#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3aeq s LYS 2 N 0.00 0.24 0.19 0.03 2.20 -1.26 -5.12 119.74 116.02 3aeq s LYS 2 Ca 0.00 -0.03 -0.31 0.00 -0.36 0.00 0.00 55.97 55.27 3aeq s LYS 2 Cb 0.00 -1.49 -0.09 0.00 -1.51 0.00 0.00 37.83 34.73 3aeq s LYS 2 CO 0.00 -0.54 1.43 -1.17 -0.36 0.00 0.00 175.35 174.71 3aeq s LEU 3 N 2.06 4.38 -0.03 5.43 1.98 -1.26 -5.00 118.68 126.24 3aeq s LEU 3 Ca 0.02 2.52 -0.01 0.00 -2.89 0.00 0.00 54.13 53.78 3aeq s LEU 3 Cb -0.15 -3.60 0.03 0.00 0.66 0.00 0.00 46.19 43.13 3aeq s LEU 3 CO -0.07 -0.68 0.04 -0.89 -1.89 0.00 0.00 176.35 172.85 3aeq s THR 4 N 0.56 -0.05 0.00 3.68 2.01 -1.26 -5.05 115.64 115.53 3aeq s THR 4 Ca 0.63 0.27 0.00 0.00 0.31 0.00 0.00 61.69 62.90 3aeq s THR 4 Cb -0.40 -0.13 0.00 0.00 0.01 0.00 0.00 72.50 71.98 3aeq s THR 4 CO 0.36 0.13 0.00 -0.11 -0.69 0.00 0.00 174.62 174.31 3aeq n LEU 5 N 4.56 0.00 -4.80 4.42 7.94 -1.26 -5.04 117.00 122.83 3aeq n LEU 5 Ca -0.19 0.00 -0.35 0.00 -1.11 0.00 0.00 56.01 54.35 3aeq n LEU 5 Cb 0.50 -0.13 -0.06 0.00 0.53 0.00 0.00 43.42 44.26 3aeq n LEU 5 CO 0.17 -0.14 0.66 0.86 -1.11 0.00 0.00 177.39 177.83 3aeq s TRP 6 N -0.29 3.47 -0.22 1.96 -0.11 -1.26 -5.07 118.94 117.42 3aeq s TRP 6 Ca 0.00 1.69 -0.02 0.00 1.22 0.00 0.00 56.10 58.99 3aeq s TRP 6 Cb 0.00 -2.93 0.07 0.00 -1.50 0.00 0.00 33.47 29.11 3aeq s TRP 6 CO 0.00 -0.06 0.05 -0.08 -4.62 0.00 0.00 176.95 172.24 3aeq s THR 7 N -1.85 0.57 0.37 5.86 -1.32 -1.26 -4.90 115.64 113.12 3aeq s THR 7 Ca 0.56 -0.72 0.09 0.00 -1.21 0.00 0.00 61.69 60.41 3aeq s THR 7 Cb -0.15 -1.15 0.31 0.00 -1.51 0.00 0.00 72.50 70.00 3aeq s THR 7 CO 0.20 -0.31 1.93 1.88 -2.21 0.00 0.00 174.62 176.11 3aeq h TYR 8 N 8.22 0.71 -3.05 9.09 -1.99 -1.98 -3.42 116.97 124.55 3aeq h TYR 8 Ca -0.16 0.02 -0.53 0.00 2.00 0.00 0.00 58.73 60.05 3aeq h TYR 8 Cb 1.10 -0.23 -0.17 0.00 2.00 0.00 0.00 36.73 39.43 3aeq h TYR 8 CO 0.30 0.33 -0.77 -1.21 -0.00 0.00 0.00 178.16 176.80 3aeq s GLU 9 N -5.61 1.37 0.01 4.88 2.02 -1.26 -4.48 118.70 115.63 3aeq s GLU 9 Ca -0.09 -1.51 -0.00 0.00 0.02 0.00 0.00 54.97 53.39 3aeq s GLU 9 Cb 0.20 -1.41 0.00 0.00 0.10 0.00 0.00 34.13 33.03 3aeq s GLU 9 CO 0.77 0.28 0.02 0.41 0.02 0.00 0.00 175.26 176.76 3aeq n GLY 10 N 0.03 -0.60 3.76 -1.39 0.00 -1.26 -4.79 105.19 100.94 3aeq n GLY 10 Ca -0.11 -1.75 -0.31 0.00 0.00 0.00 0.00 46.02 43.85 3aeq n GLY 10 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3aeq s PRO 11 N -2.87 2.02 0.24 1.61 0.04 -1.26 -1.18 135.00 133.60 3aeq s PRO 11 Ca 0.01 0.98 -0.06 0.00 0.04 0.00 0.00 61.00 61.98 3aeq s PRO 11 Cb -0.00 -1.88 0.33 0.00 0.04 0.00 0.00 34.50 32.98 3aeq s PRO 11 CO 0.01 -1.75 1.85 -1.35 0.04 0.00 0.00 177.00 175.80 3aeq h PRO 12 N -1.20 0.94 -0.75 0.56 0.11 -1.73 -2.63 132.00 127.29 3aeq h PRO 12 Ca -0.46 -0.06 0.06 0.00 0.11 0.00 0.00 66.00 65.66 3aeq h PRO 12 Cb 1.25 -0.21 -0.06 0.00 0.11 0.00 0.00 31.00 32.09 3aeq h PRO 12 CO 0.54 0.62 0.44 1.12 -0.21 0.00 0.00 178.00 180.51 3aeq h HIS 13 N 0.97 0.82 -1.01 0.65 2.07 -1.89 0.15 115.15 116.90 3aeq h HIS 13 Ca 0.37 0.03 0.23 0.00 -2.85 0.00 0.00 60.37 58.14 3aeq h HIS 13 Cb 0.17 -0.26 -0.12 0.00 2.57 0.00 0.00 27.41 29.77 3aeq h HIS 13 CO -0.03 0.40 0.61 0.28 -3.07 0.00 0.00 177.93 176.11 3aeq h VAL 14 N 0.81 0.60 -0.62 6.12 2.07 -1.83 0.43 116.25 123.82 3aeq h VAL 14 Ca 0.33 -0.22 -0.06 0.00 0.82 0.00 0.00 66.70 67.57 3aeq h VAL 14 Cb 0.19 -0.09 -0.03 0.00 -1.52 0.00 0.00 31.29 29.84 3aeq h VAL 14 CO -0.18 0.12 0.15 1.23 0.02 0.00 0.00 177.57 178.90 3aeq h GLY 15 N 0.64 1.05 0.83 2.17 0.00 -0.76 -1.79 103.07 105.21 3aeq h GLY 15 Ca 0.62 -0.64 0.04 0.00 0.00 0.00 0.00 47.33 47.35 3aeq h GLY 15 CO -0.43 0.60 0.50 0.00 0.00 0.00 0.00 176.54 177.21 3aeq h ALA 16 N 1.22 1.06 -0.45 3.60 0.00 0.66 -2.39 119.26 122.96 3aeq h ALA 16 Ca 0.20 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 3aeq h ALA 16 Cb 0.34 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 3aeq h ALA 16 CO 0.00 0.30 0.22 0.52 0.00 0.00 0.00 179.25 180.29 3aeq h MET 17 N 0.97 0.62 -0.47 0.00 2.86 0.13 -0.90 114.93 118.13 3aeq h MET 17 Ca 0.33 -0.07 -0.03 0.00 -2.06 0.00 0.00 59.70 57.87 3aeq h MET 17 Cb 0.06 -0.12 -0.02 0.00 0.06 0.00 0.00 31.60 31.57 3aeq h MET 17 CO -0.13 0.48 0.17 0.00 1.06 0.00 0.00 176.91 178.49 3aeq h ARG 18 N 0.63 0.72 0.03 1.72 3.08 -0.84 0.37 114.38 120.09 3aeq h ARG 18 Ca 0.16 -0.14 -0.00 0.00 0.07 0.00 0.00 59.98 60.07 3aeq h ARG 18 Cb 0.06 -0.11 0.00 0.00 0.08 0.00 0.00 29.97 30.00 3aeq h ARG 18 CO -0.02 0.67 -0.02 0.28 -1.07 0.00 0.00 179.97 179.81 3aeq h VAL 19 N 0.62 1.14 -0.02 2.04 2.07 -1.29 -1.31 116.25 119.50 3aeq h VAL 19 Ca 0.15 -0.54 0.02 0.00 0.82 0.00 0.00 66.70 67.16 3aeq h VAL 19 Cb 0.23 1.50 -0.02 0.00 -1.52 0.00 0.00 31.29 31.47 3aeq h VAL 19 CO -0.01 0.14 -0.09 0.00 0.02 0.00 0.00 177.57 177.62 3aeq h ALA 20 N 0.68 -0.08 0.00 1.67 0.00 -0.91 -2.56 119.26 118.06 3aeq h ALA 20 Ca -0.00 0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.86 3aeq h ALA 20 Cb 0.26 0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 3aeq h ALA 20 CO 0.01 -0.58 -0.28 1.15 0.00 0.00 0.00 179.25 179.55 3aeq h THR 21 N -0.15 1.15 -0.30 0.00 2.02 -0.33 -2.04 112.91 113.26 3aeq h THR 21 Ca 0.04 -0.97 -0.05 0.00 0.77 0.00 0.00 66.41 66.20 3aeq h THR 21 Cb 0.21 1.53 -0.02 0.00 -1.74 0.00 0.00 68.15 68.13 3aeq h THR 21 CO -0.11 0.27 -0.02 0.00 0.37 0.00 0.00 175.52 176.03 3aeq h ALA 22 N 1.72 1.41 -2.28 6.16 0.00 -0.86 -3.45 119.26 121.96 3aeq h ALA 22 Ca -0.00 -0.19 -0.48 0.00 0.00 0.00 0.00 54.91 54.23 3aeq h ALA 22 Cb 0.51 -0.13 0.05 0.00 0.00 0.00 0.00 17.79 18.22 3aeq h ALA 22 CO 0.04 0.41 0.16 -1.64 0.00 0.00 0.00 179.25 178.22 3aeq s MET 23 N -4.94 3.02 0.21 0.00 -1.94 -0.77 -1.92 119.30 112.97 3aeq s MET 23 Ca -0.07 0.02 0.09 0.00 -1.71 0.00 0.00 55.69 54.02 3aeq s MET 23 Cb 0.16 -2.29 -0.04 0.00 2.01 0.00 0.00 34.83 34.66 3aeq s MET 23 CO 0.76 -0.62 -0.09 -1.59 -0.01 0.00 0.00 175.02 173.47 3aeq s LYS 24 N -4.95 2.05 -1.44 2.03 -2.85 -0.69 -4.70 119.74 109.21 3aeq s LYS 24 Ca 0.53 -1.35 0.00 0.00 -1.00 0.00 0.00 55.97 54.15 3aeq s LYS 24 Cb -0.10 -2.11 0.00 0.00 -2.06 0.00 0.00 37.83 33.55 3aeq s LYS 24 CO 0.45 0.41 0.00 -0.25 0.10 0.00 0.00 175.35 176.06 3aeq n ASP 25 N -0.20 -4.77 -4.11 0.03 8.00 -1.26 -4.11 116.55 110.13 3aeq n ASP 25 Ca -0.09 0.14 -0.29 0.00 0.71 0.00 0.00 54.79 55.25 3aeq n ASP 25 Cb 0.57 -4.04 -0.17 0.00 -0.02 0.00 0.00 41.12 37.46 3aeq n ASP 25 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 3aeq s LEU 26 N -5.59 1.87 -0.22 0.64 0.20 -1.26 -1.78 118.68 112.53 3aeq s LEU 26 Ca 0.00 -0.46 -0.07 0.00 0.69 0.00 0.00 54.13 54.29 3aeq s LEU 26 Cb 0.00 -1.17 -0.03 0.00 -0.43 0.00 0.00 46.19 44.56 3aeq s LEU 26 CO 0.00 0.07 0.06 -1.10 -0.29 0.00 0.00 176.35 175.10 3aeq s GLN 27 N 0.68 3.77 -0.19 1.98 -1.52 -1.10 -4.75 119.66 118.53 3aeq s GLN 27 Ca -0.13 -0.43 -0.06 0.00 -1.95 0.00 0.00 55.36 52.79 3aeq s GLN 27 Cb -0.16 -3.26 -0.03 0.00 -0.22 0.00 0.00 33.01 29.33 3aeq s GLN 27 CO 0.03 0.01 0.03 -1.17 -0.25 0.00 0.00 175.29 173.93 3aeq s LEU 28 N 1.09 3.50 -0.16 2.90 2.96 -0.51 -0.44 118.68 128.01 3aeq s LEU 28 Ca 0.04 -0.08 -0.04 0.00 -0.22 0.00 0.00 54.13 53.83 3aeq s LEU 28 Cb -0.14 -1.88 -0.03 0.00 0.50 0.00 0.00 46.19 44.64 3aeq s LEU 28 CO 0.03 0.12 -0.03 -0.69 -1.32 0.00 0.00 176.35 174.46 3aeq s VAL 29 N 0.70 3.94 -0.10 1.68 1.01 0.01 -1.71 120.40 125.92 3aeq s VAL 29 Ca 0.01 -0.34 0.02 0.00 0.00 0.00 0.00 61.98 61.68 3aeq s VAL 29 Cb -0.14 -2.74 -0.01 0.00 0.00 0.00 0.00 36.38 33.50 3aeq s VAL 29 CO 0.02 0.48 -0.19 -0.76 0.00 0.00 0.00 175.10 174.65 3aeq s LEU 30 N 0.47 2.40 -0.40 3.92 1.43 0.13 -2.20 118.68 124.44 3aeq s LEU 30 Ca -0.03 -0.43 -0.25 0.00 -1.03 0.00 0.00 54.13 52.39 3aeq s LEU 30 Cb -0.14 -1.50 0.02 0.00 0.03 0.00 0.00 46.19 44.60 3aeq s LEU 30 CO 0.03 0.19 0.90 -2.28 0.23 0.00 0.00 176.35 175.41 3aeq s HIS 31 N 0.21 3.03 0.06 0.29 5.65 -0.46 -1.90 115.29 122.17 3aeq s HIS 31 Ca -0.12 0.59 -0.27 0.00 0.25 0.00 0.00 55.06 55.52 3aeq s HIS 31 Cb -0.16 -3.71 0.09 0.00 -1.18 0.00 0.00 32.58 27.62 3aeq s HIS 31 CO 0.06 -0.91 1.18 0.20 -0.65 0.00 0.00 174.74 174.63 3aeq s GLY 32 N 2.01 -0.14 0.67 1.59 0.00 -1.26 -1.10 107.32 109.09 3aeq s GLY 32 Ca 0.36 0.11 -0.07 0.00 0.00 0.00 0.00 44.72 45.12 3aeq s GLY 32 CO 0.21 2.67 0.99 2.56 0.00 0.00 0.00 173.10 179.53 3aeq s PRO 33 N -2.30 2.45 0.25 2.90 0.04 -1.26 -1.45 135.00 135.63 3aeq s PRO 33 Ca 0.21 -0.12 -0.30 0.00 0.04 0.00 0.00 61.00 60.84 3aeq s PRO 33 Cb 0.00 -2.18 -0.14 0.00 0.04 0.00 0.00 34.50 32.22 3aeq s PRO 33 CO 0.01 -1.08 1.11 1.04 0.04 0.00 0.00 177.00 178.12 3aeq n GLN 34 N -2.84 1.41 0.00 4.56 6.02 -1.21 -2.77 117.38 122.55 3aeq n GLN 34 Ca 0.07 0.50 0.00 0.00 -0.01 0.00 0.00 57.00 57.56 3aeq n GLN 34 Cb 0.59 -1.95 0.00 0.00 1.02 0.00 0.00 30.24 29.91 3aeq n GLN 34 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3aeq n GLY 35 N 1.56 2.33 0.00 1.08 0.00 -1.26 -4.84 105.19 104.05 3aeq n GLY 35 Ca 0.11 -0.20 0.06 0.00 0.00 0.00 0.00 46.02 45.99 3aeq n GLY 35 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3aeq n ASP 36 N 0.14 0.00 0.00 1.61 8.00 -1.11 -1.42 116.55 123.77 3aeq n ASP 36 Ca 0.00 -0.03 0.08 0.00 0.71 0.00 0.00 54.79 55.55 3aeq n ASP 36 Cb 0.00 -0.20 0.48 0.00 -0.02 0.00 0.00 41.12 41.38 3aeq n ASP 36 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 3aeq n THR 37 N -1.20 0.00 0.17 -3.53 -2.24 -1.26 -3.24 114.28 102.98 3aeq n THR 37 Ca 0.07 0.00 0.06 0.00 -2.27 0.00 0.00 64.05 61.90 3aeq n THR 37 Cb 0.08 -0.37 0.53 0.00 -2.10 0.00 0.00 70.33 68.46 3aeq n THR 37 CO 0.00 0.00 0.00 0.10 -0.57 0.00 0.00 175.07 174.60 3aeq h TYR 38 N 0.00 0.16 0.00 4.78 -0.00 -1.66 -1.67 116.97 118.58 3aeq h TYR 38 Ca 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.73 3aeq h TYR 38 Cb 0.00 -0.05 0.00 0.00 -0.00 0.00 0.00 36.73 36.68 3aeq h TYR 38 CO 0.00 0.16 0.00 0.00 -0.00 0.00 0.00 178.16 178.32 3aeq h ALA 39 N 1.86 1.00 -0.61 0.10 0.00 -1.82 -1.53 119.26 118.26 3aeq h ALA 39 Ca 0.04 0.00 0.05 0.00 0.00 0.00 0.00 54.91 55.00 3aeq h ALA 39 Cb 0.09 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 17.85 3aeq h ALA 39 CO -0.00 0.00 0.40 -0.44 0.00 0.00 0.00 179.25 179.21 3aeq h ASP 40 N 0.00 0.55 0.95 0.00 3.32 -1.57 -2.63 116.42 117.04 3aeq h ASP 40 Ca 0.00 -0.00 -0.04 0.00 0.02 0.00 0.00 57.03 57.01 3aeq h ASP 40 Cb 0.09 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 39.51 3aeq h ASP 40 CO 0.00 0.36 -0.18 -0.07 -1.72 0.00 0.00 179.24 177.63 3aeq h LEU 41 N 0.63 0.00 -0.94 1.55 4.07 -1.47 -2.09 115.31 117.07 3aeq h LEU 41 Ca 0.26 0.00 0.05 0.00 0.08 0.00 0.00 57.88 58.27 3aeq h LEU 41 Cb 0.22 0.00 -0.06 0.00 1.08 0.00 0.00 40.66 41.90 3aeq h LEU 41 CO -0.07 0.18 0.60 -0.07 -1.08 0.00 0.00 178.44 178.00 3aeq h LEU 42 N 0.00 0.98 0.12 1.67 4.07 -1.61 0.55 115.31 121.08 3aeq h LEU 42 Ca -0.00 0.00 -0.20 0.00 0.08 0.00 0.00 57.88 57.76 3aeq h LEU 42 Cb 0.70 -0.21 0.01 0.00 1.08 0.00 0.00 40.66 42.25 3aeq h LEU 42 CO 0.02 0.65 -0.95 -0.26 -1.08 0.00 0.00 178.44 176.82 3aeq h PHE 43 N 1.13 0.44 0.00 1.13 0.04 -1.52 -2.23 116.94 115.94 3aeq h PHE 43 Ca 0.39 -0.32 -0.06 0.00 2.80 0.00 0.00 57.97 60.78 3aeq h PHE 43 Cb 0.09 -0.02 -0.01 0.00 2.20 0.00 0.00 35.95 38.21 3aeq h PHE 43 CO -0.01 1.37 -0.28 1.79 -0.60 0.00 0.00 178.31 180.57 3aeq h THR 44 N -0.43 0.55 0.00 -1.55 1.35 -1.50 -0.36 112.91 110.97 3aeq h THR 44 Ca -0.19 -1.50 0.00 0.00 -0.55 0.00 0.00 66.41 64.17 3aeq h THR 44 Cb 1.61 2.05 0.00 0.00 -1.73 0.00 0.00 68.15 70.08 3aeq h THR 44 CO 0.09 0.28 -0.57 0.23 -0.25 0.00 0.00 175.52 175.30 3aeq n MET 45 N -3.26 0.41 0.15 4.72 2.81 0.18 -3.64 117.12 118.48 3aeq n MET 45 Ca 0.02 0.38 -0.07 0.00 -1.81 0.00 0.00 57.70 56.22 3aeq n MET 45 Cb 0.56 -1.46 -0.03 0.00 -0.71 0.00 0.00 33.22 31.57 3aeq n MET 45 CO 0.00 0.00 0.00 0.82 1.51 0.00 0.00 175.97 178.30 3aeq h ILE 46 N -0.85 0.00 0.00 2.02 2.04 -1.49 -3.13 117.51 116.10 3aeq h ILE 46 Ca 0.00 -0.65 -0.01 0.00 1.00 0.00 0.00 64.86 65.20 3aeq h ILE 46 Cb 0.57 0.00 -0.00 0.00 -0.74 0.00 0.00 36.82 36.65 3aeq h ILE 46 CO 0.00 0.00 -0.04 -0.08 0.00 0.00 0.00 178.15 178.03 3aeq h GLU 47 N -1.11 0.00 -4.83 2.37 4.81 -1.59 -3.44 114.58 110.79 3aeq h GLU 47 Ca -0.05 0.00 -0.23 0.00 -0.13 0.00 0.00 59.36 58.95 3aeq h GLU 47 Cb 0.36 0.00 0.14 0.00 0.63 0.00 0.00 28.75 29.88 3aeq h GLU 47 CO 0.08 0.04 -0.62 -2.13 -0.73 0.00 0.00 179.01 175.66 3aeq n ARG 48 N -3.16 -3.82 -2.59 1.92 0.63 -0.18 -4.98 116.66 104.49 3aeq n ARG 48 Ca 0.01 0.66 -0.32 0.00 -0.92 0.00 0.00 57.85 57.28 3aeq n ARG 48 Cb 0.34 -4.98 -0.04 0.00 0.45 0.00 0.00 32.46 28.23 3aeq n ARG 48 CO 0.00 0.00 0.00 1.03 -2.51 0.00 0.00 177.63 176.15 3aeq s ARG 49 N -4.67 3.93 0.00 -0.14 0.52 -1.00 -4.96 118.95 112.63 3aeq s ARG 49 Ca 0.13 0.83 0.20 0.00 -0.52 0.00 0.00 55.73 56.36 3aeq s ARG 49 Cb -0.02 -2.22 0.93 0.00 0.52 0.00 0.00 34.95 34.16 3aeq s ARG 49 CO 0.56 -0.17 1.63 0.27 0.02 0.00 0.00 175.30 177.61 3aeq n ASN 50 N -1.36 0.83 -3.58 0.23 6.94 -1.26 -4.78 115.26 112.27 3aeq n ASN 50 Ca 0.05 -1.56 -0.11 0.00 -0.02 0.00 0.00 54.58 52.94 3aeq n ASN 50 Cb 0.54 -0.05 -0.04 0.00 -2.36 0.00 0.00 39.78 37.87 3aeq n ASN 50 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 3aeq s ALA 51 N -1.90 -1.13 0.14 -2.53 0.00 -1.26 -5.14 121.76 109.95 3aeq s ALA 51 Ca 0.30 0.17 -0.34 0.00 0.00 0.00 0.00 51.96 52.09 3aeq s ALA 51 Cb 0.15 0.67 -0.16 0.00 0.00 0.00 0.00 23.12 23.78 3aeq s ALA 51 CO 0.24 -0.64 1.30 0.54 0.00 0.00 0.00 175.76 177.19 3aeq n ARG 52 N -0.12 1.34 -1.44 0.00 1.74 -1.26 -4.87 116.66 112.04 3aeq n ARG 52 Ca -0.17 0.48 -0.41 0.00 -0.77 0.00 0.00 57.85 56.98 3aeq n ARG 52 Cb 0.63 -2.07 0.01 0.00 -1.02 0.00 0.00 32.46 30.01 3aeq n ARG 52 CO 0.00 0.00 0.00 -2.30 -1.52 0.00 0.00 177.63 173.81 3aeq n PRO 53 N 2.24 0.52 -1.38 5.56 -0.02 -1.26 -4.84 135.00 135.83 3aeq n PRO 53 Ca 0.16 0.19 -0.29 0.00 -2.02 0.00 0.00 63.50 61.54 3aeq n PRO 53 Cb 0.23 -1.51 -0.07 0.00 -0.02 0.00 0.00 33.50 32.13 3aeq n PRO 53 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 3aeq n PRO 54 N 0.54 3.16 -4.63 0.52 -0.04 -1.26 -4.83 135.00 128.45 3aeq n PRO 54 Ca 0.11 -2.10 -0.24 0.00 -0.04 0.00 0.00 63.50 61.23 3aeq n PRO 54 Cb 0.42 -2.42 -0.16 0.00 -0.04 0.00 0.00 33.50 31.29 3aeq n PRO 54 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 3aeq s VAL 55 N 0.47 1.17 0.02 0.52 1.01 -1.26 -1.42 120.40 120.91 3aeq s VAL 55 Ca 0.64 -0.53 0.01 0.00 0.00 0.00 0.00 61.98 62.11 3aeq s VAL 55 Cb 0.26 -1.05 -0.01 0.00 0.00 0.00 0.00 36.38 35.57 3aeq s VAL 55 CO -0.07 0.36 -0.05 -0.94 0.00 0.00 0.00 175.10 174.39 3aeq s SER 56 N 0.44 0.51 0.04 3.32 1.04 -0.70 -5.01 113.70 113.35 3aeq s SER 56 Ca -0.11 -0.31 0.06 0.00 0.48 0.00 0.00 55.95 56.07 3aeq s SER 56 Cb -0.14 0.01 -0.03 0.00 0.10 0.00 0.00 66.02 65.96 3aeq s SER 56 CO 0.03 -0.11 -0.13 -0.36 0.98 0.00 0.00 173.24 173.65 3aeq s PHE 57 N -0.80 2.70 0.35 5.02 0.40 -1.26 0.22 117.98 124.61 3aeq s PHE 57 Ca -0.06 -0.17 0.06 0.00 -0.60 0.00 0.00 56.93 56.17 3aeq s PHE 57 Cb -0.06 -1.50 0.66 0.00 0.51 0.00 0.00 43.02 42.63 3aeq s PHE 57 CO -0.00 0.33 1.88 0.66 0.70 0.00 0.00 175.22 178.79 3aeq h SER 58 N 4.33 0.38 -5.10 1.36 4.64 -1.56 -3.47 113.55 114.13 3aeq h SER 58 Ca -0.48 -0.08 -0.16 0.00 -0.47 0.00 0.00 61.79 60.61 3aeq h SER 58 Cb 1.16 -0.10 0.12 0.00 -0.31 0.00 0.00 62.40 63.28 3aeq h SER 58 CO 0.50 0.50 -0.54 0.41 -0.87 0.00 0.00 176.83 176.84 3aeq n THR 59 N -4.27 -8.36 -3.14 2.95 -1.04 -0.53 -4.80 114.28 95.10 3aeq n THR 59 Ca 0.00 -0.91 -0.34 0.00 -2.04 0.00 0.00 64.05 60.77 3aeq n THR 59 Cb 0.26 -6.19 -0.06 0.00 -1.82 0.00 0.00 70.33 62.52 3aeq n THR 59 CO 0.00 0.00 0.00 0.72 -0.64 0.00 0.00 175.07 175.15 3aeq s PHE 60 N -3.24 3.46 0.32 -1.42 -0.71 -1.06 -4.68 117.98 110.64 3aeq s PHE 60 Ca 0.29 1.26 0.05 0.00 -1.04 0.00 0.00 56.93 57.48 3aeq s PHE 60 Cb -0.04 -2.55 -0.03 0.00 -1.21 0.00 0.00 43.02 39.19 3aeq s PHE 60 CO 0.64 0.18 0.21 -1.83 -1.34 0.00 0.00 175.22 173.08 3aeq s GLU 61 N -2.66 1.67 0.23 1.99 1.03 -1.26 -3.32 118.70 116.38 3aeq s GLU 61 Ca 0.50 -1.97 -0.13 0.00 0.03 0.00 0.00 54.97 53.41 3aeq s GLU 61 Cb -0.12 0.08 0.28 0.00 -0.80 0.00 0.00 34.13 33.57 3aeq s GLU 61 CO 0.19 -0.54 1.61 0.00 -1.33 0.00 0.00 175.26 175.18 3aeq h ALA 62 N 2.17 0.44 0.00 -0.84 0.00 -2.01 0.20 119.26 119.22 3aeq h ALA 62 Ca -0.30 0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.89 3aeq h ALA 62 Cb 1.24 0.57 0.00 0.00 0.00 0.00 0.00 17.79 19.61 3aeq h ALA 62 CO 0.45 -0.43 0.00 -1.13 0.00 0.00 0.00 179.25 178.14 3aeq n SER 63 N -5.48 0.00 -2.94 0.00 3.41 -1.26 -3.60 113.62 103.74 3aeq n SER 63 Ca 0.09 -0.51 -0.18 0.00 -0.26 0.00 0.00 58.87 58.02 3aeq n SER 63 Cb 0.37 -0.08 -0.01 0.00 -0.26 0.00 0.00 64.21 64.23 3aeq n SER 63 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 3aeq n HIS 64 N -1.08 1.40 -1.96 7.33 8.25 0.69 -5.09 115.22 124.76 3aeq n HIS 64 Ca 0.15 -3.52 0.00 0.00 -0.26 0.00 0.00 57.72 54.09 3aeq n HIS 64 Cb 0.10 -0.39 0.00 0.00 1.12 0.00 0.00 29.99 30.82 3aeq n HIS 64 CO 0.00 0.00 0.00 -1.33 0.64 0.00 0.00 176.34 175.65 3aeq n MET 65 N 0.03 3.07 0.00 -0.41 2.81 -1.20 -4.12 117.12 117.30 3aeq n MET 65 Ca 0.23 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 56.12 3aeq n MET 65 Cb 0.65 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 33.16 3aeq n MET 65 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3aeq n GLY 66 N 5.00 2.90 0.40 3.03 0.00 -1.26 -2.81 105.19 112.45 3aeq n GLY 66 Ca 0.00 -0.23 0.14 0.00 0.00 0.00 0.00 46.02 45.93 3aeq n GLY 66 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3aeq n THR 67 N 0.00 0.01 0.06 2.61 -2.24 -1.26 -3.75 114.28 109.71 3aeq n THR 67 Ca 0.00 -0.21 -0.07 0.00 -2.27 0.00 0.00 64.05 61.50 3aeq n THR 67 Cb 0.00 0.33 -0.12 0.00 -2.10 0.00 0.00 70.33 68.44 3aeq n THR 67 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 3aeq h ASP 68 N 1.95 0.00 -0.04 3.42 3.45 -1.79 -3.11 116.42 120.29 3aeq h ASP 68 Ca 0.00 0.00 0.03 0.00 0.43 0.00 0.00 57.03 57.49 3aeq h ASP 68 Cb 0.41 0.00 -0.04 0.00 -0.56 0.00 0.00 39.33 39.14 3aeq h ASP 68 CO 0.00 0.99 -0.21 0.71 -1.57 0.00 0.00 179.24 179.16 3aeq h THR 69 N 0.00 0.50 -0.49 0.35 1.35 -1.71 0.53 112.91 113.44 3aeq h THR 69 Ca -0.03 0.00 0.09 0.00 -0.55 0.00 0.00 66.41 65.92 3aeq h THR 69 Cb 1.77 0.50 -0.10 0.00 -1.73 0.00 0.00 68.15 68.60 3aeq h THR 69 CO 0.12 0.00 -0.36 0.00 -0.25 0.00 0.00 175.52 175.03 3aeq h ALA 70 N 0.61 -0.20 -0.46 6.62 0.00 -1.77 -1.39 119.26 122.67 3aeq h ALA 70 Ca 0.07 0.12 0.02 0.00 0.00 0.00 0.00 54.91 55.12 3aeq h ALA 70 Cb 0.41 0.80 -0.03 0.00 0.00 0.00 0.00 17.79 18.97 3aeq h ALA 70 CO -0.22 -0.75 0.28 0.82 0.00 0.00 0.00 179.25 179.38 3aeq h ILE 71 N -0.23 1.06 -0.92 0.00 1.08 -1.35 -3.13 117.51 114.02 3aeq h ILE 71 Ca 0.19 -0.19 0.02 0.00 -0.39 0.00 0.00 64.86 64.49 3aeq h ILE 71 Cb 0.56 0.45 -0.05 0.00 -3.07 0.00 0.00 36.82 34.70 3aeq h ILE 71 CO -0.62 0.10 0.60 -0.07 -0.69 0.00 0.00 178.15 177.47 3aeq h LEU 72 N 0.56 1.01 -0.11 1.44 3.38 0.11 -1.11 115.31 120.59 3aeq h LEU 72 Ca 0.18 -0.02 0.02 0.00 0.09 0.00 0.00 57.88 58.15 3aeq h LEU 72 Cb 0.00 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.50 3aeq h LEU 72 CO -0.08 0.71 0.01 0.25 0.09 0.00 0.00 178.44 179.42 3aeq h LEU 73 N 1.19 -0.03 -0.69 1.67 5.85 -1.32 -1.60 115.31 120.38 3aeq h LEU 73 Ca 0.35 0.02 0.15 0.00 0.84 0.00 0.00 57.88 59.25 3aeq h LEU 73 Cb -0.06 0.04 -0.12 0.00 0.37 0.00 0.00 40.66 40.89 3aeq h LEU 73 CO -0.10 0.00 0.03 0.50 -0.34 0.00 0.00 178.44 178.53 3aeq h LYS 74 N 0.05 0.13 -0.43 1.25 3.64 -1.18 -0.03 116.57 120.00 3aeq h LYS 74 Ca 0.05 -0.01 -0.14 0.00 -1.27 0.00 0.00 60.65 59.28 3aeq h LYS 74 Cb 0.05 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 31.84 3aeq h LYS 74 CO -0.08 0.08 -0.29 -0.44 -2.27 0.00 0.00 179.45 176.46 3aeq h ASP 75 N 0.13 0.99 0.06 4.20 3.45 -0.96 0.35 116.42 124.65 3aeq h ASP 75 Ca 0.37 -0.43 -0.10 0.00 0.43 0.00 0.00 57.03 57.30 3aeq h ASP 75 Cb 0.63 -0.28 -0.01 0.00 -0.56 0.00 0.00 39.33 39.11 3aeq h ASP 75 CO -0.58 1.21 -0.34 0.00 -1.57 0.00 0.00 179.24 177.96 3aeq h ALA 76 N 0.82 1.07 -0.08 3.45 0.00 -0.55 -0.54 119.26 123.42 3aeq h ALA 76 Ca 0.09 -0.38 -0.01 0.00 0.00 0.00 0.00 54.91 54.60 3aeq h ALA 76 Cb 0.87 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.56 3aeq h ALA 76 CO 0.08 0.58 0.01 -0.07 0.00 0.00 0.00 179.25 179.85 3aeq h LEU 77 N 0.34 0.14 0.26 0.00 3.38 -0.74 -2.64 115.31 116.05 3aeq h LEU 77 Ca 0.04 -0.27 -0.01 0.00 0.09 0.00 0.00 57.88 57.73 3aeq h LEU 77 Cb 0.76 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 41.47 3aeq h LEU 77 CO 0.06 0.38 -0.20 0.00 0.09 0.00 0.00 178.44 178.77 3aeq h ALA 78 N 0.77 -0.99 -1.05 1.53 0.00 -0.82 -3.03 119.26 115.67 3aeq h ALA 78 Ca 0.03 -0.09 0.28 0.00 0.00 0.00 0.00 54.91 55.13 3aeq h ALA 78 Cb 0.30 0.37 -0.11 0.00 0.00 0.00 0.00 17.79 18.34 3aeq h ALA 78 CO 0.00 -0.98 0.65 0.00 0.00 0.00 0.00 179.25 178.92 3aeq h ALA 79 N -1.53 2.09 -0.34 0.00 0.00 -1.16 0.31 119.26 118.64 3aeq h ALA 79 Ca -0.03 0.10 -0.05 0.00 0.00 0.00 0.00 54.91 54.93 3aeq h ALA 79 Cb 0.36 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 3aeq h ALA 79 CO 0.01 -0.57 -0.00 0.00 0.00 0.00 0.00 179.25 178.69 3aeq h ALA 80 N 1.69 0.45 -0.20 0.00 0.00 -1.51 0.77 119.26 120.46 3aeq h ALA 80 Ca 0.65 -0.24 -0.08 0.00 0.00 0.00 0.00 54.91 55.24 3aeq h ALA 80 Cb 1.53 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 19.20 3aeq h ALA 80 CO -0.41 0.21 -0.17 1.25 0.00 0.00 0.00 179.25 180.13 3aeq h HIS 81 N 0.40 0.56 -0.01 0.00 6.17 -0.37 -1.91 115.15 119.99 3aeq h HIS 81 Ca 0.10 -0.16 0.03 0.00 0.71 0.00 0.00 60.37 61.04 3aeq h HIS 81 Cb 0.45 -0.12 -0.04 0.00 2.52 0.00 0.00 27.41 30.22 3aeq h HIS 81 CO 0.04 0.81 -0.20 0.00 0.71 0.00 0.00 177.93 179.29 3aeq h ALA 82 N 0.66 -0.24 -0.01 5.26 0.00 -0.86 -0.70 119.26 123.37 3aeq h ALA 82 Ca 0.04 0.01 -0.23 0.00 0.00 0.00 0.00 54.91 54.72 3aeq h ALA 82 Cb 0.70 0.35 0.02 0.00 0.00 0.00 0.00 17.79 18.86 3aeq h ALA 82 CO 0.04 -0.69 -0.91 -0.09 0.00 0.00 0.00 179.25 177.61 3aeq h ARG 83 N -0.31 0.63 -0.38 0.00 2.43 -0.90 -3.35 114.38 112.49 3aeq h ARG 83 Ca 0.06 -0.66 0.00 0.00 -0.81 0.00 0.00 59.98 58.57 3aeq h ARG 83 Cb 0.39 0.19 0.00 0.00 -0.42 0.00 0.00 29.97 30.13 3aeq h ARG 83 CO -0.19 1.26 0.00 0.66 -1.51 0.00 0.00 179.97 180.19 3aeq n TYR 84 N -3.97 0.50 -3.50 2.20 4.02 -0.72 -5.01 117.16 110.69 3aeq n TYR 84 Ca -0.11 -0.48 -0.03 0.00 -0.01 0.00 0.00 57.90 57.27 3aeq n TYR 84 Cb 0.82 -0.02 0.00 0.00 -0.02 0.00 0.00 39.34 40.12 3aeq n TYR 84 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 176.86 177.48 3aeq n LYS 85 N 0.64 -0.80 -2.61 -0.72 4.76 -0.27 -4.81 118.16 114.34 3aeq n LYS 85 Ca 0.13 -0.36 -0.29 0.00 -2.87 0.00 0.00 58.31 54.91 3aeq n LYS 85 Cb 0.44 0.50 -0.01 0.00 -1.84 0.00 0.00 35.03 34.12 3aeq n LYS 85 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 3aeq s PRO 86 N -4.53 3.68 0.35 1.97 0.04 -1.26 -4.98 135.00 130.27 3aeq s PRO 86 Ca 0.03 0.44 0.10 0.00 0.04 0.00 0.00 61.00 61.61 3aeq s PRO 86 Cb -0.02 -2.33 0.67 0.00 0.04 0.00 0.00 34.50 32.86 3aeq s PRO 86 CO 0.07 -0.19 1.82 1.96 0.04 0.00 0.00 177.00 180.71 3aeq h GLN 87 N 0.64 0.14 -3.03 4.56 4.20 -1.66 -3.46 115.11 116.50 3aeq h GLN 87 Ca -0.47 -0.05 0.06 0.00 0.06 0.00 0.00 58.65 58.26 3aeq h GLN 87 Cb 1.19 -0.01 -0.05 0.00 0.30 0.00 0.00 27.48 28.91 3aeq h GLN 87 CO 0.63 0.44 0.21 0.00 -0.67 0.00 0.00 178.83 179.44 3aeq s ALA 88 N -4.34 -1.16 0.03 3.87 0.00 -1.23 -4.51 121.76 114.43 3aeq s ALA 88 Ca -0.04 -0.35 -0.03 0.00 0.00 0.00 0.00 51.96 51.55 3aeq s ALA 88 Cb 0.14 0.86 -0.02 0.00 0.00 0.00 0.00 23.12 24.10 3aeq s ALA 88 CO 0.74 -1.03 0.02 -1.64 0.00 0.00 0.00 175.76 173.86 3aeq s MET 89 N -3.89 0.51 0.00 0.00 -1.94 -0.66 -2.71 119.30 110.61 3aeq s MET 89 Ca 0.12 -0.82 0.07 0.00 -1.71 0.00 0.00 55.69 53.34 3aeq s MET 89 Cb -0.06 0.19 -0.02 0.00 2.01 0.00 0.00 34.83 36.95 3aeq s MET 89 CO 0.07 -0.11 -0.21 0.00 -0.01 0.00 0.00 175.02 174.77 3aeq s ALA 90 N -2.57 1.76 -0.03 3.03 0.00 0.41 -0.72 121.76 123.64 3aeq s ALA 90 Ca -0.05 -0.96 0.06 0.00 0.00 0.00 0.00 51.96 51.00 3aeq s ALA 90 Cb -0.02 -0.41 -0.01 0.00 0.00 0.00 0.00 23.12 22.68 3aeq s ALA 90 CO -0.05 0.42 -0.20 0.54 0.00 0.00 0.00 175.76 176.47 3aeq s VAL 91 N -0.59 1.65 0.28 0.00 0.11 -0.36 -0.81 120.40 120.67 3aeq s VAL 91 Ca 0.08 -0.86 -0.11 0.00 -2.93 0.00 0.00 61.98 58.15 3aeq s VAL 91 Cb -0.08 -1.39 0.00 0.00 -1.53 0.00 0.00 36.38 33.38 3aeq s VAL 91 CO 0.00 0.47 0.50 0.00 -3.33 0.00 0.00 175.10 172.74 3aeq s ALA 92 N -0.26 -0.11 -0.16 1.54 0.00 -0.93 -1.54 121.76 120.30 3aeq s ALA 92 Ca 0.02 -0.98 -0.05 0.00 0.00 0.00 0.00 51.96 50.95 3aeq s ALA 92 Cb -0.10 1.05 -0.04 0.00 0.00 0.00 0.00 23.12 24.04 3aeq s ALA 92 CO 0.01 -0.86 0.02 -0.51 0.00 0.00 0.00 175.76 174.42 3aeq s LEU 93 N -3.06 3.59 0.77 0.00 1.43 -1.26 -1.35 118.68 118.80 3aeq s LEU 93 Ca 0.23 0.02 -0.11 0.00 -1.03 0.00 0.00 54.13 53.24 3aeq s LEU 93 Cb -0.01 -1.88 0.05 0.00 0.03 0.00 0.00 46.19 44.38 3aeq s LEU 93 CO 0.11 0.20 1.08 -0.89 0.23 0.00 0.00 176.35 177.08 3aeq s THR 94 N 0.22 3.43 0.29 5.49 2.01 -0.26 -4.77 115.64 122.05 3aeq s THR 94 Ca 0.01 0.47 0.02 0.00 0.31 0.00 0.00 61.69 62.50 3aeq s THR 94 Cb -0.13 -3.03 0.29 0.00 0.01 0.00 0.00 72.50 69.64 3aeq s THR 94 CO 0.01 -0.61 1.84 0.00 -0.69 0.00 0.00 174.62 175.17 3aeq h THR 96 N 0.99 0.83 -0.14 0.00 2.02 -1.93 -3.13 112.91 111.54 3aeq h THR 96 Ca 0.50 -0.26 0.04 0.00 0.77 0.00 0.00 66.41 67.46 3aeq h THR 96 Cb 0.49 0.98 -0.01 0.00 -1.74 0.00 0.00 68.15 67.88 3aeq h THR 96 CO -0.26 0.06 0.22 0.00 0.37 0.00 0.00 175.52 175.90 3aeq h ALA 97 N 0.33 1.64 0.00 6.16 0.00 -1.52 -0.94 119.26 124.93 3aeq h ALA 97 Ca -0.03 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.87 3aeq h ALA 97 Cb 0.32 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.12 3aeq h ALA 97 CO 0.05 -0.29 0.00 0.39 0.00 0.00 0.00 179.25 179.40 3aeq n GLU 98 N -3.55 0.21 -0.31 0.00 1.02 -0.42 -2.11 120.64 115.48 3aeq n GLU 98 Ca 0.01 0.14 0.10 0.00 -0.02 0.00 0.00 57.16 57.39 3aeq n GLU 98 Cb 0.32 -1.50 0.27 0.00 -0.02 0.00 0.00 31.44 30.51 3aeq n GLU 98 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 3aeq n LEU 99 N -1.32 3.65 -4.82 -4.62 4.77 -0.36 -4.97 117.00 109.33 3aeq n LEU 99 Ca 0.08 -1.94 -0.22 0.00 -0.03 0.00 0.00 56.01 53.90 3aeq n LEU 99 Cb 0.15 -0.40 -0.04 0.00 -2.33 0.00 0.00 43.42 40.79 3aeq n LEU 99 CO 0.13 0.90 -0.17 -0.76 -1.33 0.00 0.00 177.39 176.17 3aeq s LEU 100 N -1.04 3.81 0.42 2.23 1.02 -0.90 -5.03 118.68 119.18 3aeq s LEU 100 Ca 0.42 -0.26 0.19 0.00 0.02 0.00 0.00 54.13 54.50 3aeq s LEU 100 Cb 0.22 -2.34 0.94 0.00 0.02 0.00 0.00 46.19 45.03 3aeq s LEU 100 CO 0.29 -0.04 1.88 1.56 0.02 0.00 0.00 176.35 180.06 3aeq h GLN 101 N 1.49 0.00 -6.50 1.70 7.50 -1.93 -3.47 115.11 113.90 3aeq h GLN 101 Ca -0.48 0.00 -0.56 0.00 0.50 0.00 0.00 58.65 58.11 3aeq h GLN 101 Cb 1.24 0.00 0.05 0.00 0.05 0.00 0.00 27.48 28.82 3aeq h GLN 101 CO 0.61 0.29 0.99 -0.25 -1.50 0.00 0.00 178.83 178.96 3aeq n ASP 102 N -3.82 3.63 -4.58 1.46 10.43 -1.26 -4.95 116.55 117.45 3aeq n ASP 102 Ca -0.01 1.03 -0.42 0.00 2.57 0.00 0.00 54.79 57.95 3aeq n ASP 102 Cb 0.37 -1.48 -0.05 0.00 1.84 0.00 0.00 41.12 41.80 3aeq n ASP 102 CO 0.00 0.00 0.00 -0.62 -1.07 0.00 0.00 177.20 175.51 3aeq s ASP 103 N 2.07 6.54 0.14 -2.24 3.68 -1.26 -4.97 116.67 120.63 3aeq s ASP 103 Ca 0.81 0.32 -0.17 0.00 2.13 0.00 0.00 52.55 55.64 3aeq s ASP 103 Cb -0.58 -2.39 0.03 0.00 -1.45 0.00 0.00 42.92 38.52 3aeq s ASP 103 CO 0.39 -0.74 1.74 -0.65 0.13 0.00 0.00 175.17 176.04 3aeq h PRO 104 N 8.51 0.19 0.00 4.34 0.11 -1.98 -2.97 132.00 140.21 3aeq h PRO 104 Ca -0.25 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.85 3aeq h PRO 104 Cb 1.09 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.16 3aeq h PRO 104 CO 0.91 0.13 0.00 0.09 -0.21 0.00 0.00 178.00 178.92 3aeq n ASN 105 N -5.06 0.00 -0.45 -2.05 4.13 -1.26 -2.87 115.26 107.70 3aeq n ASN 105 Ca -0.00 0.63 0.36 0.00 1.68 0.00 0.00 54.58 57.25 3aeq n ASN 105 Cb 0.12 -0.13 0.59 0.00 -1.54 0.00 0.00 39.78 38.82 3aeq n ASN 105 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3aeq n GLY 106 N -0.67 -0.72 0.10 7.41 0.00 -1.24 -0.27 105.19 109.80 3aeq n GLY 106 Ca 0.00 0.60 -0.10 0.00 0.00 0.00 0.00 46.02 46.52 3aeq n GLY 106 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3aeq h ILE 107 N 0.00 0.94 -0.01 -0.61 2.04 -1.59 -2.92 117.51 115.35 3aeq h ILE 107 Ca 0.73 -1.41 0.00 0.00 1.00 0.00 0.00 64.86 65.19 3aeq h ILE 107 Cb 2.55 1.66 -0.00 0.00 -0.74 0.00 0.00 36.82 40.29 3aeq h ILE 107 CO -0.26 0.28 0.02 0.77 0.00 0.00 0.00 178.15 178.95 3aeq h SER 108 N -0.91 0.00 0.16 1.72 4.64 -0.49 -0.54 113.55 118.13 3aeq h SER 108 Ca -0.01 0.00 -0.29 0.00 -0.47 0.00 0.00 61.79 61.02 3aeq h SER 108 Cb 0.55 0.00 0.03 0.00 -0.31 0.00 0.00 62.40 62.67 3aeq h SER 108 CO 0.02 0.00 -1.24 0.03 -0.87 0.00 0.00 176.83 174.77 3aeq h ARG 109 N 0.00 0.55 0.00 4.77 3.08 -1.43 -3.17 114.38 118.19 3aeq h ARG 109 Ca 0.01 -0.81 0.00 0.00 0.07 0.00 0.00 59.98 59.25 3aeq h ARG 109 Cb 0.04 0.28 0.00 0.00 0.08 0.00 0.00 29.97 30.37 3aeq h ARG 109 CO -0.00 1.37 0.00 0.00 -1.07 0.00 0.00 179.97 180.27 3aeq n ALA 110 N -2.69 1.80 -0.03 0.04 0.00 -0.27 -1.25 120.51 118.11 3aeq n ALA 110 Ca -0.15 -0.06 -0.08 0.00 0.00 0.00 0.00 53.44 53.15 3aeq n ALA 110 Cb 0.99 -1.27 -0.14 0.00 0.00 0.00 0.00 19.45 19.03 3aeq n ALA 110 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3aeq n LEU 111 N -1.45 0.74 -3.42 0.00 4.32 -0.84 -5.03 117.00 111.31 3aeq n LEU 111 Ca 0.05 0.35 -0.13 0.00 -0.02 0.00 0.00 56.01 56.26 3aeq n LEU 111 Cb 0.18 0.21 0.00 0.00 -1.62 0.00 0.00 43.42 42.19 3aeq n LEU 111 CO 0.15 0.38 0.03 -3.20 -1.22 0.00 0.00 177.39 173.53 3aeq n ASN 112 N -2.98 -6.31 -4.82 -1.43 4.05 -0.38 -4.95 115.26 98.45 3aeq n ASN 112 Ca -0.18 -0.49 -0.34 0.00 0.45 0.00 0.00 54.58 54.02 3aeq n ASN 112 Cb 1.04 -3.44 -0.07 0.00 1.23 0.00 0.00 39.78 38.55 3aeq n ASN 112 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 177.26 173.45 3aeq s LEU 113 N -4.38 4.01 0.00 1.20 1.02 -1.26 -4.95 118.68 114.32 3aeq s LEU 113 Ca 0.02 1.68 0.00 0.00 0.02 0.00 0.00 54.13 55.85 3aeq s LEU 113 Cb -0.00 -4.42 0.00 0.00 0.02 0.00 0.00 46.19 41.78 3aeq s LEU 113 CO 0.83 -0.30 0.58 -0.81 0.02 0.00 0.00 176.35 176.67 3aeq n PRO 114 N -0.44 0.73 -4.11 1.29 -0.04 -1.26 -4.68 135.00 126.49 3aeq n PRO 114 Ca 0.06 0.00 -0.10 0.00 -0.04 0.00 0.00 63.50 63.42 3aeq n PRO 114 Cb 0.53 -1.14 -0.10 0.00 -0.04 0.00 0.00 33.50 32.75 3aeq n PRO 114 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 3aeq s VAL 115 N -1.61 0.51 0.29 0.52 -7.23 -1.26 -5.11 120.40 106.51 3aeq s VAL 115 Ca 0.00 -1.59 -0.30 0.00 -1.81 0.00 0.00 61.98 58.29 3aeq s VAL 115 Cb 0.00 -1.23 -0.13 0.00 0.56 0.00 0.00 36.38 35.58 3aeq s VAL 115 CO 0.00 -0.73 1.41 -0.81 -0.31 0.00 0.00 175.10 174.66 3aeq n PRO 116 N 0.54 2.22 -4.01 4.82 -0.04 -1.26 -4.89 135.00 132.38 3aeq n PRO 116 Ca -0.16 0.79 -0.31 0.00 -0.04 0.00 0.00 63.50 63.77 3aeq n PRO 116 Cb 0.59 -2.45 -0.16 0.00 -0.04 0.00 0.00 33.50 31.44 3aeq n PRO 116 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 3aeq s VAL 117 N -0.45 1.81 -0.34 0.52 1.01 -1.26 -1.65 120.40 120.04 3aeq s VAL 117 Ca 0.62 -1.26 -0.16 0.00 0.00 0.00 0.00 61.98 61.18 3aeq s VAL 117 Cb -0.58 -1.92 -0.01 0.00 0.00 0.00 0.00 36.38 33.86 3aeq s VAL 117 CO 0.54 0.06 0.42 -0.69 0.00 0.00 0.00 175.10 175.43 3aeq s VAL 118 N 1.30 5.11 0.36 2.92 1.01 0.10 -4.91 120.40 126.29 3aeq s VAL 118 Ca -0.04 0.17 -0.26 0.00 0.00 0.00 0.00 61.98 61.84 3aeq s VAL 118 Cb -0.18 -3.87 -0.09 0.00 0.00 0.00 0.00 36.38 32.24 3aeq s VAL 118 CO -0.07 -0.13 1.04 -2.16 0.00 0.00 0.00 175.10 173.78 3aeq s PRO 119 N 2.15 4.36 -0.10 2.72 0.04 -1.26 -1.23 135.00 141.69 3aeq s PRO 119 Ca 0.14 1.54 -0.01 0.00 0.04 0.00 0.00 61.00 62.72 3aeq s PRO 119 Cb -0.16 -2.75 0.03 0.00 0.04 0.00 0.00 34.50 31.66 3aeq s PRO 119 CO 0.12 0.03 -0.04 -0.51 0.04 0.00 0.00 177.00 176.64 3aeq s LEU 120 N -2.24 0.92 -0.17 -3.56 1.43 -0.59 -4.92 118.68 109.56 3aeq s LEU 120 Ca 0.53 -0.21 -0.29 0.00 -1.03 0.00 0.00 54.13 53.13 3aeq s LEU 120 Cb -0.24 -0.66 -0.01 0.00 0.03 0.00 0.00 46.19 45.31 3aeq s LEU 120 CO 0.30 -0.15 1.17 -0.70 0.23 0.00 0.00 176.35 177.20 3aeq s GLU 121 N 1.83 4.27 -0.43 1.70 2.56 -1.26 -4.33 118.70 123.03 3aeq s GLU 121 Ca 0.05 1.56 0.02 0.00 0.00 0.00 0.00 54.97 56.59 3aeq s GLU 121 Cb -0.12 -3.69 0.14 0.00 2.00 0.00 0.00 34.13 32.46 3aeq s GLU 121 CO -0.07 -0.63 0.26 -0.51 -0.56 0.00 0.00 175.26 173.75 3aeq s LEU 122 N 3.15 2.25 -0.50 2.70 1.43 -1.26 -4.98 118.68 121.47 3aeq s LEU 122 Ca 0.51 -2.63 -0.26 0.00 -1.03 0.00 0.00 54.13 50.72 3aeq s LEU 122 Cb -0.20 -0.85 -0.05 0.00 0.03 0.00 0.00 46.19 45.12 3aeq s LEU 122 CO 0.13 -0.26 2.18 -2.84 0.23 0.00 0.00 176.35 175.79 3aeq s PRO 123 N 0.40 2.42 0.26 1.29 0.02 -1.26 -4.82 135.00 133.31 3aeq s PRO 123 Ca 0.20 1.20 0.12 0.00 0.02 0.00 0.00 61.00 62.54 3aeq s PRO 123 Cb -0.20 -4.48 0.27 0.00 0.02 0.00 0.00 34.50 30.11 3aeq s PRO 123 CO -0.03 -2.93 1.55 1.03 -0.33 0.00 0.00 177.00 176.29 3aeq h SER 124 N 17.36 0.00 -0.23 2.53 0.87 -1.94 -0.38 113.55 131.76 3aeq h SER 124 Ca -0.27 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.29 3aeq h SER 124 Cb 1.23 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.19 3aeq h SER 124 CO 1.16 0.63 0.00 -1.22 -0.53 0.00 0.00 176.83 176.87 3aeq n TYR 125 N -3.57 0.29 0.00 2.24 4.01 -1.26 -4.22 117.16 114.65 3aeq n TYR 125 Ca -0.00 -0.14 0.00 0.00 -0.16 0.00 0.00 57.90 57.59 3aeq n TYR 125 Cb 0.68 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.71 3aeq n TYR 125 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27 3aeq n SER 126 N 0.81 2.32 -4.59 7.72 3.41 -1.20 -5.12 113.62 116.97 3aeq n SER 126 Ca 0.17 0.00 -0.27 0.00 -0.26 0.00 0.00 58.87 58.51 3aeq n SER 126 Cb 0.45 0.30 -0.11 0.00 -0.26 0.00 0.00 64.21 64.60 3aeq n SER 126 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 3aeq s ARG 127 N -1.30 1.90 0.01 4.33 1.81 -0.16 -5.11 118.95 120.44 3aeq s ARG 127 Ca 0.00 -2.02 0.00 0.00 -1.72 0.00 0.00 55.73 51.99 3aeq s ARG 127 Cb 0.00 -1.68 -0.00 0.00 -0.45 0.00 0.00 34.95 32.82 3aeq s ARG 127 CO 0.00 0.04 0.00 1.63 -0.68 0.00 0.00 175.30 176.29 3aeq n LYS 128 N -0.90 1.04 -0.30 3.54 5.02 -1.26 -4.20 118.16 121.10 3aeq n LYS 128 Ca -0.05 -0.10 0.13 0.00 -2.02 0.00 0.00 58.31 56.27 3aeq n LYS 128 Cb 0.65 0.05 0.30 0.00 -0.02 0.00 0.00 35.03 36.02 3aeq n LYS 128 CO 0.00 0.00 0.00 1.49 -0.52 0.00 0.00 177.40 178.37 3aeq h GLU 129 N 0.00 0.33 0.28 1.97 4.81 -1.21 -0.05 114.58 120.71 3aeq h GLU 129 Ca -0.01 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.19 3aeq h GLU 129 Cb 0.04 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 29.34 3aeq h GLU 129 CO 0.02 0.22 -0.14 -0.91 -0.73 0.00 0.00 179.01 177.47 3aeq h ASN 130 N 0.34 -0.32 -0.60 1.04 2.35 -1.89 -2.31 115.58 114.18 3aeq h ASN 130 Ca 0.56 -0.20 0.12 0.00 -0.55 0.00 0.00 56.30 56.22 3aeq h ASN 130 Cb 1.08 0.08 -0.09 0.00 0.05 0.00 0.00 38.32 39.44 3aeq h ASN 130 CO -0.56 0.14 0.06 0.22 -1.65 0.00 0.00 177.43 175.64 3aeq h TYR 131 N -0.92 0.07 -0.99 1.19 3.20 -1.72 0.27 116.97 118.07 3aeq h TYR 131 Ca -0.04 0.04 0.12 0.00 3.14 0.00 0.00 58.73 62.00 3aeq h TYR 131 Cb 0.51 0.06 -0.14 0.00 1.54 0.00 0.00 36.73 38.70 3aeq h TYR 131 CO 0.05 -0.11 -0.48 0.41 -1.64 0.00 0.00 178.16 176.39 3aeq n GLY 132 N -1.34 -2.29 0.30 1.82 0.00 -0.05 -1.07 105.19 102.56 3aeq n GLY 132 Ca 0.09 1.14 -0.12 0.00 0.00 0.00 0.00 46.02 47.13 3aeq n GLY 132 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3aeq h ALA 133 N 0.97 -0.70 -0.91 4.61 0.00 -0.40 -1.20 119.26 121.63 3aeq h ALA 133 Ca 0.26 -0.18 0.25 0.00 0.00 0.00 0.00 54.91 55.24 3aeq h ALA 133 Cb 0.51 0.27 -0.16 0.00 0.00 0.00 0.00 17.79 18.41 3aeq h ALA 133 CO -0.96 -0.68 0.09 0.22 0.00 0.00 0.00 179.25 177.92 3aeq h ASP 134 N -1.12 -0.30 -0.06 0.00 3.58 -0.40 -0.68 116.42 117.44 3aeq h ASP 134 Ca -0.07 0.24 -0.07 0.00 0.42 0.00 0.00 57.03 57.55 3aeq h ASP 134 Cb 0.58 0.39 0.00 0.00 1.72 0.00 0.00 39.33 42.03 3aeq h ASP 134 CO 0.12 -0.27 -0.25 -0.08 -2.88 0.00 0.00 179.24 175.87 3aeq h GLU 135 N 0.08 0.27 -0.99 0.28 4.57 -1.14 -2.12 114.58 115.53 3aeq h GLU 135 Ca 0.56 -0.22 0.13 0.00 -1.18 0.00 0.00 59.36 58.66 3aeq h GLU 135 Cb 1.13 0.04 -0.09 0.00 -0.16 0.00 0.00 28.75 29.68 3aeq h GLU 135 CO -0.80 0.86 0.63 1.15 -1.18 0.00 0.00 179.01 179.67 3aeq h THR 136 N -0.26 0.88 -0.32 0.32 2.02 -0.20 0.17 112.91 115.52 3aeq h THR 136 Ca -0.02 -0.32 -0.11 0.00 0.77 0.00 0.00 66.41 66.73 3aeq h THR 136 Cb 0.91 -0.14 -0.01 0.00 -1.74 0.00 0.00 68.15 67.17 3aeq h THR 136 CO 0.05 0.17 -0.24 0.15 0.37 0.00 0.00 175.52 176.02 3aeq h PHE 137 N 0.93 0.85 0.51 3.16 3.57 -1.22 -2.64 116.94 122.10 3aeq h PHE 137 Ca 0.51 -0.24 -0.02 0.00 3.53 0.00 0.00 57.97 61.75 3aeq h PHE 137 Cb 0.58 -0.19 -0.01 0.00 2.79 0.00 0.00 35.95 39.12 3aeq h PHE 137 CO -0.00 0.97 -0.38 -0.09 -2.23 0.00 0.00 178.31 176.58 3aeq h ARG 138 N 0.48 -0.83 -0.94 1.11 2.43 -0.27 0.72 114.38 117.08 3aeq h ARG 138 Ca 0.06 0.06 0.19 0.00 -0.81 0.00 0.00 59.98 59.47 3aeq h ARG 138 Cb 0.80 0.19 -0.18 0.00 -0.42 0.00 0.00 29.97 30.36 3aeq h ARG 138 CO 0.06 -0.55 -0.24 0.00 -1.51 0.00 0.00 179.97 177.73 3aeq h ALA 139 N -1.25 0.60 0.12 2.80 0.00 -0.84 0.48 119.26 121.18 3aeq h ALA 139 Ca -0.07 0.36 0.00 0.00 0.00 0.00 0.00 54.91 55.21 3aeq h ALA 139 Cb 0.71 0.72 -0.01 0.00 0.00 0.00 0.00 17.79 19.22 3aeq h ALA 139 CO 0.02 -0.40 -0.10 -0.07 0.00 0.00 0.00 179.25 178.71 3aeq h LEU 140 N -0.00 -0.25 -0.20 0.00 4.07 -1.08 0.80 115.31 118.66 3aeq h LEU 140 Ca 0.45 0.02 0.03 0.00 0.08 0.00 0.00 57.88 58.46 3aeq h LEU 140 Cb 0.68 0.08 -0.03 0.00 1.08 0.00 0.00 40.66 42.48 3aeq h LEU 140 CO -0.97 -0.15 0.01 0.58 -1.08 0.00 0.00 178.44 176.83 3aeq h VAL 141 N -0.23 0.88 -0.01 1.22 2.07 0.75 -0.61 116.25 120.32 3aeq h VAL 141 Ca -0.00 -0.03 0.00 0.00 0.82 0.00 0.00 66.70 67.49 3aeq h VAL 141 Cb 0.21 0.79 -0.00 0.00 -1.52 0.00 0.00 31.29 30.76 3aeq h VAL 141 CO -0.01 0.02 0.01 -0.09 0.02 0.00 0.00 177.57 177.52 3aeq h ARG 142 N 0.08 0.00 0.03 1.57 2.43 0.17 -0.04 114.38 118.62 3aeq h ARG 142 Ca 0.09 0.00 -0.31 0.00 -0.81 0.00 0.00 59.98 58.95 3aeq h ARG 142 Cb 0.11 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 29.61 3aeq h ARG 142 CO -0.14 0.00 -1.82 0.00 -1.51 0.00 0.00 179.97 176.49 3aeq n ALA 143 N -2.31 1.36 -0.03 2.80 0.00 0.25 -4.71 120.51 117.87 3aeq n ALA 143 Ca -0.03 -0.76 -0.02 0.00 0.00 0.00 0.00 53.44 52.63 3aeq n ALA 143 Cb 0.10 -0.76 -0.05 0.00 0.00 0.00 0.00 19.45 18.73 3aeq n ALA 143 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3aeq n LEU 144 N -3.13 0.00 -4.76 0.00 4.77 -0.28 -5.01 117.00 108.59 3aeq n LEU 144 Ca -0.22 0.00 -0.40 0.00 -0.03 0.00 0.00 56.01 55.37 3aeq n LEU 144 Cb 1.06 0.13 -0.06 0.00 -2.33 0.00 0.00 43.42 42.22 3aeq n LEU 144 CO 0.44 0.13 0.60 0.00 -1.33 0.00 0.00 177.39 177.24 3aeq s ALA 145 N -2.21 3.36 0.15 -1.18 0.00 -0.07 -4.10 121.76 117.72 3aeq s ALA 145 Ca -0.03 0.54 0.06 0.00 0.00 0.00 0.00 51.96 52.53 3aeq s ALA 145 Cb 0.02 -3.14 -0.04 0.00 0.00 0.00 0.00 23.12 19.96 3aeq s ALA 145 CO 0.27 0.22 -0.12 0.14 0.00 0.00 0.00 175.76 176.26 3aeq s VAL 146 N -1.09 1.33 0.33 0.00 -7.23 -1.26 -4.89 120.40 107.59 3aeq s VAL 146 Ca 0.40 -1.94 -0.29 0.00 -1.81 0.00 0.00 61.98 58.34 3aeq s VAL 146 Cb -0.25 -1.74 -0.12 0.00 0.56 0.00 0.00 36.38 34.83 3aeq s VAL 146 CO 0.30 -0.58 1.40 -2.65 -0.31 0.00 0.00 175.10 173.26 3aeq n PRO 147 N 0.09 2.32 -3.96 4.82 -0.02 -1.26 -4.10 135.00 132.89 3aeq n PRO 147 Ca -0.12 0.82 -0.08 0.00 -2.02 0.00 0.00 63.50 62.09 3aeq n PRO 147 Cb 0.59 -2.48 -0.09 0.00 -0.02 0.00 0.00 33.50 31.50 3aeq n PRO 147 CO 0.00 0.00 0.00 -1.64 1.98 0.00 0.00 175.50 175.84 3aeq s MET 148 N -1.48 0.66 0.38 -0.52 -1.94 -1.26 -5.01 119.30 110.13 3aeq s MET 148 Ca 0.58 -0.94 -0.26 0.00 -1.71 0.00 0.00 55.69 53.36 3aeq s MET 148 Cb -0.55 0.25 -0.09 0.00 2.01 0.00 0.00 34.83 36.45 3aeq s MET 148 CO 0.58 -0.17 1.23 -2.00 -0.01 0.00 0.00 175.02 174.66 3aeq s GLU 149 N -3.30 4.10 0.88 2.03 2.12 -1.26 -4.63 118.70 118.64 3aeq s GLU 149 Ca 0.01 2.00 -0.11 0.00 0.36 0.00 0.00 54.97 57.23 3aeq s GLU 149 Cb 0.03 -2.79 0.12 0.00 0.26 0.00 0.00 34.13 31.75 3aeq s GLU 149 CO -0.08 -0.33 1.09 1.03 -0.54 0.00 0.00 175.26 176.44 3aeq s ARG 150 N -2.15 1.39 0.37 4.30 3.00 -1.26 -4.56 118.95 120.04 3aeq s ARG 150 Ca 0.55 1.01 -0.24 0.00 0.00 0.00 0.00 55.73 57.05 3aeq s ARG 150 Cb -0.35 -1.81 -0.10 0.00 0.00 0.00 0.00 34.95 32.69 3aeq s ARG 150 CO 0.44 -2.20 0.96 0.95 0.00 0.00 0.00 175.30 175.45 3aeq s THR 151 N -2.87 4.20 0.32 0.02 -4.23 -1.00 -4.97 115.64 107.12 3aeq s THR 151 Ca 0.63 1.64 0.16 0.00 -1.18 0.00 0.00 61.69 62.94 3aeq s THR 151 Cb -0.19 -3.82 0.12 0.00 1.34 0.00 0.00 72.50 69.95 3aeq s THR 151 CO 0.57 -0.04 1.82 -0.65 -0.54 0.00 0.00 174.62 175.78 3aeq h PRO 152 N 2.64 0.00 -6.34 3.99 0.11 -1.96 -3.41 132.00 127.02 3aeq h PRO 152 Ca -0.48 0.00 -0.56 0.00 0.11 0.00 0.00 66.00 65.08 3aeq h PRO 152 Cb 1.19 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.26 3aeq h PRO 152 CO 0.63 0.36 0.05 -1.21 -0.21 0.00 0.00 178.00 177.62 3aeq s GLU 153 N -3.99 4.34 -0.14 1.05 0.41 -1.26 -5.03 118.70 114.07 3aeq s GLU 153 Ca -0.02 0.89 -0.29 0.00 -0.41 0.00 0.00 54.97 55.14 3aeq s GLU 153 Cb 0.13 -3.24 -0.04 0.00 -1.78 0.00 0.00 34.13 29.20 3aeq s GLU 153 CO 0.70 0.61 1.72 0.08 -0.49 0.00 0.00 175.26 177.88 3aeq s VAL 154 N -1.13 3.53 0.06 2.63 1.01 -1.26 -4.94 120.40 120.31 3aeq s VAL 154 Ca 0.32 0.62 0.00 0.00 0.00 0.00 0.00 61.98 62.92 3aeq s VAL 154 Cb -0.21 -3.49 -0.04 0.00 0.00 0.00 0.00 36.38 32.64 3aeq s VAL 154 CO 0.22 -0.16 -0.05 0.42 0.00 0.00 0.00 175.10 175.53 3aeq s THR 155 N 5.03 0.40 0.17 3.92 -4.23 -1.26 -2.68 115.64 117.00 3aeq s THR 155 Ca 0.76 -1.73 -0.03 0.00 -1.18 0.00 0.00 61.69 59.52 3aeq s THR 155 Cb -0.30 -1.41 -0.03 0.00 1.34 0.00 0.00 72.50 72.10 3aeq s THR 155 CO 0.31 -0.87 0.14 0.00 -0.54 0.00 0.00 174.62 173.66 3aeq s ASN 157 N -3.07 5.64 -0.31 0.00 0.02 -0.80 -0.11 114.94 116.32 3aeq s ASN 157 Ca 0.28 0.16 -0.10 0.00 -1.02 0.00 0.00 52.86 52.19 3aeq s ASN 157 Cb 0.06 -1.63 -0.02 0.00 0.02 0.00 0.00 41.25 39.69 3aeq s ASN 157 CO 0.06 0.30 0.16 -0.76 0.02 0.00 0.00 177.10 176.88 3aeq s LEU 158 N -1.56 4.10 -0.11 0.60 1.43 -0.90 -0.19 118.68 122.05 3aeq s LEU 158 Ca 0.21 -0.41 0.02 0.00 -1.03 0.00 0.00 54.13 52.92 3aeq s LEU 158 Cb -0.12 -2.03 -0.01 0.00 0.03 0.00 0.00 46.19 44.06 3aeq s LEU 158 CO 0.11 -0.17 -0.20 -0.76 0.23 0.00 0.00 176.35 175.57 3aeq s LEU 159 N 1.65 2.33 0.00 1.79 1.02 -0.51 -0.67 118.68 124.29 3aeq s LEU 159 Ca 0.05 -0.47 0.00 0.00 0.02 0.00 0.00 54.13 53.73 3aeq s LEU 159 Cb -0.17 -1.49 0.00 0.00 0.02 0.00 0.00 46.19 44.55 3aeq s LEU 159 CO 0.07 0.16 0.00 0.61 0.02 0.00 0.00 176.35 177.21 3aeq n GLY 160 N 3.53 2.14 3.63 -3.19 0.00 -0.88 -1.10 105.19 109.32 3aeq n GLY 160 Ca -0.19 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.41 3aeq n GLY 160 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3aeq s ALA 161 N -2.11 3.29 0.40 4.61 0.00 -1.24 -4.74 121.76 121.97 3aeq s ALA 161 Ca 0.00 0.69 0.05 0.00 0.00 0.00 0.00 51.96 52.70 3aeq s ALA 161 Cb 0.00 -3.86 -0.06 0.00 0.00 0.00 0.00 23.12 19.19 3aeq s ALA 161 CO 0.00 -1.93 0.03 0.95 0.00 0.00 0.00 175.76 174.81 3aeq s THR 162 N 5.33 1.56 0.63 0.00 -4.23 -1.26 -0.19 115.64 117.48 3aeq s THR 162 Ca 0.78 -2.00 -0.17 0.00 -1.18 0.00 0.00 61.69 59.12 3aeq s THR 162 Cb -0.29 -2.79 -0.01 0.00 1.34 0.00 0.00 72.50 70.74 3aeq s THR 162 CO 0.32 0.00 1.16 0.00 -0.54 0.00 0.00 174.62 175.56 3aeq s ALA 163 N -2.94 2.46 -1.97 3.99 0.00 -1.09 -3.57 121.76 118.64 3aeq s ALA 163 Ca 0.31 0.81 0.00 0.00 0.00 0.00 0.00 51.96 53.08 3aeq s ALA 163 Cb 0.08 -3.40 0.00 0.00 0.00 0.00 0.00 23.12 19.80 3aeq s ALA 163 CO 0.15 -1.27 0.00 -0.11 0.00 0.00 0.00 175.76 174.53 3aeq n LEU 164 N -2.02 -1.67 -4.88 0.00 -0.00 -1.26 -4.79 117.00 102.38 3aeq n LEU 164 Ca 0.12 0.27 -0.35 0.00 -0.00 0.00 0.00 56.01 56.06 3aeq n LEU 164 Cb 0.51 -2.83 -0.05 0.00 -0.00 0.00 0.00 43.42 41.05 3aeq n LEU 164 CO 0.46 -0.69 -0.06 -0.83 -0.00 0.00 0.00 177.39 176.27 3aeq s GLY 165 N -2.48 2.25 -0.14 -3.96 0.00 -1.23 -5.03 107.32 96.73 3aeq s GLY 165 Ca 0.00 -0.57 -0.29 0.00 0.00 0.00 0.00 44.72 43.86 3aeq s GLY 165 CO 0.00 -0.37 1.74 -0.12 0.00 0.00 0.00 173.10 174.35 3aeq s PHE 166 N -1.28 1.86 -1.02 1.90 5.36 -1.26 -2.91 117.98 120.63 3aeq s PHE 166 Ca 0.27 0.33 -0.04 0.00 -0.96 0.00 0.00 56.93 56.52 3aeq s PHE 166 Cb -0.13 -3.99 0.04 0.00 -0.34 0.00 0.00 43.02 38.59 3aeq s PHE 166 CO 0.15 -3.64 0.22 0.54 -1.46 0.00 0.00 175.22 171.04 3aeq n ARG 167 N 7.62 -2.81 -0.17 10.12 5.12 -1.26 -4.87 116.66 130.41 3aeq n ARG 167 Ca 0.20 0.46 -0.10 0.00 -1.93 0.00 0.00 57.85 56.47 3aeq n ARG 167 Cb 0.44 -5.09 0.00 0.00 -1.16 0.00 0.00 32.46 26.65 3aeq n ARG 167 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 3aeq h HIS 168 N -0.44 1.04 -0.14 -1.55 3.86 -1.86 -2.49 115.15 113.57 3aeq h HIS 168 Ca -0.32 -0.21 0.05 0.00 -1.16 0.00 0.00 60.37 58.73 3aeq h HIS 168 Cb 1.22 -0.26 -0.06 0.00 1.06 0.00 0.00 27.41 29.37 3aeq h HIS 168 CO 0.71 0.99 -0.23 -0.09 0.86 0.00 0.00 177.93 180.18 3aeq h ARG 169 N 0.79 -0.27 0.00 2.45 2.43 -1.89 -1.43 114.38 116.45 3aeq h ARG 169 Ca 0.13 0.02 -0.25 0.00 -0.81 0.00 0.00 59.98 59.07 3aeq h ARG 169 Cb 0.63 0.06 -0.04 0.00 -0.42 0.00 0.00 29.97 30.20 3aeq h ARG 169 CO 0.04 -0.18 -1.31 -0.44 -1.51 0.00 0.00 179.97 176.57 3aeq h ASP 170 N -0.28 0.01 0.48 -3.80 3.32 -1.90 -2.89 116.42 111.34 3aeq h ASP 170 Ca 0.10 -0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.13 3aeq h ASP 170 Cb 0.44 -0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.98 3aeq h ASP 170 CO -0.31 1.01 -0.36 0.44 -1.72 0.00 0.00 179.24 178.30 3aeq h ASP 171 N 0.00 -0.93 -1.03 6.45 3.32 -1.32 0.53 116.42 123.43 3aeq h ASP 171 Ca -0.13 0.07 0.28 0.00 0.02 0.00 0.00 57.03 57.27 3aeq h ASP 171 Cb 1.88 0.29 -0.06 0.00 0.22 0.00 0.00 39.33 41.66 3aeq h ASP 171 CO 0.11 -0.53 0.71 0.58 -1.72 0.00 0.00 179.24 178.39 3aeq h VAL 172 N -0.82 0.51 0.01 -1.35 2.07 -1.28 0.22 116.25 115.62 3aeq h VAL 172 Ca -0.05 -0.06 -0.21 0.00 0.82 0.00 0.00 66.70 67.20 3aeq h VAL 172 Cb 0.70 0.31 0.02 0.00 -1.52 0.00 0.00 31.29 30.79 3aeq h VAL 172 CO 0.01 0.03 -0.81 0.00 0.02 0.00 0.00 177.57 176.82 3aeq h ALA 173 N 1.54 0.08 -0.08 1.67 0.00 -1.16 -2.99 119.26 118.32 3aeq h ALA 173 Ca 0.53 -0.63 -0.22 0.00 0.00 0.00 0.00 54.91 54.59 3aeq h ALA 173 Cb 1.74 0.05 0.01 0.00 0.00 0.00 0.00 17.79 19.59 3aeq h ALA 173 CO -0.13 0.50 -0.84 1.49 0.00 0.00 0.00 179.25 180.26 3aeq h GLU 174 N 0.10 0.63 -0.74 0.00 4.57 0.83 -2.06 114.58 117.91 3aeq h GLU 174 Ca -0.10 -0.57 -0.06 0.00 -1.18 0.00 0.00 59.36 57.44 3aeq h GLU 174 Cb 1.50 0.13 -0.03 0.00 -0.16 0.00 0.00 28.75 30.20 3aeq h GLU 174 CO 0.16 1.18 0.21 0.28 -1.18 0.00 0.00 179.01 179.66 3aeq h VAL 175 N 0.41 1.26 -0.16 0.32 2.07 -0.78 -1.80 116.25 117.57 3aeq h VAL 175 Ca -0.07 -0.94 0.05 0.00 0.82 0.00 0.00 66.70 66.56 3aeq h VAL 175 Cb 1.47 0.47 -0.05 0.00 -1.52 0.00 0.00 31.29 31.65 3aeq h VAL 175 CO 0.16 0.37 -0.15 0.74 0.02 0.00 0.00 177.57 178.71 3aeq h THR 176 N 1.11 0.58 -0.86 2.57 2.02 -1.39 -1.96 112.91 114.98 3aeq h THR 176 Ca 0.24 0.00 0.14 0.00 0.77 0.00 0.00 66.41 67.56 3aeq h THR 176 Cb 0.34 0.58 -0.09 0.00 -1.74 0.00 0.00 68.15 67.24 3aeq h THR 176 CO -0.00 0.00 0.45 0.11 0.37 0.00 0.00 175.52 176.45 3aeq h LYS 177 N -0.17 0.63 -0.59 6.66 1.57 -1.06 0.25 116.57 123.85 3aeq h LYS 177 Ca 0.11 -0.04 0.02 0.00 -1.87 0.00 0.00 60.65 58.87 3aeq h LYS 177 Cb 0.33 -0.14 -0.04 0.00 0.08 0.00 0.00 32.23 32.46 3aeq h LYS 177 CO -0.27 0.42 0.37 -0.07 -0.57 0.00 0.00 179.45 179.33 3aeq h LEU 178 N 0.65 0.61 -0.06 2.94 3.38 -0.73 -2.09 115.31 120.01 3aeq h LEU 178 Ca 0.46 -0.00 -0.15 0.00 0.09 0.00 0.00 57.88 58.28 3aeq h LEU 178 Cb 0.64 -0.13 0.01 0.00 0.09 0.00 0.00 40.66 41.27 3aeq h LEU 178 CO -0.35 0.43 -0.56 -0.07 0.09 0.00 0.00 178.44 177.98 3aeq h LEU 179 N 0.73 0.60 -1.13 1.67 3.38 -0.59 -2.95 115.31 117.02 3aeq h LEU 179 Ca 0.23 -0.69 0.15 0.00 0.09 0.00 0.00 57.88 57.66 3aeq h LEU 179 Cb -0.01 -0.18 -0.08 0.00 0.09 0.00 0.00 40.66 40.48 3aeq h LEU 179 CO -0.09 1.20 0.61 0.00 0.09 0.00 0.00 178.44 180.25 3aeq h ALA 180 N 0.42 1.70 0.00 1.53 0.00 -0.74 0.31 119.26 122.47 3aeq h ALA 180 Ca -0.05 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.89 3aeq h ALA 180 Cb 1.23 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.88 3aeq h ALA 180 CO 0.11 0.02 0.00 1.15 0.00 0.00 0.00 179.25 180.54 3aeq h THR 181 N 0.81 0.00 -0.45 0.00 2.02 -1.27 -1.04 112.91 112.99 3aeq h THR 181 Ca 0.50 -0.25 0.00 0.00 0.77 0.00 0.00 66.41 67.43 3aeq h THR 181 Cb 0.70 1.22 0.00 0.00 -1.74 0.00 0.00 68.15 68.33 3aeq h THR 181 CO -0.27 0.00 0.00 0.23 0.37 0.00 0.00 175.52 175.85 3aeq n MET 182 N -3.03 2.49 -2.57 6.66 2.00 0.90 -4.62 117.12 118.95 3aeq n MET 182 Ca -0.01 -2.24 -0.10 0.00 0.00 0.00 0.00 57.70 55.35 3aeq n MET 182 Cb 0.18 -1.44 0.01 0.00 0.00 0.00 0.00 33.22 31.98 3aeq n MET 182 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 3aeq n GLY 183 N 1.21 0.11 3.36 3.03 0.00 -0.39 -4.93 105.19 107.57 3aeq n GLY 183 Ca 0.18 -0.37 -0.31 0.00 0.00 0.00 0.00 46.02 45.51 3aeq n GLY 183 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3aeq s ILE 184 N -2.80 2.30 0.07 -0.61 1.01 -0.19 -4.78 121.20 116.21 3aeq s ILE 184 Ca 0.13 -1.14 0.08 0.00 0.00 0.00 0.00 60.65 59.72 3aeq s ILE 184 Cb -0.06 -1.86 -0.03 0.00 0.01 0.00 0.00 42.46 40.52 3aeq s ILE 184 CO 0.16 0.49 -0.21 -0.54 0.00 0.00 0.00 174.94 174.84 3aeq s LYS 185 N -0.90 1.87 -0.22 2.79 1.02 -1.09 -2.63 119.74 120.58 3aeq s LYS 185 Ca 0.11 -1.10 -0.29 0.00 0.02 0.00 0.00 55.97 54.71 3aeq s LYS 185 Cb -0.10 -2.09 -0.02 0.00 -0.52 0.00 0.00 37.83 35.09 3aeq s LYS 185 CO 0.01 0.51 1.57 0.08 -0.92 0.00 0.00 175.35 176.60 3aeq s VAL 186 N -0.96 3.76 0.00 3.17 1.01 -1.26 -1.33 120.40 124.79 3aeq s VAL 186 Ca 0.15 0.86 -0.07 0.00 0.00 0.00 0.00 61.98 62.92 3aeq s VAL 186 Cb -0.10 -3.75 -0.04 0.00 0.00 0.00 0.00 36.38 32.48 3aeq s VAL 186 CO 0.06 -0.29 0.78 -1.13 0.00 0.00 0.00 175.10 174.52 3aeq h ASN 187 N 10.40 -0.22 -3.57 3.32 -1.24 -0.85 -3.47 115.58 119.95 3aeq h ASN 187 Ca -0.33 0.01 -0.28 0.00 0.71 0.00 0.00 56.30 56.41 3aeq h ASN 187 Cb 1.15 0.06 -0.32 0.00 0.73 0.00 0.00 38.32 39.93 3aeq h ASN 187 CO 1.00 -0.11 -0.72 -0.69 -1.29 0.00 0.00 177.43 175.62 3aeq s VAL 188 N -2.97 -0.04 -0.31 2.57 1.01 -1.25 -5.05 120.40 114.36 3aeq s VAL 188 Ca -0.04 0.16 -0.14 0.00 0.00 0.00 0.00 61.98 61.96 3aeq s VAL 188 Cb 0.00 -0.07 -0.03 0.00 0.00 0.00 0.00 36.38 36.28 3aeq s VAL 188 CO 0.12 0.06 0.29 0.00 0.00 0.00 0.00 175.10 175.58 3aeq s ALA 190 N 1.91 0.85 0.04 0.00 0.00 0.15 -3.23 121.76 121.48 3aeq s ALA 190 Ca 0.10 -0.86 -0.30 0.00 0.00 0.00 0.00 51.96 50.90 3aeq s ALA 190 Cb -0.16 -0.03 -0.18 0.00 0.00 0.00 0.00 23.12 22.75 3aeq s ALA 190 CO 0.11 0.07 1.43 -1.35 0.00 0.00 0.00 175.76 176.02 3aeq h PRO 191 N 4.46 -0.81 -3.18 0.00 0.11 -1.77 -2.35 132.00 128.46 3aeq h PRO 191 Ca -0.38 0.06 -0.44 0.00 0.11 0.00 0.00 66.00 65.35 3aeq h PRO 191 Cb 1.20 0.18 -0.01 0.00 0.11 0.00 0.00 31.00 32.48 3aeq h PRO 191 CO 0.41 -0.50 0.51 -0.11 -0.21 0.00 0.00 178.00 178.09 3aeq n LEU 192 N -5.40 0.54 0.00 2.35 7.94 0.73 -0.53 117.00 122.63 3aeq n LEU 192 Ca -0.13 0.52 0.00 0.00 -1.11 0.00 0.00 56.01 55.29 3aeq n LEU 192 Cb 0.36 -0.47 0.00 0.00 0.53 0.00 0.00 43.42 43.84 3aeq n LEU 192 CO 0.35 -0.43 0.00 0.61 -1.11 0.00 0.00 177.39 176.81 3aeq n GLY 193 N 2.91 2.78 3.81 -3.96 0.00 -0.81 -4.71 105.19 105.21 3aeq n GLY 193 Ca 0.22 -0.16 -0.33 0.00 0.00 0.00 0.00 46.02 45.75 3aeq n GLY 193 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3aeq s ALA 194 N -1.81 2.84 0.31 4.61 0.00 0.32 -4.55 121.76 123.48 3aeq s ALA 194 Ca 0.00 0.44 0.09 0.00 0.00 0.00 0.00 51.96 52.49 3aeq s ALA 194 Cb 0.00 -3.22 -0.04 0.00 0.00 0.00 0.00 23.12 19.86 3aeq s ALA 194 CO 0.00 -0.52 0.07 -1.54 0.00 0.00 0.00 175.76 173.77 3aeq s SER 195 N -2.53 4.57 0.41 0.00 1.04 -1.26 -1.70 113.70 114.24 3aeq s SER 195 Ca 0.64 -0.75 0.21 0.00 0.48 0.00 0.00 55.95 56.53 3aeq s SER 195 Cb -0.15 -0.76 1.17 0.00 0.10 0.00 0.00 66.02 66.38 3aeq s SER 195 CO 0.29 -0.17 1.76 -0.65 0.98 0.00 0.00 173.24 175.45 3aeq h PRO 196 N 1.71 0.33 -0.34 4.02 0.11 -1.81 0.17 132.00 136.18 3aeq h PRO 196 Ca -0.44 -0.02 -0.12 0.00 0.11 0.00 0.00 66.00 65.53 3aeq h PRO 196 Cb 1.25 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 32.28 3aeq h PRO 196 CO 0.63 0.22 -0.27 -0.44 -0.21 0.00 0.00 178.00 177.92 3aeq h ASP 197 N 0.33 0.82 -0.80 -2.05 5.19 -1.94 -2.51 116.42 115.47 3aeq h ASP 197 Ca 0.61 -0.45 0.11 0.00 -0.62 0.00 0.00 57.03 56.68 3aeq h ASP 197 Cb 1.65 -0.23 -0.08 0.00 0.18 0.00 0.00 39.33 40.85 3aeq h ASP 197 CO -0.28 1.10 0.43 0.44 -3.12 0.00 0.00 179.24 177.81 3aeq h ASP 198 N 0.56 0.58 -0.37 6.45 3.45 -1.09 -1.73 116.42 124.28 3aeq h ASP 198 Ca 0.06 0.06 -0.02 0.00 0.43 0.00 0.00 57.03 57.56 3aeq h ASP 198 Cb 0.84 -0.04 -0.02 0.00 -0.56 0.00 0.00 39.33 39.54 3aeq h ASP 198 CO 0.07 0.32 0.16 -0.07 -1.57 0.00 0.00 179.24 178.15 3aeq h LEU 199 N 0.70 0.53 -2.36 1.55 4.07 -1.09 -1.86 115.31 116.85 3aeq h LEU 199 Ca 0.40 -0.06 -0.01 0.00 0.08 0.00 0.00 57.88 58.30 3aeq h LEU 199 Cb 0.43 -0.14 -0.00 0.00 1.08 0.00 0.00 40.66 42.03 3aeq h LEU 199 CO -0.28 0.49 -0.03 0.03 -1.08 0.00 0.00 178.44 177.57 3aeq h ARG 200 N 0.59 0.00 0.00 1.13 3.08 -0.86 -2.80 114.38 115.51 3aeq h ARG 200 Ca 0.14 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.19 3aeq h ARG 200 Cb 0.13 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.18 3aeq h ARG 200 CO -0.01 0.03 -0.58 0.87 -1.07 0.00 0.00 179.97 179.21 3aeq h LYS 201 N 0.00 0.00 -1.23 0.04 1.79 -1.25 -3.36 116.57 112.56 3aeq h LYS 201 Ca -0.00 0.00 0.45 0.00 -2.18 0.00 0.00 60.65 58.92 3aeq h LYS 201 Cb 0.09 0.00 -0.15 0.00 -1.58 0.00 0.00 32.23 30.58 3aeq h LYS 201 CO 0.00 0.00 0.75 -0.07 -1.08 0.00 0.00 179.45 179.05 3aeq h LEU 202 N 0.00 0.26 0.00 2.94 3.38 -1.50 -2.42 115.31 117.97 3aeq h LEU 202 Ca 0.00 0.20 0.00 0.00 0.09 0.00 0.00 57.88 58.17 3aeq h LEU 202 Cb 0.92 0.20 0.00 0.00 0.09 0.00 0.00 40.66 41.87 3aeq h LEU 202 CO 0.00 -0.32 0.00 0.61 0.09 0.00 0.00 178.44 178.82 3aeq n GLY 203 N -1.42 -0.68 0.08 0.83 0.00 -1.26 -2.67 105.19 100.07 3aeq n GLY 203 Ca 0.39 -0.03 0.11 0.00 0.00 0.00 0.00 46.02 46.49 3aeq n GLY 203 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3aeq n GLN 204 N -1.42 0.60 -2.01 1.61 10.64 -0.91 -4.04 117.38 121.85 3aeq n GLN 204 Ca 0.03 0.01 -0.38 0.00 -1.83 0.00 0.00 57.00 54.82 3aeq n GLN 204 Cb 0.08 -1.72 0.01 0.00 -0.86 0.00 0.00 30.24 27.75 3aeq n GLN 204 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 3aeq s ALA 205 N -3.40 3.03 0.11 2.61 0.00 -1.09 -2.37 121.76 120.65 3aeq s ALA 205 Ca -0.03 1.19 -0.14 0.00 0.00 0.00 0.00 51.96 52.99 3aeq s ALA 205 Cb 0.11 -3.49 -0.09 0.00 0.00 0.00 0.00 23.12 19.65 3aeq s ALA 205 CO 0.83 -0.98 1.40 0.45 0.00 0.00 0.00 175.76 177.47 3aeq h HIS 206 N 2.06 0.95 -2.70 0.00 3.86 -0.60 -3.48 115.15 115.25 3aeq h HIS 206 Ca -0.50 -0.31 -0.10 0.00 -1.16 0.00 0.00 60.37 58.30 3aeq h HIS 206 Cb 1.27 -0.19 -0.02 0.00 1.06 0.00 0.00 27.41 29.52 3aeq h HIS 206 CO 0.51 1.10 -0.06 1.97 0.86 0.00 0.00 177.93 182.30 3aeq n PHE 207 N -4.16 -0.69 -4.27 2.45 1.16 -1.22 -4.53 117.46 106.21 3aeq n PHE 207 Ca -0.04 -0.79 -0.19 0.00 -1.87 0.00 0.00 57.45 54.56 3aeq n PHE 207 Cb 0.54 0.17 -0.13 0.00 -1.61 0.00 0.00 39.48 38.45 3aeq n PHE 207 CO 0.00 0.00 0.00 -0.80 -1.87 0.00 0.00 176.76 174.09 3aeq s ASN 208 N -1.71 1.58 -0.39 5.98 0.01 -0.55 -1.91 114.94 117.95 3aeq s ASN 208 Ca 0.10 -0.50 -0.12 0.00 -0.71 0.00 0.00 52.86 51.63 3aeq s ASN 208 Cb -0.00 -0.08 0.03 0.00 0.41 0.00 0.00 41.25 41.61 3aeq s ASN 208 CO 0.07 -0.02 0.24 -0.69 -1.51 0.00 0.00 177.10 175.19 3aeq s VAL 209 N -1.00 4.71 -0.77 1.60 1.01 0.73 -1.33 120.40 125.35 3aeq s VAL 209 Ca -0.00 -0.87 -0.26 0.00 0.00 0.00 0.00 61.98 60.85 3aeq s VAL 209 Cb -0.08 -3.65 0.04 0.00 0.00 0.00 0.00 36.38 32.68 3aeq s VAL 209 CO 0.01 -0.28 1.26 -0.22 0.00 0.00 0.00 175.10 175.87 3aeq s LEU 210 N 1.57 3.39 0.09 3.92 0.20 -1.25 -1.42 118.68 125.17 3aeq s LEU 210 Ca 0.03 -0.68 -0.09 0.00 0.69 0.00 0.00 54.13 54.07 3aeq s LEU 210 Cb -0.20 -2.54 -0.21 0.00 -0.43 0.00 0.00 46.19 42.81 3aeq s LEU 210 CO 0.07 -1.73 1.19 0.24 -0.29 0.00 0.00 176.35 175.83 3aeq h MET 211 N 9.92 0.50 -2.47 1.98 2.86 -1.46 -3.43 114.93 122.83 3aeq h MET 211 Ca -0.21 -0.63 -0.40 0.00 -2.06 0.00 0.00 59.70 56.40 3aeq h MET 211 Cb 1.05 0.20 -0.36 0.00 0.06 0.00 0.00 31.60 32.54 3aeq h MET 211 CO 1.29 1.25 -0.69 0.71 1.06 0.00 0.00 176.91 180.53 3aeq s TYR 212 N -3.06 -0.13 0.21 -0.22 1.51 -1.23 -4.92 117.35 109.51 3aeq s TYR 212 Ca -0.07 -0.38 -0.14 0.00 -1.01 0.00 0.00 57.07 55.47 3aeq s TYR 212 Cb 0.07 -0.61 0.23 0.00 -0.11 0.00 0.00 41.96 41.53 3aeq s TYR 212 CO 0.90 -0.83 1.62 -1.35 -1.11 0.00 0.00 175.55 174.79 3aeq h PRO 213 N 8.33 -0.01 -0.06 -1.71 0.11 -1.90 -1.92 132.00 134.83 3aeq h PRO 213 Ca -0.16 0.00 0.02 0.00 0.11 0.00 0.00 66.00 65.97 3aeq h PRO 213 Cb 1.07 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.18 3aeq h PRO 213 CO 0.36 -0.01 0.19 1.05 -0.21 0.00 0.00 178.00 179.38 3aeq h GLU 214 N -0.01 0.00 0.00 1.05 9.09 -1.97 -1.11 114.58 121.63 3aeq h GLU 214 Ca 0.30 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.71 3aeq h GLU 214 Cb 0.47 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.57 3aeq h GLU 214 CO -0.65 0.00 0.00 0.25 0.05 0.00 0.00 179.01 178.66 3aeq n THR 215 N -3.24 0.69 -0.03 -1.06 -2.24 -0.99 -4.21 114.28 103.19 3aeq n THR 215 Ca -0.01 -0.75 0.00 0.00 -2.27 0.00 0.00 64.05 61.02 3aeq n THR 215 Cb 0.27 0.69 0.00 0.00 -2.10 0.00 0.00 70.33 69.18 3aeq n THR 215 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3aeq n GLY 216 N -0.34 0.14 0.31 3.38 0.00 -0.76 -4.21 105.19 103.70 3aeq n GLY 216 Ca 0.00 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.15 3aeq n GLY 216 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3aeq h GLU 217 N 0.00 0.20 -0.15 1.61 4.57 -1.40 -0.03 114.58 119.38 3aeq h GLU 217 Ca 0.00 -0.01 -0.01 0.00 -1.18 0.00 0.00 59.36 58.16 3aeq h GLU 217 Cb 0.00 -0.05 -0.01 0.00 -0.16 0.00 0.00 28.75 28.54 3aeq h GLU 217 CO 0.00 0.13 0.07 0.77 -1.18 0.00 0.00 179.01 178.80 3aeq h SER 218 N 0.21 0.19 0.19 1.04 0.02 -1.84 -1.87 113.55 111.49 3aeq h SER 218 Ca 0.56 -0.13 -0.12 0.00 -0.84 0.00 0.00 61.79 61.26 3aeq h SER 218 Cb 1.12 -0.05 -0.01 0.00 0.14 0.00 0.00 62.40 63.60 3aeq h SER 218 CO -0.66 0.27 -0.44 0.00 -1.14 0.00 0.00 176.83 174.86 3aeq h ALA 219 N 0.93 1.01 -0.19 3.77 0.00 -1.46 -0.68 119.26 122.64 3aeq h ALA 219 Ca 0.05 -0.44 -0.00 0.00 0.00 0.00 0.00 54.91 54.52 3aeq h ALA 219 Cb 0.12 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 3aeq h ALA 219 CO -0.01 0.62 0.11 0.00 0.00 0.00 0.00 179.25 179.98 3aeq h ALA 220 N 1.28 0.24 -0.34 0.00 0.00 -0.99 -1.04 119.26 118.42 3aeq h ALA 220 Ca 0.02 -0.05 0.03 0.00 0.00 0.00 0.00 54.91 54.91 3aeq h ALA 220 Cb 0.88 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.56 3aeq h ALA 220 CO 0.07 -0.23 0.13 0.00 0.00 0.00 0.00 179.25 179.22 3aeq h ARG 221 N 0.21 0.27 -0.54 0.00 3.08 -1.07 -1.88 114.38 114.45 3aeq h ARG 221 Ca 0.07 -0.02 0.01 0.00 0.07 0.00 0.00 59.98 60.11 3aeq h ARG 221 Cb 0.06 -0.06 -0.03 0.00 0.08 0.00 0.00 29.97 30.02 3aeq h ARG 221 CO -0.01 0.18 0.35 1.25 -1.07 0.00 0.00 179.97 180.67 3aeq h HIS 222 N 0.28 0.67 0.00 3.04 2.76 -0.95 -1.04 115.15 119.92 3aeq h HIS 222 Ca 0.15 0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.34 3aeq h HIS 222 Cb 0.11 -0.22 0.00 0.00 1.55 0.00 0.00 27.41 28.84 3aeq h HIS 222 CO -0.13 0.41 0.00 1.28 -1.30 0.00 0.00 177.93 178.19 3aeq n LEU 223 N -4.72 0.33 -0.07 0.26 4.77 -0.41 -0.04 117.00 117.11 3aeq n LEU 223 Ca 0.03 0.59 -0.17 0.00 -0.03 0.00 0.00 56.01 56.43 3aeq n LEU 223 Cb 0.03 -0.55 -0.13 0.00 -2.33 0.00 0.00 43.42 40.45 3aeq n LEU 223 CO 0.35 -0.44 0.02 -0.08 -1.33 0.00 0.00 177.39 175.91 3aeq h GLU 224 N 0.00 0.03 0.11 3.23 4.81 -0.40 -2.48 114.58 119.87 3aeq h GLU 224 Ca 0.00 -0.04 0.02 0.00 -0.13 0.00 0.00 59.36 59.20 3aeq h GLU 224 Cb 0.28 0.02 -0.05 0.00 0.63 0.00 0.00 28.75 29.62 3aeq h GLU 224 CO 0.00 1.02 -0.51 0.00 -0.73 0.00 0.00 179.01 178.79 3aeq h ARG 225 N -0.94 -0.70 -0.02 1.92 3.08 -0.86 -3.00 114.38 113.86 3aeq h ARG 225 Ca -0.14 0.05 -0.04 0.00 0.07 0.00 0.00 59.98 59.91 3aeq h ARG 225 Cb 1.17 0.16 0.00 0.00 0.08 0.00 0.00 29.97 31.38 3aeq h ARG 225 CO -0.06 -0.47 -0.15 0.00 -1.07 0.00 0.00 179.97 178.22 3aeq h ALA 226 N -0.44 0.05 -0.37 0.04 0.00 -0.63 -3.38 119.26 114.54 3aeq h ALA 226 Ca 0.00 -0.39 -0.28 0.00 0.00 0.00 0.00 54.91 54.24 3aeq h ALA 226 Cb 0.74 -0.00 -0.32 0.00 0.00 0.00 0.00 17.79 18.22 3aeq h ALA 226 CO -0.29 -0.00 -0.86 0.00 0.00 0.00 0.00 179.25 178.10 3aeq n LYS 228 N -0.57 -1.45 -3.12 0.00 4.01 -1.13 -4.88 118.16 111.02 3aeq n LYS 228 Ca 0.22 0.98 -0.43 0.00 -0.51 0.00 0.00 58.31 58.57 3aeq n LYS 228 Cb 0.89 -5.29 -0.07 0.00 -0.51 0.00 0.00 35.03 30.06 3aeq n LYS 228 CO 0.00 0.00 0.00 -0.65 -1.11 0.00 0.00 177.40 175.64 3aeq s GLN 229 N -3.31 3.24 0.78 1.97 -0.21 -0.96 -4.99 119.66 116.18 3aeq s GLN 229 Ca 0.00 -0.48 -0.11 0.00 0.02 0.00 0.00 55.36 54.79 3aeq s GLN 229 Cb 0.00 -3.98 0.06 0.00 1.00 0.00 0.00 33.01 30.09 3aeq s GLN 229 CO 0.00 -1.05 1.09 -1.25 -2.12 0.00 0.00 175.29 171.95 3aeq s PRO 230 N 2.78 2.22 0.11 2.91 0.04 -1.26 -3.64 135.00 138.16 3aeq s PRO 230 Ca 0.21 1.07 0.05 0.00 0.04 0.00 0.00 61.00 62.37 3aeq s PRO 230 Cb -0.15 -1.90 -0.04 0.00 0.04 0.00 0.00 34.50 32.45 3aeq s PRO 230 CO 0.17 -1.64 -0.12 -0.59 0.04 0.00 0.00 177.00 174.87 3aeq s PHE 231 N -2.94 1.23 0.09 0.56 -0.12 -1.26 -1.48 117.98 114.06 3aeq s PHE 231 Ca 0.61 -0.60 -0.31 0.00 -0.05 0.00 0.00 56.93 56.58 3aeq s PHE 231 Cb -0.17 -0.66 -0.07 0.00 -0.63 0.00 0.00 43.02 41.50 3aeq s PHE 231 CO 0.56 0.07 1.27 0.95 -0.05 0.00 0.00 175.22 178.03 3aeq s THR 232 N -2.24 3.71 -1.21 -4.49 -4.23 -0.44 -4.92 115.64 101.82 3aeq s THR 232 Ca 0.07 1.24 0.18 0.00 -1.18 0.00 0.00 61.69 62.00 3aeq s THR 232 Cb -0.04 -3.79 0.63 0.00 1.34 0.00 0.00 72.50 70.63 3aeq s THR 232 CO 0.02 0.10 1.54 0.29 -0.54 0.00 0.00 174.62 176.03 3aeq n LYS 233 N 3.84 3.32 -3.95 3.99 4.76 -1.26 -3.93 118.16 124.93 3aeq n LYS 233 Ca 0.10 -2.71 -0.24 0.00 -2.87 0.00 0.00 58.31 52.59 3aeq n LYS 233 Cb 0.45 -1.72 -0.17 0.00 -1.84 0.00 0.00 35.03 31.75 3aeq n LYS 233 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 3aeq s ILE 234 N -1.60 0.66 -0.24 -0.18 1.01 -1.26 -5.12 121.20 114.46 3aeq s ILE 234 Ca 0.46 -0.09 -0.23 0.00 0.00 0.00 0.00 60.65 60.78 3aeq s ILE 234 Cb 0.28 -0.73 -0.01 0.00 0.01 0.00 0.00 42.46 42.01 3aeq s ILE 234 CO 0.24 0.29 0.76 -0.69 0.00 0.00 0.00 174.94 175.54 3aeq s VAL 235 N 1.58 4.89 -0.83 2.92 1.01 -1.26 -4.81 120.40 123.90 3aeq s VAL 235 Ca 0.00 1.42 -0.20 0.00 0.00 0.00 0.00 61.98 63.20 3aeq s VAL 235 Cb -0.13 -4.05 -0.14 0.00 0.00 0.00 0.00 36.38 32.06 3aeq s VAL 235 CO -0.04 -0.03 1.96 -0.81 0.00 0.00 0.00 175.10 176.18 3aeq n PRO 236 N 5.86 1.64 -4.06 2.72 -0.04 -1.26 -4.76 135.00 135.11 3aeq n PRO 236 Ca 0.03 -1.88 -0.33 0.00 -0.04 0.00 0.00 63.50 61.28 3aeq n PRO 236 Cb 0.48 -2.92 -0.15 0.00 -0.04 0.00 0.00 33.50 30.87 3aeq n PRO 236 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 3aeq s ILE 237 N 4.76 2.39 0.00 0.52 1.01 -1.26 -0.23 121.20 128.40 3aeq s ILE 237 Ca 0.56 -0.94 0.00 0.00 0.00 0.00 0.00 60.65 60.27 3aeq s ILE 237 Cb 0.14 -2.09 0.00 0.00 0.01 0.00 0.00 42.46 40.52 3aeq s ILE 237 CO 0.09 0.42 0.00 0.61 0.00 0.00 0.00 174.94 176.07 3aeq n GLY 238 N 4.64 0.99 0.25 6.18 0.00 -1.26 -4.36 105.19 111.63 3aeq n GLY 238 Ca -0.19 -1.56 -0.04 0.00 0.00 0.00 0.00 46.02 44.22 3aeq n GLY 238 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3aeq h VAL 239 N 0.00 0.41 -0.52 1.61 2.07 -1.94 -1.41 116.25 116.46 3aeq h VAL 239 Ca 0.00 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.56 3aeq h VAL 239 Cb 0.00 0.41 -0.04 0.00 -1.52 0.00 0.00 31.29 30.13 3aeq h VAL 239 CO 0.00 0.00 0.28 1.23 0.02 0.00 0.00 177.57 179.10 3aeq h GLY 240 N -0.09 0.74 1.53 2.17 0.00 -1.99 -2.07 103.07 103.36 3aeq h GLY 240 Ca 0.22 -0.20 -0.13 0.00 0.00 0.00 0.00 47.33 47.23 3aeq h GLY 240 CO -0.53 0.13 -0.41 0.00 0.00 0.00 0.00 176.54 175.74 3aeq h ALA 241 N 1.27 0.88 -0.48 3.60 0.00 -1.61 -1.54 119.26 121.38 3aeq h ALA 241 Ca 0.23 -0.44 0.00 0.00 0.00 0.00 0.00 54.91 54.70 3aeq h ALA 241 Cb 0.11 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 3aeq h ALA 241 CO -0.15 0.64 0.32 1.15 0.00 0.00 0.00 179.25 181.21 3aeq h THR 242 N 0.43 1.12 -0.27 0.00 2.02 -1.00 0.89 112.91 116.09 3aeq h THR 242 Ca 0.04 -0.22 0.02 0.00 0.77 0.00 0.00 66.41 67.01 3aeq h THR 242 Cb 0.90 0.42 -0.02 0.00 -1.74 0.00 0.00 68.15 67.70 3aeq h THR 242 CO 0.08 0.12 0.14 0.03 0.37 0.00 0.00 175.52 176.26 3aeq h ARG 243 N 0.65 0.29 -0.89 6.66 3.08 -1.16 0.24 114.38 123.24 3aeq h ARG 243 Ca 0.18 -0.02 -0.01 0.00 0.07 0.00 0.00 59.98 60.20 3aeq h ARG 243 Cb -0.08 -0.06 -0.04 0.00 0.08 0.00 0.00 29.97 29.87 3aeq h ARG 243 CO -0.04 0.19 0.51 -0.44 -1.07 0.00 0.00 179.97 179.12 3aeq h ASP 244 N 0.29 1.09 0.98 7.04 5.19 -0.97 -0.48 116.42 129.57 3aeq h ASP 244 Ca 0.11 -0.08 -0.05 0.00 -0.62 0.00 0.00 57.03 56.39 3aeq h ASP 244 Cb 0.03 -0.28 0.01 0.00 0.18 0.00 0.00 39.33 39.27 3aeq h ASP 244 CO -0.07 0.86 -0.47 0.15 -3.12 0.00 0.00 179.24 176.58 3aeq h PHE 245 N 1.23 -1.22 -0.78 4.55 3.57 0.13 -1.04 116.94 123.39 3aeq h PHE 245 Ca 0.32 -0.03 0.06 0.00 3.53 0.00 0.00 57.97 61.85 3aeq h PHE 245 Cb -0.01 0.40 -0.05 0.00 2.79 0.00 0.00 35.95 39.08 3aeq h PHE 245 CO 0.01 -0.76 0.51 -0.07 -2.23 0.00 0.00 178.31 175.77 3aeq h LEU 246 N -1.32 0.75 -1.20 0.59 3.38 -0.47 0.14 115.31 117.19 3aeq h LEU 246 Ca -0.13 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.83 3aeq h LEU 246 Cb 1.01 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 41.56 3aeq h LEU 246 CO 0.22 0.49 0.36 0.00 0.09 0.00 0.00 178.44 179.60 3aeq h ALA 247 N 1.57 1.39 -0.17 1.53 0.00 -1.03 0.55 119.26 123.11 3aeq h ALA 247 Ca 0.33 -0.10 -0.11 0.00 0.00 0.00 0.00 54.91 55.03 3aeq h ALA 247 Cb 0.21 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.73 3aeq h ALA 247 CO -0.11 0.50 -0.33 1.49 0.00 0.00 0.00 179.25 180.80 3aeq h GLU 248 N 0.92 0.52 -0.08 0.00 4.81 0.41 -2.83 114.58 118.33 3aeq h GLU 248 Ca 0.23 -0.34 -0.03 0.00 -0.13 0.00 0.00 59.36 59.09 3aeq h GLU 248 Cb 0.02 0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.44 3aeq h GLU 248 CO -0.04 0.95 -0.11 0.28 -0.73 0.00 0.00 179.01 179.36 3aeq h VAL 249 N 0.16 1.13 0.36 0.32 2.07 -0.62 -1.62 116.25 118.06 3aeq h VAL 249 Ca 0.01 -0.57 -0.02 0.00 0.82 0.00 0.00 66.70 66.94 3aeq h VAL 249 Cb 0.93 1.19 0.00 0.00 -1.52 0.00 0.00 31.29 31.89 3aeq h VAL 249 CO 0.07 0.17 -0.17 -1.28 0.02 0.00 0.00 177.57 176.38 3aeq h SER 250 N 0.12 -0.41 -0.29 0.57 0.87 -0.80 -2.19 113.55 111.41 3aeq h SER 250 Ca 0.03 -0.01 -0.05 0.00 -1.23 0.00 0.00 61.79 60.52 3aeq h SER 250 Cb 0.27 0.11 -0.02 0.00 -0.44 0.00 0.00 62.40 62.32 3aeq h SER 250 CO 0.02 -0.26 0.02 0.50 -0.53 0.00 0.00 176.83 176.57 3aeq h LYS 251 N -0.53 0.61 0.00 2.24 3.64 -1.20 1.02 116.57 122.35 3aeq h LYS 251 Ca -0.05 -0.14 -0.07 0.00 -1.27 0.00 0.00 60.65 59.13 3aeq h LYS 251 Cb 0.40 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 32.13 3aeq h LYS 251 CO 0.08 0.62 -0.32 0.82 -2.27 0.00 0.00 179.45 178.38 3aeq h ILE 252 N 0.59 1.22 -0.00 2.00 2.04 -1.28 -3.32 117.51 118.76 3aeq h ILE 252 Ca 0.12 -1.11 0.00 0.00 1.00 0.00 0.00 64.86 64.87 3aeq h ILE 252 Cb 0.35 1.60 0.00 0.00 -0.74 0.00 0.00 36.82 38.03 3aeq h ILE 252 CO 0.01 0.32 -0.15 0.35 0.00 0.00 0.00 178.15 178.67 3aeq n THR 253 N -4.13 0.00 -1.28 -0.27 -2.24 -0.80 -5.00 114.28 100.56 3aeq n THR 253 Ca -0.02 -0.42 -0.10 0.00 -2.27 0.00 0.00 64.05 61.24 3aeq n THR 253 Cb 0.37 1.00 -0.04 0.00 -2.10 0.00 0.00 70.33 69.56 3aeq n THR 253 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3aeq n GLY 254 N 1.04 1.07 3.87 3.38 0.00 0.35 -4.99 105.19 109.91 3aeq n GLY 254 Ca 0.01 -0.27 -0.37 0.00 0.00 0.00 0.00 46.02 45.38 3aeq n GLY 254 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3aeq s LEU 255 N -2.22 4.40 0.51 0.99 1.43 -1.13 -5.02 118.68 117.63 3aeq s LEU 255 Ca 0.00 0.53 -0.23 0.00 -1.03 0.00 0.00 54.13 53.40 3aeq s LEU 255 Cb 0.00 -2.14 -0.07 0.00 0.03 0.00 0.00 46.19 44.01 3aeq s LEU 255 CO 0.00 0.39 1.30 -0.81 0.23 0.00 0.00 176.35 177.46 3aeq n PRO 256 N 1.99 1.74 -2.76 1.29 -0.04 -1.26 -4.53 135.00 131.42 3aeq n PRO 256 Ca -0.19 0.63 -0.43 0.00 -0.04 0.00 0.00 63.50 63.47 3aeq n PRO 256 Cb 0.55 -2.48 -0.04 0.00 -0.04 0.00 0.00 33.50 31.49 3aeq n PRO 256 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 3aeq s VAL 257 N -1.27 4.26 -0.19 0.52 0.11 -1.26 -4.96 120.40 117.60 3aeq s VAL 257 Ca 0.68 0.39 -0.04 0.00 -2.93 0.00 0.00 61.98 60.07 3aeq s VAL 257 Cb -0.45 -4.61 -0.02 0.00 -1.53 0.00 0.00 36.38 29.77 3aeq s VAL 257 CO 0.52 -1.23 -0.02 -0.69 -3.33 0.00 0.00 175.10 170.35 3aeq s VAL 258 N 4.29 3.74 0.11 2.04 1.01 -1.26 -5.11 120.40 125.21 3aeq s VAL 258 Ca 0.33 -0.39 0.07 0.00 0.00 0.00 0.00 61.98 62.00 3aeq s VAL 258 Cb -0.11 -2.68 -0.04 0.00 0.00 0.00 0.00 36.38 33.55 3aeq s VAL 258 CO 0.20 0.44 -0.18 0.42 0.00 0.00 0.00 175.10 175.97 3aeq s THR 259 N 0.99 1.57 -0.36 3.92 -4.23 -1.26 -4.09 115.64 112.18 3aeq s THR 259 Ca 0.01 -1.57 -0.09 0.00 -1.18 0.00 0.00 61.69 58.85 3aeq s THR 259 Cb -0.14 -1.50 0.03 0.00 1.34 0.00 0.00 72.50 72.22 3aeq s THR 259 CO 0.01 -0.17 0.17 -0.62 -0.54 0.00 0.00 174.62 173.47 3aeq s ASP 260 N -2.05 5.58 -0.15 3.99 -1.08 -1.26 -4.96 116.67 116.74 3aeq s ASP 260 Ca 0.06 -1.03 0.16 0.00 -0.52 0.00 0.00 52.55 51.22 3aeq s ASP 260 Cb -0.09 -1.97 0.50 0.00 -1.46 0.00 0.00 42.92 39.90 3aeq s ASP 260 CO 0.04 -0.36 1.40 -0.62 0.52 0.00 0.00 175.17 176.15 3aeq n GLU 261 N 4.93 2.96 0.00 4.34 1.02 -1.26 -4.69 120.64 127.95 3aeq n GLU 261 Ca -0.12 -2.71 0.12 0.00 -0.02 0.00 0.00 57.16 54.43 3aeq n GLU 261 Cb 0.46 -1.75 0.68 0.00 -0.02 0.00 0.00 31.44 30.81 3aeq n GLU 261 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 3aeq n SER 262 N -0.30 0.00 0.00 1.62 3.41 -1.26 -2.77 113.62 114.32 3aeq n SER 262 Ca 0.20 -0.56 0.00 0.00 -0.26 0.00 0.00 58.87 58.25 3aeq n SER 262 Cb 0.82 -0.08 0.00 0.00 -0.26 0.00 0.00 64.21 64.69 3aeq n SER 262 CO 0.00 0.00 0.00 1.07 -0.16 0.00 0.00 175.04 175.95 3aeq n THR 263 N -1.08 0.22 -2.68 6.66 5.66 -1.26 -4.98 114.28 116.81 3aeq n THR 263 Ca 0.16 -0.26 -0.42 0.00 -3.05 0.00 0.00 64.05 60.48 3aeq n THR 263 Cb 0.11 1.09 -0.03 0.00 -1.55 0.00 0.00 70.33 69.95 3aeq n THR 263 CO 0.00 0.00 0.00 -0.22 -3.05 0.00 0.00 175.07 171.80 3aeq s LEU 264 N -0.22 3.87 0.00 1.09 0.20 -1.12 -4.84 118.68 117.67 3aeq s LEU 264 Ca 0.00 -1.20 0.22 0.00 0.69 0.00 0.00 54.13 53.83 3aeq s LEU 264 Cb 0.00 -2.51 -0.13 0.00 -0.43 0.00 0.00 46.19 43.12 3aeq s LEU 264 CO 0.00 -1.50 0.97 0.54 -0.29 0.00 0.00 176.35 176.07 3aeq n ARG 265 N 8.35 0.03 -0.10 1.98 1.74 -1.26 -4.48 116.66 122.91 3aeq n ARG 265 Ca 0.16 -0.02 -0.09 0.00 -0.77 0.00 0.00 57.85 57.13 3aeq n ARG 265 Cb 0.49 -1.50 -0.01 0.00 -1.02 0.00 0.00 32.46 30.42 3aeq n ARG 265 CO 0.00 0.00 0.00 0.37 -1.52 0.00 0.00 177.63 176.48 3aeq h GLN 266 N 0.05 0.45 -0.21 5.56 -0.00 -1.88 -1.51 115.11 117.57 3aeq h GLN 266 Ca 0.00 -0.03 0.06 0.00 -0.00 0.00 0.00 58.65 58.68 3aeq h GLN 266 Cb 0.51 -0.10 -0.07 0.00 0.00 0.00 0.00 27.48 27.82 3aeq h GLN 266 CO 0.00 0.30 -0.24 -1.35 0.00 0.00 0.00 178.83 177.54 3aeq h PRO 267 N 0.46 -0.25 -0.32 -2.39 0.11 -1.95 -1.41 132.00 126.24 3aeq h PRO 267 Ca 0.12 0.02 -0.01 0.00 0.11 0.00 0.00 66.00 66.24 3aeq h PRO 267 Cb -0.05 0.06 -0.01 0.00 0.11 0.00 0.00 31.00 31.11 3aeq h PRO 267 CO -0.03 -0.17 0.14 2.35 -0.21 0.00 0.00 178.00 180.08 3aeq h TRP 268 N -0.26 0.47 -0.44 0.65 -0.00 -1.84 0.28 115.95 114.80 3aeq h TRP 268 Ca 0.13 -0.03 0.08 0.00 -0.00 0.00 0.00 58.89 59.07 3aeq h TRP 268 Cb 0.46 -0.14 -0.10 0.00 -0.00 0.00 0.00 29.16 29.38 3aeq h TRP 268 CO -0.38 0.43 -0.37 -1.49 -0.00 0.00 0.00 178.44 176.64 3aeq h TRP 269 N 0.37 -1.04 -0.03 2.65 6.55 -0.49 0.34 115.95 124.29 3aeq h TRP 269 Ca 0.11 0.06 -0.17 0.00 0.95 0.00 0.00 58.89 59.85 3aeq h TRP 269 Cb 0.15 0.52 -0.01 0.00 -0.86 0.00 0.00 29.16 28.96 3aeq h TRP 269 CO -0.01 -0.41 -0.73 0.66 -1.05 0.00 0.00 178.44 176.91 3aeq h SER 270 N -0.26 0.22 -0.18 -3.49 4.64 -1.17 -2.82 113.55 110.49 3aeq h SER 270 Ca 0.17 -0.15 -0.06 0.00 -0.47 0.00 0.00 61.79 61.28 3aeq h SER 270 Cb 0.56 -0.07 -0.02 0.00 -0.31 0.00 0.00 62.40 62.57 3aeq h SER 270 CO -0.58 0.87 -0.06 0.00 -0.87 0.00 0.00 176.83 176.20 3aeq h ALA 271 N 1.12 1.32 -2.69 5.18 0.00 -0.27 -3.42 119.26 120.50 3aeq h ALA 271 Ca -0.02 -0.23 -0.54 0.00 0.00 0.00 0.00 54.91 54.11 3aeq h ALA 271 Cb 1.28 -0.14 0.18 0.00 0.00 0.00 0.00 17.79 19.11 3aeq h ALA 271 CO 0.11 0.46 0.29 -1.13 0.00 0.00 0.00 179.25 178.98 3aeq n SER 272 N -4.25 1.00 -0.07 0.00 3.41 0.11 -4.88 113.62 108.95 3aeq n SER 272 Ca 0.01 0.64 0.22 0.00 -0.26 0.00 0.00 58.87 59.47 3aeq n SER 272 Cb 0.28 -1.49 0.68 0.00 -0.26 0.00 0.00 64.21 63.42 3aeq n SER 272 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 3aeq h VAL 273 N -0.56 0.69 -0.18 -3.33 2.07 -1.88 -1.35 116.25 111.70 3aeq h VAL 273 Ca -0.47 -0.02 0.05 0.00 0.82 0.00 0.00 66.70 67.08 3aeq h VAL 273 Cb 1.31 0.64 -0.01 0.00 -1.52 0.00 0.00 31.29 31.71 3aeq h VAL 273 CO 0.47 0.01 0.21 0.44 0.02 0.00 0.00 177.57 178.72 3aeq h ASP 274 N 0.05 0.00 -0.02 0.57 3.32 -1.90 -2.27 116.42 116.17 3aeq h ASP 274 Ca 0.31 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.36 3aeq h ASP 274 Cb 1.18 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.73 3aeq h ASP 274 CO -0.02 0.00 -0.15 -1.20 -1.72 0.00 0.00 179.24 176.15 3aeq n SER 275 N -3.74 2.63 -0.04 6.45 7.64 -0.51 -4.46 113.62 121.59 3aeq n SER 275 Ca 0.02 -1.82 0.12 0.00 1.01 0.00 0.00 58.87 58.20 3aeq n SER 275 Cb 0.33 0.16 0.53 0.00 -1.01 0.00 0.00 64.21 64.21 3aeq n SER 275 CO 0.00 0.00 0.00 0.71 -3.01 0.00 0.00 175.04 172.74 3aeq h THR 276 N 3.85 0.90 0.00 0.44 1.35 -1.52 0.12 112.91 118.06 3aeq h THR 276 Ca 0.00 -0.12 0.00 0.00 -0.55 0.00 0.00 66.41 65.74 3aeq h THR 276 Cb 0.89 0.53 0.00 0.00 -1.73 0.00 0.00 68.15 67.85 3aeq h THR 276 CO 0.00 0.06 0.00 0.00 -0.25 0.00 0.00 175.52 175.33 3aeq n TYR 277 N -4.47 0.00 0.32 4.73 0.18 -1.26 -2.33 117.16 114.33 3aeq n TYR 277 Ca 0.08 0.00 0.12 0.00 1.88 0.00 0.00 57.90 59.98 3aeq n TYR 277 Cb 0.35 -0.25 0.22 0.00 -0.38 0.00 0.00 39.34 39.27 3aeq n TYR 277 CO 0.00 0.00 0.00 -0.07 -2.08 0.00 0.00 176.86 174.71 3aeq h LEU 278 N 0.00 0.00 -9.47 -3.48 3.38 -1.07 -3.46 115.31 101.22 3aeq h LEU 278 Ca 0.00 -0.01 -0.53 0.00 0.09 0.00 0.00 57.88 57.43 3aeq h LEU 278 Cb 0.14 0.00 0.02 0.00 0.09 0.00 0.00 40.66 40.91 3aeq h LEU 278 CO 0.00 0.00 0.89 -0.89 0.09 0.00 0.00 178.44 178.54 3aeq s THR 279 N -3.19 3.19 0.00 0.22 2.01 -0.98 -2.68 115.64 114.21 3aeq s THR 279 Ca 0.07 0.71 0.00 0.00 0.31 0.00 0.00 61.69 62.78 3aeq s THR 279 Cb 0.07 -3.45 0.00 0.00 0.01 0.00 0.00 72.50 69.13 3aeq s THR 279 CO 0.66 0.02 0.00 0.61 -0.69 0.00 0.00 174.62 175.22 3aeq n GLY 280 N 3.79 2.78 3.68 4.40 0.00 -0.93 -5.01 105.19 113.89 3aeq n GLY 280 Ca 0.14 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.69 3aeq n GLY 280 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3aeq n LYS 281 N -0.73 2.27 -2.28 1.61 4.76 -1.09 -4.22 118.16 118.48 3aeq n LYS 281 Ca 0.00 0.83 -0.43 0.00 -2.87 0.00 0.00 58.31 55.84 3aeq n LYS 281 Cb 0.00 -2.69 -0.02 0.00 -1.84 0.00 0.00 35.03 30.48 3aeq n LYS 281 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 3aeq s ARG 282 N 3.92 3.92 -0.06 1.97 0.52 -1.26 -1.12 118.95 126.85 3aeq s ARG 282 Ca 0.91 1.51 0.05 0.00 -0.52 0.00 0.00 55.73 57.68 3aeq s ARG 282 Cb -0.66 -3.93 -0.02 0.00 0.52 0.00 0.00 34.95 30.86 3aeq s ARG 282 CO 0.49 -1.12 -0.19 0.54 0.02 0.00 0.00 175.30 175.04 3aeq s VAL 283 N 4.57 2.59 -0.23 3.52 0.11 0.93 0.72 120.40 132.61 3aeq s VAL 283 Ca 0.63 -0.89 -0.05 0.00 -2.93 0.00 0.00 61.98 58.74 3aeq s VAL 283 Cb -0.21 -1.99 -0.02 0.00 -1.53 0.00 0.00 36.38 32.64 3aeq s VAL 283 CO 0.25 0.57 -0.00 0.12 -3.33 0.00 0.00 175.10 172.71 3aeq s PHE 284 N -0.42 3.00 -0.17 1.54 5.36 -0.84 -0.48 117.98 125.98 3aeq s PHE 284 Ca 0.04 -0.74 -0.02 0.00 -0.96 0.00 0.00 56.93 55.25 3aeq s PHE 284 Cb -0.12 -2.15 -0.01 0.00 -0.34 0.00 0.00 43.02 40.40 3aeq s PHE 284 CO 0.02 -0.47 -0.09 0.42 -1.46 0.00 0.00 175.22 173.64 3aeq s ILE 285 N 1.49 3.27 0.03 3.12 1.01 -0.01 -1.35 121.20 128.76 3aeq s ILE 285 Ca 0.06 -0.56 -0.05 0.00 0.00 0.00 0.00 60.65 60.10 3aeq s ILE 285 Cb -0.15 -2.42 -0.01 0.00 0.01 0.00 0.00 42.46 39.89 3aeq s ILE 285 CO -0.01 0.49 0.08 0.12 0.00 0.00 0.00 174.94 175.61 3aeq s PHE 286 N 0.76 0.20 -4.81 3.97 2.19 -0.35 -1.28 117.98 118.66 3aeq s PHE 286 Ca -0.04 -0.48 0.00 0.00 0.33 0.00 0.00 56.93 56.74 3aeq s PHE 286 Cb -0.15 -0.15 0.00 0.00 -1.31 0.00 0.00 43.02 41.41 3aeq s PHE 286 CO 0.02 -0.33 0.00 0.41 1.83 0.00 0.00 175.22 177.15 3aeq n GLY 287 N 0.97 -0.20 3.94 13.12 0.00 -1.17 -3.83 105.19 118.01 3aeq n GLY 287 Ca -0.20 -0.96 -0.25 0.00 0.00 0.00 0.00 46.02 44.61 3aeq n GLY 287 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 3aeq s ASP 288 N -4.00 4.79 0.09 1.61 3.84 -1.26 -2.17 116.67 119.57 3aeq s ASP 288 Ca 0.00 0.35 -0.20 0.00 -0.00 0.00 0.00 52.55 52.69 3aeq s ASP 288 Cb 0.00 -0.99 -0.06 0.00 -1.38 0.00 0.00 42.92 40.48 3aeq s ASP 288 CO 0.00 -1.59 1.34 1.23 -0.00 0.00 0.00 175.17 176.15 3aeq h GLY 289 N -0.55 -1.40 0.33 2.12 0.00 -1.89 -2.37 103.07 99.32 3aeq h GLY 289 Ca -0.44 0.80 0.00 0.00 0.00 0.00 0.00 47.33 47.70 3aeq h GLY 289 CO 0.57 -0.35 -0.49 -0.84 0.00 0.00 0.00 176.54 175.43 3aeq h THR 290 N -0.20 0.05 0.00 4.70 2.02 -1.95 -1.13 112.91 116.39 3aeq h THR 290 Ca 0.06 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.21 3aeq h THR 290 Cb 0.35 0.05 -0.00 0.00 -1.74 0.00 0.00 68.15 66.80 3aeq h THR 290 CO -0.42 0.00 -0.11 0.45 0.37 0.00 0.00 175.52 175.81 3aeq h HIS 291 N -0.84 0.00 0.04 3.16 3.86 -1.89 -2.22 115.15 117.26 3aeq h HIS 291 Ca -0.02 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.18 3aeq h HIS 291 Cb 0.79 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.26 3aeq h HIS 291 CO -0.35 0.11 -0.02 0.28 0.86 0.00 0.00 177.93 178.81 3aeq h VAL 292 N 0.00 0.59 -0.89 2.45 2.07 -0.81 -1.97 116.25 117.69 3aeq h VAL 292 Ca -0.00 -1.37 0.20 0.00 0.82 0.00 0.00 66.70 66.36 3aeq h VAL 292 Cb 0.40 1.10 -0.16 0.00 -1.52 0.00 0.00 31.29 31.11 3aeq h VAL 292 CO 0.01 0.19 -0.10 0.40 0.02 0.00 0.00 177.57 178.10 3aeq h ILE 293 N -0.99 0.14 -0.19 4.57 2.04 -1.20 -1.68 117.51 120.20 3aeq h ILE 293 Ca -0.01 -0.01 -0.02 0.00 1.00 0.00 0.00 64.86 65.82 3aeq h ILE 293 Cb 0.36 0.11 -0.01 0.00 -0.74 0.00 0.00 36.82 36.54 3aeq h ILE 293 CO 0.01 0.00 0.03 0.00 0.00 0.00 0.00 178.15 178.20 3aeq h ALA 294 N 1.88 0.25 -0.51 1.87 0.00 -1.45 -2.94 119.26 118.35 3aeq h ALA 294 Ca 0.47 -0.17 0.01 0.00 0.00 0.00 0.00 54.91 55.23 3aeq h ALA 294 Cb 0.83 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.52 3aeq h ALA 294 CO -0.86 -0.09 0.33 0.00 0.00 0.00 0.00 179.25 178.63 3aeq h ALA 295 N 0.83 0.65 -0.51 0.00 0.00 -0.76 -2.45 119.26 117.02 3aeq h ALA 295 Ca 0.06 -0.03 0.03 0.00 0.00 0.00 0.00 54.91 54.97 3aeq h ALA 295 Cb 0.30 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.88 3aeq h ALA 295 CO 0.00 0.07 0.34 0.00 0.00 0.00 0.00 179.25 179.66 3aeq h ALA 296 N 1.20 1.77 0.16 0.00 0.00 -1.21 0.27 119.26 121.44 3aeq h ALA 296 Ca 0.19 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 3aeq h ALA 296 Cb -0.05 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.58 3aeq h ALA 296 CO -0.05 0.17 -0.08 -0.09 0.00 0.00 0.00 179.25 179.20 3aeq h ARG 297 N 0.56 -0.20 -0.62 0.00 2.43 -1.29 -2.42 114.38 112.84 3aeq h ARG 297 Ca 0.20 0.01 0.09 0.00 -0.81 0.00 0.00 59.98 59.47 3aeq h ARG 297 Cb 0.12 0.05 -0.07 0.00 -0.42 0.00 0.00 29.97 29.65 3aeq h ARG 297 CO -0.05 0.18 0.27 0.82 -1.51 0.00 0.00 179.97 179.68 3aeq h ILE 298 N -0.65 0.82 0.63 1.20 2.04 -0.92 0.17 117.51 120.81 3aeq h ILE 298 Ca -0.02 -0.17 -0.03 0.00 1.00 0.00 0.00 64.86 65.65 3aeq h ILE 298 Cb 0.48 0.30 -0.00 0.00 -0.74 0.00 0.00 36.82 36.86 3aeq h ILE 298 CO 0.04 0.09 -0.41 0.00 0.00 0.00 0.00 178.15 177.87 3aeq h ALA 299 N 1.40 -1.20 0.68 1.87 0.00 -0.56 0.09 119.26 121.54 3aeq h ALA 299 Ca 0.31 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 54.98 3aeq h ALA 299 Cb 0.34 0.53 0.01 0.00 0.00 0.00 0.00 17.79 18.66 3aeq h ALA 299 CO -0.27 -1.17 -0.33 0.00 0.00 0.00 0.00 179.25 177.49 3aeq h ALA 300 N -1.29 -0.96 0.00 0.00 0.00 -1.35 0.93 119.26 116.59 3aeq h ALA 300 Ca -0.08 -0.20 -0.09 0.00 0.00 0.00 0.00 54.91 54.54 3aeq h ALA 300 Cb 0.79 0.35 -0.01 0.00 0.00 0.00 0.00 17.79 18.92 3aeq h ALA 300 CO 0.08 -0.89 -0.43 0.87 0.00 0.00 0.00 179.25 178.87 3aeq h LYS 301 N -1.18 0.00 0.00 0.00 1.57 -0.78 -3.13 116.57 113.06 3aeq h LYS 301 Ca -0.09 0.00 -0.14 0.00 -1.87 0.00 0.00 60.65 58.55 3aeq h LYS 301 Cb 0.70 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.98 3aeq h LYS 301 CO 0.15 0.43 -1.52 0.39 -0.57 0.00 0.00 179.45 178.33 3aeq n GLU 302 N -3.33 2.63 -0.05 3.15 1.02 -0.13 -4.76 120.64 119.17 3aeq n GLU 302 Ca 0.01 -0.00 -0.04 0.00 -0.02 0.00 0.00 57.16 57.11 3aeq n GLU 302 Cb 0.63 -1.20 -0.07 0.00 -0.02 0.00 0.00 31.44 30.78 3aeq n GLU 302 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 3aeq n VAL 303 N -2.31 0.63 -0.11 2.62 0.31 -0.30 -4.89 118.33 114.29 3aeq n VAL 303 Ca -0.13 -0.39 0.00 0.00 -0.01 0.00 0.00 64.34 63.81 3aeq n VAL 303 Cb 0.74 -0.74 0.00 0.00 -0.91 0.00 0.00 33.84 32.94 3aeq n VAL 303 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3aeq n GLY 304 N 2.42 0.94 3.75 2.92 0.00 0.15 -4.64 105.19 110.72 3aeq n GLY 304 Ca -0.15 -0.06 -0.30 0.00 0.00 0.00 0.00 46.02 45.50 3aeq n GLY 304 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3aeq s PHE 305 N -2.00 2.49 -0.15 1.61 0.08 -0.20 -2.19 117.98 117.62 3aeq s PHE 305 Ca 0.00 1.37 -0.01 0.00 0.12 0.00 0.00 56.93 58.41 3aeq s PHE 305 Cb 0.00 -3.10 -0.01 0.00 -0.57 0.00 0.00 43.02 39.34 3aeq s PHE 305 CO 0.00 -2.07 -0.12 -2.00 -0.10 0.00 0.00 175.22 170.93 3aeq s GLU 306 N -4.95 3.34 -0.27 0.44 2.12 -0.27 -3.90 118.70 115.22 3aeq s GLU 306 Ca 0.62 -0.69 -0.19 0.00 0.36 0.00 0.00 54.97 55.07 3aeq s GLU 306 Cb -0.17 -2.68 -0.02 0.00 0.26 0.00 0.00 34.13 31.51 3aeq s GLU 306 CO 0.56 0.10 0.56 0.08 -0.54 0.00 0.00 175.26 176.03 3aeq s VAL 307 N 0.63 5.02 -0.35 3.70 1.01 -1.26 -0.05 120.40 129.11 3aeq s VAL 307 Ca -0.07 0.90 0.12 0.00 0.00 0.00 0.00 61.98 62.93 3aeq s VAL 307 Cb -0.15 -3.89 0.30 0.00 0.00 0.00 0.00 36.38 32.63 3aeq s VAL 307 CO 0.03 0.01 1.22 1.33 0.00 0.00 0.00 175.10 177.69 3aeq n VAL 308 N 5.23 1.55 0.00 2.92 0.24 0.37 -4.91 118.33 123.72 3aeq n VAL 308 Ca -0.03 -1.51 0.00 0.00 -2.04 0.00 0.00 64.34 60.76 3aeq n VAL 308 Cb 0.49 0.14 0.00 0.00 -1.47 0.00 0.00 33.84 33.00 3aeq n VAL 308 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3aeq n GLY 309 N -0.40 1.85 2.92 7.63 0.00 -1.24 -4.88 105.19 111.06 3aeq n GLY 309 Ca 0.13 0.11 -0.18 0.00 0.00 0.00 0.00 46.02 46.08 3aeq n GLY 309 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3aeq s MET 310 N -0.57 0.62 0.18 1.61 -1.94 -1.25 -0.83 119.30 117.12 3aeq s MET 310 Ca 0.00 -0.13 -0.11 0.00 -1.71 0.00 0.00 55.69 53.74 3aeq s MET 310 Cb 0.00 -0.64 -0.00 0.00 2.01 0.00 0.00 34.83 36.20 3aeq s MET 310 CO 0.00 0.00 0.36 0.20 -0.01 0.00 0.00 175.02 175.57 3aeq s GLY 311 N 0.48 0.38 0.06 -0.03 0.00 -0.41 -0.83 107.32 106.97 3aeq s GLY 311 Ca -0.06 -0.75 -0.14 0.00 0.00 0.00 0.00 44.72 43.77 3aeq s GLY 311 CO -0.00 -0.69 0.32 0.00 0.00 0.00 0.00 173.10 172.73 3aeq n TYR 313 N 0.40 0.42 -3.27 0.00 4.11 -0.92 -2.82 117.16 115.08 3aeq n TYR 313 Ca -0.18 0.12 -0.43 0.00 -0.00 0.00 0.00 57.90 57.42 3aeq n TYR 313 Cb 0.60 -0.56 -0.08 0.00 -0.00 0.00 0.00 39.34 39.30 3aeq n TYR 313 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.86 177.40 3aeq s ASN 314 N -4.08 6.24 0.44 9.48 4.22 -1.26 -4.53 114.94 125.45 3aeq s ASN 314 Ca 0.05 -0.50 0.13 0.00 -2.14 0.00 0.00 52.86 50.40 3aeq s ASN 314 Cb 0.14 -2.25 1.03 0.00 1.28 0.00 0.00 41.25 41.45 3aeq s ASN 314 CO 0.75 -0.60 2.03 -0.09 -2.04 0.00 0.00 177.10 177.15 3aeq h ARG 315 N 8.71 0.37 0.00 3.55 2.43 -1.95 -1.74 114.38 125.75 3aeq h ARG 315 Ca -0.27 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 58.88 3aeq h ARG 315 Cb 1.11 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 30.58 3aeq h ARG 315 CO 0.81 0.25 0.00 0.39 -1.51 0.00 0.00 179.97 179.90 3aeq n GLU 316 N -4.47 0.04 -0.25 0.20 4.71 -1.26 -0.90 120.64 118.71 3aeq n GLU 316 Ca 0.06 0.48 0.07 0.00 -0.01 0.00 0.00 57.16 57.76 3aeq n GLU 316 Cb 0.25 -1.61 0.18 0.00 -1.01 0.00 0.00 31.44 29.25 3aeq n GLU 316 CO 0.00 0.00 0.00 -1.33 0.09 0.00 0.00 177.13 175.89 3aeq n MET 317 N -1.68 2.56 0.14 3.49 2.81 -0.66 -4.81 117.12 118.98 3aeq n MET 317 Ca 0.00 -2.44 -0.14 0.00 -1.81 0.00 0.00 57.70 53.32 3aeq n MET 317 Cb 0.05 -1.53 -0.08 0.00 -0.71 0.00 0.00 33.22 30.94 3aeq n MET 317 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 3aeq h ALA 318 N 1.23 -0.34 -0.65 3.04 0.00 -1.12 -2.62 119.26 118.80 3aeq h ALA 318 Ca 0.00 -0.16 -0.07 0.00 0.00 0.00 0.00 54.91 54.68 3aeq h ALA 318 Cb 1.07 0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.96 3aeq h ALA 318 CO 0.10 -0.57 0.11 0.00 0.00 0.00 0.00 179.25 178.89 3aeq h ARG 319 N -0.58 1.06 -0.71 0.00 3.08 -1.87 -0.38 114.38 114.98 3aeq h ARG 319 Ca -0.03 -0.27 0.04 0.00 0.07 0.00 0.00 59.98 59.79 3aeq h ARG 319 Cb 0.42 -0.13 -0.05 0.00 0.08 0.00 0.00 29.97 30.29 3aeq h ARG 319 CO 0.06 0.97 0.43 -1.35 -1.07 0.00 0.00 179.97 179.00 3aeq h PRO 320 N 1.00 0.79 -0.10 0.04 0.11 -1.92 -0.02 132.00 131.90 3aeq h PRO 320 Ca 0.20 -0.05 -0.13 0.00 0.11 0.00 0.00 66.00 66.13 3aeq h PRO 320 Cb 0.42 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 31.33 3aeq h PRO 320 CO 0.01 0.53 -0.52 1.25 -0.21 0.00 0.00 178.00 179.06 3aeq h LEU 321 N 0.82 0.30 -0.50 2.35 5.85 -1.20 -1.09 115.31 121.84 3aeq h LEU 321 Ca 0.30 -0.15 -0.17 0.00 0.84 0.00 0.00 57.88 58.70 3aeq h LEU 321 Cb 0.10 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.03 3aeq h LEU 321 CO -0.14 0.77 -0.67 0.03 -0.34 0.00 0.00 178.44 178.09 3aeq h ARG 322 N 0.22 0.35 0.22 1.25 3.08 -0.77 -0.35 114.38 118.38 3aeq h ARG 322 Ca 0.01 -0.27 -0.01 0.00 0.07 0.00 0.00 59.98 59.78 3aeq h ARG 322 Cb 0.99 0.05 0.00 0.00 0.08 0.00 0.00 29.97 31.09 3aeq h ARG 322 CO 0.08 0.89 -0.11 1.15 -1.07 0.00 0.00 179.97 180.92 3aeq h THR 323 N 0.25 0.82 -0.54 2.04 2.02 -0.82 -2.53 112.91 114.15 3aeq h THR 323 Ca -0.02 -0.19 -0.03 0.00 0.77 0.00 0.00 66.41 66.95 3aeq h THR 323 Cb 1.22 0.93 -0.02 0.00 -1.74 0.00 0.00 68.15 68.53 3aeq h THR 323 CO 0.11 0.04 0.22 0.00 0.37 0.00 0.00 175.52 176.26 3aeq h ALA 324 N 0.38 0.70 -0.76 6.16 0.00 -1.13 -2.87 119.26 121.74 3aeq h ALA 324 Ca -0.03 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.72 3aeq h ALA 324 Cb 0.29 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 17.84 3aeq h ALA 324 CO 0.05 0.31 0.44 0.00 0.00 0.00 0.00 179.25 180.05 3aeq h ALA 325 N 1.06 1.35 -0.91 0.00 0.00 -1.05 -1.62 119.26 118.09 3aeq h ALA 325 Ca 0.18 -0.10 0.17 0.00 0.00 0.00 0.00 54.91 55.16 3aeq h ALA 325 Cb 0.19 -0.31 -0.10 0.00 0.00 0.00 0.00 17.79 17.57 3aeq h ALA 325 CO -0.02 0.55 0.49 0.00 0.00 0.00 0.00 179.25 180.28 3aeq h ALA 326 N 1.44 1.43 -0.15 0.00 0.00 -1.22 0.75 119.26 121.51 3aeq h ALA 326 Ca 0.27 0.09 0.04 0.00 0.00 0.00 0.00 54.91 55.32 3aeq h ALA 326 Cb -0.02 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 3aeq h ALA 326 CO -0.05 -0.10 0.15 0.93 0.00 0.00 0.00 179.25 180.18 3aeq h GLU 327 N 0.65 0.00 -0.52 0.00 5.08 -1.30 0.23 114.58 118.72 3aeq h GLU 327 Ca 0.52 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.88 3aeq h GLU 327 Cb 0.79 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.04 3aeq h GLU 327 CO -0.39 0.00 0.00 0.66 -1.00 0.00 0.00 179.01 178.28 3aeq n TYR 328 N -3.92 0.82 -2.96 4.33 4.02 0.20 -4.98 117.16 114.67 3aeq n TYR 328 Ca 0.01 -0.54 -0.17 0.00 -0.01 0.00 0.00 57.90 57.19 3aeq n TYR 328 Cb 0.27 -0.07 0.04 0.00 -0.02 0.00 0.00 39.34 39.56 3aeq n TYR 328 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3aeq n GLY 329 N 0.93 -0.17 3.35 2.72 0.00 0.82 -5.03 105.19 107.80 3aeq n GLY 329 Ca 0.19 -0.09 -0.26 0.00 0.00 0.00 0.00 46.02 45.86 3aeq n GLY 329 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3aeq s LEU 330 N -5.15 2.34 -0.08 0.99 1.02 -0.94 -5.01 118.68 111.86 3aeq s LEU 330 Ca 0.28 -0.76 -0.30 0.00 0.02 0.00 0.00 54.13 53.38 3aeq s LEU 330 Cb -0.12 -1.04 -0.03 0.00 0.02 0.00 0.00 46.19 45.01 3aeq s LEU 330 CO 0.35 0.10 1.18 -1.61 0.02 0.00 0.00 176.35 176.39 3aeq s GLU 331 N -2.17 4.34 0.56 1.70 0.41 -1.26 -3.68 118.70 118.59 3aeq s GLU 331 Ca 0.12 1.63 -0.19 0.00 -0.41 0.00 0.00 54.97 56.12 3aeq s GLU 331 Cb -0.09 -3.59 -0.05 0.00 -1.78 0.00 0.00 34.13 28.62 3aeq s GLU 331 CO 0.06 -0.47 1.15 0.00 -0.49 0.00 0.00 175.26 175.50 3aeq s ALA 332 N 2.40 2.66 -0.75 5.21 0.00 -1.26 -4.58 121.76 125.44 3aeq s ALA 332 Ca 0.54 0.87 -0.03 0.00 0.00 0.00 0.00 51.96 53.34 3aeq s ALA 332 Cb -0.23 -3.38 0.19 0.00 0.00 0.00 0.00 23.12 19.70 3aeq s ALA 332 CO 0.20 -0.87 0.60 -1.17 0.00 0.00 0.00 175.76 174.52 3aeq s LEU 333 N -3.87 5.45 -0.62 0.00 2.96 -0.01 -4.99 118.68 117.60 3aeq s LEU 333 Ca 0.74 -3.22 -0.28 0.00 -0.22 0.00 0.00 54.13 51.15 3aeq s LEU 333 Cb -0.25 -1.89 0.03 0.00 0.50 0.00 0.00 46.19 44.57 3aeq s LEU 333 CO 0.28 -0.30 1.21 -0.63 -1.32 0.00 0.00 176.35 175.59 3aeq s ILE 334 N -0.60 3.95 0.11 6.68 -1.09 -1.26 -3.01 121.20 125.98 3aeq s ILE 334 Ca 0.21 0.75 -0.15 0.00 -2.23 0.00 0.00 60.65 59.24 3aeq s ILE 334 Cb -0.14 -4.78 0.03 0.00 -1.58 0.00 0.00 42.46 35.99 3aeq s ILE 334 CO -0.07 -1.48 0.36 0.28 -1.23 0.00 0.00 174.94 172.80 3aeq s THR 335 N 5.14 0.08 -0.11 2.92 -1.32 -1.13 -5.02 115.64 116.20 3aeq s THR 335 Ca 0.40 -0.68 0.16 0.00 -1.21 0.00 0.00 61.69 60.36 3aeq s THR 335 Cb -0.08 -1.18 0.25 0.00 -1.51 0.00 0.00 72.50 69.98 3aeq s THR 335 CO 0.22 -0.38 1.13 -0.90 -2.21 0.00 0.00 174.62 172.49 3aeq n ASP 336 N -0.13 1.95 -4.19 8.08 5.68 -1.26 -3.55 116.55 123.12 3aeq n ASP 336 Ca -0.16 -2.94 -0.37 0.00 -0.50 0.00 0.00 54.79 50.82 3aeq n ASP 336 Cb 0.63 -0.40 -0.12 0.00 -1.14 0.00 0.00 41.12 40.09 3aeq n ASP 336 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 3aeq s ASP 337 N -2.59 5.20 0.55 -1.12 2.15 -1.26 -4.66 116.67 114.94 3aeq s ASP 337 Ca 0.27 -1.50 0.26 0.00 0.43 0.00 0.00 52.55 52.01 3aeq s ASP 337 Cb 0.24 -1.82 1.47 0.00 -0.30 0.00 0.00 42.92 42.51 3aeq s ASP 337 CO 0.02 -0.40 2.04 0.10 -0.17 0.00 0.00 175.17 176.76 3aeq h TYR 338 N 8.12 0.00 0.00 -5.34 -0.00 -1.94 0.46 116.97 118.26 3aeq h TYR 338 Ca -0.19 0.00 -0.09 0.00 0.00 0.00 0.00 58.73 58.45 3aeq h TYR 338 Cb 1.06 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 37.78 3aeq h TYR 338 CO 0.59 0.00 -0.41 -0.07 -0.00 0.00 0.00 178.16 178.27 3aeq h LEU 339 N 0.00 0.00 -0.34 0.10 3.38 -1.97 0.58 115.31 117.06 3aeq h LEU 339 Ca 0.17 0.00 -0.20 0.00 0.09 0.00 0.00 57.88 57.94 3aeq h LEU 339 Cb 0.74 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.49 3aeq h LEU 339 CO -0.00 0.41 -0.78 -0.33 0.09 0.00 0.00 178.44 177.83 3aeq h GLU 340 N 0.00 0.44 0.29 1.13 5.08 -0.52 0.09 114.58 121.10 3aeq h GLU 340 Ca -0.00 -0.38 -0.01 0.00 -1.00 0.00 0.00 59.36 57.96 3aeq h GLU 340 Cb 0.75 0.09 0.00 0.00 0.50 0.00 0.00 28.75 30.09 3aeq h GLU 340 CO 0.05 1.02 -0.14 0.28 -1.00 0.00 0.00 179.01 179.22 3aeq h VAL 341 N 0.29 0.75 -0.78 3.13 2.07 -1.12 -1.10 116.25 119.48 3aeq h VAL 341 Ca -0.04 -0.43 0.15 0.00 0.82 0.00 0.00 66.70 67.20 3aeq h VAL 341 Cb 1.37 0.98 -0.10 0.00 -1.52 0.00 0.00 31.29 32.02 3aeq h VAL 341 CO 0.14 0.09 0.31 -0.08 0.02 0.00 0.00 177.57 178.05 3aeq h GLU 342 N -0.62 0.43 -0.36 1.57 4.81 0.16 0.09 114.58 120.66 3aeq h GLU 342 Ca -0.04 -0.03 -0.11 0.00 -0.13 0.00 0.00 59.36 59.06 3aeq h GLU 342 Cb 0.45 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.71 3aeq h GLU 342 CO 0.07 0.28 -0.21 -0.22 -0.73 0.00 0.00 179.01 178.20 3aeq h LYS 343 N 0.44 0.69 0.07 1.92 3.64 -0.90 -2.52 116.57 119.92 3aeq h LYS 343 Ca 0.44 -0.27 -0.26 0.00 -1.27 0.00 0.00 60.65 59.29 3aeq h LYS 343 Cb 0.69 -0.04 0.01 0.00 -0.41 0.00 0.00 32.23 32.48 3aeq h LYS 343 CO -0.42 0.85 -1.12 0.00 -2.27 0.00 0.00 179.45 176.49 3aeq h ALA 344 N 1.15 0.18 0.77 5.00 0.00 0.20 -2.03 119.26 124.53 3aeq h ALA 344 Ca 0.09 -0.78 -0.03 0.00 0.00 0.00 0.00 54.91 54.19 3aeq h ALA 344 Cb 0.69 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.51 3aeq h ALA 344 CO 0.05 0.82 -0.47 0.82 0.00 0.00 0.00 179.25 180.47 3aeq h ILE 345 N 0.20 0.00 -0.95 0.00 2.04 -1.10 -1.78 117.51 115.93 3aeq h ILE 345 Ca -0.13 0.00 0.14 0.00 1.00 0.00 0.00 64.86 65.87 3aeq h ILE 345 Cb 1.79 0.00 -0.15 0.00 -0.74 0.00 0.00 36.82 37.72 3aeq h ILE 345 CO 0.20 0.00 -0.40 1.21 0.00 0.00 0.00 178.15 179.16 3aeq n GLU 346 N -5.42 -0.25 0.30 2.37 4.07 -0.95 -1.97 120.64 118.79 3aeq n GLU 346 Ca -0.14 1.46 -0.19 0.00 -0.06 0.00 0.00 57.16 58.23 3aeq n GLU 346 Cb 0.48 -2.16 -0.10 0.00 -0.06 0.00 0.00 31.44 29.60 3aeq n GLU 346 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 3aeq h ALA 347 N 1.19 -1.16 -1.55 4.31 0.00 -1.25 -3.20 119.26 117.59 3aeq h ALA 347 Ca 0.30 -0.20 -0.80 0.00 0.00 0.00 0.00 54.91 54.22 3aeq h ALA 347 Cb 0.54 0.73 -0.25 0.00 0.00 0.00 0.00 17.79 18.82 3aeq h ALA 347 CO -0.94 -1.19 1.15 0.00 0.00 0.00 0.00 179.25 178.27 3aeq n ALA 348 N -2.82 5.46 -1.54 0.00 0.00 -0.68 -4.99 120.51 115.95 3aeq n ALA 348 Ca -0.12 -4.65 -0.23 0.00 0.00 0.00 0.00 53.44 48.44 3aeq n ALA 348 Cb 0.47 -2.46 -0.10 0.00 0.00 0.00 0.00 19.45 17.35 3aeq n ALA 348 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3aeq n ALA 349 N 1.57 0.60 -1.11 0.00 0.00 -1.09 -4.84 120.51 115.64 3aeq n ALA 349 Ca 0.34 -1.06 -0.29 0.00 0.00 0.00 0.00 53.44 52.43 3aeq n ALA 349 Cb 0.32 -2.98 0.20 0.00 0.00 0.00 0.00 19.45 16.98 3aeq n ALA 349 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3aeq s PRO 350 N 8.40 -0.07 -0.01 0.00 0.04 -1.26 -4.98 135.00 137.12 3aeq s PRO 350 Ca 1.07 0.39 0.12 0.00 0.04 0.00 0.00 61.00 62.62 3aeq s PRO 350 Cb -0.41 -1.69 -0.15 0.00 0.04 0.00 0.00 34.50 32.29 3aeq s PRO 350 CO 0.27 -3.04 0.42 0.39 0.04 0.00 0.00 177.00 175.08 3aeq n GLU 351 N -4.37 2.00 -3.82 4.56 1.02 0.22 -4.96 120.64 115.29 3aeq n GLU 351 Ca 0.06 -0.04 -0.12 0.00 -0.02 0.00 0.00 57.16 57.04 3aeq n GLU 351 Cb 0.58 -1.16 -0.11 0.00 -0.02 0.00 0.00 31.44 30.73 3aeq n GLU 351 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 3aeq s LEU 352 N -3.07 1.30 -0.10 -4.62 2.96 -1.00 -4.30 118.68 109.86 3aeq s LEU 352 Ca 0.01 0.21 0.04 0.00 -0.22 0.00 0.00 54.13 54.17 3aeq s LEU 352 Cb 0.09 0.72 -0.00 0.00 0.50 0.00 0.00 46.19 47.49 3aeq s LEU 352 CO 0.50 -0.18 -0.23 -0.63 -1.32 0.00 0.00 176.35 174.49 3aeq s ILE 353 N -0.42 2.12 -0.26 6.68 1.01 -0.89 -1.98 121.20 127.47 3aeq s ILE 353 Ca -0.05 -1.00 -0.03 0.00 0.00 0.00 0.00 60.65 59.57 3aeq s ILE 353 Cb -0.03 -1.81 0.02 0.00 0.01 0.00 0.00 42.46 40.65 3aeq s ILE 353 CO 0.01 0.56 -0.03 -0.76 0.00 0.00 0.00 174.94 174.72 3aeq s LEU 354 N 0.28 3.30 0.00 2.97 1.43 -0.46 -1.61 118.68 124.60 3aeq s LEU 354 Ca -0.17 -0.80 0.00 0.00 -1.03 0.00 0.00 54.13 52.14 3aeq s LEU 354 Cb -0.17 -1.72 0.00 0.00 0.03 0.00 0.00 46.19 44.33 3aeq s LEU 354 CO 0.08 -0.13 0.00 0.61 0.23 0.00 0.00 176.35 177.14 3aeq n GLY 355 N 4.72 4.05 2.70 -3.19 0.00 -0.80 -1.21 105.19 111.46 3aeq n GLY 355 Ca -0.16 -0.62 -0.17 0.00 0.00 0.00 0.00 46.02 45.07 3aeq n GLY 355 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3aeq n THR 356 N 0.00 0.00 -0.29 2.61 -2.24 -1.26 -0.27 114.28 112.83 3aeq n THR 356 Ca 0.00 -1.48 0.11 0.00 -2.27 0.00 0.00 64.05 60.41 3aeq n THR 356 Cb 0.00 -0.31 0.26 0.00 -2.10 0.00 0.00 70.33 68.18 3aeq n THR 356 CO 0.00 0.00 0.00 -0.61 -0.57 0.00 0.00 175.07 173.89 3aeq h GLN 357 N 0.00 0.23 0.25 -0.78 5.75 -1.68 -1.64 115.11 117.24 3aeq h GLN 357 Ca -0.23 -0.01 -0.00 0.00 -0.15 0.00 0.00 58.65 58.25 3aeq h GLN 357 Cb 0.89 -0.05 -0.01 0.00 1.07 0.00 0.00 27.48 29.38 3aeq h GLN 357 CO 0.35 0.15 -0.18 1.98 -2.65 0.00 0.00 178.83 178.49 3aeq h MET 358 N 0.24 -0.41 -0.85 1.69 4.05 -1.95 -2.73 114.93 114.98 3aeq h MET 358 Ca 0.52 0.03 0.15 0.00 -0.28 0.00 0.00 59.70 60.11 3aeq h MET 358 Cb 1.00 0.09 -0.06 0.00 -0.80 0.00 0.00 31.60 31.83 3aeq h MET 358 CO -0.61 -0.27 0.55 0.93 0.23 0.00 0.00 176.91 177.74 3aeq h GLU 359 N -0.43 0.58 0.00 0.39 3.07 -1.68 0.28 114.58 116.80 3aeq h GLU 359 Ca -0.02 -0.03 -0.05 0.00 -0.50 0.00 0.00 59.36 58.75 3aeq h GLU 359 Cb 0.37 -0.13 -0.01 0.00 -0.84 0.00 0.00 28.75 28.14 3aeq h GLU 359 CO 0.00 0.38 -0.25 0.07 -1.40 0.00 0.00 179.01 177.81 3aeq h ARG 360 N 0.60 0.00 0.05 2.33 0.11 -1.16 0.56 114.38 116.86 3aeq h ARG 360 Ca 0.42 0.00 -0.25 0.00 0.10 0.00 0.00 59.98 60.26 3aeq h ARG 360 Cb 0.77 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 31.83 3aeq h ARG 360 CO -0.18 0.25 -1.21 -0.91 0.10 0.00 0.00 179.97 178.03 3aeq h ASN 361 N 0.00 0.16 -0.53 0.08 2.35 -0.30 -1.45 115.58 115.89 3aeq h ASN 361 Ca -0.00 -0.19 -0.07 0.00 -0.55 0.00 0.00 56.30 55.48 3aeq h ASN 361 Cb 0.94 -0.05 -0.02 0.00 0.05 0.00 0.00 38.32 39.24 3aeq h ASN 361 CO 0.03 1.15 0.05 0.40 -1.65 0.00 0.00 177.43 177.41 3aeq h ILE 362 N 0.03 1.26 -0.33 2.81 2.04 -0.47 -2.58 117.51 120.27 3aeq h ILE 362 Ca -0.10 -1.02 -0.00 0.00 1.00 0.00 0.00 64.86 64.73 3aeq h ILE 362 Cb 1.88 0.88 -0.02 0.00 -0.74 0.00 0.00 36.82 38.83 3aeq h ILE 362 CO 0.15 0.37 0.20 0.00 0.00 0.00 0.00 178.15 178.87 3aeq h ALA 363 N 0.97 0.43 -0.20 1.87 0.00 -0.91 -0.92 119.26 120.49 3aeq h ALA 363 Ca 0.16 -0.05 0.05 0.00 0.00 0.00 0.00 54.91 55.07 3aeq h ALA 363 Cb 0.46 -0.13 -0.07 0.00 0.00 0.00 0.00 17.79 18.05 3aeq h ALA 363 CO 0.02 -0.08 -0.37 0.87 0.00 0.00 0.00 179.25 179.69 3aeq h LYS 364 N 0.43 -0.39 -0.94 0.00 1.79 -1.22 0.57 116.57 116.81 3aeq h LYS 364 Ca 0.12 0.03 0.13 0.00 -2.18 0.00 0.00 60.65 58.75 3aeq h LYS 364 Cb 0.00 0.09 -0.09 0.00 -1.58 0.00 0.00 32.23 30.66 3aeq h LYS 364 CO -0.02 -0.26 0.57 0.87 -1.08 0.00 0.00 179.45 179.52 3aeq h LYS 365 N -0.41 0.83 0.00 3.15 1.57 -1.03 0.50 116.57 121.18 3aeq h LYS 365 Ca 0.10 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.83 3aeq h LYS 365 Cb 0.58 -0.19 0.00 0.00 0.08 0.00 0.00 32.23 32.71 3aeq h LYS 365 CO -0.42 0.55 -0.24 -0.07 -0.57 0.00 0.00 179.45 178.70 3aeq h LEU 366 N 0.86 0.00 0.45 2.94 3.38 -0.54 -3.47 115.31 118.92 3aeq h LEU 366 Ca 0.49 -0.03 -0.07 0.00 0.09 0.00 0.00 57.88 58.36 3aeq h LEU 366 Cb 0.56 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.31 3aeq h LEU 366 CO -0.30 0.02 -0.08 0.61 0.09 0.00 0.00 178.44 178.77 3aeq n GLY 367 N 1.21 0.24 3.77 0.83 0.00 0.18 -5.05 105.19 106.37 3aeq n GLY 367 Ca 0.04 -0.75 -0.36 0.00 0.00 0.00 0.00 46.02 44.95 3aeq n GLY 367 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3aeq s LEU 368 N -0.95 4.00 0.34 0.99 1.43 -0.05 -5.00 118.68 119.44 3aeq s LEU 368 Ca 0.00 0.30 -0.28 0.00 -1.03 0.00 0.00 54.13 53.12 3aeq s LEU 368 Cb -0.00 -1.96 -0.09 0.00 0.03 0.00 0.00 46.19 44.17 3aeq s LEU 368 CO 0.00 0.37 1.18 -2.16 0.23 0.00 0.00 176.35 175.97 3aeq s PRO 369 N -0.81 4.36 -0.16 1.29 0.04 -1.26 -4.37 135.00 134.09 3aeq s PRO 369 Ca 0.13 1.92 -0.18 0.00 0.04 0.00 0.00 61.00 62.90 3aeq s PRO 369 Cb -0.12 -2.97 0.05 0.00 0.04 0.00 0.00 34.50 31.50 3aeq s PRO 369 CO 0.03 -0.08 0.50 0.00 0.04 0.00 0.00 177.00 177.49 3aeq s ALA 371 N -0.03 1.65 -0.14 0.00 0.00 -0.63 -4.86 121.76 117.74 3aeq s ALA 371 Ca -0.02 -1.41 -0.17 0.00 0.00 0.00 0.00 51.96 50.36 3aeq s ALA 371 Cb -0.03 -0.08 -0.04 0.00 0.00 0.00 0.00 23.12 22.97 3aeq s ALA 371 CO 0.02 0.09 0.43 0.08 0.00 0.00 0.00 175.76 176.37 3aeq s VAL 372 N -2.42 5.21 -0.40 0.00 1.01 -1.26 -1.91 120.40 120.62 3aeq s VAL 372 Ca 0.13 0.83 0.05 0.00 0.00 0.00 0.00 61.98 62.99 3aeq s VAL 372 Cb -0.03 -3.76 -0.02 0.00 0.00 0.00 0.00 36.38 32.56 3aeq s VAL 372 CO 0.04 0.32 0.38 2.30 0.00 0.00 0.00 175.10 178.14 3aeq n ILE 373 N 3.80 0.00 -3.54 2.22 -5.35 0.62 -4.86 119.36 112.25 3aeq n ILE 373 Ca -0.08 -0.42 -0.17 0.00 -0.27 0.00 0.00 62.75 61.80 3aeq n ILE 373 Cb 0.51 1.04 -0.06 0.00 -1.74 0.00 0.00 39.64 39.39 3aeq n ILE 373 CO 0.00 0.00 0.00 -0.55 -1.76 0.00 0.00 176.55 174.24 3aeq s SER 374 N -1.11 -0.64 0.58 7.28 0.15 -1.18 -4.86 113.70 113.92 3aeq s SER 374 Ca 0.04 0.75 -0.18 0.00 0.70 0.00 0.00 55.95 57.26 3aeq s SER 374 Cb 0.04 0.62 -0.07 0.00 -1.71 0.00 0.00 66.02 64.90 3aeq s SER 374 CO 0.16 -0.57 0.78 0.00 1.20 0.00 0.00 173.24 174.81 3aeq n ALA 375 N 1.11 -0.38 -1.75 5.45 0.00 -1.26 -4.35 120.51 119.32 3aeq n ALA 375 Ca -0.19 0.00 -0.34 0.00 0.00 0.00 0.00 53.44 52.91 3aeq n ALA 375 Cb 0.57 -1.99 -0.01 0.00 0.00 0.00 0.00 19.45 18.01 3aeq n ALA 375 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3aeq s PRO 376 N -2.46 3.55 0.01 0.00 0.04 -1.26 -4.47 135.00 130.41 3aeq s PRO 376 Ca 0.73 1.40 -0.13 0.00 0.04 0.00 0.00 61.00 63.03 3aeq s PRO 376 Cb -0.43 -2.05 0.02 0.00 0.04 0.00 0.00 34.50 32.07 3aeq s PRO 376 CO 0.50 -0.65 0.28 0.54 0.04 0.00 0.00 177.00 177.71 3aeq s VAL 377 N -2.03 0.07 1.13 -0.36 0.11 -1.26 -2.28 120.40 115.78 3aeq s VAL 377 Ca 0.68 -0.62 -0.18 0.00 -2.93 0.00 0.00 61.98 58.93 3aeq s VAL 377 Cb -0.18 -0.76 0.26 0.00 -1.53 0.00 0.00 36.38 34.17 3aeq s VAL 377 CO 0.26 -0.34 1.19 -1.00 -3.33 0.00 0.00 175.10 171.88 3aeq s HIS 378 N -1.93 0.78 0.38 1.54 3.76 -1.26 -4.93 115.29 113.64 3aeq s HIS 378 Ca -0.10 0.40 0.23 0.00 -0.15 0.00 0.00 55.06 55.45 3aeq s HIS 378 Cb -0.03 -3.72 1.23 0.00 1.11 0.00 0.00 32.58 31.17 3aeq s HIS 378 CO 0.00 -3.50 2.00 -0.24 -0.85 0.00 0.00 174.74 172.16 3aeq h VAL 379 N -2.29 0.74 0.00 -0.90 3.04 -1.94 -2.28 116.25 112.62 3aeq h VAL 379 Ca -0.44 -0.72 0.00 0.00 -1.01 0.00 0.00 66.70 64.53 3aeq h VAL 379 Cb 1.27 1.44 0.00 0.00 -2.01 0.00 0.00 31.29 31.99 3aeq h VAL 379 CO 0.34 0.17 0.00 0.00 -1.01 0.00 0.00 177.57 177.07 3aeq n GLN 380 N -3.76 0.17 -0.65 4.17 0.00 -1.26 -1.66 117.38 114.39 3aeq n GLN 380 Ca -0.02 0.40 0.09 0.00 0.00 0.00 0.00 57.00 57.47 3aeq n GLN 380 Cb 0.28 -1.82 0.36 0.00 0.00 0.00 0.00 30.24 29.06 3aeq n GLN 380 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.06 176.81 3aeq n ASP 381 N -2.14 4.88 -3.84 2.61 8.00 -0.86 -4.07 116.55 121.13 3aeq n ASP 381 Ca 0.02 -2.51 -0.34 0.00 0.71 0.00 0.00 54.79 52.67 3aeq n ASP 381 Cb 0.22 -0.59 -0.05 0.00 -0.02 0.00 0.00 41.12 40.68 3aeq n ASP 381 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 3aeq n PHE 382 N 1.05 3.50 -2.04 1.24 3.01 -0.66 -4.67 117.46 118.88 3aeq n PHE 382 Ca 0.26 -3.75 -0.32 0.00 1.01 0.00 0.00 57.45 54.66 3aeq n PHE 382 Cb 0.93 -0.96 -0.00 0.00 -0.01 0.00 0.00 39.48 39.44 3aeq n PHE 382 CO 0.00 0.00 0.00 -1.25 1.01 0.00 0.00 176.76 176.52 3aeq s PRO 383 N -2.13 3.63 0.13 -1.08 0.04 -1.26 -4.96 135.00 129.37 3aeq s PRO 383 Ca 0.33 0.89 -0.07 0.00 0.04 0.00 0.00 61.00 62.18 3aeq s PRO 383 Cb 0.04 -2.09 -0.07 0.00 0.04 0.00 0.00 34.50 32.42 3aeq s PRO 383 CO -0.03 -0.54 1.35 0.00 0.04 0.00 0.00 177.00 177.82 3aeq h ALA 384 N 0.15 0.42 -2.47 8.56 0.00 -1.95 -3.45 119.26 120.52 3aeq h ALA 384 Ca -0.45 -0.63 -0.50 0.00 0.00 0.00 0.00 54.91 53.33 3aeq h ALA 384 Cb 1.19 -0.03 0.08 0.00 0.00 0.00 0.00 17.79 19.04 3aeq h ALA 384 CO 0.61 0.74 0.39 -0.98 0.00 0.00 0.00 179.25 180.01 3aeq s ARG 385 N -3.58 3.13 0.17 0.00 1.70 -1.26 -4.97 118.95 114.15 3aeq s ARG 385 Ca -0.08 1.42 -0.31 0.00 -0.47 0.00 0.00 55.73 56.29 3aeq s ARG 385 Cb 0.09 -1.99 -0.10 0.00 -0.57 0.00 0.00 34.95 32.38 3aeq s ARG 385 CO 0.87 -0.99 1.56 -0.47 -1.08 0.00 0.00 175.30 175.19 3aeq s TYR 386 N -2.17 3.06 -0.47 5.89 6.14 -1.26 -4.96 117.35 123.58 3aeq s TYR 386 Ca 0.68 0.65 0.06 0.00 0.64 0.00 0.00 57.07 59.10 3aeq s TYR 386 Cb -0.20 -3.92 0.30 0.00 0.42 0.00 0.00 41.96 38.56 3aeq s TYR 386 CO 0.35 -3.37 1.06 0.00 0.64 0.00 0.00 175.55 174.23 3aeq n ALA 387 N 3.86 -0.92 -1.14 3.97 0.00 -1.26 -5.12 120.51 119.90 3aeq n ALA 387 Ca 0.13 -1.46 -0.30 0.00 0.00 0.00 0.00 53.44 51.81 3aeq n ALA 387 Cb 0.39 -1.20 0.14 0.00 0.00 0.00 0.00 19.45 18.78 3aeq n ALA 387 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3aeq s PRO 388 N 0.35 1.20 -0.21 0.00 0.04 -1.26 -4.87 135.00 130.25 3aeq s PRO 388 Ca 0.25 0.90 0.07 0.00 0.04 0.00 0.00 61.00 62.25 3aeq s PRO 388 Cb 0.28 -1.80 -0.21 0.00 0.04 0.00 0.00 34.50 32.81 3aeq s PRO 388 CO -0.10 -2.30 -0.00 1.04 0.04 0.00 0.00 177.00 175.68 3aeq n GLN 389 N -3.93 0.67 -2.16 4.56 1.13 -1.26 -4.33 117.38 112.06 3aeq n GLN 389 Ca 0.07 0.12 -0.33 0.00 -1.94 0.00 0.00 57.00 54.92 3aeq n GLN 389 Cb 0.55 -1.56 -0.00 0.00 0.11 0.00 0.00 30.24 29.34 3aeq n GLN 389 CO 0.00 0.00 0.00 -1.64 -1.44 0.00 0.00 177.06 173.98 3aeq s MET 390 N -2.52 3.45 3.15 -1.09 -1.94 -1.26 -3.76 119.30 115.33 3aeq s MET 390 Ca -0.23 1.21 0.00 0.00 -1.71 0.00 0.00 55.69 54.96 3aeq s MET 390 Cb 0.08 -2.05 0.00 0.00 2.01 0.00 0.00 34.83 34.87 3aeq s MET 390 CO 0.71 -0.70 0.00 0.41 -0.01 0.00 0.00 175.02 175.43 3aeq n GLY 391 N -0.90 0.33 0.14 -0.03 0.00 0.68 -2.09 105.19 103.31 3aeq n GLY 391 Ca 0.09 -0.89 -0.18 0.00 0.00 0.00 0.00 46.02 45.04 3aeq n GLY 391 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 3aeq h PHE 392 N 0.00 0.61 0.00 1.61 0.04 -1.91 -0.89 116.94 116.40 3aeq h PHE 392 Ca 0.00 -0.34 -0.03 0.00 2.80 0.00 0.00 57.97 60.39 3aeq h PHE 392 Cb 0.00 -0.06 -0.00 0.00 2.20 0.00 0.00 35.95 38.08 3aeq h PHE 392 CO 0.00 1.17 -0.16 1.49 -0.60 0.00 0.00 178.31 180.21 3aeq h GLU 393 N -0.13 0.00 -0.28 1.51 4.57 -1.90 -2.56 114.58 115.80 3aeq h GLU 393 Ca -0.08 0.00 -0.10 0.00 -1.18 0.00 0.00 59.36 58.00 3aeq h GLU 393 Cb 1.36 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.94 3aeq h GLU 393 CO 0.12 0.16 -0.22 0.78 -1.18 0.00 0.00 179.01 178.68 3aeq h GLY 394 N 2.76 0.69 2.00 1.92 0.00 -1.42 -2.42 103.07 106.60 3aeq h GLY 394 Ca -0.00 -0.67 -0.01 0.00 0.00 0.00 0.00 47.33 46.64 3aeq h GLY 394 CO 0.02 0.61 -0.07 0.00 0.00 0.00 0.00 176.54 177.11 3aeq h ALA 395 N 0.71 1.71 -0.02 3.60 0.00 -0.82 0.34 119.26 124.77 3aeq h ALA 395 Ca 0.05 -0.06 -0.13 0.00 0.00 0.00 0.00 54.91 54.77 3aeq h ALA 395 Cb 0.76 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 18.55 3aeq h ALA 395 CO 0.06 0.08 -0.49 -0.91 0.00 0.00 0.00 179.25 177.99 3aeq h ASN 396 N 0.00 0.47 -0.15 0.00 2.35 -1.43 -2.68 115.58 114.14 3aeq h ASN 396 Ca -0.00 -0.73 -0.01 0.00 -0.55 0.00 0.00 56.30 55.01 3aeq h ASN 396 Cb 0.13 -0.14 -0.01 0.00 0.05 0.00 0.00 38.32 38.35 3aeq h ASN 396 CO 0.01 1.14 0.08 0.58 -1.65 0.00 0.00 177.43 177.58 3aeq h VAL 397 N -0.15 1.12 -0.85 2.81 2.07 -0.79 -1.62 116.25 118.84 3aeq h VAL 397 Ca -0.06 -0.35 0.15 0.00 0.82 0.00 0.00 66.70 67.27 3aeq h VAL 397 Cb 1.20 1.07 -0.10 0.00 -1.52 0.00 0.00 31.29 31.94 3aeq h VAL 397 CO 0.10 0.11 0.43 -0.07 0.02 0.00 0.00 177.57 178.16 3aeq h LEU 398 N 0.12 0.51 0.62 2.57 3.38 -0.47 0.02 115.31 122.06 3aeq h LEU 398 Ca 0.05 0.10 -0.03 0.00 0.09 0.00 0.00 57.88 58.09 3aeq h LEU 398 Cb 0.11 0.02 0.01 0.00 0.09 0.00 0.00 40.66 40.89 3aeq h LEU 398 CO -0.01 0.20 -0.30 0.15 0.09 0.00 0.00 178.44 178.58 3aeq h PHE 399 N 0.60 -0.77 -0.74 1.13 3.57 -1.03 -2.38 116.94 117.32 3aeq h PHE 399 Ca 0.47 -0.02 0.16 0.00 3.53 0.00 0.00 57.97 62.11 3aeq h PHE 399 Cb 0.69 0.25 -0.10 0.00 2.79 0.00 0.00 35.95 39.58 3aeq h PHE 399 CO -0.10 -0.43 0.23 -0.44 -2.23 0.00 0.00 178.31 175.35 3aeq h ASP 400 N -1.08 0.12 -0.17 0.41 3.32 -1.10 -1.96 116.42 115.97 3aeq h ASP 400 Ca -0.08 0.13 -0.00 0.00 0.02 0.00 0.00 57.03 57.10 3aeq h ASP 400 Cb 0.68 0.15 -0.01 0.00 0.22 0.00 0.00 39.33 40.38 3aeq h ASP 400 CO 0.14 0.01 0.10 0.74 -1.72 0.00 0.00 179.24 178.51 3aeq h THR 401 N 0.34 1.08 -0.04 0.35 2.02 -0.99 -2.75 112.91 112.93 3aeq h THR 401 Ca 0.42 -0.22 -0.25 0.00 0.77 0.00 0.00 66.41 67.13 3aeq h THR 401 Cb 0.69 0.93 0.02 0.00 -1.74 0.00 0.00 68.15 68.05 3aeq h THR 401 CO -0.47 0.08 -0.97 -0.50 0.37 0.00 0.00 175.52 174.03 3aeq h TRP 402 N 0.18 1.03 0.00 3.16 4.06 -1.01 -3.22 115.95 120.15 3aeq h TRP 402 Ca 0.06 -0.53 -0.09 0.00 2.06 0.00 0.00 58.89 60.38 3aeq h TRP 402 Cb 0.04 -0.13 -0.01 0.00 -1.00 0.00 0.00 29.16 28.06 3aeq h TRP 402 CO -0.05 1.37 -0.44 0.28 -3.56 0.00 0.00 178.44 176.04 3aeq h VAL 403 N 0.42 1.12 -0.25 1.49 2.07 -1.42 -3.37 116.25 116.31 3aeq h VAL 403 Ca -0.11 -1.62 0.04 0.00 0.82 0.00 0.00 66.70 65.82 3aeq h VAL 403 Cb 1.62 1.93 -0.06 0.00 -1.52 0.00 0.00 31.29 33.25 3aeq h VAL 403 CO 0.19 0.43 -0.48 -0.74 0.02 0.00 0.00 177.57 176.99 3aeq h HIS 404 N 0.00 -1.46 0.00 1.57 6.17 -1.49 -2.16 115.15 117.78 3aeq h HIS 404 Ca -0.00 0.06 -0.05 0.00 0.71 0.00 0.00 60.37 61.09 3aeq h HIS 404 Cb 0.89 0.67 -0.01 0.00 2.52 0.00 0.00 27.41 31.48 3aeq h HIS 404 CO 0.00 -0.45 -0.24 -1.00 0.71 0.00 0.00 177.93 176.95 3aeq h PRO 405 N -0.42 0.00 -0.42 5.26 0.13 -1.77 -2.13 132.00 132.65 3aeq h PRO 405 Ca 0.05 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 65.09 3aeq h PRO 405 Cb 0.55 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.66 3aeq h PRO 405 CO -0.46 0.24 -0.08 -0.07 -0.23 0.00 0.00 178.00 177.39 3aeq h LEU 406 N 0.00 0.71 0.24 1.56 3.38 -1.61 -2.30 115.31 117.30 3aeq h LEU 406 Ca -0.00 -0.20 -0.01 0.00 0.09 0.00 0.00 57.88 57.76 3aeq h LEU 406 Cb 0.68 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.24 3aeq h LEU 406 CO 0.03 0.83 -0.12 -0.37 0.09 0.00 0.00 178.44 178.91 3aeq h VAL 407 N 0.67 0.24 0.00 1.22 -1.51 -0.94 -2.54 116.25 113.39 3aeq h VAL 407 Ca 0.12 -0.87 0.00 0.00 -1.23 0.00 0.00 66.70 64.72 3aeq h VAL 407 Cb 0.54 0.42 0.00 0.00 -2.13 0.00 0.00 31.29 30.12 3aeq h VAL 407 CO 0.03 0.07 0.00 0.23 -1.23 0.00 0.00 177.57 176.67 3aeq n MET 408 N -4.99 0.09 0.07 5.19 2.81 -0.86 0.17 117.12 119.60 3aeq n MET 408 Ca -0.05 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.84 3aeq n MET 408 Cb 0.18 -1.11 0.00 0.00 -0.71 0.00 0.00 33.22 31.59 3aeq n MET 408 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3aeq n GLY 409 N 0.53 -0.09 0.25 3.03 0.00 -0.87 -4.28 105.19 103.77 3aeq n GLY 409 Ca 0.00 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.12 3aeq n GLY 409 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3aeq h LEU 410 N 0.00 0.00 -0.82 0.99 5.85 -1.12 0.16 115.31 120.38 3aeq h LEU 410 Ca 0.00 0.00 -0.09 0.00 0.84 0.00 0.00 57.88 58.63 3aeq h LEU 410 Cb 0.00 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.02 3aeq h LEU 410 CO 0.00 0.15 -0.41 -0.08 -0.34 0.00 0.00 178.44 177.76 3aeq h GLU 411 N 0.00 0.00 0.00 1.25 4.57 0.15 -2.04 114.58 118.51 3aeq h GLU 411 Ca -0.00 0.00 -0.20 0.00 -1.18 0.00 0.00 59.36 57.98 3aeq h GLU 411 Cb 0.35 0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 28.91 3aeq h GLU 411 CO 0.02 0.41 -1.38 1.49 -1.18 0.00 0.00 179.01 178.37 3aeq h GLU 412 N 0.00 0.00 0.00 1.92 4.57 -1.45 -3.23 114.58 116.39 3aeq h GLU 412 Ca -0.00 0.00 -0.11 0.00 -1.18 0.00 0.00 59.36 58.07 3aeq h GLU 412 Cb 0.97 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 29.55 3aeq h GLU 412 CO 0.05 0.40 -0.52 0.45 -1.18 0.00 0.00 179.01 178.22 3aeq h HIS 413 N 0.00 0.00 0.06 0.92 3.86 -0.60 -2.50 115.15 116.89 3aeq h HIS 413 Ca -0.17 0.00 -0.24 0.00 -1.16 0.00 0.00 60.37 58.80 3aeq h HIS 413 Cb 1.68 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 30.15 3aeq h HIS 413 CO 0.00 0.52 -1.06 -0.07 0.86 0.00 0.00 177.93 178.18 3aeq h LEU 414 N 0.00 0.34 -1.24 2.43 3.38 -1.50 -0.51 115.31 118.21 3aeq h LEU 414 Ca -0.01 -0.32 -0.05 0.00 0.09 0.00 0.00 57.88 57.59 3aeq h LEU 414 Cb 1.02 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.65 3aeq h LEU 414 CO 0.07 1.19 -0.25 0.25 0.09 0.00 0.00 178.44 179.79 3aeq h LEU 415 N 0.10 0.00 0.19 1.67 5.85 -1.56 0.64 115.31 122.20 3aeq h LEU 415 Ca -0.08 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.63 3aeq h LEU 415 Cb 1.75 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.78 3aeq h LEU 415 CO 0.17 0.25 -0.09 0.74 -0.34 0.00 0.00 178.44 179.16 3aeq h THR 416 N 0.00 0.60 -0.88 1.05 2.02 -1.40 0.88 112.91 115.18 3aeq h THR 416 Ca -0.00 -1.06 0.22 0.00 0.77 0.00 0.00 66.41 66.34 3aeq h THR 416 Cb 0.70 1.03 -0.13 0.00 -1.74 0.00 0.00 68.15 68.00 3aeq h THR 416 CO 0.03 0.16 0.34 -0.03 0.37 0.00 0.00 175.52 176.40 3aeq h MET 417 N -0.95 0.33 0.21 6.66 1.85 -0.68 -0.53 114.93 121.83 3aeq h MET 417 Ca -0.03 -0.02 -0.33 0.00 -0.61 0.00 0.00 59.70 58.72 3aeq h MET 417 Cb 0.46 -0.07 0.02 0.00 0.43 0.00 0.00 31.60 32.44 3aeq h MET 417 CO 0.04 0.22 -1.52 0.74 -0.40 0.00 0.00 176.91 175.99 3aeq h PHE 418 N 0.34 0.83 0.00 1.39 0.04 0.21 -3.50 116.94 116.24 3aeq h PHE 418 Ca 0.55 -0.60 0.00 0.00 2.80 0.00 0.00 57.97 60.72 3aeq h PHE 418 Cb 1.05 -0.03 0.00 0.00 2.20 0.00 0.00 35.95 39.17 3aeq h PHE 418 CO -0.17 1.59 0.00 0.54 -0.60 0.00 0.00 178.31 179.66