#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gql n ASP 6 N 0.00 2.87 0.00 1.62 5.68 -1.26 -4.40 116.55 121.06 1gql n ASP 6 Ca 0.00 -1.91 0.00 0.00 -0.50 0.00 0.00 54.79 52.38 1gql n ASP 6 Cb 0.00 -0.21 0.00 0.00 -1.14 0.00 0.00 41.12 39.77 1gql n ASP 6 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1gql n GLY 7 N 0.68 0.87 0.27 6.12 0.00 -1.26 -3.75 105.19 108.11 1gql n GLY 7 Ca 0.12 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.15 1gql n GLY 7 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1gql h TYR 8 N 0.00 0.45 0.00 1.61 3.20 -1.88 -1.34 116.97 119.02 1gql h TYR 8 Ca 0.00 -0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.83 1gql h TYR 8 Cb 0.00 -0.13 0.00 0.00 1.54 0.00 0.00 36.73 38.14 1gql h TYR 8 CO 0.00 0.47 0.00 -0.25 -1.64 0.00 0.00 178.16 176.74 1gql n ASP 9 N -4.30 0.24 0.00 -2.11 8.00 -1.26 -4.96 116.55 112.17 1gql n ASP 9 Ca 0.01 0.53 0.00 0.00 0.71 0.00 0.00 54.79 56.04 1gql n ASP 9 Cb 0.24 -0.59 0.00 0.00 -0.02 0.00 0.00 41.12 40.74 1gql n ASP 9 CO 0.00 0.00 0.00 0.23 -0.39 0.00 0.00 177.20 177.04 1gql n MET 10 N -1.74 0.00 -0.12 -1.24 2.81 -0.51 -1.47 117.12 114.86 1gql n MET 10 Ca 0.06 0.00 0.11 0.00 -1.81 0.00 0.00 57.70 56.05 1gql n MET 10 Cb 0.32 0.00 0.31 0.00 -0.71 0.00 0.00 33.22 33.14 1gql n MET 10 CO 0.00 0.00 0.00 -2.67 1.51 0.00 0.00 175.97 174.81 1gql n TRP 11 N 14.00 0.30 -2.79 2.03 2.14 -1.26 -4.38 117.44 127.48 1gql n TRP 11 Ca 0.00 -0.15 -0.39 0.00 2.07 0.00 0.00 57.50 59.03 1gql n TRP 11 Cb 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 31.31 30.50 1gql n TRP 11 CO 0.00 0.00 0.00 1.28 2.07 0.00 0.00 177.69 181.04 1gql n LEU 12 N 0.70 6.60 -4.36 5.67 4.77 -0.54 -4.64 117.00 125.19 1gql n LEU 12 Ca 0.17 -5.41 -0.45 0.00 -0.03 0.00 0.00 56.01 50.29 1gql n LEU 12 Cb 0.42 -1.07 -0.05 0.00 -2.33 0.00 0.00 43.42 40.38 1gql n LEU 12 CO 0.14 2.03 0.31 -0.13 -1.33 0.00 0.00 177.39 178.41 1gql s ARG 13 N -3.84 3.03 -1.16 3.23 0.52 -1.26 -4.87 118.95 114.60 1gql s ARG 13 Ca 0.39 -1.40 -0.08 0.00 -0.52 0.00 0.00 55.73 54.12 1gql s ARG 13 Cb 0.18 -4.26 0.25 0.00 0.52 0.00 0.00 34.95 31.64 1gql s ARG 13 CO -0.08 -1.43 1.48 0.66 0.02 0.00 0.00 175.30 175.95 1gql n TYR 14 N 5.97 3.58 -4.06 -0.53 4.01 -1.26 -4.96 117.16 119.91 1gql n TYR 14 Ca -0.11 -3.08 -0.29 0.00 -0.16 0.00 0.00 57.90 54.26 1gql n TYR 14 Cb 0.42 -1.68 -0.06 0.00 -0.31 0.00 0.00 39.34 37.71 1gql n TYR 14 CO 0.00 0.00 0.00 -0.65 -0.46 0.00 0.00 176.86 175.75 1gql s GLN 15 N -0.99 2.88 0.18 -0.72 -0.21 -1.26 -3.91 119.66 115.63 1gql s GLN 15 Ca 0.35 -0.74 -0.33 0.00 0.02 0.00 0.00 55.36 54.66 1gql s GLN 15 Cb 0.01 -2.70 -0.14 0.00 1.00 0.00 0.00 33.01 31.17 1gql s GLN 15 CO 0.02 0.55 1.43 -2.30 -2.12 0.00 0.00 175.29 172.87 1gql n PRO 16 N 0.27 1.84 -1.68 2.91 -0.02 -0.94 -4.06 135.00 133.32 1gql n PRO 16 Ca -0.09 0.66 -0.48 0.00 -2.02 0.00 0.00 63.50 61.57 1gql n PRO 16 Cb 0.52 -2.34 -0.05 0.00 -0.02 0.00 0.00 33.50 31.62 1gql n PRO 16 CO 0.00 0.00 0.00 -0.89 1.98 0.00 0.00 175.50 176.59 1gql n ILE 17 N 2.51 0.43 0.12 4.25 2.08 -0.63 -4.88 119.36 123.23 1gql n ILE 17 Ca 0.15 -0.08 -0.03 0.00 0.56 0.00 0.00 62.75 63.36 1gql n ILE 17 Cb 0.28 -1.77 0.12 0.00 -0.75 0.00 0.00 39.64 37.51 1gql n ILE 17 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1gql h ALA 18 N 8.32 0.86 -1.69 -1.39 0.00 -1.92 -3.41 119.26 120.02 1gql h ALA 18 Ca -0.48 -0.62 -0.56 0.00 0.00 0.00 0.00 54.91 53.26 1gql h ALA 18 Cb 1.27 -0.10 -0.06 0.00 0.00 0.00 0.00 17.79 18.90 1gql h ALA 18 CO 0.93 0.84 1.09 0.34 0.00 0.00 0.00 179.25 182.45 1gql s ASP 19 N -6.84 6.21 0.31 0.00 -1.08 -1.26 -4.90 116.67 109.11 1gql s ASP 19 Ca -0.01 0.56 0.02 0.00 -0.52 0.00 0.00 52.55 52.60 1gql s ASP 19 Cb 0.12 -2.54 0.52 0.00 -1.46 0.00 0.00 42.92 39.56 1gql s ASP 19 CO 0.78 -1.59 1.85 1.56 0.52 0.00 0.00 175.17 178.29 1gql h GLN 20 N 10.99 0.63 -0.26 4.34 1.08 -1.99 0.16 115.11 130.05 1gql h GLN 20 Ca -0.27 -0.14 -0.05 0.00 -1.45 0.00 0.00 58.65 56.75 1gql h GLN 20 Cb 1.10 -0.09 -0.01 0.00 -0.05 0.00 0.00 27.48 28.43 1gql h GLN 20 CO 1.13 0.63 -0.02 1.15 -0.95 0.00 0.00 178.83 180.78 1gql h THR 21 N 0.61 1.26 -0.40 -0.54 2.02 -1.96 -2.26 112.91 111.64 1gql h THR 21 Ca 0.13 -0.96 -0.04 0.00 0.77 0.00 0.00 66.41 66.31 1gql h THR 21 Cb 0.33 1.37 -0.02 0.00 -1.74 0.00 0.00 68.15 68.09 1gql h THR 21 CO 0.01 0.30 0.11 0.25 0.37 0.00 0.00 175.52 176.56 1gql h LEU 22 N 0.25 0.60 -0.63 2.58 5.85 -1.91 -2.66 115.31 119.38 1gql h LEU 22 Ca 0.07 -0.22 0.11 0.00 0.84 0.00 0.00 57.88 58.68 1gql h LEU 22 Cb 0.45 -0.16 -0.08 0.00 0.37 0.00 0.00 40.66 41.24 1gql h LEU 22 CO 0.02 0.67 0.20 0.25 -0.34 0.00 0.00 178.44 179.23 1gql h LEU 23 N 0.51 0.14 -1.19 2.25 5.85 -0.60 -1.46 115.31 120.80 1gql h LEU 23 Ca 0.13 0.10 -0.02 0.00 0.84 0.00 0.00 57.88 58.92 1gql h LEU 23 Cb 0.30 0.10 -0.03 0.00 0.37 0.00 0.00 40.66 41.40 1gql h LEU 23 CO -0.00 0.07 0.28 0.11 -0.34 0.00 0.00 178.44 178.56 1gql h LYS 24 N 0.35 0.84 -0.35 1.25 1.79 -1.29 -0.08 116.57 119.08 1gql h LYS 24 Ca 0.33 -0.11 -0.03 0.00 -2.18 0.00 0.00 60.65 58.66 1gql h LYS 24 Cb 0.46 -0.16 -0.01 0.00 -1.58 0.00 0.00 32.23 30.94 1gql h LYS 24 CO -0.37 0.66 0.10 1.15 -1.08 0.00 0.00 179.45 179.91 1gql h THR 25 N 0.84 1.22 -0.84 -0.16 2.02 -0.96 -1.38 112.91 113.65 1gql h THR 25 Ca 0.21 -0.72 -0.00 0.00 0.77 0.00 0.00 66.41 66.67 1gql h THR 25 Cb 0.10 1.02 -0.04 0.00 -1.74 0.00 0.00 68.15 67.49 1gql h THR 25 CO -0.03 0.24 0.51 1.88 0.37 0.00 0.00 175.52 178.50 1gql h TYR 26 N 0.41 1.09 -0.23 3.16 0.05 -0.63 -1.75 116.97 119.07 1gql h TYR 26 Ca 0.11 0.00 -0.03 0.00 0.05 0.00 0.00 58.73 58.87 1gql h TYR 26 Cb 0.28 -0.36 -0.01 0.00 1.01 0.00 0.00 36.73 37.64 1gql h TYR 26 CO 0.01 0.72 0.01 1.96 -1.05 0.00 0.00 178.16 179.82 1gql h GLN 27 N 1.15 0.33 -0.05 4.88 4.20 -0.82 0.50 115.11 125.30 1gql h GLN 27 Ca 0.30 -0.05 -0.24 0.00 0.06 0.00 0.00 58.65 58.72 1gql h GLN 27 Cb -0.06 -0.06 0.01 0.00 0.30 0.00 0.00 27.48 27.67 1gql h GLN 27 CO -0.06 0.34 -0.93 -0.22 -0.67 0.00 0.00 178.83 177.29 1gql h LYS 28 N 0.32 0.67 -0.11 1.46 3.64 -0.92 -3.35 116.57 118.28 1gql h LYS 28 Ca 0.08 -0.65 -0.16 0.00 -1.27 0.00 0.00 60.65 58.65 1gql h LYS 28 Cb 0.20 0.17 0.01 0.00 -0.41 0.00 0.00 32.23 32.19 1gql h LYS 28 CO 0.00 1.25 -0.56 1.96 -2.27 0.00 0.00 179.45 179.83 1gql h GLN 29 N 0.41 0.57 -3.79 1.90 4.20 -0.83 -3.41 115.11 114.15 1gql h GLN 29 Ca -0.09 -0.47 -0.66 0.00 0.06 0.00 0.00 58.65 57.49 1gql h GLN 29 Cb 1.57 0.10 -0.39 0.00 0.30 0.00 0.00 27.48 29.06 1gql h GLN 29 CO 0.18 1.09 -0.59 0.42 -0.67 0.00 0.00 178.83 179.27 1gql s ILE 30 N -3.68 2.82 -0.06 2.54 -1.09 0.12 -4.20 121.20 117.65 1gql s ILE 30 Ca -0.12 -2.94 0.19 0.00 -2.23 0.00 0.00 60.65 55.54 1gql s ILE 30 Cb 0.06 -2.95 -0.28 0.00 -1.58 0.00 0.00 42.46 37.71 1gql s ILE 30 CO 0.84 -0.77 0.33 0.54 -1.23 0.00 0.00 174.94 174.66 1gql n ARG 31 N 3.54 0.71 -4.04 2.79 1.74 0.16 -4.70 116.66 116.86 1gql n ARG 31 Ca 0.05 -0.13 -0.08 0.00 -0.77 0.00 0.00 57.85 56.91 1gql n ARG 31 Cb 0.36 -1.46 -0.09 0.00 -1.02 0.00 0.00 32.46 30.25 1gql n ARG 31 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 1gql s HIS 32 N -3.11 0.49 -0.21 -1.55 3.76 -1.04 -4.97 115.29 108.65 1gql s HIS 32 Ca -0.07 -0.98 0.01 0.00 -0.15 0.00 0.00 55.06 53.86 1gql s HIS 32 Cb 0.11 -0.32 0.05 0.00 1.11 0.00 0.00 32.58 33.53 1gql s HIS 32 CO 0.78 -0.45 -0.07 -1.17 -0.85 0.00 0.00 174.74 172.98 1gql s LEU 33 N -2.93 2.29 -0.28 0.89 2.96 -1.26 -0.19 118.68 120.16 1gql s LEU 33 Ca 0.10 -0.97 -0.07 0.00 -0.22 0.00 0.00 54.13 52.96 1gql s LEU 33 Cb 0.07 -1.16 -0.00 0.00 0.50 0.00 0.00 46.19 45.60 1gql s LEU 33 CO -0.08 -0.19 0.08 -2.28 -1.32 0.00 0.00 176.35 172.56 1gql s HIS 34 N 1.44 3.12 -0.19 5.38 5.65 0.39 -1.25 115.29 129.83 1gql s HIS 34 Ca -0.03 -0.77 -0.03 0.00 0.25 0.00 0.00 55.06 54.48 1gql s HIS 34 Cb -0.17 -2.26 0.06 0.00 -1.18 0.00 0.00 32.58 29.03 1gql s HIS 34 CO -0.07 -0.50 0.04 0.08 -0.65 0.00 0.00 174.74 173.64 1gql s VAL 35 N 1.55 0.44 0.02 0.89 1.01 -0.63 -2.08 120.40 121.60 1gql s VAL 35 Ca 0.04 -0.49 -0.04 0.00 0.00 0.00 0.00 61.98 61.49 1gql s VAL 35 Cb -0.16 -0.96 -0.28 0.00 0.00 0.00 0.00 36.38 34.97 1gql s VAL 35 CO 0.03 -0.21 0.94 0.00 0.00 0.00 0.00 175.10 175.86 1gql h ALA 36 N 8.27 0.20 -2.32 5.51 0.00 -1.82 -3.33 119.26 125.77 1gql h ALA 36 Ca -0.16 -1.04 -0.51 0.00 0.00 0.00 0.00 54.91 53.20 1gql h ALA 36 Cb 1.12 0.20 0.13 0.00 0.00 0.00 0.00 17.79 19.25 1gql h ALA 36 CO 0.33 1.07 0.30 0.20 0.00 0.00 0.00 179.25 181.15 1gql s GLY 37 N -4.86 1.66 0.00 0.00 0.00 -1.23 -4.99 107.32 97.89 1gql s GLY 37 Ca -0.08 0.17 0.00 0.00 0.00 0.00 0.00 44.72 44.81 1gql s GLY 37 CO 0.87 0.55 0.71 2.09 0.00 0.00 0.00 173.10 177.32 1gql n ASP 38 N -3.61 0.00 -4.71 1.64 5.75 -1.26 -4.75 116.55 109.60 1gql n ASP 38 Ca 0.08 -1.51 -0.31 0.00 -0.01 0.00 0.00 54.79 53.04 1gql n ASP 38 Cb 0.54 -0.10 0.13 0.00 -1.03 0.00 0.00 41.12 40.66 1gql n ASP 38 CO 0.00 0.00 0.00 -0.94 -0.11 0.00 0.00 177.20 176.15 1gql s SER 39 N -0.51 3.56 0.31 -1.12 1.04 -1.26 -4.72 113.70 111.00 1gql s SER 39 Ca 0.00 2.08 0.05 0.00 0.48 0.00 0.00 55.95 58.56 1gql s SER 39 Cb 0.00 -2.55 0.70 0.00 0.10 0.00 0.00 66.02 64.27 1gql s SER 39 CO 0.00 -2.67 1.80 -0.65 0.98 0.00 0.00 173.24 172.70 1gql h PRO 40 N -1.48 0.80 -0.21 4.02 0.11 -1.98 0.84 132.00 134.09 1gql h PRO 40 Ca -0.44 -0.05 -0.11 0.00 0.11 0.00 0.00 66.00 65.51 1gql h PRO 40 Cb 1.26 -0.18 -0.00 0.00 0.11 0.00 0.00 31.00 32.19 1gql h PRO 40 CO 0.45 0.53 -0.31 1.15 -0.21 0.00 0.00 178.00 179.61 1gql h THR 41 N 0.82 1.33 -0.67 -1.15 2.02 -1.92 -0.69 112.91 112.65 1gql h THR 41 Ca 0.54 -1.52 -0.05 0.00 0.77 0.00 0.00 66.41 66.15 1gql h THR 41 Cb 0.77 1.80 -0.03 0.00 -1.74 0.00 0.00 68.15 68.95 1gql h THR 41 CO -0.32 0.47 0.21 0.40 0.37 0.00 0.00 175.52 176.64 1gql h ILE 42 N 0.27 1.25 -0.90 3.11 1.08 -1.73 -1.26 117.51 119.33 1gql h ILE 42 Ca 0.02 -0.87 0.04 0.00 -0.39 0.00 0.00 64.86 63.67 1gql h ILE 42 Cb 0.89 0.55 -0.05 0.00 -3.07 0.00 0.00 36.82 35.14 1gql h ILE 42 CO 0.07 0.34 0.59 0.78 -0.69 0.00 0.00 178.15 179.24 1gql h ASN 43 N 0.97 0.95 -0.46 1.72 2.35 -0.69 0.94 115.58 121.36 1gql h ASN 43 Ca 0.22 -0.01 -0.11 0.00 -0.55 0.00 0.00 56.30 55.85 1gql h ASN 43 Cb 0.30 -0.21 -0.02 0.00 0.05 0.00 0.00 38.32 38.44 1gql h ASN 43 CO -0.01 0.64 -0.11 0.00 -1.65 0.00 0.00 177.43 176.30 1gql h ALA 44 N 1.48 0.86 -0.28 -0.83 0.00 -0.62 -0.57 119.26 119.30 1gql h ALA 44 Ca 0.37 -0.34 -0.05 0.00 0.00 0.00 0.00 54.91 54.89 1gql h ALA 44 Cb 0.07 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 1gql h ALA 44 CO -0.12 0.65 -0.00 0.00 0.00 0.00 0.00 179.25 179.78 1gql h ALA 45 N 1.03 0.38 -0.80 0.00 0.00 -0.52 -1.80 119.26 117.55 1gql h ALA 45 Ca 0.13 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 1gql h ALA 45 Cb 0.65 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.30 1gql h ALA 45 CO 0.05 0.12 0.46 0.00 0.00 0.00 0.00 179.25 179.88 1gql h ALA 46 N 0.83 1.03 -0.39 0.00 0.00 -0.72 -0.74 119.26 119.26 1gql h ALA 46 Ca 0.08 -0.11 -0.10 0.00 0.00 0.00 0.00 54.91 54.78 1gql h ALA 46 Cb 0.43 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 1gql h ALA 46 CO 0.01 0.51 -0.18 0.00 0.00 0.00 0.00 179.25 179.60 1gql h ALA 47 N 1.25 0.95 -0.13 0.00 0.00 -1.00 0.86 119.26 121.19 1gql h ALA 47 Ca 0.29 -0.34 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 1gql h ALA 47 Cb -0.00 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.62 1gql h ALA 47 CO -0.05 0.61 0.01 1.49 0.00 0.00 0.00 179.25 181.31 1gql h GLU 48 N 0.66 0.22 -0.81 0.00 4.57 -0.92 -1.92 114.58 116.39 1gql h GLU 48 Ca 0.10 -0.07 -0.04 0.00 -1.18 0.00 0.00 59.36 58.17 1gql h GLU 48 Cb 0.66 -0.02 -0.04 0.00 -0.16 0.00 0.00 28.75 29.20 1gql h GLU 48 CO 0.05 0.44 0.33 -0.07 -1.18 0.00 0.00 179.01 178.58 1gql h LEU 49 N -0.03 1.10 0.14 1.64 3.38 -0.95 0.23 115.31 120.82 1gql h LEU 49 Ca 0.04 -0.17 -0.01 0.00 0.09 0.00 0.00 57.88 57.83 1gql h LEU 49 Cb 0.34 -0.29 0.00 0.00 0.09 0.00 0.00 40.66 40.80 1gql h LEU 49 CO 0.00 0.97 -0.07 -0.61 0.09 0.00 0.00 178.44 178.83 1gql h GLN 50 N 1.17 -0.18 -0.41 1.13 4.15 -0.77 0.21 115.11 120.42 1gql h GLN 50 Ca 0.27 0.01 -0.14 0.00 0.77 0.00 0.00 58.65 59.56 1gql h GLN 50 Cb 0.20 0.04 -0.01 0.00 0.21 0.00 0.00 27.48 27.92 1gql h GLN 50 CO -0.02 -0.07 -0.30 0.07 -1.93 0.00 0.00 178.83 176.58 1gql h ARG 51 N -0.24 0.89 0.15 1.69 0.11 -1.27 -2.00 114.38 113.71 1gql h ARG 51 Ca -0.02 -0.41 -0.01 0.00 0.10 0.00 0.00 59.98 59.64 1gql h ARG 51 Cb 0.19 -0.01 0.00 0.00 1.11 0.00 0.00 29.97 31.26 1gql h ARG 51 CO 0.03 1.06 -0.07 0.78 0.10 0.00 0.00 179.97 181.87 1gql h GLY 52 N 0.88 -0.21 1.10 0.08 0.00 -0.44 -1.98 103.07 102.50 1gql h GLY 52 Ca 0.08 0.08 -0.04 0.00 0.00 0.00 0.00 47.33 47.45 1gql h GLY 52 CO 0.08 -0.08 0.31 1.41 0.00 0.00 0.00 176.54 178.26 1gql h LEU 53 N -0.68 1.05 -0.77 3.11 3.38 -0.67 -0.65 115.31 120.08 1gql h LEU 53 Ca -0.02 -0.16 -0.02 0.00 0.09 0.00 0.00 57.88 57.77 1gql h LEU 53 Cb 0.50 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 40.94 1gql h LEU 53 CO 0.03 0.93 0.39 0.28 0.09 0.00 0.00 178.44 180.16 1gql h SER 54 N 1.11 0.99 -0.01 -0.43 0.02 -1.38 0.32 113.55 114.18 1gql h SER 54 Ca 0.26 -0.12 -0.01 0.00 -0.84 0.00 0.00 61.79 61.08 1gql h SER 54 Cb 0.21 -0.25 0.00 0.00 0.14 0.00 0.00 62.40 62.49 1gql h SER 54 CO -0.02 0.83 -0.02 1.23 -1.14 0.00 0.00 176.83 177.71 1gql h GLY 55 N 1.08 0.03 1.39 -3.77 0.00 -1.14 -1.59 103.07 99.06 1gql h GLY 55 Ca 0.27 -0.04 -0.08 0.00 0.00 0.00 0.00 47.33 47.48 1gql h GLY 55 CO -0.04 0.03 -0.06 1.41 0.00 0.00 0.00 176.54 177.89 1gql h LEU 56 N -0.56 0.72 -0.69 3.11 3.38 -1.07 -2.48 115.31 117.72 1gql h LEU 56 Ca -0.00 -0.19 0.00 0.00 0.09 0.00 0.00 57.88 57.78 1gql h LEU 56 Cb 0.62 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.18 1gql h LEU 56 CO 0.00 0.82 -0.39 0.18 0.09 0.00 0.00 178.44 179.15 1gql n LEU 57 N -4.19 1.46 -3.64 1.67 4.32 0.09 -1.61 117.00 115.09 1gql n LEU 57 Ca 0.02 -0.48 -0.23 0.00 -0.02 0.00 0.00 56.01 55.29 1gql n LEU 57 Cb 0.33 -0.07 0.06 0.00 -1.62 0.00 0.00 43.42 42.12 1gql n LEU 57 CO 0.42 0.28 0.12 -3.20 -1.22 0.00 0.00 177.39 173.78 1gql n ASN 58 N -0.42 -3.91 -3.50 -1.43 5.15 -0.63 -4.96 115.26 105.56 1gql n ASN 58 Ca 0.10 -0.67 -0.14 0.00 -0.60 0.00 0.00 54.58 53.27 1gql n ASN 58 Cb 0.40 -4.62 -0.04 0.00 -0.53 0.00 0.00 39.78 34.99 1gql n ASN 58 CO 0.00 0.00 0.00 -1.59 1.40 0.00 0.00 177.26 177.07 1gql s LYS 59 N -6.07 1.04 -0.14 1.20 -2.85 -1.00 -5.06 119.74 106.86 1gql s LYS 59 Ca 0.34 -0.01 -0.29 0.00 -1.00 0.00 0.00 55.97 55.01 1gql s LYS 59 Cb -0.16 0.49 -0.03 0.00 -2.06 0.00 0.00 37.83 36.07 1gql s LYS 59 CO 0.77 -0.38 1.48 -2.14 0.10 0.00 0.00 175.35 175.18 1gql s PRO 60 N -2.07 4.12 -0.25 1.78 0.02 -1.26 -4.19 135.00 133.14 1gql s PRO 60 Ca -0.05 1.85 0.03 0.00 0.02 0.00 0.00 61.00 62.85 1gql s PRO 60 Cb -0.00 -3.91 0.06 0.00 0.02 0.00 0.00 34.50 30.67 1gql s PRO 60 CO 0.01 -0.88 -0.10 0.42 -0.33 0.00 0.00 177.00 176.11 1gql s ILE 61 N 4.05 2.07 -0.12 2.83 -1.09 -1.26 -5.02 121.20 122.66 1gql s ILE 61 Ca 0.65 -1.55 -0.02 0.00 -2.23 0.00 0.00 60.65 57.50 1gql s ILE 61 Cb -0.27 -2.19 -0.03 0.00 -1.58 0.00 0.00 42.46 38.39 1gql s ILE 61 CO 0.23 -0.02 -0.03 -0.69 -1.23 0.00 0.00 174.94 173.20 1gql s VAL 62 N 1.15 3.99 0.11 2.92 1.01 -1.26 -4.60 120.40 123.72 1gql s VAL 62 Ca -0.08 -0.35 -0.31 0.00 0.00 0.00 0.00 61.98 61.24 1gql s VAL 62 Cb -0.20 -2.70 -0.08 0.00 0.00 0.00 0.00 36.38 33.40 1gql s VAL 62 CO -0.05 0.54 1.36 0.00 0.00 0.00 0.00 175.10 176.95 1gql s ALA 63 N -0.22 3.56 0.02 5.51 0.00 -1.26 -4.21 121.76 125.17 1gql s ALA 63 Ca 0.04 1.08 -0.03 0.00 0.00 0.00 0.00 51.96 53.06 1gql s ALA 63 Cb -0.13 -3.52 -0.02 0.00 0.00 0.00 0.00 23.12 19.46 1gql s ALA 63 CO 0.02 -0.59 0.04 1.03 0.00 0.00 0.00 175.76 176.26 1gql s ARG 64 N 1.05 0.45 -0.68 0.00 0.52 -0.38 -4.96 118.95 114.94 1gql s ARG 64 Ca 0.63 -0.67 -0.01 0.00 -0.52 0.00 0.00 55.73 55.16 1gql s ARG 64 Cb -0.36 0.17 0.17 0.00 0.52 0.00 0.00 34.95 35.46 1gql s ARG 64 CO 0.30 -0.10 0.50 0.34 0.02 0.00 0.00 175.30 176.37 1gql s ASP 65 N -1.79 5.25 0.28 0.23 2.15 -1.25 -1.61 116.67 119.93 1gql s ASP 65 Ca -0.10 -3.18 0.03 0.00 0.43 0.00 0.00 52.55 49.72 1gql s ASP 65 Cb -0.05 -1.82 -0.04 0.00 -0.30 0.00 0.00 42.92 40.71 1gql s ASP 65 CO -0.02 -0.28 0.17 -1.83 -0.17 0.00 0.00 175.17 173.04 1gql s GLU 66 N -0.54 1.51 0.26 4.34 -1.05 -1.26 -5.06 118.70 116.89 1gql s GLU 66 Ca 0.20 -1.84 -0.31 0.00 -0.15 0.00 0.00 54.97 52.87 1gql s GLU 66 Cb -0.16 0.09 -0.12 0.00 -0.44 0.00 0.00 34.13 33.50 1gql s GLU 66 CO -0.06 -0.47 1.62 1.17 0.95 0.00 0.00 175.26 178.47 1gql n LYS 67 N -0.49 2.68 -1.67 -4.83 4.81 -1.26 -4.82 118.16 112.57 1gql n LYS 67 Ca 0.03 0.96 -0.47 0.00 -0.87 0.00 0.00 58.31 57.95 1gql n LYS 67 Cb 0.65 -2.75 -0.04 0.00 0.02 0.00 0.00 35.03 32.90 1gql n LYS 67 CO 0.00 0.00 0.00 -0.11 1.17 0.00 0.00 177.40 178.46 1gql n LEU 68 N 2.69 3.21 -4.94 3.14 7.94 -1.26 -5.00 117.00 122.79 1gql n LEU 68 Ca 0.11 1.04 -0.26 0.00 -1.11 0.00 0.00 56.01 55.79 1gql n LEU 68 Cb 0.36 -1.40 -0.03 0.00 0.53 0.00 0.00 43.42 42.87 1gql n LEU 68 CO 0.64 -0.21 -0.10 -0.54 -1.11 0.00 0.00 177.39 176.06 1gql s LYS 69 N 2.10 3.41 0.35 1.96 1.02 -1.26 -5.05 119.74 122.27 1gql s LYS 69 Ca 0.84 -0.61 -0.28 0.00 0.02 0.00 0.00 55.97 55.94 1gql s LYS 69 Cb -0.69 -2.95 -0.11 0.00 -0.52 0.00 0.00 37.83 33.56 1gql s LYS 69 CO 0.43 0.52 1.48 0.34 -0.92 0.00 0.00 175.35 177.20 1gql s ASP 70 N -3.21 6.41 -0.73 2.83 2.15 -1.26 -3.64 116.67 119.22 1gql s ASP 70 Ca 0.34 2.98 -0.04 0.00 0.43 0.00 0.00 52.55 56.26 1gql s ASP 70 Cb -0.11 -2.66 -0.04 0.00 -0.30 0.00 0.00 42.92 39.81 1gql s ASP 70 CO 0.28 -0.83 0.64 -1.22 -0.17 0.00 0.00 175.17 173.87 1gql n TYR 71 N 0.80 -1.67 -4.26 -5.34 4.01 0.42 -4.77 117.16 106.35 1gql n TYR 71 Ca 0.02 0.60 -0.30 0.00 -0.16 0.00 0.00 57.90 58.06 1gql n TYR 71 Cb 0.39 -3.67 -0.10 0.00 -0.31 0.00 0.00 39.34 35.65 1gql n TYR 71 CO 0.00 0.00 0.00 -1.12 -0.46 0.00 0.00 176.86 175.28 1gql s SER 72 N -3.34 4.21 -0.21 7.72 0.01 -1.04 -0.67 113.70 120.39 1gql s SER 72 Ca 0.28 -0.45 -0.16 0.00 1.31 0.00 0.00 55.95 56.93 1gql s SER 72 Cb -0.04 -0.73 -0.04 0.00 0.21 0.00 0.00 66.02 65.42 1gql s SER 72 CO 0.51 0.18 0.40 -0.22 0.41 0.00 0.00 173.24 174.52 1gql s LEU 73 N -2.18 4.15 -0.16 2.44 2.96 0.74 -1.37 118.68 125.25 1gql s LEU 73 Ca 0.20 0.51 0.01 0.00 -0.22 0.00 0.00 54.13 54.63 1gql s LEU 73 Cb -0.11 -2.52 0.01 0.00 0.50 0.00 0.00 46.19 44.07 1gql s LEU 73 CO 0.12 -0.09 -0.18 -0.69 -1.32 0.00 0.00 176.35 174.19 1gql s VAL 74 N 1.38 2.35 0.13 1.68 1.01 -0.09 -0.46 120.40 126.41 1gql s VAL 74 Ca 0.19 -0.87 0.11 0.00 0.00 0.00 0.00 61.98 61.41 1gql s VAL 74 Cb -0.15 -1.98 -0.04 0.00 0.00 0.00 0.00 36.38 34.21 1gql s VAL 74 CO 0.08 0.53 -0.25 0.27 0.00 0.00 0.00 175.10 175.73 1gql s ILE 75 N 0.97 2.39 -5.00 2.22 -4.36 -0.88 -1.36 121.20 115.18 1gql s ILE 75 Ca -0.03 -1.74 0.00 0.00 -0.26 0.00 0.00 60.65 58.63 1gql s ILE 75 Cb -0.15 -2.07 0.00 0.00 1.25 0.00 0.00 42.46 41.49 1gql s ILE 75 CO -0.04 0.07 0.00 0.61 0.24 0.00 0.00 174.94 175.82 1gql n GLY 76 N 0.82 -1.37 3.74 6.27 0.00 -0.66 -4.40 105.19 109.59 1gql n GLY 76 Ca -0.17 -1.52 -0.23 0.00 0.00 0.00 0.00 46.02 44.11 1gql n GLY 76 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1gql s THR 77 N -1.91 3.40 0.52 2.61 -4.23 -1.26 -2.28 115.64 112.50 1gql s THR 77 Ca 0.00 -1.67 0.23 0.00 -1.18 0.00 0.00 61.69 59.06 1gql s THR 77 Cb 0.00 -3.03 0.36 0.00 1.34 0.00 0.00 72.50 71.17 1gql s THR 77 CO 0.00 -0.26 2.03 -0.65 -0.54 0.00 0.00 174.62 175.21 1gql h PRO 78 N 1.59 0.02 -0.31 3.99 0.11 -1.81 0.43 132.00 136.02 1gql h PRO 78 Ca -0.45 -0.00 -0.11 0.00 0.11 0.00 0.00 66.00 65.55 1gql h PRO 78 Cb 1.25 -0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.34 1gql h PRO 78 CO 0.62 0.01 -0.27 -0.44 -0.21 0.00 0.00 178.00 177.71 1gql h ASP 79 N 0.02 0.64 -0.01 -2.05 3.32 -1.91 -3.36 116.42 113.07 1gql h ASP 79 Ca 0.19 -0.24 0.00 0.00 0.02 0.00 0.00 57.03 57.01 1gql h ASP 79 Cb 0.75 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 40.12 1gql h ASP 79 CO -0.01 0.88 -0.05 -0.46 -1.72 0.00 0.00 179.24 177.89 1gql n ASN 80 N -4.10 1.29 -3.73 6.45 0.23 -0.79 -4.90 115.26 109.72 1gql n ASN 80 Ca -0.00 -1.15 -0.30 0.00 -0.53 0.00 0.00 54.58 52.60 1gql n ASN 80 Cb 0.44 0.19 -0.14 0.00 -2.08 0.00 0.00 39.78 38.18 1gql n ASN 80 CO 0.00 0.00 0.00 -0.55 -0.93 0.00 0.00 177.26 175.78 1gql s SER 81 N -0.72 3.92 0.51 0.53 0.15 0.07 -3.55 113.70 114.61 1gql s SER 81 Ca 0.06 -1.95 0.23 0.00 0.70 0.00 0.00 55.95 54.98 1gql s SER 81 Cb 0.05 -0.93 1.31 0.00 -1.71 0.00 0.00 66.02 64.74 1gql s SER 81 CO 0.11 -0.37 1.99 -0.65 1.20 0.00 0.00 173.24 175.51 1gql h PRO 82 N 7.65 0.10 -0.31 5.44 0.11 -1.84 -1.27 132.00 141.88 1gql h PRO 82 Ca -0.09 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 66.00 1gql h PRO 82 Cb 0.99 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.06 1gql h PRO 82 CO 0.47 0.07 0.12 -0.07 -0.21 0.00 0.00 178.00 178.38 1gql h LEU 83 N 0.10 0.43 -0.37 2.35 3.38 -1.94 -0.02 115.31 119.23 1gql h LEU 83 Ca 0.27 -0.17 -0.08 0.00 0.09 0.00 0.00 57.88 57.99 1gql h LEU 83 Cb 0.92 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.55 1gql h LEU 83 CO -0.03 0.48 -0.08 0.40 0.09 0.00 0.00 178.44 179.31 1gql h ILE 84 N 0.35 1.27 -0.96 1.22 2.04 -1.72 -2.85 117.51 116.86 1gql h ILE 84 Ca 0.10 -1.14 0.11 0.00 1.00 0.00 0.00 64.86 64.94 1gql h ILE 84 Cb 0.18 1.25 -0.08 0.00 -0.74 0.00 0.00 36.82 37.44 1gql h ILE 84 CO -0.01 0.38 0.61 0.00 0.00 0.00 0.00 178.15 179.13 1gql h ALA 85 N 0.83 1.58 0.00 1.87 0.00 -1.12 -2.32 119.26 120.11 1gql h ALA 85 Ca 0.10 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 1gql h ALA 85 Cb 0.58 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.17 1gql h ALA 85 CO 0.03 0.19 -0.06 0.66 0.00 0.00 0.00 179.25 180.08 1gql h SER 86 N 0.94 0.00 0.71 0.00 4.64 -0.75 -1.99 113.55 117.10 1gql h SER 86 Ca 0.47 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.79 1gql h SER 86 Cb 0.48 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.57 1gql h SER 86 CO -0.23 0.06 0.00 0.18 -0.87 0.00 0.00 176.83 175.97 1gql n LEU 87 N -3.63 0.53 -3.86 5.97 4.77 -0.87 -4.93 117.00 114.99 1gql n LEU 87 Ca -0.02 0.63 -0.35 0.00 -0.03 0.00 0.00 56.01 56.24 1gql n LEU 87 Cb 0.17 -0.55 0.02 0.00 -2.33 0.00 0.00 43.42 40.73 1gql n LEU 87 CO 0.28 -0.48 -0.14 0.59 -1.33 0.00 0.00 177.39 176.31 1gql n ASN 88 N -2.09 -3.94 0.22 -1.43 5.03 -0.75 -4.85 115.26 107.45 1gql n ASN 88 Ca 0.03 -1.10 0.07 0.00 0.87 0.00 0.00 54.58 54.44 1gql n ASN 88 Cb 0.23 -2.80 0.49 0.00 -1.02 0.00 0.00 39.78 36.67 1gql n ASN 88 CO 0.00 0.00 0.00 -0.07 -1.83 0.00 0.00 177.26 175.36 1gql h LEU 89 N -2.09 0.00 0.00 3.41 3.38 -1.82 -3.47 115.31 114.72 1gql h LEU 89 Ca -0.67 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.30 1gql h LEU 89 Cb 1.38 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.13 1gql h LEU 89 CO 0.52 0.27 0.00 0.61 0.09 0.00 0.00 178.44 179.93 1gql n GLY 90 N -0.40 3.31 0.36 0.83 0.00 -1.26 -3.30 105.19 104.72 1gql n GLY 90 Ca -0.01 -0.18 0.07 0.00 0.00 0.00 0.00 46.02 45.89 1gql n GLY 90 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1gql h GLU 91 N 0.00 0.82 -0.95 1.61 4.81 -1.97 -0.69 114.58 118.20 1gql h GLU 91 Ca 0.00 -0.05 0.04 0.00 -0.13 0.00 0.00 59.36 59.22 1gql h GLU 91 Cb 0.00 -0.19 -0.05 0.00 0.63 0.00 0.00 28.75 29.14 1gql h GLU 91 CO 0.00 0.54 0.62 -0.09 -0.73 0.00 0.00 179.01 179.36 1gql h ARG 92 N 0.85 1.16 0.09 1.92 2.43 -1.97 0.12 114.38 118.97 1gql h ARG 92 Ca 0.37 -0.07 -0.17 0.00 -0.81 0.00 0.00 59.98 59.30 1gql h ARG 92 Cb 0.34 -0.26 0.00 0.00 -0.42 0.00 0.00 29.97 29.64 1gql h ARG 92 CO -0.15 0.77 -0.83 1.25 -1.51 0.00 0.00 179.97 179.50 1gql h LEU 93 N 1.20 0.29 -1.33 3.80 5.85 -1.56 -3.37 115.31 120.18 1gql h LEU 93 Ca 0.38 -0.89 0.06 0.00 0.84 0.00 0.00 57.88 58.27 1gql h LEU 93 Cb 0.01 -0.09 -0.05 0.00 0.37 0.00 0.00 40.66 40.90 1gql h LEU 93 CO -0.12 1.37 0.50 -0.61 -0.34 0.00 0.00 178.44 179.24 1gql h GLN 94 N -0.56 0.79 0.00 1.25 4.15 -0.88 -1.89 115.11 117.96 1gql h GLN 94 Ca -0.17 -0.05 0.00 0.00 0.77 0.00 0.00 58.65 59.20 1gql h GLN 94 Cb 1.49 -0.18 0.00 0.00 0.21 0.00 0.00 27.48 29.00 1gql h GLN 94 CO 0.05 0.52 0.09 0.00 -1.93 0.00 0.00 178.83 177.57 1gql h ALA 95 N 1.59 1.09 -0.00 3.38 0.00 -0.94 -2.19 119.26 122.19 1gql h ALA 95 Ca 0.32 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.23 1gql h ALA 95 Cb 0.23 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1gql h ALA 95 CO -0.11 -0.09 -0.02 1.28 0.00 0.00 0.00 179.25 180.32 1gql n LEU 96 N -2.89 0.06 0.00 0.00 4.77 -0.71 -5.01 117.00 113.23 1gql n LEU 96 Ca -0.02 0.24 0.00 0.00 -0.03 0.00 0.00 56.01 56.19 1gql n LEU 96 Cb 0.15 -0.26 0.00 0.00 -2.33 0.00 0.00 43.42 40.98 1gql n LEU 96 CO 0.17 0.01 0.00 0.61 -1.33 0.00 0.00 177.39 176.85 1gql n GLY 97 N 1.28 -0.18 0.05 -0.72 0.00 -0.83 -1.95 105.19 102.85 1gql n GLY 97 Ca 0.15 -1.04 0.13 0.00 0.00 0.00 0.00 46.02 45.25 1gql n GLY 97 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gql n ALA 98 N 2.29 2.19 -0.51 4.61 0.00 -1.26 -3.76 120.51 124.07 1gql n ALA 98 Ca 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 53.44 53.39 1gql n ALA 98 Cb 0.00 -1.44 0.00 0.00 0.00 0.00 0.00 19.45 18.01 1gql n ALA 98 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1gql n GLU 99 N -1.87 -0.34 -2.43 0.00 1.02 -1.26 -4.44 120.64 111.32 1gql n GLU 99 Ca 0.06 -0.23 -0.24 0.00 -0.02 0.00 0.00 57.16 56.73 1gql n GLU 99 Cb 0.35 -0.72 0.07 0.00 -0.02 0.00 0.00 31.44 31.12 1gql n GLU 99 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 1gql s GLY 100 N -0.02 1.76 0.17 0.62 0.00 -0.82 -4.35 107.32 104.68 1gql s GLY 100 Ca 0.00 -1.23 -0.17 0.00 0.00 0.00 0.00 44.72 43.32 1gql s GLY 100 CO 0.00 -0.83 0.47 -2.52 0.00 0.00 0.00 173.10 170.22 1gql s TYR 101 N -3.06 -0.13 -0.08 1.90 -0.85 -0.38 -4.24 117.35 110.51 1gql s TYR 101 Ca 0.61 -0.20 0.03 0.00 -0.52 0.00 0.00 57.07 56.99 1gql s TYR 101 Cb -0.09 0.32 0.00 0.00 0.38 0.00 0.00 41.96 42.58 1gql s TYR 101 CO 0.42 -0.83 -0.19 -1.17 -1.52 0.00 0.00 175.55 172.26 1gql s LEU 102 N -2.85 1.91 -0.20 -3.49 2.96 0.76 -1.70 118.68 116.07 1gql s LEU 102 Ca 0.07 -0.45 -0.03 0.00 -0.22 0.00 0.00 54.13 53.51 1gql s LEU 102 Cb 0.00 -1.17 -0.01 0.00 0.50 0.00 0.00 46.19 45.52 1gql s LEU 102 CO -0.06 0.11 -0.07 -0.76 -1.32 0.00 0.00 176.35 174.25 1gql s LEU 103 N 0.45 2.84 -0.21 -0.68 1.43 0.62 -1.18 118.68 121.96 1gql s LEU 103 Ca -0.17 -0.38 -0.14 0.00 -1.03 0.00 0.00 54.13 52.42 1gql s LEU 103 Cb -0.17 -1.70 0.06 0.00 0.03 0.00 0.00 46.19 44.41 1gql s LEU 103 CO 0.07 0.03 0.52 -0.70 0.23 0.00 0.00 176.35 176.49 1gql s GLU 104 N 1.17 0.55 -0.15 1.70 2.12 -0.74 -0.94 118.70 122.42 1gql s GLU 104 Ca 0.02 0.88 -0.28 0.00 0.36 0.00 0.00 54.97 55.95 1gql s GLU 104 Cb -0.14 0.12 -0.01 0.00 0.26 0.00 0.00 34.13 34.36 1gql s GLU 104 CO -0.02 -0.13 0.95 -1.14 -0.54 0.00 0.00 175.26 174.38 1gql s GLN 105 N 1.09 4.35 0.00 4.30 0.74 0.05 -0.13 119.66 130.06 1gql s GLN 105 Ca -0.06 1.25 0.00 0.00 0.05 0.00 0.00 55.36 56.59 1gql s GLN 105 Cb -0.06 -3.57 0.00 0.00 1.10 0.00 0.00 33.01 30.48 1gql s GLN 105 CO -0.10 -0.36 0.00 -2.37 -0.55 0.00 0.00 175.29 171.90 1gql n THR 106 N 4.73 0.00 -4.50 -0.34 5.66 0.12 -4.79 114.28 115.16 1gql n THR 106 Ca 0.08 0.00 -0.20 0.00 -3.05 0.00 0.00 64.05 60.87 1gql n THR 106 Cb 0.48 0.00 -0.15 0.00 -1.55 0.00 0.00 70.33 69.12 1gql n THR 106 CO 0.00 0.00 0.00 -0.13 -3.05 0.00 0.00 175.07 171.89 1gql s ARG 107 N -0.23 0.93 -0.08 1.09 1.81 -1.26 -1.47 118.95 119.75 1gql s ARG 107 Ca 0.00 -0.44 -0.01 0.00 -1.72 0.00 0.00 55.73 53.57 1gql s ARG 107 Cb 0.00 -0.90 0.03 0.00 -0.45 0.00 0.00 34.95 33.62 1gql s ARG 107 CO 0.00 0.25 -0.02 0.42 -0.68 0.00 0.00 175.30 175.27 1gql s ILE 108 N -0.31 0.51 -1.54 1.52 1.01 -0.66 -4.83 121.20 116.90 1gql s ILE 108 Ca 0.04 0.02 -0.12 0.00 0.00 0.00 0.00 60.65 60.59 1gql s ILE 108 Cb -0.05 -0.62 0.09 0.00 0.01 0.00 0.00 42.46 41.89 1gql s ILE 108 CO -0.00 0.27 0.88 0.59 0.00 0.00 0.00 174.94 176.68 1gql n ASN 109 N 4.98 -3.80 0.00 3.58 3.02 -1.26 -0.82 115.26 120.96 1gql n ASN 109 Ca -0.10 -0.85 0.00 0.00 -0.03 0.00 0.00 54.58 53.60 1gql n ASN 109 Cb 0.50 -3.62 0.00 0.00 -0.61 0.00 0.00 39.78 36.06 1gql n ASN 109 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1gql n LYS 110 N -4.56 0.00 -3.00 3.52 4.76 -1.26 -5.00 118.16 112.61 1gql n LYS 110 Ca -0.01 0.00 -0.37 0.00 -2.87 0.00 0.00 58.31 55.05 1gql n LYS 110 Cb 0.55 -3.67 -0.06 0.00 -1.84 0.00 0.00 35.03 30.00 1gql n LYS 110 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 1gql s ARG 111 N -0.58 4.42 -0.03 1.97 3.00 0.00 -5.02 118.95 122.70 1gql s ARG 111 Ca 0.00 1.05 -0.30 0.00 0.00 0.00 0.00 55.73 56.48 1gql s ARG 111 Cb 0.00 -3.00 -0.03 0.00 0.00 0.00 0.00 34.95 31.92 1gql s ARG 111 CO 0.00 0.44 1.12 -1.01 0.00 0.00 0.00 175.30 175.84 1gql s HIS 112 N -1.41 3.40 0.05 -0.53 3.76 -1.26 -1.65 115.29 117.64 1gql s HIS 112 Ca 0.42 1.41 -0.01 0.00 -0.15 0.00 0.00 55.06 56.72 1gql s HIS 112 Cb -0.19 -3.31 -0.04 0.00 1.11 0.00 0.00 32.58 30.15 1gql s HIS 112 CO 0.23 -0.82 -0.02 0.14 -0.85 0.00 0.00 174.74 173.42 1gql s VAL 113 N 1.73 0.22 -0.11 -0.90 -7.23 -0.54 -0.44 120.40 113.13 1gql s VAL 113 Ca 0.54 -1.79 0.03 0.00 -1.81 0.00 0.00 61.98 58.94 1gql s VAL 113 Cb -0.23 -1.52 -0.00 0.00 0.56 0.00 0.00 36.38 35.18 1gql s VAL 113 CO 0.23 -0.98 -0.21 -0.69 -0.31 0.00 0.00 175.10 173.14 1gql s VAL 114 N -3.92 2.33 -0.04 1.32 1.01 -0.47 -0.70 120.40 119.93 1gql s VAL 114 Ca 0.07 -0.92 -0.02 0.00 0.00 0.00 0.00 61.98 61.11 1gql s VAL 114 Cb 0.08 -1.92 -0.04 0.00 0.00 0.00 0.00 36.38 34.50 1gql s VAL 114 CO -0.10 0.55 0.09 0.27 0.00 0.00 0.00 175.10 175.91 1gql s ILE 115 N 0.36 4.86 -0.39 2.22 -4.36 0.82 -0.92 121.20 123.79 1gql s ILE 115 Ca -0.16 -0.25 0.01 0.00 -0.26 0.00 0.00 60.65 59.98 1gql s ILE 115 Cb -0.17 -3.18 0.11 0.00 1.25 0.00 0.00 42.46 40.46 1gql s ILE 115 CO 0.08 0.43 0.14 -0.69 0.24 0.00 0.00 174.94 175.14 1gql s VAL 116 N -1.13 2.80 -0.02 8.37 1.01 -0.47 -1.78 120.40 129.18 1gql s VAL 116 Ca 0.20 -2.26 0.04 0.00 0.00 0.00 0.00 61.98 59.96 1gql s VAL 116 Cb -0.12 -2.98 -0.03 0.00 0.00 0.00 0.00 36.38 33.25 1gql s VAL 116 CO 0.11 -0.66 -0.12 0.00 0.00 0.00 0.00 175.10 174.43 1gql s ALA 117 N 0.94 2.77 0.25 5.51 0.00 -0.32 -1.65 121.76 129.27 1gql s ALA 117 Ca 0.10 -1.02 -0.16 0.00 0.00 0.00 0.00 51.96 50.88 1gql s ALA 117 Cb -0.21 -0.99 0.01 0.00 0.00 0.00 0.00 23.12 21.93 1gql s ALA 117 CO -0.06 0.57 0.56 0.00 0.00 0.00 0.00 175.76 176.84 1gql s ALA 118 N -0.84 -0.63 -0.01 0.00 0.00 -0.96 -0.17 121.76 119.15 1gql s ALA 118 Ca 0.13 -0.64 0.11 0.00 0.00 0.00 0.00 51.96 51.57 1gql s ALA 118 Cb -0.11 0.98 -0.11 0.00 0.00 0.00 0.00 23.12 23.88 1gql s ALA 118 CO 0.03 -0.92 1.27 -0.91 0.00 0.00 0.00 175.76 175.23 1gql h ASN 119 N 2.16 0.00 -3.15 0.00 2.35 -1.77 -3.36 115.58 111.80 1gql h ASN 119 Ca -0.24 0.00 -0.46 0.00 -0.55 0.00 0.00 56.30 55.05 1gql h ASN 119 Cb 1.25 0.00 -0.14 0.00 0.05 0.00 0.00 38.32 39.48 1gql h ASN 119 CO 0.31 0.79 -0.68 -0.94 -1.65 0.00 0.00 177.43 175.26 1gql s SER 120 N -6.51 2.56 0.26 5.81 1.04 -1.26 -4.88 113.70 110.72 1gql s SER 120 Ca 0.01 -1.16 -0.01 0.00 0.48 0.00 0.00 55.95 55.27 1gql s SER 120 Cb 0.09 -0.13 0.35 0.00 0.10 0.00 0.00 66.02 66.43 1gql s SER 120 CO 0.79 -0.34 1.75 0.44 0.98 0.00 0.00 173.24 176.86 1gql h ASP 121 N 2.37 0.71 0.07 7.02 3.32 -1.91 -2.24 116.42 125.75 1gql h ASP 121 Ca -0.39 -0.19 -0.08 0.00 0.02 0.00 0.00 57.03 56.39 1gql h ASP 121 Cb 1.23 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 40.58 1gql h ASP 121 CO 0.66 0.81 -0.26 1.62 -1.72 0.00 0.00 179.24 180.35 1gql h VAL 122 N 0.67 1.25 -0.59 -1.35 3.04 -1.93 -1.17 116.25 116.17 1gql h VAL 122 Ca 0.12 -1.17 -0.03 0.00 -1.01 0.00 0.00 66.70 64.61 1gql h VAL 122 Cb 0.50 1.41 -0.03 0.00 -2.01 0.00 0.00 31.29 31.16 1gql h VAL 122 CO 0.03 0.36 0.24 1.23 -1.01 0.00 0.00 177.57 178.42 1gql h GLY 123 N 1.00 0.92 1.04 3.17 0.00 -1.63 0.36 103.07 107.93 1gql h GLY 123 Ca 0.04 -0.46 -0.06 0.00 0.00 0.00 0.00 47.33 46.85 1gql h GLY 123 CO 0.04 0.44 0.22 -2.08 0.00 0.00 0.00 176.54 175.16 1gql h VAL 124 N 0.85 1.26 -0.03 4.60 2.07 -0.77 -0.61 116.25 123.62 1gql h VAL 124 Ca 0.20 -0.89 -0.00 0.00 0.82 0.00 0.00 66.70 66.83 1gql h VAL 124 Cb 0.16 0.50 -0.00 0.00 -1.52 0.00 0.00 31.29 30.43 1gql h VAL 124 CO -0.02 0.35 0.01 0.25 0.02 0.00 0.00 177.57 178.18 1gql h LEU 125 N 1.04 0.04 -0.67 2.57 5.85 -0.54 0.45 115.31 124.05 1gql h LEU 125 Ca 0.23 -0.21 0.02 0.00 0.84 0.00 0.00 57.88 58.76 1gql h LEU 125 Cb 0.31 -0.01 -0.04 0.00 0.37 0.00 0.00 40.66 41.29 1gql h LEU 125 CO -0.01 0.24 0.42 1.88 -0.34 0.00 0.00 178.44 180.63 1gql h TYR 126 N -0.16 0.79 -0.41 1.25 0.05 -0.83 -1.56 116.97 116.10 1gql h TYR 126 Ca 0.01 0.02 -0.07 0.00 0.05 0.00 0.00 58.73 58.74 1gql h TYR 126 Cb 0.21 -0.26 -0.02 0.00 1.01 0.00 0.00 36.73 37.67 1gql h TYR 126 CO -0.00 0.46 -0.02 0.78 -1.05 0.00 0.00 178.16 178.33 1gql h GLY 127 N 0.83 0.73 0.97 3.88 0.00 -0.95 -1.52 103.07 107.01 1gql h GLY 127 Ca 0.26 -0.47 -0.02 0.00 0.00 0.00 0.00 47.33 47.10 1gql h GLY 127 CO -0.09 0.44 0.22 1.76 0.00 0.00 0.00 176.54 178.87 1gql h SER 128 N 0.63 0.60 -0.63 0.19 0.02 -0.39 0.14 113.55 114.12 1gql h SER 128 Ca 0.13 -0.13 -0.04 0.00 -0.84 0.00 0.00 61.79 60.91 1gql h SER 128 Cb 0.43 -0.16 -0.03 0.00 0.14 0.00 0.00 62.40 62.78 1gql h SER 128 CO 0.02 0.57 0.26 -0.26 -1.14 0.00 0.00 176.83 176.27 1gql h PHE 129 N 0.60 0.98 -0.52 3.45 0.04 -0.96 -1.08 116.94 119.45 1gql h PHE 129 Ca 0.16 -0.06 -0.11 0.00 2.80 0.00 0.00 57.97 60.76 1gql h PHE 129 Cb 0.13 -0.30 -0.02 0.00 2.20 0.00 0.00 35.95 37.96 1gql h PHE 129 CO -0.01 0.76 -0.09 1.25 -0.60 0.00 0.00 178.31 179.62 1gql h HIS 130 N 0.95 1.10 -0.50 -0.55 2.76 -0.80 0.22 115.15 118.33 1gql h HIS 130 Ca 0.22 -0.23 0.05 0.00 -2.20 0.00 0.00 60.37 58.22 1gql h HIS 130 Cb 0.19 -0.27 -0.05 0.00 1.55 0.00 0.00 27.41 28.83 1gql h HIS 130 CO 0.01 1.03 0.24 1.25 -1.30 0.00 0.00 177.93 179.16 1gql h LEU 131 N 0.85 0.33 -0.51 0.26 7.12 -0.35 0.71 115.31 123.72 1gql h LEU 131 Ca 0.14 0.03 -0.04 0.00 0.13 0.00 0.00 57.88 58.14 1gql h LEU 131 Cb 0.65 -0.02 -0.02 0.00 -0.53 0.00 0.00 40.66 40.74 1gql h LEU 131 CO 0.04 0.23 0.15 -0.07 -0.13 0.00 0.00 178.44 178.66 1gql h LEU 132 N 0.47 0.75 -1.10 2.25 3.38 -0.92 -2.59 115.31 117.55 1gql h LEU 132 Ca 0.22 -0.21 0.06 0.00 0.09 0.00 0.00 57.88 58.04 1gql h LEU 132 Cb 0.15 -0.20 -0.06 0.00 0.09 0.00 0.00 40.66 40.65 1gql h LEU 132 CO -0.17 0.77 0.61 -0.09 0.09 0.00 0.00 178.44 179.65 1gql h ARG 133 N 0.70 1.06 -0.80 1.13 2.43 -0.02 0.22 114.38 119.10 1gql h ARG 133 Ca 0.16 -0.06 0.05 0.00 -0.81 0.00 0.00 59.98 59.32 1gql h ARG 133 Cb 0.29 -0.24 -0.05 0.00 -0.42 0.00 0.00 29.97 29.55 1gql h ARG 133 CO -0.00 0.70 0.50 -0.07 -1.51 0.00 0.00 179.97 179.59 1gql h LEU 134 N 1.09 0.79 -0.08 3.80 3.38 -0.50 -0.78 115.31 123.02 1gql h LEU 134 Ca 0.40 0.01 -0.04 0.00 0.09 0.00 0.00 57.88 58.35 1gql h LEU 134 Cb 0.17 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 40.76 1gql h LEU 134 CO -0.15 0.53 -0.09 0.40 0.09 0.00 0.00 178.44 179.22 1gql h ILE 135 N 0.93 1.38 -0.53 1.22 2.04 -1.13 0.23 117.51 121.65 1gql h ILE 135 Ca 0.34 -1.27 0.10 0.00 1.00 0.00 0.00 64.86 65.03 1gql h ILE 135 Cb 0.10 2.05 -0.03 0.00 -0.74 0.00 0.00 36.82 38.20 1gql h ILE 135 CO -0.15 0.36 0.36 1.56 0.00 0.00 0.00 178.15 180.28 1gql h GLN 136 N -0.24 0.26 -0.65 2.37 4.20 -0.37 -0.45 115.11 120.23 1gql h GLN 136 Ca 0.01 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1gql h GLN 136 Cb 0.61 -0.06 0.00 0.00 0.30 0.00 0.00 27.48 28.34 1gql h GLN 136 CO 0.02 0.17 0.00 0.25 -0.67 0.00 0.00 178.83 178.60 1gql n THR 137 N -4.45 1.43 -3.61 -0.54 -2.24 -0.32 -4.47 114.28 100.08 1gql n THR 137 Ca 0.09 -1.01 -0.24 0.00 -2.27 0.00 0.00 64.05 60.62 1gql n THR 137 Cb 0.41 0.18 0.08 0.00 -2.10 0.00 0.00 70.33 68.90 1gql n THR 137 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1gql n GLN 138 N 1.13 -7.73 -3.51 -0.78 6.02 -0.18 -4.99 117.38 107.34 1gql n GLN 138 Ca 0.23 0.82 -0.36 0.00 -0.01 0.00 0.00 57.00 57.67 1gql n GLN 138 Cb 0.74 -5.86 -0.06 0.00 1.02 0.00 0.00 30.24 26.09 1gql n GLN 138 CO 0.00 0.00 0.00 -1.01 -1.01 0.00 0.00 177.06 175.04 1gql s HIS 139 N -3.32 3.65 0.33 1.08 3.76 0.78 -5.03 115.29 116.54 1gql s HIS 139 Ca 0.55 0.92 -0.27 0.00 -0.15 0.00 0.00 55.06 56.10 1gql s HIS 139 Cb -0.24 -2.24 -0.09 0.00 1.11 0.00 0.00 32.58 31.11 1gql s HIS 139 CO 0.74 0.57 1.10 0.00 -0.85 0.00 0.00 174.74 176.29 1gql s ALA 140 N -1.26 3.28 -0.61 -1.40 0.00 -1.26 -4.58 121.76 115.93 1gql s ALA 140 Ca 0.29 0.86 0.23 0.00 0.00 0.00 0.00 51.96 53.35 1gql s ALA 140 Cb -0.15 -3.32 0.10 0.00 0.00 0.00 0.00 23.12 19.75 1gql s ALA 140 CO 0.16 -0.24 1.08 1.28 0.00 0.00 0.00 175.76 178.04 1gql n LEU 141 N 0.66 0.63 -4.72 0.00 4.77 -1.26 -4.77 117.00 112.30 1gql n LEU 141 Ca 0.01 0.03 -0.42 0.00 -0.03 0.00 0.00 56.01 55.61 1gql n LEU 141 Cb 0.46 -0.11 -0.03 0.00 -2.33 0.00 0.00 43.42 41.41 1gql n LEU 141 CO 0.51 0.02 1.35 -0.70 -1.33 0.00 0.00 177.39 177.24 1gql s GLU 142 N -3.20 4.14 -1.70 3.23 2.12 -1.26 -1.35 118.70 120.69 1gql s GLU 142 Ca 0.04 2.56 0.00 0.00 0.36 0.00 0.00 54.97 57.93 1gql s GLU 142 Cb 0.14 -3.12 0.00 0.00 0.26 0.00 0.00 34.13 31.41 1gql s GLU 142 CO 0.79 -0.73 0.00 1.63 -0.54 0.00 0.00 175.26 176.41 1gql n LYS 143 N 4.08 -1.14 -1.70 4.30 4.76 -1.26 -4.93 118.16 122.27 1gql n LYS 143 Ca 0.16 1.06 -0.44 0.00 -2.87 0.00 0.00 58.31 56.22 1gql n LYS 143 Cb 0.36 -5.25 -0.03 0.00 -1.84 0.00 0.00 35.03 28.26 1gql n LYS 143 CO 0.00 0.00 0.00 -0.11 -1.37 0.00 0.00 177.40 175.92 1gql n LEU 144 N -1.82 3.65 -3.23 -0.35 7.94 -0.46 -4.84 117.00 117.88 1gql n LEU 144 Ca -0.16 1.07 -0.02 0.00 -1.11 0.00 0.00 56.01 55.79 1gql n LEU 144 Cb 0.53 -1.52 -0.02 0.00 0.53 0.00 0.00 43.42 42.94 1gql n LEU 144 CO 0.24 0.00 0.03 -0.55 -1.11 0.00 0.00 177.39 176.01 1gql s SER 145 N 1.08 -0.88 0.00 1.96 0.15 -1.25 -0.77 113.70 114.00 1gql s SER 145 Ca 0.77 -0.59 -0.03 0.00 0.70 0.00 0.00 55.95 56.80 1gql s SER 145 Cb -0.57 1.65 -0.01 0.00 -1.71 0.00 0.00 66.02 65.38 1gql s SER 145 CO 0.34 -0.24 0.04 -1.48 1.20 0.00 0.00 173.24 173.10 1gql s LEU 146 N 2.15 1.90 0.12 3.45 0.05 -0.11 -5.01 118.68 121.22 1gql s LEU 146 Ca 0.14 -0.21 0.05 0.00 0.05 0.00 0.00 54.13 54.16 1gql s LEU 146 Cb -0.09 0.28 -0.04 0.00 -2.05 0.00 0.00 46.19 44.30 1gql s LEU 146 CO -0.15 -0.22 -0.12 -0.94 -0.55 0.00 0.00 176.35 174.38 1gql s SER 147 N -0.91 1.76 -0.02 1.48 1.04 -1.26 -0.27 113.70 115.51 1gql s SER 147 Ca -0.10 -0.86 -0.22 0.00 0.48 0.00 0.00 55.95 55.25 1gql s SER 147 Cb -0.06 -0.03 0.04 0.00 0.10 0.00 0.00 66.02 66.08 1gql s SER 147 CO 0.00 -0.23 0.47 -0.55 0.98 0.00 0.00 173.24 173.91 1gql s SER 148 N -2.62 -0.39 -0.01 7.02 0.15 -0.69 -5.02 113.70 112.14 1gql s SER 148 Ca 0.10 0.34 -0.04 0.00 0.70 0.00 0.00 55.95 57.04 1gql s SER 148 Cb -0.02 0.42 -0.00 0.00 -1.71 0.00 0.00 66.02 64.70 1gql s SER 148 CO 0.01 -0.54 0.09 0.00 1.20 0.00 0.00 173.24 174.01 1gql s ALA 149 N -1.39 -0.20 0.49 5.45 0.00 -1.26 -1.25 121.76 123.60 1gql s ALA 149 Ca -0.12 -0.08 -0.21 0.00 0.00 0.00 0.00 51.96 51.55 1gql s ALA 149 Cb -0.03 0.02 -0.07 0.00 0.00 0.00 0.00 23.12 23.04 1gql s ALA 149 CO 0.06 -0.14 1.13 -1.25 0.00 0.00 0.00 175.76 175.56 1gql s PRO 150 N -0.89 3.62 0.00 0.00 0.04 -1.26 -4.91 135.00 131.60 1gql s PRO 150 Ca -0.10 1.65 0.24 0.00 0.04 0.00 0.00 61.00 62.84 1gql s PRO 150 Cb -0.06 -2.22 0.38 0.00 0.04 0.00 0.00 34.50 32.64 1gql s PRO 150 CO 0.00 -0.64 1.32 0.54 0.04 0.00 0.00 177.00 178.27 1gql n ARG 151 N -0.84 0.17 -4.37 4.56 1.74 0.56 -4.88 116.66 113.59 1gql n ARG 151 Ca 0.09 -0.11 -0.20 0.00 -0.77 0.00 0.00 57.85 56.86 1gql n ARG 151 Cb 0.50 -1.50 -0.14 0.00 -1.02 0.00 0.00 32.46 30.30 1gql n ARG 151 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1gql s LEU 152 N -2.91 2.14 -0.08 0.55 1.43 -1.25 -4.64 118.68 113.92 1gql s LEU 152 Ca 0.13 -0.41 -0.26 0.00 -1.03 0.00 0.00 54.13 52.55 1gql s LEU 152 Cb 0.17 -0.58 -0.25 0.00 0.03 0.00 0.00 46.19 45.56 1gql s LEU 152 CO 0.70 0.04 0.94 1.56 0.23 0.00 0.00 176.35 179.83 1gql h GLN 153 N 5.10 0.10 -4.68 1.70 4.20 -1.85 -3.43 115.11 116.24 1gql h GLN 153 Ca -0.37 -0.12 -0.69 0.00 0.06 0.00 0.00 58.65 57.53 1gql h GLN 153 Cb 1.18 0.04 -0.26 0.00 0.30 0.00 0.00 27.48 28.74 1gql h GLN 153 CO 0.45 0.93 -0.57 -1.01 -0.67 0.00 0.00 178.83 177.96 1gql s HIS 154 N -2.84 3.22 -0.41 2.96 3.76 -0.21 -4.98 115.29 116.80 1gql s HIS 154 Ca -0.17 -1.07 0.04 0.00 -0.15 0.00 0.00 55.06 53.71 1gql s HIS 154 Cb -0.01 -2.34 0.11 0.00 1.11 0.00 0.00 32.58 31.46 1gql s HIS 154 CO 0.72 -0.64 0.14 1.03 -0.85 0.00 0.00 174.74 175.15 1gql s ARG 155 N 1.50 1.65 0.09 1.40 0.52 -1.26 -0.77 118.95 122.08 1gql s ARG 155 Ca 0.01 -2.16 0.08 0.00 -0.52 0.00 0.00 55.73 53.15 1gql s ARG 155 Cb -0.19 -3.19 -0.03 0.00 0.52 0.00 0.00 34.95 32.06 1gql s ARG 155 CO 0.04 -1.02 -0.21 0.54 0.02 0.00 0.00 175.30 174.68 1gql s VAL 156 N 0.43 1.75 0.08 3.52 0.11 -0.26 -0.79 120.40 125.23 1gql s VAL 156 Ca 0.14 -1.50 0.02 0.00 -2.93 0.00 0.00 61.98 57.71 1gql s VAL 156 Cb -0.22 -1.58 -0.04 0.00 -1.53 0.00 0.00 36.38 33.02 1gql s VAL 156 CO -0.05 0.00 0.13 0.68 -3.33 0.00 0.00 175.10 172.53 1gql s VAL 157 N -1.08 4.85 -0.02 2.04 -7.23 -0.69 -1.29 120.40 116.98 1gql s VAL 157 Ca 0.07 -0.64 0.06 0.00 -1.81 0.00 0.00 61.98 59.67 1gql s VAL 157 Cb -0.10 -3.36 -0.01 0.00 0.56 0.00 0.00 36.38 33.47 1gql s VAL 157 CO 0.04 0.12 -0.22 0.20 -0.31 0.00 0.00 175.10 174.93 1gql s ASN 158 N -2.47 2.60 -0.16 4.85 0.01 0.32 -0.89 114.94 119.19 1gql s ASN 158 Ca 0.31 -0.41 0.01 0.00 -0.71 0.00 0.00 52.86 52.06 1gql s ASN 158 Cb -0.12 -0.38 0.02 0.00 0.41 0.00 0.00 41.25 41.18 1gql s ASN 158 CO 0.24 0.26 -0.15 -1.00 -1.51 0.00 0.00 177.10 174.94 1gql s HIS 159 N -0.42 2.39 -1.36 2.20 3.76 -0.20 -1.80 115.29 119.86 1gql s HIS 159 Ca 0.06 -1.40 -0.06 0.00 -0.15 0.00 0.00 55.06 53.50 1gql s HIS 159 Cb -0.09 -1.70 0.08 0.00 1.11 0.00 0.00 32.58 31.98 1gql s HIS 159 CO -0.00 -0.72 2.50 0.91 -0.85 0.00 0.00 174.74 176.57 1gql n TRP 160 N 4.71 2.55 -3.62 1.40 8.01 -1.26 -3.13 117.44 126.10 1gql n TRP 160 Ca -0.18 -2.86 -0.36 0.00 -1.31 0.00 0.00 57.50 52.80 1gql n TRP 160 Cb 0.49 -1.94 -0.08 0.00 -2.01 0.00 0.00 31.31 27.77 1gql n TRP 160 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.69 176.17 1gql s ASP 161 N 0.69 6.31 0.38 -0.99 1.11 -1.26 -1.01 116.67 121.90 1gql s ASP 161 Ca 0.57 0.35 -0.11 0.00 0.18 0.00 0.00 52.55 53.54 1gql s ASP 161 Cb 0.19 -2.14 -0.07 0.00 1.07 0.00 0.00 42.92 41.97 1gql s ASP 161 CO -0.09 0.12 0.75 0.20 1.18 0.00 0.00 175.17 177.33 1gql s ASN 162 N 0.51 6.56 0.54 0.27 0.01 -0.41 -0.65 114.94 121.77 1gql s ASN 162 Ca 0.12 1.13 0.32 0.00 -0.71 0.00 0.00 52.86 53.72 1gql s ASN 162 Cb -0.12 -2.32 1.48 0.00 0.41 0.00 0.00 41.25 40.70 1gql s ASN 162 CO 0.02 -0.35 2.04 -0.07 -1.51 0.00 0.00 177.10 177.23 1gql h LEU 163 N 1.47 0.00 0.00 0.60 3.38 -1.98 -0.26 115.31 118.52 1gql h LEU 163 Ca -0.47 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.50 1gql h LEU 163 Cb 1.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.93 1gql h LEU 163 CO 0.64 0.07 0.00 -0.46 0.09 0.00 0.00 178.44 178.78 1gql n ASN 164 N -3.26 0.00 0.00 -0.43 6.94 -1.26 -4.87 115.26 112.38 1gql n ASN 164 Ca -0.01 -0.16 0.00 0.00 -0.02 0.00 0.00 54.58 54.39 1gql n ASN 164 Cb 0.28 -0.20 0.00 0.00 -2.36 0.00 0.00 39.78 37.49 1gql n ASN 164 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 1gql n ARG 165 N -1.20 0.00 -2.87 -3.83 1.74 -0.11 -5.00 116.66 105.39 1gql n ARG 165 Ca 0.10 0.00 -0.40 0.00 -0.77 0.00 0.00 57.85 56.78 1gql n ARG 165 Cb 0.12 -2.43 -0.05 0.00 -1.02 0.00 0.00 32.46 29.09 1gql n ARG 165 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1gql s VAL 166 N -2.64 4.62 -0.24 1.55 1.01 -1.26 0.17 120.40 123.61 1gql s VAL 166 Ca 0.00 1.83 -0.10 0.00 0.00 0.00 0.00 61.98 63.71 1gql s VAL 166 Cb 0.00 -4.21 -0.05 0.00 0.00 0.00 0.00 36.38 32.12 1gql s VAL 166 CO 0.00 0.35 0.15 -0.69 0.00 0.00 0.00 175.10 174.90 1gql s VAL 167 N -0.05 5.27 -0.17 2.92 1.01 -1.26 -1.29 120.40 126.83 1gql s VAL 167 Ca 0.42 0.15 -0.29 0.00 0.00 0.00 0.00 61.98 62.26 1gql s VAL 167 Cb -0.22 -3.45 -0.01 0.00 0.00 0.00 0.00 36.38 32.70 1gql s VAL 167 CO 0.26 0.35 1.24 -0.70 0.00 0.00 0.00 175.10 176.25 1gql s GLU 168 N 1.03 4.24 -1.20 2.72 2.12 -0.18 -2.27 118.70 125.16 1gql s GLU 168 Ca 0.07 1.63 -0.04 0.00 0.36 0.00 0.00 54.97 56.99 1gql s GLU 168 Cb -0.13 -3.74 0.00 0.00 0.26 0.00 0.00 34.13 30.52 1gql s GLU 168 CO 0.04 -0.69 1.02 0.54 -0.54 0.00 0.00 175.26 175.63 1gql n ARG 169 N 6.52 -6.83 -4.05 4.30 5.12 -1.26 -4.65 116.66 115.81 1gql n ARG 169 Ca 0.14 0.79 -0.34 0.00 -1.93 0.00 0.00 57.85 56.50 1gql n ARG 169 Cb 0.45 -5.66 -0.15 0.00 -1.16 0.00 0.00 32.46 25.94 1gql n ARG 169 CO 0.00 0.00 0.00 0.20 -1.93 0.00 0.00 177.63 175.90 1gql s GLY 170 N -3.80 1.49 -0.09 -0.13 0.00 -0.96 -4.81 107.32 99.02 1gql s GLY 170 Ca 0.27 -1.19 0.13 0.00 0.00 0.00 0.00 44.72 43.93 1gql s GLY 170 CO 0.68 0.33 1.09 -1.72 0.00 0.00 0.00 173.10 173.48 1gql n TYR 171 N 4.66 0.00 -1.55 1.90 4.01 -1.26 -4.65 117.16 120.28 1gql n TYR 171 Ca -0.20 -0.78 0.05 0.00 -0.16 0.00 0.00 57.90 56.82 1gql n TYR 171 Cb 0.50 -0.11 0.07 0.00 -0.31 0.00 0.00 39.34 39.49 1gql n TYR 171 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1gql n ALA 172 N -1.07 2.17 0.00 -0.72 0.00 -1.26 -4.53 120.51 115.11 1gql n ALA 172 Ca 0.11 -1.88 0.00 0.00 0.00 0.00 0.00 53.44 51.67 1gql n ALA 172 Cb 0.55 -0.44 0.00 0.00 0.00 0.00 0.00 19.45 19.56 1gql n ALA 172 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1gql n GLY 173 N -0.72 -0.67 3.76 0.00 0.00 -1.26 -1.72 105.19 104.58 1gql n GLY 173 Ca 0.08 -2.22 -0.31 0.00 0.00 0.00 0.00 46.02 43.57 1gql n GLY 173 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1gql s LEU 174 N 0.00 2.80 0.25 0.99 1.43 -1.26 -4.42 118.68 118.47 1gql s LEU 174 Ca 0.00 1.66 -0.30 0.00 -1.03 0.00 0.00 54.13 54.46 1gql s LEU 174 Cb 0.00 -4.30 -0.14 0.00 0.03 0.00 0.00 46.19 41.78 1gql s LEU 174 CO 0.00 -2.11 1.30 -0.24 0.23 0.00 0.00 176.35 175.52 1gql n SER 175 N -3.56 2.36 0.31 2.29 2.88 0.13 -0.80 113.62 117.22 1gql n SER 175 Ca 0.08 1.16 0.17 0.00 -1.33 0.00 0.00 58.87 58.95 1gql n SER 175 Cb 0.54 -1.39 0.98 0.00 -0.75 0.00 0.00 64.21 63.59 1gql n SER 175 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 1gql h LEU 176 N 3.49 0.00 -8.78 2.46 3.38 -1.88 -3.43 115.31 110.55 1gql h LEU 176 Ca -0.44 0.00 -0.59 0.00 0.09 0.00 0.00 57.88 56.94 1gql h LEU 176 Cb 1.30 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 41.95 1gql h LEU 176 CO 0.70 0.01 0.65 0.26 0.09 0.00 0.00 178.44 180.15 1gql s TRP 177 N -4.49 3.01 -1.15 1.13 0.23 -1.26 -4.95 118.94 111.46 1gql s TRP 177 Ca -0.05 0.68 -0.12 0.00 -2.03 0.00 0.00 56.10 54.58 1gql s TRP 177 Cb 0.14 -3.83 0.22 0.00 0.03 0.00 0.00 33.47 30.03 1gql s TRP 177 CO 0.52 -0.95 1.26 0.34 0.96 0.00 0.00 176.95 179.07 1gql s ASP 178 N 2.04 7.18 0.39 2.95 2.15 -1.26 -4.85 116.67 125.27 1gql s ASP 178 Ca 0.39 -3.26 0.08 0.00 0.43 0.00 0.00 52.55 50.20 1gql s ASP 178 Cb -0.11 -2.31 0.84 0.00 -0.30 0.00 0.00 42.92 41.05 1gql s ASP 178 CO 0.22 -0.53 1.98 -0.50 -0.17 0.00 0.00 175.17 176.17 1gql h TRP 179 N 6.97 0.63 -0.03 -5.34 4.06 -1.92 -1.33 115.95 118.98 1gql h TRP 179 Ca 0.24 0.02 0.01 0.00 2.06 0.00 0.00 58.89 61.22 1gql h TRP 179 Cb 0.88 -0.21 -0.00 0.00 -1.00 0.00 0.00 29.16 28.83 1gql h TRP 179 CO 0.94 0.33 0.03 0.78 -3.56 0.00 0.00 178.44 176.96 1gql h GLY 180 N 0.62 0.00 -0.84 1.49 0.00 -1.96 -2.69 103.07 99.70 1gql h GLY 180 Ca 0.28 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.61 1gql h GLY 180 CO -0.09 0.00 -0.05 -1.14 0.00 0.00 0.00 176.54 175.26 1gql n SER 181 N -4.18 1.82 -4.86 0.19 3.41 -0.55 -4.98 113.62 104.46 1gql n SER 181 Ca -0.02 -1.41 -0.31 0.00 -0.26 0.00 0.00 58.87 56.86 1gql n SER 181 Cb 0.12 0.11 -0.05 0.00 -0.26 0.00 0.00 64.21 64.13 1gql n SER 181 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1gql s LEU 182 N -1.14 3.98 0.00 1.04 1.43 -0.89 -0.91 118.68 122.19 1gql s LEU 182 Ca 0.13 1.18 0.29 0.00 -1.03 0.00 0.00 54.13 54.70 1gql s LEU 182 Cb 0.10 -4.01 1.28 0.00 0.03 0.00 0.00 46.19 43.58 1gql s LEU 182 CO 0.18 -0.27 1.90 -0.81 0.23 0.00 0.00 176.35 177.58 1gql n PRO 183 N -0.71 0.55 -0.25 1.29 -0.04 -1.26 -4.83 135.00 129.75 1gql n PRO 183 Ca 0.03 -0.14 -0.02 0.00 -0.04 0.00 0.00 63.50 63.32 1gql n PRO 183 Cb 0.53 -1.50 0.09 0.00 -0.04 0.00 0.00 33.50 32.59 1gql n PRO 183 CO 0.00 0.00 0.00 -0.91 -0.04 0.00 0.00 175.50 174.55 1gql h ASN 184 N 0.35 0.67 -3.47 3.54 4.21 -1.90 -3.40 115.58 115.59 1gql h ASN 184 Ca 0.00 0.01 -0.71 0.00 1.21 0.00 0.00 56.30 56.81 1gql h ASN 184 Cb 0.35 -0.13 -0.20 0.00 -1.12 0.00 0.00 38.32 37.22 1gql h ASN 184 CO 0.00 0.45 -0.32 -0.47 -1.29 0.00 0.00 177.43 175.80 1gql s TYR 185 N -6.10 3.21 -1.07 1.19 5.04 -0.09 -5.01 117.35 114.52 1gql s TYR 185 Ca -0.13 -0.57 -0.15 0.00 -2.44 0.00 0.00 57.07 53.78 1gql s TYR 185 Cb 0.16 -2.81 0.16 0.00 0.35 0.00 0.00 41.96 39.82 1gql s TYR 185 CO 0.77 -0.68 1.26 -0.51 -1.34 0.00 0.00 175.55 175.05 1gql s LEU 186 N 1.86 5.22 0.32 6.97 1.43 -1.26 -4.68 118.68 128.55 1gql s LEU 186 Ca 0.08 -2.63 -0.29 0.00 -1.03 0.00 0.00 54.13 50.25 1gql s LEU 186 Cb -0.19 -2.38 -0.11 0.00 0.03 0.00 0.00 46.19 43.54 1gql s LEU 186 CO 0.11 -0.84 1.43 0.00 0.23 0.00 0.00 176.35 177.28 1gql s ALA 187 N 1.79 3.58 0.44 4.21 0.00 -1.26 -4.89 121.76 125.62 1gql s ALA 187 Ca 0.37 1.42 0.18 0.00 0.00 0.00 0.00 51.96 53.94 1gql s ALA 187 Cb -0.04 -3.56 1.12 0.00 0.00 0.00 0.00 23.12 20.63 1gql s ALA 187 CO -0.05 -0.85 1.88 -1.35 0.00 0.00 0.00 175.76 175.40 1gql h PRO 188 N 3.79 0.35 0.00 0.00 0.11 -2.02 -2.11 132.00 132.13 1gql h PRO 188 Ca -0.49 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 65.60 1gql h PRO 188 Cb 1.23 -0.08 -0.00 0.00 0.11 0.00 0.00 31.00 32.26 1gql h PRO 188 CO 0.69 0.23 -0.01 -0.09 -0.21 0.00 0.00 178.00 178.61 1gql h ARG 189 N 0.36 0.00 -0.91 1.05 2.43 -1.99 -1.09 114.38 114.23 1gql h ARG 189 Ca 0.43 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.58 1gql h ARG 189 Cb 1.11 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 30.62 1gql h ARG 189 CO -0.14 0.01 0.52 1.88 -1.51 0.00 0.00 179.97 180.73 1gql h TYR 190 N 0.00 1.24 -0.43 2.20 0.05 -1.75 0.93 116.97 119.20 1gql h TYR 190 Ca -0.00 -0.02 -0.15 0.00 0.05 0.00 0.00 58.73 58.61 1gql h TYR 190 Cb 0.03 -0.40 -0.01 0.00 1.01 0.00 0.00 36.73 37.36 1gql h TYR 190 CO 0.00 0.84 -0.31 1.15 -1.05 0.00 0.00 178.16 178.80 1gql h THR 191 N 1.27 1.27 -0.48 -2.88 2.02 -1.34 -2.32 112.91 110.44 1gql h THR 191 Ca 0.32 -1.48 -0.05 0.00 0.77 0.00 0.00 66.41 65.97 1gql h THR 191 Cb 0.00 1.25 -0.02 0.00 -1.74 0.00 0.00 68.15 67.64 1gql h THR 191 CO -0.05 0.50 0.09 0.44 0.37 0.00 0.00 175.52 176.87 1gql h ASP 192 N 0.82 0.70 -0.74 4.18 3.32 -1.09 0.43 116.42 124.04 1gql h ASP 192 Ca 0.09 -0.13 -0.01 0.00 0.02 0.00 0.00 57.03 56.99 1gql h ASP 192 Cb 0.90 -0.18 -0.03 0.00 0.22 0.00 0.00 39.33 40.23 1gql h ASP 192 CO 0.08 0.71 0.41 0.22 -1.72 0.00 0.00 179.24 178.95 1gql h TYR 193 N 0.72 1.01 -0.53 4.55 3.20 -0.76 -0.68 116.97 124.47 1gql h TYR 193 Ca 0.16 -0.02 -0.12 0.00 3.14 0.00 0.00 58.73 61.88 1gql h TYR 193 Cb 0.31 -0.32 -0.02 0.00 1.54 0.00 0.00 36.73 38.24 1gql h TYR 193 CO 0.02 0.70 -0.14 0.00 -1.64 0.00 0.00 178.16 177.10 1gql h ALA 194 N 1.21 0.74 -0.20 1.82 0.00 -0.80 -2.38 119.26 119.66 1gql h ALA 194 Ca 0.26 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1gql h ALA 194 Cb 0.03 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 1gql h ALA 194 CO -0.04 0.67 0.13 0.00 0.00 0.00 0.00 179.25 180.01 1gql h ARG 195 N 0.90 0.27 -0.20 0.00 3.08 -0.65 0.07 114.38 117.85 1gql h ARG 195 Ca 0.13 -0.02 0.05 0.00 0.07 0.00 0.00 59.98 60.21 1gql h ARG 195 Cb 0.72 -0.06 -0.05 0.00 0.08 0.00 0.00 29.97 30.66 1gql h ARG 195 CO 0.06 0.19 -0.14 0.82 -1.07 0.00 0.00 179.97 179.82 1gql h ILE 196 N 0.26 0.59 -0.26 2.04 2.04 -1.00 -0.21 117.51 120.97 1gql h ILE 196 Ca 0.07 0.00 -0.11 0.00 1.00 0.00 0.00 64.86 65.82 1gql h ILE 196 Cb -0.01 0.59 -0.00 0.00 -0.74 0.00 0.00 36.82 36.65 1gql h ILE 196 CO -0.02 0.00 -0.29 0.78 0.00 0.00 0.00 178.15 178.63 1gql h ASN 197 N -0.15 0.70 0.11 1.72 2.35 -1.32 -3.05 115.58 115.94 1gql h ASN 197 Ca 0.12 -0.48 -0.02 0.00 -0.55 0.00 0.00 56.30 55.36 1gql h ASN 197 Cb 0.32 -0.20 -0.00 0.00 0.05 0.00 0.00 38.32 38.49 1gql h ASN 197 CO -0.28 1.04 -0.11 0.00 -1.65 0.00 0.00 177.43 176.43 1gql h ALA 198 N 0.68 1.79 0.00 -0.83 0.00 -0.86 -1.37 119.26 118.66 1gql h ALA 198 Ca 0.04 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 1gql h ALA 198 Cb 0.86 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.63 1gql h ALA 198 CO 0.07 0.13 -0.03 0.66 0.00 0.00 0.00 179.25 180.08 1gql h SER 199 N 0.00 0.00 -0.02 0.00 4.64 -0.91 -0.53 113.55 116.72 1gql h SER 199 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1gql h SER 199 Cb 0.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.28 1gql h SER 199 CO 0.01 0.03 -0.14 0.18 -0.87 0.00 0.00 176.83 176.05 1gql n LEU 200 N -3.28 2.60 0.00 5.97 4.77 -0.74 -4.81 117.00 121.50 1gql n LEU 200 Ca -0.02 -0.93 0.00 0.00 -0.03 0.00 0.00 56.01 55.04 1gql n LEU 200 Cb 0.18 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.27 1gql n LEU 200 CO 0.25 0.45 0.00 0.61 -1.33 0.00 0.00 177.39 177.37 1gql n GLY 201 N 1.30 0.55 3.70 -0.72 0.00 -0.21 -4.48 105.19 105.34 1gql n GLY 201 Ca 0.12 -0.10 -0.42 0.00 0.00 0.00 0.00 46.02 45.61 1gql n GLY 201 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1gql s ILE 202 N -2.00 3.29 -0.14 -0.61 -1.09 -0.59 -4.84 121.20 115.22 1gql s ILE 202 Ca 0.00 0.84 0.09 0.00 -2.23 0.00 0.00 60.65 59.35 1gql s ILE 202 Cb 0.00 -3.54 0.17 0.00 -1.58 0.00 0.00 42.46 37.51 1gql s ILE 202 CO 0.00 0.03 1.11 -0.46 -1.23 0.00 0.00 174.94 174.39 1gql n ASN 203 N 4.65 2.33 -3.50 3.58 0.23 0.03 -4.18 115.26 118.41 1gql n ASN 203 Ca 0.13 -2.48 -0.16 0.00 -0.53 0.00 0.00 54.58 51.54 1gql n ASN 203 Cb 0.42 -0.22 -0.05 0.00 -2.08 0.00 0.00 39.78 37.85 1gql n ASN 203 CO 0.00 0.00 0.00 -0.83 -0.93 0.00 0.00 177.26 175.50 1gql s GLY 204 N -1.77 -0.57 -0.02 4.83 0.00 -1.12 -1.54 107.32 107.11 1gql s GLY 204 Ca 0.17 0.99 -0.01 0.00 0.00 0.00 0.00 44.72 45.87 1gql s GLY 204 CO 0.03 0.65 0.05 -1.08 0.00 0.00 0.00 173.10 172.75 1gql s THR 205 N -2.09 -0.03 -0.36 0.90 -1.32 -0.53 -1.70 115.64 110.51 1gql s THR 205 Ca -0.07 0.11 -0.10 0.00 -1.21 0.00 0.00 61.69 60.43 1gql s THR 205 Cb -0.00 -0.10 0.03 0.00 -1.51 0.00 0.00 72.50 70.91 1gql s THR 205 CO 0.02 0.05 0.18 -0.69 -2.21 0.00 0.00 174.62 171.97 1gql s VAL 206 N 0.61 4.43 -0.69 5.08 1.01 -0.07 -0.55 120.40 130.22 1gql s VAL 206 Ca -0.05 -0.87 0.24 0.00 0.00 0.00 0.00 61.98 61.31 1gql s VAL 206 Cb -0.07 -3.45 0.05 0.00 0.00 0.00 0.00 36.38 32.90 1gql s VAL 206 CO -0.02 -0.19 1.34 2.30 0.00 0.00 0.00 175.10 178.53 1gql n ILE 207 N 4.96 0.31 -4.36 2.22 -5.35 -1.19 -1.03 119.36 114.91 1gql n ILE 207 Ca -0.12 -0.24 -0.21 0.00 -0.27 0.00 0.00 62.75 61.91 1gql n ILE 207 Cb 0.46 -0.09 -0.11 0.00 -1.74 0.00 0.00 39.64 38.17 1gql n ILE 207 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 1gql s ASN 208 N -4.06 2.80 0.28 7.28 4.22 -1.20 -4.27 114.94 120.00 1gql s ASN 208 Ca 0.07 -0.95 -0.30 0.00 -2.14 0.00 0.00 52.86 49.53 1gql s ASN 208 Cb 0.14 -0.17 -0.12 0.00 1.28 0.00 0.00 41.25 42.37 1gql s ASN 208 CO 0.72 -0.08 1.45 -3.20 -2.04 0.00 0.00 177.10 173.95 1gql n ASN 209 N -0.13 3.17 0.14 3.54 2.85 0.18 -4.29 115.26 120.71 1gql n ASN 209 Ca -0.10 1.16 0.11 0.00 -0.11 0.00 0.00 54.58 55.65 1gql n ASN 209 Cb 0.59 -1.50 0.62 0.00 1.24 0.00 0.00 39.78 40.73 1gql n ASN 209 CO 0.00 0.00 0.00 -0.37 -2.11 0.00 0.00 177.26 174.78 1gql h VAL 210 N 3.05 0.93 -1.03 3.44 -1.51 -1.91 -3.19 116.25 116.03 1gql h VAL 210 Ca -0.46 -0.03 -0.62 0.00 -1.23 0.00 0.00 66.70 64.36 1gql h VAL 210 Cb 1.26 0.83 -0.09 0.00 -2.13 0.00 0.00 31.29 31.16 1gql h VAL 210 CO 0.74 0.02 1.70 0.20 -1.23 0.00 0.00 177.57 178.99 1gql s ASN 211 N -6.73 6.58 0.09 4.19 0.01 -1.26 -4.32 114.94 113.50 1gql s ASN 211 Ca -0.06 -1.73 -0.22 0.00 -0.71 0.00 0.00 52.86 50.14 1gql s ASN 211 Cb 0.18 -2.57 -0.07 0.00 0.41 0.00 0.00 41.25 39.20 1gql s ASN 211 CO 0.70 -1.43 0.66 0.00 -1.51 0.00 0.00 177.10 175.52 1gql s ALA 212 N 4.83 3.51 -0.26 0.60 0.00 -1.20 -5.02 121.76 124.22 1gql s ALA 212 Ca 0.49 0.16 -0.15 0.00 0.00 0.00 0.00 51.96 52.46 1gql s ALA 212 Cb 0.01 -2.78 -0.04 0.00 0.00 0.00 0.00 23.12 20.31 1gql s ALA 212 CO -0.05 0.31 0.38 0.34 0.00 0.00 0.00 175.76 176.74 1gql s ASP 213 N -0.92 6.27 0.64 0.00 -1.08 -1.26 -4.59 116.67 115.73 1gql s ASP 213 Ca 0.32 0.31 0.40 0.00 -0.52 0.00 0.00 52.55 53.06 1gql s ASP 213 Cb -0.21 -2.21 2.22 0.00 -1.46 0.00 0.00 42.92 41.26 1gql s ASP 213 CO 0.21 -0.18 2.32 1.55 0.52 0.00 0.00 175.17 179.60 1gql h PRO 214 N 8.11 0.00 -0.02 4.34 0.13 -1.95 -2.83 132.00 139.79 1gql h PRO 214 Ca -0.32 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 64.82 1gql h PRO 214 Cb 1.16 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.29 1gql h PRO 214 CO 0.65 0.00 0.03 -0.09 -0.23 0.00 0.00 178.00 178.37 1gql h ARG 215 N 0.00 0.00 0.00 0.86 2.43 -1.99 -2.15 114.38 113.53 1gql h ARG 215 Ca -0.00 0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1gql h ARG 215 Cb 0.04 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 29.59 1gql h ARG 215 CO 0.00 0.00 -0.02 -0.39 -1.51 0.00 0.00 179.97 178.05 1gql h VAL 216 N 0.00 0.67 -0.01 0.20 -1.51 -1.89 -0.95 116.25 112.77 1gql h VAL 216 Ca 0.01 -0.07 0.00 0.00 -1.23 0.00 0.00 66.70 65.41 1gql h VAL 216 Cb 0.08 1.04 0.00 0.00 -2.13 0.00 0.00 31.29 30.28 1gql h VAL 216 CO -0.00 0.02 -0.11 0.18 -1.23 0.00 0.00 177.57 176.43 1gql n LEU 217 N -4.01 0.66 -4.80 4.19 4.77 -0.81 -3.89 117.00 113.11 1gql n LEU 217 Ca -0.03 -0.11 -0.33 0.00 -0.03 0.00 0.00 56.01 55.52 1gql n LEU 217 Cb 0.10 -0.13 0.01 0.00 -2.33 0.00 0.00 43.42 41.08 1gql n LEU 217 CO 0.30 0.12 0.72 -0.94 -1.33 0.00 0.00 177.39 176.25 1gql s SER 218 N -2.37 5.73 0.23 -1.43 1.04 -0.36 -4.81 113.70 111.74 1gql s SER 218 Ca 0.31 1.83 -0.06 0.00 0.48 0.00 0.00 55.95 58.51 1gql s SER 218 Cb 0.20 -2.53 0.36 0.00 0.10 0.00 0.00 66.02 64.14 1gql s SER 218 CO 0.45 -1.20 1.79 -0.78 0.98 0.00 0.00 173.24 174.48 1gql h ASP 219 N 0.40 0.54 -0.36 7.02 1.82 -1.91 0.87 116.42 124.80 1gql h ASP 219 Ca -0.47 0.06 0.08 0.00 -0.39 0.00 0.00 57.03 56.31 1gql h ASP 219 Cb 1.22 -0.04 -0.08 0.00 0.68 0.00 0.00 39.33 41.11 1gql h ASP 219 CO 0.57 0.31 -0.25 -0.61 -1.61 0.00 0.00 179.24 177.64 1gql h GLN 220 N 0.67 -0.20 0.04 0.28 4.15 -1.92 -1.71 115.11 116.42 1gql h GLN 220 Ca 0.37 0.01 -0.23 0.00 0.77 0.00 0.00 58.65 59.57 1gql h GLN 220 Cb 0.36 0.04 -0.00 0.00 0.21 0.00 0.00 27.48 28.10 1gql h GLN 220 CO -0.26 -0.13 -1.02 0.74 -1.93 0.00 0.00 178.83 176.23 1gql h PHE 221 N -0.20 0.48 -0.65 3.99 0.04 -1.63 -3.13 116.94 115.84 1gql h PHE 221 Ca 0.17 -0.29 0.02 0.00 2.80 0.00 0.00 57.97 60.67 1gql h PHE 221 Cb 0.48 -0.04 -0.03 0.00 2.20 0.00 0.00 35.95 38.55 1gql h PHE 221 CO -0.46 1.14 0.43 -0.07 -0.60 0.00 0.00 178.31 178.75 1gql h LEU 222 N 0.15 0.72 -0.65 1.54 3.38 -0.55 0.23 115.31 120.11 1gql h LEU 222 Ca -0.08 -0.02 -0.03 0.00 0.09 0.00 0.00 57.88 57.84 1gql h LEU 222 Cb 1.68 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 42.23 1gql h LEU 222 CO 0.17 0.51 0.28 1.56 0.09 0.00 0.00 178.44 181.05 1gql h GLN 223 N 0.84 0.97 -0.16 1.13 4.20 -1.31 0.14 115.11 120.91 1gql h GLN 223 Ca 0.25 -0.16 -0.01 0.00 0.06 0.00 0.00 58.65 58.78 1gql h GLN 223 Cb -0.04 -0.16 -0.01 0.00 0.30 0.00 0.00 27.48 27.57 1gql h GLN 223 CO -0.06 0.80 0.06 0.87 -0.67 0.00 0.00 178.83 179.82 1gql h LYS 224 N 0.91 0.25 -0.45 1.46 1.57 -1.18 -3.13 116.57 116.00 1gql h LYS 224 Ca 0.22 -0.05 -0.04 0.00 -1.87 0.00 0.00 60.65 58.91 1gql h LYS 224 Cb 0.18 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.43 1gql h LYS 224 CO -0.02 0.35 0.10 0.82 -0.57 0.00 0.00 179.45 180.13 1gql h ILE 225 N 0.09 1.20 -0.57 1.86 2.04 -0.43 -2.52 117.51 119.19 1gql h ILE 225 Ca 0.05 -0.73 -0.01 0.00 1.00 0.00 0.00 64.86 65.17 1gql h ILE 225 Cb 0.20 0.75 -0.03 0.00 -0.74 0.00 0.00 36.82 37.00 1gql h ILE 225 CO -0.00 0.27 0.29 0.00 0.00 0.00 0.00 178.15 178.71 1gql h ALA 226 N 1.45 1.45 -0.72 1.87 0.00 -0.94 0.10 119.26 122.47 1gql h ALA 226 Ca 0.15 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 1gql h ALA 226 Cb 0.26 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 1gql h ALA 226 CO -0.00 0.45 0.40 0.00 0.00 0.00 0.00 179.25 180.10 1gql h ALA 227 N 1.53 0.93 -0.39 0.00 0.00 -1.40 0.48 119.26 120.41 1gql h ALA 227 Ca 0.20 -0.11 -0.05 0.00 0.00 0.00 0.00 54.91 54.95 1gql h ALA 227 Cb 0.05 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 1gql h ALA 227 CO -0.03 0.43 0.06 -0.07 0.00 0.00 0.00 179.25 179.64 1gql h LEU 228 N 1.00 0.63 -0.99 0.00 3.38 -1.25 -2.00 115.31 116.06 1gql h LEU 228 Ca 0.26 -0.26 0.07 0.00 0.09 0.00 0.00 57.88 58.03 1gql h LEU 228 Cb 0.03 -0.17 -0.07 0.00 0.09 0.00 0.00 40.66 40.54 1gql h LEU 228 CO -0.04 0.73 0.64 0.00 0.09 0.00 0.00 178.44 179.86 1gql h ALA 229 N 0.92 1.39 -0.68 1.53 0.00 -0.34 -1.07 119.26 121.01 1gql h ALA 229 Ca 0.12 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 1gql h ALA 229 Cb 0.38 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.84 1gql h ALA 229 CO 0.01 0.42 0.40 -0.44 0.00 0.00 0.00 179.25 179.64 1gql h ASP 230 N 1.16 0.83 -0.36 0.00 3.32 -0.66 -0.22 116.42 120.49 1gql h ASP 230 Ca 0.43 -0.07 -0.06 0.00 0.02 0.00 0.00 57.03 57.35 1gql h ASP 230 Cb 0.18 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.50 1gql h ASP 230 CO -0.18 0.66 0.02 0.00 -1.72 0.00 0.00 179.24 178.02 1gql h ALA 231 N 1.20 1.20 0.00 3.45 0.00 -0.61 -3.24 119.26 121.27 1gql h ALA 231 Ca 0.24 -0.24 -0.21 0.00 0.00 0.00 0.00 54.91 54.71 1gql h ALA 231 Cb -0.00 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.57 1gql h ALA 231 CO -0.04 0.53 -1.04 0.74 0.00 0.00 0.00 179.25 179.43 1gql h PHE 232 N 0.67 0.00 -0.41 0.00 0.04 -0.75 -3.39 116.94 113.10 1gql h PHE 232 Ca 0.14 0.00 0.08 0.00 2.80 0.00 0.00 57.97 60.99 1gql h PHE 232 Cb 0.39 0.00 -0.07 0.00 2.20 0.00 0.00 35.95 38.47 1gql h PHE 232 CO 0.02 0.92 -0.05 -0.09 -0.60 0.00 0.00 178.31 178.50 1gql h ARG 233 N 0.00 0.05 0.00 1.51 2.43 -1.07 -1.34 114.38 115.96 1gql h ARG 233 Ca -0.05 -0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.11 1gql h ARG 233 Cb 1.74 -0.01 -0.00 0.00 -0.42 0.00 0.00 29.97 31.28 1gql h ARG 233 CO 0.11 0.03 -0.00 -1.00 -1.51 0.00 0.00 179.97 177.60 1gql h PRO 234 N 0.05 0.00 -0.33 0.20 0.13 -1.76 -1.56 132.00 128.73 1gql h PRO 234 Ca 0.20 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.33 1gql h PRO 234 Cb 0.30 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.43 1gql h PRO 234 CO -0.38 0.00 0.00 0.66 -0.23 0.00 0.00 178.00 178.06 1gql n TYR 235 N -3.13 0.43 -1.01 1.56 4.01 -0.52 -4.10 117.16 114.41 1gql n TYR 235 Ca -0.03 -0.21 -0.00 0.00 -0.16 0.00 0.00 57.90 57.50 1gql n TYR 235 Cb 0.10 0.00 -0.00 0.00 -0.31 0.00 0.00 39.34 39.13 1gql n TYR 235 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1gql n GLY 236 N 1.25 0.47 3.49 2.72 0.00 -0.59 -4.71 105.19 107.83 1gql n GLY 236 Ca 0.17 -0.25 -0.42 0.00 0.00 0.00 0.00 46.02 45.52 1gql n GLY 236 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1gql s ILE 237 N -1.98 5.25 0.38 -0.61 1.01 -1.14 -4.60 121.20 119.51 1gql s ILE 237 Ca 0.00 -0.46 -0.19 0.00 0.00 0.00 0.00 60.65 60.01 1gql s ILE 237 Cb 0.00 -3.82 -0.10 0.00 0.01 0.00 0.00 42.46 38.55 1gql s ILE 237 CO 0.00 -0.17 0.86 -0.54 0.00 0.00 0.00 174.94 175.10 1gql s LYS 238 N 1.70 4.15 -0.01 2.79 1.02 -0.59 -4.07 119.74 124.73 1gql s LYS 238 Ca 0.05 0.95 -0.18 0.00 0.02 0.00 0.00 55.97 56.81 1gql s LYS 238 Cb -0.18 -2.31 -0.05 0.00 -0.52 0.00 0.00 37.83 34.77 1gql s LYS 238 CO 0.10 0.06 0.50 1.41 -0.92 0.00 0.00 175.35 176.50 1gql s MET 239 N -3.05 4.17 0.10 1.68 -2.45 -1.26 -1.46 119.30 117.02 1gql s MET 239 Ca 0.58 0.56 0.04 0.00 -1.25 0.00 0.00 55.69 55.62 1gql s MET 239 Cb -0.10 -3.30 -0.04 0.00 1.25 0.00 0.00 34.83 32.64 1gql s MET 239 CO 0.15 0.49 -0.10 0.71 1.05 0.00 0.00 175.02 177.31 1gql s TYR 240 N -0.49 1.10 0.00 4.11 1.51 0.28 -0.28 117.35 123.58 1gql s TYR 240 Ca 0.27 -0.65 0.05 0.00 -1.01 0.00 0.00 57.07 55.73 1gql s TYR 240 Cb -0.17 -0.60 -0.01 0.00 -0.11 0.00 0.00 41.96 41.07 1gql s TYR 240 CO 0.15 0.02 -0.15 -0.51 -1.11 0.00 0.00 175.55 173.94 1gql s LEU 241 N -2.47 2.06 0.20 -1.29 1.43 -0.75 -3.14 118.68 114.73 1gql s LEU 241 Ca 0.06 -0.32 -0.30 0.00 -1.03 0.00 0.00 54.13 52.54 1gql s LEU 241 Cb -0.03 -0.75 -0.08 0.00 0.03 0.00 0.00 46.19 45.36 1gql s LEU 241 CO 0.00 0.15 1.13 -0.44 0.23 0.00 0.00 176.35 177.43 1gql s SER 242 N -0.55 7.21 0.17 2.29 0.01 -1.26 -0.82 113.70 120.76 1gql s SER 242 Ca 0.05 2.16 0.10 0.00 1.31 0.00 0.00 55.95 59.57 1gql s SER 242 Cb -0.06 -2.61 -0.04 0.00 0.21 0.00 0.00 66.02 63.52 1gql s SER 242 CO -0.00 -0.25 -0.15 0.27 0.41 0.00 0.00 173.24 173.52 1gql s ILE 243 N -0.34 2.91 -0.26 1.44 -5.25 -0.60 -4.77 121.20 114.32 1gql s ILE 243 Ca 0.49 -1.73 -0.12 0.00 -0.99 0.00 0.00 60.65 58.31 1gql s ILE 243 Cb -0.31 -2.41 -0.05 0.00 2.95 0.00 0.00 42.46 42.65 1gql s ILE 243 CO 0.36 -0.07 0.25 0.21 -1.79 0.00 0.00 174.94 173.91 1gql s ASN 244 N -2.65 6.13 0.48 4.36 2.47 -1.26 -4.51 114.94 119.96 1gql s ASN 244 Ca 0.22 0.14 0.14 0.00 0.42 0.00 0.00 52.86 53.78 1gql s ASN 244 Cb -0.09 -2.15 1.12 0.00 -1.45 0.00 0.00 41.25 38.67 1gql s ASN 244 CO 0.13 -0.07 2.09 0.15 -3.72 0.00 0.00 177.10 175.68 1gql h PHE 245 N 8.10 0.12 -0.04 0.43 3.57 -1.88 -1.15 116.94 126.10 1gql h PHE 245 Ca -0.35 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.15 1gql h PHE 245 Cb 1.18 -0.04 0.00 0.00 2.79 0.00 0.00 35.95 39.88 1gql h PHE 245 CO 0.74 0.12 0.00 0.09 -2.23 0.00 0.00 178.31 177.03 1gql n ASN 246 N -4.48 0.55 -0.32 0.41 3.02 -1.26 -4.53 115.26 108.65 1gql n ASN 246 Ca -0.02 -2.02 0.10 0.00 -0.03 0.00 0.00 54.58 52.62 1gql n ASN 246 Cb 0.12 -0.18 0.27 0.00 -0.61 0.00 0.00 39.78 39.38 1gql n ASN 246 CO 0.00 0.00 0.00 0.28 -2.62 0.00 0.00 177.26 174.92 1gql h SER 247 N 0.23 0.63 -0.78 6.41 0.02 -1.62 -0.20 113.55 118.24 1gql h SER 247 Ca 0.00 0.10 0.08 0.00 -0.84 0.00 0.00 61.79 61.13 1gql h SER 247 Cb 0.23 -0.00 -0.05 0.00 0.14 0.00 0.00 62.40 62.71 1gql h SER 247 CO 0.01 0.23 0.51 -0.65 -1.14 0.00 0.00 176.83 175.78 1gql h PRO 248 N 0.67 0.73 -0.13 3.45 0.11 -1.86 -1.32 132.00 133.65 1gql h PRO 248 Ca 0.52 -0.04 -0.13 0.00 0.11 0.00 0.00 66.00 66.46 1gql h PRO 248 Cb 0.80 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 31.75 1gql h PRO 248 CO -0.39 0.48 -0.42 0.00 -0.21 0.00 0.00 178.00 177.47 1gql h ARG 249 N 0.75 0.51 -0.29 1.05 3.08 -1.15 -2.00 114.38 116.34 1gql h ARG 249 Ca 0.35 -0.38 -0.04 0.00 0.07 0.00 0.00 59.98 59.98 1gql h ARG 249 Cb 0.37 0.07 -0.02 0.00 0.08 0.00 0.00 29.97 30.47 1gql h ARG 249 CO -0.13 1.00 0.00 0.00 -1.07 0.00 0.00 179.97 179.78 1gql h ALA 250 N 0.51 1.47 0.00 0.04 0.00 -0.62 -0.45 119.26 120.21 1gql h ALA 250 Ca -0.02 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1gql h ALA 250 Cb 1.05 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.70 1gql h ALA 250 CO 0.09 0.38 0.00 1.19 0.00 0.00 0.00 179.25 180.91 1gql n PHE 251 N -4.31 0.00 -1.08 0.00 3.01 -0.56 -4.91 117.46 109.61 1gql n PHE 251 Ca 0.01 0.00 -0.03 0.00 1.01 0.00 0.00 57.45 58.44 1gql n PHE 251 Cb 0.22 -0.42 -0.01 0.00 -0.01 0.00 0.00 39.48 39.26 1gql n PHE 251 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1gql n GLY 252 N 1.12 0.59 0.09 1.37 0.00 -0.18 -4.93 105.19 103.24 1gql n GLY 252 Ca 0.09 -0.76 -0.09 0.00 0.00 0.00 0.00 46.02 45.26 1gql n GLY 252 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1gql n ASP 253 N 1.18 0.60 -3.95 1.61 8.00 -0.80 -4.94 116.55 118.26 1gql n ASP 253 Ca -0.03 0.28 -0.14 0.00 0.71 0.00 0.00 54.79 55.62 1gql n ASP 253 Cb 0.10 0.27 -0.14 0.00 -0.02 0.00 0.00 41.12 41.34 1gql n ASP 253 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1gql s VAL 254 N -2.56 0.28 -1.94 2.53 1.01 -0.92 -5.03 120.40 113.77 1gql s VAL 254 Ca -0.07 -0.31 0.03 0.00 0.00 0.00 0.00 61.98 61.64 1gql s VAL 254 Cb 0.07 -0.27 0.10 0.00 0.00 0.00 0.00 36.38 36.28 1gql s VAL 254 CO 0.83 -0.02 1.06 -0.90 0.00 0.00 0.00 175.10 176.06 1gql n ASP 255 N 2.72 0.66 -3.76 3.32 5.75 -1.26 -3.65 116.55 120.32 1gql n ASP 255 Ca -0.15 -2.01 -0.10 0.00 -0.01 0.00 0.00 54.79 52.53 1gql n ASP 255 Cb 0.58 -0.10 -0.04 0.00 -1.03 0.00 0.00 41.12 40.53 1gql n ASP 255 CO 0.00 0.00 0.00 0.28 -0.11 0.00 0.00 177.20 177.37 1gql s THR 256 N -1.82 0.04 -0.02 2.12 -1.32 -1.26 -5.03 115.64 108.35 1gql s THR 256 Ca 0.07 -0.84 0.02 0.00 -1.21 0.00 0.00 61.69 59.74 1gql s THR 256 Cb 0.04 -1.57 0.03 0.00 -1.51 0.00 0.00 72.50 69.50 1gql s THR 256 CO 0.05 -0.16 1.00 0.00 -2.21 0.00 0.00 174.62 173.30 1gql n ALA 257 N -0.31 2.00 -1.65 11.08 0.00 -1.26 -4.45 120.51 125.92 1gql n ALA 257 Ca -0.10 -1.18 -0.50 0.00 0.00 0.00 0.00 53.44 51.66 1gql n ALA 257 Cb 0.63 -0.05 -0.05 0.00 0.00 0.00 0.00 19.45 19.97 1gql n ALA 257 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1gql n ASP 258 N -0.59 3.05 0.21 0.00 2.03 -1.26 -4.84 116.55 115.15 1gql n ASP 258 Ca 0.02 0.88 0.15 0.00 0.52 0.00 0.00 54.79 56.36 1gql n ASP 258 Cb 0.31 -1.32 0.70 0.00 -0.72 0.00 0.00 41.12 40.09 1gql n ASP 258 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 1gql h PRO 259 N 9.54 0.00 -0.00 -0.67 0.13 -1.92 -1.43 132.00 137.64 1gql h PRO 259 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 1gql h PRO 259 Cb 1.29 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.42 1gql h PRO 259 CO 0.96 0.00 -0.24 1.28 -0.23 0.00 0.00 178.00 179.77 1gql n LEU 260 N -2.58 0.66 -4.68 1.56 4.77 -1.26 -4.60 117.00 110.87 1gql n LEU 260 Ca -0.00 -0.06 -0.43 0.00 -0.03 0.00 0.00 56.01 55.49 1gql n LEU 260 Cb 0.15 -0.20 -0.02 0.00 -2.33 0.00 0.00 43.42 41.03 1gql n LEU 260 CO 0.18 0.13 0.83 -0.62 -1.33 0.00 0.00 177.39 176.58 1gql s ASP 261 N -2.63 7.19 0.53 -1.43 -1.08 -0.54 -4.94 116.67 113.77 1gql s ASP 261 Ca 0.22 1.47 0.21 0.00 -0.52 0.00 0.00 52.55 53.93 1gql s ASP 261 Cb 0.19 -2.55 1.34 0.00 -1.46 0.00 0.00 42.92 40.44 1gql s ASP 261 CO 0.54 -0.52 2.08 -0.65 0.52 0.00 0.00 175.17 177.14 1gql h PRO 262 N 7.22 0.00 -0.24 4.34 0.11 -1.88 -0.28 132.00 141.27 1gql h PRO 262 Ca -0.27 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 65.76 1gql h PRO 262 Cb 1.12 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.21 1gql h PRO 262 CO 0.89 0.00 -0.20 0.00 -0.21 0.00 0.00 178.00 178.49 1gql h ARG 263 N 0.00 0.42 -0.08 1.05 3.08 -1.94 -0.41 114.38 116.50 1gql h ARG 263 Ca 0.12 -0.14 -0.09 0.00 0.07 0.00 0.00 59.98 59.94 1gql h ARG 263 Cb 0.47 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.49 1gql h ARG 263 CO -0.00 0.60 -0.30 0.28 -1.07 0.00 0.00 179.97 179.48 1gql h VAL 264 N 0.38 1.41 -0.67 2.04 2.07 -1.36 -1.07 116.25 119.06 1gql h VAL 264 Ca 0.06 -1.67 0.07 0.00 0.82 0.00 0.00 66.70 65.98 1gql h VAL 264 Cb 0.56 2.26 -0.06 0.00 -1.52 0.00 0.00 31.29 32.53 1gql h VAL 264 CO 0.04 0.48 0.35 1.56 0.02 0.00 0.00 177.57 180.02 1gql h GLN 265 N -0.12 0.62 -0.49 1.57 4.20 -1.17 -2.19 115.11 117.52 1gql h GLN 265 Ca -0.01 -0.04 -0.10 0.00 0.06 0.00 0.00 58.65 58.55 1gql h GLN 265 Cb 0.93 -0.14 -0.02 0.00 0.30 0.00 0.00 27.48 28.56 1gql h GLN 265 CO 0.06 0.41 -0.11 0.37 -0.67 0.00 0.00 178.83 178.89 1gql h GLN 266 N 0.64 0.91 -0.32 1.46 5.75 -1.03 -2.26 115.11 120.27 1gql h GLN 266 Ca 0.31 -0.32 0.03 0.00 -0.15 0.00 0.00 58.65 58.52 1gql h GLN 266 Cb 0.24 -0.07 -0.03 0.00 1.07 0.00 0.00 27.48 28.70 1gql h GLN 266 CO -0.21 0.97 0.12 2.35 -2.65 0.00 0.00 178.83 179.41 1gql h TRP 267 N 0.82 0.22 -0.31 3.99 7.01 -0.60 -0.25 115.95 126.83 1gql h TRP 267 Ca 0.13 0.02 -0.13 0.00 2.11 0.00 0.00 58.89 61.02 1gql h TRP 267 Cb 0.64 -0.05 -0.01 0.00 -2.10 0.00 0.00 29.16 27.63 1gql h TRP 267 CO 0.04 0.10 -0.33 -1.49 -2.79 0.00 0.00 178.44 173.97 1gql h TRP 268 N 0.27 0.80 -0.27 2.65 4.06 -1.35 0.66 115.95 122.77 1gql h TRP 268 Ca 0.14 -0.21 0.00 0.00 2.06 0.00 0.00 58.89 60.89 1gql h TRP 268 Cb 0.10 -0.18 -0.01 0.00 -1.00 0.00 0.00 29.16 28.07 1gql h TRP 268 CO -0.13 0.92 0.17 -0.22 -3.56 0.00 0.00 178.44 175.63 1gql h LYS 269 N 0.58 0.35 -0.64 0.49 3.64 -1.01 0.73 116.57 120.71 1gql h LYS 269 Ca 0.06 -0.02 -0.08 0.00 -1.27 0.00 0.00 60.65 59.34 1gql h LYS 269 Cb 0.84 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 32.55 1gql h LYS 269 CO 0.07 0.23 0.07 1.15 -2.27 0.00 0.00 179.45 178.70 1gql h THR 270 N 0.36 1.26 -0.57 1.00 2.02 -0.88 -1.58 112.91 114.53 1gql h THR 270 Ca 0.10 -1.07 -0.06 0.00 0.77 0.00 0.00 66.41 66.15 1gql h THR 270 Cb -0.04 0.70 -0.02 0.00 -1.74 0.00 0.00 68.15 67.05 1gql h THR 270 CO -0.03 0.40 0.13 -0.09 0.37 0.00 0.00 175.52 176.30 1gql h ARG 271 N 0.99 0.91 -0.75 6.66 9.65 -0.61 -1.58 114.38 129.66 1gql h ARG 271 Ca 0.19 -0.22 -0.00 0.00 -1.10 0.00 0.00 59.98 58.85 1gql h ARG 271 Cb 0.48 -0.12 -0.04 0.00 -1.39 0.00 0.00 29.97 28.90 1gql h ARG 271 CO 0.02 0.85 0.46 0.00 2.80 0.00 0.00 179.97 184.09 1gql h ALA 272 N 1.02 0.95 -0.99 2.80 0.00 -0.62 -0.01 119.26 122.41 1gql h ALA 272 Ca 0.18 -0.08 0.01 0.00 0.00 0.00 0.00 54.91 55.02 1gql h ALA 272 Cb 0.35 -0.30 -0.05 0.00 0.00 0.00 0.00 17.79 17.79 1gql h ALA 272 CO 0.00 0.42 0.66 1.96 0.00 0.00 0.00 179.25 182.29 1gql h GLN 273 N 1.02 1.29 -0.20 0.00 4.20 -0.95 -0.77 115.11 119.71 1gql h GLN 273 Ca 0.27 -0.08 -0.02 0.00 0.06 0.00 0.00 58.65 58.88 1gql h GLN 273 Cb -0.04 -0.29 -0.01 0.00 0.30 0.00 0.00 27.48 27.44 1gql h GLN 273 CO -0.05 0.86 0.03 -0.22 -0.67 0.00 0.00 178.83 178.78 1gql h LYS 274 N 1.33 0.34 -0.24 1.46 3.64 -0.54 -1.48 116.57 121.07 1gql h LYS 274 Ca 0.37 -0.09 0.04 0.00 -1.27 0.00 0.00 60.65 59.70 1gql h LYS 274 Cb -0.14 -0.04 -0.04 0.00 -0.41 0.00 0.00 32.23 31.60 1gql h LYS 274 CO -0.08 0.49 -0.03 0.82 -2.27 0.00 0.00 179.45 178.38 1gql h ILE 275 N 0.13 0.79 0.00 2.00 2.04 -0.66 -2.41 117.51 119.41 1gql h ILE 275 Ca 0.06 -0.01 -0.02 0.00 1.00 0.00 0.00 64.86 65.89 1gql h ILE 275 Cb 0.32 0.75 -0.00 0.00 -0.74 0.00 0.00 36.82 37.14 1gql h ILE 275 CO 0.00 0.01 -0.11 1.88 0.00 0.00 0.00 178.15 179.93 1gql h TYR 276 N 0.04 0.00 -0.12 1.37 0.05 -0.99 0.27 116.97 117.59 1gql h TYR 276 Ca 0.12 0.00 -0.07 0.00 0.05 0.00 0.00 58.73 58.82 1gql h TYR 276 Cb 0.16 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 37.89 1gql h TYR 276 CO -0.22 0.11 -0.25 0.66 -1.05 0.00 0.00 178.16 177.40 1gql h SER 277 N 0.00 0.21 0.28 3.88 4.64 -0.76 -2.92 113.55 118.89 1gql h SER 277 Ca -0.00 -0.06 -0.34 0.00 -0.47 0.00 0.00 61.79 60.92 1gql h SER 277 Cb 0.67 -0.06 -0.00 0.00 -0.31 0.00 0.00 62.40 62.70 1gql h SER 277 CO 0.01 0.47 -1.72 1.88 -0.87 0.00 0.00 176.83 176.61 1gql h TYR 278 N 0.19 0.55 -2.66 4.77 0.05 -1.17 -3.43 116.97 115.27 1gql h TYR 278 Ca 0.03 -0.40 -0.60 0.00 0.05 0.00 0.00 58.73 57.81 1gql h TYR 278 Cb 0.56 -0.02 -0.39 0.00 1.01 0.00 0.00 36.73 37.88 1gql h TYR 278 CO 0.01 1.56 -0.83 0.42 -1.05 0.00 0.00 178.16 178.26 1gql s ILE 279 N -2.59 0.90 0.45 -2.88 1.01 -0.00 -4.87 121.20 113.22 1gql s ILE 279 Ca -0.14 -2.63 0.40 0.00 0.00 0.00 0.00 60.65 58.28 1gql s ILE 279 Cb 0.06 -1.62 0.42 0.00 0.01 0.00 0.00 42.46 41.32 1gql s ILE 279 CO 0.84 -1.07 2.22 -0.65 0.00 0.00 0.00 174.94 176.29 1gql h PRO 280 N 6.19 0.00 -0.27 2.79 0.11 -1.76 -2.22 132.00 136.83 1gql h PRO 280 Ca 0.14 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 66.18 1gql h PRO 280 Cb 0.91 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 31.98 1gql h PRO 280 CO 0.42 0.00 -0.02 -0.40 -0.21 0.00 0.00 178.00 177.79 1gql n ASP 281 N -3.01 3.25 -4.62 -2.05 5.75 -1.26 -5.00 116.55 109.61 1gql n ASP 281 Ca -0.02 -3.29 -0.46 0.00 -0.01 0.00 0.00 54.79 51.01 1gql n ASP 281 Cb 0.13 -0.57 -0.03 0.00 -1.03 0.00 0.00 41.12 39.62 1gql n ASP 281 CO 0.00 0.00 0.00 0.33 -0.11 0.00 0.00 177.20 177.42 1gql n PHE 282 N -0.82 1.69 0.07 2.11 7.35 -0.83 -4.65 117.46 122.38 1gql n PHE 282 Ca 0.25 0.58 -0.15 0.00 -0.76 0.00 0.00 57.45 57.37 1gql n PHE 282 Cb 0.93 -2.35 -0.07 0.00 0.35 0.00 0.00 39.48 38.33 1gql n PHE 282 CO 0.00 0.00 0.00 0.78 -0.76 0.00 0.00 176.76 176.78 1gql h GLY 283 N 3.29 0.50 0.00 7.13 0.00 -0.97 -3.42 103.07 109.60 1gql h GLY 283 Ca -0.43 -0.94 0.00 0.00 0.00 0.00 0.00 47.33 45.96 1gql h GLY 283 CO 0.69 0.83 0.00 0.61 0.00 0.00 0.00 176.54 178.67 1gql n GLY 284 N 1.09 0.83 3.39 4.60 0.00 -1.25 -1.44 105.19 112.42 1gql n GLY 284 Ca -0.08 -1.83 -0.30 0.00 0.00 0.00 0.00 46.02 43.80 1gql n GLY 284 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1gql s PHE 285 N -2.90 2.41 -0.09 1.61 0.08 -0.64 -1.80 117.98 116.65 1gql s PHE 285 Ca 0.00 -0.35 -0.03 0.00 0.12 0.00 0.00 56.93 56.67 1gql s PHE 285 Cb 0.00 -1.42 -0.03 0.00 -0.57 0.00 0.00 43.02 41.00 1gql s PHE 285 CO 0.00 0.18 0.03 -1.17 -0.10 0.00 0.00 175.22 174.16 1gql s LEU 286 N -1.34 3.71 -0.13 -0.37 2.96 0.00 0.07 118.68 123.59 1gql s LEU 286 Ca 0.13 0.19 -0.02 0.00 -0.22 0.00 0.00 54.13 54.21 1gql s LEU 286 Cb -0.10 -1.86 0.04 0.00 0.50 0.00 0.00 46.19 44.77 1gql s LEU 286 CO 0.03 0.38 0.01 -0.69 -1.32 0.00 0.00 176.35 174.76 1gql s VAL 287 N -0.87 0.53 -0.38 1.68 1.01 -0.10 -1.55 120.40 120.72 1gql s VAL 287 Ca 0.13 -0.22 -0.13 0.00 0.00 0.00 0.00 61.98 61.77 1gql s VAL 287 Cb -0.11 -0.81 0.01 0.00 0.00 0.00 0.00 36.38 35.47 1gql s VAL 287 CO 0.03 0.08 0.24 -0.75 0.00 0.00 0.00 175.10 174.70 1gql s LYS 288 N 1.89 3.05 0.00 2.72 2.20 -1.26 -0.93 119.74 127.42 1gql s LYS 288 Ca 0.02 -0.94 0.02 0.00 -0.36 0.00 0.00 55.97 54.71 1gql s LYS 288 Cb -0.14 -3.82 -0.01 0.00 -1.51 0.00 0.00 37.83 32.35 1gql s LYS 288 CO -0.07 -0.65 -0.07 0.00 -0.36 0.00 0.00 175.35 174.21 1gql s ALA 289 N 1.64 0.56 -1.46 3.13 0.00 -1.26 -4.73 121.76 119.64 1gql s ALA 289 Ca 0.04 -0.37 -0.09 0.00 0.00 0.00 0.00 51.96 51.54 1gql s ALA 289 Cb -0.19 -0.11 0.06 0.00 0.00 0.00 0.00 23.12 22.88 1gql s ALA 289 CO 0.09 0.11 0.88 -0.25 0.00 0.00 0.00 175.76 176.59 1gql n ASP 290 N 2.65 -3.57 -3.72 0.00 8.00 -0.69 -4.90 116.55 114.33 1gql n ASP 290 Ca -0.15 -0.80 -0.12 0.00 0.71 0.00 0.00 54.79 54.43 1gql n ASP 290 Cb 0.57 -3.92 -0.13 0.00 -0.02 0.00 0.00 41.12 37.62 1gql n ASP 290 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 1gql s SER 291 N -3.67 -0.23 -1.41 -2.24 0.15 -1.21 -4.58 113.70 100.51 1gql s SER 291 Ca 0.44 0.56 -0.07 0.00 0.70 0.00 0.00 55.95 57.58 1gql s SER 291 Cb -0.22 0.47 0.04 0.00 -1.71 0.00 0.00 66.02 64.60 1gql s SER 291 CO 0.83 -0.18 0.57 -0.62 1.20 0.00 0.00 173.24 175.04 1gql n GLU 292 N 4.35 -4.24 -0.66 5.44 1.02 -1.26 -1.02 120.64 124.27 1gql n GLU 292 Ca -0.23 0.68 0.00 0.00 -0.02 0.00 0.00 57.16 57.58 1gql n GLU 292 Cb 0.53 -5.47 0.00 0.00 -0.02 0.00 0.00 31.44 26.48 1gql n GLU 292 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1gql n GLY 293 N -1.36 1.15 3.76 0.62 0.00 -1.26 -5.04 105.19 103.05 1gql n GLY 293 Ca -0.06 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.57 1gql n GLY 293 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1gql s GLN 294 N -0.21 4.63 0.83 1.61 -1.52 -0.19 -5.00 119.66 119.81 1gql s GLN 294 Ca 0.00 1.68 -0.11 0.00 -1.95 0.00 0.00 55.36 54.98 1gql s GLN 294 Cb 0.00 -3.11 0.09 0.00 -0.22 0.00 0.00 33.01 29.76 1gql s GLN 294 CO 0.00 0.24 1.09 -1.25 -0.25 0.00 0.00 175.29 175.13 1gql s PRO 295 N -1.54 1.82 0.00 2.91 0.04 -1.26 -1.70 135.00 135.27 1gql s PRO 295 Ca 0.46 1.08 -0.28 0.00 0.04 0.00 0.00 61.00 62.30 1gql s PRO 295 Cb -0.29 -1.85 0.10 0.00 0.04 0.00 0.00 34.50 32.49 1gql s PRO 295 CO 0.37 -1.93 1.27 0.20 0.04 0.00 0.00 177.00 176.94 1gql s GLY 296 N -3.34 -0.13 0.35 0.56 0.00 -1.26 -2.62 107.32 100.88 1gql s GLY 296 Ca 0.62 0.06 0.06 0.00 0.00 0.00 0.00 44.72 45.46 1gql s GLY 296 CO 0.57 4.89 1.93 -0.56 0.00 0.00 0.00 173.10 179.92 1gql h PRO 297 N 2.00 0.76 0.00 2.90 0.13 -1.87 -1.95 132.00 133.98 1gql h PRO 297 Ca -0.23 -0.05 -0.01 0.00 -0.87 0.00 0.00 66.00 64.84 1gql h PRO 297 Cb 1.19 -0.17 -0.00 0.00 0.13 0.00 0.00 31.00 32.14 1gql h PRO 297 CO 0.31 0.51 -0.07 1.96 -0.23 0.00 0.00 178.00 180.48 1gql h GLN 298 N 0.79 0.00 0.00 0.86 4.20 -1.80 0.36 115.11 119.52 1gql h GLN 298 Ca 0.36 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.07 1gql h GLN 298 Cb 0.38 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.16 1gql h GLN 298 CO -0.14 0.07 0.00 0.78 -0.67 0.00 0.00 178.83 178.87 1gql h GLY 299 N 0.32 0.00 -0.97 3.46 0.00 -1.65 -1.72 103.07 102.51 1gql h GLY 299 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1gql h GLY 299 CO 0.01 0.00 0.00 -1.72 0.00 0.00 0.00 176.54 174.83 1gql n TYR 300 N -2.62 0.50 -1.53 5.60 4.01 0.01 -4.97 117.16 118.15 1gql n TYR 300 Ca -0.02 -0.75 -0.12 0.00 -0.16 0.00 0.00 57.90 56.86 1gql n TYR 300 Cb 0.07 -0.17 -0.04 0.00 -0.31 0.00 0.00 39.34 38.89 1gql n TYR 300 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1gql n GLY 301 N -0.42 0.96 3.80 2.72 0.00 -0.65 -5.01 105.19 106.61 1gql n GLY 301 Ca 0.15 -0.48 -0.22 0.00 0.00 0.00 0.00 46.02 45.47 1gql n GLY 301 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1gql s ARG 302 N -3.33 2.56 0.42 1.61 1.81 -0.55 -4.97 118.95 116.50 1gql s ARG 302 Ca 0.00 -1.43 0.07 0.00 -1.72 0.00 0.00 55.73 52.66 1gql s ARG 302 Cb 0.00 -2.33 0.01 0.00 -0.45 0.00 0.00 34.95 32.18 1gql s ARG 302 CO 0.00 0.08 0.58 0.16 -0.68 0.00 0.00 175.30 175.44 1gql s ASP 303 N -3.94 5.67 0.50 0.23 1.47 -1.26 -2.55 116.67 116.79 1gql s ASP 303 Ca 0.40 -0.35 0.30 0.00 1.18 0.00 0.00 52.55 54.08 1gql s ASP 303 Cb -0.04 -0.75 1.08 0.00 -0.34 0.00 0.00 42.92 42.86 1gql s ASP 303 CO 0.25 -0.75 1.87 0.45 0.68 0.00 0.00 175.17 177.67 1gql h HIS 304 N 0.62 0.00 -0.18 2.11 3.86 -1.95 -1.69 115.15 117.92 1gql h HIS 304 Ca -0.41 0.00 -0.14 0.00 -1.16 0.00 0.00 60.37 58.67 1gql h HIS 304 Cb 1.28 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.75 1gql h HIS 304 CO 0.40 0.00 -0.41 0.00 0.86 0.00 0.00 177.93 178.78 1gql h ALA 305 N 2.03 0.30 -0.98 2.45 0.00 -1.94 -0.57 119.26 120.55 1gql h ALA 305 Ca 0.00 -0.46 0.06 0.00 0.00 0.00 0.00 54.91 54.51 1gql h ALA 305 Cb 0.63 -0.04 -0.06 0.00 0.00 0.00 0.00 17.79 18.31 1gql h ALA 305 CO 0.00 0.41 0.63 0.93 0.00 0.00 0.00 179.25 181.22 1gql h GLU 306 N 0.27 1.12 0.05 0.00 5.08 -1.79 0.12 114.58 119.43 1gql h GLU 306 Ca 0.00 -0.07 -0.00 0.00 -1.00 0.00 0.00 59.36 58.29 1gql h GLU 306 Cb 1.02 -0.25 0.00 0.00 0.50 0.00 0.00 28.75 30.02 1gql h GLU 306 CO 0.09 0.74 -0.02 0.78 -1.00 0.00 0.00 179.01 179.60 1gql h GLY 307 N 1.16 -0.06 0.99 -3.84 0.00 -1.25 -2.69 103.07 97.36 1gql h GLY 307 Ca 0.42 0.02 -0.00 0.00 0.00 0.00 0.00 47.33 47.77 1gql h GLY 307 CO -0.16 -0.02 0.22 0.00 0.00 0.00 0.00 176.54 176.57 1gql h ALA 308 N 0.41 0.46 -0.03 3.60 0.00 -0.91 -2.81 119.26 119.98 1gql h ALA 308 Ca -0.01 -0.05 -0.05 0.00 0.00 0.00 0.00 54.91 54.80 1gql h ALA 308 Cb 0.46 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 1gql h ALA 308 CO 0.01 -0.05 -0.23 -0.91 0.00 0.00 0.00 179.25 178.07 1gql h ASN 309 N 0.48 0.05 0.05 0.00 2.35 -0.85 0.65 115.58 118.32 1gql h ASN 309 Ca 0.13 -0.01 -0.00 0.00 -0.55 0.00 0.00 56.30 55.87 1gql h ASN 309 Cb -0.01 -0.01 0.00 0.00 0.05 0.00 0.00 38.32 38.35 1gql h ASN 309 CO -0.03 0.29 -0.03 -0.03 -1.65 0.00 0.00 177.43 175.99 1gql h MET 310 N 0.05 -0.07 -0.64 0.81 4.05 -1.25 -0.08 114.93 117.81 1gql h MET 310 Ca 0.01 0.00 -0.01 0.00 -0.28 0.00 0.00 59.70 59.43 1gql h MET 310 Cb 0.43 0.02 -0.03 0.00 -0.80 0.00 0.00 31.60 31.22 1gql h MET 310 CO 0.03 0.11 0.38 -0.07 0.23 0.00 0.00 176.91 177.59 1gql h LEU 311 N -0.24 0.78 -1.39 3.39 3.38 -1.25 -2.86 115.31 117.11 1gql h LEU 311 Ca -0.01 -0.07 -0.00 0.00 0.09 0.00 0.00 57.88 57.89 1gql h LEU 311 Cb 0.21 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.74 1gql h LEU 311 CO 0.01 0.62 0.33 0.00 0.09 0.00 0.00 178.44 179.49 1gql h ALA 312 N 1.19 1.54 -0.27 1.53 0.00 -0.75 -1.54 119.26 120.97 1gql h ALA 312 Ca 0.23 -0.07 -0.09 0.00 0.00 0.00 0.00 54.91 54.99 1gql h ALA 312 Cb -0.01 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 1gql h ALA 312 CO -0.04 0.40 -0.20 0.00 0.00 0.00 0.00 179.25 179.41 1gql h ALA 313 N 1.61 1.16 -0.62 0.00 0.00 -0.82 0.14 119.26 120.73 1gql h ALA 313 Ca 0.20 -0.31 -0.09 0.00 0.00 0.00 0.00 54.91 54.70 1gql h ALA 313 Cb -0.03 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 1gql h ALA 313 CO -0.04 0.53 0.03 0.00 0.00 0.00 0.00 179.25 179.77 1gql h ALA 314 N 1.35 0.87 0.00 0.00 0.00 -1.09 -3.24 119.26 117.16 1gql h ALA 314 Ca 0.07 -0.30 -0.10 0.00 0.00 0.00 0.00 54.91 54.58 1gql h ALA 314 Cb 0.60 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 1gql h ALA 314 CO 0.04 0.67 -0.79 -0.07 0.00 0.00 0.00 179.25 179.10 1gql h LEU 315 N 0.98 0.00 -0.67 0.00 3.38 -1.11 -3.40 115.31 114.49 1gql h LEU 315 Ca 0.18 0.00 0.08 0.00 0.09 0.00 0.00 57.88 58.23 1gql h LEU 315 Cb 0.53 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.21 1gql h LEU 315 CO 0.03 0.42 0.33 0.50 0.09 0.00 0.00 178.44 179.81 1gql h LYS 316 N 0.00 0.58 0.00 1.13 1.63 -0.99 -1.06 116.57 117.85 1gql h LYS 316 Ca -0.05 -0.03 0.00 0.00 -0.85 0.00 0.00 60.65 59.71 1gql h LYS 316 Cb 1.36 -0.13 0.00 0.00 -0.60 0.00 0.00 32.23 32.86 1gql h LYS 316 CO 0.05 0.38 0.00 -1.35 -3.45 0.00 0.00 179.45 175.08 1gql h PRO 317 N 0.59 0.00 -0.09 1.90 0.11 -1.78 -1.95 132.00 130.79 1gql h PRO 317 Ca 0.32 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.43 1gql h PRO 317 Cb 0.29 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.40 1gql h PRO 317 CO -0.24 0.00 0.00 1.19 -0.21 0.00 0.00 178.00 178.74 1gql n PHE 318 N -3.06 0.10 -1.16 0.65 3.72 -0.46 -4.98 117.46 112.27 1gql n PHE 318 Ca -0.02 -0.06 -0.01 0.00 -0.05 0.00 0.00 57.45 57.30 1gql n PHE 318 Cb 0.11 -0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 38.64 1gql n PHE 318 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1gql n GLY 319 N 1.06 0.47 3.89 1.37 0.00 -0.73 -4.93 105.19 106.31 1gql n GLY 319 Ca 0.12 -1.00 -0.29 0.00 0.00 0.00 0.00 46.02 44.85 1gql n GLY 319 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1gql s GLY 320 N -2.98 1.71 0.19 -0.02 0.00 -0.85 -4.97 107.32 100.41 1gql s GLY 320 Ca 0.00 -0.30 0.09 0.00 0.00 0.00 0.00 44.72 44.51 1gql s GLY 320 CO 0.00 -0.10 -0.18 -1.34 0.00 0.00 0.00 173.10 171.48 1gql s VAL 321 N -2.67 1.91 -0.22 1.40 -7.23 -0.52 -4.35 120.40 108.72 1gql s VAL 321 Ca 0.50 -2.06 -0.03 0.00 -1.81 0.00 0.00 61.98 58.58 1gql s VAL 321 Cb -0.10 -1.97 -0.00 0.00 0.56 0.00 0.00 36.38 34.86 1gql s VAL 321 CO 0.41 -0.39 -0.05 -0.69 -0.31 0.00 0.00 175.10 174.06 1gql s VAL 322 N -2.33 3.26 -0.58 1.32 1.01 0.24 -1.62 120.40 121.69 1gql s VAL 322 Ca 0.20 -0.56 -0.19 0.00 0.00 0.00 0.00 61.98 61.43 1gql s VAL 322 Cb -0.04 -2.49 0.10 0.00 0.00 0.00 0.00 36.38 33.94 1gql s VAL 322 CO 0.08 0.41 0.69 -0.36 0.00 0.00 0.00 175.10 175.92 1gql s PHE 323 N 1.46 3.01 -0.30 5.22 0.08 0.11 -0.36 117.98 127.19 1gql s PHE 323 Ca 0.05 -0.94 -0.14 0.00 0.12 0.00 0.00 56.93 56.02 1gql s PHE 323 Cb -0.14 -3.96 -0.03 0.00 -0.57 0.00 0.00 43.02 38.32 1gql s PHE 323 CO -0.04 -1.26 0.34 -0.46 -0.10 0.00 0.00 175.22 173.70 1gql s TRP 324 N 2.64 3.23 0.25 0.36 -0.11 0.16 -0.92 118.94 124.55 1gql s TRP 324 Ca 0.11 0.19 -0.30 0.00 1.22 0.00 0.00 56.10 57.32 1gql s TRP 324 Cb -0.24 -2.59 -0.09 0.00 -1.50 0.00 0.00 33.47 29.05 1gql s TRP 324 CO 0.07 -0.31 1.02 1.03 -4.62 0.00 0.00 176.95 174.14 1gql s ARG 325 N 2.01 4.74 0.00 5.86 0.52 -0.10 -0.55 118.95 131.43 1gql s ARG 325 Ca 0.13 1.64 0.20 0.00 -0.52 0.00 0.00 55.73 57.18 1gql s ARG 325 Cb -0.16 -3.24 0.74 0.00 0.52 0.00 0.00 34.95 32.81 1gql s ARG 325 CO 0.11 0.34 1.54 0.00 0.02 0.00 0.00 175.30 177.31 1gql n ALA 326 N 1.48 2.52 -2.44 2.13 0.00 0.25 -4.75 120.51 119.69 1gql n ALA 326 Ca -0.01 -0.50 -0.40 0.00 0.00 0.00 0.00 53.44 52.52 1gql n ALA 326 Cb 0.46 -1.09 -0.01 0.00 0.00 0.00 0.00 19.45 18.81 1gql n ALA 326 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1gql n PHE 327 N 0.27 4.27 -4.13 0.00 7.35 -1.26 -4.71 117.46 119.25 1gql n PHE 327 Ca 0.16 -2.60 -0.15 0.00 -0.76 0.00 0.00 57.45 54.09 1gql n PHE 327 Cb 0.31 -2.63 -0.14 0.00 0.35 0.00 0.00 39.48 37.37 1gql n PHE 327 CO 0.00 0.00 0.00 0.08 -0.76 0.00 0.00 176.76 176.08 1gql s VAL 328 N 5.36 0.37 -0.30 -2.13 1.01 -1.26 -4.75 120.40 118.69 1gql s VAL 328 Ca 0.56 -0.20 -0.13 0.00 0.00 0.00 0.00 61.98 62.22 1gql s VAL 328 Cb 0.04 -0.31 0.16 0.00 0.00 0.00 0.00 36.38 36.26 1gql s VAL 328 CO 0.08 0.10 0.89 -0.72 0.00 0.00 0.00 175.10 175.46 1gql s TYR 329 N -0.10 -0.88 0.31 5.22 -0.85 -1.26 -3.75 117.35 116.03 1gql s TYR 329 Ca 0.02 1.40 -0.21 0.00 -0.52 0.00 0.00 57.07 57.76 1gql s TYR 329 Cb -0.02 0.48 -0.09 0.00 0.38 0.00 0.00 41.96 42.71 1gql s TYR 329 CO -0.00 -0.45 0.83 -1.01 -1.52 0.00 0.00 175.55 173.41 1gql s HIS 330 N 2.63 3.54 0.08 -3.49 3.76 -1.26 -4.81 115.29 115.75 1gql s HIS 330 Ca -0.01 1.51 0.33 0.00 -0.15 0.00 0.00 55.06 56.74 1gql s HIS 330 Cb -0.08 -2.73 1.39 0.00 1.11 0.00 0.00 32.58 32.26 1gql s HIS 330 CO -0.17 0.16 1.98 -1.35 -0.85 0.00 0.00 174.74 174.51 1gql h PRO 331 N 2.82 0.00 -0.64 8.40 0.11 -2.01 -3.25 132.00 137.43 1gql h PRO 331 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1gql h PRO 331 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 1gql h PRO 331 CO 0.64 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 178.03 1gql n ASP 332 N -3.03 3.55 -4.92 -2.05 5.75 -1.26 -4.88 116.55 109.71 1gql n ASP 332 Ca 0.01 -2.07 -0.26 0.00 -0.01 0.00 0.00 54.79 52.46 1gql n ASP 332 Cb 0.29 -0.45 0.01 0.00 -1.03 0.00 0.00 41.12 39.94 1gql n ASP 332 CO 0.00 0.00 0.00 0.27 -0.11 0.00 0.00 177.20 177.36 1gql s ILE 333 N -1.26 4.55 0.21 2.12 -4.36 -1.23 -5.00 121.20 116.23 1gql s ILE 333 Ca 0.43 0.02 0.07 0.00 -0.26 0.00 0.00 60.65 60.91 1gql s ILE 333 Cb 0.23 -3.73 -0.10 0.00 1.25 0.00 0.00 42.46 40.12 1gql s ILE 333 CO 0.28 -0.68 1.48 1.05 0.24 0.00 0.00 174.94 177.31 1gql h GLU 334 N 0.20 0.06 -2.80 0.37 4.11 -1.93 -3.43 114.58 111.17 1gql h GLU 334 Ca -0.47 -0.06 -0.36 0.00 0.07 0.00 0.00 59.36 58.55 1gql h GLU 334 Cb 1.22 0.02 -0.37 0.00 0.50 0.00 0.00 28.75 30.11 1gql h GLU 334 CO 0.61 0.79 -0.67 0.34 0.07 0.00 0.00 179.01 180.15 1gql s ASP 335 N -6.84 1.53 0.41 3.06 2.15 -1.26 -5.01 116.67 110.71 1gql s ASP 335 Ca -0.01 -0.22 0.17 0.00 0.43 0.00 0.00 52.55 52.91 1gql s ASP 335 Cb 0.11 0.17 1.05 0.00 -0.30 0.00 0.00 42.92 43.96 1gql s ASP 335 CO 0.79 -0.32 1.84 -0.09 -0.17 0.00 0.00 175.17 177.23 1gql h ARG 336 N 8.36 0.43 -0.91 4.34 2.43 -1.92 -0.75 114.38 126.35 1gql h ARG 336 Ca -0.16 -0.03 0.19 0.00 -0.81 0.00 0.00 59.98 59.18 1gql h ARG 336 Cb 1.14 -0.10 -0.07 0.00 -0.42 0.00 0.00 29.97 30.53 1gql h ARG 336 CO 0.25 0.28 0.59 0.35 -1.51 0.00 0.00 179.97 179.94 1gql h PHE 337 N 0.44 0.64 0.00 2.20 3.04 -1.95 -0.49 116.94 120.82 1gql h PHE 337 Ca 0.49 0.02 0.00 0.00 3.98 0.00 0.00 57.97 62.46 1gql h PHE 337 Cb 1.18 -0.20 0.00 0.00 2.56 0.00 0.00 35.95 39.50 1gql h PHE 337 CO -0.00 0.18 0.00 0.54 -2.02 0.00 0.00 178.31 177.00 1gql n ARG 338 N -4.54 0.16 0.22 1.11 1.74 -0.29 -4.59 116.66 110.46 1gql n ARG 338 Ca 0.19 0.14 -0.16 0.00 -0.77 0.00 0.00 57.85 57.26 1gql n ARG 338 Cb 0.65 -1.69 -0.08 0.00 -1.02 0.00 0.00 32.46 30.31 1gql n ARG 338 CO 0.00 0.00 0.00 0.78 -1.52 0.00 0.00 177.63 176.89 1gql h GLY 339 N 4.59 -0.97 1.00 -0.13 0.00 -1.15 -1.56 103.07 104.84 1gql h GLY 339 Ca 0.00 0.49 -0.01 0.00 0.00 0.00 0.00 47.33 47.81 1gql h GLY 339 CO 0.00 -0.32 0.35 0.00 0.00 0.00 0.00 176.54 176.57 1gql h ALA 340 N -0.44 0.81 -0.19 3.60 0.00 -1.79 -1.11 119.26 120.14 1gql h ALA 340 Ca -0.02 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 1gql h ALA 340 Cb 0.74 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 1gql h ALA 340 CO -0.11 0.33 0.07 -0.92 0.00 0.00 0.00 179.25 178.62 1gql h TYR 341 N 0.86 0.30 0.00 0.00 5.03 -1.85 -1.24 116.97 120.08 1gql h TYR 341 Ca 0.22 -0.02 -0.04 0.00 2.58 0.00 0.00 58.73 61.47 1gql h TYR 341 Cb 0.04 -0.09 -0.01 0.00 1.55 0.00 0.00 36.73 38.23 1gql h TYR 341 CO -0.01 0.36 -0.19 -0.44 -1.32 0.00 0.00 178.16 176.56 1gql h ASP 342 N 0.16 0.00 -0.09 -2.11 3.32 -1.05 -1.51 116.42 115.14 1gql h ASP 342 Ca 0.06 0.00 -0.18 0.00 0.02 0.00 0.00 57.03 56.94 1gql h ASP 342 Cb 0.19 0.00 0.01 0.00 0.22 0.00 0.00 39.33 39.75 1gql h ASP 342 CO -0.00 0.19 -0.64 -0.33 -1.72 0.00 0.00 179.24 176.73 1gql h GLU 343 N 0.00 0.59 0.00 3.56 4.39 -0.83 -3.41 114.58 118.89 1gql h GLU 343 Ca -0.00 -0.52 -0.33 0.00 0.34 0.00 0.00 59.36 58.85 1gql h GLU 343 Cb 0.38 0.12 -0.06 0.00 -0.10 0.00 0.00 28.75 29.09 1gql h GLU 343 CO 0.02 1.14 -2.27 1.19 -1.16 0.00 0.00 179.01 177.93 1gql n PHE 344 N -4.12 0.12 -0.29 4.33 3.72 -0.50 -4.44 117.46 116.29 1gql n PHE 344 Ca -0.09 0.04 0.03 0.00 -0.05 0.00 0.00 57.45 57.39 1gql n PHE 344 Cb 0.68 -0.99 0.17 0.00 -0.94 0.00 0.00 39.48 38.40 1gql n PHE 344 CO 0.00 0.00 0.00 0.52 -0.05 0.00 0.00 176.76 177.23 1gql h MET 345 N 0.00 0.76 0.00 -1.08 2.86 -1.50 0.23 114.93 116.20 1gql h MET 345 Ca -0.48 -0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.12 1gql h MET 345 Cb 2.13 -0.17 0.00 0.00 0.06 0.00 0.00 31.60 33.62 1gql h MET 345 CO 0.03 0.50 0.00 -1.35 1.06 0.00 0.00 176.91 177.16 1gql h PRO 346 N 0.78 0.00 -0.08 -0.22 0.11 -1.80 -1.95 132.00 128.84 1gql h PRO 346 Ca 0.40 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.51 1gql h PRO 346 Cb 0.37 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.48 1gql h PRO 346 CO -0.25 0.00 0.00 1.28 -0.21 0.00 0.00 178.00 178.82 1gql n LEU 347 N -2.84 2.99 -4.68 2.35 4.77 0.05 -4.94 117.00 114.68 1gql n LEU 347 Ca -0.02 -1.05 -0.42 0.00 -0.03 0.00 0.00 56.01 54.49 1gql n LEU 347 Cb 0.07 -0.04 -0.03 0.00 -2.33 0.00 0.00 43.42 41.09 1gql n LEU 347 CO 0.17 0.52 1.51 -0.67 -1.33 0.00 0.00 177.39 177.60 1gql n ASP 348 N 1.31 4.10 0.00 -1.43 2.03 -0.74 -0.83 116.55 120.99 1gql n ASP 348 Ca 0.15 0.97 0.00 0.00 0.52 0.00 0.00 54.79 56.43 1gql n ASP 348 Cb 0.59 -1.55 0.00 0.00 -0.72 0.00 0.00 41.12 39.44 1gql n ASP 348 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1gql n GLY 349 N 4.31 1.45 0.07 0.27 0.00 -1.23 -4.92 105.19 105.15 1gql n GLY 349 Ca 0.18 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.32 1gql n GLY 349 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1gql n LYS 350 N -2.00 0.23 -3.22 1.61 5.02 -0.01 -4.90 118.16 114.90 1gql n LYS 350 Ca 0.00 -0.14 -0.36 0.00 -2.02 0.00 0.00 58.31 55.79 1gql n LYS 350 Cb 0.00 -1.50 -0.06 0.00 -0.02 0.00 0.00 35.03 33.45 1gql n LYS 350 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 1gql s PHE 351 N -2.87 3.64 0.82 2.13 0.08 -1.26 -4.89 117.98 115.64 1gql s PHE 351 Ca 0.14 1.24 -0.11 0.00 0.12 0.00 0.00 56.93 58.32 1gql s PHE 351 Cb 0.18 -2.51 0.09 0.00 -0.57 0.00 0.00 43.02 40.21 1gql s PHE 351 CO 0.67 0.39 1.14 0.00 -0.10 0.00 0.00 175.22 177.32 1gql s ALA 352 N -1.48 1.87 0.26 5.36 0.00 -1.26 -4.92 121.76 121.59 1gql s ALA 352 Ca 0.40 0.57 0.37 0.00 0.00 0.00 0.00 51.96 53.30 1gql s ALA 352 Cb -0.16 -3.40 1.68 0.00 0.00 0.00 0.00 23.12 21.23 1gql s ALA 352 CO 0.20 -2.23 2.10 0.38 0.00 0.00 0.00 175.76 176.21 1gql h ASP 353 N -1.24 0.00 -0.52 0.00 3.04 -1.99 -1.60 116.42 114.12 1gql h ASP 353 Ca -0.44 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.35 1gql h ASP 353 Cb 1.26 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.55 1gql h ASP 353 CO 0.47 0.00 0.00 -0.46 -2.04 0.00 0.00 179.24 177.21 1gql n ASN 354 N -3.08 5.09 -4.59 4.15 6.94 -1.26 -4.80 115.26 117.71 1gql n ASN 354 Ca -0.00 -2.77 -0.34 0.00 -0.02 0.00 0.00 54.58 51.44 1gql n ASN 354 Cb 0.24 -0.65 -0.11 0.00 -2.36 0.00 0.00 39.78 36.90 1gql n ASN 354 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 1gql s VAL 355 N -2.47 4.19 -0.10 3.53 1.01 -0.60 -0.59 120.40 125.36 1gql s VAL 355 Ca 0.48 -0.27 0.02 0.00 0.00 0.00 0.00 61.98 62.21 1gql s VAL 355 Cb 0.36 -2.81 0.02 0.00 0.00 0.00 0.00 36.38 33.94 1gql s VAL 355 CO 0.15 0.53 -0.14 -0.63 0.00 0.00 0.00 175.10 175.01 1gql s ILE 356 N -0.12 1.40 -0.31 2.22 1.01 0.51 -4.35 121.20 121.57 1gql s ILE 356 Ca 0.04 -0.58 -0.29 0.00 0.00 0.00 0.00 60.65 59.82 1gql s ILE 356 Cb -0.13 -1.29 0.02 0.00 0.01 0.00 0.00 42.46 41.07 1gql s ILE 356 CO 0.02 0.42 1.06 -0.22 0.00 0.00 0.00 174.94 176.22 1gql s LEU 357 N 1.02 3.96 -0.35 2.97 2.96 0.02 -0.66 118.68 128.60 1gql s LEU 357 Ca -0.06 1.06 -0.16 0.00 -0.22 0.00 0.00 54.13 54.75 1gql s LEU 357 Cb -0.15 -3.52 -0.01 0.00 0.50 0.00 0.00 46.19 43.02 1gql s LEU 357 CO -0.02 -0.84 0.39 -1.58 -1.32 0.00 0.00 176.35 172.98 1gql s GLN 358 N 3.57 3.53 -0.13 1.98 0.74 0.29 -1.10 119.66 128.54 1gql s GLN 358 Ca 0.45 -0.41 0.02 0.00 0.05 0.00 0.00 55.36 55.47 1gql s GLN 358 Cb -0.13 -3.82 0.01 0.00 1.10 0.00 0.00 33.01 30.17 1gql s GLN 358 CO 0.14 -0.57 -0.21 0.42 -0.55 0.00 0.00 175.29 174.52 1gql s ILE 359 N 2.08 2.15 0.85 -2.34 1.01 -0.43 -0.59 121.20 123.93 1gql s ILE 359 Ca 0.13 -0.96 -0.12 0.00 0.00 0.00 0.00 60.65 59.70 1gql s ILE 359 Cb -0.16 -1.86 0.11 0.00 0.01 0.00 0.00 42.46 40.56 1gql s ILE 359 CO 0.12 0.55 1.18 -0.54 0.00 0.00 0.00 174.94 176.24 1gql s LYS 360 N 0.71 1.40 0.37 2.79 1.02 -1.26 -0.38 119.74 124.40 1gql s LYS 360 Ca -0.09 1.65 0.09 0.00 0.02 0.00 0.00 55.97 57.64 1gql s LYS 360 Cb -0.16 -1.76 0.82 0.00 -0.52 0.00 0.00 37.83 36.21 1gql s LYS 360 CO 0.01 -2.37 1.91 -2.95 -0.92 0.00 0.00 175.35 171.02 1gql h ASN 361 N -1.30 0.62 -2.61 2.83 -1.07 -1.85 -3.42 115.58 108.78 1gql h ASN 361 Ca -0.45 0.02 -0.53 0.00 0.07 0.00 0.00 56.30 55.41 1gql h ASN 361 Cb 1.28 -0.10 -0.14 0.00 -2.07 0.00 0.00 38.32 37.29 1gql h ASN 361 CO 0.44 0.35 -0.66 -0.83 0.07 0.00 0.00 177.43 176.80 1gql s GLY 362 N -3.65 2.02 0.00 9.14 0.00 -1.26 -0.92 107.32 112.65 1gql s GLY 362 Ca -0.10 -2.01 0.30 0.00 0.00 0.00 0.00 44.72 42.91 1gql s GLY 362 CO 0.78 -1.91 2.02 -1.55 0.00 0.00 0.00 173.10 172.44 1gql n PRO 363 N -0.69 0.32 0.00 2.90 -0.04 -1.26 -4.57 135.00 131.66 1gql n PRO 363 Ca -0.05 -0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.41 1gql n PRO 363 Cb 0.64 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.60 1gql n PRO 363 CO 0.00 0.00 0.00 -0.89 -0.04 0.00 0.00 175.50 174.57 1gql n ILE 364 N -1.34 0.00 -2.69 0.52 2.08 -1.26 -4.69 119.36 111.97 1gql n ILE 364 Ca 0.12 0.00 -0.05 0.00 0.56 0.00 0.00 62.75 63.38 1gql n ILE 364 Cb 0.27 -0.44 0.06 0.00 -0.75 0.00 0.00 39.64 38.78 1gql n ILE 364 CO 0.00 0.00 0.00 -0.67 0.56 0.00 0.00 176.55 176.44 1gql n ASP 365 N 0.00 -1.88 -2.16 4.38 2.03 -1.26 -5.01 116.55 112.66 1gql n ASP 365 Ca 0.00 -2.20 -0.16 0.00 0.52 0.00 0.00 54.79 52.95 1gql n ASP 365 Cb 0.00 1.09 -0.02 0.00 -0.72 0.00 0.00 41.12 41.46 1gql n ASP 365 CO 0.00 0.00 0.00 0.49 -1.92 0.00 0.00 177.20 175.77 1gql n PHE 366 N 1.72 -0.98 -1.49 -0.67 3.72 -1.26 -4.94 117.46 113.56 1gql n PHE 366 Ca 0.05 0.00 -0.32 0.00 -0.05 0.00 0.00 57.45 57.13 1gql n PHE 366 Cb 0.67 -3.15 0.07 0.00 -0.94 0.00 0.00 39.48 36.14 1gql n PHE 366 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 176.76 176.06 1gql s GLN 367 N -4.57 2.47 0.45 -1.08 -1.52 -1.26 -4.78 119.66 109.37 1gql s GLN 367 Ca 0.00 1.31 0.23 0.00 -1.95 0.00 0.00 55.36 54.95 1gql s GLN 367 Cb 0.00 -1.91 1.23 0.00 -0.22 0.00 0.00 33.01 32.10 1gql s GLN 367 CO 0.00 -1.49 1.84 -1.35 -0.25 0.00 0.00 175.29 174.04 1gql h PRO 368 N -0.57 0.26 -3.47 2.91 0.11 -1.92 -3.35 132.00 125.98 1gql h PRO 368 Ca -0.45 -0.02 -0.29 0.00 0.11 0.00 0.00 66.00 65.35 1gql h PRO 368 Cb 1.24 -0.06 -0.34 0.00 0.11 0.00 0.00 31.00 31.95 1gql h PRO 368 CO 0.52 0.17 -0.71 0.50 -0.21 0.00 0.00 178.00 178.28 1gql s ARG 369 N -5.29 -0.02 0.06 1.05 3.52 -1.26 -4.88 118.95 112.12 1gql s ARG 369 Ca -0.07 0.23 0.04 0.00 -0.13 0.00 0.00 55.73 55.80 1gql s ARG 369 Cb 0.23 -0.25 -0.03 0.00 -1.56 0.00 0.00 34.95 33.35 1gql s ARG 369 CO 0.79 -0.18 -0.12 -1.21 -0.81 0.00 0.00 175.30 173.77 1gql s GLU 370 N 1.14 0.76 0.83 5.12 2.02 -1.26 -4.97 118.70 122.34 1gql s GLU 370 Ca -0.08 -0.84 -0.11 0.00 0.02 0.00 0.00 54.97 53.96 1gql s GLU 370 Cb -0.13 -0.71 0.09 0.00 0.10 0.00 0.00 34.13 33.49 1gql s GLU 370 CO -0.04 0.16 1.09 -1.25 0.02 0.00 0.00 175.26 175.25 1gql s PRO 371 N -1.53 1.80 0.49 0.39 0.04 -1.26 -4.85 135.00 130.08 1gql s PRO 371 Ca -0.03 1.08 -0.23 0.00 0.04 0.00 0.00 61.00 61.86 1gql s PRO 371 Cb -0.09 -1.85 -0.07 0.00 0.04 0.00 0.00 34.50 32.53 1gql s PRO 371 CO 0.02 -1.94 1.26 -0.59 0.04 0.00 0.00 177.00 175.79 1gql s PHE 372 N -2.89 2.64 0.06 0.56 -0.12 -1.26 -4.15 117.98 112.81 1gql s PHE 372 Ca 0.62 1.46 -0.30 0.00 -0.05 0.00 0.00 56.93 58.65 1gql s PHE 372 Cb -0.18 -3.58 -0.08 0.00 -0.63 0.00 0.00 43.02 38.55 1gql s PHE 372 CO 0.57 -2.12 1.74 -1.12 -0.05 0.00 0.00 175.22 174.24 1gql s SER 373 N -1.12 6.55 0.54 1.98 0.01 -0.10 -4.72 113.70 116.85 1gql s SER 373 Ca 0.66 2.53 0.23 0.00 1.31 0.00 0.00 55.95 60.68 1gql s SER 373 Cb -0.34 -2.55 1.51 0.00 0.21 0.00 0.00 66.02 64.84 1gql s SER 373 CO 0.42 -0.95 2.17 0.00 0.41 0.00 0.00 173.24 175.29 1gql h ALA 374 N 8.96 1.67 -0.90 1.44 0.00 -1.91 -1.62 119.26 126.92 1gql h ALA 374 Ca -0.44 -0.03 0.18 0.00 0.00 0.00 0.00 54.91 54.62 1gql h ALA 374 Cb 1.21 -0.01 -0.07 0.00 0.00 0.00 0.00 17.79 18.92 1gql h ALA 374 CO 0.94 0.04 0.58 -0.07 0.00 0.00 0.00 179.25 180.75 1gql h LEU 375 N 0.00 0.51 -1.46 0.00 3.38 -1.89 -1.82 115.31 114.02 1gql h LEU 375 Ca -0.00 0.05 -0.02 0.00 0.09 0.00 0.00 57.88 58.00 1gql h LEU 375 Cb 0.07 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 40.75 1gql h LEU 375 CO 0.00 0.22 0.13 -0.26 0.09 0.00 0.00 178.44 178.62 1gql h PHE 376 N 0.52 0.48 -0.00 1.13 0.04 -1.67 -1.71 116.94 115.73 1gql h PHE 376 Ca 0.47 -0.02 0.00 0.00 2.80 0.00 0.00 57.97 61.22 1gql h PHE 376 Cb 1.00 -0.15 0.00 0.00 2.20 0.00 0.00 35.95 39.00 1gql h PHE 376 CO -0.00 0.39 -0.50 0.00 -0.60 0.00 0.00 178.31 177.60 1gql n ALA 377 N -2.48 3.59 -0.09 2.45 0.00 -0.73 -4.51 120.51 118.74 1gql n ALA 377 Ca 0.02 -0.42 -0.12 0.00 0.00 0.00 0.00 53.44 52.92 1gql n ALA 377 Cb 0.15 -1.05 -0.10 0.00 0.00 0.00 0.00 19.45 18.45 1gql n ALA 377 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1gql n GLY 378 N 1.45 -0.42 3.56 0.00 0.00 -0.84 -4.78 105.19 104.15 1gql n GLY 378 Ca 0.08 -0.17 -0.42 0.00 0.00 0.00 0.00 46.02 45.51 1gql n GLY 378 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1gql s MET 379 N -2.38 3.35 0.00 1.61 -1.94 -0.70 -4.84 119.30 114.40 1gql s MET 379 Ca -0.20 -0.05 0.19 0.00 -1.71 0.00 0.00 55.69 53.92 1gql s MET 379 Cb 0.06 -4.09 0.07 0.00 2.01 0.00 0.00 34.83 32.87 1gql s MET 379 CO 0.50 -1.85 1.02 -1.13 -0.01 0.00 0.00 175.02 173.55 1gql n SER 380 N 8.68 2.16 -0.38 3.03 3.41 -1.26 -4.45 113.62 124.81 1gql n SER 380 Ca 0.05 -1.58 0.04 0.00 -0.26 0.00 0.00 58.87 57.13 1gql n SER 380 Cb 0.49 0.26 0.06 0.00 -0.26 0.00 0.00 64.21 64.76 1gql n SER 380 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1gql n ARG 381 N 0.44 0.55 -4.08 4.33 1.74 -1.26 -4.92 116.66 113.46 1gql n ARG 381 Ca 0.09 -1.72 -0.15 0.00 -0.77 0.00 0.00 57.85 55.30 1gql n ARG 381 Cb 0.43 -0.90 -0.14 0.00 -1.02 0.00 0.00 32.46 30.82 1gql n ARG 381 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 1gql s THR 382 N -1.22 0.30 0.26 0.55 2.01 -1.26 -3.52 115.64 112.77 1gql s THR 382 Ca 0.15 -0.15 -0.30 0.00 0.31 0.00 0.00 61.69 61.70 1gql s THR 382 Cb 0.14 -0.27 -0.10 0.00 0.01 0.00 0.00 72.50 72.28 1gql s THR 382 CO 0.00 0.09 1.41 0.20 -0.69 0.00 0.00 174.62 175.64 1gql s ASN 383 N -0.01 6.68 0.12 3.53 0.01 -1.26 -4.95 114.94 119.06 1gql s ASN 383 Ca 0.01 2.66 0.06 0.00 -0.71 0.00 0.00 52.86 54.88 1gql s ASN 383 Cb -0.02 -2.63 -0.04 0.00 0.41 0.00 0.00 41.25 38.97 1gql s ASN 383 CO -0.00 -0.67 -0.15 -0.04 -1.51 0.00 0.00 177.10 174.73 1gql s MET 384 N -0.61 1.06 0.03 -0.60 -1.94 -1.26 -0.80 119.30 115.18 1gql s MET 384 Ca 0.57 -1.24 -0.05 0.00 -1.71 0.00 0.00 55.69 53.26 1gql s MET 384 Cb -0.41 -1.00 -0.01 0.00 2.01 0.00 0.00 34.83 35.42 1gql s MET 384 CO 0.45 0.20 0.09 0.00 -0.01 0.00 0.00 175.02 175.75 1gql s MET 385 N -2.58 0.54 0.23 2.03 0.23 -0.26 -4.01 119.30 115.48 1gql s MET 385 Ca 0.09 -0.69 -0.18 0.00 -1.03 0.00 0.00 55.69 53.89 1gql s MET 385 Cb -0.06 0.21 -0.08 0.00 -1.53 0.00 0.00 34.83 33.38 1gql s MET 385 CO 0.04 -0.13 0.69 1.41 -2.03 0.00 0.00 175.02 175.00 1gql s MET 386 N -2.31 4.15 -0.19 3.16 1.75 -0.92 -1.31 119.30 123.62 1gql s MET 386 Ca -0.08 0.75 0.01 0.00 -1.25 0.00 0.00 55.69 55.12 1gql s MET 386 Cb -0.03 -2.80 0.04 0.00 2.84 0.00 0.00 34.83 34.87 1gql s MET 386 CO -0.03 0.37 -0.11 -2.00 -0.65 0.00 0.00 175.02 172.59 1gql s GLU 387 N -2.17 2.09 0.15 4.11 2.12 0.49 -0.08 118.70 125.41 1gql s GLU 387 Ca 0.44 -0.79 0.06 0.00 0.36 0.00 0.00 54.97 55.04 1gql s GLU 387 Cb -0.15 -2.36 -0.04 0.00 0.26 0.00 0.00 34.13 31.84 1gql s GLU 387 CO 0.20 -0.39 0.04 -0.06 -0.54 0.00 0.00 175.26 174.51 1gql s PHE 388 N 1.41 2.96 -0.20 5.30 2.99 -0.21 -2.21 117.98 128.02 1gql s PHE 388 Ca -0.00 -0.07 -0.09 0.00 0.00 0.00 0.00 56.93 56.77 1gql s PHE 388 Cb -0.16 -1.46 -0.04 0.00 0.00 0.00 0.00 43.02 41.36 1gql s PHE 388 CO -0.09 0.51 0.10 -1.14 -0.00 0.00 0.00 175.22 174.60 1gql s GLN 389 N -2.81 4.01 -0.23 0.44 0.74 -1.26 -0.60 119.66 119.95 1gql s GLN 389 Ca 0.28 -0.32 -0.13 0.00 0.05 0.00 0.00 55.36 55.25 1gql s GLN 389 Cb -0.10 -3.33 -0.10 0.00 1.10 0.00 0.00 33.01 30.58 1gql s GLN 389 CO 0.20 0.19 -0.31 -0.89 -0.55 0.00 0.00 175.29 173.93 1gql n ILE 390 N 3.81 1.35 -1.65 -2.34 -0.00 -0.11 -4.89 119.36 115.52 1gql n ILE 390 Ca -0.16 -0.28 -0.43 0.00 -0.00 0.00 0.00 62.75 61.88 1gql n ILE 390 Cb 0.52 -1.88 -0.00 0.00 -0.00 0.00 0.00 39.64 38.28 1gql n ILE 390 CO 0.00 0.00 0.00 1.07 -0.00 0.00 0.00 176.55 177.62 1gql n THR 391 N -4.12 2.14 -2.16 1.39 5.66 -0.65 -4.83 114.28 111.73 1gql n THR 391 Ca -0.44 -0.50 -0.40 0.00 -3.05 0.00 0.00 64.05 59.66 1gql n THR 391 Cb 0.79 -1.32 0.00 0.00 -1.55 0.00 0.00 70.33 68.25 1gql n THR 391 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1gql n GLN 392 N 0.46 4.78 -0.35 1.09 6.02 -1.26 -4.64 117.38 123.48 1gql n GLN 392 Ca 0.07 -3.75 0.03 0.00 -0.01 0.00 0.00 57.00 53.34 1gql n GLN 392 Cb 0.36 -2.60 0.18 0.00 1.02 0.00 0.00 30.24 29.20 1gql n GLN 392 CO 0.00 0.00 0.00 1.49 -1.01 0.00 0.00 177.06 177.54 1gql h GLU 393 N 4.54 1.04 -0.11 -1.09 4.81 -1.88 0.17 114.58 122.06 1gql h GLU 393 Ca 0.66 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.82 1gql h GLU 393 Cb 0.31 -0.24 0.00 0.00 0.63 0.00 0.00 28.75 29.46 1gql h GLU 393 CO 1.41 0.69 0.00 0.66 -0.73 0.00 0.00 179.01 181.04 1gql n TYR 394 N -4.57 0.15 -0.68 0.92 4.01 -1.26 -4.56 117.16 111.17 1gql n TYR 394 Ca 0.16 -0.24 0.05 0.00 -0.16 0.00 0.00 57.90 57.71 1gql n TYR 394 Cb 0.23 -0.02 0.07 0.00 -0.31 0.00 0.00 39.34 39.31 1gql n TYR 394 CO 0.00 0.00 0.00 1.19 -0.46 0.00 0.00 176.86 177.59 1gql n PHE 395 N 0.29 0.00 0.00 -0.72 3.72 -1.12 -4.78 117.46 114.85 1gql n PHE 395 Ca 0.06 -0.73 0.00 0.00 -0.05 0.00 0.00 57.45 56.73 1gql n PHE 395 Cb 0.27 -0.10 0.00 0.00 -0.94 0.00 0.00 39.48 38.71 1gql n PHE 395 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1gql n GLY 396 N -0.96 1.66 7.00 1.37 0.00 -1.08 -4.58 105.19 108.60 1gql n GLY 396 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.10 1gql n GLY 396 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1gql n PHE 397 N -1.06 0.00 -0.41 1.61 3.01 0.03 -2.04 117.46 118.60 1gql n PHE 397 Ca 0.00 0.00 0.09 0.00 1.01 0.00 0.00 57.45 58.55 1gql n PHE 397 Cb 0.00 0.00 0.27 0.00 -0.01 0.00 0.00 39.48 39.74 1gql n PHE 397 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1gql n ALA 398 N 11.75 2.52 0.24 4.37 0.00 -1.26 -4.47 120.51 133.66 1gql n ALA 398 Ca 0.00 -1.39 0.05 0.00 0.00 0.00 0.00 53.44 52.10 1gql n ALA 398 Cb 0.00 -0.78 -0.06 0.00 0.00 0.00 0.00 19.45 18.61 1gql n ALA 398 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1gql n THR 399 N 1.04 0.00 -3.99 0.00 -2.24 -0.87 -3.76 114.28 104.46 1gql n THR 399 Ca 0.21 -0.25 -0.36 0.00 -2.27 0.00 0.00 64.05 61.37 1gql n THR 399 Cb 0.64 0.67 -0.07 0.00 -2.10 0.00 0.00 70.33 69.47 1gql n THR 399 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 1gql s HIS 400 N -2.26 3.50 -0.32 4.78 3.76 -1.10 -4.09 115.29 119.56 1gql s HIS 400 Ca 0.00 0.45 -0.24 0.00 -0.15 0.00 0.00 55.06 55.12 1gql s HIS 400 Cb 0.07 -1.90 0.01 0.00 1.11 0.00 0.00 32.58 31.86 1gql s HIS 400 CO 0.40 0.68 0.83 -1.17 -0.85 0.00 0.00 174.74 174.63 1gql s LEU 401 N -1.06 4.07 -0.48 0.89 0.20 -1.26 -4.89 118.68 116.14 1gql s LEU 401 Ca 0.15 0.65 0.06 0.00 0.69 0.00 0.00 54.13 55.68 1gql s LEU 401 Cb -0.12 -3.14 0.18 0.00 -0.43 0.00 0.00 46.19 42.69 1gql s LEU 401 CO 0.05 -0.69 0.58 0.00 -0.29 0.00 0.00 176.35 176.00 1gql s ALA 402 N 3.11 -0.81 0.13 5.97 0.00 -1.26 -4.76 121.76 124.13 1gql s ALA 402 Ca 0.34 -1.17 -0.31 0.00 0.00 0.00 0.00 51.96 50.82 1gql s ALA 402 Cb -0.14 -2.30 -0.10 0.00 0.00 0.00 0.00 23.12 20.58 1gql s ALA 402 CO 0.14 -2.14 1.77 -0.47 0.00 0.00 0.00 175.76 175.06 1gql s TYR 403 N 0.58 2.36 -1.88 0.00 5.04 -1.26 -4.86 117.35 117.33 1gql s TYR 403 Ca 0.31 0.13 0.25 0.00 -2.44 0.00 0.00 57.07 55.32 1gql s TYR 403 Cb 0.01 -4.12 0.48 0.00 0.35 0.00 0.00 41.96 38.69 1gql s TYR 403 CO -0.11 -4.52 1.39 1.04 -1.34 0.00 0.00 175.55 172.02 1gql n GLN 404 N 5.32 1.00 -0.30 4.97 1.13 -1.26 -4.03 117.38 124.21 1gql n GLN 404 Ca 0.17 -0.69 0.07 0.00 -1.94 0.00 0.00 57.00 54.60 1gql n GLN 404 Cb 0.38 -1.49 0.17 0.00 0.11 0.00 0.00 30.24 29.42 1gql n GLN 404 CO 0.00 0.00 0.00 0.78 -1.44 0.00 0.00 177.06 176.40 1gql h GLY 405 N 4.90 0.86 1.80 1.08 0.00 -1.87 0.28 103.07 110.12 1gql h GLY 405 Ca 0.00 0.19 -0.05 0.00 0.00 0.00 0.00 47.33 47.47 1gql h GLY 405 CO 0.00 -0.36 -0.13 -2.55 0.00 0.00 0.00 176.54 173.50 1gql h PRO 406 N 0.04 0.25 -0.23 4.80 0.11 -1.91 0.72 132.00 135.78 1gql h PRO 406 Ca 0.46 -0.06 -0.04 0.00 0.11 0.00 0.00 66.00 66.47 1gql h PRO 406 Cb 0.82 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 31.89 1gql h PRO 406 CO -0.82 0.38 -0.03 1.25 -0.21 0.00 0.00 178.00 178.58 1gql h LEU 407 N 0.23 0.42 -0.31 2.35 6.46 -1.27 -1.26 115.31 121.93 1gql h LEU 407 Ca 0.05 -0.34 -0.03 0.00 -0.12 0.00 0.00 57.88 57.44 1gql h LEU 407 Cb 0.38 -0.11 -0.01 0.00 -0.73 0.00 0.00 40.66 40.18 1gql h LEU 407 CO 0.02 0.66 0.09 -0.26 -0.62 0.00 0.00 178.44 178.34 1gql h PHE 408 N 0.17 0.51 -0.53 1.25 0.04 -1.00 -1.85 116.94 115.52 1gql h PHE 408 Ca 0.06 -0.05 -0.02 0.00 2.80 0.00 0.00 57.97 60.76 1gql h PHE 408 Cb 0.47 -0.15 -0.02 0.00 2.20 0.00 0.00 35.95 38.45 1gql h PHE 408 CO 0.04 0.52 0.26 1.49 -0.60 0.00 0.00 178.31 180.02 1gql h GLU 409 N 0.35 0.76 -0.32 1.51 4.81 -0.88 -0.26 114.58 120.55 1gql h GLU 409 Ca 0.10 -0.11 0.05 0.00 -0.13 0.00 0.00 59.36 59.27 1gql h GLU 409 Cb 0.26 -0.14 -0.05 0.00 0.63 0.00 0.00 28.75 29.45 1gql h GLU 409 CO -0.00 0.63 0.02 1.49 -0.73 0.00 0.00 179.01 180.42 1gql h GLU 410 N 0.71 0.12 0.58 1.92 4.81 -1.11 -0.24 114.58 121.37 1gql h GLU 410 Ca 0.18 -0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.38 1gql h GLU 410 Cb 0.12 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.47 1gql h GLU 410 CO -0.02 0.08 -0.31 0.77 -0.73 0.00 0.00 179.01 178.79 1gql h SER 411 N 0.12 -0.75 -0.10 1.04 0.02 -1.08 -2.76 113.55 110.05 1gql h SER 411 Ca 0.15 0.03 -0.03 0.00 -0.84 0.00 0.00 61.79 61.11 1gql h SER 411 Cb 0.20 0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.93 1gql h SER 411 CO -0.24 -0.51 0.00 -0.07 -1.14 0.00 0.00 176.83 174.87 1gql h LEU 412 N -0.82 0.25 -1.36 5.07 3.38 -0.60 -1.86 115.31 119.36 1gql h LEU 412 Ca -0.08 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.87 1gql h LEU 412 Cb 0.65 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.33 1gql h LEU 412 CO 0.11 0.30 0.00 0.29 0.09 0.00 0.00 178.44 179.22 1gql n LYS 413 N -4.38 1.91 -2.10 1.13 5.02 -0.14 -0.73 118.16 118.88 1gql n LYS 413 Ca -0.00 -1.35 -0.42 0.00 -2.02 0.00 0.00 58.31 54.52 1gql n LYS 413 Cb 0.18 -1.45 -0.03 0.00 -0.02 0.00 0.00 35.03 33.71 1gql n LYS 413 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1gql s THR 414 N -1.83 3.31 -0.11 -0.18 2.01 -0.70 -4.82 115.64 113.32 1gql s THR 414 Ca 0.34 0.82 -0.30 0.00 0.31 0.00 0.00 61.69 62.86 1gql s THR 414 Cb 0.20 -3.52 -0.01 0.00 0.01 0.00 0.00 72.50 69.17 1gql s THR 414 CO 0.30 0.02 1.04 -0.70 -0.69 0.00 0.00 174.62 174.59 1gql s GLU 415 N 2.02 4.40 -0.02 4.92 2.56 -1.26 -1.73 118.70 129.59 1gql s GLU 415 Ca 0.67 1.43 0.22 0.00 0.00 0.00 0.00 54.97 57.29 1gql s GLU 415 Cb -0.36 -3.55 -0.30 0.00 2.00 0.00 0.00 34.13 31.91 1gql s GLU 415 CO 0.30 -0.36 0.61 0.25 -0.56 0.00 0.00 175.26 175.49 1gql n THR 416 N 4.62 0.00 -1.72 -1.70 -2.24 -0.42 -4.96 114.28 107.86 1gql n THR 416 Ca 0.09 -0.34 -0.21 0.00 -2.27 0.00 0.00 64.05 61.33 1gql n THR 416 Cb 0.48 0.32 -0.08 0.00 -2.10 0.00 0.00 70.33 68.95 1gql n THR 416 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 1gql n HIS 417 N -2.01 -0.15 -0.24 4.78 -0.00 -1.25 -4.56 115.22 111.77 1gql n HIS 417 Ca -0.01 0.00 0.04 0.00 -0.00 0.00 0.00 57.72 57.74 1gql n HIS 417 Cb 0.49 -3.55 0.16 0.00 -0.00 0.00 0.00 29.99 27.10 1gql n HIS 417 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1gql h ALA 418 N 0.16 0.98 -1.16 -1.41 0.00 -1.87 -2.57 119.26 113.40 1gql h ALA 418 Ca -0.44 0.10 -0.45 0.00 0.00 0.00 0.00 54.91 54.13 1gql h ALA 418 Cb 1.36 0.07 -0.41 0.00 0.00 0.00 0.00 17.79 18.81 1gql h ALA 418 CO 0.62 -0.19 -1.01 0.54 0.00 0.00 0.00 179.25 179.21 1gql n ARG 419 N -4.99 2.11 0.00 0.00 1.74 -1.26 -5.03 116.66 109.22 1gql n ARG 419 Ca 0.13 -3.77 0.00 0.00 -0.77 0.00 0.00 57.85 53.44 1gql n ARG 419 Cb 0.37 -1.67 0.00 0.00 -1.02 0.00 0.00 32.46 30.14 1gql n ARG 419 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1gql n GLY 420 N -0.26 -1.97 3.73 -0.13 0.00 -0.97 -4.84 105.19 100.75 1gql n GLY 420 Ca 0.21 -1.40 -0.37 0.00 0.00 0.00 0.00 46.02 44.46 1gql n GLY 420 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1gql s GLU 421 N 0.00 2.61 0.00 1.61 2.02 -1.26 -2.98 118.70 120.69 1gql s GLU 421 Ca 0.00 2.09 0.00 0.00 0.02 0.00 0.00 54.97 57.08 1gql s GLU 421 Cb 0.00 -1.88 0.00 0.00 0.10 0.00 0.00 34.13 32.35 1gql s GLU 421 CO 0.00 -1.56 0.00 0.41 0.02 0.00 0.00 175.26 174.13 1gql n GLY 422 N 0.88 0.76 2.51 -1.39 0.00 -1.26 -4.96 105.19 101.73 1gql n GLY 422 Ca 0.15 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.83 1gql n GLY 422 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1gql n SER 423 N 0.00 7.35 -4.78 1.61 7.64 -1.16 -4.80 113.62 119.49 1gql n SER 423 Ca 0.00 -3.23 -0.31 0.00 1.01 0.00 0.00 58.87 56.33 1gql n SER 423 Cb 0.00 -1.28 0.08 0.00 -1.01 0.00 0.00 64.21 61.99 1gql n SER 423 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 1gql s THR 424 N -1.98 3.44 0.21 0.44 -4.23 -1.26 -1.30 115.64 110.96 1gql s THR 424 Ca 0.55 0.50 -0.10 0.00 -1.18 0.00 0.00 61.69 61.46 1gql s THR 424 Cb 0.28 -3.03 0.14 0.00 1.34 0.00 0.00 72.50 71.22 1gql s THR 424 CO -0.16 -0.58 1.81 0.40 -0.54 0.00 0.00 174.62 175.55 1gql h ILE 425 N -0.86 0.98 -0.40 2.99 1.08 -1.34 0.69 117.51 120.65 1gql h ILE 425 Ca -0.44 -0.23 0.03 0.00 -0.39 0.00 0.00 64.86 63.82 1gql h ILE 425 Cb 1.23 0.24 -0.03 0.00 -3.07 0.00 0.00 36.82 35.18 1gql h ILE 425 CO 0.53 0.12 0.20 1.23 -0.69 0.00 0.00 178.15 179.55 1gql h GLY 426 N 0.68 0.54 1.71 5.37 0.00 -1.19 0.60 103.07 110.78 1gql h GLY 426 Ca 0.29 -0.15 -0.07 0.00 0.00 0.00 0.00 47.33 47.40 1gql h GLY 426 CO -0.17 0.11 -0.19 3.43 0.00 0.00 0.00 176.54 179.71 1gql h ASN 427 N 0.42 0.34 0.09 0.19 2.35 -1.63 -1.03 115.58 116.30 1gql h ASN 427 Ca 0.17 -0.09 -0.00 0.00 -0.55 0.00 0.00 56.30 55.82 1gql h ASN 427 Cb 0.06 -0.09 0.00 0.00 0.05 0.00 0.00 38.32 38.35 1gql h ASN 427 CO -0.11 0.55 -0.04 0.40 -1.65 0.00 0.00 177.43 176.57 1gql h ILE 428 N 0.32 0.99 -0.89 2.81 2.04 -0.29 -1.99 117.51 120.49 1gql h ILE 428 Ca 0.06 -0.28 0.07 0.00 1.00 0.00 0.00 64.86 65.71 1gql h ILE 428 Cb 0.52 1.17 -0.06 0.00 -0.74 0.00 0.00 36.82 37.71 1gql h ILE 428 CO 0.03 0.07 0.58 -0.07 0.00 0.00 0.00 178.15 178.76 1gql h LEU 429 N -0.25 0.89 -1.66 1.44 3.38 -0.60 -1.91 115.31 116.60 1gql h LEU 429 Ca -0.01 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 1gql h LEU 429 Cb 0.21 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 40.77 1gql h LEU 429 CO 0.02 0.57 -0.07 -0.08 0.09 0.00 0.00 178.44 178.97 1gql h GLU 430 N 1.01 0.00 0.00 1.13 4.81 -1.09 -3.40 114.58 117.04 1gql h GLU 430 Ca 0.39 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.62 1gql h GLU 430 Cb 0.21 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.59 1gql h GLU 430 CO -0.14 0.07 0.00 0.41 -0.73 0.00 0.00 179.01 178.61 1gql n GLY 431 N -0.20 0.85 0.20 1.92 0.00 -0.72 -4.96 105.19 102.27 1gql n GLY 431 Ca -0.00 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.10 1gql n GLY 431 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1gql h LYS 432 N 4.01 0.00 0.00 1.61 1.57 -1.57 -1.66 116.57 120.53 1gql h LYS 432 Ca 0.00 0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 58.69 1gql h LYS 432 Cb 0.00 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.30 1gql h LYS 432 CO 0.00 0.27 -0.68 0.28 -0.57 0.00 0.00 179.45 178.76 1gql h VAL 433 N 0.00 0.60 -0.01 0.50 2.07 -1.82 -3.41 116.25 114.18 1gql h VAL 433 Ca -0.00 -1.65 0.00 0.00 0.82 0.00 0.00 66.70 65.87 1gql h VAL 433 Cb 0.97 1.33 0.00 0.00 -1.52 0.00 0.00 31.29 32.07 1gql h VAL 433 CO 0.04 0.20 -0.61 0.49 0.02 0.00 0.00 177.57 177.71 1gql n PHE 434 N -4.56 0.00 -3.05 1.57 3.72 -1.26 -5.01 117.46 108.86 1gql n PHE 434 Ca -0.17 0.00 -0.01 0.00 -0.05 0.00 0.00 57.45 57.22 1gql n PHE 434 Cb 0.43 -0.02 0.00 0.00 -0.94 0.00 0.00 39.48 38.95 1gql n PHE 434 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 1gql n LYS 435 N -0.53 -1.43 -4.19 -1.08 4.01 -0.62 -4.95 118.16 109.37 1gql n LYS 435 Ca 0.08 1.55 -0.27 0.00 -0.51 0.00 0.00 58.31 59.16 1gql n LYS 435 Cb 0.42 -5.70 -0.05 0.00 -0.51 0.00 0.00 35.03 29.19 1gql n LYS 435 CO 0.00 0.00 0.00 -0.08 -1.11 0.00 0.00 177.40 176.21 1gql s THR 436 N -2.96 1.77 -0.16 -0.18 -1.32 -1.25 -5.09 115.64 106.45 1gql s THR 436 Ca 0.03 -1.69 -0.23 0.00 -1.21 0.00 0.00 61.69 58.59 1gql s THR 436 Cb -0.01 -2.46 -0.23 0.00 -1.51 0.00 0.00 72.50 68.29 1gql s THR 436 CO 0.75 0.00 0.47 0.03 -2.21 0.00 0.00 174.62 173.67 1gql h ARG 437 N 1.14 0.05 -5.21 7.08 2.47 -1.95 -3.48 114.38 114.49 1gql h ARG 437 Ca -0.41 -0.08 -0.55 0.00 -1.26 0.00 0.00 59.98 57.68 1gql h ARG 437 Cb 1.29 0.03 -0.31 0.00 -1.65 0.00 0.00 29.97 29.33 1gql h ARG 437 CO 0.66 1.04 -0.83 -1.01 0.56 0.00 0.00 179.97 180.39 1gql s HIS 438 N -2.34 1.61 0.19 3.04 3.76 -1.26 -5.09 115.29 115.20 1gql s HIS 438 Ca -0.24 -0.46 0.05 0.00 -0.15 0.00 0.00 55.06 54.26 1gql s HIS 438 Cb 0.03 -1.09 -0.05 0.00 1.11 0.00 0.00 32.58 32.58 1gql s HIS 438 CO 0.66 -0.16 -0.07 0.95 -0.85 0.00 0.00 174.74 175.27 1gql s THR 439 N 0.06 1.21 0.00 1.30 -4.23 -1.26 -4.18 115.64 108.54 1gql s THR 439 Ca -0.04 -2.07 0.00 0.00 -1.18 0.00 0.00 61.69 58.40 1gql s THR 439 Cb -0.11 -2.08 0.00 0.00 1.34 0.00 0.00 72.50 71.65 1gql s THR 439 CO 0.02 -0.55 0.00 0.61 -0.54 0.00 0.00 174.62 174.16 1gql n GLY 440 N -0.32 -0.24 3.26 3.99 0.00 -1.26 -1.04 105.19 109.59 1gql n GLY 440 Ca -0.08 -1.03 -0.13 0.00 0.00 0.00 0.00 46.02 44.78 1gql n GLY 440 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1gql s MET 441 N -2.00 0.42 0.02 1.61 1.75 0.05 -2.17 119.30 118.98 1gql s MET 441 Ca 0.00 0.57 0.07 0.00 -1.25 0.00 0.00 55.69 55.08 1gql s MET 441 Cb 0.00 0.16 -0.02 0.00 2.84 0.00 0.00 34.83 37.81 1gql s MET 441 CO 0.00 -0.07 -0.22 0.00 -0.65 0.00 0.00 175.02 174.07 1gql s ALA 442 N 0.44 1.88 -0.11 4.11 0.00 0.88 -1.10 121.76 127.86 1gql s ALA 442 Ca -0.02 -1.05 -0.00 0.00 0.00 0.00 0.00 51.96 50.89 1gql s ALA 442 Cb -0.04 -0.42 0.02 0.00 0.00 0.00 0.00 23.12 22.68 1gql s ALA 442 CO -0.02 0.45 -0.09 0.20 0.00 0.00 0.00 175.76 176.30 1gql s GLY 443 N -0.89 0.84 -0.71 0.00 0.00 -0.41 -1.04 107.32 105.11 1gql s GLY 443 Ca 0.09 -0.55 -0.24 0.00 0.00 0.00 0.00 44.72 44.02 1gql s GLY 443 CO 0.01 0.70 1.12 0.14 0.00 0.00 0.00 173.10 175.07 1gql s VAL 444 N 1.56 4.08 -0.14 1.40 1.01 0.23 -0.52 120.40 128.02 1gql s VAL 444 Ca 0.02 -0.10 0.11 0.00 0.00 0.00 0.00 61.98 62.01 1gql s VAL 444 Cb -0.13 -4.80 -0.23 0.00 0.00 0.00 0.00 36.38 31.22 1gql s VAL 444 CO -0.07 -1.64 0.29 2.30 0.00 0.00 0.00 175.10 175.98 1gql n ILE 445 N 6.13 1.53 -4.30 2.22 -5.35 -0.74 -0.94 119.36 117.91 1gql n ILE 445 Ca 0.01 -0.77 -0.31 0.00 -0.27 0.00 0.00 62.75 61.40 1gql n ILE 445 Cb 0.47 -0.96 -0.09 0.00 -1.74 0.00 0.00 39.64 37.32 1gql n ILE 445 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 1gql n ASN 446 N -3.02 0.60 -4.34 7.28 5.03 -1.24 -3.95 115.26 115.63 1gql n ASN 446 Ca -0.29 -1.25 -0.29 0.00 0.87 0.00 0.00 54.58 53.62 1gql n ASN 446 Cb 1.08 -1.73 0.18 0.00 -1.02 0.00 0.00 39.78 38.29 1gql n ASN 446 CO 0.00 0.00 0.00 -2.16 -1.83 0.00 0.00 177.26 173.27 1gql s PRO 447 N -7.30 0.26 0.00 3.52 0.04 -1.26 -4.30 135.00 125.97 1gql s PRO 447 Ca 0.07 0.03 0.00 0.00 0.04 0.00 0.00 61.00 61.14 1gql s PRO 447 Cb -0.04 -1.76 0.00 0.00 0.04 0.00 0.00 34.50 32.74 1gql s PRO 447 CO 0.99 -2.74 0.00 0.41 0.04 0.00 0.00 177.00 175.70 1gql n GLY 448 N -2.12 3.43 0.00 0.56 0.00 -0.38 -4.65 105.19 102.04 1gql n GLY 448 Ca 0.10 -1.00 0.11 0.00 0.00 0.00 0.00 46.02 45.24 1gql n GLY 448 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1gql n THR 449 N 0.00 0.35 -1.50 2.61 -2.24 0.02 -4.34 114.28 109.18 1gql n THR 449 Ca 0.00 0.09 -0.43 0.00 -2.27 0.00 0.00 64.05 61.44 1gql n THR 449 Cb 0.00 -0.70 0.00 0.00 -2.10 0.00 0.00 70.33 67.53 1gql n THR 449 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1gql n ASP 450 N -1.38 -0.20 -0.17 3.42 9.92 -0.70 -4.82 116.55 122.61 1gql n ASP 450 Ca 0.08 0.99 0.11 0.00 -0.53 0.00 0.00 54.79 55.45 1gql n ASP 450 Cb 0.22 -1.17 0.43 0.00 -0.64 0.00 0.00 41.12 39.96 1gql n ASP 450 CO 0.00 0.00 0.00 -0.09 0.13 0.00 0.00 177.20 177.24 1gql h ARG 451 N 1.12 0.56 -0.53 -1.24 9.65 -1.88 0.61 114.38 122.67 1gql h ARG 451 Ca -0.40 -0.03 0.00 0.00 -1.10 0.00 0.00 59.98 58.45 1gql h ARG 451 Cb 1.38 -0.13 0.00 0.00 -1.39 0.00 0.00 29.97 29.84 1gql h ARG 451 CO 0.54 0.37 0.00 0.27 2.80 0.00 0.00 179.97 183.95 1gql n ASN 452 N -4.49 2.87 0.00 -3.80 6.94 -1.25 -3.47 115.26 112.06 1gql n ASN 452 Ca 0.13 -2.09 0.00 0.00 -0.02 0.00 0.00 54.58 52.60 1gql n ASN 452 Cb 0.39 -0.37 0.00 0.00 -2.36 0.00 0.00 39.78 37.43 1gql n ASN 452 CO 0.00 0.00 0.00 0.79 -1.03 0.00 0.00 177.26 177.02 1gql n TRP 453 N 0.88 0.00 0.13 -2.53 7.02 0.20 -4.44 117.44 118.71 1gql n TRP 453 Ca 0.17 0.00 0.02 0.00 -1.02 0.00 0.00 57.50 56.66 1gql n TRP 453 Cb 0.48 0.00 0.01 0.00 -2.42 0.00 0.00 31.31 29.38 1gql n TRP 453 CO 0.00 0.00 0.00 0.25 -2.02 0.00 0.00 177.69 175.92 1gql n THR 454 N 0.00 0.00 0.00 -0.99 -2.24 -1.26 -1.24 114.28 108.54 1gql n THR 454 Ca 0.00 -0.49 0.00 0.00 -2.27 0.00 0.00 64.05 61.29 1gql n THR 454 Cb 0.00 1.06 0.00 0.00 -2.10 0.00 0.00 70.33 69.29 1gql n THR 454 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1gql n GLY 455 N 0.33 2.34 3.70 3.38 0.00 -1.26 -4.55 105.19 109.13 1gql n GLY 455 Ca 0.02 -0.12 -0.42 0.00 0.00 0.00 0.00 46.02 45.50 1gql n GLY 455 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1gql s HIS 456 N 0.00 3.54 0.34 1.61 5.65 -1.25 -4.95 115.29 120.23 1gql s HIS 456 Ca 0.00 1.56 0.10 0.00 0.25 0.00 0.00 55.06 56.97 1gql s HIS 456 Cb 0.00 -3.21 0.84 0.00 -1.18 0.00 0.00 32.58 29.03 1gql s HIS 456 CO 0.00 -0.38 1.80 -1.35 -0.65 0.00 0.00 174.74 174.16 1gql h PRO 457 N 6.96 0.64 0.00 2.88 0.11 -1.91 -2.03 132.00 138.66 1gql h PRO 457 Ca -0.37 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.70 1gql h PRO 457 Cb 1.19 -0.15 0.00 0.00 0.11 0.00 0.00 31.00 32.16 1gql h PRO 457 CO 0.80 0.43 0.00 0.74 -0.21 0.00 0.00 178.00 179.76 1gql h PHE 458 N 0.66 0.00 0.00 0.65 -1.00 -1.95 -1.99 116.94 113.32 1gql h PHE 458 Ca 0.54 0.00 -0.04 0.00 2.81 0.00 0.00 57.97 61.29 1gql h PHE 458 Cb 0.98 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 40.54 1gql h PHE 458 CO -0.00 0.00 -0.17 0.28 -1.61 0.00 0.00 178.31 176.81 1gql h VAL 459 N 0.00 0.98 -0.88 -0.55 2.07 -1.68 -1.85 116.25 114.35 1gql h VAL 459 Ca 0.00 -0.61 0.11 0.00 0.82 0.00 0.00 66.70 67.02 1gql h VAL 459 Cb 0.47 1.34 -0.06 0.00 -1.52 0.00 0.00 31.29 31.52 1gql h VAL 459 CO 0.00 0.17 0.57 1.56 0.02 0.00 0.00 177.57 179.88 1gql h GLN 460 N 0.00 0.78 -0.26 1.57 4.20 -1.50 -1.68 115.11 118.21 1gql h GLN 460 Ca -0.00 -0.05 -0.05 0.00 0.06 0.00 0.00 58.65 58.61 1gql h GLN 460 Cb 0.33 -0.18 -0.02 0.00 0.30 0.00 0.00 27.48 27.92 1gql h GLN 460 CO 0.02 0.52 -0.05 0.66 -0.67 0.00 0.00 178.83 179.31 1gql h SER 461 N 0.80 0.38 -0.15 1.46 4.64 -1.49 0.02 113.55 119.22 1gql h SER 461 Ca 0.42 -0.07 -0.09 0.00 -0.47 0.00 0.00 61.79 61.57 1gql h SER 461 Cb 0.50 -0.10 -0.00 0.00 -0.31 0.00 0.00 62.40 62.49 1gql h SER 461 CO -0.18 0.49 -0.25 0.28 -0.87 0.00 0.00 176.83 176.30 1gql h SER 462 N 0.39 0.48 -0.66 4.97 0.02 -1.34 -0.37 113.55 117.04 1gql h SER 462 Ca 0.08 -0.54 0.05 0.00 -0.84 0.00 0.00 61.79 60.55 1gql h SER 462 Cb 0.35 -0.14 -0.05 0.00 0.14 0.00 0.00 62.40 62.70 1gql h SER 462 CO 0.02 0.92 0.37 -0.25 -1.14 0.00 0.00 176.83 176.75 1gql h TRP 463 N 0.05 0.69 0.09 3.45 2.91 -1.16 -0.94 115.95 121.04 1gql h TRP 463 Ca 0.01 0.02 0.00 0.00 1.13 0.00 0.00 58.89 60.06 1gql h TRP 463 Cb 0.83 -0.21 -0.01 0.00 -0.51 0.00 0.00 29.16 29.26 1gql h TRP 463 CO 0.10 0.35 -0.08 -0.92 -1.03 0.00 0.00 178.44 176.85 1gql h TYR 464 N 0.70 -0.21 -0.58 2.65 3.20 -0.86 -1.82 116.97 120.05 1gql h TYR 464 Ca 0.29 0.00 -0.04 0.00 3.14 0.00 0.00 58.73 62.11 1gql h TYR 464 Cb 0.14 0.08 -0.02 0.00 1.54 0.00 0.00 36.73 38.47 1gql h TYR 464 CO -0.07 -0.13 0.19 0.00 -1.64 0.00 0.00 178.16 176.51 1gql h ALA 465 N 0.71 0.76 -0.18 1.82 0.00 -0.86 -1.79 119.26 119.73 1gql h ALA 465 Ca 0.00 -0.19 0.05 0.00 0.00 0.00 0.00 54.91 54.77 1gql h ALA 465 Cb 0.18 -0.23 -0.07 0.00 0.00 0.00 0.00 17.79 17.67 1gql h ALA 465 CO -0.02 0.42 -0.31 0.35 0.00 0.00 0.00 179.25 179.69 1gql h PHE 466 N 0.82 -0.84 -0.43 0.00 3.57 -0.98 0.10 116.94 119.18 1gql h PHE 466 Ca 0.19 0.04 -0.10 0.00 3.53 0.00 0.00 57.97 61.63 1gql h PHE 466 Cb 0.27 0.40 -0.02 0.00 2.79 0.00 0.00 35.95 39.38 1gql h PHE 466 CO 0.02 -0.38 -0.13 0.78 -2.23 0.00 0.00 178.31 176.37 1gql h GLY 467 N -0.35 0.84 0.97 2.40 0.00 -0.88 -0.05 103.07 106.00 1gql h GLY 467 Ca 0.11 -0.65 0.01 0.00 0.00 0.00 0.00 47.33 46.80 1gql h GLY 467 CO -0.38 0.59 0.25 3.21 0.00 0.00 0.00 176.54 180.22 1gql h ARG 468 N 0.70 0.49 0.00 4.80 2.47 -1.10 -2.47 114.38 119.28 1gql h ARG 468 Ca 0.12 -0.03 -0.10 0.00 -1.26 0.00 0.00 59.98 58.70 1gql h ARG 468 Cb 0.61 -0.11 -0.01 0.00 -1.65 0.00 0.00 29.97 28.80 1gql h ARG 468 CO 0.04 0.33 -0.48 0.52 0.56 0.00 0.00 179.97 180.93 1gql h MET 469 N 0.51 0.00 -0.10 0.04 2.86 -0.69 -0.52 114.93 117.02 1gql h MET 469 Ca 0.15 0.00 -0.06 0.00 -2.06 0.00 0.00 59.70 57.73 1gql h MET 469 Cb -0.04 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.61 1gql h MET 469 CO -0.05 0.48 -0.20 0.00 1.06 0.00 0.00 176.91 178.20 1gql h ALA 470 N 1.52 1.47 0.01 6.32 0.00 -0.79 -1.82 119.26 125.98 1gql h ALA 470 Ca -0.00 -0.24 -0.12 0.00 0.00 0.00 0.00 54.91 54.55 1gql h ALA 470 Cb 0.94 -0.07 0.01 0.00 0.00 0.00 0.00 17.79 18.67 1gql h ALA 470 CO 0.06 0.38 -0.46 2.35 0.00 0.00 0.00 179.25 181.58 1gql h TRP 471 N 0.16 0.44 -2.67 0.00 2.91 -0.97 -3.34 115.95 112.48 1gql h TRP 471 Ca 0.03 -0.25 -0.43 0.00 1.13 0.00 0.00 58.89 59.37 1gql h TRP 471 Cb 0.46 -0.05 -0.38 0.00 -0.51 0.00 0.00 29.16 28.68 1gql h TRP 471 CO 0.00 1.08 -0.71 0.34 -1.03 0.00 0.00 178.44 178.12 1gql s ASP 472 N -6.58 2.48 0.00 2.65 -1.08 -0.25 -0.33 116.67 113.57 1gql s ASP 472 Ca -0.15 -0.82 0.13 0.00 -0.52 0.00 0.00 52.55 51.19 1gql s ASP 472 Cb 0.02 -0.01 0.58 0.00 -1.46 0.00 0.00 42.92 42.05 1gql s ASP 472 CO 0.79 -0.39 1.39 0.00 0.52 0.00 0.00 175.17 177.48 1gql n HIS 473 N 5.28 0.00 1.17 -5.34 1.44 -0.70 -1.54 115.22 115.54 1gql n HIS 473 Ca -0.05 0.00 0.12 0.00 -2.01 0.00 0.00 57.72 55.78 1gql n HIS 473 Cb 0.46 -0.44 0.28 0.00 0.12 0.00 0.00 29.99 30.41 1gql n HIS 473 CO 0.00 0.00 0.00 1.04 -2.81 0.00 0.00 176.34 174.57 1gql n GLN 474 N -1.44 0.81 -1.90 -1.40 6.02 -1.26 -4.78 117.38 113.43 1gql n GLN 474 Ca 0.04 -0.53 -0.42 0.00 -0.01 0.00 0.00 57.00 56.08 1gql n GLN 474 Cb 0.14 -1.49 -0.02 0.00 1.02 0.00 0.00 30.24 29.88 1gql n GLN 474 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 1gql s ILE 475 N -2.55 2.44 0.54 5.09 1.01 -0.59 -4.98 121.20 122.16 1gql s ILE 475 Ca 0.22 0.35 -0.09 0.00 0.00 0.00 0.00 60.65 61.12 1gql s ILE 475 Cb 0.19 -3.22 -0.04 0.00 0.01 0.00 0.00 42.46 39.39 1gql s ILE 475 CO 0.56 0.05 0.91 -0.94 0.00 0.00 0.00 174.94 175.52 1gql s SER 476 N 0.68 6.29 0.29 3.58 1.04 -1.26 -4.89 113.70 119.42 1gql s SER 476 Ca 0.65 1.22 -0.03 0.00 0.48 0.00 0.00 55.95 58.27 1gql s SER 476 Cb -0.45 -2.38 0.41 0.00 0.10 0.00 0.00 66.02 63.70 1gql s SER 476 CO 0.40 -0.71 1.95 0.00 0.98 0.00 0.00 173.24 175.87 1gql h ALA 477 N 0.08 1.39 -0.18 5.32 0.00 -1.94 -1.76 119.26 122.17 1gql h ALA 477 Ca -0.46 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.39 1gql h ALA 477 Cb 1.20 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 18.63 1gql h ALA 477 CO 0.62 0.56 0.07 0.00 0.00 0.00 0.00 179.25 180.50 1gql h ALA 478 N 1.46 0.23 -0.30 0.00 0.00 -1.94 -0.95 119.26 117.76 1gql h ALA 478 Ca 0.33 -0.10 0.01 0.00 0.00 0.00 0.00 54.91 55.15 1gql h ALA 478 Cb -0.10 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 1gql h ALA 478 CO -0.08 -0.19 0.19 1.15 0.00 0.00 0.00 179.25 180.32 1gql h THR 479 N 0.14 1.06 -0.47 0.00 2.02 -1.88 -0.41 112.91 113.37 1gql h THR 479 Ca 0.06 -0.13 -0.06 0.00 0.77 0.00 0.00 66.41 67.04 1gql h THR 479 Cb 0.16 0.64 -0.02 0.00 -1.74 0.00 0.00 68.15 67.19 1gql h THR 479 CO -0.01 0.07 0.03 0.00 0.37 0.00 0.00 175.52 175.98 1gql h ALA 480 N 1.12 1.18 -0.55 6.16 0.00 -1.27 -1.88 119.26 124.03 1gql h ALA 480 Ca 0.11 -0.24 -0.11 0.00 0.00 0.00 0.00 54.91 54.67 1gql h ALA 480 Cb -0.03 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 1gql h ALA 480 CO -0.04 0.54 -0.10 0.00 0.00 0.00 0.00 179.25 179.65 1gql h ALA 481 N 1.32 0.78 -0.21 0.00 0.00 -0.88 -0.96 119.26 119.32 1gql h ALA 481 Ca 0.14 -0.35 -0.00 0.00 0.00 0.00 0.00 54.91 54.70 1gql h ALA 481 Cb 0.39 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 1gql h ALA 481 CO 0.01 0.67 0.12 0.22 0.00 0.00 0.00 179.25 180.27 1gql h ASP 482 N 0.91 0.25 0.05 0.00 3.58 -0.62 -0.10 116.42 120.50 1gql h ASP 482 Ca 0.14 -0.07 0.00 0.00 0.42 0.00 0.00 57.03 57.53 1gql h ASP 482 Cb 0.67 -0.06 -0.00 0.00 1.72 0.00 0.00 39.33 41.65 1gql h ASP 482 CO 0.05 0.24 -0.04 -0.33 -2.88 0.00 0.00 179.24 176.28 1gql h GLU 483 N 0.24 -0.10 -0.80 0.28 5.08 -1.26 -2.36 114.58 115.65 1gql h GLU 483 Ca 0.07 0.01 0.01 0.00 -1.00 0.00 0.00 59.36 58.45 1gql h GLU 483 Cb 0.04 0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.28 1gql h GLU 483 CO -0.01 -0.07 0.53 2.35 -1.00 0.00 0.00 179.01 180.81 1gql h TRP 484 N -0.11 1.02 -0.43 4.33 7.01 -0.97 -1.10 115.95 125.70 1gql h TRP 484 Ca 0.00 0.02 -0.04 0.00 2.11 0.00 0.00 58.89 60.98 1gql h TRP 484 Cb 0.10 -0.34 -0.02 0.00 -2.10 0.00 0.00 29.16 26.80 1gql h TRP 484 CO -0.09 0.65 0.11 -0.07 -2.79 0.00 0.00 178.44 176.25 1gql h LEU 485 N 1.09 0.65 -0.57 0.65 3.38 -0.90 0.49 115.31 120.10 1gql h LEU 485 Ca 0.29 -0.23 0.02 0.00 0.09 0.00 0.00 57.88 58.06 1gql h LEU 485 Cb -0.11 -0.17 -0.04 0.00 0.09 0.00 0.00 40.66 40.43 1gql h LEU 485 CO -0.06 0.71 0.36 0.03 0.09 0.00 0.00 178.44 179.56 1gql h ARG 486 N 0.56 0.69 -0.02 1.13 3.08 -1.11 0.10 114.38 118.82 1gql h ARG 486 Ca 0.14 -0.04 -0.17 0.00 0.07 0.00 0.00 59.98 59.97 1gql h ARG 486 Cb 0.31 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 30.19 1gql h ARG 486 CO 0.00 0.46 -0.77 0.52 -1.07 0.00 0.00 179.97 179.10 1gql h MET 487 N 0.71 0.17 0.02 0.04 2.86 -1.00 -3.33 114.93 114.40 1gql h MET 487 Ca 0.23 -0.16 -0.35 0.00 -2.06 0.00 0.00 59.70 57.36 1gql h MET 487 Cb -0.01 0.04 -0.05 0.00 0.06 0.00 0.00 31.60 31.64 1gql h MET 487 CO -0.09 0.86 -2.10 2.41 1.06 0.00 0.00 176.91 179.05 1gql n THR 488 N -3.72 1.55 0.06 2.22 -1.04 0.15 -4.31 114.28 109.19 1gql n THR 488 Ca -0.03 -0.75 0.00 0.00 -2.04 0.00 0.00 64.05 61.23 1gql n THR 488 Cb 0.74 -1.05 0.00 0.00 -1.82 0.00 0.00 70.33 68.20 1gql n THR 488 CO 0.00 0.00 0.00 0.49 -0.64 0.00 0.00 175.07 174.92 1gql n PHE 489 N -3.07 -0.72 -3.60 -1.42 3.72 0.27 -5.02 117.46 107.62 1gql n PHE 489 Ca -0.30 0.13 -0.09 0.00 -0.05 0.00 0.00 57.45 57.14 1gql n PHE 489 Cb 1.08 0.21 -0.06 0.00 -0.94 0.00 0.00 39.48 39.77 1gql n PHE 489 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1gql s SER 490 N -5.45 -0.34 0.00 4.37 0.15 -0.72 -4.87 113.70 106.85 1gql s SER 490 Ca 0.00 0.47 0.21 0.00 0.70 0.00 0.00 55.95 57.32 1gql s SER 490 Cb 0.00 0.41 0.53 0.00 -1.71 0.00 0.00 66.02 65.25 1gql s SER 490 CO 0.00 -0.25 1.44 0.59 1.20 0.00 0.00 173.24 176.22 1gql n ASN 491 N 1.12 2.86 -4.67 5.45 3.02 -1.26 -3.64 115.26 118.15 1gql n ASN 491 Ca -0.10 -1.93 -0.42 0.00 -0.03 0.00 0.00 54.58 52.10 1gql n ASN 491 Cb 0.57 -0.26 -0.03 0.00 -0.61 0.00 0.00 39.78 39.46 1gql n ASN 491 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 1gql s GLN 492 N -1.49 4.19 0.41 3.52 -1.52 -1.26 -4.90 119.66 118.62 1gql s GLN 492 Ca 0.37 2.17 0.12 0.00 -1.95 0.00 0.00 55.36 56.07 1gql s GLN 492 Cb 0.20 -3.91 0.95 0.00 -0.22 0.00 0.00 33.01 30.03 1gql s GLN 492 CO 0.28 -0.81 1.97 -1.00 -0.25 0.00 0.00 175.29 175.48 1gql h PRO 493 N 9.24 0.50 0.00 2.91 0.13 -1.99 -1.05 132.00 141.73 1gql h PRO 493 Ca -0.39 -0.03 -0.01 0.00 -0.87 0.00 0.00 66.00 64.70 1gql h PRO 493 Cb 1.18 -0.11 -0.00 0.00 0.13 0.00 0.00 31.00 32.19 1gql h PRO 493 CO 0.95 0.33 -0.06 0.00 -0.23 0.00 0.00 178.00 178.99 1gql h ALA 494 N 1.67 1.10 0.03 -0.56 0.00 -2.01 -2.47 119.26 117.01 1gql h ALA 494 Ca 0.30 -0.06 -0.21 0.00 0.00 0.00 0.00 54.91 54.94 1gql h ALA 494 Cb 0.49 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 1gql h ALA 494 CO -0.09 0.08 -1.12 0.35 0.00 0.00 0.00 179.25 178.47 1gql h PHE 495 N 0.00 0.10 -0.10 0.00 3.57 -1.63 -3.39 116.94 115.48 1gql h PHE 495 Ca -0.00 -0.07 0.02 0.00 3.53 0.00 0.00 57.97 61.45 1gql h PHE 495 Cb 0.35 -0.00 -0.02 0.00 2.79 0.00 0.00 35.95 39.06 1gql h PHE 495 CO 0.00 1.44 -0.04 0.82 -2.23 0.00 0.00 178.31 178.30 1gql h ILE 496 N -0.83 0.86 0.64 1.41 1.08 -1.08 -2.46 117.51 117.13 1gql h ILE 496 Ca -0.29 0.00 -0.02 0.00 -0.39 0.00 0.00 64.86 64.16 1gql h ILE 496 Cb 1.37 0.86 -0.01 0.00 -3.07 0.00 0.00 36.82 35.97 1gql h ILE 496 CO -0.12 0.00 -0.49 -0.08 -0.69 0.00 0.00 178.15 176.78 1gql h GLU 497 N -0.02 -1.05 -0.43 2.37 4.57 -1.67 0.15 114.58 118.49 1gql h GLU 497 Ca 0.05 0.07 -0.07 0.00 -1.18 0.00 0.00 59.36 58.23 1gql h GLU 497 Cb 0.10 0.24 -0.02 0.00 -0.16 0.00 0.00 28.75 28.91 1gql h GLU 497 CO -0.12 -0.70 -0.03 -1.00 -1.18 0.00 0.00 179.01 175.98 1gql h PRO 498 N -1.09 0.72 -0.21 0.92 0.13 -1.75 -2.21 132.00 128.52 1gql h PRO 498 Ca -0.08 -0.20 -0.15 0.00 -0.87 0.00 0.00 66.00 64.70 1gql h PRO 498 Cb 0.90 -0.08 -0.01 0.00 0.13 0.00 0.00 31.00 31.94 1gql h PRO 498 CO 0.02 0.76 -0.48 0.28 -0.23 0.00 0.00 178.00 178.36 1gql h VAL 499 N 0.67 1.31 -0.25 1.56 2.07 -1.33 -0.85 116.25 119.44 1gql h VAL 499 Ca 0.13 -1.68 -0.00 0.00 0.82 0.00 0.00 66.70 65.96 1gql h VAL 499 Cb 0.47 1.66 -0.01 0.00 -1.52 0.00 0.00 31.29 31.89 1gql h VAL 499 CO 0.02 0.53 0.15 0.50 0.02 0.00 0.00 177.57 178.79 1gql h LYS 500 N 0.45 0.34 -0.77 1.57 3.64 -0.50 -0.17 116.57 121.14 1gql h LYS 500 Ca 0.02 -0.03 -0.03 0.00 -1.27 0.00 0.00 60.65 59.34 1gql h LYS 500 Cb 1.00 -0.07 -0.03 0.00 -0.41 0.00 0.00 32.23 32.71 1gql h LYS 500 CO 0.09 0.28 0.35 1.96 -2.27 0.00 0.00 179.45 179.86 1gql h GLN 501 N 0.31 1.12 -0.46 1.90 1.08 -1.25 0.60 115.11 118.41 1gql h GLN 501 Ca 0.09 -0.18 0.05 0.00 -1.45 0.00 0.00 58.65 57.16 1gql h GLN 501 Cb 0.03 -0.20 -0.05 0.00 -0.05 0.00 0.00 27.48 27.22 1gql h GLN 501 CO -0.02 0.88 0.20 1.98 -0.95 0.00 0.00 178.83 180.93 1gql h MET 502 N 1.09 0.39 -0.60 1.46 4.05 -0.88 -1.22 114.93 119.21 1gql h MET 502 Ca 0.26 -0.02 -0.01 0.00 -0.28 0.00 0.00 59.70 59.64 1gql h MET 502 Cb 0.15 -0.09 -0.03 0.00 -0.80 0.00 0.00 31.60 30.83 1gql h MET 502 CO -0.03 0.26 0.32 0.52 0.23 0.00 0.00 176.91 178.21 1gql h MET 503 N 0.40 0.84 0.00 0.39 2.86 -0.46 -1.93 114.93 117.04 1gql h MET 503 Ca 0.21 -0.10 -0.06 0.00 -2.06 0.00 0.00 59.70 57.69 1gql h MET 503 Cb 0.16 -0.16 -0.01 0.00 0.06 0.00 0.00 31.60 31.65 1gql h MET 503 CO -0.18 0.65 -0.27 -0.07 1.06 0.00 0.00 176.91 178.10 1gql h LEU 504 N 0.81 0.00 0.00 1.22 3.38 -0.31 -2.58 115.31 117.83 1gql h LEU 504 Ca 0.21 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.15 1gql h LEU 504 Cb 0.06 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.80 1gql h LEU 504 CO -0.03 0.27 -0.80 0.58 0.09 0.00 0.00 178.44 178.55 1gql h VAL 505 N 0.00 0.14 -0.76 1.22 2.07 -1.01 -3.39 116.25 114.52 1gql h VAL 505 Ca -0.00 -1.24 0.04 0.00 0.82 0.00 0.00 66.70 66.31 1gql h VAL 505 Cb 0.54 1.76 -0.04 0.00 -1.52 0.00 0.00 31.29 32.03 1gql h VAL 505 CO 0.03 0.08 0.50 0.77 0.02 0.00 0.00 177.57 178.97 1gql h SER 506 N 0.00 0.78 0.10 0.57 4.64 -0.92 -0.19 113.55 118.52 1gql h SER 506 Ca -0.03 -0.01 -0.00 0.00 -0.47 0.00 0.00 61.79 61.28 1gql h SER 506 Cb 1.12 -0.18 0.00 0.00 -0.31 0.00 0.00 62.40 63.03 1gql h SER 506 CO 0.01 0.53 -0.05 -0.09 -0.87 0.00 0.00 176.83 176.37 1gql h ARG 507 N 0.90 -0.13 -0.58 4.77 1.12 -1.72 -2.38 114.38 116.37 1gql h ARG 507 Ca 0.31 0.01 -0.01 0.00 -1.11 0.00 0.00 59.98 59.17 1gql h ARG 507 Cb 0.09 0.03 -0.03 0.00 -0.01 0.00 0.00 29.97 30.05 1gql h ARG 507 CO -0.09 0.00 0.30 1.49 -3.11 0.00 0.00 179.97 178.56 1gql h GLU 508 N -0.23 0.80 -0.67 0.20 4.57 -1.56 -1.23 114.58 116.46 1gql h GLU 508 Ca -0.01 -0.08 0.04 0.00 -1.18 0.00 0.00 59.36 58.12 1gql h GLU 508 Cb 0.18 -0.16 -0.05 0.00 -0.16 0.00 0.00 28.75 28.57 1gql h GLU 508 CO 0.02 0.59 0.40 0.00 -1.18 0.00 0.00 179.01 178.85 1gql h ALA 509 N 1.53 0.89 -0.05 2.92 0.00 -0.95 0.11 119.26 123.71 1gql h ALA 509 Ca 0.20 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 55.07 1gql h ALA 509 Cb 0.04 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 1gql h ALA 509 CO -0.03 0.13 -0.18 0.78 0.00 0.00 0.00 179.25 179.95 1gql h GLY 510 N 0.76 0.08 0.48 0.00 0.00 -0.72 -1.78 103.07 101.89 1gql h GLY 510 Ca 0.28 -0.05 -0.00 0.00 0.00 0.00 0.00 47.33 47.56 1gql h GLY 510 CO -0.14 0.04 -0.04 -2.08 0.00 0.00 0.00 176.54 174.33 1gql h VAL 511 N 0.07 1.18 -0.60 4.60 2.07 -0.68 -3.31 116.25 119.58 1gql h VAL 511 Ca 0.01 -1.11 0.04 0.00 0.82 0.00 0.00 66.70 66.47 1gql h VAL 511 Cb 0.36 1.88 -0.05 0.00 -1.52 0.00 0.00 31.29 31.96 1gql h VAL 511 CO 0.02 0.27 0.34 0.78 0.02 0.00 0.00 177.57 179.00 1gql h ASN 512 N -0.63 0.53 0.19 0.57 -0.26 -0.00 0.11 115.58 116.08 1gql h ASN 512 Ca -0.01 0.02 0.00 0.00 -0.56 0.00 0.00 56.30 55.75 1gql h ASN 512 Cb 0.52 -0.09 0.00 0.00 -1.06 0.00 0.00 38.32 37.69 1gql h ASN 512 CO 0.02 0.36 -0.04 0.00 -1.06 0.00 0.00 177.43 176.70 1gql n TYR 513 N -4.79 0.00 -0.05 1.19 0.18 -0.77 -3.35 117.16 109.57 1gql n TYR 513 Ca 0.06 0.00 -0.11 0.00 1.88 0.00 0.00 57.90 59.73 1gql n TYR 513 Cb 0.13 -0.10 -0.04 0.00 -0.38 0.00 0.00 39.34 38.95 1gql n TYR 513 CO 0.00 0.00 0.00 0.54 -2.08 0.00 0.00 176.86 175.32 1gql n ARG 514 N -0.80 0.23 -2.70 -3.48 1.74 -0.94 -3.81 116.66 106.90 1gql n ARG 514 Ca 0.19 0.10 -0.05 0.00 -0.77 0.00 0.00 57.85 57.32 1gql n ARG 514 Cb 0.23 -0.89 0.05 0.00 -1.02 0.00 0.00 32.46 30.82 1gql n ARG 514 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 1gql n SER 515 N -3.54 -2.10 -4.59 0.55 3.41 0.34 -4.88 113.62 102.81 1gql n SER 515 Ca -0.20 -2.11 -0.29 0.00 -0.26 0.00 0.00 58.87 56.01 1gql n SER 515 Cb 0.61 1.16 0.13 0.00 -0.26 0.00 0.00 64.21 65.85 1gql n SER 515 CO 0.00 0.00 0.00 -2.16 -0.16 0.00 0.00 175.04 172.72 1gql s PRO 516 N 0.61 1.45 -1.51 4.33 0.04 -1.16 -4.17 135.00 134.60 1gql s PRO 516 Ca 0.27 -0.19 0.00 0.00 0.04 0.00 0.00 61.00 61.12 1gql s PRO 516 Cb 0.15 -1.95 0.00 0.00 0.04 0.00 0.00 34.50 32.74 1gql s PRO 516 CO -0.12 -1.88 0.00 1.28 0.04 0.00 0.00 177.00 176.32 1gql n LEU 517 N -3.43 -0.96 0.00 -3.56 4.77 -1.26 -1.56 117.00 111.00 1gql n LEU 517 Ca 0.11 0.35 0.00 0.00 -0.03 0.00 0.00 56.01 56.44 1gql n LEU 517 Cb 0.60 -2.27 0.00 0.00 -2.33 0.00 0.00 43.42 39.42 1gql n LEU 517 CO 0.51 -0.82 0.00 0.61 -1.33 0.00 0.00 177.39 176.36 1gql n GLY 518 N -0.92 0.25 3.71 -0.72 0.00 -1.16 -1.07 105.19 105.28 1gql n GLY 518 Ca -0.14 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.55 1gql n GLY 518 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1gql s LEU 519 N 0.00 3.08 0.05 0.99 1.43 -0.60 -3.36 118.68 120.27 1gql s LEU 519 Ca 0.00 2.22 -0.27 0.00 -1.03 0.00 0.00 54.13 55.05 1gql s LEU 519 Cb 0.00 -4.57 0.09 0.00 0.03 0.00 0.00 46.19 41.74 1gql s LEU 519 CO 0.00 -2.60 0.84 0.28 0.23 0.00 0.00 176.35 175.10 1gql s THR 520 N -2.38 0.00 -1.32 5.49 -1.32 -1.26 -4.60 115.64 110.25 1gql s THR 520 Ca 0.70 -0.10 -0.05 0.00 -1.21 0.00 0.00 61.69 61.03 1gql s THR 520 Cb -0.25 -1.14 0.02 0.00 -1.51 0.00 0.00 72.50 69.62 1gql s THR 520 CO 0.52 0.00 1.01 1.57 -2.21 0.00 0.00 174.62 175.51 1gql n HIS 521 N -0.30 -2.40 -0.52 9.09 -0.00 -1.26 -4.73 115.22 115.10 1gql n HIS 521 Ca -0.10 0.95 0.11 0.00 -0.00 0.00 0.00 57.72 58.67 1gql n HIS 521 Cb 0.62 -4.80 0.35 0.00 -0.00 0.00 0.00 29.99 26.16 1gql n HIS 521 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 176.34 177.62 1gql n LEU 522 N -4.54 4.45 -4.83 0.27 4.77 -1.26 -4.14 117.00 111.72 1gql n LEU 522 Ca -0.14 -2.24 -0.32 0.00 -0.03 0.00 0.00 56.01 53.28 1gql n LEU 522 Cb 0.61 -0.55 0.01 0.00 -2.33 0.00 0.00 43.42 41.16 1gql n LEU 522 CO 0.66 0.90 0.71 -0.31 -1.33 0.00 0.00 177.39 178.01 1gql s TYR 523 N -1.46 3.27 0.21 -1.77 1.51 -1.26 -0.43 117.35 117.42 1gql s TYR 523 Ca 0.51 1.44 -0.32 0.00 -1.01 0.00 0.00 57.07 57.69 1gql s TYR 523 Cb 0.30 -2.86 -0.13 0.00 -0.11 0.00 0.00 41.96 39.15 1gql s TYR 523 CO 0.29 -0.84 1.51 0.45 -1.11 0.00 0.00 175.55 175.85 1gql n SER 524 N -2.28 3.06 -4.76 2.29 2.88 0.80 -4.29 113.62 111.32 1gql n SER 524 Ca 0.07 1.12 -0.36 0.00 -1.33 0.00 0.00 58.87 58.37 1gql n SER 524 Cb 0.54 -1.45 -0.08 0.00 -0.75 0.00 0.00 64.21 62.46 1gql n SER 524 CO 0.00 0.00 0.00 -1.10 -1.23 0.00 0.00 175.04 172.71 1gql s GLN 525 N 0.18 3.16 0.00 -1.46 -1.52 -1.26 -0.79 119.66 117.96 1gql s GLN 525 Ca 0.72 -0.30 0.18 0.00 -1.95 0.00 0.00 55.36 54.01 1gql s GLN 525 Cb -0.64 -2.95 0.34 0.00 -0.22 0.00 0.00 33.01 29.54 1gql s GLN 525 CO 0.44 0.73 1.26 0.41 -0.25 0.00 0.00 175.29 177.88 1gql n GLY 526 N 2.07 1.63 0.14 3.09 0.00 -1.26 -4.87 105.19 105.99 1gql n GLY 526 Ca -0.19 -0.57 0.01 0.00 0.00 0.00 0.00 46.02 45.27 1gql n GLY 526 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 1gql h ASP 527 N 3.38 0.00 -0.43 1.61 2.03 -1.97 -3.46 116.42 117.58 1gql h ASP 527 Ca 0.00 0.00 -0.19 0.00 -0.73 0.00 0.00 57.03 56.11 1gql h ASP 527 Cb 0.82 0.00 -0.07 0.00 -0.83 0.00 0.00 39.33 39.25 1gql h ASP 527 CO 0.00 0.57 -0.17 1.41 -1.03 0.00 0.00 179.24 180.02 1gql n HIS 528 N -3.51 0.00 0.01 4.15 8.25 0.03 -4.92 115.22 119.22 1gql n HIS 528 Ca -0.00 0.00 -0.18 0.00 -0.26 0.00 0.00 57.72 57.28 1gql n HIS 528 Cb 0.65 -2.30 -0.12 0.00 1.12 0.00 0.00 29.99 29.34 1gql n HIS 528 CO 0.00 0.00 0.00 -0.92 0.64 0.00 0.00 176.34 176.06 1gql h TYR 529 N 0.00 0.59 -4.69 4.41 3.20 -1.84 -3.44 116.97 115.19 1gql h TYR 529 Ca -0.19 -0.34 -0.43 0.00 3.14 0.00 0.00 58.73 60.91 1gql h TYR 529 Cb 0.96 -0.06 -0.08 0.00 1.54 0.00 0.00 36.73 39.09 1gql h TYR 529 CO 0.49 1.17 -0.32 0.41 -1.64 0.00 0.00 178.16 178.28 1gql n GLY 530 N 1.18 3.78 3.76 1.82 0.00 -1.26 -4.89 105.19 109.57 1gql n GLY 530 Ca -0.11 -2.31 -0.40 0.00 0.00 0.00 0.00 46.02 43.20 1gql n GLY 530 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1gql s PRO 531 N -3.20 4.61 -0.43 1.61 0.04 -1.26 -0.14 135.00 136.23 1gql s PRO 531 Ca 0.00 1.82 0.08 0.00 0.04 0.00 0.00 61.00 62.94 1gql s PRO 531 Cb 0.00 -3.19 0.31 0.00 0.04 0.00 0.00 34.50 31.66 1gql s PRO 531 CO 0.00 0.16 0.93 0.00 0.04 0.00 0.00 177.00 178.13 1gql n ALA 532 N 1.37 0.17 0.35 8.56 0.00 0.43 -4.39 120.51 127.01 1gql n ALA 532 Ca -0.00 -2.16 0.09 0.00 0.00 0.00 0.00 53.44 51.37 1gql n ALA 532 Cb 0.45 -1.09 0.40 0.00 0.00 0.00 0.00 19.45 19.20 1gql n ALA 532 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1gql n PRO 533 N 0.61 0.11 0.00 0.00 -0.04 -1.13 -1.68 135.00 132.87 1gql n PRO 533 Ca 0.13 0.41 0.14 0.00 -0.04 0.00 0.00 63.50 64.14 1gql n PRO 533 Cb 0.66 -1.73 0.59 0.00 -0.04 0.00 0.00 33.50 32.98 1gql n PRO 533 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 1gql n TRP 534 N -1.94 0.00 -1.67 0.54 2.14 -1.26 -4.19 117.44 111.06 1gql n TRP 534 Ca 0.02 0.00 -0.51 0.00 2.07 0.00 0.00 57.50 59.08 1gql n TRP 534 Cb 0.16 -0.40 -0.05 0.00 -0.81 0.00 0.00 31.31 30.21 1gql n TRP 534 CO 0.00 0.00 0.00 2.41 2.07 0.00 0.00 177.69 182.17 1gql n THR 535 N -1.41 0.31 -4.09 -1.67 -1.04 -0.67 -4.78 114.28 100.93 1gql n THR 535 Ca 0.09 -0.06 -0.15 0.00 -2.04 0.00 0.00 64.05 61.89 1gql n THR 535 Cb 0.32 -1.48 -0.04 0.00 -1.82 0.00 0.00 70.33 67.31 1gql n THR 535 CO 0.00 0.00 0.00 -0.67 -0.64 0.00 0.00 175.07 173.76 1gql n ASP 536 N 5.08 -1.09 -3.83 8.00 4.64 -1.26 -1.74 116.55 126.34 1gql n ASP 536 Ca 0.22 -2.84 -0.35 0.00 -1.38 0.00 0.00 54.79 50.44 1gql n ASP 536 Cb 0.23 2.13 0.03 0.00 -1.04 0.00 0.00 41.12 42.47 1gql n ASP 536 CO 0.00 0.00 0.00 0.47 -0.82 0.00 0.00 177.20 176.85 1gql n ASP 537 N -1.70 -4.30 -4.83 1.67 8.00 -1.26 -5.00 116.55 109.13 1gql n ASP 537 Ca 0.02 -1.10 -0.22 0.00 0.71 0.00 0.00 54.79 54.21 1gql n ASP 537 Cb 0.55 -2.86 -0.04 0.00 -0.02 0.00 0.00 41.12 38.74 1gql n ASP 537 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1gql s LEU 538 N -6.81 3.43 0.49 0.64 1.43 -1.26 -5.02 118.68 111.59 1gql s LEU 538 Ca 0.42 -0.67 0.18 0.00 -1.03 0.00 0.00 54.13 53.03 1gql s LEU 538 Cb -0.17 -2.02 1.22 0.00 0.03 0.00 0.00 46.19 45.24 1gql s LEU 538 CO 0.90 -0.45 2.04 -0.65 0.23 0.00 0.00 176.35 178.41 1gql h PRO 539 N 1.24 0.15 -5.03 1.29 0.11 -2.01 -3.37 132.00 124.38 1gql h PRO 539 Ca -0.43 -0.01 -0.63 0.00 0.11 0.00 0.00 66.00 65.04 1gql h PRO 539 Cb 1.26 -0.03 -0.34 0.00 0.11 0.00 0.00 31.00 31.99 1gql h PRO 539 CO 0.60 0.10 -0.86 -0.98 -0.21 0.00 0.00 178.00 176.65 1gql s ARG 540 N -5.17 2.65 0.39 1.05 1.70 -1.26 -5.02 118.95 113.29 1gql s ARG 540 Ca -0.06 -0.73 0.08 0.00 -0.47 0.00 0.00 55.73 54.55 1gql s ARG 540 Cb 0.19 -2.13 0.82 0.00 -0.57 0.00 0.00 34.95 33.26 1gql s ARG 540 CO 0.72 0.03 1.99 0.00 -1.08 0.00 0.00 175.30 176.95 1gql h ALA 541 N 7.15 1.76 0.00 7.88 0.00 -1.90 -2.17 119.26 131.98 1gql h ALA 541 Ca -0.28 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.61 1gql h ALA 541 Cb 1.20 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.82 1gql h ALA 541 CO 0.50 0.14 0.00 -0.40 0.00 0.00 0.00 179.25 179.50 1gql n ASP 542 N -4.47 0.00 -0.55 0.00 5.68 -1.26 -1.59 116.55 114.36 1gql n ASP 542 Ca 0.09 -0.65 0.11 0.00 -0.50 0.00 0.00 54.79 53.84 1gql n ASP 542 Cb 0.21 0.00 0.01 0.00 -1.14 0.00 0.00 41.12 40.21 1gql n ASP 542 CO 0.00 0.00 0.00 0.79 -1.33 0.00 0.00 177.20 176.66 1gql n TRP 543 N -0.97 0.00 -2.31 2.11 7.02 -0.81 -5.00 117.44 117.48 1gql n TRP 543 Ca 0.14 0.00 -0.26 0.00 -1.02 0.00 0.00 57.50 56.36 1gql n TRP 543 Cb 0.06 0.00 0.11 0.00 -2.42 0.00 0.00 31.31 29.07 1gql n TRP 543 CO 0.00 0.00 0.00 0.95 -2.02 0.00 0.00 177.69 176.62 1gql s THR 544 N -2.28 2.16 -0.16 -0.99 -4.23 -0.62 -4.95 115.64 104.57 1gql s THR 544 Ca 0.19 -0.35 -0.10 0.00 -1.18 0.00 0.00 61.69 60.25 1gql s THR 544 Cb 0.17 -2.82 -0.23 0.00 1.34 0.00 0.00 72.50 70.97 1gql s THR 544 CO 0.49 0.00 0.23 0.00 -0.54 0.00 0.00 174.62 174.81 1gql n ALA 545 N -3.08 0.93 0.22 3.99 0.00 -0.71 -4.44 120.51 117.42 1gql n ALA 545 Ca 0.13 -0.64 0.07 0.00 0.00 0.00 0.00 53.44 52.99 1gql n ALA 545 Cb 0.60 -0.55 0.58 0.00 0.00 0.00 0.00 19.45 20.08 1gql n ALA 545 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 177.50 177.11 1gql h VAL 546 N -0.24 1.05 -0.98 0.00 -1.51 -1.61 -1.16 116.25 111.80 1gql h VAL 546 Ca -0.44 -0.20 0.15 0.00 -1.23 0.00 0.00 66.70 64.98 1gql h VAL 546 Cb 1.83 1.05 -0.09 0.00 -2.13 0.00 0.00 31.29 31.95 1gql h VAL 546 CO -0.03 0.06 0.61 0.22 -1.23 0.00 0.00 177.57 177.21 1gql h TYR 547 N 0.06 1.02 0.15 5.19 5.03 -1.81 -1.51 116.97 125.10 1gql h TYR 547 Ca 0.01 0.03 -0.32 0.00 2.58 0.00 0.00 58.73 61.04 1gql h TYR 547 Cb 0.09 -0.32 0.00 0.00 1.55 0.00 0.00 36.73 38.06 1gql h TYR 547 CO 0.00 0.33 -1.60 1.88 -1.32 0.00 0.00 178.16 177.45 1gql h TYR 548 N 0.82 0.59 0.05 -3.82 0.05 -1.45 -3.40 116.97 109.81 1gql h TYR 548 Ca 0.51 -0.43 -0.30 0.00 0.05 0.00 0.00 58.73 58.56 1gql h TYR 548 Cb 0.71 -0.02 -0.03 0.00 1.01 0.00 0.00 36.73 38.40 1gql h TYR 548 CO -0.00 1.62 -1.64 1.12 -1.05 0.00 0.00 178.16 178.21 1gql h HIS 549 N -0.08 0.19 -5.62 4.88 2.07 -1.47 -3.38 115.15 111.74 1gql h HIS 549 Ca -0.33 -0.14 -0.42 0.00 -2.85 0.00 0.00 60.37 56.64 1gql h HIS 549 Cb 1.94 -0.01 -0.07 0.00 2.57 0.00 0.00 27.41 31.85 1gql h HIS 549 CO 0.11 1.23 -0.63 0.54 -3.07 0.00 0.00 177.93 176.11 1gql n ARG 550 N -3.25 -3.98 -2.16 5.12 1.74 -0.57 -0.55 116.66 113.01 1gql n ARG 550 Ca -0.17 0.54 -0.41 0.00 -0.77 0.00 0.00 57.85 57.04 1gql n ARG 550 Cb 1.04 -5.31 -0.03 0.00 -1.02 0.00 0.00 32.46 27.14 1gql n ARG 550 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1gql s ALA 551 N -3.06 3.51 0.34 7.54 0.00 -1.26 -4.50 121.76 124.34 1gql s ALA 551 Ca 0.47 1.20 0.05 0.00 0.00 0.00 0.00 51.96 53.69 1gql s ALA 551 Cb -0.24 -3.48 -0.02 0.00 0.00 0.00 0.00 23.12 19.38 1gql s ALA 551 CO 0.58 -0.59 0.35 -1.13 0.00 0.00 0.00 175.76 174.98 1gql n SER 552 N 1.47 -0.93 0.16 0.00 3.41 0.18 -5.00 113.62 112.90 1gql n SER 552 Ca 0.02 -3.13 0.15 0.00 -0.26 0.00 0.00 58.87 55.65 1gql n SER 552 Cb 0.42 1.98 0.73 0.00 -0.26 0.00 0.00 64.21 67.08 1gql n SER 552 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 175.04 175.38 1gql h LYS 553 N 0.00 0.00 0.00 4.33 3.64 -1.88 -3.14 116.57 119.51 1gql h LYS 553 Ca -0.25 0.00 -0.23 0.00 -1.27 0.00 0.00 60.65 58.90 1gql h LYS 553 Cb 1.21 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 32.99 1gql h LYS 553 CO 0.36 0.00 -2.05 0.25 -2.27 0.00 0.00 179.45 175.74 1gql n THR 554 N -4.24 1.01 -3.41 1.00 -2.24 -1.26 -4.79 114.28 100.35 1gql n THR 554 Ca 0.03 -0.73 0.00 0.00 -2.27 0.00 0.00 64.05 61.07 1gql n THR 554 Cb 0.33 -0.44 0.00 0.00 -2.10 0.00 0.00 70.33 68.12 1gql n THR 554 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1gql n GLY 555 N 1.54 1.20 3.42 3.38 0.00 -1.19 -1.66 105.19 111.88 1gql n GLY 555 Ca -0.20 -0.86 -0.14 0.00 0.00 0.00 0.00 46.02 44.82 1gql n GLY 555 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1gql s ILE 556 N -2.45 0.02 0.00 -0.61 2.07 -0.22 -0.65 121.20 119.36 1gql s ILE 556 Ca 0.00 -0.16 0.00 0.00 -1.41 0.00 0.00 60.65 59.08 1gql s ILE 556 Cb 0.00 -1.00 0.00 0.00 0.13 0.00 0.00 42.46 41.59 1gql s ILE 556 CO 0.00 -0.09 0.00 0.61 -1.91 0.00 0.00 174.94 173.55 1gql n GLY 557 N 0.24 2.54 3.14 1.50 0.00 0.29 -0.10 105.19 112.81 1gql n GLY 557 Ca -0.18 -2.06 -0.33 0.00 0.00 0.00 0.00 46.02 43.45 1gql n GLY 557 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1gql s PHE 558 N -2.35 2.82 -0.52 1.61 2.19 -0.86 -4.36 117.98 116.51 1gql s PHE 558 Ca 0.00 -1.58 -0.28 0.00 0.33 0.00 0.00 56.93 55.40 1gql s PHE 558 Cb 0.00 -1.94 0.02 0.00 -1.31 0.00 0.00 43.02 39.78 1gql s PHE 558 CO 0.00 -0.78 1.34 1.21 1.83 0.00 0.00 175.22 178.82 1gql s ASN 559 N 1.31 6.30 -0.08 6.13 2.47 -1.26 -2.35 114.94 127.45 1gql s ASN 559 Ca 0.05 0.40 0.12 0.00 0.42 0.00 0.00 52.86 53.85 1gql s ASN 559 Cb -0.13 -2.55 0.33 0.00 -1.45 0.00 0.00 41.25 37.45 1gql s ASN 559 CO -0.12 -1.55 1.25 0.54 -3.72 0.00 0.00 177.10 173.50 1gql n ARG 560 N 8.39 2.65 -1.82 0.43 1.74 -0.14 -1.35 116.66 126.57 1gql n ARG 560 Ca 0.13 -2.31 -0.25 0.00 -0.77 0.00 0.00 57.85 54.65 1gql n ARG 560 Cb 0.49 -1.46 0.17 0.00 -1.02 0.00 0.00 32.46 30.64 1gql n ARG 560 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 1gql n THR 561 N -0.33 0.00 -0.07 0.55 -2.24 -1.23 -1.72 114.28 109.24 1gql n THR 561 Ca 0.14 -0.97 0.25 0.00 -2.27 0.00 0.00 64.05 61.19 1gql n THR 561 Cb 0.59 -1.44 0.72 0.00 -2.10 0.00 0.00 70.33 68.09 1gql n THR 561 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 1gql h LYS 562 N 0.00 0.00 -0.00 -0.78 1.57 -1.95 0.03 116.57 115.43 1gql h LYS 562 Ca -0.36 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.42 1gql h LYS 562 Cb 1.06 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.37 1gql h LYS 562 CO 0.28 0.00 -0.17 0.25 -0.57 0.00 0.00 179.45 179.24 1gql n THR 563 N -4.09 0.00 0.00 -0.16 -2.24 -1.26 -4.69 114.28 101.84 1gql n THR 563 Ca 0.14 -0.05 0.00 0.00 -2.27 0.00 0.00 64.05 61.87 1gql n THR 563 Cb 0.82 -0.04 0.00 0.00 -2.10 0.00 0.00 70.33 69.01 1gql n THR 563 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1gql n GLY 564 N 1.35 1.82 0.03 3.38 0.00 -0.13 -4.99 105.19 106.64 1gql n GLY 564 Ca 0.12 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.27 1gql n GLY 564 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1gql n SER 565 N 0.00 0.20 -3.06 1.61 3.41 -0.45 -4.85 113.62 110.48 1gql n SER 565 Ca 0.00 0.52 -0.21 0.00 -0.26 0.00 0.00 58.87 58.92 1gql n SER 565 Cb 0.00 -0.58 0.01 0.00 -0.26 0.00 0.00 64.21 63.39 1gql n SER 565 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1gql n ASN 566 N -1.69 -4.92 0.25 4.04 5.15 -0.43 -4.87 115.26 112.79 1gql n ASN 566 Ca 0.06 -0.26 0.10 0.00 -0.60 0.00 0.00 54.58 53.88 1gql n ASN 566 Cb 0.33 -4.03 0.65 0.00 -0.53 0.00 0.00 39.78 36.20 1gql n ASN 566 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1gql h ALA 567 N 0.99 1.53 -0.26 5.20 0.00 -1.58 -2.46 119.26 122.69 1gql h ALA 567 Ca -0.46 -0.11 0.07 0.00 0.00 0.00 0.00 54.91 54.41 1gql h ALA 567 Cb 1.32 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.08 1gql h ALA 567 CO 0.53 0.16 0.21 -0.07 0.00 0.00 0.00 179.25 180.08 1gql h LEU 568 N 0.00 0.00 -0.46 0.00 3.38 -1.69 -1.10 115.31 115.44 1gql h LEU 568 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1gql h LEU 568 Cb 0.27 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.02 1gql h LEU 568 CO 0.02 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.55 1gql n ALA 569 N -2.49 1.45 0.78 1.53 0.00 -0.92 -1.68 120.51 119.18 1gql n ALA 569 Ca 0.03 0.04 0.13 0.00 0.00 0.00 0.00 53.44 53.65 1gql n ALA 569 Cb 0.36 -1.26 0.50 0.00 0.00 0.00 0.00 19.45 19.05 1gql n ALA 569 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1gql n GLN 570 N -1.87 0.14 -3.52 0.00 6.02 -0.42 -4.85 117.38 112.89 1gql n GLN 570 Ca 0.02 0.13 -0.25 0.00 -0.01 0.00 0.00 57.00 56.88 1gql n GLN 570 Cb 0.14 -1.67 -0.02 0.00 1.02 0.00 0.00 30.24 29.71 1gql n GLN 570 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 177.06 176.76 1gql s TYR 571 N -3.06 3.49 0.56 1.08 2.02 -0.68 -4.85 117.35 115.91 1gql s TYR 571 Ca 0.12 0.34 -0.21 0.00 -0.37 0.00 0.00 57.07 56.95 1gql s TYR 571 Cb 0.15 -1.87 -0.05 0.00 -0.40 0.00 0.00 41.96 39.79 1gql s TYR 571 CO 0.56 0.23 1.23 -2.30 -1.57 0.00 0.00 175.55 173.70 1gql n PRO 572 N -1.36 1.42 -0.28 -1.71 -0.02 -1.26 -4.62 135.00 127.17 1gql n PRO 572 Ca -0.05 0.53 0.08 0.00 -2.02 0.00 0.00 63.50 62.04 1gql n PRO 572 Cb 0.55 -2.43 0.21 0.00 -0.02 0.00 0.00 33.50 31.81 1gql n PRO 572 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1gql h GLU 573 N 1.13 0.13 -0.29 -0.52 4.22 -1.92 -1.10 114.58 116.23 1gql h GLU 573 Ca -0.50 -0.01 0.00 0.00 0.08 0.00 0.00 59.36 58.94 1gql h GLU 573 Cb 1.32 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 30.53 1gql h GLU 573 CO 0.55 0.08 0.19 -1.35 -2.18 0.00 0.00 179.01 176.31 1gql h PRO 574 N 0.13 0.37 -0.03 0.92 0.11 -1.91 0.15 132.00 131.75 1gql h PRO 574 Ca 0.47 -0.02 -0.03 0.00 0.11 0.00 0.00 66.00 66.53 1gql h PRO 574 Cb 0.87 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 31.90 1gql h PRO 574 CO -0.68 0.25 -0.10 0.82 -0.21 0.00 0.00 178.00 178.08 1gql h ILE 575 N 0.38 1.47 -0.90 4.15 1.08 -1.53 -1.25 117.51 120.92 1gql h ILE 575 Ca 0.11 -1.53 0.11 0.00 -0.39 0.00 0.00 64.86 63.16 1gql h ILE 575 Cb -0.03 2.42 -0.08 0.00 -3.07 0.00 0.00 36.82 36.05 1gql h ILE 575 CO -0.02 0.41 0.53 0.00 -0.69 0.00 0.00 178.15 178.38 1gql h ALA 576 N 0.40 1.34 0.14 1.87 0.00 -0.89 0.43 119.26 122.55 1gql h ALA 576 Ca -0.00 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 1gql h ALA 576 Cb 0.72 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.37 1gql h ALA 576 CO 0.02 0.12 -0.06 -0.22 0.00 0.00 0.00 179.25 179.10 1gql h LYS 577 N 0.85 -0.18 -0.61 0.00 3.64 -1.00 -0.90 116.57 118.37 1gql h LYS 577 Ca 0.45 0.01 -0.05 0.00 -1.27 0.00 0.00 60.65 59.80 1gql h LYS 577 Cb 0.47 0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 32.30 1gql h LYS 577 CO -0.27 0.08 0.20 0.00 -2.27 0.00 0.00 179.45 177.19 1gql h ALA 578 N 0.40 0.80 0.00 5.00 0.00 -0.70 -2.54 119.26 122.23 1gql h ALA 578 Ca -0.02 -0.20 -0.08 0.00 0.00 0.00 0.00 54.91 54.62 1gql h ALA 578 Cb 0.34 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 1gql h ALA 578 CO 0.03 0.46 -0.59 -1.49 0.00 0.00 0.00 179.25 177.66 1gql h TRP 579 N 0.87 0.00 0.00 0.00 6.55 -0.99 -1.94 115.95 120.44 1gql h TRP 579 Ca 0.20 0.00 0.00 0.00 0.95 0.00 0.00 58.89 60.04 1gql h TRP 579 Cb 0.27 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 28.57 1gql h TRP 579 CO 0.02 0.33 -0.36 0.78 -1.05 0.00 0.00 178.44 178.16 1gql h GLY 580 N 3.72 0.00 -6.45 1.49 0.00 -1.03 -3.43 103.07 97.36 1gql h GLY 580 Ca -0.03 0.00 -0.61 0.00 0.00 0.00 0.00 47.33 46.70 1gql h GLY 580 CO 0.04 0.00 -0.08 -0.35 0.00 0.00 0.00 176.54 176.15 1gql s ASP 581 N -5.82 6.49 0.63 0.19 -1.08 -0.97 -4.96 116.67 111.15 1gql s ASP 581 Ca 0.04 0.58 0.39 0.00 -0.52 0.00 0.00 52.55 53.05 1gql s ASP 581 Cb 0.07 -2.27 2.15 0.00 -1.46 0.00 0.00 42.92 41.40 1gql s ASP 581 CO 0.71 -0.18 2.30 -0.07 0.52 0.00 0.00 175.17 178.45 1gql h LEU 582 N 8.11 0.00 -0.84 -1.34 3.38 -1.87 -1.16 115.31 121.60 1gql h LEU 582 Ca -0.33 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.62 1gql h LEU 582 Cb 1.15 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.90 1gql h LEU 582 CO 0.72 0.01 -0.11 -1.13 0.09 0.00 0.00 178.44 178.02 1gql h ASN 583 N 0.00 0.00 0.00 -0.43 -1.24 -1.93 -3.36 115.58 108.62 1gql h ASN 583 Ca -0.00 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.01 1gql h ASN 583 Cb 0.06 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.11 1gql h ASN 583 CO 0.00 0.11 -0.58 -1.54 -1.29 0.00 0.00 177.43 174.13 1gql n SER 584 N -3.19 2.92 -4.74 1.15 3.41 -0.75 -5.05 113.62 107.38 1gql n SER 584 Ca 0.01 -0.15 -0.42 0.00 -0.26 0.00 0.00 58.87 58.06 1gql n SER 584 Cb 0.44 0.88 -0.02 0.00 -0.26 0.00 0.00 64.21 65.25 1gql n SER 584 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1gql s VAL 585 N -1.47 2.01 0.26 -3.33 0.11 -0.51 -4.80 120.40 112.68 1gql s VAL 585 Ca 0.00 0.01 -0.30 0.00 -2.93 0.00 0.00 61.98 58.76 1gql s VAL 585 Cb 0.00 -3.01 -0.10 0.00 -1.53 0.00 0.00 36.38 31.74 1gql s VAL 585 CO 0.00 0.00 1.43 -2.84 -3.33 0.00 0.00 175.10 170.37 1gql s PRO 586 N 0.31 4.26 0.47 1.54 0.02 -1.26 -4.89 135.00 135.45 1gql s PRO 586 Ca 0.69 2.31 0.14 0.00 0.02 0.00 0.00 61.00 64.16 1gql s PRO 586 Cb -0.49 -3.10 1.08 0.00 0.02 0.00 0.00 34.50 32.02 1gql s PRO 586 CO 0.40 -0.41 2.06 0.93 -0.33 0.00 0.00 177.00 179.65 1gql h GLU 587 N 4.78 0.07 0.00 5.54 5.08 -1.96 -1.35 114.58 126.74 1gql h GLU 587 Ca -0.46 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 57.89 1gql h GLU 587 Cb 1.22 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.46 1gql h GLU 587 CO 0.76 0.14 0.00 -0.40 -1.00 0.00 0.00 179.01 178.51 1gql n ASP 588 N -4.43 0.00 -0.01 1.42 5.68 -1.26 -2.53 116.55 115.42 1gql n ASP 588 Ca -0.02 -0.07 0.00 0.00 -0.50 0.00 0.00 54.79 54.20 1gql n ASP 588 Cb 0.16 -0.25 0.00 0.00 -1.14 0.00 0.00 41.12 39.90 1gql n ASP 588 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 1gql n LEU 589 N -1.25 1.25 -0.22 -2.12 4.77 -0.55 -2.99 117.00 115.89 1gql n LEU 589 Ca 0.10 -1.22 -0.04 0.00 -0.03 0.00 0.00 56.01 54.81 1gql n LEU 589 Cb 0.14 -0.00 0.06 0.00 -2.33 0.00 0.00 43.42 41.29 1gql n LEU 589 CO 0.14 0.31 1.10 -0.29 -1.33 0.00 0.00 177.39 177.32 1gql h ILE 590 N 0.05 1.06 0.00 -0.08 2.10 -1.16 -1.35 117.51 118.13 1gql h ILE 590 Ca 0.00 -0.25 0.00 0.00 1.08 0.00 0.00 64.86 65.69 1gql h ILE 590 Cb 0.12 0.26 0.00 0.00 -1.09 0.00 0.00 36.82 36.11 1gql h ILE 590 CO 0.00 0.13 0.00 0.18 -1.08 0.00 0.00 178.15 177.38 1gql n LEU 591 N -4.74 0.00 0.20 2.19 4.77 -0.23 -1.92 117.00 117.28 1gql n LEU 591 Ca 0.06 0.29 0.05 0.00 -0.03 0.00 0.00 56.01 56.37 1gql n LEU 591 Cb 0.10 -0.29 0.44 0.00 -2.33 0.00 0.00 43.42 41.33 1gql n LEU 591 CO 0.32 -0.05 0.79 -0.50 -1.33 0.00 0.00 177.39 176.62 1gql h TRP 592 N 0.00 0.00 0.00 -1.77 4.06 -1.24 -2.30 115.95 114.70 1gql h TRP 592 Ca 0.00 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.95 1gql h TRP 592 Cb 0.24 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.40 1gql h TRP 592 CO 0.00 0.30 -0.78 1.19 -3.56 0.00 0.00 178.44 175.59 1gql n PHE 593 N -4.07 0.00 -4.88 0.49 3.72 -0.81 -4.48 117.46 107.44 1gql n PHE 593 Ca -0.02 0.00 -0.26 0.00 -0.05 0.00 0.00 57.45 57.12 1gql n PHE 593 Cb 0.35 0.00 -0.16 0.00 -0.94 0.00 0.00 39.48 38.73 1gql n PHE 593 CO 0.00 0.00 0.00 -1.01 -0.05 0.00 0.00 176.76 175.70 1gql s HIS 594 N -1.68 1.77 -0.34 1.38 3.76 -0.82 -0.96 115.29 118.39 1gql s HIS 594 Ca 0.00 -0.49 -0.15 0.00 -0.15 0.00 0.00 55.06 54.26 1gql s HIS 594 Cb 0.00 -1.18 -0.01 0.00 1.11 0.00 0.00 32.58 32.49 1gql s HIS 594 CO 0.00 -0.16 0.36 -1.58 -0.85 0.00 0.00 174.74 172.51 1gql s HIS 595 N -0.02 3.21 0.03 1.40 2.46 -1.26 -3.29 115.29 117.82 1gql s HIS 595 Ca -0.03 -0.02 0.08 0.00 0.47 0.00 0.00 55.06 55.57 1gql s HIS 595 Cb -0.11 -2.67 -0.03 0.00 -0.13 0.00 0.00 32.58 29.64 1gql s HIS 595 CO 0.02 -0.43 -0.23 -0.51 -2.47 0.00 0.00 174.74 171.12 1gql s LEU 596 N 2.02 2.35 0.40 8.88 1.43 0.86 -4.89 118.68 129.73 1gql s LEU 596 Ca 0.12 -0.50 -0.26 0.00 -1.03 0.00 0.00 54.13 52.46 1gql s LEU 596 Cb -0.17 -1.39 -0.10 0.00 0.03 0.00 0.00 46.19 44.56 1gql s LEU 596 CO 0.12 0.27 1.21 -0.24 0.23 0.00 0.00 176.35 177.94 1gql n SER 597 N 1.78 2.28 0.25 2.29 2.88 -1.26 -1.06 113.62 120.78 1gql n SER 597 Ca -0.17 1.11 0.18 0.00 -1.33 0.00 0.00 58.87 58.66 1gql n SER 597 Cb 0.52 -1.46 0.90 0.00 -0.75 0.00 0.00 64.21 63.42 1gql n SER 597 CO 0.00 0.00 0.00 -0.50 -1.23 0.00 0.00 175.04 173.31 1gql h TRP 598 N 2.04 0.00 -0.01 0.66 4.06 -1.66 -1.74 115.95 119.30 1gql h TRP 598 Ca -0.47 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.48 1gql h TRP 598 Cb 1.30 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.46 1gql h TRP 598 CO 0.47 0.00 -0.07 -0.25 -3.56 0.00 0.00 178.44 175.04 1gql n ASP 599 N -3.47 0.70 -4.68 -3.49 8.00 -1.26 -2.22 116.55 110.14 1gql n ASP 599 Ca 0.00 -0.95 -0.45 0.00 0.71 0.00 0.00 54.79 54.10 1gql n ASP 599 Cb 0.30 -0.02 -0.04 0.00 -0.02 0.00 0.00 41.12 41.35 1gql n ASP 599 CO 0.00 0.00 0.00 1.57 -0.39 0.00 0.00 177.20 178.38 1gql n HIS 600 N -0.63 2.32 -3.26 1.24 -0.00 -0.65 -4.65 115.22 109.58 1gql n HIS 600 Ca 0.18 0.28 -0.38 0.00 -0.00 0.00 0.00 57.72 57.79 1gql n HIS 600 Cb 0.27 -2.54 -0.06 0.00 -0.00 0.00 0.00 29.99 27.66 1gql n HIS 600 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 176.34 177.37 1gql s ARG 601 N 0.63 4.32 0.66 1.57 0.52 -1.26 -0.61 118.95 124.78 1gql s ARG 601 Ca 0.76 0.50 -0.04 0.00 -0.52 0.00 0.00 55.73 56.43 1gql s ARG 601 Cb -0.65 -3.47 0.06 0.00 0.52 0.00 0.00 34.95 31.41 1gql s ARG 601 CO 0.40 0.07 0.94 -1.64 0.02 0.00 0.00 175.30 175.08 1gql s MET 602 N 0.91 2.27 0.38 3.54 -1.94 0.27 -4.95 119.30 119.77 1gql s MET 602 Ca 0.27 -0.47 0.12 0.00 -1.71 0.00 0.00 55.69 53.90 1gql s MET 602 Cb -0.15 -2.28 0.90 0.00 2.01 0.00 0.00 34.83 35.31 1gql s MET 602 CO 0.11 -1.09 1.86 1.96 -0.01 0.00 0.00 175.02 177.85 1gql h GLN 603 N -0.39 0.58 0.00 2.03 4.20 -1.97 -1.06 115.11 118.50 1gql h GLN 603 Ca -0.43 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.24 1gql h GLN 603 Cb 1.31 -0.13 0.00 0.00 0.30 0.00 0.00 27.48 28.96 1gql h GLN 603 CO 0.56 0.38 0.00 0.66 -0.67 0.00 0.00 178.83 179.77 1gql h SER 604 N 0.59 0.00 0.00 1.46 4.64 -2.01 -3.46 113.55 114.77 1gql h SER 604 Ca 0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.77 1gql h SER 604 Cb 0.86 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.95 1gql h SER 604 CO -0.20 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.37 1gql n GLY 605 N -0.22 1.88 3.80 -0.77 0.00 -0.40 -5.06 105.19 104.42 1gql n GLY 605 Ca 0.01 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 1gql n GLY 605 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1gql s ARG 606 N -0.93 3.69 1.01 1.61 0.52 -1.26 -4.77 118.95 118.81 1gql s ARG 606 Ca 0.00 1.26 -0.15 0.00 -0.52 0.00 0.00 55.73 56.33 1gql s ARG 606 Cb 0.00 -2.08 0.19 0.00 0.52 0.00 0.00 34.95 33.58 1gql s ARG 606 CO 0.00 -0.52 1.16 0.54 0.02 0.00 0.00 175.30 176.50 1gql s ASN 607 N -2.34 2.67 0.20 0.23 2.20 -1.26 -0.56 114.94 116.08 1gql s ASN 607 Ca 0.65 0.79 -0.09 0.00 -0.94 0.00 0.00 52.86 53.27 1gql s ASN 607 Cb -0.15 -1.20 0.14 0.00 -2.00 0.00 0.00 41.25 38.03 1gql s ASN 607 CO 0.26 -3.06 1.78 0.25 -2.94 0.00 0.00 177.10 173.39 1gql h LEU 608 N -1.85 0.99 -0.12 3.54 5.85 -0.38 0.91 115.31 124.25 1gql h LEU 608 Ca -0.49 -0.14 0.00 0.00 0.84 0.00 0.00 57.88 58.09 1gql h LEU 608 Cb 1.31 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 42.07 1gql h LEU 608 CO 0.50 0.86 0.07 -0.25 -0.34 0.00 0.00 178.44 179.28 1gql h TRP 609 N 1.05 0.13 -0.93 1.25 2.91 -1.83 -0.18 115.95 118.35 1gql h TRP 609 Ca 0.25 0.00 -0.00 0.00 1.13 0.00 0.00 58.89 60.27 1gql h TRP 609 Cb 0.14 -0.04 -0.05 0.00 -0.51 0.00 0.00 29.16 28.71 1gql h TRP 609 CO 0.01 0.08 0.57 1.96 -1.03 0.00 0.00 178.44 180.03 1gql h GLN 610 N 0.14 1.26 -0.45 2.65 4.20 -1.75 -1.52 115.11 119.64 1gql h GLN 610 Ca 0.05 -0.11 -0.11 0.00 0.06 0.00 0.00 58.65 58.53 1gql h GLN 610 Cb -0.00 -0.27 -0.01 0.00 0.30 0.00 0.00 27.48 27.50 1gql h GLN 610 CO -0.02 0.87 -0.16 1.49 -0.67 0.00 0.00 178.83 180.34 1gql h GLU 611 N 1.29 0.91 0.19 1.46 4.57 -0.56 -0.60 114.58 121.84 1gql h GLU 611 Ca 0.34 -0.37 -0.01 0.00 -1.18 0.00 0.00 59.36 58.14 1gql h GLU 611 Cb -0.07 -0.04 0.00 0.00 -0.16 0.00 0.00 28.75 28.48 1gql h GLU 611 CO -0.06 1.03 -0.10 1.25 -1.18 0.00 0.00 179.01 179.94 1gql h LEU 612 N 0.75 -0.23 -0.55 1.64 6.46 -0.71 0.18 115.31 122.85 1gql h LEU 612 Ca 0.11 0.01 0.05 0.00 -0.12 0.00 0.00 57.88 57.93 1gql h LEU 612 Cb 0.72 0.06 -0.05 0.00 -0.73 0.00 0.00 40.66 40.66 1gql h LEU 612 CO 0.05 -0.16 0.28 0.58 -0.62 0.00 0.00 178.44 178.57 1gql h VAL 613 N -0.26 0.94 -0.67 1.05 2.07 -1.22 -2.21 116.25 115.94 1gql h VAL 613 Ca -0.02 -0.18 0.03 0.00 0.82 0.00 0.00 66.70 67.35 1gql h VAL 613 Cb 0.21 0.36 -0.04 0.00 -1.52 0.00 0.00 31.29 30.30 1gql h VAL 613 CO 0.03 0.10 0.41 -0.74 0.02 0.00 0.00 177.57 177.39 1gql h HIS 614 N 0.53 0.77 -0.36 1.57 -0.00 -0.69 -1.38 115.15 115.59 1gql h HIS 614 Ca 0.25 0.02 -0.05 0.00 -0.00 0.00 0.00 60.37 60.59 1gql h HIS 614 Cb 0.17 -0.25 -0.01 0.00 -0.00 0.00 0.00 27.41 27.32 1gql h HIS 614 CO -0.11 0.44 0.03 0.87 -0.00 0.00 0.00 177.93 179.17 1gql h LYS 615 N 0.81 0.61 -0.57 5.26 1.79 -0.62 0.26 116.57 124.10 1gql h LYS 615 Ca 0.27 -0.18 -0.01 0.00 -2.18 0.00 0.00 60.65 58.56 1gql h LYS 615 Cb 0.03 -0.06 -0.03 0.00 -1.58 0.00 0.00 32.23 30.59 1gql h LYS 615 CO -0.11 0.70 0.32 1.88 -1.08 0.00 0.00 179.45 181.15 1gql h TYR 616 N 0.43 0.78 -0.25 -1.35 -1.99 -1.19 -1.08 116.97 112.31 1gql h TYR 616 Ca 0.11 -0.02 -0.14 0.00 2.00 0.00 0.00 58.73 60.68 1gql h TYR 616 Cb 0.40 -0.25 -0.01 0.00 2.00 0.00 0.00 36.73 38.87 1gql h TYR 616 CO 0.03 0.56 -0.41 1.88 -0.00 0.00 0.00 178.16 180.22 1gql h TYR 617 N 0.77 0.73 -0.64 4.88 0.05 -1.08 -3.11 116.97 118.56 1gql h TYR 617 Ca 0.20 -0.21 0.02 0.00 0.05 0.00 0.00 58.73 58.79 1gql h TYR 617 Cb 0.03 -0.15 -0.04 0.00 1.01 0.00 0.00 36.73 37.58 1gql h TYR 617 CO -0.01 0.92 0.40 0.37 -1.05 0.00 0.00 178.16 178.79 1gql h GLN 618 N 0.50 0.77 -0.67 4.88 4.15 0.04 -1.73 115.11 123.05 1gql h GLN 618 Ca 0.04 -0.05 0.09 0.00 0.77 0.00 0.00 58.65 59.51 1gql h GLN 618 Cb 0.92 -0.17 -0.07 0.00 0.21 0.00 0.00 27.48 28.37 1gql h GLN 618 CO 0.08 0.51 0.31 0.78 -1.93 0.00 0.00 178.83 178.58 1gql h GLY 619 N 0.80 0.99 0.97 2.39 0.00 -1.15 0.19 103.07 107.26 1gql h GLY 619 Ca 0.25 -0.18 -0.05 0.00 0.00 0.00 0.00 47.33 47.34 1gql h GLY 619 CO -0.09 0.03 0.10 -2.08 0.00 0.00 0.00 176.54 174.49 1gql h VAL 620 N 0.53 1.24 -0.33 4.60 2.07 -1.47 -1.97 116.25 120.92 1gql h VAL 620 Ca 0.34 -0.88 -0.04 0.00 0.82 0.00 0.00 66.70 66.93 1gql h VAL 620 Cb 0.38 0.89 -0.02 0.00 -1.52 0.00 0.00 31.29 31.02 1gql h VAL 620 CO -0.28 0.31 0.02 -0.33 0.02 0.00 0.00 177.57 177.32 1gql h GLU 621 N 0.67 0.50 -0.52 1.57 4.39 -0.66 -1.19 114.58 119.33 1gql h GLU 621 Ca 0.15 -0.09 -0.11 0.00 0.34 0.00 0.00 59.36 59.64 1gql h GLU 621 Cb 0.36 -0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 28.92 1gql h GLU 621 CO 0.01 0.51 -0.12 1.96 -1.16 0.00 0.00 179.01 180.20 1gql h GLN 622 N 0.48 0.97 -0.62 2.33 4.20 -0.30 -0.21 115.11 121.98 1gql h GLN 622 Ca 0.11 -0.36 -0.07 0.00 0.06 0.00 0.00 58.65 58.39 1gql h GLN 622 Cb 0.28 -0.06 -0.02 0.00 0.30 0.00 0.00 27.48 27.97 1gql h GLN 622 CO 0.01 1.03 0.13 0.28 -0.67 0.00 0.00 178.83 179.60 1gql h VAL 623 N 0.87 1.26 -0.89 -0.54 2.07 -0.72 -0.87 116.25 117.42 1gql h VAL 623 Ca 0.13 -0.96 -0.02 0.00 0.82 0.00 0.00 66.70 66.67 1gql h VAL 623 Cb 0.67 0.69 -0.04 0.00 -1.52 0.00 0.00 31.29 31.09 1gql h VAL 623 CO 0.05 0.36 0.47 0.03 0.02 0.00 0.00 177.57 178.49 1gql h ARG 624 N 0.91 1.25 -0.49 1.57 3.08 -0.85 -0.55 114.38 119.30 1gql h ARG 624 Ca 0.19 -0.16 -0.07 0.00 0.07 0.00 0.00 59.98 60.00 1gql h ARG 624 Cb 0.39 -0.24 -0.02 0.00 0.08 0.00 0.00 29.97 30.18 1gql h ARG 624 CO 0.01 0.93 0.00 0.00 -1.07 0.00 0.00 179.97 179.84 1gql h ALA 625 N 1.26 1.08 -0.84 0.04 0.00 -0.82 -2.11 119.26 117.87 1gql h ALA 625 Ca 0.31 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1gql h ALA 625 Cb 0.06 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 17.61 1gql h ALA 625 CO -0.05 0.58 0.54 0.52 0.00 0.00 0.00 179.25 180.84 1gql h MET 626 N 0.77 1.11 -0.21 0.00 2.86 -0.33 -0.30 114.93 118.83 1gql h MET 626 Ca 0.15 -0.08 0.03 0.00 -2.06 0.00 0.00 59.70 57.74 1gql h MET 626 Cb 0.46 -0.24 -0.03 0.00 0.06 0.00 0.00 31.60 31.85 1gql h MET 626 CO 0.02 0.75 0.03 1.96 1.06 0.00 0.00 176.91 180.73 1gql h GLN 627 N 1.14 0.10 -0.57 1.72 4.20 -0.78 -0.11 115.11 120.82 1gql h GLN 627 Ca 0.30 -0.01 -0.03 0.00 0.06 0.00 0.00 58.65 58.97 1gql h GLN 627 Cb -0.10 -0.02 -0.02 0.00 0.30 0.00 0.00 27.48 27.63 1gql h GLN 627 CO -0.06 0.07 0.22 0.00 -0.67 0.00 0.00 178.83 178.39 1gql h ARG 628 N 0.11 0.85 -0.21 1.46 3.08 -0.99 -1.46 114.38 117.22 1gql h ARG 628 Ca 0.09 -0.16 0.02 0.00 0.07 0.00 0.00 59.98 60.01 1gql h ARG 628 Cb 0.10 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 29.99 1gql h ARG 628 CO -0.14 0.74 0.06 1.15 -1.07 0.00 0.00 179.97 180.72 1gql h THR 629 N 0.78 0.93 -0.64 2.04 2.02 -0.84 -2.73 112.91 114.47 1gql h THR 629 Ca 0.19 -0.05 -0.00 0.00 0.77 0.00 0.00 66.41 67.31 1gql h THR 629 Cb 0.21 0.76 -0.03 0.00 -1.74 0.00 0.00 68.15 67.35 1gql h THR 629 CO -0.01 0.03 0.39 -0.25 0.37 0.00 0.00 175.52 176.04 1gql h TRP 630 N 0.16 0.84 -0.59 3.16 2.91 -0.77 -2.19 115.95 119.46 1gql h TRP 630 Ca 0.09 -0.00 0.13 0.00 1.13 0.00 0.00 58.89 60.24 1gql h TRP 630 Cb 0.07 -0.28 -0.03 0.00 -0.51 0.00 0.00 29.16 28.41 1gql h TRP 630 CO -0.13 0.57 0.41 -0.44 -1.03 0.00 0.00 178.44 177.82 1gql h ASP 631 N 0.87 0.24 0.29 2.65 3.32 -1.09 -0.43 116.42 122.27 1gql h ASP 631 Ca 0.23 0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.29 1gql h ASP 631 Cb -0.03 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 39.48 1gql h ASP 631 CO -0.04 0.14 0.00 0.00 -1.72 0.00 0.00 179.24 177.61 1gql n GLN 632 N -4.45 0.37 -0.26 3.56 6.02 -0.83 -3.35 117.38 118.44 1gql n GLN 632 Ca 0.10 0.08 0.09 0.00 -0.01 0.00 0.00 57.00 57.26 1gql n GLN 632 Cb 0.48 -1.50 0.24 0.00 1.02 0.00 0.00 30.24 30.48 1gql n GLN 632 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 1gql n GLN 633 N -1.22 2.65 -0.20 -1.09 1.13 -0.17 -4.66 117.38 113.82 1gql n GLN 633 Ca 0.11 -2.33 0.14 0.00 -1.94 0.00 0.00 57.00 52.98 1gql n GLN 633 Cb 0.14 -1.44 0.46 0.00 0.11 0.00 0.00 30.24 29.51 1gql n GLN 633 CO 0.00 0.00 0.00 1.49 -1.44 0.00 0.00 177.06 177.11 1gql h GLU 634 N 3.42 0.49 0.00 -1.09 4.81 -1.70 -0.80 114.58 119.72 1gql h GLU 634 Ca 0.00 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.20 1gql h GLU 634 Cb 0.88 -0.11 0.00 0.00 0.63 0.00 0.00 28.75 30.14 1gql h GLU 634 CO 0.00 0.32 0.00 0.00 -0.73 0.00 0.00 179.01 178.60 1gql h ALA 635 N 1.63 1.00 0.00 2.92 0.00 -1.90 -3.28 119.26 119.63 1gql h ALA 635 Ca 0.40 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.31 1gql h ALA 635 Cb 0.83 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.62 1gql h ALA 635 CO -0.15 0.00 -1.08 0.66 0.00 0.00 0.00 179.25 178.68 1gql n TYR 636 N -2.85 0.00 -4.53 0.00 4.01 -0.31 -4.98 117.16 108.50 1gql n TYR 636 Ca 0.01 0.00 -0.30 0.00 -0.16 0.00 0.00 57.90 57.45 1gql n TYR 636 Cb 0.28 -0.09 -0.12 0.00 -0.31 0.00 0.00 39.34 39.10 1gql n TYR 636 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 1gql s VAL 637 N -2.88 2.67 0.64 -0.72 1.01 -1.19 -4.73 120.40 115.21 1gql s VAL 637 Ca 0.04 -1.39 -0.18 0.00 0.00 0.00 0.00 61.98 60.45 1gql s VAL 637 Cb 0.14 -2.16 -0.01 0.00 0.00 0.00 0.00 36.38 34.34 1gql s VAL 637 CO 0.77 0.23 1.30 1.51 0.00 0.00 0.00 175.10 178.91 1gql s ASP 638 N -1.74 4.64 0.36 3.32 -4.77 -1.26 -4.81 116.67 112.41 1gql s ASP 638 Ca 0.15 2.64 0.04 0.00 -3.30 0.00 0.00 52.55 52.08 1gql s ASP 638 Cb -0.10 -2.62 0.70 0.00 -1.09 0.00 0.00 42.92 39.81 1gql s ASP 638 CO 0.07 -1.98 2.00 0.00 0.70 0.00 0.00 175.17 175.96 1gql h ALA 639 N 0.60 1.62 0.18 2.11 0.00 -1.98 -1.30 119.26 120.49 1gql h ALA 639 Ca -0.51 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.36 1gql h ALA 639 Cb 1.34 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.90 1gql h ALA 639 CO 0.53 0.33 -0.09 0.00 0.00 0.00 0.00 179.25 180.02 1gql h ALA 640 N 1.62 -0.24 -0.22 0.00 0.00 -1.90 -1.79 119.26 116.73 1gql h ALA 640 Ca 0.24 -0.22 -0.08 0.00 0.00 0.00 0.00 54.91 54.86 1gql h ALA 640 Cb 0.01 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 1gql h ALA 640 CO -0.06 -0.38 -0.20 0.00 0.00 0.00 0.00 179.25 178.60 1gql h ARG 641 N -0.74 0.40 0.02 0.00 3.08 -1.76 -1.25 114.38 114.12 1gql h ARG 641 Ca -0.02 -0.13 0.02 0.00 0.07 0.00 0.00 59.98 59.91 1gql h ARG 641 Cb 0.51 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.50 1gql h ARG 641 CO 0.04 0.59 -0.11 0.35 -1.07 0.00 0.00 179.97 179.77 1gql h PHE 642 N 0.36 -0.27 -0.63 3.04 3.57 -1.23 -1.10 116.94 120.68 1gql h PHE 642 Ca 0.06 0.01 -0.06 0.00 3.53 0.00 0.00 57.97 61.51 1gql h PHE 642 Cb 0.56 0.12 -0.03 0.00 2.79 0.00 0.00 35.95 39.40 1gql h PHE 642 CO 0.01 -0.16 0.14 0.00 -2.23 0.00 0.00 178.31 176.07 1gql h ALA 643 N 0.76 1.06 0.20 2.41 0.00 -1.01 -0.77 119.26 121.92 1gql h ALA 643 Ca 0.03 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.70 1gql h ALA 643 Cb 0.23 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.78 1gql h ALA 643 CO -0.09 0.62 -0.10 0.37 0.00 0.00 0.00 179.25 180.05 1gql h GLN 644 N 0.95 -0.26 -0.68 0.00 4.15 -1.05 -1.39 115.11 116.83 1gql h GLN 644 Ca 0.20 0.02 0.01 0.00 0.77 0.00 0.00 58.65 59.65 1gql h GLN 644 Cb 0.35 0.06 -0.04 0.00 0.21 0.00 0.00 27.48 28.07 1gql h GLN 644 CO 0.00 -0.01 0.45 0.28 -1.93 0.00 0.00 178.83 177.63 1gql h VAL 645 N -0.49 1.17 -0.42 2.39 2.07 -1.12 -0.52 116.25 119.33 1gql h VAL 645 Ca -0.03 -0.31 0.06 0.00 0.82 0.00 0.00 66.70 67.24 1gql h VAL 645 Cb 0.37 0.17 -0.05 0.00 -1.52 0.00 0.00 31.29 30.25 1gql h VAL 645 CO 0.04 0.17 0.11 0.50 0.02 0.00 0.00 177.57 178.41 1gql h LYS 646 N 0.92 0.24 -0.49 1.57 3.64 -1.04 -1.05 116.57 120.36 1gql h LYS 646 Ca 0.25 -0.01 -0.06 0.00 -1.27 0.00 0.00 60.65 59.56 1gql h LYS 646 Cb -0.09 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 31.65 1gql h LYS 646 CO -0.06 0.16 0.07 0.00 -2.27 0.00 0.00 179.45 177.35 1gql h ALA 647 N 1.30 0.65 -0.48 5.00 0.00 -0.79 -2.53 119.26 122.41 1gql h ALA 647 Ca 0.20 -0.24 -0.07 0.00 0.00 0.00 0.00 54.91 54.80 1gql h ALA 647 Cb 0.22 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 1gql h ALA 647 CO -0.24 0.40 0.03 -0.07 0.00 0.00 0.00 179.25 179.37 1gql h LEU 648 N 0.69 0.75 -1.31 0.00 3.38 -0.90 -1.76 115.31 116.16 1gql h LEU 648 Ca 0.15 -0.17 -0.05 0.00 0.09 0.00 0.00 57.88 57.90 1gql h LEU 648 Cb 0.41 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.95 1gql h LEU 648 CO 0.01 0.80 -0.09 -0.07 0.09 0.00 0.00 178.44 179.18 1gql h LEU 649 N 0.74 0.34 -0.35 1.67 3.38 -1.03 0.12 115.31 120.18 1gql h LEU 649 Ca 0.15 -0.07 -0.03 0.00 0.09 0.00 0.00 57.88 58.02 1gql h LEU 649 Cb 0.41 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 1gql h LEU 649 CO 0.01 0.47 0.12 1.56 0.09 0.00 0.00 178.44 180.69 1gql h GLN 650 N 0.34 0.54 -0.38 1.13 4.20 -0.92 -0.28 115.11 119.73 1gql h GLN 650 Ca 0.07 -0.11 0.00 0.00 0.06 0.00 0.00 58.65 58.67 1gql h GLN 650 Cb 0.37 -0.08 -0.02 0.00 0.30 0.00 0.00 27.48 28.05 1gql h GLN 650 CO 0.02 0.55 0.25 0.28 -0.67 0.00 0.00 178.83 179.27 1gql h VAL 651 N 0.41 1.10 -0.71 -0.54 2.07 -0.51 -2.32 116.25 115.74 1gql h VAL 651 Ca 0.11 -0.18 0.04 0.00 0.82 0.00 0.00 66.70 67.50 1gql h VAL 651 Cb 0.23 0.53 -0.05 0.00 -1.52 0.00 0.00 31.29 30.49 1gql h VAL 651 CO -0.01 0.09 0.43 -0.61 0.02 0.00 0.00 177.57 177.50 1gql h GLN 652 N 0.52 0.80 -0.62 1.57 4.15 -0.66 -0.59 115.11 120.28 1gql h GLN 652 Ca 0.14 -0.05 -0.04 0.00 0.77 0.00 0.00 58.65 59.47 1gql h GLN 652 Cb -0.06 -0.18 -0.03 0.00 0.21 0.00 0.00 27.48 27.42 1gql h GLN 652 CO -0.03 0.53 0.24 1.49 -1.93 0.00 0.00 178.83 179.13 1gql h GLU 653 N 0.82 0.94 -0.45 1.69 4.22 -0.78 0.24 114.58 121.26 1gql h GLU 653 Ca 0.30 -0.18 -0.04 0.00 0.08 0.00 0.00 59.36 59.52 1gql h GLU 653 Cb 0.09 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.17 1gql h GLU 653 CO -0.14 0.80 0.12 -0.09 -2.18 0.00 0.00 179.01 177.52 1gql h ARG 654 N 0.87 0.70 -0.23 1.92 2.43 -1.00 -1.11 114.38 117.97 1gql h ARG 654 Ca 0.21 -0.16 -0.11 0.00 -0.81 0.00 0.00 59.98 59.10 1gql h ARG 654 Cb 0.22 -0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 29.66 1gql h ARG 654 CO -0.02 0.69 -0.33 0.93 -1.51 0.00 0.00 179.97 179.74 1gql h GLU 655 N 0.59 0.49 -0.50 0.20 5.08 -0.85 -1.94 114.58 117.64 1gql h GLU 655 Ca 0.14 -0.21 -0.12 0.00 -1.00 0.00 0.00 59.36 58.17 1gql h GLU 655 Cb 0.30 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.52 1gql h GLU 655 CO -0.00 0.76 -0.16 0.00 -1.00 0.00 0.00 179.01 178.61 1gql h ALA 656 N 1.23 0.76 -0.72 3.43 0.00 -0.27 0.03 119.26 123.72 1gql h ALA 656 Ca 0.05 -0.37 -0.00 0.00 0.00 0.00 0.00 54.91 54.59 1gql h ALA 656 Cb 0.78 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 18.36 1gql h ALA 656 CO 0.06 0.67 0.44 0.28 0.00 0.00 0.00 179.25 180.70 1gql h VAL 657 N 0.86 1.20 -0.52 0.00 2.07 -1.09 0.34 116.25 119.12 1gql h VAL 657 Ca 0.12 -0.43 -0.00 0.00 0.82 0.00 0.00 66.70 67.21 1gql h VAL 657 Cb 0.73 0.19 -0.03 0.00 -1.52 0.00 0.00 31.29 30.66 1gql h VAL 657 CO 0.06 0.21 0.32 -0.09 0.02 0.00 0.00 177.57 178.08 1gql h ARG 658 N 0.98 0.69 0.26 1.57 2.43 -0.93 0.82 114.38 120.21 1gql h ARG 658 Ca 0.26 -0.06 -0.01 0.00 -0.81 0.00 0.00 59.98 59.36 1gql h ARG 658 Cb -0.05 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 29.36 1gql h ARG 658 CO -0.05 0.49 -0.13 -1.49 -1.51 0.00 0.00 179.97 177.28 1gql h TRP 659 N 0.69 -0.34 0.11 2.20 4.06 -0.72 -0.50 115.95 121.45 1gql h TRP 659 Ca 0.19 -0.01 0.02 0.00 2.06 0.00 0.00 58.89 61.15 1gql h TRP 659 Cb -0.03 0.11 -0.04 0.00 -1.00 0.00 0.00 29.16 28.20 1gql h TRP 659 CO -0.03 -0.21 -0.29 -0.09 -3.56 0.00 0.00 178.44 174.26 1gql h ARG 660 N -0.36 -0.48 -0.73 0.49 2.43 -0.76 -0.93 114.38 114.03 1gql h ARG 660 Ca -0.03 0.03 -0.02 0.00 -0.81 0.00 0.00 59.98 59.15 1gql h ARG 660 Cb 0.28 0.11 -0.03 0.00 -0.42 0.00 0.00 29.97 29.91 1gql h ARG 660 CO 0.05 -0.32 0.39 -0.91 -1.51 0.00 0.00 179.97 177.68 1gql h ASN 661 N -0.50 0.93 -0.45 -3.80 2.35 -0.79 -0.50 115.58 112.82 1gql h ASN 661 Ca 0.03 -0.10 -0.01 0.00 -0.55 0.00 0.00 56.30 55.67 1gql h ASN 661 Cb 0.53 -0.24 -0.02 0.00 0.05 0.00 0.00 38.32 38.64 1gql h ASN 661 CO -0.17 0.77 0.23 0.28 -1.65 0.00 0.00 177.43 176.88 1gql h SER 662 N 1.02 0.58 0.06 5.81 0.02 -0.81 -1.29 113.55 118.93 1gql h SER 662 Ca 0.26 -0.11 -0.16 0.00 -0.84 0.00 0.00 61.79 60.93 1gql h SER 662 Cb 0.05 -0.15 0.02 0.00 0.14 0.00 0.00 62.40 62.46 1gql h SER 662 CO -0.04 0.53 -0.68 0.00 -1.14 0.00 0.00 176.83 175.50 1gql h VAL 664 N -0.23 1.18 -0.55 0.00 2.07 -1.11 0.02 116.25 117.63 1gql h VAL 664 Ca -0.10 -0.53 -0.06 0.00 0.82 0.00 0.00 66.70 66.83 1gql h VAL 664 Cb 1.44 0.89 -0.02 0.00 -1.52 0.00 0.00 31.29 32.07 1gql h VAL 664 CO 0.13 0.19 0.12 -0.07 0.02 0.00 0.00 177.57 177.96 1gql h LEU 665 N 0.42 0.81 0.32 2.57 3.38 -1.30 0.12 115.31 121.62 1gql h LEU 665 Ca 0.12 -0.15 -0.02 0.00 0.09 0.00 0.00 57.88 57.92 1gql h LEU 665 Cb 0.16 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.70 1gql h LEU 665 CO -0.01 0.80 -0.15 0.22 0.09 0.00 0.00 178.44 179.39 1gql h TYR 666 N 0.82 -0.39 -0.23 1.13 3.20 -0.94 -1.01 116.97 119.55 1gql h TYR 666 Ca 0.18 -0.01 -0.04 0.00 3.14 0.00 0.00 58.73 62.00 1gql h TYR 666 Cb 0.33 0.13 -0.01 0.00 1.54 0.00 0.00 36.73 38.71 1gql h TYR 666 CO 0.02 -0.12 -0.02 0.74 -1.64 0.00 0.00 178.16 177.14 1gql h PHE 667 N -0.63 0.35 -0.69 -3.82 0.04 -0.89 -1.62 116.94 109.67 1gql h PHE 667 Ca -0.04 -0.03 -0.01 0.00 2.80 0.00 0.00 57.97 60.69 1gql h PHE 667 Cb 0.45 -0.10 -0.03 0.00 2.20 0.00 0.00 35.95 38.47 1gql h PHE 667 CO -0.00 0.37 0.40 0.37 -0.60 0.00 0.00 178.31 178.85 1gql h GLN 668 N 0.33 0.95 -0.08 1.51 4.15 -0.65 0.15 115.11 121.47 1gql h GLN 668 Ca 0.08 -0.09 -0.02 0.00 0.77 0.00 0.00 58.65 59.38 1gql h GLN 668 Cb 0.26 -0.19 -0.01 0.00 0.21 0.00 0.00 27.48 27.75 1gql h GLN 668 CO 0.01 0.69 -0.04 0.66 -1.93 0.00 0.00 178.83 178.21 1gql h SER 669 N 0.94 0.10 0.04 -0.69 4.64 -0.20 0.18 113.55 118.56 1gql h SER 669 Ca 0.25 -0.01 -0.14 0.00 -0.47 0.00 0.00 61.79 61.41 1gql h SER 669 Cb -0.01 -0.03 -0.01 0.00 -0.31 0.00 0.00 62.40 62.05 1gql h SER 669 CO -0.04 0.17 -0.73 0.58 -0.87 0.00 0.00 176.83 175.93 1gql h VAL 670 N 0.11 1.36 0.00 0.95 2.07 -1.08 -3.38 116.25 116.28 1gql h VAL 670 Ca 0.03 -2.33 -0.11 0.00 0.82 0.00 0.00 66.70 65.11 1gql h VAL 670 Cb 0.15 2.90 -0.02 0.00 -1.52 0.00 0.00 31.29 32.81 1gql h VAL 670 CO 0.01 0.55 -0.53 0.00 0.02 0.00 0.00 177.57 177.62 1gql h ALA 671 N -0.15 0.99 -4.25 1.67 0.00 -0.65 -3.23 119.26 113.64 1gql h ALA 671 Ca -0.18 -0.48 -0.31 0.00 0.00 0.00 0.00 54.91 53.94 1gql h ALA 671 Cb 1.31 -0.09 0.08 0.00 0.00 0.00 0.00 17.79 19.09 1gql h ALA 671 CO -0.04 0.67 -0.50 0.41 0.00 0.00 0.00 179.25 179.79 1gql n GLY 672 N 0.23 -0.21 3.45 0.00 0.00 0.64 -4.85 105.19 104.45 1gql n GLY 672 Ca -0.01 -0.01 -0.28 0.00 0.00 0.00 0.00 46.02 45.72 1gql n GLY 672 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1gql s ARG 673 N -5.78 1.62 0.43 1.61 0.52 -1.25 -5.10 118.95 110.99 1gql s ARG 673 Ca 0.37 -1.39 -0.17 0.00 -0.52 0.00 0.00 55.73 54.02 1gql s ARG 673 Cb -0.16 -1.95 -0.09 0.00 0.52 0.00 0.00 34.95 33.27 1gql s ARG 673 CO 0.45 0.43 0.88 -1.25 0.02 0.00 0.00 175.30 175.84 1gql s PRO 674 N -2.47 4.03 -0.15 3.54 0.04 -1.26 -4.84 135.00 133.88 1gql s PRO 674 Ca 0.19 0.87 -0.29 0.00 0.04 0.00 0.00 61.00 61.81 1gql s PRO 674 Cb -0.09 -2.26 -0.01 0.00 0.04 0.00 0.00 34.50 32.18 1gql s PRO 674 CO 0.10 -0.06 1.20 0.42 0.04 0.00 0.00 177.00 178.71 1gql s ILE 675 N -2.29 4.36 0.34 0.56 1.01 -1.26 -4.99 121.20 118.94 1gql s ILE 675 Ca 0.58 1.65 -0.26 0.00 0.00 0.00 0.00 60.65 62.62 1gql s ILE 675 Cb -0.10 -4.07 -0.13 0.00 0.01 0.00 0.00 42.46 38.17 1gql s ILE 675 CO 0.22 -0.12 0.82 -2.65 0.00 0.00 0.00 174.94 173.22 1gql n PRO 676 N 6.25 0.98 0.30 2.79 -0.02 -1.26 -4.85 135.00 139.19 1gql n PRO 676 Ca 0.13 0.35 0.16 0.00 -2.02 0.00 0.00 63.50 62.12 1gql n PRO 676 Cb 0.45 -1.69 0.94 0.00 -0.02 0.00 0.00 33.50 33.19 1gql n PRO 676 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1gql h ALA 677 N 1.44 1.43 -0.13 3.55 0.00 -2.03 -2.34 119.26 121.18 1gql h ALA 677 Ca -0.39 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 54.52 1gql h ALA 677 Cb 1.37 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.15 1gql h ALA 677 CO 0.57 0.01 0.09 -2.95 0.00 0.00 0.00 179.25 176.97 1gql h ASN 678 N 0.00 0.09 -3.71 0.00 -1.07 -2.04 -3.44 115.58 105.41 1gql h ASN 678 Ca -0.00 -0.00 -0.50 0.00 0.07 0.00 0.00 56.30 55.87 1gql h ASN 678 Cb 0.03 -0.02 -0.02 0.00 -2.07 0.00 0.00 38.32 36.24 1gql h ASN 678 CO 0.00 0.07 0.29 -0.31 0.07 0.00 0.00 177.43 177.55 1gql s TYR 679 N -5.15 3.88 0.08 4.14 2.02 -0.88 -5.00 117.35 116.43 1gql s TYR 679 Ca -0.06 1.78 -0.31 0.00 -0.37 0.00 0.00 57.07 58.12 1gql s TYR 679 Cb 0.17 -2.89 -0.08 0.00 -0.40 0.00 0.00 41.96 38.76 1gql s TYR 679 CO 0.69 0.41 1.60 -1.83 -1.57 0.00 0.00 175.55 174.85 1gql s GLU 680 N -1.43 4.22 0.19 -0.62 -1.05 -1.26 -4.95 118.70 113.80 1gql s GLU 680 Ca 0.42 2.28 -0.30 0.00 -0.15 0.00 0.00 54.97 57.22 1gql s GLU 680 Cb -0.23 -3.52 -0.08 0.00 -0.44 0.00 0.00 34.13 29.86 1gql s GLU 680 CO 0.28 -0.68 1.11 -1.14 0.95 0.00 0.00 175.26 175.78 1gql s GLN 681 N 2.34 4.59 0.24 -4.83 -0.44 -1.26 -4.94 119.66 115.35 1gql s GLN 681 Ca 0.72 1.75 -0.30 0.00 -2.50 0.00 0.00 55.36 55.02 1gql s GLN 681 Cb -0.39 -3.26 -0.14 0.00 -1.64 0.00 0.00 33.01 27.57 1gql s GLN 681 CO 0.31 0.08 1.16 -2.30 0.50 0.00 0.00 175.29 175.04 1gql n PRO 682 N 2.21 1.45 -0.41 1.67 -0.02 -1.26 -4.88 135.00 133.77 1gql n PRO 682 Ca 0.02 0.51 0.33 0.00 -2.02 0.00 0.00 63.50 62.35 1gql n PRO 682 Cb 0.46 -1.99 0.63 0.00 -0.02 0.00 0.00 33.50 32.57 1gql n PRO 682 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 1gql h GLU 683 N 2.95 0.16 0.00 -0.52 5.08 -1.99 -3.44 114.58 116.83 1gql h GLU 683 Ca -0.42 -0.01 -0.47 0.00 -1.00 0.00 0.00 59.36 57.46 1gql h GLU 683 Cb 1.33 -0.04 -0.12 0.00 0.50 0.00 0.00 28.75 30.42 1gql h GLU 683 CO 0.67 0.11 -0.45 0.72 -1.00 0.00 0.00 179.01 179.06 1gql n HIS 684 N -4.54 -0.64 -2.66 4.33 8.25 -1.26 -5.20 115.22 113.50 1gql n HIS 684 Ca 0.32 -2.67 -0.22 0.00 -0.26 0.00 0.00 57.72 54.89 1gql n HIS 684 Cb 1.26 0.24 0.07 0.00 1.12 0.00 0.00 29.99 32.69 1gql n HIS 684 CO 0.00 0.00 0.00 0.16 0.64 0.00 0.00 176.34 177.14 1gql s ASP 685 N -3.26 4.79 0.16 0.41 3.84 -1.26 -4.97 116.67 116.39 1gql s ASP 685 Ca 0.36 -0.29 -0.15 0.00 -0.00 0.00 0.00 52.55 52.47 1gql s ASP 685 Cb 0.02 -0.31 0.08 0.00 -1.38 0.00 0.00 42.92 41.33 1gql s ASP 685 CO 0.25 -1.52 1.78 0.25 -0.00 0.00 0.00 175.17 175.93 1gql h LEU 686 N -0.21 0.33 -1.44 2.11 5.85 -1.94 -1.84 115.31 118.17 1gql h LEU 686 Ca -0.38 0.02 0.08 0.00 0.84 0.00 0.00 57.88 58.45 1gql h LEU 686 Cb 1.28 -0.04 -0.05 0.00 0.37 0.00 0.00 40.66 42.22 1gql h LEU 686 CO 0.45 0.23 0.47 -0.08 -0.34 0.00 0.00 178.44 179.17 1gql h GLU 687 N 0.44 0.63 -0.70 1.25 4.57 -1.99 -0.44 114.58 118.35 1gql h GLU 687 Ca 0.18 -0.04 -0.05 0.00 -1.18 0.00 0.00 59.36 58.27 1gql h GLU 687 Cb 0.08 -0.14 -0.03 0.00 -0.16 0.00 0.00 28.75 28.50 1gql h GLU 687 CO -0.12 0.42 0.22 -0.92 -1.18 0.00 0.00 179.01 177.43 1gql h TYR 688 N 0.65 1.12 -0.05 0.92 5.03 -1.73 -1.86 116.97 121.05 1gql h TYR 688 Ca 0.32 -0.11 -0.15 0.00 2.58 0.00 0.00 58.73 61.37 1gql h TYR 688 Cb 0.40 -0.33 -0.01 0.00 1.55 0.00 0.00 36.73 38.34 1gql h TYR 688 CO -0.00 0.89 -0.65 1.88 -1.32 0.00 0.00 178.16 178.97 1gql h TYR 689 N 1.03 0.28 -0.23 -3.82 -1.99 -0.98 0.13 116.97 111.39 1gql h TYR 689 Ca 0.23 -0.12 -0.02 0.00 2.00 0.00 0.00 58.73 60.82 1gql h TYR 689 Cb 0.29 -0.05 -0.01 0.00 2.00 0.00 0.00 36.73 38.96 1gql h TYR 689 CO 0.02 0.80 0.04 0.87 -0.00 0.00 0.00 178.16 179.89 1gql h LYS 690 N 0.15 0.32 -0.08 4.88 1.57 -0.93 -0.49 116.57 121.99 1gql h LYS 690 Ca -0.01 -0.04 -0.05 0.00 -1.87 0.00 0.00 60.65 58.67 1gql h LYS 690 Cb 1.17 -0.06 -0.00 0.00 0.08 0.00 0.00 32.23 33.42 1gql h LYS 690 CO 0.10 0.32 -0.14 1.98 -0.57 0.00 0.00 179.45 181.13 1gql h MET 691 N 0.32 0.24 -0.14 3.15 4.05 -0.74 -3.18 114.93 118.63 1gql h MET 691 Ca 0.08 -0.15 0.04 0.00 -0.28 0.00 0.00 59.70 59.39 1gql h MET 691 Cb 0.16 0.02 -0.01 0.00 -0.80 0.00 0.00 31.60 30.97 1gql h MET 691 CO -0.00 0.73 0.11 -0.07 0.23 0.00 0.00 176.91 177.90 1gql h LEU 692 N -0.21 0.00 -1.94 3.39 3.38 -0.46 -0.98 115.31 118.49 1gql h LEU 692 Ca 0.01 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 1gql h LEU 692 Cb 0.71 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.46 1gql h LEU 692 CO 0.03 0.00 -0.12 0.00 0.09 0.00 0.00 178.44 178.45 1gql h ALA 693 N 1.92 1.44 0.00 1.53 0.00 -1.08 -0.30 119.26 122.77 1gql h ALA 693 Ca 0.07 -0.11 -0.13 0.00 0.00 0.00 0.00 54.91 54.74 1gql h ALA 693 Cb 0.28 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 1gql h ALA 693 CO -0.00 0.14 -1.69 0.54 0.00 0.00 0.00 179.25 178.24 1gql n ARG 694 N -3.86 0.64 -0.00 0.00 1.74 -0.47 -4.35 116.66 110.36 1gql n ARG 694 Ca -0.02 0.05 0.10 0.00 -0.77 0.00 0.00 57.85 57.20 1gql n ARG 694 Cb 0.21 -1.68 -0.13 0.00 -1.02 0.00 0.00 32.46 29.84 1gql n ARG 694 CO 0.00 0.00 0.00 2.41 -1.52 0.00 0.00 177.63 178.52 1gql n THR 695 N -2.65 0.00 -2.63 0.55 -1.04 -0.63 -4.91 114.28 102.97 1gql n THR 695 Ca -0.11 -0.19 -0.41 0.00 -2.04 0.00 0.00 64.05 61.30 1gql n THR 695 Cb 0.78 0.64 -0.03 0.00 -1.82 0.00 0.00 70.33 69.90 1gql n THR 695 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 1gql s THR 696 N -3.11 3.87 -0.21 12.58 2.01 -0.14 -4.90 115.64 125.75 1gql s THR 696 Ca 0.02 0.20 -0.19 0.00 0.31 0.00 0.00 61.69 62.03 1gql s THR 696 Cb 0.15 -4.87 -0.08 0.00 0.01 0.00 0.00 72.50 67.71 1gql s THR 696 CO 0.84 -1.76 0.73 0.00 -0.69 0.00 0.00 174.62 173.74 1gql n TYR 697 N 8.96 0.66 -2.87 4.92 9.36 -1.26 -4.83 117.16 132.10 1gql n TYR 697 Ca 0.02 0.43 -0.43 0.00 3.32 0.00 0.00 57.90 61.24 1gql n TYR 697 Cb 0.48 -0.93 -0.05 0.00 -0.63 0.00 0.00 39.34 38.22 1gql n TYR 697 CO 0.00 0.00 0.00 0.08 0.22 0.00 0.00 176.86 177.16 1gql s VAL 698 N 1.60 4.51 -1.31 2.97 1.01 -1.26 -4.99 120.40 122.92 1gql s VAL 698 Ca 0.45 0.51 -0.14 0.00 0.00 0.00 0.00 61.98 62.81 1gql s VAL 698 Cb -0.62 -4.43 0.11 0.00 0.00 0.00 0.00 36.38 31.45 1gql s VAL 698 CO 0.32 -0.87 1.81 -0.81 0.00 0.00 0.00 175.10 175.55 1gql n PRO 699 N 7.09 3.27 -3.70 2.72 -0.04 -1.26 -4.87 135.00 138.21 1gql n PRO 699 Ca 0.04 -3.34 -0.12 0.00 -0.04 0.00 0.00 63.50 60.04 1gql n PRO 699 Cb 0.48 -3.19 -0.10 0.00 -0.04 0.00 0.00 33.50 30.66 1gql n PRO 699 CO 0.00 0.00 0.00 -1.83 -0.04 0.00 0.00 175.50 173.63 1gql s GLU 700 N 2.33 0.53 0.10 0.54 -1.05 -1.26 -4.86 118.70 115.03 1gql s GLU 700 Ca 0.46 0.74 -0.16 0.00 -0.15 0.00 0.00 54.97 55.86 1gql s GLU 700 Cb 0.06 0.18 -0.06 0.00 -0.44 0.00 0.00 34.13 33.87 1gql s GLU 700 CO 0.00 -0.10 1.50 -1.35 0.95 0.00 0.00 175.26 176.26 1gql h PRO 701 N 5.96 0.61 -6.98 -4.83 0.11 -1.89 -3.44 132.00 121.54 1gql h PRO 701 Ca -0.30 -0.24 -0.52 0.00 0.11 0.00 0.00 66.00 65.05 1gql h PRO 701 Cb 1.18 -0.03 0.08 0.00 0.11 0.00 0.00 31.00 32.34 1gql h PRO 701 CO 0.23 0.80 0.54 -0.46 -0.21 0.00 0.00 178.00 178.90 1gql s TRP 702 N -4.75 2.83 0.07 0.65 -0.00 -1.26 -5.06 118.94 111.42 1gql s TRP 702 Ca -0.13 1.48 0.05 0.00 -0.00 0.00 0.00 56.10 57.50 1gql s TRP 702 Cb 0.09 -3.52 -0.03 0.00 -0.00 0.00 0.00 33.47 30.00 1gql s TRP 702 CO 0.79 -1.81 -0.13 -3.38 -0.00 0.00 0.00 176.95 172.41 1gql s HIS 703 N -1.40 1.16 0.79 5.86 -3.43 -1.26 -4.99 115.29 112.03 1gql s HIS 703 Ca 0.61 -0.48 -0.11 0.00 -0.80 0.00 0.00 55.06 54.27 1gql s HIS 703 Cb -0.33 -0.65 0.07 0.00 -1.43 0.00 0.00 32.58 30.24 1gql s HIS 703 CO 0.42 0.04 1.12 -2.14 -2.00 0.00 0.00 174.74 172.18 1gql s PRO 704 N -1.86 1.98 0.00 -0.38 0.02 -1.26 -5.14 135.00 128.36 1gql s PRO 704 Ca -0.02 1.35 0.07 0.00 0.02 0.00 0.00 61.00 62.42 1gql s PRO 704 Cb -0.09 -1.85 0.42 0.00 0.02 0.00 0.00 34.50 33.00 1gql s PRO 704 CO 0.02 -1.88 0.88 0.00 -0.33 0.00 0.00 177.00 175.70