 0.00 179.24 176.66 3gli h GLN 248 N -0.14 0.90 0.62 0.28 4.15 -1.79 -2.35 115.11 116.78 3gli h GLN 248 Ca 0.24 -0.05 -0.03 0.00 0.77 0.00 0.00 58.65 59.58 3gli h GLN 248 Cb 0.56 -0.20 0.01 0.00 0.21 0.00 0.00 27.48 28.05 3gli h GLN 248 CO -0.76 0.59 -0.30 0.00 -1.93 0.00 0.00 178.83 176.44 3gli h ALA 249 N 1.57 -0.83 -0.62 3.38 0.00 -1.77 -3.06 119.26 117.92 3gli h ALA 249 Ca 0.51 -0.19 0.13 0.00 0.00 0.00 0.00 54.91 55.35 3gli h ALA 249 Cb 0.59 0.32 -0.11 0.00 0.00 0.00 0.00 17.79 18.59 3gli h ALA 249 CO -0.28 -0.79 -0.11 1.25 0.00 0.00 0.00 179.25 179.31 3gli h LEU 250 N -1.18 -0.49 -0.96 0.00 5.85 -1.58 -0.75 115.31 116.19 3gli h LEU 250 Ca -0.09 0.18 0.20 0.00 0.84 0.00 0.00 57.88 59.01 3gli h LEU 250 Cb 0.66 0.35 -0.11 0.00 0.37 0.00 0.00 40.66 41.93 3gli h LEU 250 CO 0.14 -0.18 0.55 0.28 -0.34 0.00 0.00 178.44 178.88 3gli h SER 251 N 0.03 0.65 0.55 1.25 0.02 -1.45 0.37 113.55 114.97 3gli h SER 251 Ca 0.31 0.11 -0.03 0.00 -0.84 0.00 0.00 61.79 61.35 3gli h SER 251 Cb 0.48 0.01 0.01 0.00 0.14 0.00 0.00 62.40 63.04 3gli h SER 251 CO -0.61 0.18 -0.26 0.25 -1.14 0.00 0.00 176.83 175.25 3gli h LEU 252 N 0.64 -0.63 -0.82 5.07 6.46 -1.07 -0.31 115.31 124.65 3gli h LEU 252 Ca 0.58 0.02 0.25 0.00 -0.12 0.00 0.00 57.88 58.61 3gli h LEU 252 Cb 0.97 0.16 -0.15 0.00 -0.73 0.00 0.00 40.66 40.91 3gli h LEU 252 CO -0.43 -0.34 0.11 0.52 -0.62 0.00 0.00 178.44 177.68 3gli n VAL 253 N -4.57 -0.35 0.30 1.05 0.31 -0.62 -0.90 118.33 113.55 3gli n VAL 253 Ca -0.09 1.78 -0.14 0.00 -0.01 0.00 0.00 64.34 65.88 3gli n VAL 253 Cb 0.29 -2.66 -0.07 0.00 -0.91 0.00 0.00 33.84 30.49 3gli n VAL 253 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 3gli h GLU 254 N 0.00 -0.78 0.00 5.55 5.08 -0.16 -2.87 114.58 121.40 3gli h GLU 254 Ca 0.54 0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.96 3gli h GLU 254 Cb 1.20 0.18 0.00 0.00 0.50 0.00 0.00 28.75 30.63 3gli h GLU 254 CO -0.74 -0.49 0.13 0.00 -1.00 0.00 0.00 179.01 176.91 3gli n ALA 255 N -2.67 0.80 0.02 3.43 0.00 -0.09 -1.82 120.51 120.18 3gli n ALA 255 Ca -0.11 0.07 -0.22 0.00 0.00 0.00 0.00 53.44 53.18 3gli n ALA 255 Cb 0.34 -0.90 -0.14 0.00 0.00 0.00 0.00 19.45 18.75 3gli n ALA 255 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 177.50 179.48 3gli h MET 256 N 0.00 0.29 0.00 0.00 1.85 -0.81 -2.30 114.93 113.96 3gli h MET 256 Ca 0.00 -0.49 -0.13 0.00 -0.61 0.00 0.00 59.70 58.47 3gli h MET 256 Cb 0.25 0.18 -0.02 0.00 0.43 0.00 0.00 31.60 32.45 3gli h MET 256 CO 0.00 1.24 -0.60 -0.39 -0.40 0.00 0.00 176.91 176.76 3gli h VAL 257 N -0.01 1.05 0.00 -5.77 -1.51 -1.27 -2.51 116.25 106.23 3gli h VAL 257 Ca -0.39 -2.41 0.00 0.00 -1.23 0.00 0.00 66.70 62.67 3gli h VAL 257 Cb 1.99 2.47 0.00 0.00 -2.13 0.00 0.00 31.29 33.62 3gli h VAL 257 CO 0.10 0.58 0.00 -0.62 -1.23 0.00 0.00 177.57 176.40 3gli n GLU 258 N -3.28 0.19 -0.96 5.19 1.02 -0.76 -4.86 120.64 117.19 3gli n GLU 258 Ca 0.01 0.15 0.00 0.00 -0.02 0.00 0.00 57.16 57.30 3gli n GLU 258 Cb 0.76 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.68 3gli n GLU 258 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3gli n ALA 259 N -1.33 0.00 -2.21 0.62 0.00 -0.95 -4.92 120.51 111.72 3gli n ALA 259 Ca 0.07 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 53.19 3gli n ALA 259 Cb 0.15 -0.71 -0.04 0.00 0.00 0.00 0.00 19.45 18.84 3gli n ALA 259 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 3gli s ASN 260 N -2.09 5.57 0.03 0.00 3.84 -0.87 -4.86 114.94 116.57 3gli s ASN 260 Ca 0.00 -1.23 -0.11 0.00 0.21 0.00 0.00 52.86 51.74 3gli s ASN 260 Cb 0.00 -2.57 -0.04 0.00 -0.55 0.00 0.00 41.25 38.09 3gli s ASN 260 CO 0.00 -2.41 1.17 1.23 -2.79 0.00 0.00 177.10 174.30 3gli h GLY 261 N 16.26 -1.29 -0.71 1.21 0.00 -1.91 -0.80 103.07 115.83 3gli h GLY 261 Ca 0.18 0.61 0.35 0.00 0.00 0.00 0.00 47.33 48.47 3gli h GLY 261 CO 1.28 -0.43 0.53 -2.09 0.00 0.00 0.00 176.54 175.83 3gli h GLU 262 N -0.21 0.18 0.07 4.80 4.81 -1.96 0.40 114.58 122.67 3gli h GLU 262 Ca 0.00 -0.01 -0.25 0.00 -0.13 0.00 0.00 59.36 58.98 3gli h GLU 262 Cb 0.22 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.56 3gli h GLU 262 CO -0.11 0.12 -1.12 -0.09 -0.73 0.00 0.00 179.01 177.08 3gli h ARG 263 N 0.19 0.19 0.01 1.92 2.43 -1.86 -1.39 114.38 115.86 3gli h ARG 263 Ca 0.77 -0.30 -0.00 0.00 -0.81 0.00 0.00 59.98 59.63 3gli h ARG 263 Cb 1.86 0.11 0.00 0.00 -0.42 0.00 0.00 29.97 31.52 3gli h ARG 263 CO -0.68 1.12 -0.00 0.28 -1.51 0.00 0.00 179.97 179.18 3gli h VAL 264 N 0.06 1.19 -0.37 0.20 2.07 0.12 -0.48 116.25 119.04 3gli h VAL 264 Ca -0.09 -0.57 0.00 0.00 0.82 0.00 0.00 66.70 66.87 3gli h VAL 264 Cb 1.85 1.58 -0.02 0.00 -1.52 0.00 0.00 31.29 33.18 3gli h VAL 264 CO 0.17 0.15 0.25 0.24 0.02 0.00 0.00 177.57 178.40 3gli h MET 265 N -0.25 0.49 0.00 1.57 2.86 -1.18 -1.86 114.93 116.56 3gli h MET 265 Ca -0.00 -0.03 -0.09 0.00 -2.06 0.00 0.00 59.70 57.52 3gli h MET 265 Cb 0.25 -0.11 -0.01 0.00 0.06 0.00 0.00 31.60 31.79 3gli h MET 265 CO 0.00 0.32 -0.41 0.00 1.06 0.00 0.00 176.91 177.88 3gli h ALA 266 N 1.14 0.98 -0.44 6.32 0.00 -1.19 -1.50 119.26 124.57 3gli h ALA 266 Ca 0.14 -0.37 -0.09 0.00 0.00 0.00 0.00 54.91 54.59 3gli h ALA 266 Cb -0.05 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 3gli h ALA 266 CO -0.03 0.51 -0.06 1.25 0.00 0.00 0.00 179.25 180.92 3gli h LEU 267 N 0.00 0.81 -0.19 0.00 5.85 -0.75 -2.42 115.31 118.60 3gli h LEU 267 Ca -0.00 -0.34 -0.00 0.00 0.84 0.00 0.00 57.88 58.37 3gli h LEU 267 Cb 0.95 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.75 3gli h LEU 267 CO 0.05 0.96 0.10 0.40 -0.34 0.00 0.00 178.44 179.62 3gli h ILE 268 N 0.65 1.10 -0.60 4.05 2.04 -1.00 -2.05 117.51 121.70 3gli h ILE 268 Ca 0.12 -0.28 0.12 0.00 1.00 0.00 0.00 64.86 65.82 3gli h ILE 268 Cb 0.58 0.95 -0.11 0.00 -0.74 0.00 0.00 36.82 37.50 3gli h ILE 268 CO 0.03 0.10 -0.05 -1.13 0.00 0.00 0.00 178.15 177.11 3gli h ASN 269 N 0.20 -0.36 -0.43 1.72 -0.73 -1.14 0.46 115.58 115.30 3gli h ASN 269 Ca 0.07 0.16 -0.04 0.00 1.87 0.00 0.00 56.30 58.36 3gli h ASN 269 Cb 0.07 0.30 -0.02 0.00 0.27 0.00 0.00 38.32 38.93 3gli h ASN 269 CO -0.01 -0.14 0.16 -0.33 -0.37 0.00 0.00 177.43 176.74 3gli h GLU 270 N 0.08 0.72 -0.07 6.67 5.08 -1.27 -1.83 114.58 123.95 3gli h GLU 270 Ca 0.31 -0.12 -0.01 0.00 -1.00 0.00 0.00 59.36 58.54 3gli h GLU 270 Cb 0.49 -0.12 -0.00 0.00 0.50 0.00 0.00 28.75 29.61 3gli h GLU 270 CO -0.55 0.62 0.01 0.00 -1.00 0.00 0.00 179.01 178.10 3gli h ALA 271 N 1.47 0.09 -0.98 3.43 0.00 -0.28 -2.62 119.26 120.37 3gli h ALA 271 Ca 0.16 -0.14 0.18 0.00 0.00 0.00 0.00 54.91 55.12 3gli h ALA 271 Cb 0.20 -0.03 -0.11 0.00 0.00 0.00 0.00 17.79 17.86 3gli h ALA 271 CO -0.01 -0.27 0.58 0.00 0.00 0.00 0.00 179.25 179.56 3gli h ALA 272 N 0.78 1.61 -0.11 0.00 0.00 0.29 -0.40 119.26 121.43 3gli h ALA 272 Ca 0.02 0.08 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 3gli h ALA 272 Cb 0.27 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 3gli h ALA 272 CO 0.00 -0.05 0.06 0.00 0.00 0.00 0.00 179.25 179.27 3gli h ALA 273 N 1.63 0.14 0.00 0.00 0.00 -1.15 -2.22 119.26 117.67 3gli h ALA 273 Ca 0.56 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.43 3gli h ALA 273 Cb 0.85 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.60 3gli h ALA 273 CO -0.38 -0.33 0.00 0.54 0.00 0.00 0.00 179.25 179.08 3gli n ARG 274 N -4.98 0.14 -2.58 0.00 1.74 -0.25 -4.89 116.66 105.84 3gli n ARG 274 Ca -0.05 0.19 -0.07 0.00 -0.77 0.00 0.00 57.85 57.15 3gli n ARG 274 Cb 0.06 -1.50 0.03 0.00 -1.02 0.00 0.00 32.46 30.03 3gli n ARG 274 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3gli n GLY 275 N -0.07 -0.55 3.86 -0.13 0.00 -0.67 -5.01 105.19 102.61 3gli n GLY 275 Ca 0.06 0.26 -0.35 0.00 0.00 0.00 0.00 46.02 45.99 3gli n GLY 275 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3gli s ILE 276 N -3.18 5.05 -0.29 -0.61 1.01 -1.22 -4.88 121.20 117.07 3gli s ILE 276 Ca 0.21 0.54 -0.29 0.00 0.00 0.00 0.00 60.65 61.11 3gli s ILE 276 Cb -0.03 -3.66 -0.02 0.00 0.01 0.00 0.00 42.46 38.76 3gli s ILE 276 CO 0.47 0.30 1.70 -0.70 0.00 0.00 0.00 174.94 176.72 3gli s GLU 277 N -1.86 3.52 0.25 2.79 2.12 -1.22 -4.87 118.70 119.43 3gli s GLU 277 Ca 0.33 1.48 -0.04 0.00 0.36 0.00 0.00 54.97 57.10 3gli s GLU 277 Cb -0.14 -4.13 0.45 0.00 0.26 0.00 0.00 34.13 30.57 3gli s GLU 277 CO 0.18 -1.63 1.76 -1.49 -0.54 0.00 0.00 175.26 173.54 3gli h TRP 278 N 11.92 0.65 -0.23 5.30 4.06 -1.94 0.33 115.95 136.03 3gli h TRP 278 Ca -0.33 0.03 0.05 0.00 2.06 0.00 0.00 58.89 60.70 3gli h TRP 278 Cb 1.16 -0.17 -0.01 0.00 -1.00 0.00 0.00 29.16 29.14 3gli h TRP 278 CO 0.94 0.16 0.16 1.49 -3.56 0.00 0.00 178.44 177.63 3gli h GLU 279 N 0.56 0.10 0.69 0.49 4.81 -1.96 -2.54 114.58 116.74 3gli h GLU 279 Ca 0.41 -0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.60 3gli h GLU 279 Cb 0.56 -0.02 0.01 0.00 0.63 0.00 0.00 28.75 29.92 3gli h GLU 279 CO -0.35 0.07 -0.33 0.00 -0.73 0.00 0.00 179.01 177.67 3gli h ALA 280 N 1.88 -0.93 -0.97 2.92 0.00 -0.72 -2.30 119.26 119.14 3gli h ALA 280 Ca 0.11 -0.21 0.09 0.00 0.00 0.00 0.00 54.91 54.90 3gli h ALA 280 Cb 0.29 0.36 -0.12 0.00 0.00 0.00 0.00 17.79 18.32 3gli h ALA 280 CO -0.01 -1.01 -0.58 1.25 0.00 0.00 0.00 179.25 178.89 3gli h LEU 281 N -0.94 -2.14 -0.73 0.00 5.85 -1.23 0.36 115.31 116.47 3gli h LEU 281 Ca -0.09 0.32 0.09 0.00 0.84 0.00 0.00 57.88 59.04 3gli h LEU 281 Cb 0.72 0.95 -0.07 0.00 0.37 0.00 0.00 40.66 42.62 3gli h LEU 281 CO 0.16 -0.24 0.38 -0.07 -0.34 0.00 0.00 178.44 178.32 3gli h LEU 282 N -0.02 0.50 -0.53 2.25 3.38 -1.47 0.13 115.31 119.55 3gli h LEU 282 Ca 0.16 0.06 -0.05 0.00 0.09 0.00 0.00 57.88 58.14 3gli h LEU 282 Cb 0.42 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 41.12 3gli h LEU 282 CO -0.92 0.28 0.13 0.58 0.09 0.00 0.00 178.44 178.60 3gli h VAL 283 N 0.63 1.24 -0.73 1.22 2.07 -0.76 0.37 116.25 120.30 3gli h VAL 283 Ca 0.36 -0.86 -0.07 0.00 0.82 0.00 0.00 66.70 66.96 3gli h VAL 283 Cb 0.38 0.79 -0.03 0.00 -1.52 0.00 0.00 31.29 30.90 3gli h VAL 283 CO -0.27 0.31 0.20 -0.08 0.02 0.00 0.00 177.57 177.75 3gli h GLU 284 N 0.74 1.15 0.15 1.57 4.57 0.30 0.17 114.58 123.24 3gli h GLU 284 Ca 0.17 -0.27 -0.01 0.00 -1.18 0.00 0.00 59.36 58.07 3gli h GLU 284 Cb 0.33 -0.16 0.00 0.00 -0.16 0.00 0.00 28.75 28.77 3gli h GLU 284 CO 0.00 1.00 -0.07 0.52 -1.18 0.00 0.00 179.01 179.28 3gli h MET 285 N 1.10 -0.20 -1.15 1.92 2.86 -0.57 0.13 114.93 119.02 3gli h MET 285 Ca 0.23 0.01 0.33 0.00 -2.06 0.00 0.00 59.70 58.22 3gli h MET 285 Cb 0.35 0.05 -0.10 0.00 0.06 0.00 0.00 31.60 31.95 3gli h MET 285 CO -0.00 0.09 0.75 -0.07 1.06 0.00 0.00 176.91 178.74 3gli h LEU 286 N -0.49 0.35 -0.24 1.22 3.38 0.07 0.45 115.31 120.05 3gli h LEU 286 Ca -0.02 0.10 -0.17 0.00 0.09 0.00 0.00 57.88 57.88 3gli h LEU 286 Cb 0.38 0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.19 3gli h LEU 286 CO 0.03 -0.02 -0.52 1.23 0.09 0.00 0.00 178.44 179.26 3gli h GLY 287 N 0.26 0.84 0.63 0.83 0.00 0.29 -2.47 103.07 103.45 3gli h GLY 287 Ca 0.68 -1.02 -0.00 0.00 0.00 0.00 0.00 47.33 46.98 3gli h GLY 287 CO -0.32 0.92 -0.02 1.41 0.00 0.00 0.00 176.54 178.52 3gli h LEU 288 N 0.51 -0.05 -1.85 3.11 3.38 0.25 -2.19 115.31 118.46 3gli h LEU 288 Ca 0.00 -0.34 0.20 0.00 0.09 0.00 0.00 57.88 57.83 3gli h LEU 288 Cb 1.13 0.01 -0.03 0.00 0.09 0.00 0.00 40.66 41.87 3gli h LEU 288 CO 0.11 0.32 0.64 -0.07 0.09 0.00 0.00 178.44 179.53 3gli h LEU 289 N -0.43 0.00 0.01 1.67 3.38 -0.83 -2.19 115.31 116.92 3gli h LEU 289 Ca -0.01 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.96 3gli h LEU 289 Cb 0.39 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.14 3gli h LEU 289 CO 0.01 0.00 -0.00 -0.74 0.09 0.00 0.00 178.44 177.80 3gli h HIS 290 N 0.00 -0.01 0.09 1.13 2.76 -0.91 -2.37 115.15 115.84 3gli h HIS 290 Ca 0.32 -0.00 0.02 0.00 -2.20 0.00 0.00 60.37 58.51 3gli h HIS 290 Cb 1.60 0.00 -0.05 0.00 1.55 0.00 0.00 27.41 30.51 3gli h HIS 290 CO 0.00 0.75 -0.40 0.00 -1.30 0.00 0.00 177.93 176.98 3gli h ARG 291 N -0.79 -0.58 -0.83 5.26 2.47 -1.24 -0.84 114.38 117.83 3gli h ARG 291 Ca -0.00 0.04 0.14 0.00 -1.26 0.00 0.00 59.98 58.90 3gli h ARG 291 Cb 0.76 0.13 -0.15 0.00 -1.65 0.00 0.00 29.97 29.07 3gli h ARG 291 CO 0.00 -0.39 -0.33 0.82 0.56 0.00 0.00 179.97 180.64 3gli h ILE 292 N -0.61 0.09 0.00 2.04 2.04 -1.48 2.01 117.51 121.61 3gli h ILE 292 Ca 0.03 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.88 3gli h ILE 292 Cb 0.65 0.09 -0.00 0.00 -0.74 0.00 0.00 36.82 36.82 3gli h ILE 292 CO -0.25 0.00 -0.08 0.00 0.00 0.00 0.00 178.15 177.82 3gli h ALA 293 N 1.38 1.11 0.17 1.87 0.00 -1.15 -2.64 119.26 120.00 3gli h ALA 293 Ca 0.33 -0.07 -0.30 0.00 0.00 0.00 0.00 54.91 54.86 3gli h ALA 293 Cb 0.59 -0.01 0.02 0.00 0.00 0.00 0.00 17.79 18.38 3gli h ALA 293 CO -0.86 0.10 -1.37 0.52 0.00 0.00 0.00 179.25 177.63 3gli h MET 294 N 0.00 0.37 -0.33 0.00 2.86 0.39 -3.30 114.93 114.91 3gli h MET 294 Ca -0.00 -0.62 -0.14 0.00 -2.06 0.00 0.00 59.70 56.88 3gli h MET 294 Cb 0.39 0.23 -0.01 0.00 0.06 0.00 0.00 31.60 32.27 3gli h MET 294 CO 0.01 1.29 -0.35 0.28 1.06 0.00 0.00 176.91 179.20 3gli h VAL 295 N 0.10 1.28 -0.93 -2.22 2.07 0.25 -2.85 116.25 113.96 3gli h VAL 295 Ca -0.20 -1.51 0.16 0.00 0.82 0.00 0.00 66.70 65.97 3gli h VAL 295 Cb 2.05 1.40 -0.10 0.00 -1.52 0.00 0.00 31.29 33.12 3gli h VAL 295 CO 0.22 0.50 0.53 1.56 0.02 0.00 0.00 177.57 180.40 3gli h GLN 296 N 0.64 0.71 0.36 1.57 4.20 -1.56 -2.91 115.11 118.11 3gli h GLN 296 Ca 0.06 -0.04 -0.02 0.00 0.06 0.00 0.00 58.65 58.71 3gli h GLN 296 Cb 0.89 -0.16 0.00 0.00 0.30 0.00 0.00 27.48 28.52 3gli h GLN 296 CO 0.08 0.47 -0.17 1.25 -0.67 0.00 0.00 178.83 179.79 3gli h LEU 297 N 0.74 -0.41 -8.20 1.46 5.85 -1.58 -3.42 115.31 109.75 3gli h LEU 297 Ca 0.51 0.01 -0.61 0.00 0.84 0.00 0.00 57.88 58.64 3gli h LEU 297 Cb 0.73 0.11 -0.33 0.00 0.37 0.00 0.00 40.66 41.53 3gli h LEU 297 CO -0.36 -0.27 -0.85 -0.94 -0.34 0.00 0.00 178.44 175.68 3gli s SER 298 N -2.90 2.52 0.30 1.25 1.04 -1.18 -5.03 113.70 109.71 3gli s SER 298 Ca -0.07 -0.45 0.06 0.00 0.48 0.00 0.00 55.95 55.98 3gli s SER 298 Cb 0.01 -1.12 0.76 0.00 0.10 0.00 0.00 66.02 65.77 3gli s SER 298 CO 0.21 0.11 1.76 -0.65 0.98 0.00 0.00 173.24 175.65 3gli h PRO 299 N 6.77 0.67 -0.34 4.02 0.11 -1.78 -1.87 132.00 139.57 3gli h PRO 299 Ca -0.25 -0.04 0.10 0.00 0.11 0.00 0.00 66.00 65.92 3gli h PRO 299 Cb 1.21 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 32.16 3gli h PRO 299 CO 0.47 0.44 0.29 0.00 -0.21 0.00 0.00 178.00 179.00 3gli h ALA 300 N 1.67 2.16 0.00 -0.75 0.00 -1.94 -3.18 119.26 117.21 3gli h ALA 300 Ca 0.59 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.49 3gli h ALA 300 Cb 0.98 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.79 3gli h ALA 300 CO -0.41 -0.47 0.00 0.00 0.00 0.00 0.00 179.25 178.37 3gli n ALA 301 N -2.48 1.30 -2.66 0.00 0.00 -0.70 -4.52 120.51 111.45 3gli n ALA 301 Ca 0.05 -0.01 -0.42 0.00 0.00 0.00 0.00 53.44 53.07 3gli n ALA 301 Cb 0.46 -1.03 -0.04 0.00 0.00 0.00 0.00 19.45 18.84 3gli n ALA 301 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 3gli s LEU 302 N -2.56 4.13 1.03 0.00 2.96 -1.20 -4.78 118.68 118.26 3gli s LEU 302 Ca 0.02 1.10 -0.11 0.00 -0.22 0.00 0.00 54.13 54.92 3gli s LEU 302 Cb 0.01 -3.21 0.21 0.00 0.50 0.00 0.00 46.19 43.70 3gli s LEU 302 CO 0.03 -0.46 1.08 -0.83 -1.32 0.00 0.00 176.35 174.86 3gli s GLY 303 N 1.24 1.61 0.63 7.98 0.00 -1.26 -4.91 107.32 112.62 3gli s GLY 303 Ca 0.36 0.19 0.41 0.00 0.00 0.00 0.00 44.72 45.69 3gli s GLY 303 CO 0.10 0.76 2.26 3.43 0.00 0.00 0.00 173.10 179.65 3gli h ASN 304 N -2.20 0.00 -0.61 1.64 2.35 -1.96 -3.18 115.58 111.63 3gli h ASN 304 Ca -0.52 0.00 -0.09 0.00 -0.55 0.00 0.00 56.30 55.13 3gli h ASN 304 Cb 1.30 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.65 3gli h ASN 304 CO 0.47 0.00 0.02 0.44 -1.65 0.00 0.00 177.43 176.71 3gli h ASP 305 N 0.00 1.04 0.50 5.81 3.32 -2.03 -3.24 116.42 121.83 3gli h ASP 305 Ca -0.00 -0.29 0.00 0.00 0.02 0.00 0.00 57.03 56.76 3gli h ASP 305 Cb 0.15 -0.28 0.00 0.00 0.22 0.00 0.00 39.33 39.42 3gli h ASP 305 CO 0.00 1.08 -0.06 0.23 -1.72 0.00 0.00 179.24 178.77 3gli n MET 306 N -4.18 0.50 -0.07 3.56 2.81 -1.20 -4.45 117.12 114.09 3gli n MET 306 Ca 0.03 -0.09 0.02 0.00 -1.81 0.00 0.00 57.70 55.85 3gli n MET 306 Cb 0.34 -1.50 0.05 0.00 -0.71 0.00 0.00 33.22 31.40 3gli n MET 306 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 3gli n ALA 307 N -1.17 0.09 -0.23 3.04 0.00 -1.23 0.16 120.51 121.17 3gli n ALA 307 Ca 0.14 0.21 -0.06 0.00 0.00 0.00 0.00 53.44 53.73 3gli n ALA 307 Cb 0.26 -0.15 0.05 0.00 0.00 0.00 0.00 19.45 19.61 3gli n ALA 307 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3gli h ALA 308 N 0.39 0.83 0.16 0.00 0.00 -1.91 -3.08 119.26 115.66 3gli h ALA 308 Ca 0.11 -0.05 -0.33 0.00 0.00 0.00 0.00 54.91 54.64 3gli h ALA 308 Cb 0.22 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.75 3gli h ALA 308 CO -0.19 0.27 -1.65 0.82 0.00 0.00 0.00 179.25 178.50 3gli h ILE 309 N 0.89 1.04 -0.35 0.00 2.04 0.13 -3.43 117.51 117.84 3gli h ILE 309 Ca 0.24 -2.64 0.11 0.00 1.00 0.00 0.00 64.86 63.58 3gli h ILE 309 Cb -0.10 2.78 -0.06 0.00 -0.74 0.00 0.00 36.82 38.70 3gli h ILE 309 CO -0.05 0.84 0.07 -1.84 0.00 0.00 0.00 178.15 177.17 3gli n GLU 310 N -3.54 -0.03 -0.15 2.37 0.28 -0.04 0.18 120.64 119.71 3gli n GLU 310 Ca -0.21 0.50 -0.04 0.00 -0.16 0.00 0.00 57.16 57.25 3gli n GLU 310 Cb 1.07 -0.84 0.02 0.00 1.43 0.00 0.00 31.44 33.12 3gli n GLU 310 CO 0.00 0.00 0.00 1.25 -0.16 0.00 0.00 177.13 178.22 3gli h LEU 311 N 0.00 -0.71 -0.69 -1.84 5.85 -1.83 -0.25 115.31 115.83 3gli h LEU 311 Ca 0.24 0.17 -0.12 0.00 0.84 0.00 0.00 57.88 59.01 3gli h LEU 311 Cb 0.56 0.40 -0.02 0.00 0.37 0.00 0.00 40.66 41.97 3gli h LEU 311 CO -0.30 -0.23 -0.57 0.03 -0.34 0.00 0.00 178.44 177.02 3gli h ARG 312 N -0.10 0.00 -0.01 1.25 3.08 0.16 -3.08 114.38 115.68 3gli h ARG 312 Ca 0.23 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.27 3gli h ARG 312 Cb 0.45 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.50 3gli h ARG 312 CO -0.55 0.57 -0.01 0.52 -1.07 0.00 0.00 179.97 179.44 3gli h MET 313 N 0.00 0.03 -0.71 0.04 2.86 -1.37 -2.85 114.93 112.92 3gli h MET 313 Ca -0.01 -0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.62 3gli h MET 313 Cb 1.12 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.75 3gli h MET 313 CO 0.07 0.50 0.45 0.00 1.06 0.00 0.00 176.91 179.00 3gli h ARG 314 N -0.44 0.94 0.55 1.72 2.47 -1.05 -1.07 114.38 117.50 3gli h ARG 314 Ca 0.00 -0.07 -0.03 0.00 -1.26 0.00 0.00 59.98 58.63 3gli h ARG 314 Cb 0.50 -0.21 0.01 0.00 -1.65 0.00 0.00 29.97 28.62 3gli h ARG 314 CO 0.00 0.64 -0.26 0.93 0.56 0.00 0.00 179.97 181.84 3gli h GLU 315 N 0.97 -0.71 -1.02 0.04 4.39 -1.51 -0.67 114.58 116.07 3gli h GLU 315 Ca 0.26 0.05 0.27 0.00 0.34 0.00 0.00 59.36 60.28 3gli h GLU 315 Cb -0.08 0.16 -0.13 0.00 -0.10 0.00 0.00 28.75 28.61 3gli h GLU 315 CO -0.05 -0.45 0.61 -0.07 -1.16 0.00 0.00 179.01 177.89 3gli h LEU 316 N -0.79 0.60 -0.44 1.33 3.38 -1.13 0.33 115.31 118.59 3gli h LEU 316 Ca -0.07 0.14 -0.17 0.00 0.09 0.00 0.00 57.88 57.87 3gli h LEU 316 Cb 0.59 0.05 -0.00 0.00 0.09 0.00 0.00 40.66 41.39 3gli h LEU 316 CO 0.12 0.04 -0.53 0.00 0.09 0.00 0.00 178.44 178.17 3gli h ALA 317 N 1.74 0.62 -0.27 1.53 0.00 -0.62 -2.84 119.26 119.43 3gli h ALA 317 Ca 0.66 -0.51 -0.16 0.00 0.00 0.00 0.00 54.91 54.91 3gli h ALA 317 Cb 1.39 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 19.09 3gli h ALA 317 CO -0.48 0.68 -0.46 0.00 0.00 0.00 0.00 179.25 178.99 3gli h ARG 318 N 0.54 0.79 0.19 0.00 3.08 0.11 -3.38 114.38 115.71 3gli h ARG 318 Ca 0.02 -0.49 -0.01 0.00 0.07 0.00 0.00 59.98 59.57 3gli h ARG 318 Cb 1.10 0.05 0.00 0.00 0.08 0.00 0.00 29.97 31.20 3gli h ARG 318 CO 0.11 1.12 -0.09 1.15 -1.07 0.00 0.00 179.97 181.18 3gli h THR 319 N 0.55 0.53 -3.41 2.04 2.02 -1.03 -3.46 112.91 110.13 3gli h THR 319 Ca 0.02 -1.04 -0.55 0.00 0.77 0.00 0.00 66.41 65.61 3gli h THR 319 Cb 1.06 0.91 -0.04 0.00 -1.74 0.00 0.00 68.15 68.34 3gli h THR 319 CO 0.10 0.15 0.18 -0.63 0.37 0.00 0.00 175.52 175.69 3gli s ILE 320 N -2.98 4.83 0.37 3.11 1.01 -1.07 -5.02 121.20 121.45 3gli s ILE 320 Ca -0.10 1.66 -0.28 0.00 0.00 0.00 0.00 60.65 61.94 3gli s ILE 320 Cb 0.00 -4.14 -0.11 0.00 0.01 0.00 0.00 42.46 38.23 3gli s ILE 320 CO 0.34 0.30 1.49 -2.84 0.00 0.00 0.00 174.94 174.23 3gli s PRO 321 N 0.35 4.12 0.07 2.79 0.02 -1.26 -4.85 135.00 136.24 3gli s PRO 321 Ca 0.41 2.56 -0.15 0.00 0.02 0.00 0.00 61.00 63.83 3gli s PRO 321 Cb -0.20 -2.98 -0.04 0.00 0.02 0.00 0.00 34.50 31.30 3gli s PRO 321 CO 0.23 -0.53 1.26 -1.35 -0.33 0.00 0.00 177.00 176.28 3gli h PRO 322 N 3.20 -0.04 -0.07 5.54 0.11 -1.95 -1.44 132.00 137.35 3gli h PRO 322 Ca -0.50 0.00 0.01 0.00 0.11 0.00 0.00 66.00 65.62 3gli h PRO 322 Cb 1.24 0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.35 3gli h PRO 322 CO 0.66 -0.03 -0.04 2.41 -0.21 0.00 0.00 178.00 180.79 3gli n THR 323 N -4.07 -0.05 0.06 -1.15 -1.04 -1.26 -0.74 114.28 106.02 3gli n THR 323 Ca 0.00 0.98 0.20 0.00 -2.04 0.00 0.00 64.05 63.19 3gli n THR 323 Cb 0.14 -1.29 0.73 0.00 -1.82 0.00 0.00 70.33 68.08 3gli n THR 323 CO 0.00 0.00 0.00 0.44 -0.64 0.00 0.00 175.07 174.87 3gli h ASP 324 N 0.00 0.00 -0.20 8.00 3.32 -1.68 -0.95 116.42 124.91 3gli h ASP 324 Ca 0.01 0.00 -0.10 0.00 0.02 0.00 0.00 57.03 56.96 3gli h ASP 324 Cb 0.03 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.58 3gli h ASP 324 CO -0.06 0.00 -0.28 0.40 -1.72 0.00 0.00 179.24 177.58 3gli h ILE 325 N 0.00 1.33 -1.01 0.35 2.04 0.06 -2.40 117.51 117.87 3gli h ILE 325 Ca 0.21 -1.48 0.25 0.00 1.00 0.00 0.00 64.86 64.84 3gli h ILE 325 Cb 0.95 1.82 -0.12 0.00 -0.74 0.00 0.00 36.82 38.73 3gli h ILE 325 CO -0.00 0.45 0.61 1.56 0.00 0.00 0.00 178.15 180.78 3gli h GLN 326 N 0.21 0.54 0.61 2.37 1.08 -0.54 0.19 115.11 119.57 3gli h GLN 326 Ca 0.02 -0.03 -0.03 0.00 -1.45 0.00 0.00 58.65 57.16 3gli h GLN 326 Cb 0.85 -0.12 0.01 0.00 -0.05 0.00 0.00 27.48 28.17 3gli h GLN 326 CO 0.07 0.36 -0.29 -0.07 -0.95 0.00 0.00 178.83 177.94 3gli h LEU 327 N 0.55 -0.70 -0.57 1.46 3.38 -1.29 -1.74 115.31 116.41 3gli h LEU 327 Ca 0.63 -0.01 0.11 0.00 0.09 0.00 0.00 57.88 58.70 3gli h LEU 327 Cb 1.27 0.18 -0.11 0.00 0.09 0.00 0.00 40.66 42.09 3gli h LEU 327 CO -0.43 -0.42 -0.19 1.88 0.09 0.00 0.00 178.44 179.37 3gli h TYR 328 N -0.94 -0.45 0.05 1.13 0.05 -0.43 0.41 116.97 116.78 3gli h TYR 328 Ca -0.08 0.06 0.01 0.00 0.05 0.00 0.00 58.73 58.76 3gli h TYR 328 Cb 0.67 0.29 -0.01 0.00 1.01 0.00 0.00 36.73 38.68 3gli h TYR 328 CO -0.01 -0.29 -0.07 -0.92 -1.05 0.00 0.00 178.16 175.82 3gli h TYR 329 N -0.05 -0.18 -0.10 4.88 3.20 -0.64 -1.72 116.97 122.37 3gli h TYR 329 Ca 0.27 0.00 0.02 0.00 3.14 0.00 0.00 58.73 62.16 3gli h TYR 329 Cb 0.47 0.07 -0.02 0.00 1.54 0.00 0.00 36.73 38.79 3gli h TYR 329 CO -0.51 -0.11 0.00 0.37 -1.64 0.00 0.00 178.16 176.27 3gli h GLN 330 N -0.14 0.04 -0.90 1.82 4.15 -0.80 0.08 115.11 119.35 3gli h GLN 330 Ca 0.01 -0.00 0.13 0.00 0.77 0.00 0.00 58.65 59.56 3gli h GLN 330 Cb 0.15 -0.01 -0.07 0.00 0.21 0.00 0.00 27.48 27.76 3gli h GLN 330 CO -0.04 0.02 0.58 1.15 -1.93 0.00 0.00 178.83 178.62 3gli h THR 331 N 0.04 0.86 -0.13 2.39 2.02 -0.56 -0.20 112.91 117.34 3gli h THR 331 Ca 0.05 -0.26 -0.18 0.00 0.77 0.00 0.00 66.41 66.79 3gli h THR 331 Cb 0.05 0.05 0.01 0.00 -1.74 0.00 0.00 68.15 66.51 3gli h THR 331 CO -0.08 0.14 -0.60 -0.07 0.37 0.00 0.00 175.52 175.28 3gli h LEU 332 N 0.75 0.75 0.46 2.58 3.38 -0.70 -2.14 115.31 120.39 3gli h LEU 332 Ca 0.45 -0.63 -0.01 0.00 0.09 0.00 0.00 57.88 57.77 3gli h LEU 332 Cb 0.65 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.16 3gli h LEU 332 CO -0.21 1.26 -0.42 0.25 0.09 0.00 0.00 178.44 179.41 3gli h LEU 333 N 0.29 -1.15 -0.99 1.67 5.85 0.04 0.70 115.31 121.72 3gli h LEU 333 Ca -0.04 0.09 0.28 0.00 0.84 0.00 0.00 57.88 59.04 3gli h LEU 333 Cb 1.24 0.37 -0.18 0.00 0.37 0.00 0.00 40.66 42.46 3gli h LEU 333 CO 0.13 -0.57 0.03 0.40 -0.34 0.00 0.00 178.44 178.09 3gli h ILE 334 N -0.87 0.01 -0.12 4.05 2.04 -1.18 0.90 117.51 122.35 3gli h ILE 334 Ca -0.06 -0.00 -0.10 0.00 1.00 0.00 0.00 64.86 65.70 3gli h ILE 334 Cb 0.74 0.01 -0.01 0.00 -0.74 0.00 0.00 36.82 36.82 3gli h ILE 334 CO -0.03 0.00 -0.38 1.23 0.00 0.00 0.00 178.15 178.97 3gli h GLY 335 N 0.01 0.27 0.84 5.37 0.00 -0.56 -0.33 103.07 108.66 3gli h GLY 335 Ca 0.61 -0.24 -0.01 0.00 0.00 0.00 0.00 47.33 47.69 3gli h GLY 335 CO -0.93 0.22 0.03 -0.09 0.00 0.00 0.00 176.54 175.78 3gli h ARG 336 N 0.21 0.15 0.00 4.80 2.43 0.69 -1.73 114.38 120.93 3gli h ARG 336 Ca 0.02 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.16 3gli h ARG 336 Cb 0.77 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.30 3gli h ARG 336 CO 0.06 0.30 0.00 1.17 -1.51 0.00 0.00 179.97 179.99 3gli n LYS 337 N -4.90 0.00 0.00 0.20 4.81 0.15 -1.99 118.16 116.43 3gli n LYS 337 Ca -0.06 0.56 0.00 0.00 -0.87 0.00 0.00 58.31 57.94 3gli n LYS 337 Cb 0.13 -1.29 0.00 0.00 0.02 0.00 0.00 35.03 33.89 3gli n LYS 337 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 3gli n GLU 338 N -1.78 0.41 0.19 1.64 1.02 -0.19 -4.17 120.64 117.76 3gli n GLU 338 Ca 0.00 0.00 -0.13 0.00 -0.02 0.00 0.00 57.16 57.01 3gli n GLU 338 Cb 0.00 -1.18 -0.08 0.00 -0.02 0.00 0.00 31.44 30.16 3gli n GLU 338 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 3gli h LEU 339 N 0.52 -0.43 0.00 -4.62 5.85 -0.67 -3.13 115.31 112.84 3gli h LEU 339 Ca 0.00 -0.14 0.00 0.00 0.84 0.00 0.00 57.88 58.58 3gli h LEU 339 Cb 0.18 0.11 0.00 0.00 0.37 0.00 0.00 40.66 41.32 3gli h LEU 339 CO 0.00 -0.06 0.00 -2.65 -0.34 0.00 0.00 178.44 175.39 3gli n PRO 340 N -5.18 0.09 -0.03 5.25 -0.02 -1.26 -2.69 135.00 131.16 3gli n PRO 340 Ca -0.10 0.24 -0.03 0.00 -2.02 0.00 0.00 63.50 61.59 3gli n PRO 340 Cb 0.28 -1.50 -0.14 0.00 -0.02 0.00 0.00 33.50 32.12 3gli n PRO 340 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 3gli n TYR 341 N -1.32 0.41 -2.38 6.00 4.02 -1.19 -4.89 117.16 117.82 3gli n TYR 341 Ca 0.03 0.14 -0.35 0.00 -0.01 0.00 0.00 57.90 57.71 3gli n TYR 341 Cb 0.07 -0.95 -0.02 0.00 -0.02 0.00 0.00 39.34 38.42 3gli n TYR 341 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 3gli s ALA 342 N -2.83 2.86 0.26 -0.72 0.00 -1.10 -4.96 121.76 115.29 3gli s ALA 342 Ca -0.07 0.77 -0.10 0.00 0.00 0.00 0.00 51.96 52.56 3gli s ALA 342 Cb 0.09 -3.32 0.40 0.00 0.00 0.00 0.00 23.12 20.28 3gli s ALA 342 CO 0.84 -0.54 1.57 -1.35 0.00 0.00 0.00 175.76 176.29 3gli h PRO 343 N 1.67 -0.00 -6.32 0.00 0.11 -1.90 -3.38 132.00 122.19 3gli h PRO 343 Ca -0.49 0.00 -0.60 0.00 0.11 0.00 0.00 66.00 65.02 3gli h PRO 343 Cb 1.24 0.00 -0.13 0.00 0.11 0.00 0.00 31.00 32.23 3gli h PRO 343 CO 0.59 -0.00 -0.71 -0.51 -0.21 0.00 0.00 178.00 177.16 3gli s ASP 344 N -5.26 4.19 0.15 -2.05 1.01 -1.26 -5.03 116.67 108.42 3gli s ASP 344 Ca -0.15 -0.71 -0.10 0.00 0.71 0.00 0.00 52.55 52.30 3gli s ASP 344 Cb 0.25 -0.66 -0.03 0.00 1.01 0.00 0.00 42.92 43.49 3gli s ASP 344 CO 0.77 0.05 1.46 0.03 0.21 0.00 0.00 175.17 177.69 3gli h ARG 345 N 2.40 0.88 0.21 8.23 3.08 -1.85 -2.73 114.38 124.59 3gli h ARG 345 Ca -0.44 -0.50 0.01 0.00 0.07 0.00 0.00 59.98 59.12 3gli h ARG 345 Cb 1.23 0.03 -0.03 0.00 0.08 0.00 0.00 29.97 31.28 3gli h ARG 345 CO 0.57 1.14 -0.36 -0.09 -1.07 0.00 0.00 179.97 180.16 3gli h ARG 346 N 0.70 -0.62 -0.52 0.04 2.43 -1.94 -2.02 114.38 112.45 3gli h ARG 346 Ca 0.04 0.04 0.10 0.00 -0.81 0.00 0.00 59.98 59.36 3gli h ARG 346 Cb 1.04 0.14 -0.09 0.00 -0.42 0.00 0.00 29.97 30.65 3gli h ARG 346 CO 0.10 -0.41 -0.01 1.98 -1.51 0.00 0.00 179.97 180.12 3gli h MET 347 N -0.64 0.10 -0.98 0.20 4.05 -1.94 0.17 114.93 115.89 3gli h MET 347 Ca 0.01 -0.01 0.26 0.00 -0.28 0.00 0.00 59.70 59.69 3gli h MET 347 Cb 0.63 -0.02 -0.13 0.00 -0.80 0.00 0.00 31.60 31.28 3gli h MET 347 CO -0.16 0.07 0.55 0.78 0.23 0.00 0.00 176.91 178.38 3gli h GLY 348 N 0.11 1.88 0.99 1.39 0.00 -1.12 0.39 103.07 106.71 3gli h GLY 348 Ca 0.27 -0.26 -0.15 0.00 0.00 0.00 0.00 47.33 47.18 3gli h GLY 348 CO -0.45 -0.32 -0.45 -2.08 0.00 0.00 0.00 176.54 173.25 3gli h VAL 349 N 0.48 1.32 -0.41 4.60 2.07 -0.06 -2.26 116.25 121.97 3gli h VAL 349 Ca 0.65 -1.67 -0.09 0.00 0.82 0.00 0.00 66.70 66.42 3gli h VAL 349 Cb 1.32 1.83 -0.02 0.00 -1.52 0.00 0.00 31.29 32.90 3gli h VAL 349 CO -0.52 0.52 -0.11 -0.33 0.02 0.00 0.00 177.57 177.15 3gli h GLU 350 N 0.38 0.73 0.00 1.57 5.08 0.15 -0.00 114.58 122.48 3gli h GLU 350 Ca 0.00 -0.23 -0.14 0.00 -1.00 0.00 0.00 59.36 57.99 3gli h GLU 350 Cb 1.05 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 30.22 3gli h GLU 350 CO 0.10 0.81 -0.66 0.52 -1.00 0.00 0.00 179.01 178.78 3gli h MET 351 N 0.66 0.00 -0.05 2.33 2.86 -0.41 -1.08 114.93 119.24 3gli h MET 351 Ca 0.12 0.00 -0.09 0.00 -2.06 0.00 0.00 59.70 57.66 3gli h MET 351 Cb 0.57 0.00 0.01 0.00 0.06 0.00 0.00 31.60 32.23 3gli h MET 351 CO 0.04 0.66 -0.34 1.15 1.06 0.00 0.00 176.91 179.48 3gli h THR 352 N 0.00 1.45 -0.17 2.22 2.02 -0.74 -1.17 112.91 116.52 3gli h THR 352 Ca -0.01 -1.81 0.03 0.00 0.77 0.00 0.00 66.41 65.39 3gli h THR 352 Cb 1.22 2.45 -0.03 0.00 -1.74 0.00 0.00 68.15 70.06 3gli h THR 352 CO 0.09 0.52 -0.01 -0.07 0.37 0.00 0.00 175.52 176.42 3gli h LEU 353 N -0.22 -0.08 0.17 2.58 3.38 -1.02 -1.50 115.31 118.63 3gli h LEU 353 Ca -0.03 0.04 0.01 0.00 0.09 0.00 0.00 57.88 57.99 3gli h LEU 353 Cb 1.02 0.07 -0.04 0.00 0.09 0.00 0.00 40.66 41.79 3gli h LEU 353 CO 0.07 -0.01 -0.52 -0.07 0.09 0.00 0.00 178.44 177.99 3gli h LEU 354 N 0.05 -1.56 -0.80 1.67 3.38 -1.12 1.15 115.31 118.08 3gli h LEU 354 Ca 0.08 0.16 0.19 0.00 0.09 0.00 0.00 57.88 58.40 3gli h LEU 354 Cb 0.10 0.57 -0.14 0.00 0.09 0.00 0.00 40.66 41.28 3gli h LEU 354 CO -0.14 -0.57 0.06 -0.09 0.09 0.00 0.00 178.44 177.79 3gli h ARG 355 N -0.79 0.12 0.00 1.13 2.43 -1.00 0.61 114.38 116.89 3gli h ARG 355 Ca -0.01 -0.01 -0.08 0.00 -0.81 0.00 0.00 59.98 59.06 3gli h ARG 355 Cb 0.77 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.28 3gli h ARG 355 CO -0.25 0.08 -0.40 0.00 -1.51 0.00 0.00 179.97 177.89 3gli h ALA 356 N 1.74 1.06 0.25 2.80 0.00 -0.01 -3.32 119.26 121.78 3gli h ALA 356 Ca 0.45 -0.36 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 3gli h ALA 356 Cb 0.84 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.53 3gli h ALA 356 CO -0.68 0.50 -0.42 1.25 0.00 0.00 0.00 179.25 179.90 3gli h LEU 357 N 0.00 -1.21 -5.49 0.00 5.85 0.71 -3.03 115.31 112.14 3gli h LEU 357 Ca -0.00 0.11 -0.67 0.00 0.84 0.00 0.00 57.88 58.16 3gli h LEU 357 Cb 0.86 0.42 0.00 0.00 0.37 0.00 0.00 40.66 42.32 3gli h LEU 357 CO 0.05 -0.49 3.45 0.00 -0.34 0.00 0.00 178.44 181.11 3gli n ALA 358 N -2.77 6.44 0.23 1.25 0.00 -1.20 -3.56 120.51 120.90 3gli n ALA 358 Ca -0.08 -3.59 0.03 0.00 0.00 0.00 0.00 53.44 49.79 3gli n ALA 358 Cb 0.35 -3.44 -0.04 0.00 0.00 0.00 0.00 19.45 16.33 3gli n ALA 358 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 3gli n PHE 359 N 4.80 0.00 0.05 0.00 3.72 -1.15 -4.90 117.46 119.98 3gli n PHE 359 Ca 0.65 0.00 -0.13 0.00 -0.05 0.00 0.00 57.45 57.92 3gli n PHE 359 Cb 0.30 -0.03 -0.09 0.00 -0.94 0.00 0.00 39.48 38.72 3gli n PHE 359 CO 0.00 0.00 0.00 1.25 -0.05 0.00 0.00 176.76 177.96 3gli h HIS 360 N 0.00 -0.09 -3.67 1.38 2.76 -1.83 -3.41 115.15 110.29 3gli h HIS 360 Ca 0.00 -0.00 -0.62 0.00 -2.20 0.00 0.00 60.37 57.55 3gli h HIS 360 Cb 0.18 0.03 -0.14 0.00 1.55 0.00 0.00 27.41 29.03 3gli h HIS 360 CO 0.00 0.20 -0.30 -2.14 -1.30 0.00 0.00 177.93 174.40 3gli s PRO 361 N -4.99 4.05 0.00 5.26 0.02 -1.26 -4.97 135.00 133.11 3gli s PRO 361 Ca -0.15 -0.01 0.00 0.00 0.02 0.00 0.00 61.00 60.87 3gli s PRO 361 Cb 0.03 -3.61 0.00 0.00 0.02 0.00 0.00 34.50 30.94 3gli s PRO 361 CO 0.64 -0.17 0.63 0.54 -0.33 0.00 0.00 177.00 178.31 3gli n ARG 362 N 4.97 0.00 0.00 5.54 1.74 -1.26 -5.21 116.66 122.43 3gli n ARG 362 Ca -0.10 0.30 0.00 0.00 -0.77 0.00 0.00 57.85 57.28 3gli n ARG 362 Cb 0.51 -1.19 0.00 0.00 -1.02 0.00 0.00 32.46 30.76 3gli n ARG 362 CO 0.00 0.00 0.00 -1.33 -1.52 0.00 0.00 177.63 174.78