#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3brw s ARG 2 N 0.00 3.54 -0.19 3.17 3.52 -1.25 -4.83 118.95 122.90 3brw s ARG 2 Ca 0.00 0.69 -0.05 0.00 -0.13 0.00 0.00 55.73 56.24 3brw s ARG 2 Cb 0.00 -2.10 -0.03 0.00 -1.56 0.00 0.00 34.95 31.27 3brw s ARG 2 CO 0.00 -0.58 -0.00 -1.21 -0.81 0.00 0.00 175.30 172.70 3brw s GLU 3 N -5.16 3.65 -0.21 5.12 2.02 -1.26 -1.71 118.70 121.15 3brw s GLU 3 Ca 0.55 -0.51 -0.03 0.00 0.02 0.00 0.00 54.97 55.00 3brw s GLU 3 Cb -0.11 -3.07 -0.00 0.00 0.10 0.00 0.00 34.13 31.05 3brw s GLU 3 CO 0.53 0.06 -0.07 0.71 0.02 0.00 0.00 175.26 176.51 3brw s TYR 4 N 0.87 2.92 -0.55 1.61 2.02 -1.15 -5.02 117.35 118.05 3brw s TYR 4 Ca 0.01 -1.07 -0.18 0.00 -0.37 0.00 0.00 57.07 55.45 3brw s TYR 4 Cb -0.14 -2.07 0.10 0.00 -0.40 0.00 0.00 41.96 39.45 3brw s TYR 4 CO 0.02 -0.60 0.61 0.15 -1.57 0.00 0.00 175.55 174.17 3brw s LYS 5 N 1.43 3.04 -0.07 -0.62 1.02 -1.26 -1.18 119.74 122.10 3brw s LYS 5 Ca 0.05 -1.32 -0.03 0.00 0.02 0.00 0.00 55.97 54.70 3brw s LYS 5 Cb -0.14 -4.22 -0.04 0.00 -0.52 0.00 0.00 37.83 32.91 3brw s LYS 5 CO -0.05 -1.38 0.06 -0.51 -0.92 0.00 0.00 175.35 172.55 3brw s LEU 6 N 2.34 3.86 -0.13 3.17 1.43 0.26 -0.76 118.68 128.85 3brw s LEU 6 Ca 0.10 0.22 0.00 0.00 -1.03 0.00 0.00 54.13 53.41 3brw s LEU 6 Cb -0.24 -2.02 0.02 0.00 0.03 0.00 0.00 46.19 43.98 3brw s LEU 6 CO 0.07 0.35 -0.12 -0.69 0.23 0.00 0.00 176.35 176.19 3brw s VAL 7 N -1.01 1.34 -0.30 -1.59 1.01 -0.01 -0.52 120.40 119.31 3brw s VAL 7 Ca 0.17 -0.49 -0.10 0.00 0.00 0.00 0.00 61.98 61.55 3brw s VAL 7 Cb -0.12 -1.29 -0.02 0.00 0.00 0.00 0.00 36.38 34.96 3brw s VAL 7 CO 0.06 0.42 0.16 0.54 0.00 0.00 0.00 175.10 176.28 3brw s VAL 8 N 1.52 4.76 0.22 2.92 0.11 -0.66 -0.94 120.40 128.32 3brw s VAL 8 Ca 0.04 -0.28 0.03 0.00 -2.93 0.00 0.00 61.98 58.84 3brw s VAL 8 Cb -0.13 -3.38 -0.05 0.00 -1.53 0.00 0.00 36.38 31.29 3brw s VAL 8 CO -0.09 0.12 -0.00 -1.48 -3.33 0.00 0.00 175.10 170.32 3brw s LEU 9 N 1.65 2.17 0.00 2.54 0.05 0.05 -2.77 118.68 122.36 3brw s LEU 9 Ca 0.05 -1.21 0.00 0.00 0.05 0.00 0.00 54.13 53.02 3brw s LEU 9 Cb -0.17 -0.23 0.00 0.00 -2.05 0.00 0.00 46.19 43.74 3brw s LEU 9 CO 0.07 -0.52 0.00 0.61 -0.55 0.00 0.00 176.35 175.96 3brw n GLY 10 N -0.39 1.33 3.94 -3.48 0.00 -1.26 -1.22 105.19 104.11 3brw n GLY 10 Ca -0.05 -1.44 -0.28 0.00 0.00 0.00 0.00 46.02 44.25 3brw n GLY 10 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3brw s SER 11 N 0.00 3.59 0.31 1.61 1.04 -1.26 -4.12 113.70 114.86 3brw s SER 11 Ca 0.00 0.23 -0.29 0.00 0.48 0.00 0.00 55.95 56.38 3brw s SER 11 Cb 0.00 -0.42 -0.13 0.00 0.10 0.00 0.00 66.02 65.57 3brw s SER 11 CO 0.00 -2.42 1.30 0.61 0.98 0.00 0.00 173.24 173.71 3brw n GLY 12 N -3.51 0.57 2.66 7.32 0.00 -1.25 -3.51 105.19 107.47 3brw n GLY 12 Ca 0.14 0.37 -0.12 0.00 0.00 0.00 0.00 46.02 46.40 3brw n GLY 12 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3brw n GLY 13 N 1.19 1.20 0.10 -0.02 0.00 -1.26 -4.85 105.19 101.55 3brw n GLY 13 Ca 0.07 -0.09 0.13 0.00 0.00 0.00 0.00 46.02 46.13 3brw n GLY 13 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3brw n VAL 14 N -2.34 0.59 0.00 1.61 0.24 -1.23 -4.91 118.33 112.29 3brw n VAL 14 Ca -0.12 -0.14 0.00 0.00 -2.04 0.00 0.00 64.34 62.04 3brw n VAL 14 Cb 0.55 -0.70 0.00 0.00 -1.47 0.00 0.00 33.84 32.22 3brw n VAL 14 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3brw n GLY 15 N 1.04 1.14 0.12 7.63 0.00 -1.26 -4.59 105.19 109.27 3brw n GLY 15 Ca 0.05 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.90 3brw n GLY 15 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3brw h LYS 16 N 0.00 0.31 -0.46 1.61 1.57 -1.91 -0.52 116.57 117.16 3brw h LYS 16 Ca 0.00 -0.37 -0.04 0.00 -1.87 0.00 0.00 60.65 58.37 3brw h LYS 16 Cb 0.00 0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.40 3brw h LYS 16 CO 0.00 1.08 0.12 0.77 -0.57 0.00 0.00 179.45 180.84 3brw h SER 17 N -0.30 0.69 0.73 0.86 0.02 -1.96 -2.30 113.55 111.29 3brw h SER 17 Ca -0.07 -0.23 -0.03 0.00 -0.84 0.00 0.00 61.79 60.62 3brw h SER 17 Cb 1.28 -0.18 -0.01 0.00 0.14 0.00 0.00 62.40 63.63 3brw h SER 17 CO 0.10 0.74 -0.48 0.00 -1.14 0.00 0.00 176.83 176.05 3brw h ALA 18 N 0.98 -1.25 -0.91 3.77 0.00 -1.89 0.35 119.26 120.31 3brw h ALA 18 Ca 0.14 -0.24 0.26 0.00 0.00 0.00 0.00 54.91 55.08 3brw h ALA 18 Cb 0.32 0.62 -0.04 0.00 0.00 0.00 0.00 17.79 18.69 3brw h ALA 18 CO 0.00 -1.22 0.65 -0.07 0.00 0.00 0.00 179.25 178.62 3brw h LEU 19 N -1.15 0.01 0.00 0.00 3.38 -1.12 -0.40 115.31 116.04 3brw h LEU 19 Ca -0.10 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.79 3brw h LEU 19 Cb 0.93 -0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.67 3brw h LEU 19 CO 0.08 0.00 -0.46 0.74 0.09 0.00 0.00 178.44 178.89 3brw h THR 20 N 0.01 1.41 0.00 0.22 2.02 -0.88 -2.92 112.91 112.78 3brw h THR 20 Ca 0.43 -2.24 -0.06 0.00 0.77 0.00 0.00 66.41 65.32 3brw h THR 20 Cb 1.72 2.85 -0.01 0.00 -1.74 0.00 0.00 68.15 70.97 3brw h THR 20 CO -0.01 0.48 -0.27 -0.37 0.37 0.00 0.00 175.52 175.72 3brw h VAL 21 N -1.00 1.04 -0.38 3.16 -1.51 -0.71 0.01 116.25 116.87 3brw h VAL 21 Ca -0.13 -0.98 -0.05 0.00 -1.23 0.00 0.00 66.70 64.32 3brw h VAL 21 Cb 1.08 1.55 -0.01 0.00 -2.13 0.00 0.00 31.29 31.77 3brw h VAL 21 CO -0.08 0.26 0.06 -0.61 -1.23 0.00 0.00 177.57 175.98 3brw h GLN 22 N 0.00 0.62 -0.26 5.19 5.75 -1.03 0.20 115.11 125.59 3brw h GLN 22 Ca -0.00 -0.17 -0.06 0.00 -0.15 0.00 0.00 58.65 58.27 3brw h GLN 22 Cb 0.53 -0.07 -0.01 0.00 1.07 0.00 0.00 27.48 29.00 3brw h GLN 22 CO 0.04 0.69 -0.08 0.35 -2.65 0.00 0.00 178.83 177.17 3brw h PHE 23 N 0.47 0.58 0.22 3.99 3.57 -1.19 0.13 116.94 124.71 3brw h PHE 23 Ca 0.11 -0.13 -0.35 0.00 3.53 0.00 0.00 57.97 61.14 3brw h PHE 23 Cb 0.37 -0.14 0.02 0.00 2.79 0.00 0.00 35.95 38.99 3brw h PHE 23 CO 0.03 0.74 -1.63 -0.39 -2.23 0.00 0.00 178.31 174.82 3brw h VAL 24 N 0.25 1.09 -0.01 1.41 -1.51 -1.02 -3.38 116.25 113.08 3brw h VAL 24 Ca 0.06 -2.60 0.00 0.00 -1.23 0.00 0.00 66.70 62.93 3brw h VAL 24 Cb 0.56 2.89 0.00 0.00 -2.13 0.00 0.00 31.29 32.61 3brw h VAL 24 CO 0.03 0.84 -0.16 0.00 -1.23 0.00 0.00 177.57 177.05 3brw n GLN 25 N -3.64 1.74 -2.39 5.19 6.02 0.68 -5.00 117.38 119.97 3brw n GLN 25 Ca -0.21 -0.71 -0.21 0.00 -0.01 0.00 0.00 57.00 55.86 3brw n GLN 25 Cb 1.09 -1.10 -0.01 0.00 1.02 0.00 0.00 30.24 31.24 3brw n GLN 25 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3brw n GLY 26 N 0.82 -0.46 3.23 1.08 0.00 0.03 -4.96 105.19 104.93 3brw n GLY 26 Ca 0.04 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.79 3brw n GLY 26 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3brw s ILE 27 N -3.04 1.67 -0.36 -0.61 -1.09 -1.23 -4.96 121.20 111.59 3brw s ILE 27 Ca 0.00 -0.91 -0.19 0.00 -2.23 0.00 0.00 60.65 57.32 3brw s ILE 27 Cb 0.00 -1.39 0.00 0.00 -1.58 0.00 0.00 42.46 39.49 3brw s ILE 27 CO 0.00 0.47 0.56 0.12 -1.23 0.00 0.00 174.94 174.87 3brw s PHE 28 N -0.50 3.16 -0.08 3.97 5.36 -1.26 -3.17 117.98 125.46 3brw s PHE 28 Ca 0.08 0.22 -0.28 0.00 -0.96 0.00 0.00 56.93 55.99 3brw s PHE 28 Cb -0.08 -3.02 -0.02 0.00 -0.34 0.00 0.00 43.02 39.55 3brw s PHE 28 CO -0.01 -0.59 0.93 0.08 -1.46 0.00 0.00 175.22 174.18 3brw s VAL 29 N 2.53 4.86 -0.09 3.12 1.01 -1.26 -4.93 120.40 125.63 3brw s VAL 29 Ca 0.21 1.91 0.07 0.00 0.00 0.00 0.00 61.98 64.17 3brw s VAL 29 Cb -0.15 -4.26 -0.10 0.00 0.00 0.00 0.00 36.38 31.87 3brw s VAL 29 CO 0.14 0.08 0.02 -1.84 0.00 0.00 0.00 175.10 173.51 3brw n GLU 30 N 4.56 2.44 -2.54 2.72 0.28 -1.26 -4.86 120.64 121.98 3brw n GLU 30 Ca 0.06 -0.00 -0.41 0.00 -0.16 0.00 0.00 57.16 56.65 3brw n GLU 30 Cb 0.50 -1.22 -0.04 0.00 1.43 0.00 0.00 31.44 32.10 3brw n GLU 30 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 177.13 177.18 3brw s LYS 31 N -2.21 4.65 -0.56 3.44 2.20 -1.26 -4.99 119.74 121.01 3brw s LYS 31 Ca -0.05 1.71 -0.23 0.00 -0.36 0.00 0.00 55.97 57.03 3brw s LYS 31 Cb 0.03 -3.25 0.05 0.00 -1.51 0.00 0.00 37.83 33.14 3brw s LYS 31 CO 0.35 0.18 0.91 -0.47 -0.36 0.00 0.00 175.35 175.96 3brw s TYR 32 N -0.65 2.81 -0.61 4.03 5.04 -1.26 -4.97 117.35 121.74 3brw s TYR 32 Ca 0.47 -0.13 0.04 0.00 -2.44 0.00 0.00 57.07 55.01 3brw s TYR 32 Cb -0.30 -4.03 0.15 0.00 0.35 0.00 0.00 41.96 38.13 3brw s TYR 32 CO 0.36 -1.34 0.37 0.34 -1.34 0.00 0.00 175.55 173.94 3brw s ASP 33 N 2.91 4.57 0.04 4.32 2.15 -1.26 -5.08 116.67 124.32 3brw s ASP 33 Ca 0.28 -3.40 -0.38 0.00 0.43 0.00 0.00 52.55 49.48 3brw s ASP 33 Cb -0.14 -1.64 -0.17 0.00 -0.30 0.00 0.00 42.92 40.66 3brw s ASP 33 CO 0.17 -0.17 1.31 -2.65 -0.17 0.00 0.00 175.17 173.67 3brw n PRO 34 N 2.59 0.89 -3.70 4.34 -0.02 -1.26 -4.92 135.00 132.92 3brw n PRO 34 Ca 0.12 0.32 -0.33 0.00 -2.02 0.00 0.00 63.50 61.58 3brw n PRO 34 Cb 0.33 -1.93 -0.05 0.00 -0.02 0.00 0.00 33.50 31.83 3brw n PRO 34 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 3brw s THR 35 N 0.60 5.21 -0.14 3.45 -4.23 -1.26 -5.01 115.64 114.27 3brw s THR 35 Ca 0.87 0.16 -0.08 0.00 -1.18 0.00 0.00 61.69 61.46 3brw s THR 35 Cb -1.04 -3.61 -0.03 0.00 1.34 0.00 0.00 72.50 69.16 3brw s THR 35 CO 0.51 0.23 -0.13 0.40 -0.54 0.00 0.00 174.62 175.09 3brw h ILE 36 N 2.63 0.04 -1.59 2.99 2.04 -1.90 -3.40 117.51 118.33 3brw h ILE 36 Ca -0.48 -1.05 0.11 0.00 1.00 0.00 0.00 64.86 64.44 3brw h ILE 36 Cb 1.18 0.10 -0.23 0.00 -0.74 0.00 0.00 36.82 37.13 3brw h ILE 36 CO 0.69 0.01 0.11 -0.70 0.00 0.00 0.00 178.15 178.26 3brw s GLU 37 N -2.12 0.47 0.18 2.37 2.12 -1.26 -3.03 118.70 117.43 3brw s GLU 37 Ca -0.13 1.03 0.08 0.00 0.36 0.00 0.00 54.97 56.31 3brw s GLU 37 Cb 0.02 0.46 -0.04 0.00 0.26 0.00 0.00 34.13 34.82 3brw s GLU 37 CO 0.19 -0.14 -0.16 -0.51 -0.54 0.00 0.00 175.26 174.11 3brw s ASP 38 N 2.24 2.56 -0.11 -1.70 1.01 -1.05 -5.04 116.67 114.59 3brw s ASP 38 Ca -0.06 -0.93 -0.10 0.00 0.71 0.00 0.00 52.55 52.18 3brw s ASP 38 Cb -0.07 -0.14 0.03 0.00 1.01 0.00 0.00 42.92 43.75 3brw s ASP 38 CO -0.18 -0.11 0.29 -0.94 0.21 0.00 0.00 175.17 174.45 3brw s SER 39 N -2.94 -0.31 0.12 0.27 1.04 -1.26 -0.89 113.70 109.74 3brw s SER 39 Ca 0.18 0.59 0.06 0.00 0.48 0.00 0.00 55.95 57.27 3brw s SER 39 Cb -0.03 0.59 -0.04 0.00 0.10 0.00 0.00 66.02 66.63 3brw s SER 39 CO 0.06 -0.11 -0.15 -0.31 0.98 0.00 0.00 173.24 173.71 3brw s TYR 40 N 0.31 1.47 -0.23 5.02 1.51 -0.65 -4.98 117.35 119.79 3brw s TYR 40 Ca -0.01 -0.53 0.01 0.00 -1.01 0.00 0.00 57.07 55.52 3brw s TYR 40 Cb -0.03 -0.77 0.06 0.00 -0.11 0.00 0.00 41.96 41.11 3brw s TYR 40 CO -0.01 0.17 -0.06 -0.98 -1.11 0.00 0.00 175.55 173.56 3brw s ARG 41 N -2.60 1.66 0.42 -0.62 1.70 -1.26 -0.56 118.95 117.69 3brw s ARG 41 Ca 0.09 -0.98 0.07 0.00 -0.47 0.00 0.00 55.73 54.44 3brw s ARG 41 Cb -0.05 -2.57 0.01 0.00 -0.57 0.00 0.00 34.95 31.76 3brw s ARG 41 CO 0.03 -0.58 0.58 0.15 -1.08 0.00 0.00 175.30 174.40 3brw s LYS 42 N 1.39 2.87 -0.22 3.89 1.02 -0.36 -4.95 119.74 123.39 3brw s LYS 42 Ca -0.05 -1.10 -0.02 0.00 0.02 0.00 0.00 55.97 54.81 3brw s LYS 42 Cb -0.19 -2.73 0.07 0.00 -0.52 0.00 0.00 37.83 34.46 3brw s LYS 42 CO -0.06 -0.25 0.04 -1.14 -0.92 0.00 0.00 175.35 173.02 3brw s GLN 43 N -4.37 0.77 0.06 1.68 -0.44 -1.26 -1.27 119.66 114.83 3brw s GLN 43 Ca 0.53 -0.59 -0.16 0.00 -2.50 0.00 0.00 55.36 52.64 3brw s GLN 43 Cb -0.10 -2.13 0.03 0.00 -1.64 0.00 0.00 33.01 29.17 3brw s GLN 43 CO 0.33 -0.70 0.38 0.54 0.50 0.00 0.00 175.29 176.35 3brw s VAL 44 N 1.77 0.07 -0.09 1.34 0.11 -0.78 -5.04 120.40 117.78 3brw s VAL 44 Ca 0.00 -0.55 -0.09 0.00 -2.93 0.00 0.00 61.98 58.41 3brw s VAL 44 Cb -0.17 -1.00 -0.04 0.00 -1.53 0.00 0.00 36.38 33.63 3brw s VAL 44 CO -0.11 -0.30 0.21 -1.83 -3.33 0.00 0.00 175.10 169.74 3brw s GLU 45 N -2.80 3.57 -0.23 1.54 -1.05 -1.26 -1.72 118.70 116.75 3brw s GLU 45 Ca -0.03 0.01 -0.01 0.00 -0.15 0.00 0.00 54.97 54.79 3brw s GLU 45 Cb -0.00 -3.20 0.07 0.00 -0.44 0.00 0.00 34.13 30.56 3brw s GLU 45 CO -0.05 0.75 0.03 0.14 0.95 0.00 0.00 175.26 177.08 3brw s VAL 46 N -1.03 0.89 -0.11 1.83 -7.23 -1.15 -4.93 120.40 108.66 3brw s VAL 46 Ca 0.17 -0.94 -0.07 0.00 -1.81 0.00 0.00 61.98 59.33 3brw s VAL 46 Cb -0.13 -1.40 0.01 0.00 0.56 0.00 0.00 36.38 35.42 3brw s VAL 46 CO 0.06 -0.29 0.12 -0.90 -0.31 0.00 0.00 175.10 173.79 3brw n ASP 47 N 4.90 -6.52 0.00 4.85 3.85 -1.26 -3.89 116.55 118.48 3brw n ASP 47 Ca -0.08 0.39 0.00 0.00 -0.71 0.00 0.00 54.79 54.39 3brw n ASP 47 Cb 0.45 -1.93 0.00 0.00 -1.35 0.00 0.00 41.12 38.29 3brw n ASP 47 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 3brw n ALA 48 N 0.97 0.00 -2.04 2.12 0.00 -1.26 -4.75 120.51 115.56 3brw n ALA 48 Ca -0.01 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 53.00 3brw n ALA 48 Cb 0.49 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.92 3brw n ALA 48 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 3brw s GLN 49 N 0.00 3.72 0.00 0.00 2.00 -1.25 -5.00 119.66 119.14 3brw s GLN 49 Ca 0.00 1.72 -0.01 0.00 -2.00 0.00 0.00 55.36 55.07 3brw s GLN 49 Cb 0.00 -4.08 -0.04 0.00 0.80 0.00 0.00 33.01 29.69 3brw s GLN 49 CO 0.00 -1.39 0.14 1.14 -0.50 0.00 0.00 175.29 174.68 3brw s GLN 50 N 4.88 3.25 0.17 1.67 -2.07 -1.26 -2.95 119.66 123.34 3brw s GLN 50 Ca 0.75 -0.42 0.06 0.00 -1.82 0.00 0.00 55.36 53.93 3brw s GLN 50 Cb -0.26 -2.97 -0.04 0.00 -1.09 0.00 0.00 33.01 28.64 3brw s GLN 50 CO 0.31 0.65 -0.12 0.00 -1.32 0.00 0.00 175.29 174.81 3brw s MET 52 N -3.64 1.16 -0.11 0.00 1.75 -0.69 -1.87 119.30 115.88 3brw s MET 52 Ca 0.18 -1.47 -0.16 0.00 -1.25 0.00 0.00 55.69 52.99 3brw s MET 52 Cb 0.01 -2.64 -0.05 0.00 2.84 0.00 0.00 34.83 34.99 3brw s MET 52 CO 0.03 -0.94 0.40 -0.51 -0.65 0.00 0.00 175.02 173.35 3brw s LEU 53 N 1.24 4.30 -0.25 4.11 1.02 -0.39 -2.91 118.68 125.79 3brw s LEU 53 Ca 0.09 0.73 -0.07 0.00 0.02 0.00 0.00 54.13 54.91 3brw s LEU 53 Cb -0.18 -2.57 -0.02 0.00 0.02 0.00 0.00 46.19 43.44 3brw s LEU 53 CO -0.15 0.08 0.05 -0.70 0.02 0.00 0.00 176.35 175.65 3brw s GLU 54 N 0.31 3.52 -0.18 1.70 2.12 -0.33 -1.22 118.70 124.62 3brw s GLU 54 Ca 0.22 -0.56 -0.06 0.00 0.36 0.00 0.00 54.97 54.93 3brw s GLU 54 Cb -0.15 -3.27 -0.04 0.00 0.26 0.00 0.00 34.13 30.94 3brw s GLU 54 CO 0.09 -0.23 0.03 0.42 -0.54 0.00 0.00 175.26 175.03 3brw s ILE 55 N 1.57 4.46 -0.34 -3.70 -1.09 0.28 -0.58 121.20 121.80 3brw s ILE 55 Ca 0.06 -0.15 -0.10 0.00 -2.23 0.00 0.00 60.65 58.23 3brw s ILE 55 Cb -0.15 -3.00 0.01 0.00 -1.58 0.00 0.00 42.46 37.74 3brw s ILE 55 CO 0.02 0.46 0.18 -0.22 -1.23 0.00 0.00 174.94 174.15 3brw s LEU 56 N 0.44 4.42 -0.65 2.97 2.96 0.32 -1.64 118.68 127.50 3brw s LEU 56 Ca 0.01 -0.77 -0.21 0.00 -0.22 0.00 0.00 54.13 52.94 3brw s LEU 56 Cb -0.13 -2.01 0.08 0.00 0.50 0.00 0.00 46.19 44.63 3brw s LEU 56 CO 0.01 -0.29 0.90 -0.62 -1.32 0.00 0.00 176.35 175.03 3brw s ASP 57 N 1.58 6.20 0.74 3.68 2.15 -0.07 -1.66 116.67 129.29 3brw s ASP 57 Ca 0.03 -1.17 -0.11 0.00 0.43 0.00 0.00 52.55 51.73 3brw s ASP 57 Cb -0.18 -2.38 0.04 0.00 -0.30 0.00 0.00 42.92 40.09 3brw s ASP 57 CO 0.06 -1.33 1.11 0.42 -0.17 0.00 0.00 175.17 175.27 3brw s THR 58 N 3.60 2.92 0.43 1.71 -4.23 -1.12 -2.51 115.64 116.43 3brw s THR 58 Ca 0.19 0.26 -0.22 0.00 -1.18 0.00 0.00 61.69 60.74 3brw s THR 58 Cb -0.18 -3.29 -0.09 0.00 1.34 0.00 0.00 72.50 70.28 3brw s THR 58 CO 0.08 -0.37 1.02 0.00 -0.54 0.00 0.00 174.62 174.80 3brw s ALA 59 N -3.42 3.02 -0.29 3.99 0.00 -1.17 -4.89 121.76 119.00 3brw s ALA 59 Ca 0.59 0.59 0.19 0.00 0.00 0.00 0.00 51.96 53.34 3brw s ALA 59 Cb -0.11 -3.23 0.19 0.00 0.00 0.00 0.00 23.12 19.97 3brw s ALA 59 CO 0.50 -0.14 1.52 0.78 0.00 0.00 0.00 175.76 178.42 3brw h GLY 60 N 2.14 0.00 -1.36 0.00 0.00 -1.78 -3.44 103.07 98.64 3brw h GLY 60 Ca -0.49 0.00 -0.52 0.00 0.00 0.00 0.00 47.33 46.32 3brw h GLY 60 CO 0.61 0.00 0.28 -1.08 0.00 0.00 0.00 176.54 176.36 3brw s THR 61 N -3.08 2.65 -0.33 4.70 -1.32 -1.26 -3.77 115.64 113.22 3brw s THR 61 Ca 0.05 0.22 0.07 0.00 -1.21 0.00 0.00 61.69 60.83 3brw s THR 61 Cb 0.06 -2.51 0.50 0.00 -1.51 0.00 0.00 72.50 69.05 3brw s THR 61 CO 0.71 -0.26 1.49 1.21 -2.21 0.00 0.00 174.62 175.56 3brw n GLU 62 N -3.72 2.11 0.02 7.08 2.13 -1.26 -4.92 120.64 122.09 3brw n GLU 62 Ca 0.11 -3.32 -0.01 0.00 0.66 0.00 0.00 57.16 54.60 3brw n GLU 62 Cb 0.52 -1.92 -0.01 0.00 0.27 0.00 0.00 31.44 30.31 3brw n GLU 62 CO 0.00 0.00 0.00 0.37 -0.41 0.00 0.00 177.13 177.09 3brw h GLN 63 N 1.21 -0.07 -4.42 5.31 4.15 -1.95 -3.41 115.11 115.93 3brw h GLN 63 Ca 0.29 0.00 -0.71 0.00 0.77 0.00 0.00 58.65 59.00 3brw h GLN 63 Cb 1.63 0.02 -0.06 0.00 0.21 0.00 0.00 27.48 29.28 3brw h GLN 63 CO 0.55 -0.05 2.82 1.19 -1.93 0.00 0.00 178.83 181.41 3brw n PHE 64 N -2.47 3.80 -0.35 3.99 3.72 -1.26 -4.86 117.46 120.02 3brw n PHE 64 Ca -0.01 -2.94 -0.01 0.00 -0.05 0.00 0.00 57.45 54.43 3brw n PHE 64 Cb 0.03 -2.53 0.03 0.00 -0.94 0.00 0.00 39.48 36.07 3brw n PHE 64 CO 0.00 0.00 0.00 2.41 -0.05 0.00 0.00 176.76 179.12 3brw n THR 65 N 5.29 -0.49 0.25 4.37 -1.04 -1.26 -0.47 114.28 120.93 3brw n THR 65 Ca 0.50 2.15 -0.16 0.00 -2.04 0.00 0.00 64.05 64.51 3brw n THR 65 Cb 0.41 -2.84 -0.09 0.00 -1.82 0.00 0.00 70.33 65.99 3brw n THR 65 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3brw h ALA 66 N 1.23 -1.10 -0.03 2.41 0.00 -1.99 0.04 119.26 119.81 3brw h ALA 66 Ca 0.31 -0.17 0.02 0.00 0.00 0.00 0.00 54.91 55.07 3brw h ALA 66 Cb 0.54 0.67 -0.02 0.00 0.00 0.00 0.00 17.79 18.99 3brw h ALA 66 CO -0.91 -1.13 -0.06 1.98 0.00 0.00 0.00 179.25 179.14 3brw h MET 67 N -0.88 -0.08 -0.83 0.00 -1.53 -1.48 -2.18 114.93 107.96 3brw h MET 67 Ca -0.05 0.01 0.20 0.00 -3.44 0.00 0.00 59.70 56.41 3brw h MET 67 Cb 0.76 0.02 -0.12 0.00 -0.55 0.00 0.00 31.60 31.71 3brw h MET 67 CO -0.06 -0.05 0.28 0.00 0.14 0.00 0.00 176.91 177.22 3brw h ARG 68 N -0.08 0.31 -0.25 0.39 2.47 -0.71 -0.88 114.38 115.63 3brw h ARG 68 Ca 0.04 -0.02 -0.08 0.00 -1.26 0.00 0.00 59.98 58.66 3brw h ARG 68 Cb 0.13 -0.07 -0.01 0.00 -1.65 0.00 0.00 29.97 28.37 3brw h ARG 68 CO -0.08 0.21 -0.19 0.22 0.56 0.00 0.00 179.97 180.68 3brw h ASP 69 N 0.32 0.44 -0.03 7.04 3.58 -0.39 -2.74 116.42 124.64 3brw h ASP 69 Ca 0.50 -0.13 -0.04 0.00 0.42 0.00 0.00 57.03 57.78 3brw h ASP 69 Cb 0.92 -0.12 -0.01 0.00 1.72 0.00 0.00 39.33 41.84 3brw h ASP 69 CO -0.54 0.65 -0.08 -0.07 -2.88 0.00 0.00 179.24 176.31 3brw h LEU 70 N 0.41 0.25 -1.22 2.28 -0.00 -0.59 -1.56 115.31 114.87 3brw h LEU 70 Ca 0.07 -0.04 0.08 0.00 -0.00 0.00 0.00 57.88 57.98 3brw h LEU 70 Cb 0.57 -0.07 -0.06 0.00 -0.00 0.00 0.00 40.66 41.11 3brw h LEU 70 CO 0.04 0.37 0.56 1.88 -0.00 0.00 0.00 178.44 181.29 3brw h TYR 71 N 0.26 0.95 -0.48 1.13 0.05 -1.27 -2.72 116.97 114.88 3brw h TYR 71 Ca 0.06 0.02 -0.06 0.00 0.05 0.00 0.00 58.73 58.80 3brw h TYR 71 Cb 0.32 -0.31 -0.02 0.00 1.01 0.00 0.00 36.73 37.73 3brw h TYR 71 CO 0.01 0.47 0.07 0.52 -1.05 0.00 0.00 178.16 178.17 3brw h MET 72 N 0.91 0.81 0.30 4.88 2.86 -1.35 -2.17 114.93 121.18 3brw h MET 72 Ca 0.38 -0.22 -0.01 0.00 -2.06 0.00 0.00 59.70 57.79 3brw h MET 72 Cb 0.31 -0.09 0.00 0.00 0.06 0.00 0.00 31.60 31.88 3brw h MET 72 CO -0.15 0.82 -0.15 0.87 1.06 0.00 0.00 176.91 179.36 3brw h LYS 73 N 0.68 -0.39 0.00 1.72 1.57 -1.40 -3.33 116.57 115.42 3brw h LYS 73 Ca 0.15 0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.95 3brw h LYS 73 Cb 0.41 0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.81 3brw h LYS 73 CO 0.01 -0.26 0.00 0.09 -0.57 0.00 0.00 179.45 178.72 3brw n ASN 74 N -3.39 0.52 -4.77 0.86 3.02 -1.04 -4.75 115.26 105.72 3brw n ASN 74 Ca -0.05 0.66 -0.39 0.00 -0.03 0.00 0.00 54.58 54.77 3brw n ASN 74 Cb 0.16 -0.76 -0.04 0.00 -0.61 0.00 0.00 39.78 38.53 3brw n ASN 74 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 3brw s GLY 75 N -3.45 2.94 -0.26 7.41 0.00 -0.81 -4.90 107.32 108.25 3brw s GLY 75 Ca 0.03 0.81 -0.03 0.00 0.00 0.00 0.00 44.72 45.52 3brw s GLY 75 CO 0.31 1.34 -0.24 -1.06 0.00 0.00 0.00 173.10 173.45 3brw n GLN 76 N 0.69 0.64 -4.35 2.90 6.02 0.06 -4.98 117.38 118.35 3brw n GLN 76 Ca 0.01 0.19 -0.19 0.00 -0.01 0.00 0.00 57.00 57.00 3brw n GLN 76 Cb 0.47 -1.52 -0.14 0.00 1.02 0.00 0.00 30.24 30.07 3brw n GLN 76 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 3brw s GLY 77 N -6.18 0.67 -0.12 1.08 0.00 -1.13 -4.14 107.32 97.50 3brw s GLY 77 Ca -0.36 -0.70 0.00 0.00 0.00 0.00 0.00 44.72 43.67 3brw s GLY 77 CO 0.58 -0.67 -0.11 -1.36 0.00 0.00 0.00 173.10 171.54 3brw s PHE 78 N -0.71 1.75 -0.39 1.90 0.40 0.48 -0.83 117.98 120.58 3brw s PHE 78 Ca 0.01 -0.91 -0.17 0.00 -0.60 0.00 0.00 56.93 55.27 3brw s PHE 78 Cb -0.07 -1.36 0.01 0.00 0.51 0.00 0.00 43.02 42.11 3brw s PHE 78 CO 0.01 -0.55 0.43 0.00 0.70 0.00 0.00 175.22 175.81 3brw s ALA 79 N 1.52 3.45 -0.42 5.36 0.00 -0.12 -0.80 121.76 130.75 3brw s ALA 79 Ca 0.03 -1.36 -0.16 0.00 0.00 0.00 0.00 51.96 50.47 3brw s ALA 79 Cb -0.13 -3.00 0.03 0.00 0.00 0.00 0.00 23.12 20.02 3brw s ALA 79 CO -0.08 -1.41 0.36 -0.51 0.00 0.00 0.00 175.76 174.11 3brw s LEU 80 N 2.16 5.09 -0.06 0.00 1.02 0.16 -0.77 118.68 126.28 3brw s LEU 80 Ca 0.13 -0.88 0.00 0.00 0.02 0.00 0.00 54.13 53.40 3brw s LEU 80 Cb -0.17 -2.23 -0.03 0.00 0.02 0.00 0.00 46.19 43.78 3brw s LEU 80 CO 0.13 -0.52 -0.04 -0.69 0.02 0.00 0.00 176.35 175.25 3brw s VAL 81 N 1.83 3.94 0.25 -1.59 1.01 -0.36 -0.99 120.40 124.50 3brw s VAL 81 Ca 0.07 -0.43 0.01 0.00 0.00 0.00 0.00 61.98 61.63 3brw s VAL 81 Cb -0.19 -2.65 -0.05 0.00 0.00 0.00 0.00 36.38 33.50 3brw s VAL 81 CO 0.11 0.57 0.11 -0.72 0.00 0.00 0.00 175.10 175.17 3brw s TYR 82 N -0.87 1.47 -0.12 5.22 1.13 -0.61 -4.22 117.35 119.33 3brw s TYR 82 Ca 0.14 -1.24 -0.05 0.00 -1.41 0.00 0.00 57.07 54.50 3brw s TYR 82 Cb -0.11 -0.82 -0.04 0.00 -1.10 0.00 0.00 41.96 39.89 3brw s TYR 82 CO 0.03 -0.42 0.08 0.45 -2.51 0.00 0.00 175.55 173.18 3brw s SER 83 N -3.29 5.84 0.00 -0.18 0.15 -1.26 -1.19 113.70 113.77 3brw s SER 83 Ca 0.38 0.27 0.17 0.00 0.70 0.00 0.00 55.95 57.47 3brw s SER 83 Cb 0.07 -1.85 0.87 0.00 -1.71 0.00 0.00 66.02 63.41 3brw s SER 83 CO 0.14 0.34 1.47 2.30 1.20 0.00 0.00 173.24 178.69 3brw n ILE 84 N 2.43 0.42 -0.08 6.45 -5.35 -0.79 -3.41 119.36 119.03 3brw n ILE 84 Ca -0.19 0.10 -0.21 0.00 -0.27 0.00 0.00 62.75 62.19 3brw n ILE 84 Cb 0.54 -0.83 -0.12 0.00 -1.74 0.00 0.00 39.64 37.48 3brw n ILE 84 CO 0.00 0.00 0.00 0.41 -1.76 0.00 0.00 176.55 175.20 3brw n THR 85 N -1.23 1.60 -3.82 7.28 -1.04 -1.26 -0.32 114.28 115.49 3brw n THR 85 Ca 0.09 -0.53 -0.36 0.00 -2.04 0.00 0.00 64.05 61.20 3brw n THR 85 Cb 0.12 -1.63 -0.13 0.00 -1.82 0.00 0.00 70.33 66.87 3brw n THR 85 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3brw s ALA 86 N -2.52 2.98 0.24 2.41 0.00 -1.22 -4.46 121.76 119.19 3brw s ALA 86 Ca -0.31 -1.33 0.08 0.00 0.00 0.00 0.00 51.96 50.40 3brw s ALA 86 Cb 0.09 -1.98 0.23 0.00 0.00 0.00 0.00 23.12 21.46 3brw s ALA 86 CO 0.64 -0.72 1.54 0.37 0.00 0.00 0.00 175.76 177.59 3brw h GLN 87 N 8.18 0.08 -0.44 0.00 4.15 -1.88 -2.83 115.11 122.36 3brw h GLN 87 Ca -0.35 -0.07 0.13 0.00 0.77 0.00 0.00 58.65 59.13 3brw h GLN 87 Cb 1.14 0.01 -0.02 0.00 0.21 0.00 0.00 27.48 28.83 3brw h GLN 87 CO 0.60 0.73 0.37 0.66 -1.93 0.00 0.00 178.83 179.26 3brw h SER 88 N 0.05 0.00 1.46 -0.69 4.64 -1.94 0.11 113.55 117.19 3brw h SER 88 Ca -0.01 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.24 3brw h SER 88 Cb 1.21 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.29 3brw h SER 88 CO 0.09 0.00 -0.35 0.71 -0.87 0.00 0.00 176.83 176.42 3brw h THR 89 N 0.00 0.63 0.06 2.95 1.35 -1.84 -2.87 112.91 113.19 3brw h THR 89 Ca 0.21 -1.74 -0.26 0.00 -0.55 0.00 0.00 66.41 64.07 3brw h THR 89 Cb 0.94 2.20 0.01 0.00 -1.73 0.00 0.00 68.15 69.57 3brw h THR 89 CO -0.00 0.34 -1.10 0.15 -0.25 0.00 0.00 175.52 174.66 3brw h PHE 90 N 0.00 0.73 0.00 4.73 3.57 -0.87 -3.24 116.94 121.86 3brw h PHE 90 Ca -0.00 -0.44 0.00 0.00 3.53 0.00 0.00 57.97 61.05 3brw h PHE 90 Cb 1.17 -0.07 0.00 0.00 2.79 0.00 0.00 35.95 39.84 3brw h PHE 90 CO 0.00 1.29 0.00 -0.91 -2.23 0.00 0.00 178.31 176.46 3brw h ASN 91 N 0.22 0.00 0.53 0.41 2.35 -1.43 -3.02 115.58 114.65 3brw h ASN 91 Ca -0.13 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.62 3brw h ASN 91 Cb 1.77 0.00 0.00 0.00 0.05 0.00 0.00 38.32 40.14 3brw h ASN 91 CO 0.20 0.00 0.00 0.44 -1.65 0.00 0.00 177.43 176.42 3brw h ASP 92 N 0.00 0.00 0.17 5.81 5.19 -1.53 -3.22 116.42 122.84 3brw h ASP 92 Ca 0.00 0.00 -0.21 0.00 -0.62 0.00 0.00 57.03 56.20 3brw h ASP 92 Cb 0.71 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.23 3brw h ASP 92 CO 0.00 0.00 -0.82 -0.07 -3.12 0.00 0.00 179.24 175.23 3brw h LEU 93 N 0.00 0.63 -0.16 1.55 3.38 -1.68 -3.36 115.31 115.67 3brw h LEU 93 Ca 0.00 -0.44 0.02 0.00 0.09 0.00 0.00 57.88 57.55 3brw h LEU 93 Cb 0.27 -0.19 -0.05 0.00 0.09 0.00 0.00 40.66 40.78 3brw h LEU 93 CO 0.00 1.22 -0.35 -0.61 0.09 0.00 0.00 178.44 178.78 3brw h GLN 94 N 0.33 -0.31 -0.87 1.13 5.75 -1.77 0.17 115.11 119.54 3brw h GLN 94 Ca -0.06 0.02 0.00 0.00 -0.15 0.00 0.00 58.65 58.47 3brw h GLN 94 Cb 1.43 0.07 0.00 0.00 1.07 0.00 0.00 27.48 30.05 3brw h GLN 94 CO 0.15 -0.21 0.00 -0.40 -2.65 0.00 0.00 178.83 175.72 3brw n ASP 95 N -4.41 2.16 -0.12 -0.69 5.68 -1.26 -1.54 116.55 116.38 3brw n ASP 95 Ca -0.03 -2.23 -0.25 0.00 -0.50 0.00 0.00 54.79 51.78 3brw n ASP 95 Cb 0.23 -0.53 -0.11 0.00 -1.14 0.00 0.00 41.12 39.57 3brw n ASP 95 CO 0.00 0.00 0.00 -0.11 -1.33 0.00 0.00 177.20 175.76 3brw n LEU 96 N 0.15 2.13 -0.21 -2.12 7.94 0.42 -3.33 117.00 121.98 3brw n LEU 96 Ca 0.07 0.29 -0.01 0.00 -1.11 0.00 0.00 56.01 55.24 3brw n LEU 96 Cb 0.48 -0.90 0.10 0.00 0.53 0.00 0.00 43.42 43.63 3brw n LEU 96 CO 0.08 0.57 1.05 -0.09 -1.11 0.00 0.00 177.39 177.89 3brw h ARG 97 N -0.78 0.55 -0.38 1.96 9.65 -0.71 -1.25 114.38 123.43 3brw h ARG 97 Ca -0.57 -0.03 -0.07 0.00 -1.10 0.00 0.00 59.98 58.21 3brw h ARG 97 Cb 1.61 -0.12 -0.02 0.00 -1.39 0.00 0.00 29.97 30.04 3brw h ARG 97 CO -0.28 0.36 -0.04 0.93 2.80 0.00 0.00 179.97 183.74 3brw h GLU 98 N 0.57 0.62 -0.49 0.20 5.08 -1.48 -2.34 114.58 116.75 3brw h GLU 98 Ca 0.29 -0.16 -0.13 0.00 -1.00 0.00 0.00 59.36 58.36 3brw h GLU 98 Cb 0.25 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.41 3brw h GLU 98 CO -0.22 0.67 -0.22 0.37 -1.00 0.00 0.00 179.01 178.61 3brw h GLN 99 N 0.58 1.00 0.42 2.33 4.15 -1.42 -1.94 115.11 120.23 3brw h GLN 99 Ca 0.11 -0.43 -0.01 0.00 0.77 0.00 0.00 58.65 59.09 3brw h GLN 99 Cb 0.43 -0.03 -0.02 0.00 0.21 0.00 0.00 27.48 28.07 3brw h GLN 99 CO 0.02 1.11 -0.42 0.82 -1.93 0.00 0.00 178.83 178.43 3brw h ILE 100 N 0.86 0.00 -0.93 2.39 1.08 -0.93 -1.96 117.51 118.02 3brw h ILE 100 Ca 0.11 0.00 0.13 0.00 -0.39 0.00 0.00 64.86 64.71 3brw h ILE 100 Cb 0.80 0.00 -0.07 0.00 -3.07 0.00 0.00 36.82 34.47 3brw h ILE 100 CO 0.07 0.00 0.60 -0.07 -0.69 0.00 0.00 178.15 178.05 3brw h LEU 101 N -0.84 0.78 -0.18 1.44 3.38 -1.41 0.13 115.31 118.61 3brw h LEU 101 Ca -0.05 0.04 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 3brw h LEU 101 Cb 0.72 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.35 3brw h LEU 101 CO -0.05 0.41 0.09 0.03 0.09 0.00 0.00 178.44 179.01 3brw h ARG 102 N 0.84 0.26 -0.32 1.13 3.08 -1.24 0.23 114.38 118.36 3brw h ARG 102 Ca 0.46 -0.04 -0.16 0.00 0.07 0.00 0.00 59.98 60.32 3brw h ARG 102 Cb 0.58 -0.05 -0.00 0.00 0.08 0.00 0.00 29.97 30.58 3brw h ARG 102 CO -0.22 0.28 -0.42 0.28 -1.07 0.00 0.00 179.97 178.81 3brw h VAL 103 N 0.17 1.28 0.00 2.04 2.07 -0.30 -3.07 116.25 118.44 3brw h VAL 103 Ca 0.06 -1.60 -0.05 0.00 0.82 0.00 0.00 66.70 65.93 3brw h VAL 103 Cb 0.10 1.55 -0.01 0.00 -1.52 0.00 0.00 31.29 31.42 3brw h VAL 103 CO -0.01 0.52 -0.22 0.11 0.02 0.00 0.00 177.57 178.00 3brw h LYS 104 N 0.63 0.00 0.00 1.57 1.79 -0.80 -3.47 116.57 116.28 3brw h LYS 104 Ca 0.04 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.51 3brw h LYS 104 Cb 1.02 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.67 3brw h LYS 104 CO 0.10 0.22 0.00 -3.47 -1.08 0.00 0.00 179.45 175.22 3brw n ASP 105 N -3.28 0.00 -4.79 0.86 2.03 0.81 -4.97 116.55 107.21 3brw n ASP 105 Ca 0.01 0.00 -0.22 0.00 0.52 0.00 0.00 54.79 55.10 3brw n ASP 105 Cb 0.49 -0.22 -0.05 0.00 -0.72 0.00 0.00 41.12 40.62 3brw n ASP 105 CO 0.00 0.00 0.00 -0.89 -1.92 0.00 0.00 177.20 174.39 3brw s THR 106 N -1.36 3.23 -2.13 5.18 2.01 -1.24 -4.96 115.64 116.37 3brw s THR 106 Ca 0.00 -1.55 0.23 0.00 0.31 0.00 0.00 61.69 60.68 3brw s THR 106 Cb 0.00 -3.07 0.59 0.00 0.01 0.00 0.00 72.50 70.03 3brw s THR 106 CO 0.00 -0.17 1.51 -0.90 -0.69 0.00 0.00 174.62 174.36 3brw n ASP 107 N -1.25 3.80 -3.86 3.53 5.75 -1.26 -4.53 116.55 118.73 3brw n ASP 107 Ca -0.02 -2.00 -0.42 0.00 -0.01 0.00 0.00 54.79 52.33 3brw n ASP 107 Cb 0.61 -0.42 0.01 0.00 -1.03 0.00 0.00 41.12 40.28 3brw n ASP 107 CO 0.00 0.00 0.00 -0.67 -0.11 0.00 0.00 177.20 176.42 3brw n ASP 108 N 1.61 6.00 -3.98 -1.12 2.03 -1.26 -4.94 116.55 114.90 3brw n ASP 108 Ca 0.23 -3.26 -0.27 0.00 0.52 0.00 0.00 54.79 52.01 3brw n ASP 108 Cb 0.62 -1.37 -0.17 0.00 -0.72 0.00 0.00 41.12 39.48 3brw n ASP 108 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 3brw s VAL 109 N -1.20 1.21 -0.57 5.18 1.01 -1.26 -5.09 120.40 119.68 3brw s VAL 109 Ca 0.38 -0.45 -0.36 0.00 0.00 0.00 0.00 61.98 61.55 3brw s VAL 109 Cb 0.10 -1.16 -0.16 0.00 0.00 0.00 0.00 36.38 35.16 3brw s VAL 109 CO 0.02 0.39 2.31 -2.65 0.00 0.00 0.00 175.10 175.17 3brw n PRO 110 N 4.47 0.45 -4.32 2.72 -0.02 -1.26 -4.92 135.00 132.11 3brw n PRO 110 Ca -0.17 0.10 -0.21 0.00 -2.02 0.00 0.00 63.50 61.20 3brw n PRO 110 Cb 0.51 -1.99 -0.16 0.00 -0.02 0.00 0.00 33.50 31.84 3brw n PRO 110 CO 0.00 0.00 0.00 1.41 1.98 0.00 0.00 175.50 178.89 3brw s MET 111 N 6.97 1.00 -0.06 -0.52 1.75 -1.26 -0.38 119.30 126.80 3brw s MET 111 Ca 1.18 -0.24 0.01 0.00 -1.25 0.00 0.00 55.69 55.40 3brw s MET 111 Cb -1.12 -0.93 0.02 0.00 2.84 0.00 0.00 34.83 35.64 3brw s MET 111 CO 0.53 0.02 -0.07 -1.50 -0.65 0.00 0.00 175.02 173.35 3brw s ILE 112 N 0.54 0.78 -0.06 10.11 2.07 0.02 -3.50 121.20 131.17 3brw s ILE 112 Ca -0.08 -0.26 -0.20 0.00 -1.41 0.00 0.00 60.65 58.70 3brw s ILE 112 Cb -0.12 -0.77 -0.05 0.00 0.13 0.00 0.00 42.46 41.66 3brw s ILE 112 CO 0.01 0.28 0.57 -0.22 -1.91 0.00 0.00 174.94 173.67 3brw s LEU 113 N 0.91 4.35 -0.31 8.50 2.96 0.95 -0.66 118.68 135.37 3brw s LEU 113 Ca -0.11 1.04 0.01 0.00 -0.22 0.00 0.00 54.13 54.85 3brw s LEU 113 Cb -0.15 -2.87 0.10 0.00 0.50 0.00 0.00 46.19 43.77 3brw s LEU 113 CO 0.01 0.03 0.08 -0.69 -1.32 0.00 0.00 176.35 174.46 3brw s VAL 114 N 0.26 1.29 -1.17 1.68 1.01 -0.16 -2.00 120.40 121.31 3brw s VAL 114 Ca 0.30 -1.65 -0.20 0.00 0.00 0.00 0.00 61.98 60.43 3brw s VAL 114 Cb -0.17 -1.95 0.07 0.00 0.00 0.00 0.00 36.38 34.32 3brw s VAL 114 CO 0.15 -0.63 1.59 -0.83 0.00 0.00 0.00 175.10 175.38 3brw s GLY 115 N 1.41 1.51 0.86 4.51 0.00 -0.91 -1.58 107.32 113.12 3brw s GLY 115 Ca 0.10 -2.65 -0.13 0.00 0.00 0.00 0.00 44.72 42.04 3brw s GLY 115 CO -0.20 2.67 1.18 0.21 0.00 0.00 0.00 173.10 176.97 3brw s ASN 116 N 4.49 4.01 -0.99 1.64 2.47 -0.33 -0.31 114.94 125.91 3brw s ASN 116 Ca 0.50 0.78 -0.02 0.00 0.42 0.00 0.00 52.86 54.54 3brw s ASN 116 Cb 0.02 -1.25 0.00 0.00 -1.45 0.00 0.00 41.25 38.57 3brw s ASN 116 CO -0.00 -2.22 0.32 0.29 -3.72 0.00 0.00 177.10 171.76 3brw n LYS 117 N -3.52 -2.73 0.00 0.43 5.02 0.12 -1.88 118.16 115.60 3brw n LYS 117 Ca 0.08 0.58 0.11 0.00 -2.02 0.00 0.00 58.31 57.06 3brw n LYS 117 Cb 0.60 -4.74 0.62 0.00 -0.02 0.00 0.00 35.03 31.50 3brw n LYS 117 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3brw h ASP 119 N 0.00 0.00 -1.50 0.00 2.03 -1.92 -3.34 116.42 111.70 3brw h ASP 119 Ca 0.00 0.00 -0.76 0.00 -0.73 0.00 0.00 57.03 55.54 3brw h ASP 119 Cb 0.13 0.00 -0.17 0.00 -0.83 0.00 0.00 39.33 38.46 3brw h ASP 119 CO 0.00 0.25 2.00 0.18 -1.03 0.00 0.00 179.24 180.64 3brw n LEU 120 N -3.37 7.77 -0.32 0.15 4.77 -0.94 -4.80 117.00 120.26 3brw n LEU 120 Ca 0.00 -5.02 0.03 0.00 -0.03 0.00 0.00 56.01 51.00 3brw n LEU 120 Cb 0.47 -1.31 0.21 0.00 -2.33 0.00 0.00 43.42 40.46 3brw n LEU 120 CO 0.34 2.01 1.26 -0.08 -1.33 0.00 0.00 177.39 179.60 3brw h GLU 121 N 4.58 1.07 0.00 3.23 4.57 -1.83 -1.43 114.58 124.77 3brw h GLU 121 Ca 0.63 -0.06 0.00 0.00 -1.18 0.00 0.00 59.36 58.75 3brw h GLU 121 Cb 0.33 -0.24 0.00 0.00 -0.16 0.00 0.00 28.75 28.68 3brw h GLU 121 CO 1.41 0.71 0.00 -0.40 -1.18 0.00 0.00 179.01 179.54 3brw n ASP 122 N -4.48 0.00 -0.43 1.04 5.68 -1.26 -1.96 116.55 115.14 3brw n ASP 122 Ca 0.14 0.38 0.09 0.00 -0.50 0.00 0.00 54.79 54.90 3brw n ASP 122 Cb 0.16 -0.44 -0.00 0.00 -1.14 0.00 0.00 41.12 39.70 3brw n ASP 122 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 3brw n GLU 123 N -1.44 1.48 -1.68 0.11 1.02 -0.55 -5.01 120.64 114.56 3brw n GLU 123 Ca 0.05 -0.90 -0.45 0.00 -0.02 0.00 0.00 57.16 55.84 3brw n GLU 123 Cb 0.17 -1.37 -0.04 0.00 -0.02 0.00 0.00 31.44 30.19 3brw n GLU 123 CO 0.00 0.00 0.00 -2.13 1.18 0.00 0.00 177.13 176.18 3brw n ARG 124 N -0.07 2.34 0.00 3.49 0.63 -0.83 -4.50 116.66 117.72 3brw n ARG 124 Ca 0.08 0.85 0.00 0.00 -0.92 0.00 0.00 57.85 57.85 3brw n ARG 124 Cb 0.40 -2.65 0.00 0.00 0.45 0.00 0.00 32.46 30.66 3brw n ARG 124 CO 0.00 0.00 0.00 1.33 -2.51 0.00 0.00 177.63 176.45 3brw n VAL 125 N 3.85 0.00 -3.31 5.15 0.24 0.57 -4.98 118.33 119.85 3brw n VAL 125 Ca 0.17 0.00 -0.39 0.00 -2.04 0.00 0.00 64.34 62.08 3brw n VAL 125 Cb 0.31 0.05 -0.08 0.00 -1.47 0.00 0.00 33.84 32.66 3brw n VAL 125 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 3brw s VAL 126 N -1.85 5.13 0.78 3.34 1.01 -0.91 -4.97 120.40 122.92 3brw s VAL 126 Ca 0.00 0.79 -0.12 0.00 0.00 0.00 0.00 61.98 62.65 3brw s VAL 126 Cb 0.00 -3.78 0.06 0.00 0.00 0.00 0.00 36.38 32.66 3brw s VAL 126 CO 0.00 0.16 1.12 -0.83 0.00 0.00 0.00 175.10 175.54 3brw s GLY 127 N 1.38 1.84 0.13 4.51 0.00 -1.26 -4.92 107.32 109.00 3brw s GLY 127 Ca 0.20 0.46 -0.15 0.00 0.00 0.00 0.00 44.72 45.22 3brw s GLY 127 CO 0.09 0.83 1.64 1.70 0.00 0.00 0.00 173.10 177.35 3brw h LYS 128 N -0.97 0.64 -0.56 2.90 1.63 -2.00 -3.14 116.57 115.07 3brw h LYS 128 Ca -0.44 -0.15 -0.04 0.00 -0.85 0.00 0.00 60.65 59.16 3brw h LYS 128 Cb 1.25 -0.09 -0.02 0.00 -0.60 0.00 0.00 32.23 32.77 3brw h LYS 128 CO 0.50 0.65 0.18 0.93 -3.45 0.00 0.00 179.45 178.26 3brw h GLU 129 N 0.52 0.86 -0.37 1.90 4.39 -1.99 -2.80 114.58 117.08 3brw h GLU 129 Ca 0.13 -0.18 0.04 0.00 0.34 0.00 0.00 59.36 59.68 3brw h GLU 129 Cb 0.29 -0.13 -0.06 0.00 -0.10 0.00 0.00 28.75 28.76 3brw h GLU 129 CO -0.00 0.78 -0.36 1.96 -1.16 0.00 0.00 179.01 180.23 3brw h GLN 130 N 0.77 -0.17 -0.27 2.33 4.20 -1.92 -1.86 115.11 118.19 3brw h GLN 130 Ca 0.18 0.01 -0.10 0.00 0.06 0.00 0.00 58.65 58.80 3brw h GLN 130 Cb 0.28 0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.08 3brw h GLN 130 CO -0.01 -0.11 -0.24 0.78 -0.67 0.00 0.00 178.83 178.58 3brw h GLY 131 N -0.18 0.56 0.74 3.46 0.00 -1.59 -2.41 103.07 103.65 3brw h GLY 131 Ca 0.06 -0.45 0.04 0.00 0.00 0.00 0.00 47.33 46.97 3brw h GLY 131 CO -0.44 0.42 0.13 -1.61 0.00 0.00 0.00 176.54 175.04 3brw h GLN 132 N 0.46 0.28 0.00 4.80 -0.00 -1.20 -1.91 115.11 117.53 3brw h GLN 132 Ca 0.07 -0.02 0.00 0.00 -0.00 0.00 0.00 58.65 58.70 3brw h GLN 132 Cb 0.67 -0.06 0.00 0.00 0.00 0.00 0.00 27.48 28.08 3brw h GLN 132 CO 0.05 0.18 -0.10 -0.91 0.00 0.00 0.00 178.83 178.05 3brw h ASN 133 N 0.28 0.00 0.55 -0.69 2.35 -1.13 -2.29 115.58 114.66 3brw h ASN 133 Ca 0.15 -0.03 -0.21 0.00 -0.55 0.00 0.00 56.30 55.67 3brw h ASN 133 Cb 0.11 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.47 3brw h ASN 133 CO -0.14 0.01 -0.92 0.25 -1.65 0.00 0.00 177.43 174.98 3brw h LEU 134 N 0.00 0.31 -0.73 1.61 7.12 -1.20 -1.95 115.31 120.48 3brw h LEU 134 Ca 0.00 -0.26 -0.09 0.00 0.13 0.00 0.00 57.88 57.66 3brw h LEU 134 Cb 0.78 -0.10 -0.02 0.00 -0.53 0.00 0.00 40.66 40.79 3brw h LEU 134 CO 0.00 1.07 0.01 0.00 -0.13 0.00 0.00 178.44 179.39 3brw h ALA 135 N 0.90 0.93 -0.20 1.25 0.00 -1.08 -2.78 119.26 118.29 3brw h ALA 135 Ca -0.06 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.55 3brw h ALA 135 Cb 1.56 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 19.12 3brw h ALA 135 CO 0.14 0.64 0.09 0.00 0.00 0.00 0.00 179.25 180.12 3brw h ARG 136 N 0.90 0.29 -0.64 0.00 3.08 -1.39 0.31 114.38 116.93 3brw h ARG 136 Ca 0.17 -0.05 0.19 0.00 0.07 0.00 0.00 59.98 60.35 3brw h ARG 136 Cb 0.52 -0.05 -0.03 0.00 0.08 0.00 0.00 29.97 30.49 3brw h ARG 136 CO 0.03 0.34 0.54 1.96 -1.07 0.00 0.00 179.97 181.77 3brw h GLN 137 N 0.18 0.00 -2.35 0.04 4.20 -1.16 -0.75 115.11 115.26 3brw h GLN 137 Ca 0.07 0.00 -0.60 0.00 0.06 0.00 0.00 58.65 58.17 3brw h GLN 137 Cb 0.15 0.00 -0.13 0.00 0.30 0.00 0.00 27.48 27.80 3brw h GLN 137 CO -0.01 0.00 1.50 0.91 -0.67 0.00 0.00 178.83 180.57 3brw n TRP 138 N -4.00 2.01 -1.50 2.96 8.01 -1.01 -4.84 117.44 119.06 3brw n TRP 138 Ca 0.13 -2.40 -0.03 0.00 -1.31 0.00 0.00 57.50 53.89 3brw n TRP 138 Cb 0.79 -1.68 0.00 0.00 -2.01 0.00 0.00 31.31 28.41 3brw n TRP 138 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 177.69 176.95 3brw n ASN 139 N 1.55 -0.43 -3.86 -0.99 2.04 -0.40 -2.25 115.26 110.92 3brw n ASN 139 Ca 0.57 -0.03 -0.38 0.00 -0.44 0.00 0.00 54.58 54.30 3brw n ASN 139 Cb 0.41 -0.13 0.03 0.00 -2.53 0.00 0.00 39.78 37.57 3brw n ASN 139 CO 0.00 0.00 0.00 0.59 -0.44 0.00 0.00 177.26 177.41 3brw n ASN 140 N 0.77 -4.74 -4.80 0.53 3.02 -0.56 -4.98 115.26 104.50 3brw n ASN 140 Ca -0.01 -1.14 -0.34 0.00 -0.03 0.00 0.00 54.58 53.06 3brw n ASN 140 Cb 0.06 -2.62 -0.03 0.00 -0.61 0.00 0.00 39.78 36.57 3brw n ASN 140 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3brw s ALA 142 N -2.08 3.58 -0.07 0.00 0.00 -1.23 -4.61 121.76 117.36 3brw s ALA 142 Ca 0.66 1.18 -0.06 0.00 0.00 0.00 0.00 51.96 53.74 3brw s ALA 142 Cb -0.16 -3.52 0.02 0.00 0.00 0.00 0.00 23.12 19.46 3brw s ALA 142 CO 0.22 -0.62 0.18 0.12 0.00 0.00 0.00 175.76 175.66 3brw s PHE 143 N 0.39 -0.21 0.00 0.00 5.36 -1.26 -0.04 117.98 122.23 3brw s PHE 143 Ca 0.60 0.51 -0.27 0.00 -0.96 0.00 0.00 56.93 56.81 3brw s PHE 143 Cb -0.38 0.05 0.06 0.00 -0.34 0.00 0.00 43.02 42.41 3brw s PHE 143 CO 0.37 -0.11 0.61 -0.48 -1.46 0.00 0.00 175.22 174.15 3brw s LEU 144 N 0.27 -0.42 0.11 6.12 0.05 -0.85 -4.98 118.68 118.98 3brw s LEU 144 Ca -0.01 0.46 -0.16 0.00 0.05 0.00 0.00 54.13 54.47 3brw s LEU 144 Cb -0.03 2.38 -0.07 0.00 -2.05 0.00 0.00 46.19 46.42 3brw s LEU 144 CO -0.01 -0.67 0.53 -1.61 -0.55 0.00 0.00 176.35 174.04 3brw s GLU 145 N -1.83 4.03 0.08 1.48 2.02 -1.26 -2.15 118.70 121.07 3brw s GLU 145 Ca -0.08 0.54 0.03 0.00 0.02 0.00 0.00 54.97 55.48 3brw s GLU 145 Cb -0.01 -3.06 -0.03 0.00 0.10 0.00 0.00 34.13 31.14 3brw s GLU 145 CO 0.04 0.55 -0.09 -1.12 0.02 0.00 0.00 175.26 174.66 3brw s SER 146 N -1.47 1.22 -0.12 -0.19 0.01 0.57 -4.58 113.70 109.14 3brw s SER 146 Ca 0.33 -0.76 -0.04 0.00 1.31 0.00 0.00 55.95 56.80 3brw s SER 146 Cb -0.16 0.03 0.05 0.00 0.21 0.00 0.00 66.02 66.15 3brw s SER 146 CO 0.18 -0.27 0.07 -0.55 0.41 0.00 0.00 173.24 173.08 3brw s SER 147 N -2.26 1.94 0.44 2.44 0.15 -0.78 0.12 113.70 115.75 3brw s SER 147 Ca 0.02 -0.37 0.20 0.00 0.70 0.00 0.00 55.95 56.49 3brw s SER 147 Cb -0.04 -0.23 1.00 0.00 -1.71 0.00 0.00 66.02 65.04 3brw s SER 147 CO -0.01 -0.31 1.91 0.00 1.20 0.00 0.00 173.24 176.03 3brw h ALA 148 N 8.41 1.27 0.12 5.45 0.00 -1.94 -2.80 119.26 129.77 3brw h ALA 148 Ca -0.14 -0.24 -0.23 0.00 0.00 0.00 0.00 54.91 54.30 3brw h ALA 148 Cb 1.14 -0.04 0.02 0.00 0.00 0.00 0.00 17.79 18.91 3brw h ALA 148 CO 0.24 0.33 -0.98 -0.22 0.00 0.00 0.00 179.25 178.62 3brw h LYS 149 N 0.00 0.46 0.00 0.00 3.64 -1.97 -3.42 116.57 115.29 3brw h LYS 149 Ca -0.00 -0.65 0.00 0.00 -1.27 0.00 0.00 60.65 58.73 3brw h LYS 149 Cb 0.57 0.22 0.00 0.00 -0.41 0.00 0.00 32.23 32.61 3brw h LYS 149 CO 0.03 1.28 0.00 0.43 -2.27 0.00 0.00 179.45 178.93 3brw n SER 150 N -3.99 0.00 0.00 4.20 7.64 -1.22 -5.02 113.62 115.22 3brw n SER 150 Ca -0.13 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.75 3brw n SER 150 Cb 0.87 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 64.07 3brw n SER 150 CO 0.00 0.00 0.00 1.17 -3.01 0.00 0.00 175.04 173.20 3brw n LYS 151 N 0.00 0.00 -1.55 1.43 3.00 -1.06 -5.08 118.16 114.90 3brw n LYS 151 Ca 0.00 0.00 -0.57 0.00 -0.00 0.00 0.00 58.31 57.74 3brw n LYS 151 Cb 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 35.03 34.95 3brw n LYS 151 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.40 176.51 3brw n ILE 152 N 0.00 0.19 -1.08 3.15 5.41 -1.23 -2.16 119.36 123.64 3brw n ILE 152 Ca 0.00 -0.10 -0.08 0.00 1.00 0.00 0.00 62.75 63.57 3brw n ILE 152 Cb 0.00 -1.16 -0.03 0.00 -0.71 0.00 0.00 39.64 37.74 3brw n ILE 152 CO 0.00 0.00 0.00 0.59 0.00 0.00 0.00 176.55 177.14 3brw n ASN 153 N 7.00 -4.11 -0.33 4.38 3.02 -1.26 -1.86 115.26 122.10 3brw n ASN 153 Ca 0.37 0.19 -0.03 0.00 -0.03 0.00 0.00 54.58 55.07 3brw n ASN 153 Cb 0.11 -3.14 0.09 0.00 -0.61 0.00 0.00 39.78 36.23 3brw n ASN 153 CO 0.00 0.00 0.00 0.58 -2.62 0.00 0.00 177.26 175.22 3brw h VAL 154 N 0.00 1.24 0.03 2.41 2.07 -1.72 -2.92 116.25 117.36 3brw h VAL 154 Ca -0.16 -0.47 -0.00 0.00 0.82 0.00 0.00 66.70 66.89 3brw h VAL 154 Cb 0.85 -0.05 0.00 0.00 -1.52 0.00 0.00 31.29 30.57 3brw h VAL 154 CO 0.23 0.24 -0.01 0.78 0.02 0.00 0.00 177.57 178.82 3brw h ASN 155 N 1.22 -0.03 -0.13 0.57 4.21 -1.89 -3.32 115.58 116.21 3brw h ASN 155 Ca 0.32 -0.68 0.04 0.00 1.21 0.00 0.00 56.30 57.19 3brw h ASN 155 Cb -0.10 0.01 -0.01 0.00 -1.12 0.00 0.00 38.32 37.10 3brw h ASN 155 CO -0.07 0.71 0.50 -0.33 -1.29 0.00 0.00 177.43 176.96 3brw h GLU 156 N -0.82 0.00 0.09 0.81 3.07 -1.93 -0.38 114.58 115.41 3brw h GLU 156 Ca -0.00 0.00 0.01 0.00 -0.50 0.00 0.00 59.36 58.87 3brw h GLU 156 Cb 0.71 0.00 -0.05 0.00 -0.84 0.00 0.00 28.75 28.58 3brw h GLU 156 CO 0.01 0.00 -0.49 0.82 -1.40 0.00 0.00 179.01 177.94 3brw h ILE 157 N 0.00 0.00 0.00 3.13 1.08 -1.62 -2.40 117.51 117.70 3brw h ILE 157 Ca 0.06 0.00 -0.24 0.00 -0.39 0.00 0.00 64.86 64.29 3brw h ILE 157 Cb 1.06 0.00 -0.04 0.00 -3.07 0.00 0.00 36.82 34.78 3brw h ILE 157 CO -0.00 0.00 -1.27 -0.26 -0.69 0.00 0.00 178.15 175.93 3brw h PHE 158 N -0.69 0.00 -0.53 1.37 0.04 -1.29 -3.18 116.94 112.66 3brw h PHE 158 Ca -0.00 0.00 -0.04 0.00 2.80 0.00 0.00 57.97 60.73 3brw h PHE 158 Cb 0.70 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.82 3brw h PHE 158 CO -0.46 1.00 0.18 1.88 -0.60 0.00 0.00 178.31 180.31 3brw h TYR 159 N 0.00 0.83 0.00 -0.55 0.05 -1.57 -2.19 116.97 113.54 3brw h TYR 159 Ca -0.12 -0.08 0.00 0.00 0.05 0.00 0.00 58.73 58.59 3brw h TYR 159 Cb 1.86 -0.24 0.00 0.00 1.01 0.00 0.00 36.73 39.36 3brw h TYR 159 CO 0.00 0.71 0.00 -3.47 -1.05 0.00 0.00 178.16 174.35 3brw n ASP 160 N -4.49 0.00 0.00 3.88 4.64 -0.90 -0.78 116.55 118.90 3brw n ASP 160 Ca 0.02 0.07 -0.22 0.00 -1.38 0.00 0.00 54.79 53.29 3brw n ASP 160 Cb 0.18 -0.32 -0.14 0.00 -1.04 0.00 0.00 41.12 39.81 3brw n ASP 160 CO 0.00 0.00 0.00 -0.07 -0.82 0.00 0.00 177.20 176.31 3brw h LEU 161 N 0.00 0.37 -0.30 -2.67 3.38 -1.43 -3.14 115.31 111.52 3brw h LEU 161 Ca 0.00 -0.85 0.02 0.00 0.09 0.00 0.00 57.88 57.15 3brw h LEU 161 Cb 0.22 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 40.83 3brw h LEU 161 CO 0.00 1.66 0.14 0.58 0.09 0.00 0.00 178.44 180.91 3brw h VAL 162 N -0.28 0.98 -0.65 1.22 2.07 -0.98 -0.25 116.25 118.37 3brw h VAL 162 Ca -0.33 -0.10 0.18 0.00 0.82 0.00 0.00 66.70 67.27 3brw h VAL 162 Cb 1.79 0.65 -0.03 0.00 -1.52 0.00 0.00 31.29 32.19 3brw h VAL 162 CO 0.05 0.05 0.47 0.03 0.02 0.00 0.00 177.57 178.19 3brw h ARG 163 N 0.30 0.03 0.05 1.57 3.08 -1.10 0.13 114.38 118.44 3brw h ARG 163 Ca 0.12 -0.00 -0.27 0.00 0.07 0.00 0.00 59.98 59.90 3brw h ARG 163 Cb 0.05 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.07 3brw h ARG 163 CO -0.09 0.02 -1.39 1.96 -1.07 0.00 0.00 179.97 179.40 3brw h GLN 164 N 0.03 0.11 -0.06 0.04 4.20 -1.21 -3.16 115.11 115.05 3brw h GLN 164 Ca 0.31 -0.19 -0.17 0.00 0.06 0.00 0.00 58.65 58.66 3brw h GLN 164 Cb 1.21 0.07 -0.01 0.00 0.30 0.00 0.00 27.48 29.05 3brw h GLN 164 CO -0.01 0.93 -0.71 0.82 -0.67 0.00 0.00 178.83 179.19 3brw h ILE 165 N 0.03 1.40 -0.80 2.54 2.04 0.03 -3.20 117.51 119.54 3brw h ILE 165 Ca -0.17 -2.16 -0.04 0.00 1.00 0.00 0.00 64.86 63.49 3brw h ILE 165 Cb 1.93 2.12 -0.04 0.00 -0.74 0.00 0.00 36.82 40.10 3brw h ILE 165 CO 0.13 0.64 0.33 0.78 0.00 0.00 0.00 178.15 180.04 3brw h ASN 166 N 0.22 1.10 0.00 1.72 2.35 -0.89 -3.51 115.58 116.56 3brw h ASN 166 Ca -0.02 -0.17 0.00 0.00 -0.55 0.00 0.00 56.30 55.56 3brw h ASN 166 Cb 1.27 -0.28 0.00 0.00 0.05 0.00 0.00 38.32 39.35 3brw h ASN 166 CO 0.12 0.96 0.00 -1.14 -1.65 0.00 0.00 177.43 175.72