#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1glq s PRO 2 N 0.00 0.95 -0.13 0.52 0.04 -1.26 -3.36 135.00 131.75 1glq s PRO 2 Ca 0.00 1.22 -0.01 0.00 0.04 0.00 0.00 61.00 62.25 1glq s PRO 2 Cb 0.00 -1.74 -0.02 0.00 0.04 0.00 0.00 34.50 32.78 1glq s PRO 2 CO 0.00 -2.57 -0.11 0.71 0.04 0.00 0.00 177.00 175.07 1glq s TYR 3 N -2.72 2.86 -0.04 0.56 2.02 -1.26 -1.17 117.35 117.61 1glq s TYR 3 Ca 0.65 -0.53 0.03 0.00 -0.37 0.00 0.00 57.07 56.85 1glq s TYR 3 Cb -0.21 -1.86 0.00 0.00 -0.40 0.00 0.00 41.96 39.49 1glq s TYR 3 CO 0.59 -0.15 -0.12 0.99 -1.57 0.00 0.00 175.55 175.29 1glq s THR 4 N 0.30 1.00 -0.16 -0.71 2.01 -0.44 -0.87 115.64 116.76 1glq s THR 4 Ca -0.08 -0.47 -0.03 0.00 0.31 0.00 0.00 61.69 61.42 1glq s THR 4 Cb -0.15 -0.88 -0.02 0.00 0.01 0.00 0.00 72.50 71.45 1glq s THR 4 CO 0.05 0.30 -0.06 -0.63 -0.69 0.00 0.00 174.62 173.59 1glq s ILE 5 N 0.22 3.60 -0.26 1.82 1.01 -0.08 -0.89 121.20 126.62 1glq s ILE 5 Ca -0.05 -0.46 -0.03 0.00 0.00 0.00 0.00 60.65 60.12 1glq s ILE 5 Cb -0.10 -2.57 0.02 0.00 0.01 0.00 0.00 42.46 39.81 1glq s ILE 5 CO 0.01 0.49 -0.02 -0.69 0.00 0.00 0.00 174.94 174.73 1glq s VAL 6 N 0.53 3.20 0.19 2.92 1.01 0.21 -0.54 120.40 127.93 1glq s VAL 6 Ca -0.05 -0.90 -0.20 0.00 0.00 0.00 0.00 61.98 60.83 1glq s VAL 6 Cb -0.15 -2.62 0.04 0.00 0.00 0.00 0.00 36.38 33.65 1glq s VAL 6 CO 0.03 0.18 0.58 -0.47 0.00 0.00 0.00 175.10 175.42 1glq s TYR 7 N 1.38 -0.28 0.82 5.22 5.04 -0.95 -1.87 117.35 126.70 1glq s TYR 7 Ca 0.01 -0.03 -0.13 0.00 -2.44 0.00 0.00 57.07 54.48 1glq s TYR 7 Cb -0.17 0.50 0.09 0.00 0.35 0.00 0.00 41.96 42.74 1glq s TYR 7 CO -0.02 -0.94 1.18 -0.06 -1.34 0.00 0.00 175.55 174.37 1glq s PHE 8 N -3.83 1.85 -0.63 4.97 0.08 -1.26 -0.89 117.98 118.27 1glq s PHE 8 Ca 0.06 1.69 -0.06 0.00 0.12 0.00 0.00 56.93 58.74 1glq s PHE 8 Cb -0.02 -3.42 -0.13 0.00 -0.57 0.00 0.00 43.02 38.89 1glq s PHE 8 CO -0.05 -2.72 2.62 -0.35 -0.10 0.00 0.00 175.22 174.62 1glq n PRO 9 N -3.44 2.14 -4.18 0.24 -0.04 -1.25 -4.80 135.00 123.65 1glq n PRO 9 Ca 0.13 -1.27 -0.11 0.00 -0.04 0.00 0.00 63.50 62.21 1glq n PRO 9 Cb 0.51 -2.25 -0.10 0.00 -0.04 0.00 0.00 33.50 31.62 1glq n PRO 9 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1glq s VAL 10 N 2.25 0.11 -0.03 0.52 -7.23 -1.26 -4.37 120.40 110.39 1glq s VAL 10 Ca 0.51 -1.96 -0.12 0.00 -1.81 0.00 0.00 61.98 58.60 1glq s VAL 10 Cb 0.18 -2.27 -0.07 0.00 0.56 0.00 0.00 36.38 34.79 1glq s VAL 10 CO -0.02 -0.25 0.58 0.03 -0.31 0.00 0.00 175.10 175.13 1glq h ARG 11 N 2.73 -0.41 0.00 4.82 3.08 -0.90 -3.45 114.38 120.24 1glq h ARG 11 Ca -0.36 0.03 0.00 0.00 0.07 0.00 0.00 59.98 59.72 1glq h ARG 11 Cb 1.22 0.09 0.00 0.00 0.08 0.00 0.00 29.97 31.37 1glq h ARG 11 CO 0.57 -0.28 0.00 0.41 -1.07 0.00 0.00 179.97 179.60 1glq n GLY 12 N 0.48 2.12 0.33 0.04 0.00 0.40 -1.25 105.19 107.31 1glq n GLY 12 Ca -0.05 0.22 0.06 0.00 0.00 0.00 0.00 46.02 46.25 1glq n GLY 12 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1glq n ARG 13 N 13.25 1.42 0.00 1.61 1.74 -1.26 -4.03 116.66 129.38 1glq n ARG 13 Ca 0.00 -0.65 0.03 0.00 -0.77 0.00 0.00 57.85 56.46 1glq n ARG 13 Cb 0.00 -1.23 -0.03 0.00 -1.02 0.00 0.00 32.46 30.18 1glq n ARG 13 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1glq h GLU 15 N 0.09 0.45 -0.61 0.00 4.57 -1.62 -1.84 114.58 115.63 1glq h GLU 15 Ca 0.00 -0.21 -0.09 0.00 -1.18 0.00 0.00 59.36 57.88 1glq h GLU 15 Cb 0.14 -0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 28.70 1glq h GLU 15 CO 0.00 0.76 0.02 0.00 -1.18 0.00 0.00 179.01 178.61 1glq h ALA 16 N 1.22 0.88 -0.00 2.92 0.00 -1.85 -1.06 119.26 121.37 1glq h ALA 16 Ca 0.04 -0.30 -0.15 0.00 0.00 0.00 0.00 54.91 54.50 1glq h ALA 16 Cb 0.83 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.37 1glq h ALA 16 CO 0.07 0.66 -0.71 0.00 0.00 0.00 0.00 179.25 179.27 1glq h MET 17 N 0.97 0.01 -0.34 0.00 -0.00 -1.81 -1.43 114.93 112.33 1glq h MET 17 Ca 0.18 -0.01 -0.05 0.00 -0.00 0.00 0.00 59.70 59.81 1glq h MET 17 Cb 0.53 0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 32.12 1glq h MET 17 CO 0.03 0.72 0.01 0.00 -0.00 0.00 0.00 176.91 177.67 1glq h ARG 18 N 0.01 0.60 -0.77 -0.10 3.08 -1.07 -1.49 114.38 114.64 1glq h ARG 18 Ca -0.01 -0.18 -0.04 0.00 0.07 0.00 0.00 59.98 59.82 1glq h ARG 18 Cb 1.25 -0.06 -0.03 0.00 0.08 0.00 0.00 29.97 31.21 1glq h ARG 18 CO 0.09 0.71 0.33 0.52 -1.07 0.00 0.00 179.97 180.56 1glq h MET 19 N 0.41 1.12 0.13 0.04 2.86 -1.02 -0.82 114.93 117.66 1glq h MET 19 Ca 0.10 -0.18 0.00 0.00 -2.06 0.00 0.00 59.70 57.56 1glq h MET 19 Cb 0.43 -0.19 -0.01 0.00 0.06 0.00 0.00 31.60 31.89 1glq h MET 19 CO 0.02 0.89 -0.11 1.25 1.06 0.00 0.00 176.91 180.01 1glq h LEU 20 N 1.10 -0.30 -0.64 1.22 6.46 -1.15 -1.11 115.31 120.90 1glq h LEU 20 Ca 0.26 0.03 -0.04 0.00 -0.12 0.00 0.00 57.88 58.01 1glq h LEU 20 Cb 0.17 0.10 -0.03 0.00 -0.73 0.00 0.00 40.66 40.17 1glq h LEU 20 CO -0.03 -0.18 0.26 -0.07 -0.62 0.00 0.00 178.44 177.80 1glq h LEU 21 N -0.26 0.88 -0.26 2.25 3.38 -1.05 -2.03 115.31 118.21 1glq h LEU 21 Ca 0.00 -0.17 -0.00 0.00 0.09 0.00 0.00 57.88 57.80 1glq h LEU 21 Cb 0.24 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 1glq h LEU 21 CO -0.02 0.81 0.15 0.00 0.09 0.00 0.00 178.44 179.46 1glq h ALA 22 N 1.11 0.34 0.00 1.53 0.00 -1.03 -0.87 119.26 120.32 1glq h ALA 22 Ca 0.21 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 1glq h ALA 22 Cb 0.20 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 17.88 1glq h ALA 22 CO -0.02 -0.15 -0.06 0.22 0.00 0.00 0.00 179.25 179.24 1glq h ASP 23 N 0.32 0.00 -0.63 0.00 3.58 -1.05 -1.55 116.42 117.10 1glq h ASP 23 Ca 0.09 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.54 1glq h ASP 23 Cb 0.04 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.09 1glq h ASP 23 CO -0.02 0.06 0.00 0.00 -2.88 0.00 0.00 179.24 176.41 1glq n GLN 24 N -3.29 3.36 -2.75 0.28 1.13 -0.78 -4.94 117.38 110.39 1glq n GLN 24 Ca -0.01 -2.63 -0.18 0.00 -1.94 0.00 0.00 57.00 52.24 1glq n GLN 24 Cb 0.25 -1.79 0.02 0.00 0.11 0.00 0.00 30.24 28.83 1glq n GLN 24 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1glq n GLY 25 N 1.20 -0.31 3.95 1.08 0.00 -0.58 -5.02 105.19 105.52 1glq n GLY 25 Ca 0.24 -0.07 -0.24 0.00 0.00 0.00 0.00 46.02 45.95 1glq n GLY 25 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1glq s GLN 26 N -5.33 3.43 0.23 1.61 -1.52 -0.39 -5.03 119.66 112.67 1glq s GLN 26 Ca 0.19 -0.68 0.10 0.00 -1.95 0.00 0.00 55.36 53.02 1glq s GLN 26 Cb -0.08 -2.92 -0.04 0.00 -0.22 0.00 0.00 33.01 29.74 1glq s GLN 26 CO 0.23 0.48 -0.09 -1.54 -0.25 0.00 0.00 175.29 174.13 1glq s SER 27 N -3.59 4.20 0.16 5.90 1.04 -1.26 -4.44 113.70 115.71 1glq s SER 27 Ca 0.34 -0.71 -0.13 0.00 0.48 0.00 0.00 55.95 55.94 1glq s SER 27 Cb -0.10 -0.67 0.01 0.00 0.10 0.00 0.00 66.02 65.36 1glq s SER 27 CO 0.29 0.05 0.36 -1.66 0.98 0.00 0.00 173.24 173.26 1glq s TRP 28 N -2.10 0.10 -0.13 5.02 -2.14 -1.26 -4.48 118.94 113.94 1glq s TRP 28 Ca 0.28 -0.46 -0.05 0.00 2.66 0.00 0.00 56.10 58.54 1glq s TRP 28 Cb -0.07 0.14 -0.04 0.00 -3.10 0.00 0.00 33.47 30.40 1glq s TRP 28 CO 0.17 -0.75 0.03 0.21 -2.66 0.00 0.00 176.95 173.94 1glq s LYS 29 N -3.89 3.49 -0.32 3.25 2.20 -0.05 -5.00 119.74 119.41 1glq s LYS 29 Ca 0.10 -0.38 -0.13 0.00 -0.36 0.00 0.00 55.97 55.20 1glq s LYS 29 Cb 0.02 -2.99 -0.03 0.00 -1.51 0.00 0.00 37.83 33.32 1glq s LYS 29 CO -0.05 0.48 0.28 -1.21 -0.36 0.00 0.00 175.35 174.50 1glq s GLU 30 N -0.25 3.70 -0.41 4.03 0.41 -1.26 -0.91 118.70 124.01 1glq s GLU 30 Ca 0.07 -0.41 -0.13 0.00 -0.41 0.00 0.00 54.97 54.09 1glq s GLU 30 Cb -0.12 -3.75 0.04 0.00 -1.78 0.00 0.00 34.13 28.52 1glq s GLU 30 CO 0.02 -0.38 0.28 -2.00 -0.49 0.00 0.00 175.26 172.69 1glq s GLU 31 N 1.86 2.88 -0.10 1.61 2.12 0.30 -4.97 118.70 122.41 1glq s GLU 31 Ca 0.09 -1.15 -0.22 0.00 0.36 0.00 0.00 54.97 54.05 1glq s GLU 31 Cb -0.17 -3.90 -0.03 0.00 0.26 0.00 0.00 34.13 30.29 1glq s GLU 31 CO 0.11 -0.80 0.66 0.08 -0.54 0.00 0.00 175.26 174.77 1glq s VAL 32 N 1.60 5.06 -0.21 3.70 1.01 -1.26 -2.23 120.40 128.07 1glq s VAL 32 Ca 0.04 1.34 -0.05 0.00 0.00 0.00 0.00 61.98 63.31 1glq s VAL 32 Cb -0.20 -4.00 -0.02 0.00 0.00 0.00 0.00 36.38 32.16 1glq s VAL 32 CO 0.07 0.23 -0.01 -0.69 0.00 0.00 0.00 175.10 174.70 1glq s VAL 33 N 0.99 3.73 0.51 2.92 1.01 -0.07 -4.94 120.40 124.54 1glq s VAL 33 Ca 0.34 -0.38 -0.12 0.00 0.00 0.00 0.00 61.98 61.83 1glq s VAL 33 Cb -0.17 -2.69 -0.06 0.00 0.00 0.00 0.00 36.38 33.46 1glq s VAL 33 CO 0.15 0.42 0.91 0.42 0.00 0.00 0.00 175.10 177.01 1glq s THR 34 N 1.24 4.70 0.25 3.92 -4.23 -1.26 -3.91 115.64 116.36 1glq s THR 34 Ca 0.03 0.82 -0.02 0.00 -1.18 0.00 0.00 61.69 61.34 1glq s THR 34 Cb -0.15 -3.78 0.23 0.00 1.34 0.00 0.00 72.50 70.14 1glq s THR 34 CO 0.00 -0.79 1.74 0.40 -0.54 0.00 0.00 174.62 175.43 1glq h ILE 35 N 0.53 0.68 -0.54 2.99 2.04 -1.99 0.36 117.51 121.58 1glq h ILE 35 Ca -0.46 -0.18 -0.06 0.00 1.00 0.00 0.00 64.86 65.16 1glq h ILE 35 Cb 1.19 0.12 -0.02 0.00 -0.74 0.00 0.00 36.82 37.36 1glq h ILE 35 CO 0.62 0.09 0.09 -2.24 0.00 0.00 0.00 178.15 176.72 1glq h ASP 36 N 0.52 0.86 -0.38 1.72 2.03 -1.99 0.12 116.42 119.29 1glq h ASP 36 Ca 0.44 -0.26 -0.05 0.00 -0.73 0.00 0.00 57.03 56.44 1glq h ASP 36 Cb 0.66 -0.23 -0.01 0.00 -0.83 0.00 0.00 39.33 38.92 1glq h ASP 36 CO -0.39 0.90 0.06 0.74 -1.03 0.00 0.00 179.24 179.52 1glq h THR 37 N 0.78 1.24 -0.72 1.15 2.02 -1.80 -3.00 112.91 112.58 1glq h THR 37 Ca 0.16 -0.85 0.01 0.00 0.77 0.00 0.00 66.41 66.51 1glq h THR 37 Cb 0.40 1.06 -0.04 0.00 -1.74 0.00 0.00 68.15 67.83 1glq h THR 37 CO 0.01 0.29 0.47 -0.25 0.37 0.00 0.00 175.52 176.41 1glq h TRP 38 N 0.48 0.89 0.00 3.16 2.91 -0.39 -2.08 115.95 120.92 1glq h TRP 38 Ca 0.12 0.02 -0.01 0.00 1.13 0.00 0.00 58.89 60.15 1glq h TRP 38 Cb 0.36 -0.30 -0.00 0.00 -0.51 0.00 0.00 29.16 28.71 1glq h TRP 38 CO 0.02 0.55 -0.04 0.52 -1.03 0.00 0.00 178.44 178.47 1glq h MET 39 N 0.95 0.00 0.00 2.65 2.86 -0.70 -0.31 114.93 120.38 1glq h MET 39 Ca 0.27 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.90 1glq h MET 39 Cb -0.07 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.58 1glq h MET 39 CO -0.07 0.04 -0.08 1.96 1.06 0.00 0.00 176.91 179.81 1glq h GLN 40 N 0.00 0.00 0.00 1.72 4.20 -1.23 -3.47 115.11 116.33 1glq h GLN 40 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1glq h GLN 40 Cb 0.09 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.87 1glq h GLN 40 CO 0.00 0.08 0.00 0.41 -0.67 0.00 0.00 178.83 178.66 1glq n GLY 41 N -0.93 0.59 0.08 3.46 0.00 -0.13 -4.96 105.19 103.30 1glq n GLY 41 Ca -0.02 -0.12 -0.06 0.00 0.00 0.00 0.00 46.02 45.81 1glq n GLY 41 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1glq h LEU 42 N 0.00 0.00 0.13 0.99 4.07 -1.82 -3.39 115.31 115.29 1glq h LEU 42 Ca 0.00 0.00 -0.35 0.00 0.08 0.00 0.00 57.88 57.61 1glq h LEU 42 Cb 0.00 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 41.73 1glq h LEU 42 CO 0.00 0.92 -1.88 0.25 -1.08 0.00 0.00 178.44 176.65 1glq h LEU 43 N 0.00 0.42 -0.73 1.67 5.85 -1.88 -3.39 115.31 117.25 1glq h LEU 43 Ca -0.16 -0.83 0.16 0.00 0.84 0.00 0.00 57.88 57.88 1glq h LEU 43 Cb 1.85 -0.14 -0.13 0.00 0.37 0.00 0.00 40.66 42.61 1glq h LEU 43 CO 0.09 1.74 -0.03 0.50 -0.34 0.00 0.00 178.44 180.39 1glq h LYS 44 N 0.07 0.08 -0.04 1.25 3.64 -1.87 0.18 116.57 119.89 1glq h LYS 44 Ca -0.38 -0.00 0.01 0.00 -1.27 0.00 0.00 60.65 59.01 1glq h LYS 44 Cb 2.05 -0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 33.85 1glq h LYS 44 CO 0.11 0.05 0.05 -1.35 -2.27 0.00 0.00 179.45 176.04 1glq h PRO 45 N 0.08 0.00 0.00 1.90 0.11 -1.77 -1.56 132.00 130.77 1glq h PRO 45 Ca 0.39 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.50 1glq h PRO 45 Cb 0.66 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.77 1glq h PRO 45 CO -0.66 0.00 -0.32 0.25 -0.21 0.00 0.00 178.00 177.06 1glq n THR 46 N -3.75 0.13 -2.86 -1.15 -2.24 0.04 -4.83 114.28 99.62 1glq n THR 46 Ca -0.02 -0.08 -0.40 0.00 -2.27 0.00 0.00 64.05 61.27 1glq n THR 46 Cb 0.14 -0.14 -0.05 0.00 -2.10 0.00 0.00 70.33 68.18 1glq n THR 46 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1glq h LEU 48 N 5.73 -0.23 -3.26 0.00 5.85 -1.86 -1.33 115.31 120.20 1glq h LEU 48 Ca -0.43 0.14 0.00 0.00 0.84 0.00 0.00 57.88 58.43 1glq h LEU 48 Cb 1.21 0.24 0.00 0.00 0.37 0.00 0.00 40.66 42.48 1glq h LEU 48 CO 0.72 -0.09 0.00 -1.22 -0.34 0.00 0.00 178.44 177.50 1glq n TYR 49 N -5.25 1.04 -1.18 1.25 4.01 -1.26 -4.95 117.16 110.82 1glq n TYR 49 Ca 0.08 -0.83 -0.06 0.00 -0.16 0.00 0.00 57.90 56.93 1glq n TYR 49 Cb 0.33 -0.31 -0.03 0.00 -0.31 0.00 0.00 39.34 39.02 1glq n TYR 49 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1glq n GLY 50 N -0.29 0.81 3.29 2.72 0.00 -0.50 -4.98 105.19 106.24 1glq n GLY 50 Ca 0.21 -0.37 -0.16 0.00 0.00 0.00 0.00 46.02 45.71 1glq n GLY 50 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1glq s GLN 51 N -2.13 1.36 0.21 1.61 -0.21 -1.26 -4.88 119.66 114.35 1glq s GLN 51 Ca 0.00 -1.73 0.08 0.00 0.02 0.00 0.00 55.36 53.74 1glq s GLN 51 Cb 0.00 -0.19 -0.04 0.00 1.00 0.00 0.00 33.01 33.78 1glq s GLN 51 CO 0.00 -0.29 -0.02 -0.51 -2.12 0.00 0.00 175.29 172.35 1glq s LEU 52 N -3.28 3.22 0.63 2.90 1.43 -1.26 -4.69 118.68 117.62 1glq s LEU 52 Ca 0.37 -0.51 -0.17 0.00 -1.03 0.00 0.00 54.13 52.79 1glq s LEU 52 Cb 0.08 -1.83 -0.02 0.00 0.03 0.00 0.00 46.19 44.45 1glq s LEU 52 CO 0.13 0.06 1.13 -2.16 0.23 0.00 0.00 176.35 175.74 1glq s PRO 53 N -3.19 2.92 -0.01 1.29 0.04 -1.26 -4.98 135.00 129.81 1glq s PRO 53 Ca 0.28 1.52 0.07 0.00 0.04 0.00 0.00 61.00 62.92 1glq s PRO 53 Cb -0.08 -1.96 -0.02 0.00 0.04 0.00 0.00 34.50 32.48 1glq s PRO 53 CO 0.18 -1.18 -0.23 0.21 0.04 0.00 0.00 177.00 176.03 1glq s LYS 54 N -3.78 2.14 -0.02 4.56 2.20 -0.78 -3.99 119.74 120.07 1glq s LYS 54 Ca 0.70 -0.91 0.02 0.00 -0.36 0.00 0.00 55.97 55.41 1glq s LYS 54 Cb -0.23 -2.11 0.01 0.00 -1.51 0.00 0.00 37.83 33.99 1glq s LYS 54 CO 0.37 0.56 -0.05 0.12 -0.36 0.00 0.00 175.35 175.99 1glq s PHE 55 N -0.69 0.65 -0.13 4.03 5.36 -0.02 -0.62 117.98 126.56 1glq s PHE 55 Ca 0.11 -0.15 0.00 0.00 -0.96 0.00 0.00 56.93 55.93 1glq s PHE 55 Cb -0.10 -0.51 -0.01 0.00 -0.34 0.00 0.00 43.02 42.05 1glq s PHE 55 CO 0.00 -0.10 -0.14 -1.21 -1.46 0.00 0.00 175.22 172.31 1glq s GLU 56 N 0.38 3.34 -0.34 10.12 2.02 -0.06 -0.62 118.70 133.53 1glq s GLU 56 Ca -0.05 -0.71 0.02 0.00 0.02 0.00 0.00 54.97 54.25 1glq s GLU 56 Cb -0.09 -2.60 0.10 0.00 0.10 0.00 0.00 34.13 31.64 1glq s GLU 56 CO -0.00 0.18 0.09 0.34 0.02 0.00 0.00 175.26 175.89 1glq s ASP 57 N 0.41 4.38 1.85 -0.19 -1.08 -0.03 -1.33 116.67 120.68 1glq s ASP 57 Ca -0.11 -2.02 0.00 0.00 -0.52 0.00 0.00 52.55 49.90 1glq s ASP 57 Cb -0.16 -1.29 0.00 0.00 -1.46 0.00 0.00 42.92 40.01 1glq s ASP 57 CO 0.05 -0.38 0.00 0.61 0.52 0.00 0.00 175.17 175.97 1glq n GLY 58 N 4.40 3.76 1.17 2.66 0.00 -0.32 -1.50 105.19 115.35 1glq n GLY 58 Ca 0.02 -0.02 0.10 0.00 0.00 0.00 0.00 46.02 46.12 1glq n GLY 58 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1glq n ASP 59 N 7.74 3.39 -4.70 1.61 5.75 -1.26 -4.82 116.55 124.26 1glq n ASP 59 Ca 0.00 -1.99 -0.36 0.00 -0.01 0.00 0.00 54.79 52.42 1glq n ASP 59 Cb 0.00 -0.41 -0.08 0.00 -1.03 0.00 0.00 41.12 39.60 1glq n ASP 59 CO 0.00 0.00 0.00 -0.22 -0.11 0.00 0.00 177.20 176.87 1glq s LEU 60 N -1.05 4.18 -0.10 -2.12 2.96 -0.57 -5.08 118.68 116.91 1glq s LEU 60 Ca 0.42 0.34 -0.01 0.00 -0.22 0.00 0.00 54.13 54.67 1glq s LEU 60 Cb 0.22 -2.27 -0.03 0.00 0.50 0.00 0.00 46.19 44.62 1glq s LEU 60 CO 0.29 0.07 -0.07 -0.89 -1.32 0.00 0.00 176.35 174.43 1glq s THR 61 N 0.78 3.65 0.09 3.68 2.01 -1.26 -0.85 115.64 123.73 1glq s THR 61 Ca 0.13 -0.48 0.04 0.00 0.31 0.00 0.00 61.69 61.69 1glq s THR 61 Cb -0.13 -2.53 -0.03 0.00 0.01 0.00 0.00 72.50 69.82 1glq s THR 61 CO 0.04 0.56 -0.11 -0.76 -0.69 0.00 0.00 174.62 173.65 1glq s LEU 62 N -0.30 2.36 0.32 4.42 1.43 0.20 -4.98 118.68 122.14 1glq s LEU 62 Ca 0.04 -0.74 0.04 0.00 -1.03 0.00 0.00 54.13 52.44 1glq s LEU 62 Cb -0.13 -0.37 -0.06 0.00 0.03 0.00 0.00 46.19 45.66 1glq s LEU 62 CO 0.02 -0.20 0.05 -0.31 0.23 0.00 0.00 176.35 176.15 1glq s TYR 63 N -2.03 1.96 0.01 0.29 2.02 -1.26 -0.84 117.35 117.49 1glq s TYR 63 Ca 0.03 -0.95 0.00 0.00 -0.37 0.00 0.00 57.07 55.78 1glq s TYR 63 Cb -0.05 -1.27 0.00 0.00 -0.40 0.00 0.00 41.96 40.24 1glq s TYR 63 CO 0.01 0.01 0.00 1.04 -1.57 0.00 0.00 175.55 175.04 1glq n GLN 64 N -0.68 -0.56 -0.30 -0.62 1.13 -1.26 -4.55 117.38 110.54 1glq n GLN 64 Ca -0.02 0.85 0.06 0.00 -1.94 0.00 0.00 57.00 55.95 1glq n GLN 64 Cb 0.66 -0.78 0.27 0.00 0.11 0.00 0.00 30.24 30.50 1glq n GLN 64 CO 0.00 0.00 0.00 0.66 -1.44 0.00 0.00 177.06 176.28 1glq h SER 65 N 0.45 0.86 1.31 1.08 4.64 -1.90 -1.11 113.55 118.88 1glq h SER 65 Ca 0.00 0.02 -0.13 0.00 -0.47 0.00 0.00 61.79 61.21 1glq h SER 65 Cb 0.00 -0.16 -0.02 0.00 -0.31 0.00 0.00 62.40 61.91 1glq h SER 65 CO 0.00 0.52 -0.71 0.78 -0.87 0.00 0.00 176.83 176.54 1glq h ASN 66 N 0.96 0.00 0.28 4.97 2.35 -1.93 -1.79 115.58 120.41 1glq h ASN 66 Ca 0.42 0.00 -0.15 0.00 -0.55 0.00 0.00 56.30 56.02 1glq h ASN 66 Cb 0.34 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.70 1glq h ASN 66 CO -0.18 0.57 -0.57 0.00 -1.65 0.00 0.00 177.43 175.60 1glq h ALA 67 N 1.43 0.84 -0.19 -0.83 0.00 -1.54 -1.94 119.26 117.02 1glq h ALA 67 Ca -0.03 -0.52 -0.03 0.00 0.00 0.00 0.00 54.91 54.33 1glq h ALA 67 Cb 1.46 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 19.16 1glq h ALA 67 CO 0.07 0.71 0.02 0.82 0.00 0.00 0.00 179.25 180.86 1glq h ILE 68 N 0.23 1.24 -0.63 0.00 2.04 -1.05 -1.35 117.51 117.99 1glq h ILE 68 Ca -0.00 -0.79 0.03 0.00 1.00 0.00 0.00 64.86 65.10 1glq h ILE 68 Cb 1.08 1.39 -0.04 0.00 -0.74 0.00 0.00 36.82 38.50 1glq h ILE 68 CO 0.09 0.24 0.38 -0.07 0.00 0.00 0.00 178.15 178.80 1glq h LEU 69 N 0.11 0.61 -0.94 1.44 3.38 -1.30 -0.97 115.31 117.64 1glq h LEU 69 Ca 0.06 0.01 -0.10 0.00 0.09 0.00 0.00 57.88 57.94 1glq h LEU 69 Cb 0.35 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 1glq h LEU 69 CO 0.01 0.42 -0.26 0.03 0.09 0.00 0.00 178.44 178.73 1glq h ARG 70 N 0.74 0.47 0.01 1.13 3.08 -1.31 -0.71 114.38 117.79 1glq h ARG 70 Ca 0.26 -0.18 -0.00 0.00 0.07 0.00 0.00 59.98 60.13 1glq h ARG 70 Cb 0.05 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.07 1glq h ARG 70 CO -0.12 0.69 -0.01 1.25 -1.07 0.00 0.00 179.97 180.72 1glq h HIS 71 N 0.41 -0.02 -0.85 3.04 2.76 -0.87 -0.27 115.15 119.36 1glq h HIS 71 Ca 0.06 -0.00 -0.01 0.00 -2.20 0.00 0.00 60.37 58.22 1glq h HIS 71 Cb 0.67 0.01 -0.04 0.00 1.55 0.00 0.00 27.41 29.60 1glq h HIS 71 CO 0.02 0.30 0.49 -0.07 -1.30 0.00 0.00 177.93 177.37 1glq h LEU 72 N -0.33 1.04 -0.78 0.26 3.38 -1.04 -0.19 115.31 117.65 1glq h LEU 72 Ca -0.00 -0.08 -0.01 0.00 0.09 0.00 0.00 57.88 57.88 1glq h LEU 72 Cb 0.32 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.77 1glq h LEU 72 CO 0.00 0.82 0.45 1.23 0.09 0.00 0.00 178.44 181.03 1glq h GLY 73 N 1.19 1.15 0.42 0.83 0.00 -0.97 0.09 103.07 105.78 1glq h GLY 73 Ca 0.30 -0.50 -0.04 0.00 0.00 0.00 0.00 47.33 47.10 1glq h GLY 73 CO -0.05 0.48 -0.14 -0.09 0.00 0.00 0.00 176.54 176.74 1glq h ARG 74 N 1.07 0.12 0.00 4.80 2.43 -0.70 0.39 114.38 122.49 1glq h ARG 74 Ca 0.28 -0.11 -0.08 0.00 -0.81 0.00 0.00 59.98 59.26 1glq h ARG 74 Cb -0.01 0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.56 1glq h ARG 74 CO -0.05 0.81 -0.39 0.66 -1.51 0.00 0.00 179.97 179.48 1glq h SER 75 N -0.53 0.00 -0.65 -3.80 4.64 -0.97 -3.05 113.55 109.19 1glq h SER 75 Ca -0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 1glq h SER 75 Cb 0.84 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.93 1glq h SER 75 CO 0.03 0.39 0.00 0.18 -0.87 0.00 0.00 176.83 176.56 1glq n LEU 76 N -3.50 4.12 -1.82 5.97 4.77 0.01 -4.97 117.00 121.59 1glq n LEU 76 Ca -0.00 -2.18 -0.13 0.00 -0.03 0.00 0.00 56.01 53.68 1glq n LEU 76 Cb 0.53 -0.49 0.02 0.00 -2.33 0.00 0.00 43.42 41.15 1glq n LEU 76 CO 0.37 0.89 0.01 0.61 -1.33 0.00 0.00 177.39 177.94 1glq n GLY 77 N 1.29 0.01 2.45 -0.72 0.00 -0.92 -4.95 105.19 102.34 1glq n GLY 77 Ca 0.23 -0.27 -0.30 0.00 0.00 0.00 0.00 46.02 45.69 1glq n GLY 77 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1glq n LEU 78 N -2.41 5.83 -1.93 0.99 7.99 0.13 -4.67 117.00 122.93 1glq n LEU 78 Ca -0.06 -4.89 -0.01 0.00 -0.01 0.00 0.00 56.01 51.04 1glq n LEU 78 Cb 0.57 -0.64 0.06 0.00 -0.11 0.00 0.00 43.42 43.29 1glq n LEU 78 CO 0.27 1.99 0.10 0.00 -1.51 0.00 0.00 177.39 178.24 1glq n TYR 79 N -0.61 0.86 0.00 -1.77 4.19 -1.21 -1.40 117.16 117.22 1glq n TYR 79 Ca 0.47 -1.49 0.00 0.00 3.31 0.00 0.00 57.90 60.19 1glq n TYR 79 Cb 0.64 -0.22 0.00 0.00 0.49 0.00 0.00 39.34 40.25 1glq n TYR 79 CO 0.00 0.00 0.00 0.41 0.91 0.00 0.00 176.86 178.18 1glq n GLY 80 N -0.31 -1.08 0.07 2.98 0.00 -1.26 -4.18 105.19 101.42 1glq n GLY 80 Ca 0.14 -1.63 0.00 0.00 0.00 0.00 0.00 46.02 44.53 1glq n GLY 80 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1glq n LYS 81 N -1.13 0.66 -3.26 1.61 5.02 -1.26 -4.96 118.16 114.84 1glq n LYS 81 Ca 0.00 0.01 -0.10 0.00 -2.02 0.00 0.00 58.31 56.20 1glq n LYS 81 Cb 0.00 -1.62 -0.01 0.00 -0.02 0.00 0.00 35.03 33.38 1glq n LYS 81 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 1glq n ASN 82 N -2.64 -1.22 -0.18 4.39 0.23 -1.26 -5.07 115.26 109.52 1glq n ASN 82 Ca -0.16 -2.34 -0.06 0.00 -0.53 0.00 0.00 54.58 51.49 1glq n ASN 82 Cb 0.86 2.17 0.10 0.00 -2.08 0.00 0.00 39.78 40.83 1glq n ASN 82 CO 0.00 0.00 0.00 1.56 -0.93 0.00 0.00 177.26 177.89 1glq h GLN 83 N 0.00 0.97 -0.48 -3.83 4.20 -1.96 -2.13 115.11 111.89 1glq h GLN 83 Ca -0.22 -0.26 -0.02 0.00 0.06 0.00 0.00 58.65 58.22 1glq h GLN 83 Cb 0.89 -0.11 -0.02 0.00 0.30 0.00 0.00 27.48 28.53 1glq h GLN 83 CO 0.29 0.92 0.23 -0.09 -0.67 0.00 0.00 178.83 179.51 1glq h ARG 84 N 0.91 0.69 -0.32 1.46 2.43 -1.99 -1.94 114.38 115.61 1glq h ARG 84 Ca 0.18 -0.10 -0.01 0.00 -0.81 0.00 0.00 59.98 59.24 1glq h ARG 84 Cb 0.44 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 29.85 1glq h ARG 84 CO 0.02 0.58 0.17 0.93 -1.51 0.00 0.00 179.97 180.15 1glq h GLU 85 N 0.63 0.46 -0.68 0.20 5.08 -1.91 -1.73 114.58 116.62 1glq h GLU 85 Ca 0.16 -0.06 0.06 0.00 -1.00 0.00 0.00 59.36 58.53 1glq h GLU 85 Cb 0.11 -0.09 -0.06 0.00 0.50 0.00 0.00 28.75 29.22 1glq h GLU 85 CO -0.02 0.41 0.38 0.00 -1.00 0.00 0.00 179.01 178.78 1glq h ALA 86 N 1.03 0.92 -0.47 3.43 0.00 -1.21 -0.78 119.26 122.17 1glq h ALA 86 Ca 0.11 0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.98 1glq h ALA 86 Cb 0.09 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 1glq h ALA 86 CO -0.02 0.06 0.05 0.00 0.00 0.00 0.00 179.25 179.34 1glq h ALA 87 N 1.36 0.63 -0.63 0.00 0.00 -1.13 -1.51 119.26 117.97 1glq h ALA 87 Ca 0.31 -0.25 -0.04 0.00 0.00 0.00 0.00 54.91 54.93 1glq h ALA 87 Cb 0.20 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 1glq h ALA 87 CO -0.19 0.39 0.23 1.96 0.00 0.00 0.00 179.25 181.63 1glq h GLN 88 N 0.66 0.94 -0.53 0.00 4.20 -0.97 -1.69 115.11 117.72 1glq h GLN 88 Ca 0.14 -0.17 -0.11 0.00 0.06 0.00 0.00 58.65 58.58 1glq h GLN 88 Cb 0.43 -0.16 -0.02 0.00 0.30 0.00 0.00 27.48 28.04 1glq h GLN 88 CO 0.01 0.79 -0.09 0.52 -0.67 0.00 0.00 178.83 179.39 1glq h MET 89 N 0.92 0.98 -0.73 1.46 2.86 -0.84 -1.47 114.93 118.10 1glq h MET 89 Ca 0.21 -0.35 -0.06 0.00 -2.06 0.00 0.00 59.70 57.44 1glq h MET 89 Cb 0.22 -0.07 -0.03 0.00 0.06 0.00 0.00 31.60 31.78 1glq h MET 89 CO -0.01 1.02 0.21 -0.44 1.06 0.00 0.00 176.91 178.74 1glq h ASP 90 N 0.88 1.08 -0.50 1.22 3.32 -0.91 -1.16 116.42 120.34 1glq h ASP 90 Ca 0.14 -0.22 0.01 0.00 0.02 0.00 0.00 57.03 56.98 1glq h ASP 90 Cb 0.64 -0.28 -0.03 0.00 0.22 0.00 0.00 39.33 39.88 1glq h ASP 90 CO 0.04 1.02 0.33 -0.03 -1.72 0.00 0.00 179.24 178.88 1glq h MET 91 N 1.10 0.65 0.21 3.56 1.85 -1.06 0.35 114.93 121.59 1glq h MET 91 Ca 0.23 -0.04 -0.01 0.00 -0.61 0.00 0.00 59.70 59.27 1glq h MET 91 Cb 0.34 -0.15 0.00 0.00 0.43 0.00 0.00 31.60 32.22 1glq h MET 91 CO -0.00 0.43 -0.10 0.28 -0.40 0.00 0.00 176.91 177.12 1glq h VAL 92 N 0.67 0.84 -0.73 -5.77 2.07 -1.13 -1.86 116.25 110.34 1glq h VAL 92 Ca 0.19 -0.19 -0.03 0.00 0.82 0.00 0.00 66.70 67.48 1glq h VAL 92 Cb -0.07 0.95 -0.03 0.00 -1.52 0.00 0.00 31.29 30.62 1glq h VAL 92 CO -0.05 0.05 0.33 -1.13 0.02 0.00 0.00 177.57 176.79 1glq h ASN 93 N -0.37 0.96 -0.61 0.57 -1.24 -1.00 0.15 115.58 114.03 1glq h ASN 93 Ca -0.03 -0.12 -0.05 0.00 0.71 0.00 0.00 56.30 56.81 1glq h ASN 93 Cb 0.29 -0.25 -0.03 0.00 0.73 0.00 0.00 38.32 39.06 1glq h ASN 93 CO 0.05 0.82 0.18 0.44 -1.29 0.00 0.00 177.43 177.63 1glq h ASP 94 N 1.04 0.92 -0.57 1.15 5.19 -0.88 -0.70 116.42 122.58 1glq h ASP 94 Ca 0.25 -0.17 -0.07 0.00 -0.62 0.00 0.00 57.03 56.42 1glq h ASP 94 Cb 0.13 -0.24 -0.03 0.00 0.18 0.00 0.00 39.33 39.38 1glq h ASP 94 CO -0.03 0.88 0.10 1.23 -3.12 0.00 0.00 179.24 178.30 1glq h GLY 95 N 1.04 1.05 0.94 2.75 0.00 -0.54 -1.58 103.07 106.73 1glq h GLY 95 Ca 0.21 -0.67 -0.00 0.00 0.00 0.00 0.00 47.33 46.87 1glq h GLY 95 CO -0.00 0.62 0.06 -2.08 0.00 0.00 0.00 176.54 175.13 1glq h VAL 96 N 0.92 1.08 -0.97 4.60 2.07 -0.63 -2.83 116.25 120.50 1glq h VAL 96 Ca 0.19 -0.22 0.08 0.00 0.82 0.00 0.00 66.70 67.58 1glq h VAL 96 Cb 0.40 1.04 -0.07 0.00 -1.52 0.00 0.00 31.29 31.13 1glq h VAL 96 CO 0.01 0.07 0.61 -0.08 0.02 0.00 0.00 177.57 178.20 1glq h GLU 97 N 0.08 1.03 -0.41 1.57 4.57 -0.93 0.11 114.58 120.60 1glq h GLU 97 Ca 0.04 -0.06 0.01 0.00 -1.18 0.00 0.00 59.36 58.17 1glq h GLU 97 Cb 0.06 -0.23 -0.03 0.00 -0.16 0.00 0.00 28.75 28.39 1glq h GLU 97 CO -0.01 0.68 0.25 -0.44 -1.18 0.00 0.00 179.01 178.32 1glq h ASP 98 N 1.06 0.41 0.49 1.04 5.19 -1.19 0.84 116.42 124.26 1glq h ASP 98 Ca 0.44 -0.00 -0.17 0.00 -0.62 0.00 0.00 57.03 56.68 1glq h ASP 98 Cb 0.28 -0.09 -0.01 0.00 0.18 0.00 0.00 39.33 39.69 1glq h ASP 98 CO -0.21 0.30 -0.73 0.25 -3.12 0.00 0.00 179.24 175.73 1glq h LEU 99 N 0.51 0.24 -0.45 1.55 5.85 -1.19 -2.71 115.31 119.11 1glq h LEU 99 Ca 0.16 -0.16 -0.01 0.00 0.84 0.00 0.00 57.88 58.70 1glq h LEU 99 Cb -0.01 -0.07 -0.02 0.00 0.37 0.00 0.00 40.66 40.93 1glq h LEU 99 CO -0.06 0.88 0.23 -0.09 -0.34 0.00 0.00 178.44 179.06 1glq h ARG 100 N 0.13 0.64 -0.82 1.25 2.43 -0.32 -0.51 114.38 117.18 1glq h ARG 100 Ca -0.02 -0.09 0.09 0.00 -0.81 0.00 0.00 59.98 59.15 1glq h ARG 100 Cb 1.29 -0.12 -0.07 0.00 -0.42 0.00 0.00 29.97 30.65 1glq h ARG 100 CO 0.11 0.53 0.47 0.78 -1.51 0.00 0.00 179.97 180.35 1glq h GLY 101 N 0.59 1.26 1.00 2.80 0.00 -0.71 -0.48 103.07 107.52 1glq h GLY 101 Ca 0.16 -0.32 -0.04 0.00 0.00 0.00 0.00 47.33 47.13 1glq h GLY 101 CO -0.02 0.15 0.21 0.50 0.00 0.00 0.00 176.54 177.38 1glq h LYS 102 N 0.81 0.89 -0.38 4.80 1.57 -1.10 -2.18 116.57 120.99 1glq h LYS 102 Ca 0.39 -0.17 -0.02 0.00 -1.87 0.00 0.00 60.65 58.98 1glq h LYS 102 Cb 0.33 -0.14 -0.02 0.00 0.08 0.00 0.00 32.23 32.48 1glq h LYS 102 CO -0.23 0.78 0.17 -0.92 -0.57 0.00 0.00 179.45 178.68 1glq h TYR 103 N 0.82 0.56 -0.41 -1.35 3.20 -0.22 -1.38 116.97 118.19 1glq h TYR 103 Ca 0.19 -0.03 0.03 0.00 3.14 0.00 0.00 58.73 62.06 1glq h TYR 103 Cb 0.24 -0.17 -0.03 0.00 1.54 0.00 0.00 36.73 38.30 1glq h TYR 103 CO 0.01 0.49 0.21 0.28 -1.64 0.00 0.00 178.16 177.51 1glq h VAL 104 N 0.47 0.99 -0.52 1.81 2.07 -1.01 -1.05 116.25 119.01 1glq h VAL 104 Ca 0.13 -0.15 0.01 0.00 0.82 0.00 0.00 66.70 67.51 1glq h VAL 104 Cb 0.15 0.52 -0.03 0.00 -1.52 0.00 0.00 31.29 30.42 1glq h VAL 104 CO -0.01 0.08 0.33 0.74 0.02 0.00 0.00 177.57 178.73 1glq h THR 105 N 0.43 1.11 0.28 2.57 2.02 -1.10 -0.88 112.91 117.33 1glq h THR 105 Ca 0.17 -0.23 -0.00 0.00 0.77 0.00 0.00 66.41 67.12 1glq h THR 105 Cb 0.07 0.37 -0.01 0.00 -1.74 0.00 0.00 68.15 66.84 1glq h THR 105 CO -0.11 0.12 -0.22 0.25 0.37 0.00 0.00 175.52 175.93 1glq h LEU 106 N 0.67 -0.56 -0.25 2.58 5.85 -0.72 -0.91 115.31 121.99 1glq h LEU 106 Ca 0.20 0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.96 1glq h LEU 106 Cb -0.05 0.18 -0.01 0.00 0.37 0.00 0.00 40.66 41.15 1glq h LEU 106 CO -0.06 -0.33 0.16 0.40 -0.34 0.00 0.00 178.44 178.26 1glq h ILE 107 N -0.51 1.08 0.00 4.05 5.03 -0.93 0.01 117.51 126.24 1glq h ILE 107 Ca -0.02 -0.17 -0.01 0.00 -0.12 0.00 0.00 64.86 64.55 1glq h ILE 107 Cb 0.44 0.75 -0.00 0.00 -3.03 0.00 0.00 36.82 34.98 1glq h ILE 107 CO -0.01 0.08 -0.84 1.88 -0.68 0.00 0.00 178.15 178.58 1glq h TYR 108 N 0.32 0.00 0.00 1.37 0.05 -1.15 -3.40 116.97 114.16 1glq h TYR 108 Ca 0.09 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.87 1glq h TYR 108 Cb -0.01 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.73 1glq h TYR 108 CO -0.05 0.03 -0.41 0.25 -1.05 0.00 0.00 178.16 176.93 1glq n THR 109 N -2.77 0.00 -2.68 -2.88 -2.24 -0.35 -4.94 114.28 98.42 1glq n THR 109 Ca 0.00 -0.19 -0.03 0.00 -2.27 0.00 0.00 64.05 61.56 1glq n THR 109 Cb 0.56 0.68 0.12 0.00 -2.10 0.00 0.00 70.33 69.60 1glq n THR 109 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1glq n ASN 110 N -0.99 -1.35 0.13 3.42 5.15 -0.14 -5.00 115.26 116.48 1glq n ASN 110 Ca 0.00 -2.26 -0.13 0.00 -0.60 0.00 0.00 54.58 51.59 1glq n ASN 110 Cb 0.00 0.67 -0.08 0.00 -0.53 0.00 0.00 39.78 39.84 1glq n ASN 110 CO 0.00 0.00 0.00 0.22 1.40 0.00 0.00 177.26 178.88 1glq h TYR 111 N 1.30 -0.31 -0.60 1.20 3.20 -1.41 0.34 116.97 120.68 1glq h TYR 111 Ca -0.40 -0.01 -0.09 0.00 3.14 0.00 0.00 58.73 61.38 1glq h TYR 111 Cb 1.30 0.10 -0.02 0.00 1.54 0.00 0.00 36.73 39.65 1glq h TYR 111 CO 0.01 -0.00 0.04 0.93 -1.64 0.00 0.00 178.16 177.49 1glq h GLU 112 N -0.64 1.02 0.00 1.82 3.07 -1.94 -2.46 114.58 115.46 1glq h GLU 112 Ca -0.03 -0.30 -0.02 0.00 -0.50 0.00 0.00 59.36 58.50 1glq h GLU 112 Cb 0.45 -0.11 -0.00 0.00 -0.84 0.00 0.00 28.75 28.25 1glq h GLU 112 CO 0.06 0.98 -1.27 0.09 -1.40 0.00 0.00 179.01 177.46 1glq n ASN 113 N -4.20 0.66 -0.25 1.42 4.13 -1.23 -4.38 115.26 111.43 1glq n ASN 113 Ca 0.03 0.26 0.09 0.00 1.68 0.00 0.00 54.58 56.64 1glq n ASN 113 Cb 0.32 0.74 -0.04 0.00 -1.54 0.00 0.00 39.78 39.26 1glq n ASN 113 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1glq n GLY 114 N 1.23 -0.28 0.06 7.41 0.00 0.12 -4.68 105.19 109.06 1glq n GLY 114 Ca -0.02 -0.52 -0.11 0.00 0.00 0.00 0.00 46.02 45.37 1glq n GLY 114 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1glq h LYS 115 N 1.20 -0.02 -0.11 1.61 3.64 -1.57 -1.70 116.57 119.63 1glq h LYS 115 Ca 0.00 0.00 0.03 0.00 -1.27 0.00 0.00 60.65 59.41 1glq h LYS 115 Cb 0.54 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.33 1glq h LYS 115 CO 0.00 -0.01 -0.08 -0.97 -2.27 0.00 0.00 179.45 176.11 1glq h ASN 116 N -0.02 -0.26 -0.65 4.20 -0.73 -1.86 -0.16 115.58 116.10 1glq h ASN 116 Ca 0.02 0.06 0.06 0.00 1.87 0.00 0.00 56.30 58.31 1glq h ASN 116 Cb 0.05 0.13 -0.06 0.00 0.27 0.00 0.00 38.32 38.72 1glq h ASN 116 CO -0.05 -0.11 0.36 0.44 -0.37 0.00 0.00 177.43 177.70 1glq h ASP 117 N -0.09 0.52 0.14 1.15 3.32 -1.82 -0.26 116.42 119.38 1glq h ASP 117 Ca 0.07 0.03 -0.01 0.00 0.02 0.00 0.00 57.03 57.15 1glq h ASP 117 Cb 0.19 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 39.68 1glq h ASP 117 CO -0.16 0.33 -0.07 0.22 -1.72 0.00 0.00 179.24 177.84 1glq h TYR 118 N 0.66 -0.18 -0.40 4.55 5.03 -0.70 -1.51 116.97 124.41 1glq h TYR 118 Ca 0.30 -0.00 -0.05 0.00 2.58 0.00 0.00 58.73 61.55 1glq h TYR 118 Cb 0.20 0.06 -0.02 0.00 1.55 0.00 0.00 36.73 38.52 1glq h TYR 118 CO -0.08 -0.11 0.04 0.28 -1.32 0.00 0.00 178.16 176.97 1glq h VAL 119 N -0.20 1.20 -0.29 1.81 2.07 -0.77 0.88 116.25 120.96 1glq h VAL 119 Ca -0.02 -0.78 -0.07 0.00 0.82 0.00 0.00 66.70 66.65 1glq h VAL 119 Cb 0.15 0.86 -0.02 0.00 -1.52 0.00 0.00 31.29 30.76 1glq h VAL 119 CO 0.03 0.28 -0.11 0.50 0.02 0.00 0.00 177.57 178.29 1glq h LYS 120 N 0.59 0.48 0.00 1.57 3.64 -0.70 -2.97 116.57 119.18 1glq h LYS 120 Ca 0.13 -0.13 -0.07 0.00 -1.27 0.00 0.00 60.65 59.31 1glq h LYS 120 Cb 0.31 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.07 1glq h LYS 120 CO 0.01 0.59 -0.54 0.00 -2.27 0.00 0.00 179.45 177.24 1glq h ALA 121 N 1.45 0.75 -0.93 5.00 0.00 -0.40 -3.39 119.26 121.73 1glq h ALA 121 Ca 0.08 -0.32 0.14 0.00 0.00 0.00 0.00 54.91 54.82 1glq h ALA 121 Cb 0.46 0.00 -0.09 0.00 0.00 0.00 0.00 17.79 18.16 1glq h ALA 121 CO 0.03 0.41 0.54 1.25 0.00 0.00 0.00 179.25 181.48 1glq h LEU 122 N 0.00 0.73 -0.95 0.00 5.85 -0.69 -2.25 115.31 118.01 1glq h LEU 122 Ca -0.02 0.08 0.13 0.00 0.84 0.00 0.00 57.88 58.90 1glq h LEU 122 Cb 1.25 -0.06 -0.09 0.00 0.37 0.00 0.00 40.66 42.14 1glq h LEU 122 CO 0.04 0.33 0.57 -0.65 -0.34 0.00 0.00 178.44 178.39 1glq h PRO 123 N 0.79 0.84 0.00 5.25 0.11 -1.77 0.21 132.00 137.43 1glq h PRO 123 Ca 0.50 -0.05 -0.04 0.00 0.11 0.00 0.00 66.00 66.52 1glq h PRO 123 Cb 0.64 -0.19 -0.01 0.00 0.11 0.00 0.00 31.00 31.55 1glq h PRO 123 CO -0.33 0.56 -0.17 0.78 -0.21 0.00 0.00 178.00 178.63 1glq h GLY 124 N 0.87 0.00 1.33 -0.55 0.00 -1.71 -0.82 103.07 102.18 1glq h GLY 124 Ca 0.48 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.81 1glq h GLY 124 CO -0.29 0.00 -0.62 0.45 0.00 0.00 0.00 176.54 176.07 1glq h HIS 125 N 0.00 0.00 0.00 5.60 3.86 -0.60 -3.38 115.15 120.63 1glq h HIS 125 Ca -0.00 0.00 -0.29 0.00 -1.16 0.00 0.00 60.37 58.92 1glq h HIS 125 Cb 0.54 0.00 -0.05 0.00 1.06 0.00 0.00 27.41 28.96 1glq h HIS 125 CO 0.00 0.00 -1.78 1.28 0.86 0.00 0.00 177.93 178.29 1glq n LEU 126 N -2.63 0.74 -0.34 2.43 4.77 -0.44 -4.43 117.00 117.10 1glq n LEU 126 Ca 0.02 0.35 0.19 0.00 -0.03 0.00 0.00 56.01 56.54 1glq n LEU 126 Cb 0.51 0.21 0.41 0.00 -2.33 0.00 0.00 43.42 42.22 1glq n LEU 126 CO 0.37 0.37 1.17 0.50 -1.33 0.00 0.00 177.39 178.47 1glq h LYS 127 N 0.00 0.51 -0.92 3.23 1.63 -1.39 -1.36 116.57 118.27 1glq h LYS 127 Ca -0.31 -0.03 0.03 0.00 -0.85 0.00 0.00 60.65 59.49 1glq h LYS 127 Cb 1.99 -0.12 -0.05 0.00 -0.60 0.00 0.00 32.23 33.46 1glq h LYS 127 CO 0.07 0.34 0.61 -1.35 -3.45 0.00 0.00 179.45 175.66 1glq h PRO 128 N 0.53 1.16 -0.10 1.90 0.11 -1.82 -1.37 132.00 132.40 1glq h PRO 128 Ca 0.65 -0.07 -0.18 0.00 0.11 0.00 0.00 66.00 66.51 1glq h PRO 128 Cb 1.32 -0.26 -0.00 0.00 0.11 0.00 0.00 31.00 32.17 1glq h PRO 128 CO -0.46 0.76 -0.71 0.74 -0.21 0.00 0.00 178.00 178.12 1glq h PHE 129 N 1.19 0.62 -0.40 0.65 0.04 -1.54 0.39 116.94 117.89 1glq h PHE 129 Ca 0.35 -0.27 0.01 0.00 2.80 0.00 0.00 57.97 60.87 1glq h PHE 129 Cb -0.05 -0.10 -0.02 0.00 2.20 0.00 0.00 35.95 37.98 1glq h PHE 129 CO -0.00 1.02 0.26 1.49 -0.60 0.00 0.00 178.31 180.48 1glq h GLU 130 N 0.32 0.51 -0.55 1.51 4.57 -1.15 -1.72 114.58 118.07 1glq h GLU 130 Ca -0.03 -0.03 -0.02 0.00 -1.18 0.00 0.00 59.36 58.11 1glq h GLU 130 Cb 1.28 -0.11 -0.03 0.00 -0.16 0.00 0.00 28.75 29.73 1glq h GLU 130 CO 0.13 0.33 0.28 1.15 -1.18 0.00 0.00 179.01 179.72 1glq h THR 131 N 0.52 1.19 -0.30 0.32 2.02 -1.00 -1.14 112.91 114.52 1glq h THR 131 Ca 0.15 -0.51 0.00 0.00 0.77 0.00 0.00 66.41 66.82 1glq h THR 131 Cb -0.04 0.53 -0.01 0.00 -1.74 0.00 0.00 68.15 66.88 1glq h THR 131 CO -0.04 0.21 0.19 -0.07 0.37 0.00 0.00 175.52 176.18 1glq h LEU 132 N 0.74 0.36 -0.69 2.58 3.38 -0.72 -2.29 115.31 118.67 1glq h LEU 132 Ca 0.19 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.14 1glq h LEU 132 Cb 0.08 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 40.71 1glq h LEU 132 CO -0.03 0.28 0.44 -0.07 0.09 0.00 0.00 178.44 179.15 1glq h LEU 133 N 0.40 0.80 -1.78 1.67 3.38 -1.08 -1.71 115.31 117.00 1glq h LEU 133 Ca 0.11 -0.04 -0.03 0.00 0.09 0.00 0.00 57.88 58.01 1glq h LEU 133 Cb -0.02 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 40.52 1glq h LEU 133 CO -0.02 0.60 -0.16 0.77 0.09 0.00 0.00 178.44 179.72 1glq h SER 134 N 0.93 0.00 0.98 -0.43 4.64 -0.91 0.63 113.55 119.40 1glq h SER 134 Ca 0.25 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.57 1glq h SER 134 Cb -0.08 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.01 1glq h SER 134 CO -0.05 0.16 -0.12 0.00 -0.87 0.00 0.00 176.83 175.95 1glq n GLN 135 N -3.91 0.06 -3.43 4.77 6.02 -0.70 -3.27 117.38 116.92 1glq n GLN 135 Ca -0.02 0.04 -0.44 0.00 -0.01 0.00 0.00 57.00 56.57 1glq n GLN 135 Cb 0.25 -1.56 -0.04 0.00 1.02 0.00 0.00 30.24 29.91 1glq n GLN 135 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.06 177.26 1glq s ASN 136 N -3.31 6.30 -1.53 1.08 3.04 0.01 -4.66 114.94 115.87 1glq s ASN 136 Ca 0.13 -2.56 -0.06 0.00 0.04 0.00 0.00 52.86 50.41 1glq s ASN 136 Cb 0.17 -2.12 0.01 0.00 -1.54 0.00 0.00 41.25 37.77 1glq s ASN 136 CO 0.58 -0.57 0.67 0.00 -3.04 0.00 0.00 177.10 174.74 1glq n GLN 137 N 4.10 -5.16 -1.90 0.43 6.02 -1.26 -0.99 117.38 118.62 1glq n GLN 137 Ca 0.08 0.87 -0.20 0.00 -0.01 0.00 0.00 57.00 57.74 1glq n GLN 137 Cb 0.44 -5.75 -0.05 0.00 1.02 0.00 0.00 30.24 25.89 1glq n GLN 137 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1glq n GLY 138 N -1.56 0.94 2.03 1.08 0.00 -1.20 -1.87 105.19 104.61 1glq n GLY 138 Ca -0.09 -0.06 -0.00 0.00 0.00 0.00 0.00 46.02 45.86 1glq n GLY 138 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1glq n GLY 139 N -0.74 0.46 0.02 -0.02 0.00 -0.01 -4.75 105.19 100.15 1glq n GLY 139 Ca -0.21 -0.58 0.12 0.00 0.00 0.00 0.00 46.02 45.34 1glq n GLY 139 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1glq n LYS 140 N -2.92 0.12 0.00 1.61 2.85 -0.78 -4.86 118.16 114.18 1glq n LYS 140 Ca -0.00 0.03 0.00 0.00 -1.05 0.00 0.00 58.31 57.28 1glq n LYS 140 Cb 0.02 -1.57 0.00 0.00 -0.65 0.00 0.00 35.03 32.84 1glq n LYS 140 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1glq n ALA 141 N -1.63 0.00 -3.46 0.58 0.00 -1.26 -5.11 120.51 109.62 1glq n ALA 141 Ca 0.04 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.45 1glq n ALA 141 Cb 0.38 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.83 1glq n ALA 141 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1glq n PHE 142 N 0.00 -1.63 0.08 0.00 3.72 -1.25 -5.03 117.46 113.36 1glq n PHE 142 Ca 0.00 -0.31 -0.11 0.00 -0.05 0.00 0.00 57.45 56.98 1glq n PHE 142 Cb 0.00 -0.06 -0.06 0.00 -0.94 0.00 0.00 39.48 38.41 1glq n PHE 142 CO 0.00 0.00 0.00 0.97 -0.05 0.00 0.00 176.76 177.68 1glq h ILE 143 N 0.44 1.51 -3.49 4.37 6.09 -1.97 -3.43 117.51 121.03 1glq h ILE 143 Ca -0.04 -2.82 -0.39 0.00 -1.37 0.00 0.00 64.86 60.23 1glq h ILE 143 Cb 0.17 2.64 -0.34 0.00 0.47 0.00 0.00 36.82 39.77 1glq h ILE 143 CO 0.07 0.82 -0.77 -0.69 -3.07 0.00 0.00 178.15 174.52 1glq s VAL 144 N -3.00 0.48 0.00 2.19 1.01 -1.26 -4.66 120.40 115.16 1glq s VAL 144 Ca -0.03 -0.10 0.00 0.00 0.00 0.00 0.00 61.98 61.85 1glq s VAL 144 Cb 0.09 -0.51 0.00 0.00 0.00 0.00 0.00 36.38 35.96 1glq s VAL 144 CO 0.85 0.21 0.00 0.61 0.00 0.00 0.00 175.10 176.76 1glq n GLY 145 N 3.99 -0.85 0.42 4.51 0.00 -1.26 -4.45 105.19 107.55 1glq n GLY 145 Ca -0.25 -1.14 0.04 0.00 0.00 0.00 0.00 46.02 44.66 1glq n GLY 145 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1glq n ASP 146 N -1.17 2.58 -4.24 1.61 5.75 -1.26 -3.78 116.55 116.02 1glq n ASP 146 Ca 0.00 -1.97 -0.23 0.00 -0.01 0.00 0.00 54.79 52.58 1glq n ASP 146 Cb 0.00 -0.15 -0.13 0.00 -1.03 0.00 0.00 41.12 39.81 1glq n ASP 146 CO 0.00 0.00 0.00 -1.10 -0.11 0.00 0.00 177.20 175.99 1glq s GLN 147 N -0.98 1.10 0.63 0.11 -0.21 -1.26 -4.85 119.66 114.19 1glq s GLN 147 Ca 0.15 -1.04 -0.18 0.00 0.02 0.00 0.00 55.36 54.31 1glq s GLN 147 Cb 0.08 -1.27 -0.02 0.00 1.00 0.00 0.00 33.01 32.81 1glq s GLN 147 CO 0.10 0.30 1.19 -1.50 -2.12 0.00 0.00 175.29 173.27 1glq s ILE 148 N -1.08 2.65 0.29 1.08 2.07 -1.26 -4.84 121.20 120.11 1glq s ILE 148 Ca 0.05 0.37 0.02 0.00 -1.41 0.00 0.00 60.65 59.68 1glq s ILE 148 Cb -0.10 -3.06 -0.04 0.00 0.13 0.00 0.00 42.46 39.39 1glq s ILE 148 CO 0.03 -0.12 0.12 -0.94 -1.91 0.00 0.00 174.94 172.13 1glq s SER 149 N -1.80 1.54 0.38 4.50 1.04 -1.26 -4.72 113.70 113.38 1glq s SER 149 Ca 0.75 -1.48 0.11 0.00 0.48 0.00 0.00 55.95 55.81 1glq s SER 149 Cb -0.29 0.27 0.89 0.00 0.10 0.00 0.00 66.02 66.99 1glq s SER 149 CO 0.36 -0.80 1.90 2.19 0.98 0.00 0.00 173.24 177.87 1glq h PHE 150 N 2.25 0.69 -0.04 5.02 -0.00 -1.57 -1.57 116.94 121.72 1glq h PHE 150 Ca -0.36 0.02 -0.04 0.00 -0.00 0.00 0.00 57.97 57.59 1glq h PHE 150 Cb 1.25 -0.22 -0.01 0.00 -0.00 0.00 0.00 35.95 36.97 1glq h PHE 150 CO 0.78 0.28 -0.17 0.00 -0.00 0.00 0.00 178.31 179.20 1glq h ALA 151 N 1.62 1.65 -0.70 12.09 0.00 -1.88 -2.64 119.26 129.39 1glq h ALA 151 Ca 0.39 -0.18 -0.06 0.00 0.00 0.00 0.00 54.91 55.06 1glq h ALA 151 Cb 0.68 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.40 1glq h ALA 151 CO -0.16 0.26 0.19 -0.44 0.00 0.00 0.00 179.25 179.10 1glq h ASP 152 N 0.05 1.04 -0.25 0.00 3.32 -1.68 0.37 116.42 119.28 1glq h ASP 152 Ca 0.01 -0.23 -0.11 0.00 0.02 0.00 0.00 57.03 56.73 1glq h ASP 152 Cb 0.34 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.60 1glq h ASP 152 CO 0.02 0.99 -0.22 1.88 -1.72 0.00 0.00 179.24 180.20 1glq h TYR 153 N 1.04 0.81 -0.20 4.55 0.05 -1.52 0.10 116.97 121.79 1glq h TYR 153 Ca 0.22 -0.18 -0.10 0.00 0.05 0.00 0.00 58.73 58.72 1glq h TYR 153 Cb 0.35 -0.20 -0.00 0.00 1.01 0.00 0.00 36.73 37.89 1glq h TYR 153 CO 0.03 0.87 -0.28 -0.97 -1.05 0.00 0.00 178.16 176.76 1glq h ASN 154 N 0.63 0.60 -0.75 3.88 -0.00 -1.27 -1.47 115.58 117.20 1glq h ASN 154 Ca 0.09 -0.51 -0.06 0.00 -0.00 0.00 0.00 56.30 55.82 1glq h ASN 154 Cb 0.71 -0.17 -0.03 0.00 -0.00 0.00 0.00 38.32 38.83 1glq h ASN 154 CO 0.05 0.99 0.25 0.25 -0.00 0.00 0.00 177.43 178.98 1glq h LEU 155 N 0.22 1.08 0.01 0.34 5.85 -0.77 -2.15 115.31 119.89 1glq h LEU 155 Ca 0.02 -0.19 -0.00 0.00 0.84 0.00 0.00 57.88 58.55 1glq h LEU 155 Cb 0.85 -0.28 0.00 0.00 0.37 0.00 0.00 40.66 41.60 1glq h LEU 155 CO 0.07 0.99 -0.01 0.25 -0.34 0.00 0.00 178.44 179.40 1glq h LEU 156 N 1.12 -0.02 -0.40 2.25 5.85 -0.71 -1.47 115.31 121.93 1glq h LEU 156 Ca 0.25 -0.02 0.06 0.00 0.84 0.00 0.00 57.88 59.00 1glq h LEU 156 Cb 0.28 0.00 -0.05 0.00 0.37 0.00 0.00 40.66 41.27 1glq h LEU 156 CO -0.01 0.01 0.11 -0.78 -0.34 0.00 0.00 178.44 177.43 1glq h ASP 157 N -0.04 0.09 -0.49 1.25 3.58 -1.08 -1.14 116.42 118.59 1glq h ASP 157 Ca -0.00 0.06 0.06 0.00 0.42 0.00 0.00 57.03 57.56 1glq h ASP 157 Cb 0.03 0.06 -0.05 0.00 1.72 0.00 0.00 39.33 41.09 1glq h ASP 157 CO 0.00 0.08 0.19 0.25 -2.88 0.00 0.00 179.24 176.89 1glq h LEU 158 N 0.26 0.22 -0.76 2.28 5.85 -1.13 -1.56 115.31 120.46 1glq h LEU 158 Ca 0.19 0.05 -0.11 0.00 0.84 0.00 0.00 57.88 58.85 1glq h LEU 158 Cb 0.20 0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.24 1glq h LEU 158 CO -0.22 0.16 -0.22 -0.07 -0.34 0.00 0.00 178.44 177.75 1glq h LEU 159 N 0.38 0.71 -0.48 2.25 3.38 -0.92 -2.23 115.31 118.41 1glq h LEU 159 Ca 0.23 -0.25 -0.08 0.00 0.09 0.00 0.00 57.88 57.87 1glq h LEU 159 Cb 0.22 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.76 1glq h LEU 159 CO -0.22 0.91 -0.03 -0.07 0.09 0.00 0.00 178.44 179.13 1glq h LEU 160 N 0.62 0.85 -0.89 1.67 3.38 -0.69 -1.18 115.31 119.06 1glq h LEU 160 Ca 0.09 -0.32 -0.10 0.00 0.09 0.00 0.00 57.88 57.64 1glq h LEU 160 Cb 0.70 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.21 1glq h LEU 160 CO 0.05 0.97 -0.46 0.16 0.09 0.00 0.00 178.44 179.25 1glq h ILE 161 N 0.71 1.09 0.00 1.22 3.07 -1.22 -2.44 117.51 119.94 1glq h ILE 161 Ca 0.13 -1.71 -0.11 0.00 1.55 0.00 0.00 64.86 64.72 1glq h ILE 161 Cb 0.55 1.99 -0.02 0.00 -0.27 0.00 0.00 36.82 39.07 1glq h ILE 161 CO 0.03 0.45 -0.51 0.45 -1.05 0.00 0.00 178.15 177.52 1glq h HIS 162 N 0.00 0.00 0.00 0.16 3.86 -1.10 -2.25 115.15 115.83 1glq h HIS 162 Ca -0.00 0.00 -0.04 0.00 -1.16 0.00 0.00 60.37 59.16 1glq h HIS 162 Cb 0.95 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.42 1glq h HIS 162 CO 0.00 0.51 -0.21 1.96 0.86 0.00 0.00 177.93 181.06 1glq h GLN 163 N 0.00 0.00 -0.00 2.45 4.20 -0.73 0.11 115.11 121.14 1glq h GLN 163 Ca -0.01 0.00 -0.17 0.00 0.06 0.00 0.00 58.65 58.53 1glq h GLN 163 Cb 1.08 0.00 0.01 0.00 0.30 0.00 0.00 27.48 28.87 1glq h GLN 163 CO 0.07 0.21 -0.68 0.28 -0.67 0.00 0.00 178.83 178.03 1glq h VAL 164 N 0.00 1.40 -0.18 -0.54 2.07 -1.36 -3.02 116.25 114.62 1glq h VAL 164 Ca -0.00 -2.10 -0.02 0.00 0.82 0.00 0.00 66.70 65.39 1glq h VAL 164 Cb 0.66 2.55 -0.01 0.00 -1.52 0.00 0.00 31.29 32.98 1glq h VAL 164 CO 0.03 0.62 0.04 0.25 0.02 0.00 0.00 177.57 178.53 1glq h LEU 165 N -0.01 0.28 -6.62 2.57 7.12 -1.16 -3.39 115.31 114.10 1glq h LEU 165 Ca -0.08 -0.24 -0.59 0.00 0.13 0.00 0.00 57.88 57.10 1glq h LEU 165 Cb 1.38 -0.07 -0.39 0.00 -0.53 0.00 0.00 40.66 41.04 1glq h LEU 165 CO 0.13 0.45 -0.85 0.00 -0.13 0.00 0.00 178.44 178.04 1glq s ALA 166 N -5.27 1.50 0.23 1.25 0.00 0.34 -5.09 121.76 114.73 1glq s ALA 166 Ca -0.14 -2.33 -0.31 0.00 0.00 0.00 0.00 51.96 49.19 1glq s ALA 166 Cb 0.07 -1.69 -0.11 0.00 0.00 0.00 0.00 23.12 21.38 1glq s ALA 166 CO 0.71 -2.05 1.64 -2.14 0.00 0.00 0.00 175.76 173.92 1glq s PRO 167 N 0.43 4.14 0.00 0.00 0.02 -1.14 -1.00 135.00 137.46 1glq s PRO 167 Ca 0.23 2.54 0.00 0.00 0.02 0.00 0.00 61.00 63.80 1glq s PRO 167 Cb -0.13 -3.07 0.00 0.00 0.02 0.00 0.00 34.50 31.32 1glq s PRO 167 CO -0.07 -0.67 0.00 0.41 -0.33 0.00 0.00 177.00 176.34 1glq n GLY 168 N 3.20 0.68 0.29 0.52 0.00 -1.26 -4.91 105.19 103.70 1glq n GLY 168 Ca 0.12 0.00 0.18 0.00 0.00 0.00 0.00 46.02 46.32 1glq n GLY 168 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1glq n LEU 170 N -3.21 2.35 -0.35 0.00 4.77 -1.26 -4.37 117.00 114.93 1glq n LEU 170 Ca -0.01 -0.93 0.10 0.00 -0.03 0.00 0.00 56.01 55.14 1glq n LEU 170 Cb 0.24 -0.11 0.29 0.00 -2.33 0.00 0.00 43.42 41.51 1glq n LEU 170 CO 0.26 0.47 1.22 0.44 -1.33 0.00 0.00 177.39 178.44 1glq h ASP 171 N 3.27 0.84 -0.23 -1.43 3.32 -1.85 0.59 116.42 120.93 1glq h ASP 171 Ca 0.00 0.07 0.00 0.00 0.02 0.00 0.00 57.03 57.12 1glq h ASP 171 Cb 0.71 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 40.17 1glq h ASP 171 CO 0.00 0.38 0.00 0.59 -1.72 0.00 0.00 179.24 178.49 1glq n ASN 172 N -4.68 1.74 -3.88 6.45 4.13 -1.26 -4.51 115.26 113.25 1glq n ASN 172 Ca 0.21 -1.80 -0.28 0.00 1.68 0.00 0.00 54.58 54.39 1glq n ASN 172 Cb 0.47 -0.15 -0.12 0.00 -1.54 0.00 0.00 39.78 38.44 1glq n ASN 172 CO 0.00 0.00 0.00 0.49 0.28 0.00 0.00 177.26 178.03 1glq n PHE 173 N 0.39 3.30 -0.15 3.10 3.72 0.20 -4.98 117.46 123.05 1glq n PHE 173 Ca 0.15 -4.31 0.00 0.00 -0.05 0.00 0.00 57.45 53.24 1glq n PHE 173 Cb 0.32 -0.63 0.27 0.00 -0.94 0.00 0.00 39.48 38.50 1glq n PHE 173 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 1glq h PRO 174 N 5.32 0.85 -0.25 -1.08 0.13 -1.79 -1.19 132.00 133.98 1glq h PRO 174 Ca 0.15 -0.08 -0.19 0.00 -0.87 0.00 0.00 66.00 65.01 1glq h PRO 174 Cb 0.75 -0.18 0.00 0.00 0.13 0.00 0.00 31.00 31.70 1glq h PRO 174 CO 0.73 0.61 -0.60 -0.07 -0.23 0.00 0.00 178.00 178.44 1glq h LEU 175 N 0.86 0.94 -0.61 1.56 3.38 -1.93 -1.76 115.31 117.75 1glq h LEU 175 Ca 0.22 -0.53 -0.12 0.00 0.09 0.00 0.00 57.88 57.54 1glq h LEU 175 Cb -0.01 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.46 1glq h LEU 175 CO -0.04 1.32 -0.23 -0.07 0.09 0.00 0.00 178.44 179.52 1glq h LEU 176 N 0.63 0.88 -0.47 1.67 3.38 -1.82 0.19 115.31 119.77 1glq h LEU 176 Ca 0.00 -0.33 -0.00 0.00 0.09 0.00 0.00 57.88 57.64 1glq h LEU 176 Cb 1.20 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.69 1glq h LEU 176 CO 0.13 1.07 0.29 0.28 0.09 0.00 0.00 178.44 180.30 1glq h SER 177 N 0.75 0.56 -0.68 -0.43 0.02 -1.20 -0.37 113.55 112.19 1glq h SER 177 Ca 0.10 -0.05 -0.06 0.00 -0.84 0.00 0.00 61.79 60.94 1glq h SER 177 Cb 0.77 -0.14 -0.03 0.00 0.14 0.00 0.00 62.40 63.14 1glq h SER 177 CO 0.06 0.44 0.19 0.00 -1.14 0.00 0.00 176.83 176.38 1glq h ALA 178 N 1.14 0.89 -0.27 3.77 0.00 -1.14 -2.18 119.26 121.48 1glq h ALA 178 Ca 0.17 -0.23 0.02 0.00 0.00 0.00 0.00 54.91 54.87 1glq h ALA 178 Cb -0.02 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.48 1glq h ALA 178 CO -0.03 0.59 0.12 -0.92 0.00 0.00 0.00 179.25 179.01 1glq h TYR 179 N 1.00 0.23 -0.30 0.00 3.20 -0.62 -0.64 116.97 119.84 1glq h TYR 179 Ca 0.22 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 62.09 1glq h TYR 179 Cb 0.33 -0.06 -0.01 0.00 1.54 0.00 0.00 36.73 38.52 1glq h TYR 179 CO 0.03 0.12 0.15 0.28 -1.64 0.00 0.00 178.16 177.09 1glq h VAL 180 N 0.26 1.15 -0.72 1.81 2.07 -0.89 -1.44 116.25 118.49 1glq h VAL 180 Ca 0.11 -0.43 0.02 0.00 0.82 0.00 0.00 66.70 67.22 1glq h VAL 180 Cb 0.04 0.89 -0.04 0.00 -1.52 0.00 0.00 31.29 30.66 1glq h VAL 180 CO -0.09 0.16 0.46 0.00 0.02 0.00 0.00 177.57 178.12 1glq h ALA 181 N 1.00 0.94 0.15 1.67 0.00 -1.16 -0.41 119.26 121.45 1glq h ALA 181 Ca 0.10 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 1glq h ALA 181 Cb 0.12 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.65 1glq h ALA 181 CO -0.01 0.27 -0.07 -0.09 0.00 0.00 0.00 179.25 179.35 1glq h ARG 182 N 0.92 -0.19 -0.34 0.00 2.43 -0.90 -1.96 114.38 114.35 1glq h ARG 182 Ca 0.28 0.01 -0.13 0.00 -0.81 0.00 0.00 59.98 59.34 1glq h ARG 182 Cb -0.03 0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.55 1glq h ARG 182 CO -0.09 0.04 -0.31 -0.07 -1.51 0.00 0.00 179.97 178.03 1glq h LEU 183 N -0.39 0.75 -1.66 3.80 4.07 -1.16 -2.65 115.31 118.07 1glq h LEU 183 Ca -0.02 -0.30 -0.04 0.00 0.08 0.00 0.00 57.88 57.60 1glq h LEU 183 Cb 0.31 -0.21 -0.01 0.00 1.08 0.00 0.00 40.66 41.84 1glq h LEU 183 CO 0.03 1.00 -0.20 0.28 -1.08 0.00 0.00 178.44 178.48 1glq h SER 184 N 0.61 0.00 0.00 -0.43 0.02 -1.06 -2.12 113.55 110.58 1glq h SER 184 Ca 0.07 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.02 1glq h SER 184 Cb 0.82 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.36 1glq h SER 184 CO 0.07 0.20 -0.00 0.00 -1.14 0.00 0.00 176.83 175.95 1glq n ALA 185 N -2.42 2.65 -1.94 3.77 0.00 -0.74 -3.03 120.51 118.80 1glq n ALA 185 Ca -0.02 -0.29 -0.42 0.00 0.00 0.00 0.00 53.44 52.71 1glq n ALA 185 Cb 0.27 -1.39 -0.03 0.00 0.00 0.00 0.00 19.45 18.30 1glq n ALA 185 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1glq s ARG 186 N -2.01 4.21 0.27 0.00 0.52 -0.80 -4.76 118.95 116.38 1glq s ARG 186 Ca 0.44 2.35 -0.04 0.00 -0.52 0.00 0.00 55.73 57.96 1glq s ARG 186 Cb 0.22 -3.28 0.36 0.00 0.52 0.00 0.00 34.95 32.77 1glq s ARG 186 CO 0.36 -0.64 1.92 -1.00 0.02 0.00 0.00 175.30 175.96 1glq h PRO 187 N 7.22 1.21 0.00 3.54 0.13 -1.90 0.18 132.00 142.38 1glq h PRO 187 Ca -0.43 -0.07 -0.11 0.00 -0.87 0.00 0.00 66.00 64.53 1glq h PRO 187 Cb 1.20 -0.27 -0.02 0.00 0.13 0.00 0.00 31.00 32.05 1glq h PRO 187 CO 0.92 0.80 -0.50 0.87 -0.23 0.00 0.00 178.00 179.85 1glq h LYS 188 N 1.24 0.00 0.05 0.86 1.57 -1.91 -0.74 116.57 117.64 1glq h LYS 188 Ca 0.38 0.00 -0.16 0.00 -1.87 0.00 0.00 60.65 59.01 1glq h LYS 188 Cb -0.01 0.00 0.02 0.00 0.08 0.00 0.00 32.23 32.31 1glq h LYS 188 CO -0.11 0.50 -0.64 0.82 -0.57 0.00 0.00 179.45 179.45 1glq h ILE 189 N 0.00 1.47 -0.68 1.86 2.04 -1.20 -2.63 117.51 118.38 1glq h ILE 189 Ca -0.01 -2.24 0.14 0.00 1.00 0.00 0.00 64.86 63.76 1glq h ILE 189 Cb 1.03 2.84 -0.11 0.00 -0.74 0.00 0.00 36.82 39.84 1glq h ILE 189 CO 0.07 0.64 0.10 0.50 0.00 0.00 0.00 178.15 179.45 1glq h LYS 190 N -0.24 0.20 -0.47 2.37 3.64 -0.67 0.10 116.57 121.50 1glq h LYS 190 Ca -0.09 -0.01 -0.03 0.00 -1.27 0.00 0.00 60.65 59.24 1glq h LYS 190 Cb 1.40 -0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 33.16 1glq h LYS 190 CO 0.12 0.13 0.16 0.00 -2.27 0.00 0.00 179.45 177.59 1glq h ALA 191 N 1.59 0.61 -0.57 5.00 0.00 -1.17 -2.46 119.26 122.26 1glq h ALA 191 Ca 0.37 -0.17 -0.05 0.00 0.00 0.00 0.00 54.91 55.06 1glq h ALA 191 Cb 0.62 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 1glq h ALA 191 CO -0.52 0.25 0.17 0.35 0.00 0.00 0.00 179.25 179.51 1glq h PHE 192 N 0.62 0.91 0.00 0.00 3.57 -0.82 -1.66 116.94 119.56 1glq h PHE 192 Ca 0.15 -0.09 0.00 0.00 3.53 0.00 0.00 57.97 61.56 1glq h PHE 192 Cb 0.25 -0.26 0.00 0.00 2.79 0.00 0.00 35.95 38.72 1glq h PHE 192 CO 0.01 0.77 0.00 -0.07 -2.23 0.00 0.00 178.31 176.79 1glq h LEU 193 N 0.79 0.00 -1.68 0.59 3.38 -0.63 -2.12 115.31 115.64 1glq h LEU 193 Ca 0.18 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.15 1glq h LEU 193 Cb 0.29 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.04 1glq h LEU 193 CO -0.01 0.00 -0.07 -1.54 0.09 0.00 0.00 178.44 176.91 1glq n SER 194 N -2.79 2.64 -4.77 -0.43 3.41 -0.95 -4.64 113.62 106.10 1glq n SER 194 Ca 0.02 -1.82 -0.39 0.00 -0.26 0.00 0.00 58.87 56.42 1glq n SER 194 Cb 0.32 0.08 -0.01 0.00 -0.26 0.00 0.00 64.21 64.34 1glq n SER 194 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1glq s SER 195 N -1.88 6.31 0.45 4.04 1.04 -0.65 -4.83 113.70 118.18 1glq s SER 195 Ca 0.24 2.61 0.10 0.00 0.48 0.00 0.00 55.95 59.37 1glq s SER 195 Cb 0.18 -2.63 0.99 0.00 0.10 0.00 0.00 66.02 64.65 1glq s SER 195 CO 0.31 -0.84 2.09 1.55 0.98 0.00 0.00 173.24 177.32 1glq h PRO 196 N 2.63 0.37 -0.23 4.02 0.13 -1.92 0.07 132.00 137.07 1glq h PRO 196 Ca -0.49 -0.02 0.04 0.00 -0.87 0.00 0.00 66.00 64.65 1glq h PRO 196 Cb 1.25 -0.08 -0.04 0.00 0.13 0.00 0.00 31.00 32.25 1glq h PRO 196 CO 0.62 0.24 -0.01 0.93 -0.23 0.00 0.00 178.00 179.56 1glq h GLU 197 N 0.38 0.06 -0.02 0.86 3.07 -1.92 0.41 114.58 117.41 1glq h GLU 197 Ca 0.11 -0.00 -0.01 0.00 -0.50 0.00 0.00 59.36 58.95 1glq h GLU 197 Cb -0.03 -0.01 -0.00 0.00 -0.84 0.00 0.00 28.75 27.87 1glq h GLU 197 CO -0.02 0.04 -0.03 1.25 -1.40 0.00 0.00 179.01 178.84 1glq h HIS 198 N 0.06 0.08 -0.31 4.33 -0.00 -1.67 -3.17 115.15 114.47 1glq h HIS 198 Ca 0.11 -0.02 -0.04 0.00 -0.00 0.00 0.00 60.37 60.42 1glq h HIS 198 Cb 0.15 -0.02 -0.02 0.00 -0.00 0.00 0.00 27.41 27.52 1glq h HIS 198 CO -0.20 0.56 0.03 0.28 -0.00 0.00 0.00 177.93 178.60 1glq h VAL 199 N -0.43 1.17 -0.00 5.26 2.07 -0.31 -2.74 116.25 121.27 1glq h VAL 199 Ca 0.00 -0.65 0.00 0.00 0.82 0.00 0.00 66.70 66.87 1glq h VAL 199 Cb 0.55 0.91 0.00 0.00 -1.52 0.00 0.00 31.29 31.24 1glq h VAL 199 CO 0.01 0.22 -0.33 0.59 0.02 0.00 0.00 177.57 178.08 1glq n ASN 200 N -4.32 0.49 -4.68 0.57 5.03 0.14 -4.79 115.26 107.69 1glq n ASN 200 Ca 0.01 -0.25 -0.40 0.00 0.87 0.00 0.00 54.58 54.81 1glq n ASN 200 Cb 0.21 0.06 -0.05 0.00 -1.02 0.00 0.00 39.78 38.98 1glq n ASN 200 CO 0.00 0.00 0.00 -0.60 -1.83 0.00 0.00 177.26 174.83 1glq s ARG 201 N -2.86 4.31 0.60 3.52 3.52 -1.04 -5.04 118.95 121.96 1glq s ARG 201 Ca 0.16 0.80 -0.20 0.00 -0.13 0.00 0.00 55.73 56.37 1glq s ARG 201 Cb 0.18 -3.53 -0.03 0.00 -1.56 0.00 0.00 34.95 30.01 1glq s ARG 201 CO 0.62 -0.16 1.30 -1.25 -0.81 0.00 0.00 175.30 174.99 1glq s PRO 202 N 1.60 2.86 0.12 5.12 0.04 -1.26 -4.70 135.00 138.78 1glq s PRO 202 Ca 0.34 2.07 -0.17 0.00 0.04 0.00 0.00 61.00 63.28 1glq s PRO 202 Cb -0.17 -2.01 -0.03 0.00 0.04 0.00 0.00 34.50 32.33 1glq s PRO 202 CO 0.13 -1.36 1.65 0.82 0.04 0.00 0.00 177.00 178.28 1glq h ILE 203 N 0.95 1.20 -2.40 0.56 2.04 -1.95 0.14 117.51 118.05 1glq h ILE 203 Ca -0.51 -0.63 -0.53 0.00 1.00 0.00 0.00 64.86 64.19 1glq h ILE 203 Cb 1.32 0.97 -0.14 0.00 -0.74 0.00 0.00 36.82 38.23 1glq h ILE 203 CO 0.55 0.22 -0.58 0.20 0.00 0.00 0.00 178.15 178.54 1glq s ASN 204 N -5.82 2.84 0.29 1.72 -0.87 -1.26 -0.45 114.94 111.38 1glq s ASN 204 Ca -0.13 -1.45 0.25 0.00 -1.57 0.00 0.00 52.86 49.96 1glq s ASN 204 Cb 0.09 0.02 0.71 0.00 -0.02 0.00 0.00 41.25 42.05 1glq s ASN 204 CO 0.74 -0.66 1.73 1.23 -2.57 0.00 0.00 177.10 177.58 1glq h GLY 205 N 1.94 0.00 -1.36 0.66 0.00 -1.89 -3.30 103.07 99.11 1glq h GLY 205 Ca -0.41 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.92 1glq h GLY 205 CO 0.70 0.00 0.00 1.16 0.00 0.00 0.00 176.54 178.40 1glq n ASN 206 N -2.51 3.14 0.00 0.19 2.04 -1.26 -4.97 115.26 111.89 1glq n ASN 206 Ca 0.05 -2.21 0.00 0.00 -0.44 0.00 0.00 54.58 51.98 1glq n ASN 206 Cb 0.44 -0.30 0.00 0.00 -2.53 0.00 0.00 39.78 37.39 1glq n ASN 206 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 1glq n GLY 207 N 0.31 0.26 3.94 4.83 0.00 -1.24 -5.01 105.19 108.29 1glq n GLY 207 Ca 0.14 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.90 1glq n GLY 207 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1glq s LYS 208 N -0.99 3.43 0.00 1.61 1.02 -1.26 -5.06 119.74 118.48 1glq s LYS 208 Ca 0.00 -0.60 0.00 0.00 0.02 0.00 0.00 55.97 55.39 1glq s LYS 208 Cb 0.00 -2.96 0.00 0.00 -0.52 0.00 0.00 37.83 34.35 1glq s LYS 208 CO 0.00 0.52 0.00 0.00 -0.92 0.00 0.00 175.35 174.95