#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 2.30 -0.08 0.52 0.04 -1.26 -3.66 135.00 132.85 1glq s PRO 2 Ca 0.00 1.43 -0.00 0.00 0.04 0.00 0.00 61.00 62.47 1glq s PRO 2 Cb 0.00 -1.88 -0.03 0.00 0.04 0.00 0.00 34.50 32.63 1glq s PRO 2 CO 0.00 -1.65 -0.05 0.71 0.04 0.00 0.00 177.00 176.05 1glq s TYR 3 N -2.45 2.98 -0.04 0.56 2.02 -1.26 -0.98 117.35 118.19 1glq s TYR 3 Ca 0.67 0.00 0.01 0.00 -0.37 0.00 0.00 57.07 57.39 1glq s TYR 3 Cb -0.22 -1.76 0.02 0.00 -0.40 0.00 0.00 41.96 39.61 1glq s TYR 3 CO 0.48 0.30 -0.05 0.99 -1.57 0.00 0.00 175.55 175.70 1glq s THR 4 N -0.66 0.57 -0.15 -0.71 2.01 -0.72 -0.67 115.64 115.31 1glq s THR 4 Ca 0.10 -0.16 -0.04 0.00 0.31 0.00 0.00 61.69 61.90 1glq s THR 4 Cb -0.11 -0.58 -0.03 0.00 0.01 0.00 0.00 72.50 71.79 1glq s THR 4 CO 0.02 0.22 -0.03 -0.63 -0.69 0.00 0.00 174.62 173.52 1glq s ILE 5 N 0.76 4.00 -0.22 1.82 1.01 -0.16 -1.70 121.20 126.71 1glq s ILE 5 Ca -0.11 -0.32 -0.01 0.00 0.00 0.00 0.00 60.65 60.21 1glq s ILE 5 Cb -0.13 -2.75 0.02 0.00 0.01 0.00 0.00 42.46 39.60 1glq s ILE 5 CO 0.00 0.50 -0.10 -0.69 0.00 0.00 0.00 174.94 174.65 1glq s VAL 6 N 0.27 2.73 0.14 2.92 1.01 -0.17 -0.11 120.40 127.18 1glq s VAL 6 Ca -0.02 -0.87 -0.25 0.00 0.00 0.00 0.00 61.98 60.84 1glq s VAL 6 Cb -0.14 -2.29 0.07 0.00 0.00 0.00 0.00 36.38 34.02 1glq s VAL 6 CO 0.03 0.36 0.77 -0.47 0.00 0.00 0.00 175.10 175.79 1glq s TYR 7 N 1.35 -0.33 0.78 5.22 5.04 -0.79 -1.71 117.35 126.91 1glq s TYR 7 Ca 0.03 0.07 -0.14 0.00 -2.44 0.00 0.00 57.07 54.59 1glq s TYR 7 Cb -0.15 0.60 0.07 0.00 0.35 0.00 0.00 41.96 42.83 1glq s TYR 7 CO -0.07 -0.85 1.21 -0.06 -1.34 0.00 0.00 175.55 174.45 1glq s PHE 8 N -3.53 1.87 -1.07 4.97 0.08 -1.26 -0.92 117.98 118.13 1glq s PHE 8 Ca 0.06 1.65 -0.07 0.00 0.12 0.00 0.00 56.93 58.69 1glq s PHE 8 Cb -0.02 -3.49 -0.09 0.00 -0.57 0.00 0.00 43.02 38.85 1glq s PHE 8 CO -0.05 -2.80 2.58 -0.35 -0.10 0.00 0.00 175.22 174.50 1glq n PRO 9 N -3.11 2.67 -4.23 0.24 -0.04 -1.26 -4.79 135.00 124.49 1glq n PRO 9 Ca 0.14 -1.66 -0.13 0.00 -0.04 0.00 0.00 63.50 61.81 1glq n PRO 9 Cb 0.50 -2.51 -0.10 0.00 -0.04 0.00 0.00 33.50 31.35 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 2.61 0.16 -0.05 0.52 -7.23 -1.26 -4.30 120.40 110.85 1glq s VAL 10 Ca 0.54 -1.99 -0.11 0.00 -1.81 0.00 0.00 61.98 58.61 1glq s VAL 10 Cb 0.15 -2.50 -0.06 0.00 0.56 0.00 0.00 36.38 34.54 1glq s VAL 10 CO -0.04 -0.04 0.46 0.03 -0.31 0.00 0.00 175.10 175.20 1glq h ARG 11 N 2.58 -0.37 0.00 4.82 3.08 -0.71 -3.46 114.38 120.33 1glq h ARG 11 Ca -0.36 0.03 0.00 0.00 0.07 0.00 0.00 59.98 59.71 1glq h ARG 11 Cb 1.25 0.08 0.00 0.00 0.08 0.00 0.00 29.97 31.38 1glq h ARG 11 CO 0.55 -0.25 0.00 0.41 -1.07 0.00 0.00 179.97 179.62 1glq n GLY 12 N 0.76 2.58 0.19 0.04 0.00 -0.67 -1.20 105.19 106.89 1glq n GLY 12 Ca -0.05 0.10 0.09 0.00 0.00 0.00 0.00 46.02 46.16 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 14.00 1.25 0.00 1.61 1.74 -1.26 -3.69 116.66 130.31 1glq n ARG 13 Ca 0.00 -0.38 0.06 0.00 -0.77 0.00 0.00 57.85 56.76 1glq n ARG 13 Cb 0.00 -1.30 -0.05 0.00 -1.02 0.00 0.00 32.46 30.09 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 0.46 0.00 -0.36 0.00 4.57 -1.53 -2.08 114.58 115.64 1glq h GLU 15 Ca 0.00 0.00 -0.09 0.00 -1.18 0.00 0.00 59.36 58.09 1glq h GLU 15 Cb 0.35 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.93 1glq h GLU 15 CO 0.00 0.47 -0.13 0.00 -1.18 0.00 0.00 179.01 178.17 1glq h ALA 16 N 1.53 0.50 -0.11 2.92 0.00 -1.84 -1.57 119.26 120.70 1glq h ALA 16 Ca -0.00 -0.33 -0.10 0.00 0.00 0.00 0.00 54.91 54.48 1glq h ALA 16 Cb 0.86 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 1glq h ALA 16 CO 0.06 0.40 -0.38 0.00 0.00 0.00 0.00 179.25 179.33 1glq h MET 17 N 0.52 0.23 -0.35 0.00 -0.00 -1.81 -0.95 114.93 112.57 1glq h MET 17 Ca 0.09 -0.10 -0.04 0.00 -0.00 0.00 0.00 59.70 59.64 1glq h MET 17 Cb 0.66 -0.01 -0.01 0.00 -0.00 0.00 0.00 31.60 32.24 1glq h MET 17 CO 0.04 0.58 0.05 0.00 -0.00 0.00 0.00 176.91 177.59 1glq h ARG 18 N 0.20 0.58 -0.68 -0.10 3.08 -1.23 -1.36 114.38 114.87 1glq h ARG 18 Ca 0.02 -0.16 -0.06 0.00 0.07 0.00 0.00 59.98 59.85 1glq h ARG 18 Cb 0.77 -0.07 -0.03 0.00 0.08 0.00 0.00 29.97 30.72 1glq h ARG 18 CO 0.06 0.66 0.17 0.52 -1.07 0.00 0.00 179.97 180.31 1glq h MET 19 N 0.41 1.07 0.20 0.04 2.86 -1.08 -1.08 114.93 117.35 1glq h MET 19 Ca 0.10 -0.24 -0.00 0.00 -2.06 0.00 0.00 59.70 57.50 1glq h MET 19 Cb 0.36 -0.15 -0.01 0.00 0.06 0.00 0.00 31.60 31.87 1glq h MET 19 CO 0.01 0.94 -0.14 1.25 1.06 0.00 0.00 176.91 180.03 1glq h LEU 20 N 1.02 -0.35 -0.46 1.22 6.46 -1.00 0.45 115.31 122.64 1glq h LEU 20 Ca 0.22 0.03 -0.00 0.00 -0.12 0.00 0.00 57.88 58.00 1glq h LEU 20 Cb 0.34 0.11 -0.02 0.00 -0.73 0.00 0.00 40.66 40.36 1glq h LEU 20 CO -0.00 -0.22 0.28 -0.07 -0.62 0.00 0.00 178.44 177.81 1glq h LEU 21 N -0.34 0.55 -0.34 2.25 3.38 -1.04 -1.05 115.31 118.72 1glq h LEU 21 Ca -0.01 -0.06 0.01 0.00 0.09 0.00 0.00 57.88 57.91 1glq h LEU 21 Cb 0.29 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.88 1glq h LEU 21 CO 0.01 0.44 0.22 0.00 0.09 0.00 0.00 178.44 179.20 1glq h ALA 22 N 1.13 0.43 0.00 1.53 0.00 -1.11 0.05 119.26 121.28 1glq h ALA 22 Ca 0.16 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 55.01 1glq h ALA 22 Cb -0.01 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 1glq h ALA 22 CO -0.03 -0.12 -0.23 0.22 0.00 0.00 0.00 179.25 179.08 1glq h ASP 23 N 0.44 0.00 -0.36 0.00 3.58 -0.61 -1.75 116.42 117.71 1glq h ASP 23 Ca 0.13 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.58 1glq h ASP 23 Cb -0.03 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.02 1glq h ASP 23 CO -0.04 0.23 0.00 0.00 -2.88 0.00 0.00 179.24 176.55 1glq n GLN 24 N -3.92 2.77 -2.05 0.28 1.13 -0.42 -4.89 117.38 110.28 1glq n GLN 24 Ca -0.02 -1.70 -0.15 0.00 -1.94 0.00 0.00 57.00 53.19 1glq n GLN 24 Cb 0.32 -1.71 -0.02 0.00 0.11 0.00 0.00 30.24 28.93 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 0.66 0.26 3.92 1.08 0.00 -0.66 -5.00 105.19 105.45 1glq n GLY 25 Ca 0.15 -0.26 -0.30 0.00 0.00 0.00 0.00 46.02 45.62 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 -4.34 3.49 0.28 1.61 -1.52 -0.07 -5.02 119.66 114.09 1glq s GLN 26 Ca 0.00 -0.38 0.08 0.00 -1.95 0.00 0.00 55.36 53.11 1glq s GLN 26 Cb 0.00 -2.95 -0.04 0.00 -0.22 0.00 0.00 33.01 29.80 1glq s GLN 26 CO 0.00 0.53 0.13 -1.54 -0.25 0.00 0.00 175.29 174.16 1glq s SER 27 N -2.74 5.03 0.12 5.90 1.04 -1.26 -4.31 113.70 117.47 1glq s SER 27 Ca 0.37 -0.50 -0.10 0.00 0.48 0.00 0.00 55.95 56.19 1glq s SER 27 Cb -0.12 -1.05 0.00 0.00 0.10 0.00 0.00 66.02 64.95 1glq s SER 27 CO 0.28 -0.11 0.26 -1.66 0.98 0.00 0.00 173.24 172.99 1glq s TRP 28 N -2.27 0.13 -0.00 5.02 -2.14 -1.26 -4.49 118.94 113.92 1glq s TRP 28 Ca 0.34 -0.52 -0.05 0.00 2.66 0.00 0.00 56.10 58.53 1glq s TRP 28 Cb -0.06 0.02 -0.04 0.00 -3.10 0.00 0.00 33.47 30.28 1glq s TRP 28 CO 0.23 -0.62 0.24 0.21 -2.66 0.00 0.00 176.95 174.34 1glq s LYS 29 N -3.87 3.53 -0.16 3.25 2.20 0.16 -4.98 119.74 119.87 1glq s LYS 29 Ca 0.07 -0.16 0.01 0.00 -0.36 0.00 0.00 55.97 55.53 1glq s LYS 29 Cb 0.04 -3.09 0.00 0.00 -1.51 0.00 0.00 37.83 33.27 1glq s LYS 29 CO -0.09 0.66 -0.16 -2.00 -0.36 0.00 0.00 175.35 173.40 1glq s GLU 30 N -1.79 3.17 -0.37 4.03 2.56 -1.26 -0.99 118.70 124.04 1glq s GLU 30 Ca 0.27 -0.77 -0.01 0.00 0.00 0.00 0.00 54.97 54.46 1glq s GLU 30 Cb -0.13 -2.60 0.09 0.00 2.00 0.00 0.00 34.13 33.49 1glq s GLU 30 CO 0.16 -0.02 0.12 -2.00 -0.56 0.00 0.00 175.26 172.96 1glq s GLU 31 N 0.88 1.99 -0.08 4.30 2.56 0.84 -4.95 118.70 124.25 1glq s GLU 31 Ca -0.04 -1.70 -0.20 0.00 0.00 0.00 0.00 54.97 53.03 1glq s GLU 31 Cb -0.15 -3.40 -0.04 0.00 2.00 0.00 0.00 34.13 32.53 1glq s GLU 31 CO -0.02 -0.93 0.54 0.08 -0.56 0.00 0.00 175.26 174.37 1glq s VAL 32 N 1.11 5.09 -0.27 3.70 1.01 -1.26 -1.89 120.40 127.90 1glq s VAL 32 Ca 0.05 1.11 -0.05 0.00 0.00 0.00 0.00 61.98 63.10 1glq s VAL 32 Cb -0.21 -3.88 0.01 0.00 0.00 0.00 0.00 36.38 32.30 1glq s VAL 32 CO -0.04 0.34 0.02 -0.69 0.00 0.00 0.00 175.10 174.72 1glq s VAL 33 N 0.41 3.50 0.72 2.92 1.01 -0.09 -4.94 120.40 123.93 1glq s VAL 33 Ca 0.29 -0.79 -0.11 0.00 0.00 0.00 0.00 61.98 61.37 1glq s VAL 33 Cb -0.16 -2.78 0.02 0.00 0.00 0.00 0.00 36.38 33.46 1glq s VAL 33 CO 0.13 0.16 1.07 0.42 0.00 0.00 0.00 175.10 176.89 1glq s THR 34 N 1.43 3.75 0.38 3.92 -4.23 -1.26 -3.99 115.64 115.64 1glq s THR 34 Ca 0.02 0.57 0.08 0.00 -1.18 0.00 0.00 61.69 61.18 1glq s THR 34 Cb -0.17 -3.40 0.16 0.00 1.34 0.00 0.00 72.50 70.43 1glq s THR 34 CO -0.01 -0.74 1.91 0.40 -0.54 0.00 0.00 174.62 175.64 1glq h ILE 35 N -0.75 1.18 0.14 2.99 2.04 -1.98 -0.73 117.51 120.39 1glq h ILE 35 Ca -0.45 -0.76 -0.01 0.00 1.00 0.00 0.00 64.86 64.65 1glq h ILE 35 Cb 1.23 1.13 0.00 0.00 -0.74 0.00 0.00 36.82 38.45 1glq h ILE 35 CO 0.60 0.24 -0.07 0.44 0.00 0.00 0.00 178.15 179.36 1glq h ASP 36 N 0.29 -0.16 -0.20 1.72 5.19 -1.98 0.97 116.42 122.25 1glq h ASP 36 Ca 0.06 -0.06 0.03 0.00 -0.62 0.00 0.00 57.03 56.44 1glq h ASP 36 Cb 0.35 0.04 -0.03 0.00 0.18 0.00 0.00 39.33 39.87 1glq h ASP 36 CO 0.02 -0.04 0.05 0.74 -3.12 0.00 0.00 179.24 176.88 1glq h THR 37 N -0.26 0.92 -0.88 0.35 2.02 -1.85 -2.40 112.91 110.81 1glq h THR 37 Ca -0.02 -0.04 0.07 0.00 0.77 0.00 0.00 66.41 67.19 1glq h THR 37 Cb 0.20 0.78 -0.07 0.00 -1.74 0.00 0.00 68.15 67.32 1glq h THR 37 CO 0.03 0.02 0.54 -0.25 0.37 0.00 0.00 175.52 176.24 1glq h TRP 38 N 0.13 1.00 0.00 3.16 2.91 -0.76 -0.50 115.95 121.88 1glq h TRP 38 Ca 0.09 0.03 0.00 0.00 1.13 0.00 0.00 58.89 60.14 1glq h TRP 38 Cb 0.08 -0.32 0.00 0.00 -0.51 0.00 0.00 29.16 28.41 1glq h TRP 38 CO -0.14 0.48 0.00 -1.33 -1.03 0.00 0.00 178.44 176.43 1glq n MET 39 N -4.63 0.21 0.29 2.65 2.81 0.30 -1.83 117.12 116.92 1glq n MET 39 Ca 0.13 0.38 0.16 0.00 -1.81 0.00 0.00 57.70 56.57 1glq n MET 39 Cb 0.21 -1.86 0.87 0.00 -0.71 0.00 0.00 33.22 31.72 1glq n MET 39 CO 0.00 0.00 0.00 1.96 1.51 0.00 0.00 175.97 179.44 1glq h GLN 40 N 0.00 0.00 0.00 0.03 4.20 -0.60 -3.47 115.11 115.27 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 0.44 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.22 1glq h GLN 40 CO 0.00 0.06 0.00 0.41 -0.67 0.00 0.00 178.83 178.63 1glq n GLY 41 N -0.85 0.45 0.09 3.46 0.00 -0.76 -4.92 105.19 102.66 1glq n GLY 41 Ca -0.02 -0.60 -0.00 0.00 0.00 0.00 0.00 46.02 45.40 1glq n GLY 41 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1glq n LEU 42 N 0.00 0.62 -0.04 0.99 4.77 -1.26 -4.55 117.00 117.53 1glq n LEU 42 Ca 0.00 0.27 -0.22 0.00 -0.03 0.00 0.00 56.01 56.03 1glq n LEU 42 Cb 0.00 0.13 -0.13 0.00 -2.33 0.00 0.00 43.42 41.09 1glq n LEU 42 CO 0.00 0.18 -0.68 0.25 -1.33 0.00 0.00 177.39 175.81 1glq h LEU 43 N 0.00 0.26 -0.58 2.23 5.85 -1.88 -3.40 115.31 117.79 1glq h LEU 43 Ca -0.20 -0.77 0.12 0.00 0.84 0.00 0.00 57.88 57.86 1glq h LEU 43 Cb 1.61 -0.08 -0.10 0.00 0.37 0.00 0.00 40.66 42.46 1glq h LEU 43 CO 0.04 1.71 -0.01 0.50 -0.34 0.00 0.00 178.44 180.33 1glq h LYS 44 N -0.37 0.11 0.00 1.25 3.64 -1.86 -0.25 116.57 119.08 1glq h LYS 44 Ca -0.39 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 58.98 1glq h LYS 44 Cb 1.74 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 33.53 1glq h LYS 44 CO -0.03 0.07 0.00 -0.35 -2.27 0.00 0.00 179.45 176.87 1glq n PRO 45 N -5.27 0.17 0.01 1.90 -0.04 -1.26 -1.37 135.00 129.14 1glq n PRO 45 Ca 0.08 0.16 0.11 0.00 -0.04 0.00 0.00 63.50 63.81 1glq n PRO 45 Cb 0.33 -1.50 0.11 0.00 -0.04 0.00 0.00 33.50 32.40 1glq n PRO 45 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1glq n THR 46 N -1.33 0.09 -2.62 0.52 -2.24 -0.12 -4.89 114.28 103.69 1glq n THR 46 Ca 0.07 -0.10 -0.42 0.00 -2.27 0.00 0.00 64.05 61.33 1glq n THR 46 Cb 0.14 0.31 -0.03 0.00 -2.10 0.00 0.00 70.33 68.65 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 6.34 -0.89 -3.41 0.00 5.85 -1.87 -1.10 115.31 120.23 1glq h LEU 48 Ca -0.42 0.17 0.00 0.00 0.84 0.00 0.00 57.88 58.47 1glq h LEU 48 Cb 1.22 0.43 0.00 0.00 0.37 0.00 0.00 40.66 42.68 1glq h LEU 48 CO 0.75 -0.29 0.00 -1.22 -0.34 0.00 0.00 178.44 177.35 1glq n TYR 49 N -5.40 1.79 -1.47 1.25 4.01 -1.26 -4.95 117.16 111.12 1glq n TYR 49 Ca 0.01 -0.71 -0.14 0.00 -0.16 0.00 0.00 57.90 56.90 1glq n TYR 49 Cb 0.32 -0.41 -0.06 0.00 -0.31 0.00 0.00 39.34 38.87 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 0.65 1.37 3.16 2.72 0.00 -0.42 -4.99 105.19 107.68 1glq n GLY 50 Ca 0.26 -0.35 -0.10 0.00 0.00 0.00 0.00 46.02 45.84 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 -3.32 0.99 0.22 1.61 -0.21 -1.26 -4.90 119.66 112.79 1glq s GLN 51 Ca 0.00 -1.48 0.08 0.00 0.02 0.00 0.00 55.36 53.98 1glq s GLN 51 Cb 0.00 0.25 -0.04 0.00 1.00 0.00 0.00 33.01 34.22 1glq s GLN 51 CO 0.00 -0.29 0.01 -0.51 -2.12 0.00 0.00 175.29 172.38 1glq s LEU 52 N -3.07 3.30 0.59 2.90 1.43 -1.26 -4.72 118.68 117.85 1glq s LEU 52 Ca 0.27 -0.49 -0.17 0.00 -1.03 0.00 0.00 54.13 52.72 1glq s LEU 52 Cb 0.07 -1.89 -0.03 0.00 0.03 0.00 0.00 46.19 44.37 1glq s LEU 52 CO 0.04 0.04 1.09 -2.16 0.23 0.00 0.00 176.35 175.59 1glq s PRO 53 N -3.31 3.20 -0.04 1.29 0.04 -1.26 -4.98 135.00 129.94 1glq s PRO 53 Ca 0.29 1.38 0.06 0.00 0.04 0.00 0.00 61.00 62.77 1glq s PRO 53 Cb -0.08 -2.00 -0.02 0.00 0.04 0.00 0.00 34.50 32.43 1glq s PRO 53 CO 0.20 -0.93 -0.21 0.21 0.04 0.00 0.00 177.00 176.31 1glq s LYS 54 N -3.82 2.33 -0.02 4.56 2.20 -0.69 -4.08 119.74 120.22 1glq s LYS 54 Ca 0.67 -0.82 0.02 0.00 -0.36 0.00 0.00 55.97 55.48 1glq s LYS 54 Cb -0.19 -2.20 0.00 0.00 -1.51 0.00 0.00 37.83 33.93 1glq s LYS 54 CO 0.34 0.57 -0.08 0.12 -0.36 0.00 0.00 175.35 175.95 1glq s PHE 55 N -0.62 0.82 -0.09 4.03 5.36 -0.24 -1.00 117.98 126.23 1glq s PHE 55 Ca 0.09 -0.19 0.04 0.00 -0.96 0.00 0.00 56.93 55.92 1glq s PHE 55 Cb -0.11 -0.58 -0.01 0.00 -0.34 0.00 0.00 43.02 41.98 1glq s PHE 55 CO 0.00 -0.08 -0.23 -1.21 -1.46 0.00 0.00 175.22 172.24 1glq s GLU 56 N 0.15 2.94 -0.35 10.12 2.02 -0.69 -0.64 118.70 132.25 1glq s GLU 56 Ca -0.02 -0.86 0.02 0.00 0.02 0.00 0.00 54.97 54.13 1glq s GLU 56 Cb -0.07 -2.30 0.10 0.00 0.10 0.00 0.00 34.13 31.96 1glq s GLU 56 CO 0.00 0.25 0.10 0.34 0.02 0.00 0.00 175.26 175.97 1glq s ASP 57 N 0.18 4.34 1.60 -0.19 2.15 0.51 -1.75 116.67 123.51 1glq s ASP 57 Ca -0.13 -2.04 0.00 0.00 0.43 0.00 0.00 52.55 50.81 1glq s ASP 57 Cb -0.16 -1.26 0.00 0.00 -0.30 0.00 0.00 42.92 41.19 1glq s ASP 57 CO 0.07 -0.38 0.00 0.61 -0.17 0.00 0.00 175.17 175.30 1glq n GLY 58 N 4.36 3.19 0.20 2.66 0.00 -0.15 -1.08 105.19 114.37 1glq n GLY 58 Ca 0.02 0.27 0.09 0.00 0.00 0.00 0.00 46.02 46.40 1glq n GLY 58 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 1glq h ASP 59 N 0.00 0.00 -3.53 1.61 3.58 -1.91 -3.45 116.42 112.73 1glq h ASP 59 Ca 0.00 0.00 -0.61 0.00 0.42 0.00 0.00 57.03 56.84 1glq h ASP 59 Cb 0.00 0.00 -0.12 0.00 1.72 0.00 0.00 39.33 40.93 1glq h ASP 59 CO 0.00 0.24 -0.25 -0.22 -2.88 0.00 0.00 179.24 176.13 1glq s LEU 60 N -6.52 4.13 -0.20 2.28 2.96 -0.24 -5.06 118.68 116.03 1glq s LEU 60 Ca 0.03 0.43 -0.05 0.00 -0.22 0.00 0.00 54.13 54.31 1glq s LEU 60 Cb 0.08 -2.44 -0.03 0.00 0.50 0.00 0.00 46.19 44.30 1glq s LEU 60 CO 0.66 -0.07 0.01 -0.89 -1.32 0.00 0.00 176.35 174.74 1glq s THR 61 N 1.39 4.13 0.15 3.68 2.01 -1.26 -0.36 115.64 125.37 1glq s THR 61 Ca 0.17 -0.26 0.10 0.00 0.31 0.00 0.00 61.69 62.01 1glq s THR 61 Cb -0.15 -2.86 -0.04 0.00 0.01 0.00 0.00 72.50 69.46 1glq s THR 61 CO 0.08 0.43 -0.23 -0.76 -0.69 0.00 0.00 174.62 173.45 1glq s LEU 62 N 0.86 2.37 0.38 4.42 1.43 0.18 -4.98 118.68 123.34 1glq s LEU 62 Ca 0.01 -0.78 0.05 0.00 -1.03 0.00 0.00 54.13 52.38 1glq s LEU 62 Cb -0.14 -1.04 -0.07 0.00 0.03 0.00 0.00 46.19 44.97 1glq s LEU 62 CO 0.02 0.09 0.03 -0.31 0.23 0.00 0.00 176.35 176.42 1glq s TYR 63 N -1.43 2.24 -0.00 0.29 2.02 -1.26 -1.08 117.35 118.13 1glq s TYR 63 Ca 0.14 -0.82 -0.00 0.00 -0.37 0.00 0.00 57.07 56.02 1glq s TYR 63 Cb -0.09 -1.55 0.00 0.00 -0.40 0.00 0.00 41.96 39.93 1glq s TYR 63 CO 0.07 0.24 0.00 1.04 -1.57 0.00 0.00 175.55 175.33 1glq n GLN 64 N -0.86 -0.55 -0.28 -0.62 1.13 -1.26 -4.54 117.38 110.41 1glq n GLN 64 Ca -0.04 0.85 0.11 0.00 -1.94 0.00 0.00 57.00 55.97 1glq n GLN 64 Cb 0.67 -1.04 0.36 0.00 0.11 0.00 0.00 30.24 30.34 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 0.69 1.30 1.08 4.64 -1.90 -0.56 113.55 119.26 1glq h SER 65 Ca -0.01 0.04 -0.12 0.00 -0.47 0.00 0.00 61.79 61.23 1glq h SER 65 Cb 0.02 -0.10 -0.02 0.00 -0.31 0.00 0.00 62.40 62.00 1glq h SER 65 CO 0.00 0.36 -0.57 0.78 -0.87 0.00 0.00 176.83 176.53 1glq h ASN 66 N 0.73 0.00 -0.54 4.97 2.35 -1.92 -1.18 115.58 119.99 1glq h ASN 66 Ca 0.45 0.00 -0.11 0.00 -0.55 0.00 0.00 56.30 56.08 1glq h ASN 66 Cb 0.66 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.02 1glq h ASN 66 CO -0.21 0.57 -0.10 0.00 -1.65 0.00 0.00 177.43 176.04 1glq h ALA 67 N 1.43 0.74 -0.44 -0.83 0.00 -1.42 -0.67 119.26 118.09 1glq h ALA 67 Ca -0.01 -0.35 -0.04 0.00 0.00 0.00 0.00 54.91 54.51 1glq h ALA 67 Cb 1.37 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.95 1glq h ALA 67 CO 0.07 0.66 0.11 0.82 0.00 0.00 0.00 179.25 180.90 1glq h ILE 68 N 0.91 1.23 -0.54 0.00 2.04 -1.16 -0.12 117.51 119.86 1glq h ILE 68 Ca 0.14 -0.81 -0.01 0.00 1.00 0.00 0.00 64.86 65.19 1glq h ILE 68 Cb 0.67 0.93 -0.03 0.00 -0.74 0.00 0.00 36.82 37.65 1glq h ILE 68 CO 0.05 0.29 0.32 -0.07 0.00 0.00 0.00 178.15 178.73 1glq h LEU 69 N 0.57 0.66 -0.84 1.44 3.38 -1.07 -1.47 115.31 117.98 1glq h LEU 69 Ca 0.14 -0.07 -0.08 0.00 0.09 0.00 0.00 57.88 57.95 1glq h LEU 69 Cb 0.32 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.88 1glq h LEU 69 CO 0.00 0.54 -0.03 0.03 0.09 0.00 0.00 178.44 179.07 1glq h ARG 70 N 0.73 0.84 -0.24 1.13 3.08 -1.02 -0.93 114.38 117.96 1glq h ARG 70 Ca 0.19 -0.25 0.01 0.00 0.07 0.00 0.00 59.98 60.00 1glq h ARG 70 Cb 0.01 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 29.96 1glq h ARG 70 CO -0.03 0.86 0.15 1.25 -1.07 0.00 0.00 179.97 181.12 1glq h HIS 71 N 0.77 0.28 -0.23 3.04 2.76 -0.74 -0.57 115.15 120.47 1glq h HIS 71 Ca 0.14 0.01 -0.08 0.00 -2.20 0.00 0.00 60.37 58.24 1glq h HIS 71 Cb 0.51 -0.09 -0.01 0.00 1.55 0.00 0.00 27.41 29.36 1glq h HIS 71 CO 0.03 0.17 -0.22 -0.07 -1.30 0.00 0.00 177.93 176.53 1glq h LEU 72 N 0.31 0.42 -0.49 0.26 3.38 -1.08 0.40 115.31 118.50 1glq h LEU 72 Ca 0.09 -0.13 -0.05 0.00 0.09 0.00 0.00 57.88 57.88 1glq h LEU 72 Cb -0.02 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.60 1glq h LEU 72 CO -0.04 0.65 0.10 1.23 0.09 0.00 0.00 178.44 180.48 1glq h GLY 73 N 0.99 0.86 0.59 0.83 0.00 -0.69 -0.38 103.07 105.28 1glq h GLY 73 Ca 0.06 -0.56 -0.00 0.00 0.00 0.00 0.00 47.33 46.83 1glq h GLY 73 CO 0.04 0.52 -0.03 -0.09 0.00 0.00 0.00 176.54 176.98 1glq h ARG 74 N 0.68 -0.08 0.00 4.80 2.43 -0.79 0.38 114.38 121.80 1glq h ARG 74 Ca 0.15 0.01 -0.06 0.00 -0.81 0.00 0.00 59.98 59.27 1glq h ARG 74 Cb 0.36 0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.92 1glq h ARG 74 CO 0.01 0.31 -0.28 0.66 -1.51 0.00 0.00 179.97 179.16 1glq h SER 75 N -0.50 0.00 -0.48 -3.80 4.64 -0.88 -3.06 113.55 109.47 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 0.43 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.52 1glq h SER 75 CO 0.01 0.28 0.00 0.18 -0.87 0.00 0.00 176.83 176.43 1glq n LEU 76 N -3.28 3.35 -1.18 5.97 4.77 -0.16 -4.97 117.00 121.50 1glq n LEU 76 Ca 0.01 -1.84 -0.06 0.00 -0.03 0.00 0.00 56.01 54.10 1glq n LEU 76 Cb 0.55 -0.32 0.02 0.00 -2.33 0.00 0.00 43.42 41.34 1glq n LEU 76 CO 0.36 0.81 0.04 0.61 -1.33 0.00 0.00 177.39 177.88 1glq n GLY 77 N 1.13 0.52 1.67 -0.72 0.00 -0.92 -4.97 105.19 101.90 1glq n GLY 77 Ca 0.18 -0.47 -0.17 0.00 0.00 0.00 0.00 46.02 45.55 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 -1.51 4.50 -1.36 0.99 4.77 0.13 -4.69 117.00 119.83 1glq n LEU 78 Ca -0.01 -4.50 -0.01 0.00 -0.03 0.00 0.00 56.01 51.46 1glq n LEU 78 Cb 0.52 -0.42 0.11 0.00 -2.33 0.00 0.00 43.42 41.30 1glq n LEU 78 CO 0.15 1.89 0.21 0.00 -1.33 0.00 0.00 177.39 178.31 1glq n TYR 79 N -0.83 0.66 0.00 -1.77 4.19 -1.21 -1.69 117.16 116.52 1glq n TYR 79 Ca 0.39 -1.45 0.00 0.00 3.31 0.00 0.00 57.90 60.15 1glq n TYR 79 Cb 0.90 -0.24 0.00 0.00 0.49 0.00 0.00 39.34 40.49 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 -0.56 -0.89 0.11 2.98 0.00 -1.26 -4.09 105.19 101.48 1glq n GLY 80 Ca 0.19 -1.68 0.06 0.00 0.00 0.00 0.00 46.02 44.59 1glq n GLY 80 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1glq n LYS 81 N -0.91 2.54 -3.87 1.61 2.85 -1.26 -4.96 118.16 114.16 1glq n LYS 81 Ca 0.00 -0.27 -0.10 0.00 -1.05 0.00 0.00 58.31 56.88 1glq n LYS 81 Cb 0.00 -1.12 0.01 0.00 -0.65 0.00 0.00 35.03 33.28 1glq n LYS 81 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 1glq s ASN 82 N -1.94 0.23 0.32 -5.58 2.20 -1.26 -5.05 114.94 103.87 1glq s ASN 82 Ca 0.07 -1.25 0.08 0.00 -0.94 0.00 0.00 52.86 50.81 1glq s ASN 82 Cb 0.10 0.82 0.56 0.00 -2.00 0.00 0.00 41.25 40.73 1glq s ASN 82 CO 0.43 -1.63 1.77 1.56 -2.94 0.00 0.00 177.10 176.29 1glq h GLN 83 N 2.02 0.23 -0.10 3.55 4.20 -1.96 -2.17 115.11 120.88 1glq h GLN 83 Ca -0.32 -0.09 -0.01 0.00 0.06 0.00 0.00 58.65 58.29 1glq h GLN 83 Cb 1.25 -0.01 -0.00 0.00 0.30 0.00 0.00 27.48 29.01 1glq h GLN 83 CO 0.41 0.54 0.01 -0.09 -0.67 0.00 0.00 178.83 179.02 1glq h ARG 84 N 0.20 0.17 -0.51 1.46 2.43 -1.99 -1.85 114.38 114.29 1glq h ARG 84 Ca 0.03 -0.05 -0.00 0.00 -0.81 0.00 0.00 59.98 59.14 1glq h ARG 84 Cb 0.68 -0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 30.19 1glq h ARG 84 CO 0.05 0.41 0.32 0.93 -1.51 0.00 0.00 179.97 180.16 1glq h GLU 85 N -0.09 0.69 -0.90 0.20 5.08 -1.91 -2.08 114.58 115.59 1glq h GLU 85 Ca 0.03 -0.06 0.03 0.00 -1.00 0.00 0.00 59.36 58.36 1glq h GLU 85 Cb 0.32 -0.15 -0.05 0.00 0.50 0.00 0.00 28.75 29.38 1glq h GLU 85 CO 0.00 0.50 0.59 0.00 -1.00 0.00 0.00 179.01 179.10 1glq h ALA 86 N 1.16 1.41 -0.29 3.43 0.00 -1.32 0.06 119.26 123.70 1glq h ALA 86 Ca 0.19 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.02 1glq h ALA 86 Cb -0.02 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.42 1glq h ALA 86 CO -0.04 0.51 0.08 0.00 0.00 0.00 0.00 179.25 179.81 1glq h ALA 87 N 1.47 0.39 -0.53 0.00 0.00 -1.07 -1.96 119.26 117.55 1glq h ALA 87 Ca 0.35 -0.16 -0.06 0.00 0.00 0.00 0.00 54.91 55.04 1glq h ALA 87 Cb -0.03 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 1glq h ALA 87 CO -0.10 0.03 0.09 1.96 0.00 0.00 0.00 179.25 181.23 1glq h GLN 88 N 0.31 0.84 -0.51 0.00 4.20 -0.71 -1.84 115.11 117.41 1glq h GLN 88 Ca 0.09 -0.19 -0.07 0.00 0.06 0.00 0.00 58.65 58.53 1glq h GLN 88 Cb 0.26 -0.12 -0.02 0.00 0.30 0.00 0.00 27.48 27.90 1glq h GLN 88 CO -0.00 0.79 0.02 0.52 -0.67 0.00 0.00 178.83 179.49 1glq h MET 89 N 0.80 0.85 -0.52 1.46 2.86 -0.81 -1.42 114.93 118.16 1glq h MET 89 Ca 0.17 -0.23 -0.09 0.00 -2.06 0.00 0.00 59.70 57.49 1glq h MET 89 Cb 0.36 -0.10 -0.02 0.00 0.06 0.00 0.00 31.60 31.90 1glq h MET 89 CO 0.01 0.84 -0.04 -0.44 1.06 0.00 0.00 176.91 178.33 1glq h ASP 90 N 0.80 0.94 -0.73 1.22 3.32 -0.99 -0.20 116.42 120.77 1glq h ASP 90 Ca 0.16 -0.33 -0.00 0.00 0.02 0.00 0.00 57.03 56.88 1glq h ASP 90 Cb 0.45 -0.25 -0.04 0.00 0.22 0.00 0.00 39.33 39.71 1glq h ASP 90 CO 0.02 1.04 0.45 -0.03 -1.72 0.00 0.00 179.24 179.00 1glq h MET 91 N 0.81 0.98 0.39 3.56 4.05 -1.11 -0.70 114.93 122.91 1glq h MET 91 Ca 0.14 -0.08 -0.02 0.00 -0.28 0.00 0.00 59.70 59.46 1glq h MET 91 Cb 0.59 -0.21 0.00 0.00 -0.80 0.00 0.00 31.60 31.18 1glq h MET 91 CO 0.04 0.68 -0.19 0.28 0.23 0.00 0.00 176.91 177.95 1glq h VAL 92 N 0.99 0.61 -0.58 -5.77 2.07 -1.07 -2.34 116.25 110.16 1glq h VAL 92 Ca 0.26 -0.31 0.04 0.00 0.82 0.00 0.00 66.70 67.51 1glq h VAL 92 Cb -0.06 0.76 -0.03 0.00 -1.52 0.00 0.00 31.29 30.44 1glq h VAL 92 CO -0.05 0.06 0.38 -1.13 0.02 0.00 0.00 177.57 176.85 1glq h ASN 93 N -0.71 0.57 0.03 0.57 -1.24 -0.87 -0.75 115.58 113.18 1glq h ASN 93 Ca -0.05 -0.01 -0.13 0.00 0.71 0.00 0.00 56.30 56.82 1glq h ASN 93 Cb 0.50 -0.13 -0.01 0.00 0.73 0.00 0.00 38.32 39.41 1glq h ASN 93 CO 0.09 0.39 -0.42 0.44 -1.29 0.00 0.00 177.43 176.64 1glq h ASP 94 N 0.66 0.52 -0.55 1.15 5.19 -1.11 -0.12 116.42 122.17 1glq h ASP 94 Ca 0.23 -0.23 -0.11 0.00 -0.62 0.00 0.00 57.03 56.30 1glq h ASP 94 Cb 0.11 -0.15 -0.02 0.00 0.18 0.00 0.00 39.33 39.45 1glq h ASP 94 CO -0.06 0.88 -0.10 1.23 -3.12 0.00 0.00 179.24 178.06 1glq h GLY 95 N 1.11 1.12 0.97 2.75 0.00 -0.62 -1.31 103.07 107.09 1glq h GLY 95 Ca 0.03 -0.91 -0.01 0.00 0.00 0.00 0.00 47.33 46.45 1glq h GLY 95 CO 0.08 0.83 -0.10 -2.08 0.00 0.00 0.00 176.54 175.27 1glq h VAL 96 N 0.92 0.80 -0.96 4.60 2.07 -1.03 -2.36 116.25 120.28 1glq h VAL 96 Ca 0.14 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.71 1glq h VAL 96 Cb 0.68 0.80 -0.06 0.00 -1.52 0.00 0.00 31.29 31.18 1glq h VAL 96 CO 0.05 0.00 0.62 -0.08 0.02 0.00 0.00 177.57 178.18 1glq h GLU 97 N -0.26 1.13 -0.74 1.57 4.57 -0.96 -0.21 114.58 119.68 1glq h GLU 97 Ca -0.02 -0.07 -0.02 0.00 -1.18 0.00 0.00 59.36 58.07 1glq h GLU 97 Cb 0.21 -0.25 -0.03 0.00 -0.16 0.00 0.00 28.75 28.51 1glq h GLU 97 CO 0.03 0.75 0.39 -0.44 -1.18 0.00 0.00 179.01 178.55 1glq h ASP 98 N 1.16 0.93 -0.19 1.04 3.32 -0.89 -0.66 116.42 121.12 1glq h ASP 98 Ca 0.40 -0.11 -0.14 0.00 0.02 0.00 0.00 57.03 57.20 1glq h ASP 98 Cb 0.10 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.40 1glq h ASP 98 CO -0.15 0.77 -0.38 0.25 -1.72 0.00 0.00 179.24 178.01 1glq h LEU 99 N 1.02 0.77 -0.90 1.55 5.85 -0.93 -2.69 115.31 119.98 1glq h LEU 99 Ca 0.26 -0.34 0.01 0.00 0.84 0.00 0.00 57.88 58.65 1glq h LEU 99 Cb 0.06 -0.22 -0.05 0.00 0.37 0.00 0.00 40.66 40.83 1glq h LEU 99 CO -0.04 1.07 0.60 -0.09 -0.34 0.00 0.00 178.44 179.63 1glq h ARG 100 N 0.60 1.18 -0.73 1.25 2.43 -0.74 -0.26 114.38 118.11 1glq h ARG 100 Ca 0.05 -0.07 0.04 0.00 -0.81 0.00 0.00 59.98 59.19 1glq h ARG 100 Cb 0.92 -0.27 -0.05 0.00 -0.42 0.00 0.00 29.97 30.16 1glq h ARG 100 CO 0.08 0.78 0.45 0.78 -1.51 0.00 0.00 179.97 180.55 1glq h GLY 101 N 1.21 1.06 1.03 2.80 0.00 -0.95 -0.05 103.07 108.16 1glq h GLY 101 Ca 0.33 -0.34 -0.10 0.00 0.00 0.00 0.00 47.33 47.22 1glq h GLY 101 CO -0.08 0.27 -0.13 0.50 0.00 0.00 0.00 176.54 177.10 1glq h LYS 102 N 0.87 0.87 -0.20 4.80 1.57 -0.96 -2.38 116.57 121.14 1glq h LYS 102 Ca 0.30 -0.34 0.01 0.00 -1.87 0.00 0.00 60.65 58.75 1glq h LYS 102 Cb 0.05 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.31 1glq h LYS 102 CO -0.12 0.98 0.10 -0.92 -0.57 0.00 0.00 179.45 178.91 1glq h TYR 103 N 0.70 0.18 -0.87 -1.35 3.20 -0.77 -1.06 116.97 117.00 1glq h TYR 103 Ca 0.11 0.01 -0.03 0.00 3.14 0.00 0.00 58.73 61.96 1glq h TYR 103 Cb 0.68 -0.05 -0.04 0.00 1.54 0.00 0.00 36.73 38.85 1glq h TYR 103 CO 0.05 0.10 0.44 0.28 -1.64 0.00 0.00 178.16 177.39 1glq h VAL 104 N 0.21 1.26 -0.45 1.81 2.07 -0.95 -1.02 116.25 119.17 1glq h VAL 104 Ca 0.08 -0.71 -0.02 0.00 0.82 0.00 0.00 66.70 66.87 1glq h VAL 104 Cb 0.02 0.13 -0.02 0.00 -1.52 0.00 0.00 31.29 29.89 1glq h VAL 104 CO -0.05 0.31 0.19 0.74 0.02 0.00 0.00 177.57 178.77 1glq h THR 105 N 1.23 1.20 0.54 2.57 2.02 -1.10 -1.83 112.91 117.55 1glq h THR 105 Ca 0.30 -0.61 -0.02 0.00 0.77 0.00 0.00 66.41 66.85 1glq h THR 105 Cb 0.09 0.76 -0.02 0.00 -1.74 0.00 0.00 68.15 67.24 1glq h THR 105 CO -0.04 0.23 -0.49 0.25 0.37 0.00 0.00 175.52 175.83 1glq h LEU 106 N 0.59 -1.34 -0.32 2.58 5.85 -0.71 -0.43 115.31 121.53 1glq h LEU 106 Ca 0.15 0.10 0.07 0.00 0.84 0.00 0.00 57.88 59.04 1glq h LEU 106 Cb 0.18 0.43 -0.07 0.00 0.37 0.00 0.00 40.66 41.57 1glq h LEU 106 CO -0.01 -0.67 -0.14 0.40 -0.34 0.00 0.00 178.44 177.68 1glq h ILE 107 N -1.03 0.56 0.00 4.05 1.08 -1.13 0.13 117.51 121.17 1glq h ILE 107 Ca -0.07 0.00 -0.07 0.00 -0.39 0.00 0.00 64.86 64.33 1glq h ILE 107 Cb 0.88 0.56 -0.01 0.00 -3.07 0.00 0.00 36.82 35.17 1glq h ILE 107 CO -0.04 0.00 -0.93 1.88 -0.69 0.00 0.00 178.15 178.37 1glq h TYR 108 N -0.08 0.00 0.00 1.37 0.05 -1.35 -3.40 116.97 113.55 1glq h TYR 108 Ca 0.16 0.00 -0.10 0.00 0.05 0.00 0.00 58.73 58.84 1glq h TYR 108 Cb 0.33 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 38.05 1glq h TYR 108 CO -0.35 0.26 -1.49 2.41 -1.05 0.00 0.00 178.16 177.94 1glq n THR 109 N -2.88 0.37 -2.69 -2.88 -1.04 -0.17 -4.91 114.28 100.08 1glq n THR 109 Ca -0.02 -0.29 -0.05 0.00 -2.04 0.00 0.00 64.05 61.65 1glq n THR 109 Cb 0.67 -0.46 0.12 0.00 -1.82 0.00 0.00 70.33 68.84 1glq n THR 109 CO 0.00 0.00 0.00 -3.20 -0.64 0.00 0.00 175.07 171.23 1glq n ASN 110 N -2.14 -1.44 0.32 8.00 5.15 -0.05 -5.00 115.26 120.10 1glq n ASN 110 Ca -0.09 -2.35 -0.17 0.00 -0.60 0.00 0.00 54.58 51.37 1glq n ASN 110 Cb 0.59 0.75 -0.09 0.00 -0.53 0.00 0.00 39.78 40.51 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 1.63 -0.72 0.02 1.20 3.20 -1.53 0.41 116.97 121.17 1glq h TYR 111 Ca -0.34 -0.02 0.01 0.00 3.14 0.00 0.00 58.73 61.52 1glq h TYR 111 Cb 1.29 0.24 -0.02 0.00 1.54 0.00 0.00 36.73 39.79 1glq h TYR 111 CO 0.07 -0.43 -0.09 0.93 -1.64 0.00 0.00 178.16 176.99 1glq h GLU 112 N -0.82 -0.17 0.22 1.82 3.07 -1.94 -0.56 114.58 116.20 1glq h GLU 112 Ca -0.08 0.01 -0.32 0.00 -0.50 0.00 0.00 59.36 58.47 1glq h GLU 112 Cb 0.62 0.04 0.03 0.00 -0.84 0.00 0.00 28.75 28.59 1glq h GLU 112 CO 0.13 -0.11 -1.48 -0.91 -1.40 0.00 0.00 179.01 175.24 1glq h ASN 113 N -0.17 0.71 1.04 1.42 -0.26 -1.98 -3.39 115.58 112.96 1glq h ASN 113 Ca 0.03 -0.93 -0.11 0.00 -0.56 0.00 0.00 56.30 54.74 1glq h ASN 113 Cb 0.21 -0.23 -0.02 0.00 -1.06 0.00 0.00 38.32 37.22 1glq h ASN 113 CO -0.08 1.70 -0.51 1.23 -1.06 0.00 0.00 177.43 178.71 1glq h GLY 114 N 0.23 0.00 0.04 2.83 0.00 -0.15 -3.36 103.07 102.65 1glq h GLY 114 Ca -0.27 0.00 0.20 0.00 0.00 0.00 0.00 47.33 47.26 1glq h GLY 114 CO 0.22 0.00 0.58 1.70 0.00 0.00 0.00 176.54 179.04 1glq h LYS 115 N 0.00 0.66 0.32 4.80 3.64 -1.19 -1.98 116.57 122.82 1glq h LYS 115 Ca -0.01 -0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 59.32 1glq h LYS 115 Cb 1.17 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 32.84 1glq h LYS 115 CO 0.07 0.44 -0.15 -0.97 -2.27 0.00 0.00 179.45 176.56 1glq h ASN 116 N 0.68 -0.36 0.65 4.20 -0.00 -1.84 -1.82 115.58 117.09 1glq h ASN 116 Ca 0.59 -0.06 -0.08 0.00 -0.00 0.00 0.00 56.30 56.75 1glq h ASN 116 Cb 0.98 0.09 -0.01 0.00 -0.00 0.00 0.00 38.32 39.38 1glq h ASN 116 CO -0.42 -0.17 -0.39 0.44 -0.00 0.00 0.00 177.43 176.89 1glq h ASP 117 N -0.53 0.00 0.20 1.15 5.19 -1.72 -2.32 116.42 118.39 1glq h ASP 117 Ca -0.04 0.00 -0.01 0.00 -0.62 0.00 0.00 57.03 56.36 1glq h ASP 117 Cb 0.39 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.91 1glq h ASP 117 CO 0.07 0.39 -0.10 0.22 -3.12 0.00 0.00 179.24 176.71 1glq h TYR 118 N 0.00 -0.25 -0.09 4.55 5.03 -1.19 -1.03 116.97 123.99 1glq h TYR 118 Ca -0.00 -0.01 -0.02 0.00 2.58 0.00 0.00 58.73 61.28 1glq h TYR 118 Cb 0.82 0.08 -0.01 0.00 1.55 0.00 0.00 36.73 39.18 1glq h TYR 118 CO 0.00 0.01 -0.02 0.28 -1.32 0.00 0.00 178.16 177.11 1glq h VAL 119 N -0.50 1.08 -0.34 1.81 2.07 -1.28 -0.20 116.25 118.88 1glq h VAL 119 Ca -0.03 -0.31 -0.16 0.00 0.82 0.00 0.00 66.70 67.02 1glq h VAL 119 Cb 0.38 1.04 -0.00 0.00 -1.52 0.00 0.00 31.29 31.18 1glq h VAL 119 CO 0.05 0.10 -0.44 0.50 0.02 0.00 0.00 177.57 177.80 1glq h LYS 120 N 0.13 0.87 0.00 1.57 1.63 -1.10 -3.11 116.57 116.56 1glq h LYS 120 Ca 0.03 -0.48 0.00 0.00 -0.85 0.00 0.00 60.65 59.35 1glq h LYS 120 Cb 0.13 0.03 0.00 0.00 -0.60 0.00 0.00 32.23 31.79 1glq h LYS 120 CO 0.00 1.13 -0.11 0.00 -3.45 0.00 0.00 179.45 177.02 1glq n ALA 121 N -2.55 2.39 -0.32 5.00 0.00 -0.41 -4.36 120.51 120.27 1glq n ALA 121 Ca -0.03 -0.06 0.05 0.00 0.00 0.00 0.00 53.44 53.40 1glq n ALA 121 Cb 0.57 -1.42 0.24 0.00 0.00 0.00 0.00 19.45 18.84 1glq n ALA 121 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1glq h LEU 122 N 0.00 0.91 -1.40 0.00 5.85 -1.02 -2.80 115.31 116.85 1glq h LEU 122 Ca 0.00 0.02 0.07 0.00 0.84 0.00 0.00 57.88 58.81 1glq h LEU 122 Cb 0.74 -0.17 -0.05 0.00 0.37 0.00 0.00 40.66 41.55 1glq h LEU 122 CO 0.00 0.56 0.47 1.55 -0.34 0.00 0.00 178.44 180.68 1glq h PRO 123 N 1.02 0.70 0.00 5.25 0.13 -1.79 0.25 132.00 137.56 1glq h PRO 123 Ca 0.42 -0.04 -0.05 0.00 -0.87 0.00 0.00 66.00 65.46 1glq h PRO 123 Cb 0.29 -0.16 -0.01 0.00 0.13 0.00 0.00 31.00 31.26 1glq h PRO 123 CO -0.18 0.46 -0.25 0.78 -0.23 0.00 0.00 178.00 178.59 1glq h GLY 124 N 0.72 0.00 1.43 1.56 0.00 -1.81 -0.23 103.07 104.74 1glq h GLY 124 Ca 0.31 0.00 -0.07 0.00 0.00 0.00 0.00 47.33 47.58 1glq h GLY 124 CO -0.10 0.00 -0.78 0.45 0.00 0.00 0.00 176.54 176.10 1glq h HIS 125 N 0.00 0.00 0.00 5.60 3.86 -1.04 -3.35 115.15 120.22 1glq h HIS 125 Ca -0.00 0.00 -0.19 0.00 -1.16 0.00 0.00 60.37 59.02 1glq h HIS 125 Cb 0.44 0.00 -0.03 0.00 1.06 0.00 0.00 27.41 28.88 1glq h HIS 125 CO 0.00 0.26 -1.46 1.28 0.86 0.00 0.00 177.93 178.87 1glq n LEU 126 N -2.95 0.86 -0.28 2.43 4.77 -0.30 -4.34 117.00 117.20 1glq n LEU 126 Ca -0.01 0.38 0.07 0.00 -0.03 0.00 0.00 56.01 56.42 1glq n LEU 126 Cb 0.66 0.09 0.22 0.00 -2.33 0.00 0.00 43.42 42.06 1glq n LEU 126 CO 0.40 0.18 1.06 0.50 -1.33 0.00 0.00 177.39 178.19 1glq h LYS 127 N 0.00 0.50 -0.85 3.23 3.64 -1.20 -1.94 116.57 119.96 1glq h LYS 127 Ca -0.18 -0.03 0.20 0.00 -1.27 0.00 0.00 60.65 59.37 1glq h LYS 127 Cb 1.65 -0.11 -0.12 0.00 -0.41 0.00 0.00 32.23 33.24 1glq h LYS 127 CO 0.05 0.33 0.32 -1.35 -2.27 0.00 0.00 179.45 176.53 1glq h PRO 128 N 0.52 0.35 -0.21 1.90 0.11 -1.78 -0.71 132.00 132.18 1glq h PRO 128 Ca 0.45 -0.02 -0.15 0.00 0.11 0.00 0.00 66.00 66.40 1glq h PRO 128 Cb 0.69 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 31.71 1glq h PRO 128 CO -0.40 0.23 -0.48 0.74 -0.21 0.00 0.00 178.00 177.88 1glq h PHE 129 N 0.36 0.66 -0.36 0.65 0.04 -1.63 -0.09 116.94 116.57 1glq h PHE 129 Ca 0.51 -0.21 -0.04 0.00 2.80 0.00 0.00 57.97 61.03 1glq h PHE 129 Cb 0.93 -0.13 -0.01 0.00 2.20 0.00 0.00 35.95 38.94 1glq h PHE 129 CO -0.18 0.92 0.07 1.49 -0.60 0.00 0.00 178.31 180.00 1glq h GLU 130 N 0.43 0.59 -0.58 1.51 4.57 -1.13 -1.43 114.58 118.54 1glq h GLU 130 Ca 0.02 -0.15 -0.01 0.00 -1.18 0.00 0.00 59.36 58.04 1glq h GLU 130 Cb 0.99 -0.07 -0.03 0.00 -0.16 0.00 0.00 28.75 29.49 1glq h GLU 130 CO 0.09 0.65 0.32 1.15 -1.18 0.00 0.00 179.01 180.04 1glq h THR 131 N 0.43 1.19 -0.83 0.32 2.02 -0.75 -1.64 112.91 113.65 1glq h THR 131 Ca 0.11 -0.48 0.01 0.00 0.77 0.00 0.00 66.41 66.83 1glq h THR 131 Cb 0.34 0.45 -0.04 0.00 -1.74 0.00 0.00 68.15 67.16 1glq h THR 131 CO 0.01 0.20 0.54 -0.07 0.37 0.00 0.00 175.52 176.57 1glq h LEU 132 N 0.78 0.94 -0.53 2.58 3.38 -0.77 -1.87 115.31 119.82 1glq h LEU 132 Ca 0.20 -0.02 -0.04 0.00 0.09 0.00 0.00 57.88 58.11 1glq h LEU 132 Cb 0.04 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.54 1glq h LEU 132 CO -0.03 0.67 0.16 -0.07 0.09 0.00 0.00 178.44 179.26 1glq h LEU 133 N 1.10 0.78 -0.90 1.67 3.38 -1.07 -2.13 115.31 118.16 1glq h LEU 133 Ca 0.31 -0.21 -0.04 0.00 0.09 0.00 0.00 57.88 58.02 1glq h LEU 133 Cb -0.11 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.41 1glq h LEU 133 CO -0.07 0.79 0.30 0.77 0.09 0.00 0.00 178.44 180.32 1glq h SER 134 N 0.74 1.02 0.55 -0.43 4.64 -0.86 0.27 113.55 119.48 1glq h SER 134 Ca 0.17 -0.15 -0.00 0.00 -0.47 0.00 0.00 61.79 61.34 1glq h SER 134 Cb 0.29 -0.26 -0.00 0.00 -0.31 0.00 0.00 62.40 62.12 1glq h SER 134 CO -0.00 0.90 -0.01 1.56 -0.87 0.00 0.00 176.83 178.41 1glq h GLN 135 N 1.08 0.00 -4.13 4.77 4.20 -1.11 -2.92 115.11 117.00 1glq h GLN 135 Ca 0.25 0.00 -0.71 0.00 0.06 0.00 0.00 58.65 58.26 1glq h GLN 135 Cb 0.20 0.00 -0.33 0.00 0.30 0.00 0.00 27.48 27.64 1glq h GLN 135 CO -0.02 0.01 -0.43 1.21 -0.67 0.00 0.00 178.83 178.93 1glq s ASN 136 N -5.49 5.42 -1.47 1.46 2.47 -0.45 -4.68 114.94 112.20 1glq s ASN 136 Ca -0.02 -2.30 -0.12 0.00 0.42 0.00 0.00 52.86 50.84 1glq s ASN 136 Cb 0.11 -1.89 0.06 0.00 -1.45 0.00 0.00 41.25 38.07 1glq s ASN 136 CO 0.49 -0.52 1.03 0.00 -3.72 0.00 0.00 177.10 174.37 1glq n GLN 137 N 4.28 -6.27 -3.14 0.43 6.02 -1.26 -1.55 117.38 115.89 1glq n GLN 137 Ca 0.00 0.68 -0.23 0.00 -0.01 0.00 0.00 57.00 57.45 1glq n GLN 137 Cb 0.40 -5.63 0.02 0.00 1.02 0.00 0.00 30.24 26.06 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 -1.78 -0.51 2.88 1.08 0.00 -1.10 -2.12 105.19 103.63 1glq n GLY 138 Ca 0.03 0.12 0.00 0.00 0.00 0.00 0.00 46.02 46.17 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 -1.43 0.86 0.29 -0.02 0.00 0.83 -4.83 105.19 100.90 1glq n GLY 139 Ca -0.08 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.08 1glq n GLY 139 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1glq n LYS 140 N -2.14 1.25 0.00 1.61 5.02 -0.90 -4.83 118.16 118.17 1glq n LYS 140 Ca 0.00 -0.59 0.00 0.00 -2.02 0.00 0.00 58.31 55.70 1glq n LYS 140 Cb 0.00 -1.49 0.00 0.00 -0.02 0.00 0.00 35.03 33.53 1glq n LYS 140 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1glq n ALA 141 N -0.36 0.00 -3.85 7.82 0.00 -1.26 -5.13 120.51 117.73 1glq n ALA 141 Ca 0.18 0.00 -0.18 0.00 0.00 0.00 0.00 53.44 53.44 1glq n ALA 141 Cb 0.29 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.74 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 -0.69 0.06 0.00 3.72 -1.20 -5.03 117.46 114.32 1glq n PHE 142 Ca 0.00 -1.44 -0.08 0.00 -0.05 0.00 0.00 57.45 55.88 1glq n PHE 142 Cb 0.00 -0.26 0.06 0.00 -0.94 0.00 0.00 39.48 38.34 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 0.69 1.38 -3.35 4.37 6.09 -1.96 -3.41 117.51 121.31 1glq h ILE 143 Ca -0.22 -2.04 -0.44 0.00 -1.37 0.00 0.00 64.86 60.78 1glq h ILE 143 Cb 0.78 2.03 -0.36 0.00 0.47 0.00 0.00 36.82 39.74 1glq h ILE 143 CO 0.35 0.61 -0.78 -0.69 -3.07 0.00 0.00 178.15 174.57 1glq s VAL 144 N -3.71 0.59 0.00 2.19 1.01 -1.26 -4.70 120.40 114.52 1glq s VAL 144 Ca -0.05 -0.09 0.00 0.00 0.00 0.00 0.00 61.98 61.84 1glq s VAL 144 Cb 0.11 -0.65 0.00 0.00 0.00 0.00 0.00 36.38 35.84 1glq s VAL 144 CO 0.83 0.27 0.00 0.61 0.00 0.00 0.00 175.10 176.80 1glq n GLY 145 N 4.52 -0.95 0.34 4.51 0.00 -1.26 -4.39 105.19 107.95 1glq n GLY 145 Ca -0.17 -1.20 0.09 0.00 0.00 0.00 0.00 46.02 44.74 1glq n GLY 145 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1glq n ASP 146 N -0.69 1.60 -4.22 1.61 8.00 -1.26 -3.24 116.55 118.34 1glq n ASP 146 Ca 0.00 -1.30 -0.20 0.00 0.71 0.00 0.00 54.79 54.00 1glq n ASP 146 Cb 0.00 0.56 -0.12 0.00 -0.02 0.00 0.00 41.12 41.54 1glq n ASP 146 CO 0.00 0.00 0.00 -1.58 -0.39 0.00 0.00 177.20 175.23 1glq s GLN 147 N -2.19 0.95 0.62 -1.24 0.74 -1.26 -4.76 119.66 112.52 1glq s GLN 147 Ca 0.14 -1.06 -0.19 0.00 0.05 0.00 0.00 55.36 54.29 1glq s GLN 147 Cb 0.14 -1.04 -0.02 0.00 1.10 0.00 0.00 33.01 33.19 1glq s GLN 147 CO 0.50 0.23 1.31 -1.50 -0.55 0.00 0.00 175.29 175.29 1glq s ILE 148 N -1.33 2.04 0.26 -2.34 2.07 -1.26 -4.82 121.20 115.83 1glq s ILE 148 Ca 0.02 0.03 0.02 0.00 -1.41 0.00 0.00 60.65 59.31 1glq s ILE 148 Cb -0.09 -3.01 -0.04 0.00 0.13 0.00 0.00 42.46 39.44 1glq s ILE 148 CO 0.03 -0.00 0.15 -0.94 -1.91 0.00 0.00 174.94 172.26 1glq s SER 149 N -1.26 0.97 0.45 4.50 1.04 -1.26 -4.77 113.70 113.36 1glq s SER 149 Ca 0.80 -1.48 0.15 0.00 0.48 0.00 0.00 55.95 55.89 1glq s SER 149 Cb -0.38 0.35 1.08 0.00 0.10 0.00 0.00 66.02 67.17 1glq s SER 149 CO 0.42 -0.85 2.01 2.19 0.98 0.00 0.00 173.24 177.99 1glq h PHE 150 N 2.39 0.34 -0.47 5.02 -0.00 -1.67 -1.83 116.94 120.73 1glq h PHE 150 Ca -0.35 0.01 -0.04 0.00 -0.00 0.00 0.00 57.97 57.59 1glq h PHE 150 Cb 1.25 -0.11 -0.02 0.00 -0.00 0.00 0.00 35.95 37.06 1glq h PHE 150 CO 0.73 0.17 0.11 0.00 -0.00 0.00 0.00 178.31 179.32 1glq h ALA 151 N 1.74 1.32 -0.50 12.09 0.00 -1.89 -2.74 119.26 129.28 1glq h ALA 151 Ca 0.23 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 1glq h ALA 151 Cb 0.46 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 1glq h ALA 151 CO -0.05 0.48 0.18 -0.44 0.00 0.00 0.00 179.25 179.42 1glq h ASP 152 N 0.68 0.71 -0.70 0.00 3.32 -1.73 -1.01 116.42 117.69 1glq h ASP 152 Ca 0.15 -0.18 -0.05 0.00 0.02 0.00 0.00 57.03 56.97 1glq h ASP 152 Cb 0.26 -0.19 -0.03 0.00 0.22 0.00 0.00 39.33 39.59 1glq h ASP 152 CO -0.00 0.70 0.25 1.88 -1.72 0.00 0.00 179.24 180.35 1glq h TYR 153 N 0.68 1.12 -0.26 4.55 0.05 -1.52 0.28 116.97 121.87 1glq h TYR 153 Ca 0.17 -0.09 -0.19 0.00 0.05 0.00 0.00 58.73 58.66 1glq h TYR 153 Cb 0.23 -0.33 0.00 0.00 1.01 0.00 0.00 36.73 37.64 1glq h TYR 153 CO 0.01 0.87 -0.58 -0.97 -1.05 0.00 0.00 178.16 176.43 1glq h ASN 154 N 1.06 0.97 -0.47 3.88 -0.00 -1.32 -2.31 115.58 117.39 1glq h ASN 154 Ca 0.24 -0.55 -0.11 0.00 -0.00 0.00 0.00 56.30 55.87 1glq h ASN 154 Cb 0.26 -0.28 -0.01 0.00 -0.00 0.00 0.00 38.32 38.28 1glq h ASN 154 CO -0.01 1.34 -0.15 0.25 -0.00 0.00 0.00 177.43 178.86 1glq h LEU 155 N 0.64 0.94 -0.15 0.34 5.85 -0.85 -2.05 115.31 120.02 1glq h LEU 155 Ca 0.00 -0.38 0.02 0.00 0.84 0.00 0.00 57.88 58.36 1glq h LEU 155 Cb 1.20 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 41.95 1glq h LEU 155 CO 0.13 1.11 0.03 0.25 -0.34 0.00 0.00 178.44 179.61 1glq h LEU 156 N 0.78 0.01 -0.41 2.25 5.85 -0.96 -0.81 115.31 122.02 1glq h LEU 156 Ca 0.11 0.02 0.05 0.00 0.84 0.00 0.00 57.88 58.91 1glq h LEU 156 Cb 0.71 0.03 -0.05 0.00 0.37 0.00 0.00 40.66 41.73 1glq h LEU 156 CO 0.05 0.03 0.13 -0.78 -0.34 0.00 0.00 178.44 177.53 1glq h ASP 157 N 0.09 0.12 -0.66 1.25 3.58 -1.35 0.89 116.42 120.35 1glq h ASP 157 Ca 0.07 0.05 -0.00 0.00 0.42 0.00 0.00 57.03 57.57 1glq h ASP 157 Cb 0.06 0.04 -0.03 0.00 1.72 0.00 0.00 39.33 41.12 1glq h ASP 157 CO -0.09 0.11 0.41 0.25 -2.88 0.00 0.00 179.24 177.04 1glq h LEU 158 N 0.29 0.79 -0.46 2.28 5.85 -1.03 -1.96 115.31 121.06 1glq h LEU 158 Ca 0.19 -0.05 -0.15 0.00 0.84 0.00 0.00 57.88 58.71 1glq h LEU 158 Cb 0.19 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.01 1glq h LEU 158 CO -0.21 0.61 -0.39 -0.07 -0.34 0.00 0.00 178.44 178.04 1glq h LEU 159 N 0.90 0.91 -0.80 2.25 3.38 -0.71 -2.34 115.31 118.90 1glq h LEU 159 Ca 0.24 -0.41 -0.02 0.00 0.09 0.00 0.00 57.88 57.78 1glq h LEU 159 Cb -0.05 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.41 1glq h LEU 159 CO -0.05 1.18 0.44 -0.07 0.09 0.00 0.00 178.44 180.04 1glq h LEU 160 N 0.70 1.00 -0.52 1.67 3.38 -0.50 -1.03 115.31 120.01 1glq h LEU 160 Ca 0.06 -0.10 -0.11 0.00 0.09 0.00 0.00 57.88 57.82 1glq h LEU 160 Cb 0.96 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.44 1glq h LEU 160 CO 0.09 0.81 -0.53 0.16 0.09 0.00 0.00 178.44 179.07 1glq h ILE 161 N 1.11 1.06 -0.13 1.22 3.07 -1.30 -2.88 117.51 119.66 1glq h ILE 161 Ca 0.28 -2.06 -0.13 0.00 1.55 0.00 0.00 64.86 64.50 1glq h ILE 161 Cb 0.03 2.22 -0.01 0.00 -0.27 0.00 0.00 36.82 38.79 1glq h ILE 161 CO -0.05 0.52 -0.50 0.45 -1.05 0.00 0.00 178.15 177.52 1glq h HIS 162 N 0.00 0.42 -0.26 0.16 3.86 -0.94 -1.98 115.15 116.41 1glq h HIS 162 Ca -0.01 -0.14 -0.07 0.00 -1.16 0.00 0.00 60.37 58.99 1glq h HIS 162 Cb 1.18 -0.08 -0.01 0.00 1.06 0.00 0.00 27.41 29.55 1glq h HIS 162 CO 0.00 0.78 -0.15 1.96 0.86 0.00 0.00 177.93 181.38 1glq h GLN 163 N 0.27 0.45 -0.46 2.45 4.20 -1.00 0.11 115.11 121.14 1glq h GLN 163 Ca 0.01 -0.13 -0.13 0.00 0.06 0.00 0.00 58.65 58.46 1glq h GLN 163 Cb 0.98 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.70 1glq h GLN 163 CO 0.08 0.59 -0.20 0.28 -0.67 0.00 0.00 178.83 178.91 1glq h VAL 164 N 0.42 1.27 -0.13 -0.54 2.07 -1.32 -2.88 116.25 115.14 1glq h VAL 164 Ca 0.08 -1.36 -0.14 0.00 0.82 0.00 0.00 66.70 66.10 1glq h VAL 164 Cb 0.51 1.18 -0.01 0.00 -1.52 0.00 0.00 31.29 31.44 1glq h VAL 164 CO 0.03 0.47 -0.51 0.25 0.02 0.00 0.00 177.57 177.82 1glq h LEU 165 N 0.78 0.38 -6.13 2.57 7.12 -0.83 -3.40 115.31 115.81 1glq h LEU 165 Ca 0.10 -0.19 -0.36 0.00 0.13 0.00 0.00 57.88 57.56 1glq h LEU 165 Cb 0.78 -0.11 -0.29 0.00 -0.53 0.00 0.00 40.66 40.51 1glq h LEU 165 CO 0.06 0.83 -0.70 0.00 -0.13 0.00 0.00 178.44 178.50 1glq s ALA 166 N -3.98 -0.45 0.47 1.25 0.00 0.35 -5.04 121.76 114.37 1glq s ALA 166 Ca -0.05 -1.12 0.25 0.00 0.00 0.00 0.00 51.96 51.03 1glq s ALA 166 Cb 0.12 -2.11 1.28 0.00 0.00 0.00 0.00 23.12 22.42 1glq s ALA 166 CO 0.80 -2.14 1.86 -1.35 0.00 0.00 0.00 175.76 174.94 1glq h PRO 167 N 6.45 0.20 -0.59 0.00 0.11 -1.73 0.79 132.00 137.23 1glq h PRO 167 Ca 0.10 -0.01 -0.03 0.00 0.11 0.00 0.00 66.00 66.16 1glq h PRO 167 Cb 1.04 -0.05 -0.02 0.00 0.11 0.00 0.00 31.00 32.09 1glq h PRO 167 CO 0.19 0.13 0.04 0.41 -0.21 0.00 0.00 178.00 178.57 1glq n GLY 168 N -1.61 3.14 0.25 -0.55 0.00 -1.26 -4.60 105.19 100.56 1glq n GLY 168 Ca 0.20 -0.95 0.11 0.00 0.00 0.00 0.00 46.02 45.38 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 -3.69 4.02 0.17 0.00 4.77 -1.26 -4.46 117.00 116.54 1glq n LEU 170 Ca -0.02 -2.01 0.03 0.00 -0.03 0.00 0.00 56.01 53.98 1glq n LEU 170 Cb 0.27 -0.50 0.39 0.00 -2.33 0.00 0.00 43.42 41.25 1glq n LEU 170 CO 0.31 0.91 0.81 0.44 -1.33 0.00 0.00 177.39 178.53 1glq h ASP 171 N 4.10 0.09 -0.56 -1.43 3.32 -1.73 -1.21 116.42 119.00 1glq h ASP 171 Ca 0.00 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.03 1glq h ASP 171 Cb 1.07 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 40.60 1glq h ASP 171 CO 0.06 0.35 0.00 0.59 -1.72 0.00 0.00 179.24 178.52 1glq n ASN 172 N -4.20 3.06 -3.81 6.45 5.03 -1.26 -4.65 115.26 115.89 1glq n ASN 172 Ca -0.02 -2.02 -0.28 0.00 0.87 0.00 0.00 54.58 53.13 1glq n ASN 172 Cb 0.33 -0.39 -0.12 0.00 -1.02 0.00 0.00 39.78 38.59 1glq n ASN 172 CO 0.00 0.00 0.00 -0.36 -1.83 0.00 0.00 177.26 175.07 1glq s PHE 173 N -1.28 3.03 0.18 3.10 0.08 -0.46 -4.98 117.98 117.66 1glq s PHE 173 Ca 0.38 -3.11 -0.12 0.00 0.12 0.00 0.00 56.93 54.20 1glq s PHE 173 Cb 0.20 -2.36 0.16 0.00 -0.57 0.00 0.00 43.02 40.44 1glq s PHE 173 CO 0.25 -0.62 1.78 -1.35 -0.10 0.00 0.00 175.22 175.18 1glq h PRO 174 N 5.59 0.47 -0.45 0.24 0.11 -1.83 -0.57 132.00 135.57 1glq h PRO 174 Ca 0.14 -0.03 -0.13 0.00 0.11 0.00 0.00 66.00 66.09 1glq h PRO 174 Cb 0.80 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 31.79 1glq h PRO 174 CO 0.64 0.31 -0.24 -0.07 -0.21 0.00 0.00 178.00 178.44 1glq h LEU 175 N 0.48 0.95 -0.69 2.35 3.38 -1.93 -1.13 115.31 118.72 1glq h LEU 175 Ca 0.24 -0.37 -0.13 0.00 0.09 0.00 0.00 57.88 57.71 1glq h LEU 175 Cb 0.17 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 1glq h LEU 175 CO -0.18 1.14 -0.37 -0.07 0.09 0.00 0.00 178.44 179.05 1glq h LEU 176 N 0.80 0.61 -0.25 1.67 3.38 -1.84 -0.16 115.31 119.52 1glq h LEU 176 Ca 0.10 -0.26 -0.03 0.00 0.09 0.00 0.00 57.88 57.78 1glq h LEU 176 Cb 0.80 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.37 1glq h LEU 176 CO 0.07 0.93 0.05 0.28 0.09 0.00 0.00 178.44 179.86 1glq h SER 177 N 0.49 0.39 -0.65 -0.43 0.02 -0.77 -1.45 113.55 111.16 1glq h SER 177 Ca 0.05 -0.24 -0.06 0.00 -0.84 0.00 0.00 61.79 60.69 1glq h SER 177 Cb 0.87 -0.10 -0.03 0.00 0.14 0.00 0.00 62.40 63.27 1glq h SER 177 CO 0.07 0.54 0.18 0.00 -1.14 0.00 0.00 176.83 176.48 1glq h ALA 178 N 0.87 1.05 -0.30 3.77 0.00 -1.11 -2.22 119.26 121.33 1glq h ALA 178 Ca 0.08 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 1glq h ALA 178 Cb 0.30 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1glq h ALA 178 CO 0.00 0.63 0.16 -0.92 0.00 0.00 0.00 179.25 179.13 1glq h TYR 179 N 1.00 0.41 -0.51 0.00 3.20 -0.76 0.74 116.97 121.05 1glq h TYR 179 Ca 0.21 -0.01 -0.02 0.00 3.14 0.00 0.00 58.73 62.06 1glq h TYR 179 Cb 0.33 -0.13 -0.02 0.00 1.54 0.00 0.00 36.73 38.44 1glq h TYR 179 CO 0.02 0.34 0.25 0.28 -1.64 0.00 0.00 178.16 177.41 1glq h VAL 180 N 0.37 1.19 -0.61 1.81 2.07 -1.11 -0.01 116.25 119.96 1glq h VAL 180 Ca 0.11 -0.54 -0.02 0.00 0.82 0.00 0.00 66.70 67.06 1glq h VAL 180 Cb 0.06 0.61 -0.03 0.00 -1.52 0.00 0.00 31.29 30.42 1glq h VAL 180 CO -0.02 0.22 0.29 0.00 0.02 0.00 0.00 177.57 178.08 1glq h ALA 181 N 1.09 0.79 -0.04 1.67 0.00 -1.16 -0.80 119.26 120.81 1glq h ALA 181 Ca 0.18 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 1glq h ALA 181 Cb 0.11 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.66 1glq h ALA 181 CO -0.02 0.36 0.01 -0.09 0.00 0.00 0.00 179.25 179.50 1glq h ARG 182 N 0.84 0.07 -0.01 0.00 2.43 -0.48 -2.52 114.38 114.70 1glq h ARG 182 Ca 0.21 -0.02 -0.15 0.00 -0.81 0.00 0.00 59.98 59.21 1glq h ARG 182 Cb 0.13 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.65 1glq h ARG 182 CO -0.03 0.28 -0.70 -0.07 -1.51 0.00 0.00 179.97 177.94 1glq h LEU 183 N -0.16 0.09 -1.74 3.80 4.07 -0.92 -2.70 115.31 117.75 1glq h LEU 183 Ca 0.01 -0.06 -0.04 0.00 0.08 0.00 0.00 57.88 57.88 1glq h LEU 183 Cb 0.24 -0.03 -0.01 0.00 1.08 0.00 0.00 40.66 41.95 1glq h LEU 183 CO 0.00 0.76 -0.17 0.28 -1.08 0.00 0.00 178.44 178.23 1glq h SER 184 N 0.05 0.00 1.16 -0.43 0.02 -1.11 -2.46 113.55 110.77 1glq h SER 184 Ca -0.01 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.94 1glq h SER 184 Cb 1.24 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.78 1glq h SER 184 CO 0.10 0.17 -0.00 0.00 -1.14 0.00 0.00 176.83 175.95 1glq n ALA 185 N -2.34 2.32 -1.68 3.77 0.00 -0.95 -2.89 120.51 118.74 1glq n ALA 185 Ca -0.02 -0.08 -0.46 0.00 0.00 0.00 0.00 53.44 52.89 1glq n ALA 185 Cb 0.27 -1.47 -0.04 0.00 0.00 0.00 0.00 19.45 18.21 1glq n ALA 185 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1glq n ARG 186 N -1.75 2.28 -0.27 0.00 1.74 -0.93 -4.71 116.66 113.01 1glq n ARG 186 Ca 0.07 0.83 0.07 0.00 -0.77 0.00 0.00 57.85 58.04 1glq n ARG 186 Cb 0.37 -2.63 0.19 0.00 -1.02 0.00 0.00 32.46 29.37 1glq n ARG 186 CO 0.00 0.00 0.00 -1.35 -1.52 0.00 0.00 177.63 174.76 1glq h PRO 187 N 6.98 0.12 0.00 5.56 0.11 -1.91 0.79 132.00 143.65 1glq h PRO 187 Ca -0.46 -0.01 -0.11 0.00 0.11 0.00 0.00 66.00 65.54 1glq h PRO 187 Cb 1.25 -0.03 -0.02 0.00 0.11 0.00 0.00 31.00 32.32 1glq h PRO 187 CO 0.91 0.08 -0.51 0.87 -0.21 0.00 0.00 178.00 179.14 1glq h LYS 188 N 0.12 0.00 0.00 1.05 1.57 -1.90 -2.12 116.57 115.29 1glq h LYS 188 Ca 0.45 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 59.23 1glq h LYS 188 Cb 0.83 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.14 1glq h LYS 188 CO -0.68 0.51 -0.00 0.82 -0.57 0.00 0.00 179.45 179.53 1glq h ILE 189 N 0.00 1.54 -0.81 1.86 2.04 -1.23 -2.28 117.51 118.63 1glq h ILE 189 Ca -0.01 -1.65 0.16 0.00 1.00 0.00 0.00 64.86 64.37 1glq h ILE 189 Cb 1.36 2.66 -0.10 0.00 -0.74 0.00 0.00 36.82 40.00 1glq h ILE 189 CO 0.07 0.43 0.34 0.50 0.00 0.00 0.00 178.15 179.48 1glq h LYS 190 N -0.72 0.44 -0.63 2.37 3.64 -0.96 0.23 116.57 120.95 1glq h LYS 190 Ca -0.00 -0.03 -0.06 0.00 -1.27 0.00 0.00 60.65 59.29 1glq h LYS 190 Cb 0.70 -0.10 -0.03 0.00 -0.41 0.00 0.00 32.23 32.40 1glq h LYS 190 CO 0.00 0.29 0.15 0.00 -2.27 0.00 0.00 179.45 177.62 1glq h ALA 191 N 1.60 0.83 -0.43 5.00 0.00 -1.43 -1.52 119.26 123.31 1glq h ALA 191 Ca 0.46 -0.24 -0.08 0.00 0.00 0.00 0.00 54.91 55.06 1glq h ALA 191 Cb 0.75 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 1glq h ALA 191 CO -0.44 0.54 -0.04 0.35 0.00 0.00 0.00 179.25 179.66 1glq h PHE 192 N 0.92 0.86 0.00 0.00 3.57 -0.50 -2.01 116.94 119.79 1glq h PHE 192 Ca 0.20 -0.17 -0.06 0.00 3.53 0.00 0.00 57.97 61.47 1glq h PHE 192 Cb 0.36 -0.22 -0.01 0.00 2.79 0.00 0.00 35.95 38.88 1glq h PHE 192 CO 0.03 0.87 -0.27 -0.07 -2.23 0.00 0.00 178.31 176.64 1glq h LEU 193 N 0.61 0.00 -1.00 0.59 3.38 -0.39 -1.69 115.31 116.82 1glq h LEU 193 Ca 0.12 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.09 1glq h LEU 193 Cb 0.55 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.30 1glq h LEU 193 CO 0.03 0.27 -0.09 -1.20 0.09 0.00 0.00 178.44 177.53 1glq n SER 194 N -3.67 1.64 -4.77 -0.43 7.64 -0.59 -4.57 113.62 108.87 1glq n SER 194 Ca -0.01 -1.43 -0.38 0.00 1.01 0.00 0.00 58.87 58.06 1glq n SER 194 Cb 0.38 0.06 -0.02 0.00 -1.01 0.00 0.00 64.21 63.63 1glq n SER 194 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1glq s SER 195 N -2.15 6.52 0.42 6.43 1.04 -0.63 -4.84 113.70 120.48 1glq s SER 195 Ca 0.32 2.32 0.10 0.00 0.48 0.00 0.00 55.95 59.17 1glq s SER 195 Cb 0.20 -2.61 0.91 0.00 0.10 0.00 0.00 66.02 64.62 1glq s SER 195 CO 0.39 -0.68 2.01 1.55 0.98 0.00 0.00 173.24 177.49 1glq h PRO 196 N 2.60 0.29 -0.57 4.02 0.13 -1.92 0.11 132.00 136.66 1glq h PRO 196 Ca -0.49 -0.04 -0.02 0.00 -0.87 0.00 0.00 66.00 64.59 1glq h PRO 196 Cb 1.23 -0.05 -0.03 0.00 0.13 0.00 0.00 31.00 32.28 1glq h PRO 196 CO 0.62 0.29 0.28 0.93 -0.23 0.00 0.00 178.00 179.90 1glq h GLU 197 N 0.29 0.81 -0.08 0.86 5.08 -1.92 0.13 114.58 119.74 1glq h GLU 197 Ca 0.07 -0.11 -0.04 0.00 -1.00 0.00 0.00 59.36 58.28 1glq h GLU 197 Cb 0.15 -0.15 -0.00 0.00 0.50 0.00 0.00 28.75 29.25 1glq h GLU 197 CO -0.00 0.65 -0.11 1.25 -1.00 0.00 0.00 179.01 179.80 1glq h HIS 198 N 0.77 0.26 -0.38 4.33 2.76 -1.60 -3.12 115.15 118.16 1glq h HIS 198 Ca 0.20 -0.09 -0.05 0.00 -2.20 0.00 0.00 60.37 58.23 1glq h HIS 198 Cb 0.10 -0.05 -0.02 0.00 1.55 0.00 0.00 27.41 28.99 1glq h HIS 198 CO -0.01 0.69 0.03 0.28 -1.30 0.00 0.00 177.93 177.62 1glq h VAL 199 N -0.24 1.20 0.00 5.26 2.07 -0.63 -2.68 116.25 121.23 1glq h VAL 199 Ca 0.01 -0.77 0.00 0.00 0.82 0.00 0.00 66.70 66.76 1glq h VAL 199 Cb 0.66 0.88 0.00 0.00 -1.52 0.00 0.00 31.29 31.31 1glq h VAL 199 CO 0.03 0.27 -0.14 0.59 0.02 0.00 0.00 177.57 178.33 1glq n ASN 200 N -4.29 0.65 -4.69 0.57 5.03 0.42 -4.76 115.26 108.20 1glq n ASN 200 Ca 0.02 0.44 -0.42 0.00 0.87 0.00 0.00 54.58 55.49 1glq n ASN 200 Cb 0.23 -0.52 -0.03 0.00 -1.02 0.00 0.00 39.78 38.44 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 -3.09 4.41 0.61 3.52 3.52 -1.01 -5.03 118.95 121.87 1glq s ARG 201 Ca 0.10 1.32 -0.19 0.00 -0.13 0.00 0.00 55.73 56.83 1glq s ARG 201 Cb 0.14 -3.54 -0.03 0.00 -1.56 0.00 0.00 34.95 29.96 1glq s ARG 201 CO 0.61 -0.30 1.25 -1.25 -0.81 0.00 0.00 175.30 174.81 1glq s PRO 202 N 1.98 2.81 0.11 5.12 0.04 -1.26 -4.72 135.00 139.07 1glq s PRO 202 Ca 0.46 1.95 -0.16 0.00 0.04 0.00 0.00 61.00 63.30 1glq s PRO 202 Cb -0.18 -1.91 -0.05 0.00 0.04 0.00 0.00 34.50 32.40 1glq s PRO 202 CO 0.17 -1.36 1.52 0.82 0.04 0.00 0.00 177.00 178.18 1glq h ILE 203 N 0.78 1.28 -2.65 0.56 2.04 -1.94 0.89 117.51 118.47 1glq h ILE 203 Ca -0.51 -1.12 -0.49 0.00 1.00 0.00 0.00 64.86 63.74 1glq h ILE 203 Cb 1.31 1.30 -0.14 0.00 -0.74 0.00 0.00 36.82 38.56 1glq h ILE 203 CO 0.54 0.37 -0.63 0.20 0.00 0.00 0.00 178.15 178.63 1glq s ASN 204 N -6.24 2.66 0.40 1.72 -0.87 -1.26 -1.67 114.94 109.67 1glq s ASN 204 Ca -0.13 -1.31 0.25 0.00 -1.57 0.00 0.00 52.86 50.10 1glq s ASN 204 Cb 0.09 -0.15 0.58 0.00 -0.02 0.00 0.00 41.25 41.75 1glq s ASN 204 CO 0.79 -0.50 1.69 1.23 -2.57 0.00 0.00 177.10 177.74 1glq h GLY 205 N 2.14 0.00 -2.35 0.66 0.00 -1.89 -3.34 103.07 98.28 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 -2.89 4.29 0.00 0.19 2.04 -1.26 -4.98 115.26 112.66 1glq n ASN 206 Ca 0.04 -2.60 0.00 0.00 -0.44 0.00 0.00 54.58 51.58 1glq n ASN 206 Cb 0.47 -0.52 0.00 0.00 -2.53 0.00 0.00 39.78 37.21 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 0.45 2.63 3.82 4.83 0.00 -1.26 -5.00 105.19 110.65 1glq n GLY 207 Ca 0.22 0.00 -0.34 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 0.00 4.28 0.00 1.61 1.02 -1.26 -5.02 119.74 120.37 1glq s LYS 208 Ca 0.00 1.03 0.00 0.00 0.02 0.00 0.00 55.97 57.02 1glq s LYS 208 Cb 0.00 -2.52 0.00 0.00 -0.52 0.00 0.00 37.83 34.79 1glq s LYS 208 CO 0.00 0.17 0.00 0.00 -0.92 0.00 0.00 175.35 174.60