#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1aqv s PRO 2 N 0.00 2.76 0.23 0.54 0.04 -1.26 -3.71 135.00 133.60 1aqv s PRO 2 Ca 0.00 0.44 0.09 0.00 0.04 0.00 0.00 61.00 61.58 1aqv s PRO 2 Cb 0.00 -2.01 -0.04 0.00 0.04 0.00 0.00 34.50 32.49 1aqv s PRO 2 CO 0.00 -1.10 -0.04 0.71 0.04 0.00 0.00 177.00 176.61 1aqv s TYR 3 N -3.37 2.67 -0.04 0.56 2.02 -1.26 -2.34 117.35 115.59 1aqv s TYR 3 Ca 0.59 -0.22 -0.03 0.00 -0.37 0.00 0.00 57.07 57.03 1aqv s TYR 3 Cb -0.11 -1.23 0.02 0.00 -0.40 0.00 0.00 41.96 40.24 1aqv s TYR 3 CO 0.52 0.58 0.11 0.99 -1.57 0.00 0.00 175.55 176.18 1aqv s THR 4 N -2.08 -0.02 -0.04 -0.71 2.01 -0.85 -0.41 115.64 113.54 1aqv s THR 4 Ca 0.29 0.06 0.07 0.00 0.31 0.00 0.00 61.69 62.42 1aqv s THR 4 Cb -0.07 -0.17 -0.02 0.00 0.01 0.00 0.00 72.50 72.25 1aqv s THR 4 CO 0.18 0.02 -0.25 -0.69 -0.69 0.00 0.00 174.62 173.19 1aqv s VAL 5 N 0.40 2.09 -0.12 3.82 1.01 -0.08 -1.06 120.40 126.47 1aqv s VAL 5 Ca -0.03 -1.07 0.01 0.00 0.00 0.00 0.00 61.98 60.89 1aqv s VAL 5 Cb -0.04 -1.74 0.02 0.00 0.00 0.00 0.00 36.38 34.62 1aqv s VAL 5 CO -0.02 0.58 -0.15 -0.69 0.00 0.00 0.00 175.10 174.82 1aqv s VAL 6 N -0.38 1.51 0.10 2.92 1.01 -0.18 -0.94 120.40 124.44 1aqv s VAL 6 Ca 0.03 -0.63 -0.26 0.00 0.00 0.00 0.00 61.98 61.12 1aqv s VAL 6 Cb -0.12 -1.39 0.08 0.00 0.00 0.00 0.00 36.38 34.96 1aqv s VAL 6 CO 0.01 0.44 1.09 -0.47 0.00 0.00 0.00 175.10 176.18 1aqv s TYR 7 N 1.11 -0.04 0.74 5.22 5.04 -1.06 -2.01 117.35 126.34 1aqv s TYR 7 Ca -0.04 -0.22 -0.11 0.00 -2.44 0.00 0.00 57.07 54.26 1aqv s TYR 7 Cb -0.14 0.63 0.04 0.00 0.35 0.00 0.00 41.96 42.83 1aqv s TYR 7 CO -0.04 -0.67 1.08 -0.06 -1.34 0.00 0.00 175.55 174.52 1aqv s PHE 8 N -2.67 2.86 -1.52 4.97 0.08 -1.26 -0.99 117.98 119.45 1aqv s PHE 8 Ca 0.17 1.42 -0.11 0.00 0.12 0.00 0.00 56.93 58.52 1aqv s PHE 8 Cb 0.00 -2.98 -0.06 0.00 -0.57 0.00 0.00 43.02 39.41 1aqv s PHE 8 CO 0.01 -1.55 2.72 -0.35 -0.10 0.00 0.00 175.22 175.95 1aqv n PRO 9 N -3.34 3.35 -4.21 0.24 -0.04 -1.25 -4.80 135.00 124.95 1aqv n PRO 9 Ca 0.08 -2.23 -0.14 0.00 -0.04 0.00 0.00 63.50 61.16 1aqv n PRO 9 Cb 0.54 -2.89 -0.09 0.00 -0.04 0.00 0.00 33.50 31.02 1aqv n PRO 9 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1aqv s VAL 10 N 2.56 0.00 -0.16 0.52 -7.23 -1.26 -4.39 120.40 110.43 1aqv s VAL 10 Ca 0.62 -1.94 -0.21 0.00 -1.81 0.00 0.00 61.98 58.65 1aqv s VAL 10 Cb 0.16 -2.49 -0.18 0.00 0.56 0.00 0.00 36.38 34.43 1aqv s VAL 10 CO -0.06 0.00 0.39 0.03 -0.31 0.00 0.00 175.10 175.15 1aqv h ARG 11 N 2.41 0.00 0.00 4.82 3.08 -1.06 -3.46 114.38 120.17 1aqv h ARG 11 Ca -0.31 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.74 1aqv h ARG 11 Cb 1.24 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.29 1aqv h ARG 11 CO 0.46 0.77 0.00 0.41 -1.07 0.00 0.00 179.97 180.54 1aqv n GLY 12 N 1.57 1.07 0.00 0.04 0.00 -0.21 -1.09 105.19 106.58 1aqv n GLY 12 Ca -0.16 0.05 0.11 0.00 0.00 0.00 0.00 46.02 46.03 1aqv n GLY 12 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1aqv n ARG 13 N 6.23 0.83 0.00 1.61 1.74 -1.26 -3.06 116.66 122.75 1aqv n ARG 13 Ca 0.00 0.00 0.08 0.00 -0.77 0.00 0.00 57.85 57.16 1aqv n ARG 13 Cb 0.00 -1.42 0.01 0.00 -1.02 0.00 0.00 32.46 30.03 1aqv n ARG 13 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1aqv h ALA 15 N 2.73 1.09 -0.08 0.00 0.00 -1.31 -1.93 119.26 119.77 1aqv h ALA 15 Ca 0.00 -0.09 -0.18 0.00 0.00 0.00 0.00 54.91 54.63 1aqv h ALA 15 Cb 0.54 -0.35 -0.00 0.00 0.00 0.00 0.00 17.79 17.98 1aqv h ALA 15 CO 0.00 0.55 -0.72 0.00 0.00 0.00 0.00 179.25 179.08 1aqv h ALA 16 N 1.28 0.60 0.00 0.00 0.00 -1.83 -1.81 119.26 117.51 1aqv h ALA 16 Ca 0.31 -0.60 -0.07 0.00 0.00 0.00 0.00 54.91 54.55 1aqv h ALA 16 Cb -0.05 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 1aqv h ALA 16 CO -0.06 0.76 -0.32 1.37 0.00 0.00 0.00 179.25 181.00 1aqv h LEU 17 N 0.28 0.00 -0.30 0.00 8.10 -1.80 -1.84 115.31 119.75 1aqv h LEU 17 Ca -0.03 0.00 -0.20 0.00 0.11 0.00 0.00 57.88 57.76 1aqv h LEU 17 Cb 1.30 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 41.52 1aqv h LEU 17 CO 0.12 0.32 -0.76 0.03 -4.11 0.00 0.00 178.44 174.05 1aqv h ARG 18 N 0.00 0.57 -0.34 0.17 3.08 -1.13 -1.52 114.38 115.21 1aqv h ARG 18 Ca -0.00 -0.47 -0.09 0.00 0.07 0.00 0.00 59.98 59.49 1aqv h ARG 18 Cb 1.11 0.10 -0.02 0.00 0.08 0.00 0.00 29.97 31.24 1aqv h ARG 18 CO 0.04 1.09 -0.16 0.52 -1.07 0.00 0.00 179.97 180.40 1aqv h MET 19 N 0.38 0.61 -0.38 0.04 2.86 -1.07 -1.33 114.93 116.05 1aqv h MET 19 Ca -0.04 -0.20 -0.16 0.00 -2.06 0.00 0.00 59.70 57.23 1aqv h MET 19 Cb 1.36 -0.05 -0.01 0.00 0.06 0.00 0.00 31.60 32.96 1aqv h MET 19 CO 0.14 0.74 -0.40 1.25 1.06 0.00 0.00 176.91 179.70 1aqv h LEU 20 N 0.55 1.01 -0.61 1.22 6.46 -1.13 -0.64 115.31 122.17 1aqv h LEU 20 Ca 0.09 -0.47 -0.15 0.00 -0.12 0.00 0.00 57.88 57.23 1aqv h LEU 20 Cb 0.59 -0.28 -0.01 0.00 -0.73 0.00 0.00 40.66 40.22 1aqv h LEU 20 CO 0.04 1.27 -0.57 -0.07 -0.62 0.00 0.00 178.44 178.49 1aqv h LEU 21 N 0.76 0.42 -0.07 2.25 3.38 -0.92 -1.65 115.31 119.48 1aqv h LEU 21 Ca 0.06 -0.23 -0.18 0.00 0.09 0.00 0.00 57.88 57.62 1aqv h LEU 21 Cb 1.00 -0.12 0.01 0.00 0.09 0.00 0.00 40.66 41.64 1aqv h LEU 21 CO 0.10 0.90 -0.66 0.00 0.09 0.00 0.00 178.44 178.87 1aqv h ALA 22 N 1.11 0.18 0.00 1.53 0.00 -1.09 0.18 119.26 121.16 1aqv h ALA 22 Ca 0.00 -0.57 -0.04 0.00 0.00 0.00 0.00 54.91 54.30 1aqv h ALA 22 Cb 1.09 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.88 1aqv h ALA 22 CO 0.10 0.47 -0.19 0.22 0.00 0.00 0.00 179.25 179.85 1aqv h ASP 23 N 0.18 0.00 -0.07 0.00 3.58 -1.07 -0.11 116.42 118.93 1aqv h ASP 23 Ca -0.06 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.39 1aqv h ASP 23 Cb 1.32 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.37 1aqv h ASP 23 CO 0.13 0.19 0.00 0.00 -2.88 0.00 0.00 179.24 176.68 1aqv n GLN 24 N -3.39 1.87 -2.63 0.28 1.13 -0.63 -4.83 117.38 109.19 1aqv n GLN 24 Ca -0.00 -1.27 -0.10 0.00 -1.94 0.00 0.00 57.00 53.68 1aqv n GLN 24 Cb 0.39 -1.46 0.02 0.00 0.11 0.00 0.00 30.24 29.30 1aqv n GLN 24 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1aqv n GLY 25 N 1.22 0.13 3.97 1.08 0.00 -0.06 -5.03 105.19 106.50 1aqv n GLY 25 Ca 0.17 -0.35 -0.22 0.00 0.00 0.00 0.00 46.02 45.63 1aqv n GLY 25 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1aqv s GLN 26 N -5.10 3.43 0.21 1.61 -1.52 0.59 -5.03 119.66 113.84 1aqv s GLN 26 Ca 0.15 -0.75 0.07 0.00 -1.95 0.00 0.00 55.36 52.88 1aqv s GLN 26 Cb -0.07 -2.89 -0.04 0.00 -0.22 0.00 0.00 33.01 29.79 1aqv s GLN 26 CO 0.18 0.44 0.11 -1.12 -0.25 0.00 0.00 175.29 174.65 1aqv s SER 27 N -3.91 5.25 0.12 5.90 0.01 -1.26 -4.51 113.70 115.29 1aqv s SER 27 Ca 0.34 -0.29 -0.25 0.00 1.31 0.00 0.00 55.95 57.07 1aqv s SER 27 Cb -0.09 -1.27 0.08 0.00 0.21 0.00 0.00 66.02 64.95 1aqv s SER 27 CO 0.29 0.03 0.72 -1.66 0.41 0.00 0.00 173.24 173.03 1aqv s TRP 28 N -1.94 -0.43 0.03 2.43 -2.14 -1.26 -4.11 118.94 111.52 1aqv s TRP 28 Ca 0.31 0.22 0.03 0.00 2.66 0.00 0.00 56.10 59.32 1aqv s TRP 28 Cb -0.09 0.57 -0.04 0.00 -3.10 0.00 0.00 33.47 30.82 1aqv s TRP 28 CO 0.22 -0.79 -0.03 0.21 -2.66 0.00 0.00 176.95 173.91 1aqv s LYS 29 N -3.55 2.61 -0.06 3.25 2.47 0.45 -4.97 119.74 119.93 1aqv s LYS 29 Ca 0.04 -0.73 0.01 0.00 -1.56 0.00 0.00 55.97 53.73 1aqv s LYS 29 Cb -0.01 -2.56 -0.03 0.00 -1.46 0.00 0.00 37.83 33.77 1aqv s LYS 29 CO -0.09 0.59 -0.07 -1.21 0.16 0.00 0.00 175.35 174.72 1aqv s GLU 30 N -1.75 2.72 -0.23 4.03 0.41 -1.26 -0.90 118.70 121.72 1aqv s GLU 30 Ca 0.20 -0.57 0.01 0.00 -0.41 0.00 0.00 54.97 54.21 1aqv s GLU 30 Cb -0.11 -2.57 0.06 0.00 -1.78 0.00 0.00 34.13 29.72 1aqv s GLU 30 CO 0.12 0.66 -0.07 -1.21 -0.49 0.00 0.00 175.26 174.26 1aqv s GLU 31 N -0.84 1.79 0.11 1.61 0.41 -0.12 -4.93 118.70 116.73 1aqv s GLU 31 Ca 0.13 -1.00 -0.18 0.00 -0.41 0.00 0.00 54.97 53.50 1aqv s GLU 31 Cb -0.11 -2.58 -0.07 0.00 -1.78 0.00 0.00 34.13 29.59 1aqv s GLU 31 CO 0.02 -0.55 0.58 0.08 -0.49 0.00 0.00 175.26 174.90 1aqv s VAL 32 N 1.36 4.75 -0.10 2.63 1.01 -1.26 -2.56 120.40 126.22 1aqv s VAL 32 Ca -0.05 1.13 0.04 0.00 0.00 0.00 0.00 61.98 63.09 1aqv s VAL 32 Cb -0.18 -3.85 0.00 0.00 0.00 0.00 0.00 36.38 32.34 1aqv s VAL 32 CO -0.06 0.43 -0.23 -0.69 0.00 0.00 0.00 175.10 174.54 1aqv s VAL 33 N -1.25 2.03 0.46 2.92 1.01 -0.16 -4.93 120.40 120.47 1aqv s VAL 33 Ca 0.33 -1.00 0.01 0.00 0.00 0.00 0.00 61.98 61.32 1aqv s VAL 33 Cb -0.18 -1.75 0.00 0.00 0.00 0.00 0.00 36.38 34.45 1aqv s VAL 33 CO 0.19 0.55 0.67 0.42 0.00 0.00 0.00 175.10 176.94 1aqv s THR 34 N 0.38 3.75 0.16 3.92 -4.23 -1.26 -3.88 115.64 114.47 1aqv s THR 34 Ca -0.18 -0.57 0.35 0.00 -1.18 0.00 0.00 61.69 60.11 1aqv s THR 34 Cb -0.18 -3.38 0.39 0.00 1.34 0.00 0.00 72.50 70.67 1aqv s THR 34 CO 0.08 -0.25 2.04 0.58 -0.54 0.00 0.00 174.62 176.52 1aqv h VAL 35 N 0.38 0.00 -0.04 2.29 2.07 -1.99 -0.76 116.25 118.20 1aqv h VAL 35 Ca -0.45 -0.36 -0.18 0.00 0.82 0.00 0.00 66.70 66.53 1aqv h VAL 35 Cb 1.26 1.33 0.01 0.00 -1.52 0.00 0.00 31.29 32.37 1aqv h VAL 35 CO 0.56 0.00 -0.67 -0.08 0.02 0.00 0.00 177.57 177.40 1aqv h GLU 36 N 0.00 0.52 0.00 1.57 4.22 -1.98 0.20 114.58 119.11 1aqv h GLU 36 Ca 0.00 -0.51 0.00 0.00 0.08 0.00 0.00 59.36 58.93 1aqv h GLU 36 Cb 0.38 0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.76 1aqv h GLU 36 CO 0.00 1.14 0.00 1.79 -2.18 0.00 0.00 179.01 179.76 1aqv h THR 37 N 0.09 0.00 0.00 0.32 1.35 -1.80 -2.86 112.91 110.01 1aqv h THR 37 Ca -0.07 -0.88 -0.24 0.00 -0.55 0.00 0.00 66.41 64.66 1aqv h THR 37 Cb 1.34 1.88 -0.04 0.00 -1.73 0.00 0.00 68.15 69.60 1aqv h THR 37 CO 0.13 0.00 -1.28 -0.25 -0.25 0.00 0.00 175.52 173.87 1aqv h TRP 38 N 0.00 0.00 0.00 4.73 2.91 -0.93 -3.23 115.95 119.43 1aqv h TRP 38 Ca 0.00 -0.00 0.00 0.00 1.13 0.00 0.00 58.89 60.02 1aqv h TRP 38 Cb 0.90 -0.00 0.00 0.00 -0.51 0.00 0.00 29.16 29.55 1aqv h TRP 38 CO 0.00 1.00 0.00 1.04 -1.03 0.00 0.00 178.44 179.45 1aqv n GLN 39 N -3.23 0.32 0.00 2.65 6.02 0.70 -1.54 117.38 122.30 1aqv n GLN 39 Ca -0.07 0.05 0.15 0.00 -0.01 0.00 0.00 57.00 57.12 1aqv n GLN 39 Cb 0.99 -1.50 0.64 0.00 1.02 0.00 0.00 30.24 31.39 1aqv n GLN 39 CO 0.00 0.00 0.00 -0.85 -1.01 0.00 0.00 177.06 175.20 1aqv n GLU 40 N -1.31 1.37 -0.35 -1.09 -0.00 -1.20 -4.94 120.64 113.13 1aqv n GLU 40 Ca 0.11 -0.62 0.00 0.00 -0.00 0.00 0.00 57.16 56.65 1aqv n GLU 40 Cb 0.21 -1.49 0.00 0.00 -0.00 0.00 0.00 31.44 30.16 1aqv n GLU 40 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1aqv n GLY 41 N 1.14 0.00 0.19 -1.84 0.00 -0.59 -4.81 105.19 99.28 1aqv n GLY 41 Ca 0.20 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.29 1aqv n GLY 41 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1aqv h SER 42 N 0.00 0.00 0.59 1.61 4.64 -1.83 -2.39 113.55 116.17 1aqv h SER 42 Ca 0.00 0.00 -0.28 0.00 -0.47 0.00 0.00 61.79 61.04 1aqv h SER 42 Cb 0.00 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.06 1aqv h SER 42 CO 0.00 0.29 -1.49 0.25 -0.87 0.00 0.00 176.83 175.01 1aqv h LEU 43 N 0.00 0.13 -1.51 5.97 5.85 -1.87 -3.23 115.31 120.65 1aqv h LEU 43 Ca -0.00 -0.21 -0.04 0.00 0.84 0.00 0.00 57.88 58.47 1aqv h LEU 43 Cb 1.09 -0.04 -0.01 0.00 0.37 0.00 0.00 40.66 42.07 1aqv h LEU 43 CO 0.04 1.18 -0.06 0.50 -0.34 0.00 0.00 178.44 179.75 1aqv h LYS 44 N 0.02 0.24 0.00 1.25 3.64 -1.84 -0.02 116.57 119.87 1aqv h LYS 44 Ca -0.21 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.13 1aqv h LYS 44 Cb 1.95 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 33.73 1aqv h LYS 44 CO 0.12 0.32 0.00 0.00 -2.27 0.00 0.00 179.45 177.62 1aqv h ALA 45 N 1.71 1.00 -0.01 5.00 0.00 -1.46 -2.46 119.26 123.04 1aqv h ALA 45 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1aqv h ALA 45 Cb 0.27 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.06 1aqv h ALA 45 CO 0.01 0.00 -0.42 -1.13 0.00 0.00 0.00 179.25 177.71 1aqv n SER 46 N -2.78 0.99 -4.77 0.00 3.41 -0.05 -4.86 113.62 105.55 1aqv n SER 46 Ca 0.04 -0.79 -0.39 0.00 -0.26 0.00 0.00 58.87 57.47 1aqv n SER 46 Cb 0.46 0.28 -0.06 0.00 -0.26 0.00 0.00 64.21 64.63 1aqv n SER 46 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1aqv h LEU 48 N 4.98 0.41 -3.08 0.00 5.85 -1.88 0.11 115.31 121.70 1aqv h LEU 48 Ca -0.47 0.10 0.00 0.00 0.84 0.00 0.00 57.88 58.35 1aqv h LEU 48 Cb 1.21 0.04 0.00 0.00 0.37 0.00 0.00 40.66 42.28 1aqv h LEU 48 CO 0.67 0.17 0.00 -1.22 -0.34 0.00 0.00 178.44 177.72 1aqv n TYR 49 N -4.93 0.54 -2.05 1.25 4.01 -1.26 -4.95 117.16 109.77 1aqv n TYR 49 Ca 0.15 -0.74 -0.18 0.00 -0.16 0.00 0.00 57.90 56.98 1aqv n TYR 49 Cb 0.41 -0.17 -0.03 0.00 -0.31 0.00 0.00 39.34 39.24 1aqv n TYR 49 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1aqv n GLY 50 N -0.35 0.38 3.17 2.72 0.00 0.37 -4.98 105.19 106.50 1aqv n GLY 50 Ca 0.15 -0.15 -0.11 0.00 0.00 0.00 0.00 46.02 45.91 1aqv n GLY 50 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1aqv s GLN 51 N -4.40 1.00 0.28 1.61 -0.21 -1.26 -4.93 119.66 111.76 1aqv s GLN 51 Ca 0.00 -1.49 0.10 0.00 0.02 0.00 0.00 55.36 54.00 1aqv s GLN 51 Cb 0.00 0.19 -0.05 0.00 1.00 0.00 0.00 33.01 34.15 1aqv s GLN 51 CO 0.00 -0.27 -0.08 -0.51 -2.12 0.00 0.00 175.29 172.31 1aqv s LEU 52 N -3.09 2.92 0.76 2.90 1.43 -1.26 -4.69 118.68 117.65 1aqv s LEU 52 Ca 0.27 -0.86 -0.11 0.00 -1.03 0.00 0.00 54.13 52.40 1aqv s LEU 52 Cb 0.07 -1.41 0.05 0.00 0.03 0.00 0.00 46.19 44.94 1aqv s LEU 52 CO 0.04 -0.02 1.10 -2.16 0.23 0.00 0.00 176.35 175.54 1aqv s PRO 53 N -3.62 2.26 0.15 1.29 0.04 -1.26 -4.98 135.00 128.88 1aqv s PRO 53 Ca 0.31 1.26 0.09 0.00 0.04 0.00 0.00 61.00 62.70 1aqv s PRO 53 Cb -0.05 -1.89 -0.04 0.00 0.04 0.00 0.00 34.50 32.56 1aqv s PRO 53 CO 0.18 -1.65 -0.21 0.21 0.04 0.00 0.00 177.00 175.57 1aqv s LYS 54 N -4.70 1.29 -0.03 4.56 2.20 -0.85 -3.87 119.74 118.34 1aqv s LYS 54 Ca 0.63 -1.35 -0.14 0.00 -0.36 0.00 0.00 55.97 54.76 1aqv s LYS 54 Cb -0.19 -1.52 0.02 0.00 -1.51 0.00 0.00 37.83 34.64 1aqv s LYS 54 CO 0.53 0.33 0.29 0.12 -0.36 0.00 0.00 175.35 176.27 1aqv s PHE 55 N -1.58 -0.18 0.06 4.03 5.36 -0.35 -1.01 117.98 124.31 1aqv s PHE 55 Ca 0.14 0.30 0.05 0.00 -0.96 0.00 0.00 56.93 56.46 1aqv s PHE 55 Cb -0.08 0.09 -0.03 0.00 -0.34 0.00 0.00 43.02 42.66 1aqv s PHE 55 CO 0.06 -0.35 -0.14 -0.65 -1.46 0.00 0.00 175.22 172.68 1aqv s GLN 56 N -1.15 0.86 -0.33 10.12 -0.21 -0.22 -0.64 119.66 128.09 1aqv s GLN 56 Ca -0.12 -0.88 0.01 0.00 0.02 0.00 0.00 55.36 54.39 1aqv s GLN 56 Cb -0.05 -0.87 0.14 0.00 1.00 0.00 0.00 33.01 33.23 1aqv s GLN 56 CO 0.03 0.20 0.30 0.34 -2.12 0.00 0.00 175.29 174.04 1aqv s ASP 57 N -1.51 1.86 1.64 5.90 -1.08 -0.30 -2.00 116.67 121.17 1aqv s ASP 57 Ca -0.01 -1.33 0.00 0.00 -0.52 0.00 0.00 52.55 50.69 1aqv s ASP 57 Cb -0.09 0.31 0.00 0.00 -1.46 0.00 0.00 42.92 41.68 1aqv s ASP 57 CO 0.02 -0.33 0.00 0.61 0.52 0.00 0.00 175.17 175.99 1aqv n GLY 58 N 4.72 2.64 0.27 2.66 0.00 -0.99 -1.78 105.19 112.71 1aqv n GLY 58 Ca 0.05 -0.29 0.15 0.00 0.00 0.00 0.00 46.02 45.92 1aqv n GLY 58 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1aqv n ASP 59 N 5.26 0.85 -4.79 1.61 8.00 -1.26 -4.83 116.55 121.39 1aqv n ASP 59 Ca 0.00 -1.23 -0.38 0.00 0.71 0.00 0.00 54.79 53.89 1aqv n ASP 59 Cb 0.00 -0.00 -0.06 0.00 -0.02 0.00 0.00 41.12 41.04 1aqv n ASP 59 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1aqv s LEU 60 N -2.05 4.38 0.02 0.64 2.96 -0.73 -5.07 118.68 118.83 1aqv s LEU 60 Ca 0.41 0.84 0.09 0.00 -0.22 0.00 0.00 54.13 55.25 1aqv s LEU 60 Cb 0.21 -2.58 -0.03 0.00 0.50 0.00 0.00 46.19 44.30 1aqv s LEU 60 CO 0.36 0.20 -0.26 -0.89 -1.32 0.00 0.00 176.35 174.44 1aqv s THR 61 N -0.35 2.11 0.05 3.68 2.01 -1.26 -1.15 115.64 120.73 1aqv s THR 61 Ca 0.23 -1.29 -0.01 0.00 0.31 0.00 0.00 61.69 60.93 1aqv s THR 61 Cb -0.16 -1.79 -0.04 0.00 0.01 0.00 0.00 72.50 70.53 1aqv s THR 61 CO 0.11 0.44 -0.03 -0.76 -0.69 0.00 0.00 174.62 173.69 1aqv s LEU 62 N -1.01 2.49 0.33 4.42 1.43 0.19 -4.98 118.68 121.54 1aqv s LEU 62 Ca 0.11 -1.00 0.03 0.00 -1.03 0.00 0.00 54.13 52.25 1aqv s LEU 62 Cb -0.10 0.18 -0.04 0.00 0.03 0.00 0.00 46.19 46.26 1aqv s LEU 62 CO 0.01 -0.59 0.12 -0.31 0.23 0.00 0.00 176.35 175.81 1aqv s TYR 63 N -3.88 1.72 0.04 0.29 1.51 -1.26 -1.21 117.35 114.55 1aqv s TYR 63 Ca 0.07 -1.22 0.00 0.00 -1.01 0.00 0.00 57.07 54.91 1aqv s TYR 63 Cb 0.08 -1.04 0.00 0.00 -0.11 0.00 0.00 41.96 40.88 1aqv s TYR 63 CO -0.10 -0.31 0.00 1.04 -1.11 0.00 0.00 175.55 175.07 1aqv n GLN 64 N -0.68 -0.95 -0.22 -0.62 1.13 -1.25 -4.56 117.38 110.23 1aqv n GLN 64 Ca -0.02 1.07 -0.01 0.00 -1.94 0.00 0.00 57.00 56.10 1aqv n GLN 64 Cb 0.65 -0.72 0.21 0.00 0.11 0.00 0.00 30.24 30.49 1aqv n GLN 64 CO 0.00 0.00 0.00 0.66 -1.44 0.00 0.00 177.06 176.28 1aqv h SER 65 N 0.72 0.89 1.72 1.08 4.64 -1.90 -1.82 113.55 118.88 1aqv h SER 65 Ca 0.00 -0.06 -0.01 0.00 -0.47 0.00 0.00 61.79 61.26 1aqv h SER 65 Cb 0.00 -0.23 -0.00 0.00 -0.31 0.00 0.00 62.40 61.86 1aqv h SER 65 CO 0.00 0.70 -0.03 0.78 -0.87 0.00 0.00 176.83 177.41 1aqv h ASN 66 N 1.02 0.00 0.75 4.97 4.21 -1.93 -2.14 115.58 122.45 1aqv h ASN 66 Ca 0.26 0.00 -0.21 0.00 1.21 0.00 0.00 56.30 57.57 1aqv h ASN 66 Cb -0.02 0.00 -0.02 0.00 -1.12 0.00 0.00 38.32 37.16 1aqv h ASN 66 CO -0.05 0.03 -0.95 0.74 -1.29 0.00 0.00 177.43 175.91 1aqv h THR 67 N 0.00 1.57 -0.22 2.81 2.02 -1.62 -1.30 112.91 116.17 1aqv h THR 67 Ca -0.00 -2.93 -0.18 0.00 0.77 0.00 0.00 66.41 64.07 1aqv h THR 67 Cb 0.89 2.65 -0.00 0.00 -1.74 0.00 0.00 68.15 69.95 1aqv h THR 67 CO 0.00 0.85 -0.58 0.40 0.37 0.00 0.00 175.52 176.56 1aqv h ILE 68 N 0.05 1.30 -0.47 3.11 2.04 -0.85 -0.81 117.51 121.88 1aqv h ILE 68 Ca -0.04 -1.81 -0.12 0.00 1.00 0.00 0.00 64.86 63.89 1aqv h ILE 68 Cb 1.63 1.75 -0.01 0.00 -0.74 0.00 0.00 36.82 39.45 1aqv h ILE 68 CO 0.14 0.57 -0.18 -0.07 0.00 0.00 0.00 178.15 178.61 1aqv h LEU 69 N 0.53 0.98 -0.96 1.44 3.38 -1.35 -1.61 115.31 117.73 1aqv h LEU 69 Ca 0.00 -0.39 -0.11 0.00 0.09 0.00 0.00 57.88 57.48 1aqv h LEU 69 Cb 1.17 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.63 1aqv h LEU 69 CO 0.12 1.14 -0.47 0.03 0.09 0.00 0.00 178.44 179.35 1aqv h ARG 70 N 0.81 0.11 -0.25 1.13 3.08 -1.11 0.14 114.38 118.28 1aqv h ARG 70 Ca 0.11 -0.06 -0.17 0.00 0.07 0.00 0.00 59.98 59.93 1aqv h ARG 70 Cb 0.75 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.80 1aqv h ARG 70 CO 0.06 0.56 -0.52 1.25 -1.07 0.00 0.00 179.97 180.25 1aqv h HIS 71 N 0.09 0.91 0.00 3.04 2.76 -0.70 0.79 115.15 122.04 1aqv h HIS 71 Ca 0.00 -0.31 -0.15 0.00 -2.20 0.00 0.00 60.37 57.71 1aqv h HIS 71 Cb 0.87 -0.18 -0.02 0.00 1.55 0.00 0.00 27.41 29.63 1aqv h HIS 71 CO 0.01 1.09 -0.71 -0.07 -1.30 0.00 0.00 177.93 176.95 1aqv h LEU 72 N 0.57 0.00 -0.40 0.26 3.38 -1.07 -0.90 115.31 117.15 1aqv h LEU 72 Ca 0.02 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.97 1aqv h LEU 72 Cb 1.09 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.83 1aqv h LEU 72 CO 0.11 0.71 0.17 1.23 0.09 0.00 0.00 178.44 180.75 1aqv h GLY 73 N 2.45 0.63 1.54 0.83 0.00 -0.03 -0.07 103.07 108.42 1aqv h GLY 73 Ca -0.01 -0.33 -0.07 0.00 0.00 0.00 0.00 47.33 46.92 1aqv h GLY 73 CO 0.09 0.31 -0.70 0.07 0.00 0.00 0.00 176.54 176.31 1aqv h ARG 74 N 0.50 0.00 0.00 4.80 0.11 -0.65 0.72 114.38 119.86 1aqv h ARG 74 Ca 0.13 0.00 -0.01 0.00 0.10 0.00 0.00 59.98 60.21 1aqv h ARG 74 Cb 0.16 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 31.24 1aqv h ARG 74 CO -0.01 0.22 -0.59 1.79 0.10 0.00 0.00 179.97 181.47 1aqv h THR 75 N 0.00 0.04 -0.04 0.08 1.35 -0.95 -3.30 112.91 110.09 1aqv h THR 75 Ca -0.04 -1.07 0.00 0.00 -0.55 0.00 0.00 66.41 64.75 1aqv h THR 75 Cb 1.25 1.75 0.00 0.00 -1.73 0.00 0.00 68.15 69.41 1aqv h THR 75 CO 0.03 0.02 0.00 0.18 -0.25 0.00 0.00 175.52 175.50 1aqv n LEU 76 N -2.87 2.31 -1.35 3.87 4.77 -0.06 -5.00 117.00 118.66 1aqv n LEU 76 Ca 0.01 -1.04 -0.05 0.00 -0.03 0.00 0.00 56.01 54.91 1aqv n LEU 76 Cb 0.56 -0.01 0.02 0.00 -2.33 0.00 0.00 43.42 41.65 1aqv n LEU 76 CO 0.38 0.42 0.05 0.61 -1.33 0.00 0.00 177.39 177.52 1aqv n GLY 77 N 0.86 0.48 2.15 -0.72 0.00 -0.97 -4.98 105.19 102.00 1aqv n GLY 77 Ca 0.09 -0.42 -0.23 0.00 0.00 0.00 0.00 46.02 45.47 1aqv n GLY 77 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1aqv n LEU 78 N -1.62 4.62 -0.80 0.99 4.32 0.21 -4.76 117.00 119.96 1aqv n LEU 78 Ca -0.02 -4.69 0.05 0.00 -0.02 0.00 0.00 56.01 51.33 1aqv n LEU 78 Cb 0.52 -0.29 0.11 0.00 -1.62 0.00 0.00 43.42 42.14 1aqv n LEU 78 CO 0.15 2.05 0.28 0.00 -1.22 0.00 0.00 177.39 178.65 1aqv n TYR 79 N -0.66 0.00 0.00 -1.77 4.19 -1.23 -1.65 117.16 116.04 1aqv n TYR 79 Ca 0.40 -0.91 0.00 0.00 3.31 0.00 0.00 57.90 60.71 1aqv n TYR 79 Cb 0.91 -0.18 0.00 0.00 0.49 0.00 0.00 39.34 40.56 1aqv n TYR 79 CO 0.00 0.00 0.00 0.41 0.91 0.00 0.00 176.86 178.18 1aqv n GLY 80 N -0.49 -0.07 0.02 2.98 0.00 -1.26 -3.85 105.19 102.51 1aqv n GLY 80 Ca 0.12 -1.79 0.11 0.00 0.00 0.00 0.00 46.02 44.46 1aqv n GLY 80 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1aqv n LYS 81 N 0.07 0.15 -2.83 1.61 2.85 -1.26 -4.87 118.16 113.88 1aqv n LYS 81 Ca 0.00 0.01 -0.06 0.00 -1.05 0.00 0.00 58.31 57.20 1aqv n LYS 81 Cb 0.00 -1.56 0.01 0.00 -0.65 0.00 0.00 35.03 32.84 1aqv n LYS 81 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 177.40 176.95 1aqv n ASP 82 N -1.75 -1.40 0.22 -5.58 5.68 -1.26 -5.03 116.55 107.43 1aqv n ASP 82 Ca 0.03 -2.06 0.08 0.00 -0.50 0.00 0.00 54.79 52.34 1aqv n ASP 82 Cb 0.39 2.35 0.51 0.00 -1.14 0.00 0.00 41.12 43.23 1aqv n ASP 82 CO 0.00 0.00 0.00 1.56 -1.33 0.00 0.00 177.20 177.43 1aqv h GLN 83 N 0.00 0.00 -0.34 0.11 4.20 -1.94 -0.02 115.11 117.12 1aqv h GLN 83 Ca -0.21 0.00 -0.16 0.00 0.06 0.00 0.00 58.65 58.34 1aqv h GLN 83 Cb 0.79 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.57 1aqv h GLN 83 CO 0.27 0.25 -0.42 0.37 -0.67 0.00 0.00 178.83 178.63 1aqv h GLN 84 N 0.00 0.86 0.00 1.46 4.15 -1.97 -2.30 115.11 117.32 1aqv h GLN 84 Ca -0.00 -0.47 -0.18 0.00 0.77 0.00 0.00 58.65 58.76 1aqv h GLN 84 Cb 0.55 0.03 -0.02 0.00 0.21 0.00 0.00 27.48 28.25 1aqv h GLN 84 CO 0.03 1.11 -0.87 0.93 -1.93 0.00 0.00 178.83 178.11 1aqv h GLU 85 N 0.70 0.03 -0.05 1.69 5.08 -1.79 -2.88 114.58 117.35 1aqv h GLU 85 Ca 0.05 -0.03 -0.05 0.00 -1.00 0.00 0.00 59.36 58.32 1aqv h GLU 85 Cb 1.01 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 30.26 1aqv h GLU 85 CO 0.10 0.87 -0.22 0.00 -1.00 0.00 0.00 179.01 178.76 1aqv h ALA 86 N 1.11 1.55 -0.03 3.43 0.00 -0.83 0.62 119.26 125.11 1aqv h ALA 86 Ca -0.02 -0.23 -0.18 0.00 0.00 0.00 0.00 54.91 54.48 1aqv h ALA 86 Cb 1.52 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 19.25 1aqv h ALA 86 CO 0.12 0.33 -0.78 0.00 0.00 0.00 0.00 179.25 178.92 1aqv h ALA 87 N 1.70 0.60 -0.00 0.00 0.00 -1.21 -1.83 119.26 118.52 1aqv h ALA 87 Ca 0.01 -0.65 -0.16 0.00 0.00 0.00 0.00 54.91 54.11 1aqv h ALA 87 Cb 0.43 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 1aqv h ALA 87 CO 0.03 0.83 -0.77 -0.07 0.00 0.00 0.00 179.25 179.27 1aqv h LEU 88 N 0.17 0.05 -0.78 0.00 3.38 -1.05 -1.31 115.31 115.77 1aqv h LEU 88 Ca -0.03 -0.04 -0.12 0.00 0.09 0.00 0.00 57.88 57.78 1aqv h LEU 88 Cb 1.37 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 42.09 1aqv h LEU 88 CO 0.12 0.80 -0.33 0.58 0.09 0.00 0.00 178.44 179.71 1aqv h VAL 89 N 0.02 1.28 -0.18 1.22 2.07 -0.58 -2.08 116.25 118.01 1aqv h VAL 89 Ca -0.01 -1.43 -0.16 0.00 0.82 0.00 0.00 66.70 65.92 1aqv h VAL 89 Cb 1.36 1.44 -0.01 0.00 -1.52 0.00 0.00 31.29 32.56 1aqv h VAL 89 CO 0.10 0.45 -0.54 0.44 0.02 0.00 0.00 177.57 178.05 1aqv h ASP 90 N 0.47 0.59 0.20 0.57 3.32 -0.94 -1.51 116.42 119.11 1aqv h ASP 90 Ca 0.05 -0.31 -0.10 0.00 0.02 0.00 0.00 57.03 56.70 1aqv h ASP 90 Cb 0.79 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 40.16 1aqv h ASP 90 CO 0.06 1.01 -0.37 -0.03 -1.72 0.00 0.00 179.24 178.20 1aqv h MET 91 N 0.41 0.23 -0.06 3.56 4.05 -0.80 -0.09 114.93 122.23 1aqv h MET 91 Ca 0.01 -0.10 -0.17 0.00 -0.28 0.00 0.00 59.70 59.16 1aqv h MET 91 Cb 1.07 -0.01 0.01 0.00 -0.80 0.00 0.00 31.60 31.87 1aqv h MET 91 CO 0.10 0.57 -0.62 0.28 0.23 0.00 0.00 176.91 177.47 1aqv h VAL 92 N 0.20 1.37 -0.29 -5.77 2.07 -1.15 -2.69 116.25 109.99 1aqv h VAL 92 Ca 0.02 -1.97 -0.06 0.00 0.82 0.00 0.00 66.70 65.52 1aqv h VAL 92 Cb 0.74 2.33 -0.02 0.00 -1.52 0.00 0.00 31.29 32.83 1aqv h VAL 92 CO 0.06 0.59 -0.08 -1.13 0.02 0.00 0.00 177.57 177.03 1aqv h ASN 93 N 0.12 0.44 0.77 0.57 -0.73 -0.88 0.12 115.58 115.98 1aqv h ASN 93 Ca -0.06 -0.10 -0.13 0.00 1.87 0.00 0.00 56.30 57.88 1aqv h ASN 93 Cb 1.29 -0.12 -0.02 0.00 0.27 0.00 0.00 38.32 39.74 1aqv h ASN 93 CO 0.13 0.56 -0.63 0.44 -0.37 0.00 0.00 177.43 177.56 1aqv h ASP 94 N 0.44 0.00 -0.09 1.15 3.32 -1.04 0.11 116.42 120.31 1aqv h ASP 94 Ca 0.09 0.00 -0.20 0.00 0.02 0.00 0.00 57.03 56.94 1aqv h ASP 94 Cb 0.41 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.96 1aqv h ASP 94 CO 0.02 0.63 -0.67 1.23 -1.72 0.00 0.00 179.24 178.73 1aqv h GLY 95 N 2.16 0.78 1.05 2.75 0.00 -0.89 -1.77 103.07 107.16 1aqv h GLY 95 Ca -0.01 -1.02 -0.06 0.00 0.00 0.00 0.00 47.33 46.24 1aqv h GLY 95 CO 0.08 0.91 0.24 -2.08 0.00 0.00 0.00 176.54 175.70 1aqv h VAL 96 N 0.51 1.26 -0.20 4.60 2.07 -0.62 -2.72 116.25 121.16 1aqv h VAL 96 Ca -0.02 -0.90 -0.08 0.00 0.82 0.00 0.00 66.70 66.52 1aqv h VAL 96 Cb 1.28 0.44 -0.01 0.00 -1.52 0.00 0.00 31.29 31.47 1aqv h VAL 96 CO 0.14 0.35 -0.23 -0.08 0.02 0.00 0.00 177.57 177.77 1aqv h GLU 97 N 1.10 0.35 -0.33 1.57 4.57 -0.81 -0.47 114.58 120.56 1aqv h GLU 97 Ca 0.24 -0.12 -0.12 0.00 -1.18 0.00 0.00 59.36 58.18 1aqv h GLU 97 Cb 0.30 -0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 28.84 1aqv h GLU 97 CO -0.01 0.57 -0.29 -0.44 -1.18 0.00 0.00 179.01 177.66 1aqv h ASP 98 N 0.32 0.72 1.30 1.04 3.32 -1.02 -1.65 116.42 120.44 1aqv h ASP 98 Ca 0.05 -0.28 -0.14 0.00 0.02 0.00 0.00 57.03 56.68 1aqv h ASP 98 Cb 0.59 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.92 1aqv h ASP 98 CO 0.04 0.97 -0.71 0.25 -1.72 0.00 0.00 179.24 178.07 1aqv h LEU 99 N 0.60 0.00 -1.23 1.55 5.85 -1.17 -2.95 115.31 117.96 1aqv h LEU 99 Ca 0.07 0.00 -0.08 0.00 0.84 0.00 0.00 57.88 58.72 1aqv h LEU 99 Cb 0.79 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.81 1aqv h LEU 99 CO 0.07 0.67 -0.33 -0.09 -0.34 0.00 0.00 178.44 178.42 1aqv h ARG 100 N 0.00 0.09 0.00 1.25 2.43 -0.72 -0.70 114.38 116.73 1aqv h ARG 100 Ca -0.02 -0.03 -0.13 0.00 -0.81 0.00 0.00 59.98 58.99 1aqv h ARG 100 Cb 1.52 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 31.05 1aqv h ARG 100 CO 0.09 0.41 -0.63 0.00 -1.51 0.00 0.00 179.97 178.33 1aqv h LYS 102 N 0.00 0.19 -0.37 0.00 1.57 -1.19 -2.24 116.57 114.53 1aqv h LYS 102 Ca -0.01 -0.26 -0.12 0.00 -1.87 0.00 0.00 60.65 58.40 1aqv h LYS 102 Cb 1.13 0.08 -0.01 0.00 0.08 0.00 0.00 32.23 33.52 1aqv h LYS 102 CO 0.08 1.04 -0.23 -0.92 -0.57 0.00 0.00 179.45 178.85 1aqv h TYR 103 N 0.09 0.95 -0.07 -1.35 3.20 -0.76 -1.82 116.97 117.20 1aqv h TYR 103 Ca -0.06 -0.25 -0.08 0.00 3.14 0.00 0.00 58.73 61.48 1aqv h TYR 103 Cb 1.68 -0.21 -0.01 0.00 1.54 0.00 0.00 36.73 39.72 1aqv h TYR 103 CO 0.04 1.01 -0.32 0.82 -1.64 0.00 0.00 178.16 178.07 1aqv h ILE 104 N 0.61 1.25 0.00 1.81 2.04 -1.07 -0.28 117.51 121.88 1aqv h ILE 104 Ca 0.08 -1.21 -0.15 0.00 1.00 0.00 0.00 64.86 64.58 1aqv h ILE 104 Cb 0.79 1.55 -0.02 0.00 -0.74 0.00 0.00 36.82 38.40 1aqv h ILE 104 CO 0.06 0.36 -0.72 -1.28 0.00 0.00 0.00 178.15 176.57 1aqv h SER 105 N 0.12 0.00 0.04 1.72 0.87 -1.19 -0.71 113.55 114.40 1aqv h SER 105 Ca 0.02 0.00 -0.24 0.00 -1.23 0.00 0.00 61.79 60.34 1aqv h SER 105 Cb 0.63 0.00 0.01 0.00 -0.44 0.00 0.00 62.40 62.60 1aqv h SER 105 CO 0.05 0.72 -0.92 0.25 -0.53 0.00 0.00 176.83 176.40 1aqv h LEU 106 N 0.00 0.82 -0.24 2.23 5.85 -0.28 -2.06 115.31 121.63 1aqv h LEU 106 Ca -0.01 -0.61 -0.17 0.00 0.84 0.00 0.00 57.88 57.94 1aqv h LEU 106 Cb 1.38 -0.25 0.00 0.00 0.37 0.00 0.00 40.66 42.17 1aqv h LEU 106 CO 0.09 1.41 -0.50 0.40 -0.34 0.00 0.00 178.44 179.50 1aqv h ILE 107 N 0.40 1.30 0.00 4.05 1.08 -0.90 0.94 117.51 124.38 1aqv h ILE 107 Ca -0.09 -1.70 0.00 0.00 -0.39 0.00 0.00 64.86 62.68 1aqv h ILE 107 Cb 1.56 1.76 0.00 0.00 -3.07 0.00 0.00 36.82 37.07 1aqv h ILE 107 CO 0.18 0.54 -0.81 -1.22 -0.69 0.00 0.00 178.15 176.15 1aqv n TYR 108 N -4.11 0.03 -0.60 1.37 4.01 -0.29 -4.45 117.16 113.12 1aqv n TYR 108 Ca -0.05 0.01 0.00 0.00 -0.16 0.00 0.00 57.90 57.70 1aqv n TYR 108 Cb 0.60 -0.16 0.00 0.00 -0.31 0.00 0.00 39.34 39.47 1aqv n TYR 108 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 1aqv n THR 109 N -1.56 0.00 -1.96 -0.72 -2.24 -0.78 -4.95 114.28 102.07 1aqv n THR 109 Ca 0.04 -0.07 -0.03 0.00 -2.27 0.00 0.00 64.05 61.73 1aqv n THR 109 Cb 0.35 1.60 -0.03 0.00 -2.10 0.00 0.00 70.33 70.15 1aqv n THR 109 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1aqv n ASN 110 N -0.04 -0.37 -0.29 3.42 5.15 -1.06 -5.01 115.26 117.06 1aqv n ASN 110 Ca 0.00 -1.33 0.09 0.00 -0.60 0.00 0.00 54.58 52.75 1aqv n ASN 110 Cb 0.15 0.11 0.25 0.00 -0.53 0.00 0.00 39.78 39.76 1aqv n ASN 110 CO 0.00 0.00 0.00 0.22 1.40 0.00 0.00 177.26 178.88 1aqv h TYR 111 N 0.00 0.57 0.00 1.20 3.20 -1.03 0.06 116.97 120.97 1aqv h TYR 111 Ca -0.21 0.04 -0.19 0.00 3.14 0.00 0.00 58.73 61.51 1aqv h TYR 111 Cb 1.11 -0.12 -0.03 0.00 1.54 0.00 0.00 36.73 39.23 1aqv h TYR 111 CO -0.24 -0.00 -0.92 0.93 -1.64 0.00 0.00 178.16 176.29 1aqv h GLU 112 N 0.42 0.00 0.00 1.82 3.07 -1.95 -3.08 114.58 114.86 1aqv h GLU 112 Ca 0.49 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.35 1aqv h GLU 112 Cb 0.86 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.77 1aqv h GLU 112 CO -0.48 0.87 -1.43 0.00 -1.40 0.00 0.00 179.01 176.57 1aqv n ALA 113 N -2.33 3.55 -0.37 3.43 0.00 -1.01 -4.48 120.51 119.30 1aqv n ALA 113 Ca -0.00 -0.51 0.02 0.00 0.00 0.00 0.00 53.44 52.95 1aqv n ALA 113 Cb 0.90 -0.82 0.02 0.00 0.00 0.00 0.00 19.45 19.55 1aqv n ALA 113 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1aqv n GLY 114 N 1.36 2.46 0.20 0.00 0.00 -0.02 -4.73 105.19 104.46 1aqv n GLY 114 Ca 0.00 -0.19 0.08 0.00 0.00 0.00 0.00 46.02 45.91 1aqv n GLY 114 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1aqv h LYS 115 N 0.00 0.00 0.15 1.61 3.64 -1.71 -1.82 116.57 118.45 1aqv h LYS 115 Ca 0.00 0.00 -0.29 0.00 -1.27 0.00 0.00 60.65 59.09 1aqv h LYS 115 Cb 0.68 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 32.51 1aqv h LYS 115 CO 0.00 0.27 -1.29 -0.44 -2.27 0.00 0.00 179.45 175.72 1aqv h ASP 116 N 0.00 0.52 0.80 4.20 3.32 -1.88 -1.74 116.42 121.64 1aqv h ASP 116 Ca -0.00 -0.55 -0.17 0.00 0.02 0.00 0.00 57.03 56.33 1aqv h ASP 116 Cb 0.94 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 40.30 1aqv h ASP 116 CO 0.03 1.43 -0.79 0.44 -1.72 0.00 0.00 179.24 178.64 1aqv h ASP 117 N 0.09 0.00 0.33 6.45 3.32 -1.87 -1.16 116.42 123.58 1aqv h ASP 117 Ca -0.16 0.00 -0.15 0.00 0.02 0.00 0.00 57.03 56.74 1aqv h ASP 117 Cb 2.01 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 41.55 1aqv h ASP 117 CO 0.22 0.79 -0.62 0.22 -1.72 0.00 0.00 179.24 178.13 1aqv h TYR 118 N 0.00 0.36 0.00 4.55 5.03 -1.25 -1.96 116.97 123.69 1aqv h TYR 118 Ca -0.01 -0.14 -0.02 0.00 2.58 0.00 0.00 58.73 61.14 1aqv h TYR 118 Cb 1.40 -0.06 -0.00 0.00 1.55 0.00 0.00 36.73 39.61 1aqv h TYR 118 CO 0.00 0.82 -0.27 0.28 -1.32 0.00 0.00 178.16 177.67 1aqv h VAL 119 N 0.20 0.17 0.00 1.81 2.07 -1.07 -2.17 116.25 117.26 1aqv h VAL 119 Ca -0.01 -1.25 -0.11 0.00 0.82 0.00 0.00 66.70 66.16 1aqv h VAL 119 Cb 1.13 2.01 -0.02 0.00 -1.52 0.00 0.00 31.29 32.89 1aqv h VAL 119 CO 0.10 0.10 -0.51 0.11 0.02 0.00 0.00 177.57 177.39 1aqv h LYS 120 N 0.00 0.00 -0.00 1.57 1.57 -0.67 -3.07 116.57 115.97 1aqv h LYS 120 Ca -0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 1aqv h LYS 120 Cb 1.09 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.40 1aqv h LYS 120 CO 0.01 0.51 -0.70 0.00 -0.57 0.00 0.00 179.45 178.70 1aqv n ALA 121 N -2.24 4.05 -0.32 3.86 0.00 -0.79 -4.46 120.51 120.60 1aqv n ALA 121 Ca 0.01 -0.48 0.01 0.00 0.00 0.00 0.00 53.44 52.98 1aqv n ALA 121 Cb 0.70 -0.95 0.14 0.00 0.00 0.00 0.00 19.45 19.35 1aqv n ALA 121 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1aqv h LEU 122 N 0.25 0.88 -0.84 0.00 5.85 -1.29 -2.80 115.31 117.36 1aqv h LEU 122 Ca 0.00 0.01 0.10 0.00 0.84 0.00 0.00 57.88 58.83 1aqv h LEU 122 Cb 0.52 -0.17 -0.08 0.00 0.37 0.00 0.00 40.66 41.30 1aqv h LEU 122 CO 0.00 0.57 0.48 -0.65 -0.34 0.00 0.00 178.44 178.50 1aqv h PRO 123 N 1.02 0.77 -0.22 5.25 0.11 -1.79 -0.59 132.00 136.56 1aqv h PRO 123 Ca 0.38 -0.05 -0.04 0.00 0.11 0.00 0.00 66.00 66.40 1aqv h PRO 123 Cb 0.15 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 31.07 1aqv h PRO 123 CO -0.16 0.51 -0.04 0.78 -0.21 0.00 0.00 178.00 178.88 1aqv h GLY 124 N 0.80 0.35 2.00 -0.55 0.00 -1.81 -1.74 103.07 102.11 1aqv h GLY 124 Ca 0.41 -0.19 -0.03 0.00 0.00 0.00 0.00 47.33 47.52 1aqv h GLY 124 CO -0.26 0.18 -0.17 1.46 0.00 0.00 0.00 176.54 177.76 1aqv h GLN 125 N 0.32 0.00 0.00 4.80 1.08 -1.13 -3.28 115.11 116.90 1aqv h GLN 125 Ca 0.07 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.27 1aqv h GLN 125 Cb 0.28 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.71 1aqv h GLN 125 CO 0.01 0.17 -1.49 1.28 -0.95 0.00 0.00 178.83 177.84 1aqv n LEU 126 N -3.15 0.41 -0.13 1.46 4.77 -0.65 -4.35 117.00 115.34 1aqv n LEU 126 Ca 0.03 0.09 0.12 0.00 -0.03 0.00 0.00 56.01 56.22 1aqv n LEU 126 Cb 0.57 -0.03 0.47 0.00 -2.33 0.00 0.00 43.42 42.10 1aqv n LEU 126 CO 0.36 -0.05 1.20 0.50 -1.33 0.00 0.00 177.39 178.07 1aqv h LYS 127 N 0.00 0.47 -0.45 3.23 3.64 -1.39 -2.06 116.57 120.02 1aqv h LYS 127 Ca 0.00 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.34 1aqv h LYS 127 Cb 0.95 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 32.64 1aqv h LYS 127 CO 0.00 0.31 0.22 -1.35 -2.27 0.00 0.00 179.45 176.36 1aqv h PRO 128 N 0.48 0.61 0.00 1.90 0.11 -1.77 -1.17 132.00 132.17 1aqv h PRO 128 Ca 0.32 -0.07 -0.12 0.00 0.11 0.00 0.00 66.00 66.24 1aqv h PRO 128 Cb 0.59 -0.12 -0.02 0.00 0.11 0.00 0.00 31.00 31.56 1aqv h PRO 128 CO -0.10 0.47 -0.57 0.74 -0.21 0.00 0.00 178.00 178.33 1aqv h PHE 129 N 0.62 0.00 -0.09 0.65 0.04 -1.66 -1.38 116.94 115.12 1aqv h PHE 129 Ca 0.16 0.00 -0.19 0.00 2.80 0.00 0.00 57.97 60.74 1aqv h PHE 129 Cb 0.06 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.20 1aqv h PHE 129 CO 0.00 0.57 -0.72 1.49 -0.60 0.00 0.00 178.31 179.06 1aqv h GLU 130 N 0.00 0.45 -0.14 1.51 4.57 -1.39 -2.00 114.58 117.58 1aqv h GLU 130 Ca -0.01 -0.36 -0.14 0.00 -1.18 0.00 0.00 59.36 57.67 1aqv h GLU 130 Cb 1.27 0.07 -0.01 0.00 -0.16 0.00 0.00 28.75 29.93 1aqv h GLU 130 CO 0.07 0.99 -0.53 1.15 -1.18 0.00 0.00 179.01 179.52 1aqv h THR 131 N 0.31 1.34 -0.08 0.32 2.02 -1.04 -0.62 112.91 115.15 1aqv h THR 131 Ca -0.03 -1.79 -0.13 0.00 0.77 0.00 0.00 66.41 65.22 1aqv h THR 131 Cb 1.30 1.81 -0.01 0.00 -1.74 0.00 0.00 68.15 69.50 1aqv h THR 131 CO 0.13 0.54 -0.55 -0.07 0.37 0.00 0.00 175.52 175.95 1aqv h LEU 132 N 0.32 0.27 -0.32 2.58 3.38 -0.99 -2.56 115.31 117.99 1aqv h LEU 132 Ca 0.01 -0.14 -0.20 0.00 0.09 0.00 0.00 57.88 57.64 1aqv h LEU 132 Cb 1.04 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.71 1aqv h LEU 132 CO 0.09 0.76 -0.75 -0.07 0.09 0.00 0.00 178.44 178.57 1aqv h LEU 133 N 0.19 0.65 -1.51 1.67 3.38 -0.85 -2.65 115.31 116.19 1aqv h LEU 133 Ca 0.00 -0.43 0.00 0.00 0.09 0.00 0.00 57.88 57.55 1aqv h LEU 133 Cb 1.02 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.58 1aqv h LEU 133 CO 0.08 1.19 0.00 0.77 0.09 0.00 0.00 178.44 180.57 1aqv h SER 134 N 0.37 0.00 0.17 -0.43 4.64 -0.75 0.13 113.55 117.68 1aqv h SER 134 Ca -0.04 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.28 1aqv h SER 134 Cb 1.34 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.43 1aqv h SER 134 CO 0.14 0.00 -0.54 0.00 -0.87 0.00 0.00 176.83 175.56 1aqv n GLN 135 N -2.74 0.58 -3.79 4.77 6.02 -1.00 -3.98 117.38 117.24 1aqv n GLN 135 Ca 0.00 -0.42 -0.35 0.00 -0.01 0.00 0.00 57.00 56.22 1aqv n GLN 135 Cb 0.21 -1.49 -0.11 0.00 1.02 0.00 0.00 30.24 29.87 1aqv n GLN 135 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.06 177.26 1aqv s ASN 136 N -2.71 5.04 -1.48 1.08 2.47 -0.35 -4.73 114.94 114.26 1aqv s ASN 136 Ca 0.16 -2.70 -0.06 0.00 0.42 0.00 0.00 52.86 50.68 1aqv s ASN 136 Cb 0.18 -1.80 0.03 0.00 -1.45 0.00 0.00 41.25 38.21 1aqv s ASN 136 CO 0.65 -0.37 0.63 0.00 -3.72 0.00 0.00 177.10 174.28 1aqv n GLN 137 N 3.65 -4.74 -1.51 0.43 6.02 -1.26 -1.25 117.38 118.72 1aqv n GLN 137 Ca 0.05 0.78 -0.14 0.00 -0.01 0.00 0.00 57.00 57.69 1aqv n GLN 137 Cb 0.38 -5.62 -0.05 0.00 1.02 0.00 0.00 30.24 25.96 1aqv n GLN 137 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1aqv n GLY 138 N -1.47 1.25 2.17 1.08 0.00 -1.26 -2.23 105.19 104.73 1aqv n GLY 138 Ca -0.08 -0.37 -0.07 0.00 0.00 0.00 0.00 46.02 45.51 1aqv n GLY 138 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1aqv n GLY 139 N -1.25 0.53 0.10 -0.02 0.00 0.32 -4.80 105.19 100.07 1aqv n GLY 139 Ca -0.14 -0.67 0.12 0.00 0.00 0.00 0.00 46.02 45.32 1aqv n GLY 139 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1aqv n LYS 140 N -2.27 0.28 0.00 1.61 5.02 -0.95 -4.85 118.16 117.01 1aqv n LYS 140 Ca -0.08 -0.19 0.00 0.00 -2.02 0.00 0.00 58.31 56.02 1aqv n LYS 140 Cb 0.38 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.90 1aqv n LYS 140 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1aqv n THR 141 N -1.19 0.00 -3.47 -0.18 -2.24 -1.26 -5.14 114.28 100.79 1aqv n THR 141 Ca 0.07 0.00 -0.19 0.00 -2.27 0.00 0.00 64.05 61.66 1aqv n THR 141 Cb 0.35 0.00 0.03 0.00 -2.10 0.00 0.00 70.33 68.60 1aqv n THR 141 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 1aqv n PHE 142 N 0.00 -1.47 0.18 4.78 3.72 -1.25 -5.02 117.46 118.40 1aqv n PHE 142 Ca 0.00 -1.85 0.02 0.00 -0.05 0.00 0.00 57.45 55.57 1aqv n PHE 142 Cb 0.00 -0.41 0.35 0.00 -0.94 0.00 0.00 39.48 38.48 1aqv n PHE 142 CO 0.00 0.00 0.00 0.97 -0.05 0.00 0.00 176.76 177.68 1aqv h ILE 143 N 0.39 1.25 -3.58 4.37 6.09 -1.96 -3.43 117.51 120.65 1aqv h ILE 143 Ca -0.26 -1.34 -0.27 0.00 -1.37 0.00 0.00 64.86 61.62 1aqv h ILE 143 Cb 1.05 1.73 -0.32 0.00 0.47 0.00 0.00 36.82 39.75 1aqv h ILE 143 CO 0.39 0.38 -0.72 -0.69 -3.07 0.00 0.00 178.15 174.45 1aqv s VAL 144 N -4.12 -0.04 0.00 2.19 1.01 -1.26 -4.75 120.40 113.43 1aqv s VAL 144 Ca -0.03 0.13 0.00 0.00 0.00 0.00 0.00 61.98 62.09 1aqv s VAL 144 Cb 0.14 -0.07 0.00 0.00 0.00 0.00 0.00 36.38 36.46 1aqv s VAL 144 CO 0.72 0.05 0.00 0.61 0.00 0.00 0.00 175.10 176.49 1aqv n GLY 145 N 3.77 0.59 0.42 4.51 0.00 -1.26 -4.28 105.19 108.93 1aqv n GLY 145 Ca -0.22 -0.89 0.07 0.00 0.00 0.00 0.00 46.02 44.98 1aqv n GLY 145 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1aqv n ASP 146 N -2.71 2.87 -4.30 1.61 5.68 -1.26 -3.78 116.55 114.66 1aqv n ASP 146 Ca 0.00 -2.64 -0.21 0.00 -0.50 0.00 0.00 54.79 51.44 1aqv n ASP 146 Cb 0.00 -0.34 -0.11 0.00 -1.14 0.00 0.00 41.12 39.52 1aqv n ASP 146 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1aqv s GLN 147 N -2.13 1.18 0.55 0.11 -2.07 -1.26 -4.87 119.66 111.17 1aqv s GLN 147 Ca 0.27 -1.34 -0.18 0.00 -1.82 0.00 0.00 55.36 52.29 1aqv s GLN 147 Cb 0.21 -1.19 -0.06 0.00 -1.09 0.00 0.00 33.01 30.88 1aqv s GLN 147 CO 0.07 0.24 1.06 -1.50 -1.32 0.00 0.00 175.29 173.84 1aqv s ILE 148 N -2.04 3.67 0.29 3.63 2.07 -1.26 -4.79 121.20 122.77 1aqv s ILE 148 Ca 0.13 0.92 0.02 0.00 -1.41 0.00 0.00 60.65 60.32 1aqv s ILE 148 Cb -0.06 -3.38 -0.04 0.00 0.13 0.00 0.00 42.46 39.11 1aqv s ILE 148 CO 0.05 -0.34 0.13 -0.94 -1.91 0.00 0.00 174.94 171.93 1aqv s SER 149 N -2.30 1.42 0.52 4.50 1.04 -1.26 -4.63 113.70 112.99 1aqv s SER 149 Ca 0.67 -1.47 0.28 0.00 0.48 0.00 0.00 55.95 55.90 1aqv s SER 149 Cb -0.18 0.28 1.44 0.00 0.10 0.00 0.00 66.02 67.67 1aqv s SER 149 CO 0.29 -0.81 2.06 2.19 0.98 0.00 0.00 173.24 177.95 1aqv h PHE 150 N 2.28 0.00 0.00 5.02 -5.15 -1.66 -1.23 116.94 116.20 1aqv h PHE 150 Ca -0.36 0.00 -0.02 0.00 -0.20 0.00 0.00 57.97 57.39 1aqv h PHE 150 Cb 1.25 0.00 -0.00 0.00 0.22 0.00 0.00 35.95 37.42 1aqv h PHE 150 CO 0.76 0.12 -0.09 0.00 -2.00 0.00 0.00 178.31 177.09 1aqv h ALA 151 N 1.88 1.01 -0.31 12.09 0.00 -1.87 -2.47 119.26 129.59 1aqv h ALA 151 Ca -0.00 -0.09 -0.14 0.00 0.00 0.00 0.00 54.91 54.68 1aqv h ALA 151 Cb 0.35 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 1aqv h ALA 151 CO 0.02 0.12 -0.39 -0.44 0.00 0.00 0.00 179.25 178.55 1aqv h ASP 152 N 0.00 0.79 0.67 0.00 3.32 -1.62 0.33 116.42 119.91 1aqv h ASP 152 Ca -0.00 -0.35 -0.14 0.00 0.02 0.00 0.00 57.03 56.55 1aqv h ASP 152 Cb 0.66 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 39.97 1aqv h ASP 152 CO 0.01 1.09 -0.68 1.88 -1.72 0.00 0.00 179.24 179.82 1aqv h TYR 153 N 0.61 0.02 0.09 4.55 0.05 -1.53 0.15 116.97 120.91 1aqv h TYR 153 Ca 0.05 -0.01 -0.25 0.00 0.05 0.00 0.00 58.73 58.57 1aqv h TYR 153 Cb 0.93 -0.00 -0.00 0.00 1.01 0.00 0.00 36.73 38.67 1aqv h TYR 153 CO 0.05 0.69 -1.14 -0.97 -1.05 0.00 0.00 178.16 175.74 1aqv h ASN 154 N 0.01 0.38 0.20 3.88 -0.00 -1.30 -1.95 115.58 116.80 1aqv h ASN 154 Ca -0.01 -0.38 -0.22 0.00 -0.00 0.00 0.00 56.30 55.69 1aqv h ASN 154 Cb 1.21 -0.12 0.00 0.00 -0.00 0.00 0.00 38.32 39.41 1aqv h ASN 154 CO 0.09 1.27 -0.89 0.25 -0.00 0.00 0.00 177.43 178.15 1aqv h LEU 155 N 0.09 0.64 -0.75 0.34 5.85 -0.70 -2.28 115.31 118.51 1aqv h LEU 155 Ca -0.11 -0.48 -0.01 0.00 0.84 0.00 0.00 57.88 58.13 1aqv h LEU 155 Cb 1.85 -0.19 -0.04 0.00 0.37 0.00 0.00 40.66 42.65 1aqv h LEU 155 CO 0.18 1.26 0.42 0.25 -0.34 0.00 0.00 178.44 180.21 1aqv h LEU 156 N 0.31 0.93 -0.90 2.25 5.85 -0.63 -1.06 115.31 122.06 1aqv h LEU 156 Ca -0.07 -0.09 -0.07 0.00 0.84 0.00 0.00 57.88 58.49 1aqv h LEU 156 Cb 1.51 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 42.28 1aqv h LEU 156 CO 0.16 0.75 0.04 -0.78 -0.34 0.00 0.00 178.44 178.27 1aqv h ASP 157 N 1.03 0.81 0.54 1.25 3.58 -1.23 -0.12 116.42 122.28 1aqv h ASP 157 Ca 0.26 -0.19 -0.10 0.00 0.42 0.00 0.00 57.03 57.43 1aqv h ASP 157 Cb 0.02 -0.22 -0.01 0.00 1.72 0.00 0.00 39.33 40.84 1aqv h ASP 157 CO -0.04 0.85 -0.46 0.25 -2.88 0.00 0.00 179.24 176.96 1aqv h LEU 158 N 0.80 0.00 0.04 2.28 5.85 -0.73 -0.63 115.31 122.92 1aqv h LEU 158 Ca 0.16 0.00 -0.28 0.00 0.84 0.00 0.00 57.88 58.60 1aqv h LEU 158 Cb 0.42 0.00 0.02 0.00 0.37 0.00 0.00 40.66 41.47 1aqv h LEU 158 CO 0.01 0.46 -1.15 -0.07 -0.34 0.00 0.00 178.44 177.35 1aqv h LEU 159 N 0.00 0.76 -1.03 2.25 3.38 -0.53 -2.43 115.31 117.72 1aqv h LEU 159 Ca -0.00 -0.68 -0.09 0.00 0.09 0.00 0.00 57.88 57.20 1aqv h LEU 159 Cb 0.85 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.35 1aqv h LEU 159 CO 0.06 1.49 -0.27 -0.07 0.09 0.00 0.00 178.44 179.74 1aqv h LEU 160 N 0.26 0.37 0.00 1.67 3.38 -0.63 -1.66 115.31 118.70 1aqv h LEU 160 Ca -0.15 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 57.70 1aqv h LEU 160 Cb 1.82 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 42.47 1aqv h LEU 160 CO 0.21 0.64 -0.08 0.16 0.09 0.00 0.00 178.44 179.46 1aqv h ILE 161 N 0.33 0.00 0.00 1.22 3.07 -1.05 -2.93 117.51 118.15 1aqv h ILE 161 Ca 0.05 -0.78 -0.08 0.00 1.55 0.00 0.00 64.86 65.60 1aqv h ILE 161 Cb 0.65 1.74 -0.01 0.00 -0.27 0.00 0.00 36.82 38.93 1aqv h ILE 161 CO 0.05 0.00 -0.69 0.45 -1.05 0.00 0.00 178.15 176.90 1aqv h HIS 162 N 0.00 0.00 0.00 0.16 3.86 -0.81 -2.75 115.15 115.60 1aqv h HIS 162 Ca 0.00 0.00 -0.06 0.00 -1.16 0.00 0.00 60.37 59.15 1aqv h HIS 162 Cb 0.89 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.35 1aqv h HIS 162 CO 0.00 0.31 -0.30 0.93 0.86 0.00 0.00 177.93 179.74 1aqv h GLU 163 N 0.00 0.00 0.00 2.45 4.39 -1.20 0.24 114.58 120.46 1aqv h GLU 163 Ca -0.04 0.00 -0.16 0.00 0.34 0.00 0.00 59.36 59.50 1aqv h GLU 163 Cb 1.27 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.90 1aqv h GLU 163 CO 0.03 0.30 -0.86 0.28 -1.16 0.00 0.00 179.01 177.60 1aqv h VAL 164 N 0.00 1.14 0.06 3.13 2.07 -1.46 -2.54 116.25 118.66 1aqv h VAL 164 Ca -0.00 -2.68 -0.28 0.00 0.82 0.00 0.00 66.70 64.56 1aqv h VAL 164 Cb 0.89 2.54 -0.02 0.00 -1.52 0.00 0.00 31.29 33.18 1aqv h VAL 164 CO 0.04 0.65 -1.45 0.25 0.02 0.00 0.00 177.57 177.08 1aqv h LEU 165 N 0.00 0.21 -6.13 2.57 5.85 -1.06 -3.41 115.31 113.34 1aqv h LEU 165 Ca -0.04 -0.30 -0.51 0.00 0.84 0.00 0.00 57.88 57.87 1aqv h LEU 165 Cb 1.59 -0.07 -0.34 0.00 0.37 0.00 0.00 40.66 42.21 1aqv h LEU 165 CO 0.09 1.25 -0.89 0.00 -0.34 0.00 0.00 178.44 178.55 1aqv s ALA 166 N -2.63 0.74 0.19 1.25 0.00 0.78 -5.10 121.76 116.98 1aqv s ALA 166 Ca -0.06 -2.06 -0.32 0.00 0.00 0.00 0.00 51.96 49.52 1aqv s ALA 166 Cb 0.08 -1.79 -0.15 0.00 0.00 0.00 0.00 23.12 21.25 1aqv s ALA 166 CO 0.84 -2.02 1.17 -2.30 0.00 0.00 0.00 175.76 173.45 1aqv n PRO 167 N 2.91 1.28 -1.00 0.00 -0.02 -0.96 -1.06 135.00 136.16 1aqv n PRO 167 Ca 0.27 0.45 0.00 0.00 -2.02 0.00 0.00 63.50 62.21 1aqv n PRO 167 Cb 0.49 -1.96 0.00 0.00 -0.02 0.00 0.00 33.50 32.02 1aqv n PRO 167 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1aqv n GLY 168 N 1.95 0.67 0.24 -1.23 0.00 -1.26 -4.90 105.19 100.67 1aqv n GLY 168 Ca 0.14 0.00 0.17 0.00 0.00 0.00 0.00 46.02 46.33 1aqv n GLY 168 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1aqv n LEU 170 N -2.72 2.79 0.25 0.00 4.77 -1.26 -4.34 117.00 116.49 1aqv n LEU 170 Ca -0.01 -1.04 0.08 0.00 -0.03 0.00 0.00 56.01 55.01 1aqv n LEU 170 Cb 0.13 -0.08 0.62 0.00 -2.33 0.00 0.00 43.42 41.76 1aqv n LEU 170 CO 0.18 0.52 1.02 0.44 -1.33 0.00 0.00 177.39 178.22 1aqv h ASP 171 N 4.07 0.00 0.48 -1.43 3.32 -1.59 -1.92 116.42 119.35 1aqv h ASP 171 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1aqv h ASP 171 Cb 0.88 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.43 1aqv h ASP 171 CO 0.00 0.06 -0.10 0.00 -1.72 0.00 0.00 179.24 177.47 1aqv n ALA 172 N -2.51 2.71 -3.96 3.45 0.00 -1.26 -4.57 120.51 114.38 1aqv n ALA 172 Ca -0.03 -0.23 -0.30 0.00 0.00 0.00 0.00 53.44 52.88 1aqv n ALA 172 Cb 0.14 -1.37 -0.14 0.00 0.00 0.00 0.00 19.45 18.08 1aqv n ALA 172 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 1aqv s PHE 173 N -2.58 3.26 0.18 0.00 0.08 -0.72 -4.99 117.98 113.21 1aqv s PHE 173 Ca 0.26 -3.11 -0.14 0.00 0.12 0.00 0.00 56.93 54.06 1aqv s PHE 173 Cb 0.20 -2.81 0.17 0.00 -0.57 0.00 0.00 43.02 40.01 1aqv s PHE 173 CO 0.49 -0.79 1.68 -1.35 -0.10 0.00 0.00 175.22 175.15 1aqv h PRO 174 N 6.76 0.09 -0.06 0.24 0.11 -1.80 -1.47 132.00 135.87 1aqv h PRO 174 Ca -0.07 -0.01 -0.12 0.00 0.11 0.00 0.00 66.00 65.91 1aqv h PRO 174 Cb 0.92 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.00 1aqv h PRO 174 CO 0.64 0.06 -0.53 -0.07 -0.21 0.00 0.00 178.00 177.90 1aqv h LEU 175 N 0.09 0.17 -0.17 2.35 3.38 -1.94 -1.96 115.31 117.24 1aqv h LEU 175 Ca 0.24 -0.09 -0.23 0.00 0.09 0.00 0.00 57.88 57.89 1aqv h LEU 175 Cb 0.36 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.06 1aqv h LEU 175 CO -0.41 0.67 -0.94 -0.07 0.09 0.00 0.00 178.44 177.77 1aqv h LEU 176 N 0.12 0.57 -0.63 1.67 3.38 -1.80 -1.15 115.31 117.46 1aqv h LEU 176 Ca 0.00 -0.45 -0.08 0.00 0.09 0.00 0.00 57.88 57.44 1aqv h LEU 176 Cb 0.97 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.52 1aqv h LEU 176 CO 0.08 1.25 0.07 0.28 0.09 0.00 0.00 178.44 180.20 1aqv h SER 177 N 0.25 1.04 0.96 -0.43 0.02 -1.23 -0.67 113.55 113.47 1aqv h SER 177 Ca -0.08 -0.28 -0.10 0.00 -0.84 0.00 0.00 61.79 60.49 1aqv h SER 177 Cb 1.58 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 63.83 1aqv h SER 177 CO 0.17 1.06 -0.46 0.00 -1.14 0.00 0.00 176.83 176.45 1aqv h ALA 178 N 1.02 0.89 0.03 3.77 0.00 -1.23 -2.61 119.26 121.13 1aqv h ALA 178 Ca 0.19 -0.42 -0.24 0.00 0.00 0.00 0.00 54.91 54.44 1aqv h ALA 178 Cb 0.48 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.20 1aqv h ALA 178 CO 0.02 0.58 -1.01 -0.92 0.00 0.00 0.00 179.25 177.92 1aqv h TYR 179 N 0.00 0.57 -0.12 0.00 3.20 -0.64 -1.74 116.97 118.24 1aqv h TYR 179 Ca -0.00 -0.34 -0.10 0.00 3.14 0.00 0.00 58.73 61.43 1aqv h TYR 179 Cb 1.06 -0.06 -0.01 0.00 1.54 0.00 0.00 36.73 39.26 1aqv h TYR 179 CO 0.00 1.18 -0.39 0.28 -1.64 0.00 0.00 178.16 177.59 1aqv h VAL 180 N 0.19 1.30 -0.09 1.81 2.07 -0.96 -1.99 116.25 118.57 1aqv h VAL 180 Ca -0.09 -1.47 -0.02 0.00 0.82 0.00 0.00 66.70 65.94 1aqv h VAL 180 Cb 1.67 1.64 -0.00 0.00 -1.52 0.00 0.00 31.29 33.07 1aqv h VAL 180 CO 0.17 0.44 -0.02 1.23 0.02 0.00 0.00 177.57 179.41 1aqv h GLY 181 N 1.18 0.19 1.07 2.17 0.00 -1.31 -1.76 103.07 104.61 1aqv h GLY 181 Ca 0.02 -0.15 -0.07 0.00 0.00 0.00 0.00 47.33 47.12 1aqv h GLY 181 CO 0.06 0.14 0.15 3.21 0.00 0.00 0.00 176.54 180.10 1aqv h ARG 182 N -0.15 1.14 0.00 4.80 3.08 -1.05 -3.02 114.38 119.18 1aqv h ARG 182 Ca 0.02 -0.29 -0.15 0.00 0.07 0.00 0.00 59.98 59.64 1aqv h ARG 182 Cb 0.42 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 30.31 1aqv h ARG 182 CO 0.01 1.02 -0.71 -0.07 -1.07 0.00 0.00 179.97 179.14 1aqv h LEU 183 N 1.07 0.00 -0.42 3.04 4.07 -1.32 -2.86 115.31 118.89 1aqv h LEU 183 Ca 0.22 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.18 1aqv h LEU 183 Cb 0.40 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.14 1aqv h LEU 183 CO 0.01 0.71 0.00 -1.20 -1.08 0.00 0.00 178.44 176.88 1aqv n SER 184 N -3.45 0.45 -0.75 -0.43 7.64 -0.67 -2.31 113.62 114.10 1aqv n SER 184 Ca 0.00 0.60 0.12 0.00 1.01 0.00 0.00 58.87 60.60 1aqv n SER 184 Cb 0.76 -0.70 0.06 0.00 -1.01 0.00 0.00 64.21 63.32 1aqv n SER 184 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1aqv n ALA 185 N -1.68 2.94 -1.84 -0.43 0.00 -1.08 -3.94 120.51 114.48 1aqv n ALA 185 Ca 0.03 -0.66 -0.42 0.00 0.00 0.00 0.00 53.44 52.39 1aqv n ALA 185 Cb 0.23 -0.81 -0.02 0.00 0.00 0.00 0.00 19.45 18.84 1aqv n ALA 185 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1aqv s ARG 186 N -2.21 4.20 0.09 0.00 0.52 -0.98 -4.78 118.95 115.78 1aqv s ARG 186 Ca 0.24 2.43 -0.19 0.00 -0.52 0.00 0.00 55.73 57.69 1aqv s ARG 186 Cb 0.19 -3.09 -0.05 0.00 0.52 0.00 0.00 34.95 32.52 1aqv s ARG 186 CO 0.42 -0.56 1.32 -1.00 0.02 0.00 0.00 175.30 175.50 1aqv h PRO 187 N 5.54 -0.11 0.00 3.54 0.13 -1.91 0.25 132.00 139.44 1aqv h PRO 187 Ca -0.45 0.01 -0.03 0.00 -0.87 0.00 0.00 66.00 64.65 1aqv h PRO 187 Cb 1.21 0.03 -0.00 0.00 0.13 0.00 0.00 31.00 32.36 1aqv h PRO 187 CO 0.83 -0.07 -0.15 0.87 -0.23 0.00 0.00 178.00 179.24 1aqv h LYS 188 N -0.12 0.00 0.02 0.86 1.57 -1.89 -2.20 116.57 114.81 1aqv h LYS 188 Ca 0.07 0.00 -0.23 0.00 -1.87 0.00 0.00 60.65 58.62 1aqv h LYS 188 Cb 0.30 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.58 1aqv h LYS 188 CO -0.46 0.15 -1.16 1.25 -0.57 0.00 0.00 179.45 178.66 1aqv h LEU 189 N 0.00 0.06 -0.57 2.94 5.85 -1.66 -2.65 115.31 119.27 1aqv h LEU 189 Ca -0.00 -0.08 -0.16 0.00 0.84 0.00 0.00 57.88 58.49 1aqv h LEU 189 Cb 0.38 -0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.38 1aqv h LEU 189 CO 0.02 1.06 -0.60 0.50 -0.34 0.00 0.00 178.44 179.08 1aqv h LYS 190 N 0.01 0.37 -0.14 1.25 3.64 0.05 -0.43 116.57 121.32 1aqv h LYS 190 Ca -0.08 -0.25 -0.17 0.00 -1.27 0.00 0.00 60.65 58.88 1aqv h LYS 190 Cb 1.84 0.04 -0.00 0.00 -0.41 0.00 0.00 32.23 33.69 1aqv h LYS 190 CO 0.13 0.86 -0.63 0.00 -2.27 0.00 0.00 179.45 177.54 1aqv h ALA 191 N 1.08 0.64 -0.05 5.00 0.00 -1.43 -2.77 119.26 121.72 1aqv h ALA 191 Ca -0.01 -0.55 -0.17 0.00 0.00 0.00 0.00 54.91 54.18 1aqv h ALA 191 Cb 1.13 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.84 1aqv h ALA 191 CO 0.10 0.72 -0.73 0.35 0.00 0.00 0.00 179.25 179.69 1aqv h PHE 192 N 0.37 0.39 0.00 0.00 3.57 -1.09 -2.50 116.94 117.68 1aqv h PHE 192 Ca -0.01 -0.18 0.00 0.00 3.53 0.00 0.00 57.97 61.31 1aqv h PHE 192 Cb 1.19 -0.06 0.00 0.00 2.79 0.00 0.00 35.95 39.87 1aqv h PHE 192 CO 0.05 0.92 0.00 1.28 -2.23 0.00 0.00 178.31 178.32 1aqv n LEU 193 N -3.80 0.63 -0.45 0.59 4.77 -0.21 -1.92 117.00 116.61 1aqv n LEU 193 Ca -0.03 0.62 0.11 0.00 -0.03 0.00 0.00 56.01 56.67 1aqv n LEU 193 Cb 0.71 -0.48 -0.01 0.00 -2.33 0.00 0.00 43.42 41.30 1aqv n LEU 193 CO 0.47 -0.39 0.27 0.00 -1.33 0.00 0.00 177.39 176.42 1aqv n ALA 194 N -1.74 3.67 -1.75 -1.18 0.00 -0.97 -4.53 120.51 114.00 1aqv n ALA 194 Ca 0.04 -0.64 -0.33 0.00 0.00 0.00 0.00 53.44 52.50 1aqv n ALA 194 Cb 0.29 -0.79 -0.02 0.00 0.00 0.00 0.00 19.45 18.94 1aqv n ALA 194 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1aqv s SER 195 N -2.53 6.20 0.35 0.00 1.04 -0.81 -4.83 113.70 113.12 1aqv s SER 195 Ca 0.18 1.80 0.03 0.00 0.48 0.00 0.00 55.95 58.44 1aqv s SER 195 Cb 0.18 -2.54 0.65 0.00 0.10 0.00 0.00 66.02 64.41 1aqv s SER 195 CO 0.60 -0.88 1.97 -0.65 0.98 0.00 0.00 173.24 175.26 1aqv h PRO 196 N 1.00 0.71 0.00 4.02 0.11 -1.93 0.40 132.00 136.31 1aqv h PRO 196 Ca -0.48 -0.07 0.00 0.00 0.11 0.00 0.00 66.00 65.56 1aqv h PRO 196 Cb 1.21 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 32.18 1aqv h PRO 196 CO 0.59 0.54 0.00 1.05 -0.21 0.00 0.00 178.00 179.96 1aqv h GLU 197 N 0.72 0.00 0.00 1.05 4.11 -1.93 0.73 114.58 119.26 1aqv h GLU 197 Ca 0.18 0.00 -0.37 0.00 0.07 0.00 0.00 59.36 59.24 1aqv h GLU 197 Cb 0.04 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.24 1aqv h GLU 197 CO -0.03 0.00 -2.21 0.98 0.07 0.00 0.00 179.01 177.82 1aqv n TYR 198 N -3.04 0.00 0.20 2.06 9.36 -0.72 -4.46 117.16 120.56 1aqv n TYR 198 Ca -0.02 0.00 0.05 0.00 3.32 0.00 0.00 57.90 61.25 1aqv n TYR 198 Cb 0.11 -0.84 0.41 0.00 -0.63 0.00 0.00 39.34 38.39 1aqv n TYR 198 CO 0.00 0.00 0.00 0.28 0.22 0.00 0.00 176.86 177.36 1aqv h VAL 199 N -0.89 1.01 -0.28 2.97 2.07 -0.91 -2.88 116.25 117.34 1aqv h VAL 199 Ca -0.56 -1.28 0.00 0.00 0.82 0.00 0.00 66.70 65.69 1aqv h VAL 199 Cb 1.47 1.74 0.00 0.00 -1.52 0.00 0.00 31.29 32.98 1aqv h VAL 199 CO -0.34 0.33 0.00 0.59 0.02 0.00 0.00 177.57 178.18 1aqv n ASN 200 N -3.79 2.12 -4.79 0.57 3.02 0.24 -4.82 115.26 107.81 1aqv n ASN 200 Ca -0.01 -1.84 -0.36 0.00 -0.03 0.00 0.00 54.58 52.34 1aqv n ASN 200 Cb 0.42 -0.18 -0.07 0.00 -0.61 0.00 0.00 39.78 39.34 1aqv n ASN 200 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1aqv s LEU 201 N -1.38 4.13 0.73 3.41 1.43 -1.09 -5.05 118.68 120.86 1aqv s LEU 201 Ca 0.32 0.32 -0.12 0.00 -1.03 0.00 0.00 54.13 53.62 1aqv s LEU 201 Cb 0.17 -2.01 0.04 0.00 0.03 0.00 0.00 46.19 44.42 1aqv s LEU 201 CO 0.25 0.34 1.10 -2.16 0.23 0.00 0.00 176.35 176.11 1aqv s PRO 202 N -0.63 2.45 0.13 1.29 0.04 -1.26 -4.71 135.00 132.30 1aqv s PRO 202 Ca 0.12 1.27 -0.10 0.00 0.04 0.00 0.00 61.00 62.33 1aqv s PRO 202 Cb -0.12 -1.91 -0.08 0.00 0.04 0.00 0.00 34.50 32.43 1aqv s PRO 202 CO 0.02 -1.51 1.38 0.82 0.04 0.00 0.00 177.00 177.76 1aqv h ILE 203 N -0.67 1.28 -2.31 0.56 2.04 -1.95 -0.57 117.51 115.90 1aqv h ILE 203 Ca -0.45 -1.84 -0.54 0.00 1.00 0.00 0.00 64.86 63.03 1aqv h ILE 203 Cb 1.24 1.78 -0.13 0.00 -0.74 0.00 0.00 36.82 38.97 1aqv h ILE 203 CO 0.52 0.59 -0.60 0.20 0.00 0.00 0.00 178.15 178.87 1aqv s ASN 204 N -7.01 2.99 0.11 1.72 0.02 -1.26 -1.05 114.94 110.47 1aqv s ASN 204 Ca -0.10 -1.40 0.26 0.00 -1.02 0.00 0.00 52.86 50.60 1aqv s ASN 204 Cb 0.10 -0.14 0.80 0.00 0.02 0.00 0.00 41.25 42.04 1aqv s ASN 204 CO 0.89 -0.58 1.69 0.61 0.02 0.00 0.00 177.10 179.73 1aqv n GLY 205 N -0.82 -1.54 0.95 0.66 0.00 -1.26 -3.60 105.19 99.58 1aqv n GLY 205 Ca -0.04 -0.13 0.09 0.00 0.00 0.00 0.00 46.02 45.94 1aqv n GLY 205 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1aqv n ASN 206 N -1.94 3.26 0.00 1.61 6.94 -1.26 -4.96 115.26 118.91 1aqv n ASN 206 Ca 0.06 -1.94 0.00 0.00 -0.02 0.00 0.00 54.58 52.67 1aqv n ASN 206 Cb 0.40 -0.29 0.00 0.00 -2.36 0.00 0.00 39.78 37.53 1aqv n ASN 206 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1aqv n GLY 207 N 1.09 2.85 3.84 4.83 0.00 -1.24 -5.00 105.19 111.56 1aqv n GLY 207 Ca 0.17 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.86 1aqv n GLY 207 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1aqv s LYS 208 N 0.00 3.88 0.00 1.61 1.02 -1.26 -4.96 119.74 120.03 1aqv s LYS 208 Ca 0.00 1.00 0.00 0.00 0.02 0.00 0.00 55.97 56.99 1aqv s LYS 208 Cb 0.00 -2.12 0.00 0.00 -0.52 0.00 0.00 37.83 35.19 1aqv s LYS 208 CO 0.00 -0.33 0.00 0.00 -0.92 0.00 0.00 175.35 174.10