#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1u87 s SER 2 N 0.00 5.42 0.00 7.83 1.04 -1.26 -4.99 113.70 121.74 1u87 s SER 2 Ca 0.00 -0.19 0.00 0.00 0.48 0.00 0.00 55.95 56.24 1u87 s SER 2 Cb 0.00 -1.99 0.00 0.00 0.10 0.00 0.00 66.02 64.13 1u87 s SER 2 CO 0.00 -0.06 0.00 -2.65 0.98 0.00 0.00 173.24 171.51 1u87 n PRO 3 N 4.97 0.00 -3.74 4.02 -0.02 -1.26 -4.49 135.00 134.48 1u87 n PRO 3 Ca -0.15 0.00 -0.28 0.00 -2.02 0.00 0.00 63.50 61.04 1u87 n PRO 3 Cb 0.51 0.00 -0.16 0.00 -0.02 0.00 0.00 33.50 33.83 1u87 n PRO 3 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1u87 s ILE 4 N 0.00 0.68 -0.11 4.25 1.01 -0.92 -1.69 121.20 124.41 1u87 s ILE 4 Ca 0.00 -0.84 -0.05 0.00 0.00 0.00 0.00 60.65 59.76 1u87 s ILE 4 Cb 0.00 -1.26 -0.04 0.00 0.01 0.00 0.00 42.46 41.17 1u87 s ILE 4 CO 0.00 -0.34 0.08 -0.22 0.00 0.00 0.00 174.94 174.45 1u87 s LEU 5 N 1.77 4.00 0.05 2.97 2.96 -0.74 -1.70 118.68 127.99 1u87 s LEU 5 Ca 0.02 0.30 0.01 0.00 -0.22 0.00 0.00 54.13 54.24 1u87 s LEU 5 Cb -0.17 -1.96 -0.03 0.00 0.50 0.00 0.00 46.19 44.53 1u87 s LEU 5 CO -0.14 0.38 -0.06 -0.83 -1.32 0.00 0.00 176.35 174.38 1u87 s GLY 6 N -0.86 0.48 0.00 7.98 0.00 -0.24 -1.43 107.32 113.26 1u87 s GLY 6 Ca 0.13 -0.87 0.00 0.00 0.00 0.00 0.00 44.72 43.99 1u87 s GLY 6 CO 0.03 -0.94 0.00 0.33 0.00 0.00 0.00 173.10 172.52 1u87 n PHE 7 N 1.10 0.00 -0.00 1.90 7.35 -1.14 -0.66 117.46 126.00 1u87 n PHE 7 Ca -0.20 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.49 1u87 n PHE 7 Cb 0.56 0.00 0.00 0.00 0.35 0.00 0.00 39.48 40.39 1u87 n PHE 7 CO 0.00 0.00 0.00 0.91 -0.76 0.00 0.00 176.76 176.91 1u87 n TRP 8 N -0.12 -1.62 -3.54 -5.13 5.03 -1.26 -3.74 117.44 107.06 1u87 n TRP 8 Ca 0.00 0.00 -0.30 0.00 3.03 0.00 0.00 57.50 60.23 1u87 n TRP 8 Cb 0.00 0.00 -0.08 0.00 -1.03 0.00 0.00 31.31 30.20 1u87 n TRP 8 CO 0.00 0.00 0.00 1.17 -0.03 0.00 0.00 177.69 178.83 1u87 n LYS 9 N -1.22 2.53 0.00 -0.99 4.81 -1.10 -4.44 118.16 117.75 1u87 n LYS 9 Ca 0.00 -4.60 0.00 0.00 -0.87 0.00 0.00 58.31 52.84 1u87 n LYS 9 Cb 0.00 -2.31 0.00 0.00 0.02 0.00 0.00 35.03 32.74 1u87 n LYS 9 CO 0.00 0.00 0.00 0.44 1.17 0.00 0.00 177.40 179.01 1u87 n ILE 10 N 1.33 0.00 -0.04 3.15 -5.35 -1.26 -4.69 119.36 112.50 1u87 n ILE 10 Ca 0.26 0.00 -0.10 0.00 -0.27 0.00 0.00 62.75 62.64 1u87 n ILE 10 Cb 0.38 0.00 -0.03 0.00 -1.74 0.00 0.00 39.64 38.25 1u87 n ILE 10 CO 0.00 0.00 0.00 0.29 -1.76 0.00 0.00 176.55 175.08 1u87 n LYS 11 N 0.00 0.24 0.00 6.28 5.02 -1.11 -4.79 118.16 123.80 1u87 n LYS 11 Ca 0.00 0.10 0.00 0.00 -2.02 0.00 0.00 58.31 56.39 1u87 n LYS 11 Cb 0.00 -0.90 0.00 0.00 -0.02 0.00 0.00 35.03 34.11 1u87 n LYS 11 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1u87 n GLY 12 N 2.38 1.42 0.04 0.72 0.00 0.87 -1.55 105.19 109.07 1u87 n GLY 12 Ca -0.18 0.41 0.00 0.00 0.00 0.00 0.00 46.02 46.25 1u87 n GLY 12 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 1u87 n LEU 13 N 0.00 1.64 -0.02 0.99 -0.00 -1.26 -4.64 117.00 113.72 1u87 n LEU 13 Ca 0.00 -1.58 -0.09 0.00 -0.00 0.00 0.00 56.01 54.34 1u87 n LEU 13 Cb 0.00 -0.01 -0.14 0.00 -0.00 0.00 0.00 43.42 43.27 1u87 n LEU 13 CO 0.00 0.41 -0.52 1.62 -0.00 0.00 0.00 177.39 178.90 1u87 h VAL 14 N 0.14 0.86 -0.48 1.47 3.04 -1.65 -3.40 116.25 116.23 1u87 h VAL 14 Ca 0.00 -2.71 0.09 0.00 -1.01 0.00 0.00 66.70 63.08 1u87 h VAL 14 Cb 0.31 2.43 -0.10 0.00 -2.01 0.00 0.00 31.29 31.92 1u87 h VAL 14 CO 0.00 0.51 -0.30 -0.61 -1.01 0.00 0.00 177.57 176.16 1u87 h GLN 15 N 0.00 -0.19 -0.98 4.17 5.75 -1.73 0.42 115.11 122.57 1u87 h GLN 15 Ca -0.28 0.01 0.23 0.00 -0.15 0.00 0.00 58.65 58.46 1u87 h GLN 15 Cb 2.01 0.04 -0.08 0.00 1.07 0.00 0.00 27.48 30.52 1u87 h GLN 15 CO 0.08 -0.12 0.64 -1.35 -2.65 0.00 0.00 178.83 175.43 1u87 h PRO 16 N -0.19 0.39 -0.16 -2.39 0.11 -1.86 0.47 132.00 128.37 1u87 h PRO 16 Ca 0.21 -0.02 -0.18 0.00 0.11 0.00 0.00 66.00 66.11 1u87 h PRO 16 Cb 0.53 -0.09 0.01 0.00 0.11 0.00 0.00 31.00 31.56 1u87 h PRO 16 CO -0.59 0.26 -0.60 1.15 -0.21 0.00 0.00 178.00 178.01 1u87 h THR 17 N 0.40 1.31 0.40 -1.15 2.02 -0.57 -2.38 112.91 112.94 1u87 h THR 17 Ca 0.53 -1.84 -0.01 0.00 0.77 0.00 0.00 66.41 65.87 1u87 h THR 17 Cb 1.34 1.99 -0.03 0.00 -1.74 0.00 0.00 68.15 69.72 1u87 h THR 17 CO -0.23 0.57 -0.45 0.03 0.37 0.00 0.00 175.52 175.82 1u87 h ARG 18 N 0.38 -0.84 -0.38 6.66 3.08 0.31 -1.81 114.38 121.78 1u87 h ARG 18 Ca -0.03 0.06 0.08 0.00 0.07 0.00 0.00 59.98 60.16 1u87 h ARG 18 Cb 1.23 0.19 -0.09 0.00 0.08 0.00 0.00 29.97 31.38 1u87 h ARG 18 CO 0.13 -0.56 -0.31 -0.07 -1.07 0.00 0.00 179.97 178.08 1u87 h LEU 19 N -0.87 -1.03 0.16 3.04 3.38 -0.86 -0.90 115.31 118.22 1u87 h LEU 19 Ca -0.04 0.18 0.01 0.00 0.09 0.00 0.00 57.88 58.13 1u87 h LEU 19 Cb 0.78 0.49 -0.05 0.00 0.09 0.00 0.00 40.66 41.97 1u87 h LEU 19 CO -0.09 -0.31 -0.50 0.25 0.09 0.00 0.00 178.44 177.88 1u87 h LEU 20 N -0.25 -1.48 -0.52 1.67 5.85 -1.24 0.13 115.31 119.48 1u87 h LEU 20 Ca 0.17 0.15 0.08 0.00 0.84 0.00 0.00 57.88 59.13 1u87 h LEU 20 Cb 0.53 0.54 -0.10 0.00 0.37 0.00 0.00 40.66 42.00 1u87 h LEU 20 CO -0.52 -0.55 -0.41 -0.07 -0.34 0.00 0.00 178.44 176.55 1u87 h LEU 21 N -0.75 -1.39 -0.77 2.25 3.38 -0.82 0.10 115.31 117.31 1u87 h LEU 21 Ca -0.00 0.23 0.16 0.00 0.09 0.00 0.00 57.88 58.36 1u87 h LEU 21 Cb 0.75 0.64 -0.10 0.00 0.09 0.00 0.00 40.66 42.03 1u87 h LEU 21 CO -0.26 -0.34 0.27 -0.33 0.09 0.00 0.00 178.44 177.88 1u87 h GLU 22 N -0.25 0.37 -0.75 1.13 4.39 -0.65 -0.38 114.58 118.44 1u87 h GLU 22 Ca 0.18 -0.02 0.07 0.00 0.34 0.00 0.00 59.36 59.92 1u87 h GLU 22 Cb 0.57 -0.08 -0.05 0.00 -0.10 0.00 0.00 28.75 29.08 1u87 h GLU 22 CO -0.64 0.24 0.49 -0.92 -1.16 0.00 0.00 179.01 177.02 1u87 h TYR 23 N 0.38 0.79 -0.37 4.33 3.20 0.18 -1.04 116.97 124.44 1u87 h TYR 23 Ca 0.44 0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.33 1u87 h TYR 23 Cb 0.72 -0.26 0.00 0.00 1.54 0.00 0.00 36.73 38.73 1u87 h TYR 23 CO -0.19 0.41 0.00 1.28 -1.64 0.00 0.00 178.16 178.01 1u87 n LEU 24 N -4.49 2.42 -3.97 2.82 4.77 -0.17 -4.92 117.00 113.46 1u87 n LEU 24 Ca 0.11 -1.21 -0.40 0.00 -0.03 0.00 0.00 56.01 54.48 1u87 n LEU 24 Cb 0.25 -0.34 0.02 0.00 -2.33 0.00 0.00 43.42 41.01 1u87 n LEU 24 CO 0.33 0.50 -0.16 -0.62 -1.33 0.00 0.00 177.39 176.11 1u87 n GLU 25 N 0.56 -0.78 -3.71 3.23 1.02 -0.39 -4.93 120.64 115.63 1u87 n GLU 25 Ca 0.13 0.21 -0.23 0.00 -0.02 0.00 0.00 57.16 57.26 1u87 n GLU 25 Cb 0.43 -3.22 -0.02 0.00 -0.02 0.00 0.00 31.44 28.62 1u87 n GLU 25 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 1u87 s GLU 26 N -6.94 3.46 -0.21 3.49 0.41 -1.14 -5.06 118.70 112.72 1u87 s GLU 26 Ca 0.42 -0.55 -0.11 0.00 -0.41 0.00 0.00 54.97 54.32 1u87 s GLU 26 Cb -0.20 -2.80 -0.05 0.00 -1.78 0.00 0.00 34.13 29.30 1u87 s GLU 26 CO 0.94 0.32 0.18 0.21 -0.49 0.00 0.00 175.26 176.41 1u87 s LYS 27 N -4.03 4.16 -0.17 1.61 2.20 -1.26 -4.86 119.74 117.39 1u87 s LYS 27 Ca 0.37 -0.17 -0.29 0.00 -0.36 0.00 0.00 55.97 55.52 1u87 s LYS 27 Cb -0.09 -3.47 0.10 0.00 -1.51 0.00 0.00 37.83 32.86 1u87 s LYS 27 CO 0.32 0.20 0.87 1.52 -0.36 0.00 0.00 175.35 177.89 1u87 s TYR 28 N 0.65 -0.54 0.04 4.03 1.13 -1.26 -4.02 117.35 117.38 1u87 s TYR 28 Ca 0.10 1.08 0.02 0.00 -1.41 0.00 0.00 57.07 56.86 1u87 s TYR 28 Cb -0.12 0.39 -0.04 0.00 -1.10 0.00 0.00 41.96 41.09 1u87 s TYR 28 CO 0.01 -0.40 0.04 -1.21 -2.51 0.00 0.00 175.55 171.48 1u87 s GLU 29 N -0.64 2.81 -0.11 -3.49 0.41 -0.68 -4.99 118.70 112.00 1u87 s GLU 29 Ca -0.03 -0.67 0.00 0.00 -0.41 0.00 0.00 54.97 53.86 1u87 s GLU 29 Cb -0.02 -2.69 -0.02 0.00 -1.78 0.00 0.00 34.13 29.62 1u87 s GLU 29 CO 0.02 0.59 -0.12 -1.21 -0.49 0.00 0.00 175.26 174.06 1u87 s GLU 30 N -2.02 3.16 -0.46 1.61 2.02 -1.26 -1.79 118.70 119.96 1u87 s GLU 30 Ca 0.25 -0.66 -0.13 0.00 0.02 0.00 0.00 54.97 54.45 1u87 s GLU 30 Cb -0.12 -2.60 0.08 0.00 0.10 0.00 0.00 34.13 31.59 1u87 s GLU 30 CO 0.16 0.35 0.35 -1.01 0.02 0.00 0.00 175.26 175.14 1u87 s HIS 31 N -0.00 3.28 -0.14 1.61 3.76 -0.51 -5.02 115.29 118.26 1u87 s HIS 31 Ca -0.03 -1.17 -0.00 0.00 -0.15 0.00 0.00 55.06 53.71 1u87 s HIS 31 Cb -0.14 -3.13 -0.01 0.00 1.11 0.00 0.00 32.58 30.40 1u87 s HIS 31 CO 0.04 -0.83 -0.13 -0.51 -0.85 0.00 0.00 174.74 172.46 1u87 s LEU 32 N 1.56 2.66 -0.14 0.89 1.02 -1.26 -2.89 118.68 120.53 1u87 s LEU 32 Ca 0.04 -0.37 -0.07 0.00 0.02 0.00 0.00 54.13 53.74 1u87 s LEU 32 Cb -0.24 -1.61 -0.04 0.00 0.02 0.00 0.00 46.19 44.32 1u87 s LEU 32 CO 0.05 0.13 0.12 -0.31 0.02 0.00 0.00 176.35 176.36 1u87 s TYR 33 N 0.56 3.51 0.12 0.29 1.51 -1.25 -4.91 117.35 117.19 1u87 s TYR 33 Ca -0.08 0.44 -0.02 0.00 -1.01 0.00 0.00 57.07 56.40 1u87 s TYR 33 Cb -0.16 -1.98 0.03 0.00 -0.11 0.00 0.00 41.96 39.74 1u87 s TYR 33 CO 0.03 0.60 0.16 0.39 -1.11 0.00 0.00 175.55 175.62 1u87 n GLU 34 N 2.40 -0.14 0.25 -0.62 -0.58 -1.26 -2.70 120.64 117.98 1u87 n GLU 34 Ca -0.19 -0.25 0.13 0.00 -0.42 0.00 0.00 57.16 56.43 1u87 n GLU 34 Cb 0.54 -0.17 0.50 0.00 -0.57 0.00 0.00 31.44 31.75 1u87 n GLU 34 CO 0.00 0.00 0.00 -0.09 -0.48 0.00 0.00 177.13 176.56 1u87 h ARG 35 N 0.00 0.00 0.00 3.49 2.43 -1.99 -3.22 114.38 115.09 1u87 h ARG 35 Ca -0.05 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.10 1u87 h ARG 35 Cb 0.15 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 29.69 1u87 h ARG 35 CO 0.04 0.09 -1.68 -0.40 -1.51 0.00 0.00 179.97 176.51 1u87 n ASP 36 N -3.20 1.68 -0.50 -3.80 5.68 -1.26 -4.52 116.55 110.63 1u87 n ASP 36 Ca 0.01 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.30 1u87 n ASP 36 Cb 0.40 1.61 0.00 0.00 -1.14 0.00 0.00 41.12 41.99 1u87 n ASP 36 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 1u87 n GLU 37 N -2.04 0.84 0.00 0.11 1.02 -1.21 -4.30 120.64 115.06 1u87 n GLU 37 Ca -0.04 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.10 1u87 n GLU 37 Cb 0.41 -1.42 0.00 0.00 -0.02 0.00 0.00 31.44 30.41 1u87 n GLU 37 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1u87 n GLY 38 N 0.08 -0.06 0.01 0.62 0.00 -1.26 -0.38 105.19 104.20 1u87 n GLY 38 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.01 1u87 n GLY 38 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1u87 n ASP 39 N -1.01 4.12 0.06 1.61 5.68 -1.26 -4.04 116.55 121.72 1u87 n ASP 39 Ca 0.00 0.00 0.20 0.00 -0.50 0.00 0.00 54.79 54.49 1u87 n ASP 39 Cb 0.01 0.77 0.73 0.00 -1.14 0.00 0.00 41.12 41.49 1u87 n ASP 39 CO 0.00 0.00 0.00 0.50 -1.33 0.00 0.00 177.20 176.37 1u87 h LYS 40 N 0.00 0.00 0.05 0.11 3.64 -1.03 -1.84 116.57 117.50 1u87 h LYS 40 Ca -0.07 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.31 1u87 h LYS 40 Cb 0.89 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.72 1u87 h LYS 40 CO 0.00 0.00 -0.03 2.35 -2.27 0.00 0.00 179.45 179.51 1u87 h TRP 41 N 0.00 -0.07 -0.96 1.91 -0.00 -1.73 -3.33 115.95 111.78 1u87 h TRP 41 Ca 0.21 -0.00 0.28 0.00 -0.00 0.00 0.00 58.89 59.37 1u87 h TRP 41 Cb 0.92 0.02 -0.04 0.00 -0.00 0.00 0.00 29.16 30.06 1u87 h TRP 41 CO 0.00 -0.04 0.84 0.54 -0.00 0.00 0.00 178.44 179.78 1u87 n ARG 42 N -2.70 0.00 0.02 2.65 1.74 -0.75 -0.79 116.66 116.83 1u87 n ARG 42 Ca -0.01 0.67 -0.01 0.00 -0.77 0.00 0.00 57.85 57.73 1u87 n ARG 42 Cb 0.03 -1.60 -0.01 0.00 -1.02 0.00 0.00 32.46 29.86 1u87 n ARG 42 CO 0.00 0.00 0.00 -0.97 -1.52 0.00 0.00 177.63 175.14 1u87 h ASN 43 N 0.00 -0.08 0.32 0.55 -0.73 -1.52 -3.34 115.58 110.79 1u87 h ASN 43 Ca 0.46 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.63 1u87 h ASN 43 Cb 2.14 0.02 0.00 0.00 0.27 0.00 0.00 38.32 40.75 1u87 h ASN 43 CO -0.00 0.13 0.00 0.29 -0.37 0.00 0.00 177.43 177.48 1u87 n LYS 44 N -3.28 0.08 0.17 6.67 5.02 0.03 -3.67 118.16 123.17 1u87 n LYS 44 Ca -0.01 0.24 0.12 0.00 -2.02 0.00 0.00 58.31 56.64 1u87 n LYS 44 Cb 0.03 -1.50 0.33 0.00 -0.02 0.00 0.00 35.03 33.87 1u87 n LYS 44 CO 0.00 0.00 0.00 -0.22 -0.52 0.00 0.00 177.40 176.66 1u87 h LYS 45 N 0.00 0.00 0.00 1.97 3.64 -1.28 -1.66 116.57 119.24 1u87 h LYS 45 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1u87 h LYS 45 Cb 0.16 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.98 1u87 h LYS 45 CO 0.00 0.00 -0.95 1.19 -2.27 0.00 0.00 179.45 177.42 1u87 n PHE 46 N -2.87 0.00 -0.22 1.91 3.01 -1.24 -4.66 117.46 113.38 1u87 n PHE 46 Ca 0.06 0.00 0.30 0.00 1.01 0.00 0.00 57.45 58.82 1u87 n PHE 46 Cb 0.99 0.00 0.56 0.00 -0.01 0.00 0.00 39.48 41.02 1u87 n PHE 46 CO 0.00 0.00 0.00 0.93 1.01 0.00 0.00 176.76 178.70 1u87 h GLU 47 N 0.00 0.00 -0.18 -1.08 4.39 -1.47 -2.13 114.58 114.12 1u87 h GLU 47 Ca 0.00 0.00 -0.14 0.00 0.34 0.00 0.00 59.36 59.56 1u87 h GLU 47 Cb 0.95 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.59 1u87 h GLU 47 CO 0.00 0.00 -0.48 -0.07 -1.16 0.00 0.00 179.01 177.30 1u87 h LEU 48 N 0.00 0.50 0.00 1.33 3.38 -1.80 -3.48 115.31 115.25 1u87 h LEU 48 Ca 0.49 -0.25 0.00 0.00 0.09 0.00 0.00 57.88 58.22 1u87 h LEU 48 Cb 2.65 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 43.25 1u87 h LEU 48 CO -0.01 0.91 0.00 0.61 0.09 0.00 0.00 178.44 180.04 1u87 n GLY 49 N 0.09 1.78 3.73 0.83 0.00 -0.80 -5.08 105.19 105.75 1u87 n GLY 49 Ca -0.02 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.62 1u87 n GLY 49 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1u87 s LEU 50 N 0.00 4.30 0.00 0.99 1.43 -1.26 -4.92 118.68 119.22 1u87 s LEU 50 Ca 0.00 0.89 0.26 0.00 -1.03 0.00 0.00 54.13 54.24 1u87 s LEU 50 Cb 0.00 -2.74 1.27 0.00 0.03 0.00 0.00 46.19 44.74 1u87 s LEU 50 CO 0.00 0.02 1.86 -0.62 0.23 0.00 0.00 176.35 177.84 1u87 n GLU 51 N 3.49 0.31 -2.86 1.70 1.02 -1.26 -3.77 120.64 119.28 1u87 n GLU 51 Ca -0.07 0.05 -0.12 0.00 -0.02 0.00 0.00 57.16 57.00 1u87 n GLU 51 Cb 0.52 -1.50 0.04 0.00 -0.02 0.00 0.00 31.44 30.47 1u87 n GLU 51 CO 0.00 0.00 0.00 1.19 1.18 0.00 0.00 177.13 179.50 1u87 n PHE 52 N -1.32 -0.50 -1.29 -0.32 3.01 -1.26 -5.13 117.46 110.66 1u87 n PHE 52 Ca 0.11 -2.87 -0.49 0.00 1.01 0.00 0.00 57.45 55.21 1u87 n PHE 52 Cb 0.22 0.30 -0.06 0.00 -0.01 0.00 0.00 39.48 39.93 1u87 n PHE 52 CO 0.00 0.00 0.00 -2.30 1.01 0.00 0.00 176.76 175.47 1u87 n PRO 53 N 0.04 0.00 -3.13 -1.08 -0.02 -1.25 -4.74 135.00 124.82 1u87 n PRO 53 Ca 0.12 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.60 1u87 n PRO 53 Cb 0.75 -1.20 0.00 0.00 -0.02 0.00 0.00 33.50 33.03 1u87 n PRO 53 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 1u87 n ASN 54 N 1.44 0.00 -4.04 2.55 2.85 -1.26 -5.06 115.26 111.74 1u87 n ASN 54 Ca 0.17 0.00 -0.22 0.00 -0.11 0.00 0.00 54.58 54.42 1u87 n ASN 54 Cb 0.11 0.00 -0.16 0.00 1.24 0.00 0.00 39.78 40.98 1u87 n ASN 54 CO 0.00 0.00 0.00 -0.76 -2.11 0.00 0.00 177.26 174.39 1u87 s LEU 55 N 0.00 1.81 0.67 1.20 1.43 -1.26 -4.22 118.68 118.31 1u87 s LEU 55 Ca 0.00 -0.23 -0.08 0.00 -1.03 0.00 0.00 54.13 52.79 1u87 s LEU 55 Cb 0.00 -0.67 0.03 0.00 0.03 0.00 0.00 46.19 45.58 1u87 s LEU 55 CO 0.00 0.09 1.01 -2.16 0.23 0.00 0.00 176.35 175.52 1u87 s PRO 56 N 0.17 2.60 0.19 1.29 0.04 -1.26 -4.74 135.00 133.29 1u87 s PRO 56 Ca -0.04 0.06 0.07 0.00 0.04 0.00 0.00 61.00 61.14 1u87 s PRO 56 Cb -0.10 -2.15 -0.05 0.00 0.04 0.00 0.00 34.50 32.25 1u87 s PRO 56 CO 0.01 -1.03 -0.14 1.52 0.04 0.00 0.00 177.00 177.40 1u87 s TYR 57 N -3.22 1.64 -0.09 0.56 -0.85 0.17 -3.72 117.35 111.85 1u87 s TYR 57 Ca 0.57 -0.58 -0.04 0.00 -0.52 0.00 0.00 57.07 56.50 1u87 s TYR 57 Cb -0.11 -0.78 0.05 0.00 0.38 0.00 0.00 41.96 41.50 1u87 s TYR 57 CO 0.47 0.31 0.20 -0.47 -1.52 0.00 0.00 175.55 174.54 1u87 s TYR 58 N -2.87 -0.26 -0.19 -3.49 5.04 -0.50 -1.07 117.35 114.00 1u87 s TYR 58 Ca 0.20 0.68 0.01 0.00 -2.44 0.00 0.00 57.07 55.52 1u87 s TYR 58 Cb -0.01 -0.04 0.02 0.00 0.35 0.00 0.00 41.96 42.28 1u87 s TYR 58 CO 0.06 -0.23 -0.18 0.96 -1.34 0.00 0.00 175.55 174.82 1u87 s ILE 59 N 1.46 2.15 -1.60 3.14 -4.36 -0.69 -0.39 121.20 120.92 1u87 s ILE 59 Ca -0.07 -1.02 0.21 0.00 -0.26 0.00 0.00 60.65 59.51 1u87 s ILE 59 Cb -0.11 -1.96 -0.08 0.00 1.25 0.00 0.00 42.46 41.56 1u87 s ILE 59 CO -0.07 0.45 0.98 -0.67 0.24 0.00 0.00 174.94 175.87 1u87 n ASP 60 N 4.60 1.62 0.00 4.36 2.03 0.26 -2.17 116.55 127.25 1u87 n ASP 60 Ca -0.20 -1.31 0.00 0.00 0.52 0.00 0.00 54.79 53.80 1u87 n ASP 60 Cb 0.49 0.66 0.00 0.00 -0.72 0.00 0.00 41.12 41.55 1u87 n ASP 60 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1u87 n GLY 61 N 1.41 0.60 0.00 0.27 0.00 -1.26 -4.46 105.19 101.74 1u87 n GLY 61 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.09 1u87 n GLY 61 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1u87 n ASP 62 N 0.00 4.27 -3.75 1.61 8.00 -1.26 -5.02 116.55 120.40 1u87 n ASP 62 Ca 0.00 0.00 -0.10 0.00 0.71 0.00 0.00 54.79 55.40 1u87 n ASP 62 Cb 0.00 0.55 -0.05 0.00 -0.02 0.00 0.00 41.12 41.60 1u87 n ASP 62 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 1u87 s VAL 63 N -1.81 0.06 -0.31 2.53 -7.23 -1.26 -5.13 120.40 107.24 1u87 s VAL 63 Ca 0.00 -0.85 -0.02 0.00 -1.81 0.00 0.00 61.98 59.31 1u87 s VAL 63 Cb 0.00 -1.46 0.10 0.00 0.56 0.00 0.00 36.38 35.58 1u87 s VAL 63 CO 0.00 -0.26 0.12 -0.54 -0.31 0.00 0.00 175.10 174.11 1u87 s LYS 64 N -3.86 0.57 0.09 4.82 1.02 -1.26 -0.57 119.74 120.54 1u87 s LYS 64 Ca 0.08 -0.96 0.05 0.00 0.02 0.00 0.00 55.97 55.16 1u87 s LYS 64 Cb 0.01 -1.73 -0.04 0.00 -0.52 0.00 0.00 37.83 35.55 1u87 s LYS 64 CO -0.06 -1.01 -0.02 -0.51 -0.92 0.00 0.00 175.35 172.82 1u87 s LEU 65 N 1.69 3.38 0.39 3.17 1.43 0.47 -4.71 118.68 124.50 1u87 s LEU 65 Ca 0.10 -0.21 0.03 0.00 -1.03 0.00 0.00 54.13 53.03 1u87 s LEU 65 Cb -0.17 -2.11 -0.04 0.00 0.03 0.00 0.00 46.19 43.90 1u87 s LEU 65 CO -0.27 0.18 0.09 -0.89 0.23 0.00 0.00 176.35 175.70 1u87 s THR 66 N -1.27 0.89 -0.01 5.49 2.01 -1.26 -1.41 115.64 120.07 1u87 s THR 66 Ca 0.24 -2.00 -0.01 0.00 0.31 0.00 0.00 61.69 60.24 1u87 s THR 66 Cb -0.12 -2.49 0.00 0.00 0.01 0.00 0.00 72.50 69.90 1u87 s THR 66 CO 0.17 0.00 0.01 0.00 -0.69 0.00 0.00 174.62 174.11 1u87 n GLN 67 N -0.87 -0.89 -0.18 4.92 1.13 -1.24 -4.58 117.38 115.68 1u87 n GLN 67 Ca -0.06 1.06 -0.01 0.00 -1.94 0.00 0.00 57.00 56.05 1u87 n GLN 67 Cb 0.66 -1.38 0.08 0.00 0.11 0.00 0.00 30.24 29.71 1u87 n GLN 67 CO 0.00 0.00 0.00 0.66 -1.44 0.00 0.00 177.06 176.28 1u87 h SER 68 N 0.74 0.02 -0.69 1.08 4.64 -1.85 -1.91 113.55 115.58 1u87 h SER 68 Ca -0.03 0.10 -0.02 0.00 -0.47 0.00 0.00 61.79 61.37 1u87 h SER 68 Cb 0.07 0.13 -0.03 0.00 -0.31 0.00 0.00 62.40 62.25 1u87 h SER 68 CO 0.00 0.03 0.36 0.24 -0.87 0.00 0.00 176.83 176.60 1u87 h MET 69 N 0.26 0.99 -0.18 4.77 2.86 -1.91 -1.67 114.93 120.05 1u87 h MET 69 Ca 0.28 -0.12 -0.07 0.00 -2.06 0.00 0.00 59.70 57.72 1u87 h MET 69 Cb 0.38 -0.19 -0.01 0.00 0.06 0.00 0.00 31.60 31.83 1u87 h MET 69 CO -0.35 0.75 -0.20 0.00 1.06 0.00 0.00 176.91 178.16 1u87 h ALA 70 N 1.41 1.32 -0.28 6.32 0.00 -1.64 -2.49 119.26 123.91 1u87 h ALA 70 Ca 0.25 -0.28 -0.04 0.00 0.00 0.00 0.00 54.91 54.84 1u87 h ALA 70 Cb 0.06 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 1u87 h ALA 70 CO -0.04 0.46 0.00 0.82 0.00 0.00 0.00 179.25 180.50 1u87 h ILE 71 N 0.29 1.25 -0.18 0.00 2.04 -0.68 -2.36 117.51 117.88 1u87 h ILE 71 Ca 0.05 -0.91 -0.15 0.00 1.00 0.00 0.00 64.86 64.85 1u87 h ILE 71 Cb 0.53 1.31 -0.01 0.00 -0.74 0.00 0.00 36.82 37.91 1u87 h ILE 71 CO 0.04 0.29 -0.50 -0.29 0.00 0.00 0.00 178.15 177.69 1u87 h ILE 72 N 0.27 1.32 -0.49 -0.67 2.10 -1.38 -2.40 117.51 116.26 1u87 h ILE 72 Ca 0.08 -1.73 -0.07 0.00 1.08 0.00 0.00 64.86 64.21 1u87 h ILE 72 Cb 0.42 1.73 -0.02 0.00 -1.09 0.00 0.00 36.82 37.86 1u87 h ILE 72 CO 0.01 0.53 0.02 0.03 -1.08 0.00 0.00 178.15 177.66 1u87 h ARG 73 N 0.39 0.86 0.50 2.19 3.08 -1.45 -1.51 114.38 118.44 1u87 h ARG 73 Ca 0.02 -0.27 -0.02 0.00 0.07 0.00 0.00 59.98 59.78 1u87 h ARG 73 Cb 1.01 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.97 1u87 h ARG 73 CO 0.09 0.89 -0.46 -0.92 -1.07 0.00 0.00 179.97 178.50 1u87 h TYR 74 N 0.72 -1.26 -1.09 3.04 3.20 -1.29 0.85 116.97 121.14 1u87 h TYR 74 Ca 0.14 0.01 0.30 0.00 3.14 0.00 0.00 58.73 62.32 1u87 h TYR 74 Cb 0.49 0.48 -0.10 0.00 1.54 0.00 0.00 36.73 39.15 1u87 h TYR 74 CO 0.04 -0.62 0.71 0.82 -1.64 0.00 0.00 178.16 177.46 1u87 h ILE 75 N -0.95 0.45 0.44 1.81 2.04 -1.31 0.05 117.51 120.04 1u87 h ILE 75 Ca -0.06 -0.11 -0.02 0.00 1.00 0.00 0.00 64.86 65.66 1u87 h ILE 75 Cb 0.81 0.10 0.00 0.00 -0.74 0.00 0.00 36.82 36.99 1u87 h ILE 75 CO -0.03 0.06 -0.21 0.00 0.00 0.00 0.00 178.15 177.97 1u87 h ALA 76 N 1.61 -0.59 -0.72 1.87 0.00 -0.16 -3.19 119.26 118.08 1u87 h ALA 76 Ca 0.63 -0.16 0.21 0.00 0.00 0.00 0.00 54.91 55.59 1u87 h ALA 76 Cb 1.72 0.23 -0.03 0.00 0.00 0.00 0.00 17.79 19.71 1u87 h ALA 76 CO -0.30 -0.58 0.73 0.22 0.00 0.00 0.00 179.25 179.32 1u87 h ASP 77 N -1.09 0.00 -0.23 0.00 1.82 0.25 0.32 116.42 117.49 1u87 h ASP 77 Ca -0.06 0.00 -0.11 0.00 -0.39 0.00 0.00 57.03 56.47 1u87 h ASP 77 Cb 0.52 0.00 -0.06 0.00 0.68 0.00 0.00 39.33 40.47 1u87 h ASP 77 CO 0.10 0.00 0.14 0.29 -1.61 0.00 0.00 179.24 178.16 1u87 n LYS 78 N -3.66 1.42 -0.72 0.28 4.76 -0.37 -3.34 118.16 116.53 1u87 n LYS 78 Ca 0.15 -0.75 -0.03 0.00 -2.87 0.00 0.00 58.31 54.81 1u87 n LYS 78 Cb 0.99 -1.36 -0.03 0.00 -1.84 0.00 0.00 35.03 32.79 1u87 n LYS 78 CO 0.00 0.00 0.00 0.72 -1.37 0.00 0.00 177.40 176.75 1u87 n HIS 79 N 0.10 0.00 0.00 2.13 8.25 0.11 -4.99 115.22 120.82 1u87 n HIS 79 Ca 0.14 -0.21 0.00 0.00 -0.26 0.00 0.00 57.72 57.39 1u87 n HIS 79 Cb 0.74 0.32 0.00 0.00 1.12 0.00 0.00 29.99 32.17 1u87 n HIS 79 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1u87 n ASN 80 N 0.02 0.00 0.00 0.41 3.02 -1.21 -4.78 115.26 112.71 1u87 n ASN 80 Ca -0.11 0.00 0.01 0.00 -0.03 0.00 0.00 54.58 54.46 1u87 n ASN 80 Cb 0.61 -0.79 0.08 0.00 -0.61 0.00 0.00 39.78 39.07 1u87 n ASN 80 CO 0.00 0.00 0.00 0.23 -2.62 0.00 0.00 177.26 174.87 1u87 n MET 81 N -1.59 0.12 0.04 3.52 2.81 -1.23 -3.07 117.12 117.72 1u87 n MET 81 Ca 0.00 0.00 -0.13 0.00 -1.81 0.00 0.00 57.70 55.76 1u87 n MET 81 Cb 0.00 -1.38 -0.14 0.00 -0.71 0.00 0.00 33.22 31.00 1u87 n MET 81 CO 0.00 0.00 0.00 1.25 1.51 0.00 0.00 175.97 178.73 1u87 h LEU 82 N 0.00 0.23 0.00 4.03 6.46 -1.87 -3.46 115.31 120.70 1u87 h LEU 82 Ca 0.00 -0.33 0.00 0.00 -0.12 0.00 0.00 57.88 57.43 1u87 h LEU 82 Cb 0.00 -0.07 0.00 0.00 -0.73 0.00 0.00 40.66 39.86 1u87 h LEU 82 CO 0.00 1.28 0.00 0.61 -0.62 0.00 0.00 178.44 179.71 1u87 n GLY 83 N 1.59 -0.57 0.00 3.75 0.00 -1.17 -4.35 105.19 104.44 1u87 n GLY 83 Ca -0.14 -0.79 0.00 0.00 0.00 0.00 0.00 46.02 45.09 1u87 n GLY 83 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1u87 n GLY 84 N 0.00 0.02 3.46 -0.02 0.00 -1.26 -4.98 105.19 102.41 1u87 n GLY 84 Ca 0.00 -0.01 -0.12 0.00 0.00 0.00 0.00 46.02 45.89 1u87 n GLY 84 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1u87 n PRO 86 N -0.39 -0.13 0.00 0.00 -0.02 -1.26 -0.77 135.00 132.43 1u87 n PRO 86 Ca -0.16 0.84 -0.10 0.00 -2.02 0.00 0.00 63.50 62.06 1u87 n PRO 86 Cb 0.64 -1.25 -0.04 0.00 -0.02 0.00 0.00 33.50 32.84 1u87 n PRO 86 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 1u87 h LYS 87 N 0.00 -0.08 -0.18 -0.52 3.64 -1.99 -2.06 116.57 115.39 1u87 h LYS 87 Ca 0.19 0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 59.53 1u87 h LYS 87 Cb 0.32 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.16 1u87 h LYS 87 CO -0.54 -0.05 -0.04 1.49 -2.27 0.00 0.00 179.45 178.04 1u87 h GLU 88 N -0.08 0.34 -1.00 1.90 4.81 -1.36 -2.87 114.58 116.31 1u87 h GLU 88 Ca 0.07 -0.13 0.06 0.00 -0.13 0.00 0.00 59.36 59.23 1u87 h GLU 88 Cb 0.18 -0.02 -0.07 0.00 0.63 0.00 0.00 28.75 29.47 1u87 h GLU 88 CO -0.15 0.60 0.65 0.00 -0.73 0.00 0.00 179.01 179.38 1u87 h ARG 89 N 0.05 1.16 0.00 1.92 3.08 -1.38 0.37 114.38 119.58 1u87 h ARG 89 Ca 0.05 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 60.03 1u87 h ARG 89 Cb 0.48 -0.26 0.00 0.00 0.08 0.00 0.00 29.97 30.26 1u87 h ARG 89 CO 0.02 0.77 0.00 0.00 -1.07 0.00 0.00 179.97 179.68 1u87 n ALA 90 N -2.36 1.85 0.09 0.04 0.00 -0.78 -1.99 120.51 117.35 1u87 n ALA 90 Ca 0.15 -0.02 -0.19 0.00 0.00 0.00 0.00 53.44 53.39 1u87 n ALA 90 Cb 0.17 -1.35 -0.15 0.00 0.00 0.00 0.00 19.45 18.13 1u87 n ALA 90 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 1u87 h GLU 91 N 0.00 0.32 -0.13 0.00 4.81 -0.05 -2.19 114.58 117.35 1u87 h GLU 91 Ca 0.00 -0.55 -0.20 0.00 -0.13 0.00 0.00 59.36 58.48 1u87 h GLU 91 Cb 0.38 0.21 0.00 0.00 0.63 0.00 0.00 28.75 29.97 1u87 h GLU 91 CO 0.00 1.22 -0.72 0.82 -0.73 0.00 0.00 179.01 179.60 1u87 h ILE 92 N 0.09 1.32 -0.23 2.32 2.04 -1.19 -0.76 117.51 121.10 1u87 h ILE 92 Ca -0.23 -2.01 0.03 0.00 1.00 0.00 0.00 64.86 63.65 1u87 h ILE 92 Cb 2.04 1.99 -0.03 0.00 -0.74 0.00 0.00 36.82 40.09 1u87 h ILE 92 CO 0.20 0.62 0.06 0.28 0.00 0.00 0.00 178.15 179.31 1u87 h SER 93 N 0.42 0.04 -0.17 1.72 0.02 -1.44 1.40 113.55 115.54 1u87 h SER 93 Ca -0.03 0.03 0.04 0.00 -0.84 0.00 0.00 61.79 60.99 1u87 h SER 93 Cb 1.32 0.04 -0.04 0.00 0.14 0.00 0.00 62.40 63.85 1u87 h SER 93 CO 0.14 0.05 -0.09 -0.03 -1.14 0.00 0.00 176.83 175.76 1u87 h MET 94 N 0.15 -0.08 -0.92 3.45 1.85 -1.19 0.79 114.93 118.99 1u87 h MET 94 Ca 0.11 0.01 0.06 0.00 -0.61 0.00 0.00 59.70 59.26 1u87 h MET 94 Cb 0.09 0.02 -0.06 0.00 0.43 0.00 0.00 31.60 32.08 1u87 h MET 94 CO -0.13 -0.05 0.58 -0.07 -0.40 0.00 0.00 176.91 176.84 1u87 h LEU 95 N -0.08 0.93 0.00 3.39 3.38 -0.14 -0.85 115.31 121.95 1u87 h LEU 95 Ca 0.10 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.08 1u87 h LEU 95 Cb 0.23 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.78 1u87 h LEU 95 CO -0.23 0.61 0.00 1.21 0.09 0.00 0.00 178.44 180.12 1u87 n GLU 96 N -4.56 0.00 0.17 1.13 2.13 0.47 -1.59 120.64 118.40 1u87 n GLU 96 Ca 0.13 0.53 0.08 0.00 0.66 0.00 0.00 57.16 58.56 1u87 n GLU 96 Cb 0.16 -1.44 0.44 0.00 0.27 0.00 0.00 31.44 30.87 1u87 n GLU 96 CO 0.00 0.00 0.00 0.78 -0.41 0.00 0.00 177.13 177.50 1u87 h GLY 97 N 0.00 0.00 0.63 8.31 0.00 0.54 -0.72 103.07 111.83 1u87 h GLY 97 Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 47.33 47.16 1u87 h GLY 97 CO 0.00 0.00 -0.72 0.00 0.00 0.00 0.00 176.54 175.82 1u87 h ALA 98 N 1.40 -0.07 -0.14 3.60 0.00 -0.54 -3.00 119.26 120.51 1u87 h ALA 98 Ca 0.00 -0.67 -0.07 0.00 0.00 0.00 0.00 54.91 54.17 1u87 h ALA 98 Cb 0.45 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 1u87 h ALA 98 CO 0.00 0.34 -0.23 0.28 0.00 0.00 0.00 179.25 179.64 1u87 h VAL 99 N -0.41 1.23 0.18 0.00 2.07 -0.15 -2.91 116.25 116.26 1u87 h VAL 99 Ca -0.12 -1.05 -0.00 0.00 0.82 0.00 0.00 66.70 66.34 1u87 h VAL 99 Cb 1.55 1.38 -0.01 0.00 -1.52 0.00 0.00 31.29 32.69 1u87 h VAL 99 CO 0.14 0.32 -0.13 -0.07 0.02 0.00 0.00 177.57 177.85 1u87 h LEU 100 N 0.22 -0.34 -0.98 2.57 3.38 -1.34 -2.58 115.31 116.24 1u87 h LEU 100 Ca 0.04 0.03 0.35 0.00 0.09 0.00 0.00 57.88 58.38 1u87 h LEU 100 Cb 0.53 0.11 -0.18 0.00 0.09 0.00 0.00 40.66 41.21 1u87 h LEU 100 CO 0.04 -0.21 0.30 0.47 0.09 0.00 0.00 178.44 179.13 1u87 n ASP 101 N -5.25 0.13 0.06 -0.43 8.00 -1.10 -0.69 116.55 117.27 1u87 n ASP 101 Ca -0.08 1.65 -0.02 0.00 0.71 0.00 0.00 54.79 57.05 1u87 n ASP 101 Cb 0.17 -0.71 -0.01 0.00 -0.02 0.00 0.00 41.12 40.55 1u87 n ASP 101 CO 0.00 0.00 0.00 0.40 -0.39 0.00 0.00 177.20 177.21 1u87 h ILE 102 N 0.00 0.00 -0.46 0.53 2.04 -1.56 -2.58 117.51 115.47 1u87 h ILE 102 Ca 0.73 -0.05 0.05 0.00 1.00 0.00 0.00 64.86 66.59 1u87 h ILE 102 Cb 1.76 0.00 -0.08 0.00 -0.74 0.00 0.00 36.82 37.76 1u87 h ILE 102 CO -0.84 0.00 -0.54 -0.09 0.00 0.00 0.00 178.15 176.69 1u87 h ARG 103 N -0.20 -0.32 -0.98 2.37 9.65 -0.83 0.17 114.38 124.24 1u87 h ARG 103 Ca -0.01 0.02 0.07 0.00 -1.10 0.00 0.00 59.98 58.96 1u87 h ARG 103 Cb 0.11 0.07 -0.07 0.00 -1.39 0.00 0.00 29.97 28.70 1u87 h ARG 103 CO 0.02 -0.21 0.63 1.88 2.80 0.00 0.00 179.97 185.09 1u87 h TYR 104 N -0.33 1.16 -0.19 2.20 0.05 -1.07 0.46 116.97 119.24 1u87 h TYR 104 Ca 0.08 0.03 0.06 0.00 0.05 0.00 0.00 58.73 58.95 1u87 h TYR 104 Cb 0.55 -0.38 -0.01 0.00 1.01 0.00 0.00 36.73 37.90 1u87 h TYR 104 CO -0.76 0.59 0.22 0.78 -1.05 0.00 0.00 178.16 177.95 1u87 h GLY 105 N 1.13 0.00 2.00 3.88 0.00 -0.31 0.20 103.07 109.97 1u87 h GLY 105 Ca 0.43 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.71 1u87 h GLY 105 CO -0.17 0.00 -0.23 -2.08 0.00 0.00 0.00 176.54 174.06 1u87 h VAL 106 N 0.00 0.43 0.00 4.60 2.07 0.14 -3.35 116.25 120.15 1u87 h VAL 106 Ca 0.09 -1.42 -0.14 0.00 0.82 0.00 0.00 66.70 66.06 1u87 h VAL 106 Cb 0.54 2.05 -0.03 0.00 -1.52 0.00 0.00 31.29 32.34 1u87 h VAL 106 CO -0.00 0.23 -1.72 -1.54 0.02 0.00 0.00 177.57 174.55 1u87 n SER 107 N -3.21 2.11 0.00 0.57 3.41 0.47 -2.92 113.62 114.04 1u87 n SER 107 Ca 0.02 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.63 1u87 n SER 107 Cb 0.56 1.08 0.00 0.00 -0.26 0.00 0.00 64.21 65.59 1u87 n SER 107 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1u87 n ARG 108 N -2.25 0.00 0.04 4.33 1.74 0.18 -2.87 116.66 117.82 1u87 n ARG 108 Ca -0.13 0.25 0.00 0.00 -0.77 0.00 0.00 57.85 57.20 1u87 n ARG 108 Cb 0.68 -1.70 0.00 0.00 -1.02 0.00 0.00 32.46 30.42 1u87 n ARG 108 CO 0.00 0.00 0.00 0.44 -1.52 0.00 0.00 177.63 176.55 1u87 n ILE 109 N -1.23 0.62 -0.12 0.55 -5.35 -1.26 -4.79 119.36 107.78 1u87 n ILE 109 Ca 0.00 0.21 0.10 0.00 -0.27 0.00 0.00 62.75 62.78 1u87 n ILE 109 Cb 0.20 -1.20 0.15 0.00 -1.74 0.00 0.00 39.64 37.05 1u87 n ILE 109 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1u87 n ALA 110 N -3.08 0.34 0.05 -1.28 0.00 -1.14 0.23 120.51 115.62 1u87 n ALA 110 Ca 0.00 0.13 -0.20 0.00 0.00 0.00 0.00 53.44 53.38 1u87 n ALA 110 Cb 0.00 -0.21 -0.14 0.00 0.00 0.00 0.00 19.45 19.09 1u87 n ALA 110 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.50 179.38 1u87 h TYR 111 N 0.00 0.53 -0.53 0.00 0.05 -1.87 -2.63 116.97 112.53 1u87 h TYR 111 Ca 0.18 -0.39 0.00 0.00 0.05 0.00 0.00 58.73 58.56 1u87 h TYR 111 Cb 0.68 -0.02 0.00 0.00 1.01 0.00 0.00 36.73 38.39 1u87 h TYR 111 CO -0.00 1.56 0.00 0.45 -1.05 0.00 0.00 178.16 179.12 1u87 n SER 112 N -3.48 -1.06 -0.09 3.88 2.88 0.62 -4.49 113.62 111.88 1u87 n SER 112 Ca -0.23 0.00 -0.12 0.00 -1.33 0.00 0.00 58.87 57.19 1u87 n SER 112 Cb 1.06 0.00 -0.10 0.00 -0.75 0.00 0.00 64.21 64.42 1u87 n SER 112 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 1u87 n LYS 113 N -1.06 0.72 -0.47 -1.46 4.76 -1.26 -4.59 118.16 114.80 1u87 n LYS 113 Ca 0.00 0.09 -0.03 0.00 -2.87 0.00 0.00 58.31 55.50 1u87 n LYS 113 Cb 0.00 -1.39 0.01 0.00 -1.84 0.00 0.00 35.03 31.81 1u87 n LYS 113 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 1u87 n ASP 114 N -2.96 5.03 0.00 4.39 8.00 -1.26 -4.56 116.55 125.20 1u87 n ASP 114 Ca -0.32 -2.45 0.00 0.00 0.71 0.00 0.00 54.79 52.73 1u87 n ASP 114 Cb 0.90 -0.99 0.00 0.00 -0.02 0.00 0.00 41.12 41.01 1u87 n ASP 114 CO 0.00 0.00 0.00 0.33 -0.39 0.00 0.00 177.20 177.14 1u87 n PHE 115 N 1.10 0.00 0.22 1.24 7.35 -1.26 0.28 117.46 126.39 1u87 n PHE 115 Ca 0.05 0.00 0.02 0.00 -0.76 0.00 0.00 57.45 56.76 1u87 n PHE 115 Cb 0.53 -0.28 0.10 0.00 0.35 0.00 0.00 39.48 40.19 1u87 n PHE 115 CO 0.00 0.00 0.00 0.93 -0.76 0.00 0.00 176.76 176.93 1u87 h GLU 116 N 0.00 0.00 0.00 -4.13 4.39 -1.98 1.32 114.58 114.18 1u87 h GLU 116 Ca 0.00 0.00 -0.26 0.00 0.34 0.00 0.00 59.36 59.44 1u87 h GLU 116 Cb 0.00 0.00 -0.05 0.00 -0.10 0.00 0.00 28.75 28.60 1u87 h GLU 116 CO 0.00 0.00 -2.07 2.41 -1.16 0.00 0.00 179.01 178.19 1u87 n THR 117 N -2.08 0.98 0.02 1.13 -1.04 0.07 -4.54 114.28 108.83 1u87 n THR 117 Ca -0.00 -0.65 0.03 0.00 -2.04 0.00 0.00 64.05 61.39 1u87 n THR 117 Cb 0.74 -0.49 -0.10 0.00 -1.82 0.00 0.00 70.33 68.66 1u87 n THR 117 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 1u87 n LEU 118 N -2.54 0.54 -0.17 -4.42 4.77 0.82 -4.17 117.00 111.83 1u87 n LEU 118 Ca -0.24 0.23 -0.02 0.00 -0.03 0.00 0.00 56.01 55.95 1u87 n LEU 118 Cb 0.96 0.09 0.19 0.00 -2.33 0.00 0.00 43.42 42.33 1u87 n LEU 118 CO 0.34 0.10 1.05 0.07 -1.33 0.00 0.00 177.39 177.63 1u87 h LYS 119 N 0.00 0.92 -0.62 3.23 2.10 -0.48 -0.87 116.57 120.84 1u87 h LYS 119 Ca -0.15 -0.15 0.02 0.00 -2.00 0.00 0.00 60.65 58.37 1u87 h LYS 119 Cb 1.44 -0.16 -0.04 0.00 -0.90 0.00 0.00 32.23 32.57 1u87 h LYS 119 CO 0.02 0.76 0.39 0.28 -2.00 0.00 0.00 179.45 178.90 1u87 h VAL 120 N 0.91 1.09 0.00 0.07 2.07 -1.78 0.73 116.25 119.34 1u87 h VAL 120 Ca 0.21 -0.27 0.00 0.00 0.82 0.00 0.00 66.70 67.47 1u87 h VAL 120 Cb 0.18 0.25 0.00 0.00 -1.52 0.00 0.00 31.29 30.20 1u87 h VAL 120 CO -0.02 0.14 0.00 -0.78 0.02 0.00 0.00 177.57 176.93 1u87 h ASP 121 N 0.77 0.00 0.00 0.57 3.58 -1.37 -2.37 116.42 117.61 1u87 h ASP 121 Ca 0.25 0.00 -0.06 0.00 0.42 0.00 0.00 57.03 57.63 1u87 h ASP 121 Cb -0.00 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.04 1u87 h ASP 121 CO -0.09 0.00 -0.81 0.33 -2.88 0.00 0.00 179.24 175.78 1u87 n PHE 122 N -2.55 0.76 0.31 0.28 7.35 0.06 -4.23 117.46 119.44 1u87 n PHE 122 Ca 0.00 0.33 0.10 0.00 -0.76 0.00 0.00 57.45 57.12 1u87 n PHE 122 Cb 0.18 -0.80 0.54 0.00 0.35 0.00 0.00 39.48 39.75 1u87 n PHE 122 CO 0.00 0.00 0.00 -0.07 -0.76 0.00 0.00 176.76 175.93 1u87 h LEU 123 N -1.00 0.00 -0.26 -2.13 3.38 0.51 0.63 115.31 116.43 1u87 h LEU 123 Ca -0.10 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.67 1u87 h LEU 123 Cb 0.78 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.53 1u87 h LEU 123 CO -0.06 0.00 -0.80 0.77 0.09 0.00 0.00 178.44 178.44 1u87 h SER 124 N 0.00 0.66 0.13 -0.43 4.64 -1.60 -3.27 113.55 113.68 1u87 h SER 124 Ca 0.00 -0.46 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 1u87 h SER 124 Cb 1.00 -0.20 0.00 0.00 -0.31 0.00 0.00 62.40 62.90 1u87 h SER 124 CO 0.00 1.23 -1.08 0.29 -0.87 0.00 0.00 176.83 176.40 1u87 n LYS 125 N -3.85 0.13 0.09 4.77 5.02 0.19 -4.59 118.16 119.92 1u87 n LYS 125 Ca -0.06 -0.03 -0.12 0.00 -2.02 0.00 0.00 58.31 56.08 1u87 n LYS 125 Cb 0.75 -1.52 -0.07 0.00 -0.02 0.00 0.00 35.03 34.17 1u87 n LYS 125 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 1u87 h LEU 126 N 0.00 -1.18 -1.99 -0.35 5.85 -0.88 -2.73 115.31 114.02 1u87 h LEU 126 Ca 0.00 0.12 0.35 0.00 0.84 0.00 0.00 57.88 59.19 1u87 h LEU 126 Cb 0.60 0.43 -0.05 0.00 0.37 0.00 0.00 40.66 42.02 1u87 h LEU 126 CO 0.00 -0.41 0.86 -0.65 -0.34 0.00 0.00 178.44 177.90 1u87 h PRO 127 N -0.56 0.00 0.00 5.25 0.11 -1.81 0.16 132.00 135.15 1u87 h PRO 127 Ca -0.01 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 66.05 1u87 h PRO 127 Cb 0.56 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.67 1u87 h PRO 127 CO -0.21 0.00 -0.26 0.93 -0.21 0.00 0.00 178.00 178.25 1u87 h GLU 128 N 0.00 0.00 0.00 1.05 5.08 -1.77 -1.55 114.58 117.39 1u87 h GLU 128 Ca 0.57 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.91 1u87 h GLU 128 Cb 2.29 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 31.53 1u87 h GLU 128 CO -0.01 0.26 -0.31 0.52 -1.00 0.00 0.00 179.01 178.47 1u87 h MET 129 N 0.00 0.00 -0.94 2.33 0.00 -0.76 -3.34 114.93 112.22 1u87 h MET 129 Ca -0.00 0.00 0.13 0.00 0.00 0.00 0.00 59.70 59.83 1u87 h MET 129 Cb 0.56 0.00 -0.15 0.00 0.00 0.00 0.00 31.60 32.01 1u87 h MET 129 CO 0.03 0.12 -0.43 -0.07 0.00 0.00 0.00 176.91 176.56 1u87 h LEU 130 N -1.00 -1.59 -0.76 1.22 3.38 -1.43 0.66 115.31 115.79 1u87 h LEU 130 Ca -0.02 0.31 0.16 0.00 0.09 0.00 0.00 57.88 58.42 1u87 h LEU 130 Cb 0.37 0.79 -0.11 0.00 0.09 0.00 0.00 40.66 41.80 1u87 h LEU 130 CO -0.01 -0.28 0.24 0.50 0.09 0.00 0.00 178.44 178.97 1u87 h LYS 131 N -0.03 0.32 -0.87 1.13 3.64 -1.47 0.22 116.57 119.52 1u87 h LYS 131 Ca 0.29 -0.02 0.22 0.00 -1.27 0.00 0.00 60.65 59.87 1u87 h LYS 131 Cb 0.55 -0.07 -0.13 0.00 -0.41 0.00 0.00 32.23 32.17 1u87 h LYS 131 CO -0.94 0.21 0.28 0.52 -2.27 0.00 0.00 179.45 177.26 1u87 h MET 132 N 0.33 0.27 -0.02 1.90 2.86 -0.98 0.51 114.93 119.80 1u87 h MET 132 Ca 0.43 -0.02 -0.00 0.00 -2.06 0.00 0.00 59.70 58.05 1u87 h MET 132 Cb 0.73 -0.06 -0.00 0.00 0.06 0.00 0.00 31.60 32.33 1u87 h MET 132 CO -0.48 0.18 0.00 0.74 1.06 0.00 0.00 176.91 178.41 1u87 h PHE 133 N 0.27 0.03 -0.94 -0.22 0.04 -0.54 -2.92 116.94 112.67 1u87 h PHE 133 Ca 0.54 -0.00 0.08 0.00 2.80 0.00 0.00 57.97 61.39 1u87 h PHE 133 Cb 1.07 -0.01 -0.11 0.00 2.20 0.00 0.00 35.95 39.09 1u87 h PHE 133 CO -0.22 0.27 -0.55 -1.91 -0.60 0.00 0.00 178.31 175.30 1u87 n GLU 134 N -4.95 -0.41 0.34 1.51 4.07 0.16 0.20 120.64 121.56 1u87 n GLU 134 Ca -0.07 1.46 0.17 0.00 -0.06 0.00 0.00 57.16 58.66 1u87 n GLU 134 Cb 0.15 -2.15 0.93 0.00 -0.06 0.00 0.00 31.44 30.31 1u87 n GLU 134 CO 0.00 0.00 0.00 -0.44 -0.06 0.00 0.00 177.13 176.63 1u87 h ASP 135 N 0.00 0.00 0.04 4.31 5.19 -0.93 -1.89 116.42 123.13 1u87 h ASP 135 Ca 0.15 0.00 -0.00 0.00 -0.62 0.00 0.00 57.03 56.56 1u87 h ASP 135 Cb 0.39 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.90 1u87 h ASP 135 CO -0.88 0.00 -0.02 -0.09 -3.12 0.00 0.00 179.24 175.13 1u87 h ARG 136 N 0.00 -0.05 -0.12 3.56 9.65 0.24 -3.29 114.38 124.37 1u87 h ARG 136 Ca 0.00 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.88 1u87 h ARG 136 Cb 0.48 0.01 0.00 0.00 -1.39 0.00 0.00 29.97 29.07 1u87 h ARG 136 CO -0.00 0.49 0.00 1.28 2.80 0.00 0.00 179.97 184.54 1u87 n LEU 137 N -4.74 0.12 0.23 3.80 4.77 -0.57 -3.88 117.00 116.72 1u87 n LEU 137 Ca -0.06 -0.06 -0.14 0.00 -0.03 0.00 0.00 56.01 55.72 1u87 n LEU 137 Cb 0.27 -0.06 -0.08 0.00 -2.33 0.00 0.00 43.42 41.22 1u87 n LEU 137 CO 0.21 0.03 0.52 0.00 -1.33 0.00 0.00 177.39 176.82 1u87 n HIS 139 N -5.24 3.41 -3.54 0.00 8.25 -1.25 -4.98 115.22 111.87 1u87 n HIS 139 Ca -0.10 -3.08 -0.15 0.00 -0.26 0.00 0.00 57.72 54.13 1u87 n HIS 139 Cb 0.30 -0.26 -0.05 0.00 1.12 0.00 0.00 29.99 31.10 1u87 n HIS 139 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 1u87 s LYS 140 N -3.61 1.07 -0.04 -0.41 1.02 -1.25 -5.07 119.74 111.45 1u87 s LYS 140 Ca 0.48 -0.10 -0.03 0.00 0.02 0.00 0.00 55.97 56.35 1u87 s LYS 140 Cb 0.39 0.49 -0.27 0.00 -0.52 0.00 0.00 37.83 37.93 1u87 s LYS 140 CO -0.21 -0.38 0.68 1.15 -0.92 0.00 0.00 175.35 175.66 1u87 h THR 141 N 2.78 0.94 -4.00 2.17 2.02 -1.85 -3.44 112.91 111.53 1u87 h THR 141 Ca -0.30 -2.62 -0.20 0.00 0.77 0.00 0.00 66.41 64.06 1u87 h THR 141 Cb 1.20 2.65 -0.20 0.00 -1.74 0.00 0.00 68.15 70.06 1u87 h THR 141 CO 0.40 0.80 -0.71 -0.31 0.37 0.00 0.00 175.52 176.07 1u87 s TYR 142 N -2.59 0.46 0.18 3.16 2.02 -0.74 -4.97 117.35 114.87 1u87 s TYR 142 Ca -0.13 -0.63 0.00 0.00 -0.37 0.00 0.00 57.07 55.94 1u87 s TYR 142 Cb 0.07 -0.30 0.00 0.00 -0.40 0.00 0.00 41.96 41.32 1u87 s TYR 142 CO 0.83 -0.18 0.50 1.28 -1.57 0.00 0.00 175.55 176.40 1u87 n LEU 143 N 1.22 0.00 0.00 -1.29 4.32 -1.26 -0.94 117.00 119.04 1u87 n LEU 143 Ca -0.21 0.14 0.00 0.00 -0.02 0.00 0.00 56.01 55.92 1u87 n LEU 143 Cb 0.56 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.36 1u87 n LEU 143 CO 0.22 -0.14 -0.39 -3.20 -1.22 0.00 0.00 177.39 172.66 1u87 n ASN 144 N -1.19 3.87 0.00 -1.43 5.15 -1.26 -5.00 115.26 115.40 1u87 n ASN 144 Ca 0.00 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.98 1u87 n ASN 144 Cb 0.50 0.42 0.00 0.00 -0.53 0.00 0.00 39.78 40.17 1u87 n ASN 144 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1u87 n GLY 145 N 2.39 -0.54 0.11 8.20 0.00 -0.12 -4.98 105.19 110.25 1u87 n GLY 145 Ca 0.00 0.09 -0.14 0.00 0.00 0.00 0.00 46.02 45.97 1u87 n GLY 145 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1u87 n ASP 146 N 0.00 1.32 -4.85 1.61 8.00 -1.26 -1.80 116.55 119.58 1u87 n ASP 146 Ca 0.00 0.28 -0.31 0.00 0.71 0.00 0.00 54.79 55.47 1u87 n ASP 146 Cb 0.00 -0.29 0.03 0.00 -0.02 0.00 0.00 41.12 40.84 1u87 n ASP 146 CO 0.00 0.00 0.00 -1.00 -0.39 0.00 0.00 177.20 175.81 1u87 s HIS 147 N -2.57 3.36 0.53 1.24 3.76 -1.26 -4.85 115.29 115.51 1u87 s HIS 147 Ca -0.13 1.33 -0.06 0.00 -0.15 0.00 0.00 55.06 56.05 1u87 s HIS 147 Cb 0.07 -2.82 0.12 0.00 1.11 0.00 0.00 32.58 31.06 1u87 s HIS 147 CO 0.79 -0.99 0.73 0.28 -0.85 0.00 0.00 174.74 174.70 1u87 n VAL 148 N -2.95 0.00 -3.65 -0.90 0.31 -1.26 -4.75 118.33 105.13 1u87 n VAL 148 Ca 0.07 -0.76 -0.03 0.00 -0.01 0.00 0.00 64.34 63.61 1u87 n VAL 148 Cb 0.54 -1.43 -0.07 0.00 -0.91 0.00 0.00 33.84 31.98 1u87 n VAL 148 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 1u87 s THR 149 N -2.35 0.00 0.35 2.52 -1.32 -1.26 -5.00 115.64 108.58 1u87 s THR 149 Ca 0.44 0.00 0.19 0.00 -1.21 0.00 0.00 61.69 61.11 1u87 s THR 149 Cb -0.02 -1.00 0.34 0.00 -1.51 0.00 0.00 72.50 70.31 1u87 s THR 149 CO 0.30 0.00 1.52 0.00 -2.21 0.00 0.00 174.62 174.23 1u87 n HIS 150 N 2.27 1.10 -0.07 9.09 1.44 -1.26 0.62 115.22 128.40 1u87 n HIS 150 Ca -0.13 1.14 0.24 0.00 -2.01 0.00 0.00 57.72 56.95 1u87 n HIS 150 Cb 0.57 -1.53 0.71 0.00 0.12 0.00 0.00 29.99 29.86 1u87 n HIS 150 CO 0.00 0.00 0.00 -1.35 -2.81 0.00 0.00 176.34 172.18 1u87 h PRO 151 N 0.00 0.00 -0.48 -1.40 0.11 -1.96 0.32 132.00 128.58 1u87 h PRO 151 Ca 0.81 0.00 0.01 0.00 0.11 0.00 0.00 66.00 66.92 1u87 h PRO 151 Cb 2.12 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 33.21 1u87 h PRO 151 CO -0.75 0.00 0.32 -0.44 -0.21 0.00 0.00 178.00 176.92 1u87 h ASP 152 N 0.00 0.54 0.20 -2.05 3.32 -0.23 -1.23 116.42 116.97 1u87 h ASP 152 Ca 0.33 -0.01 -0.14 0.00 0.02 0.00 0.00 57.03 57.23 1u87 h ASP 152 Cb 1.33 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 40.73 1u87 h ASP 152 CO -0.00 0.39 -0.51 -0.26 -1.72 0.00 0.00 179.24 177.14 1u87 h PHE 153 N 0.64 0.43 -0.21 4.55 0.04 -0.55 -1.81 116.94 120.04 1u87 h PHE 153 Ca 0.18 -0.14 -0.05 0.00 2.80 0.00 0.00 57.97 60.76 1u87 h PHE 153 Cb -0.06 -0.08 -0.01 0.00 2.20 0.00 0.00 35.95 37.99 1u87 h PHE 153 CO -0.04 0.79 -0.08 0.52 -0.60 0.00 0.00 178.31 178.90 1u87 h MET 154 N 0.27 0.32 -0.03 1.51 2.86 -0.68 -2.61 114.93 116.57 1u87 h MET 154 Ca 0.01 -0.07 -0.14 0.00 -2.06 0.00 0.00 59.70 57.44 1u87 h MET 154 Cb 0.99 -0.05 0.01 0.00 0.06 0.00 0.00 31.60 32.62 1u87 h MET 154 CO 0.09 0.42 -0.52 1.25 1.06 0.00 0.00 176.91 179.21 1u87 h LEU 155 N 0.31 0.51 -1.72 1.22 5.85 -0.96 -2.69 115.31 117.82 1u87 h LEU 155 Ca 0.07 -0.72 0.00 0.00 0.84 0.00 0.00 57.88 58.07 1u87 h LEU 155 Cb 0.34 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 41.21 1u87 h LEU 155 CO 0.02 1.16 0.31 0.22 -0.34 0.00 0.00 178.44 179.81 1u87 h TYR 156 N -0.09 0.00 0.00 1.25 3.20 -0.98 -1.48 116.97 118.87 1u87 h TYR 156 Ca -0.06 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.81 1u87 h TYR 156 Cb 1.21 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.48 1u87 h TYR 156 CO 0.14 0.00 -0.00 0.22 -1.64 0.00 0.00 178.16 176.88 1u87 h ASP 157 N 0.00 0.00 -0.81 -2.11 1.82 -1.17 -2.91 116.42 111.24 1u87 h ASP 157 Ca 0.00 0.00 0.30 0.00 -0.39 0.00 0.00 57.03 56.94 1u87 h ASP 157 Cb 0.63 0.00 -0.15 0.00 0.68 0.00 0.00 39.33 40.49 1u87 h ASP 157 CO 0.00 0.02 0.29 0.00 -1.61 0.00 0.00 179.24 177.94 1u87 n ALA 158 N -2.05 0.68 0.35 -0.78 0.00 -0.79 -0.54 120.51 117.38 1u87 n ALA 158 Ca -0.00 0.84 -0.14 0.00 0.00 0.00 0.00 53.44 54.14 1u87 n ALA 158 Cb 0.00 -0.76 -0.07 0.00 0.00 0.00 0.00 19.45 18.63 1u87 n ALA 158 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1u87 h LEU 159 N 0.00 -0.78 -1.76 0.00 3.38 -1.43 -0.23 115.31 114.49 1u87 h LEU 159 Ca 0.62 0.03 0.31 0.00 0.09 0.00 0.00 57.88 58.93 1u87 h LEU 159 Cb 1.53 0.20 -0.07 0.00 0.09 0.00 0.00 40.66 42.42 1u87 h LEU 159 CO -0.67 -0.40 0.78 -0.78 0.09 0.00 0.00 178.44 177.45 1u87 h ASP 160 N -1.23 0.16 0.08 -0.43 3.58 -0.60 -0.88 116.42 117.10 1u87 h ASP 160 Ca -0.09 0.03 -0.00 0.00 0.42 0.00 0.00 57.03 57.39 1u87 h ASP 160 Cb 0.71 0.01 0.00 0.00 1.72 0.00 0.00 39.33 41.76 1u87 h ASP 160 CO 0.15 0.02 -0.04 0.58 -2.88 0.00 0.00 179.24 177.08 1u87 h VAL 161 N 0.14 0.00 -0.98 2.25 2.07 -1.07 -3.33 116.25 115.33 1u87 h VAL 161 Ca 0.57 -0.13 0.33 0.00 0.82 0.00 0.00 66.70 68.30 1u87 h VAL 161 Cb 1.97 0.00 -0.16 0.00 -1.52 0.00 0.00 31.29 31.58 1u87 h VAL 161 CO -0.12 0.00 0.46 -0.37 0.02 0.00 0.00 177.57 177.56 1u87 h VAL 162 N -0.23 0.20 0.00 2.57 -1.51 -0.60 0.12 116.25 116.81 1u87 h VAL 162 Ca -0.01 -0.07 0.00 0.00 -1.23 0.00 0.00 66.70 65.39 1u87 h VAL 162 Cb 0.08 -0.01 0.00 0.00 -2.13 0.00 0.00 31.29 29.23 1u87 h VAL 162 CO 0.02 0.04 0.00 0.18 -1.23 0.00 0.00 177.57 176.57 1u87 n LEU 163 N -5.17 0.08 -0.00 4.19 4.77 -0.37 0.16 117.00 120.66 1u87 n LEU 163 Ca 0.31 -0.04 0.01 0.00 -0.03 0.00 0.00 56.01 56.25 1u87 n LEU 163 Cb 0.99 -0.04 -0.01 0.00 -2.33 0.00 0.00 43.42 42.03 1u87 n LEU 163 CO 0.06 0.02 -0.43 -1.22 -1.33 0.00 0.00 177.39 174.49 1u87 n TYR 164 N -0.16 0.00 0.32 -1.77 4.01 0.43 -4.25 117.16 115.74 1u87 n TYR 164 Ca 0.00 0.00 0.11 0.00 -0.16 0.00 0.00 57.90 57.85 1u87 n TYR 164 Cb 0.02 -0.03 0.03 0.00 -0.31 0.00 0.00 39.34 39.05 1u87 n TYR 164 CO 0.00 0.00 0.00 -0.12 -0.46 0.00 0.00 176.86 176.28 1u87 n MET 165 N -1.47 0.46 0.00 -0.72 1.56 0.42 -4.85 117.12 112.52 1u87 n MET 165 Ca -0.00 0.06 0.00 0.00 -0.27 0.00 0.00 57.70 57.48 1u87 n MET 165 Cb 0.04 -1.71 0.00 0.00 2.15 0.00 0.00 33.22 33.70 1u87 n MET 165 CO 0.00 0.00 0.00 -3.47 -0.73 0.00 0.00 175.97 171.77 1u87 n ASP 166 N -2.33 0.00 -1.14 6.12 2.03 -0.65 -5.04 116.55 115.54 1u87 n ASP 166 Ca 0.01 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.32 1u87 n ASP 166 Cb 0.50 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.90 1u87 n ASP 166 CO 0.00 0.00 0.00 -2.65 -1.92 0.00 0.00 177.20 172.63 1u87 n PRO 167 N 0.00 0.13 0.00 -0.67 -0.02 -1.26 -2.42 135.00 130.76 1u87 n PRO 167 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 1u87 n PRO 167 Cb 0.00 -1.43 0.00 0.00 -0.02 0.00 0.00 33.50 32.05 1u87 n PRO 167 CO 0.00 0.00 0.00 -1.33 1.98 0.00 0.00 175.50 176.15 1u87 n MET 168 N 1.08 3.06 0.30 -0.52 2.81 -1.26 -4.78 117.12 117.81 1u87 n MET 168 Ca 0.00 0.00 0.15 0.00 -1.81 0.00 0.00 57.70 56.04 1u87 n MET 168 Cb 0.07 -0.38 0.82 0.00 -0.71 0.00 0.00 33.22 33.02 1u87 n MET 168 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1u87 n LEU 170 N -2.76 0.92 0.19 0.00 4.77 -1.26 -4.61 117.00 114.25 1u87 n LEU 170 Ca -0.02 -0.50 -0.12 0.00 -0.03 0.00 0.00 56.01 55.34 1u87 n LEU 170 Cb 0.28 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.30 1u87 n LEU 170 CO 0.13 0.23 0.52 0.44 -1.33 0.00 0.00 177.39 177.38 1u87 h ASP 171 N 0.00 -0.93 0.00 -1.43 3.32 -1.66 -1.27 116.42 114.45 1u87 h ASP 171 Ca 0.00 0.07 0.00 0.00 0.02 0.00 0.00 57.03 57.12 1u87 h ASP 171 Cb 0.46 0.31 0.00 0.00 0.22 0.00 0.00 39.33 40.32 1u87 h ASP 171 CO 0.00 -0.45 0.49 0.00 -1.72 0.00 0.00 179.24 177.57 1u87 h ALA 172 N -1.19 1.48 -3.19 3.45 0.00 -1.82 -3.22 119.26 114.78 1u87 h ALA 172 Ca -0.04 0.00 -0.66 0.00 0.00 0.00 0.00 54.91 54.20 1u87 h ALA 172 Cb 0.58 0.00 -0.38 0.00 0.00 0.00 0.00 17.79 17.99 1u87 h ALA 172 CO -0.04 -0.48 -0.46 -0.06 0.00 0.00 0.00 179.25 178.21 1u87 s PHE 173 N -3.98 3.42 0.06 0.00 0.08 -0.48 -4.99 117.98 112.08 1u87 s PHE 173 Ca -0.02 -3.03 -0.35 0.00 0.12 0.00 0.00 56.93 53.64 1u87 s PHE 173 Cb 0.06 -2.99 -0.20 0.00 -0.57 0.00 0.00 43.02 39.32 1u87 s PHE 173 CO 0.19 -0.74 1.53 -1.00 -0.10 0.00 0.00 175.22 175.10 1u87 h PRO 174 N 6.42 -1.15 -1.00 0.24 0.13 -1.67 -3.20 132.00 131.76 1u87 h PRO 174 Ca 0.01 0.08 0.25 0.00 -0.87 0.00 0.00 66.00 65.48 1u87 h PRO 174 Cb 0.88 0.26 -0.08 0.00 0.13 0.00 0.00 31.00 32.19 1u87 h PRO 174 CO 0.72 -0.77 0.66 0.87 -0.23 0.00 0.00 178.00 179.26 1u87 h LYS 175 N -1.23 0.33 -0.42 0.86 1.79 -1.93 0.25 116.57 116.22 1u87 h LYS 175 Ca -0.12 -0.02 -0.08 0.00 -2.18 0.00 0.00 60.65 58.25 1u87 h LYS 175 Cb 0.92 -0.07 -0.01 0.00 -1.58 0.00 0.00 32.23 31.48 1u87 h LYS 175 CO 0.20 0.22 -0.05 -0.07 -1.08 0.00 0.00 179.45 178.66 1u87 h LEU 176 N 0.34 0.77 -1.45 2.94 3.38 -1.91 -0.95 115.31 118.43 1u87 h LEU 176 Ca 0.54 -0.34 0.00 0.00 0.09 0.00 0.00 57.88 58.17 1u87 h LEU 176 Cb 1.49 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 42.03 1u87 h LEU 176 CO -0.21 0.92 0.00 0.58 0.09 0.00 0.00 178.44 179.82 1u87 h VAL 177 N 0.60 0.00 0.11 1.22 2.07 -0.51 -0.28 116.25 119.45 1u87 h VAL 177 Ca 0.11 -0.08 -0.36 0.00 0.82 0.00 0.00 66.70 67.19 1u87 h VAL 177 Cb 0.56 0.70 -0.02 0.00 -1.52 0.00 0.00 31.29 31.02 1u87 h VAL 177 CO 0.03 0.00 -1.99 0.00 0.02 0.00 0.00 177.57 175.63 1u87 h PHE 179 N 0.06 0.99 0.55 0.00 3.57 0.26 1.14 116.94 123.52 1u87 h PHE 179 Ca -0.42 0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.09 1u87 h PHE 179 Cb 2.03 -0.30 0.01 0.00 2.79 0.00 0.00 35.95 40.48 1u87 h PHE 179 CO 0.07 0.27 -0.27 -0.22 -2.23 0.00 0.00 178.31 175.94 1u87 h LYS 180 N 0.77 -0.71 -0.27 1.11 3.64 -1.40 -0.05 116.57 119.66 1u87 h LYS 180 Ca 0.52 0.05 0.02 0.00 -1.27 0.00 0.00 60.65 59.97 1u87 h LYS 180 Cb 0.72 0.16 -0.03 0.00 -0.41 0.00 0.00 32.23 32.67 1u87 h LYS 180 CO -0.35 -0.44 0.11 0.87 -2.27 0.00 0.00 179.45 177.37 1u87 h LYS 181 N -0.84 0.23 -0.81 1.90 1.57 -1.28 0.54 116.57 117.88 1u87 h LYS 181 Ca -0.08 -0.01 0.20 0.00 -1.87 0.00 0.00 60.65 58.89 1u87 h LYS 181 Cb 0.61 -0.05 -0.13 0.00 0.08 0.00 0.00 32.23 32.74 1u87 h LYS 181 CO 0.12 0.15 0.20 -0.09 -0.57 0.00 0.00 179.45 179.26 1u87 h ARG 182 N 0.24 0.23 0.58 3.15 2.43 0.15 0.42 114.38 121.58 1u87 h ARG 182 Ca 0.12 -0.01 -0.03 0.00 -0.81 0.00 0.00 59.98 59.24 1u87 h ARG 182 Cb 0.07 -0.05 0.01 0.00 -0.42 0.00 0.00 29.97 29.57 1u87 h ARG 182 CO -0.11 0.15 -0.28 0.82 -1.51 0.00 0.00 179.97 179.05 1u87 h ILE 183 N 0.24 0.15 0.00 1.20 1.08 -0.37 -2.64 117.51 117.17 1u87 h ILE 183 Ca 0.48 -0.41 0.00 0.00 -0.39 0.00 0.00 64.86 64.55 1u87 h ILE 183 Cb 0.90 0.22 0.00 0.00 -3.07 0.00 0.00 36.82 34.87 1u87 h ILE 183 CO -0.59 0.03 0.00 -0.62 -0.69 0.00 0.00 178.15 176.27 1u87 n GLU 184 N -5.31 0.00 -0.31 2.37 1.02 0.13 -0.77 120.64 117.76 1u87 n GLU 184 Ca -0.11 0.00 0.07 0.00 -0.02 0.00 0.00 57.16 57.10 1u87 n GLU 184 Cb 0.33 -1.37 0.21 0.00 -0.02 0.00 0.00 31.44 30.59 1u87 n GLU 184 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1u87 n ALA 185 N -0.84 2.56 -2.63 0.62 0.00 0.13 -4.57 120.51 115.78 1u87 n ALA 185 Ca 0.00 -1.63 -0.40 0.00 0.00 0.00 0.00 53.44 51.41 1u87 n ALA 185 Cb 0.00 -0.58 -0.07 0.00 0.00 0.00 0.00 19.45 18.80 1u87 n ALA 185 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1u87 s ILE 186 N -1.77 5.06 0.06 0.00 1.01 0.05 -4.98 121.20 120.63 1u87 s ILE 186 Ca 0.32 0.96 -0.11 0.00 0.00 0.00 0.00 60.65 61.82 1u87 s ILE 186 Cb 0.22 -3.85 -0.02 0.00 0.01 0.00 0.00 42.46 38.81 1u87 s ILE 186 CO 0.14 0.10 0.83 -2.65 0.00 0.00 0.00 174.94 173.36 1u87 n PRO 187 N 5.35 -0.16 -0.12 2.79 -0.02 -1.26 -0.67 135.00 140.90 1u87 n PRO 187 Ca -0.04 0.82 -0.05 0.00 -2.02 0.00 0.00 63.50 62.22 1u87 n PRO 187 Cb 0.50 -1.22 -0.04 0.00 -0.02 0.00 0.00 33.50 32.72 1u87 n PRO 187 CO 0.00 0.00 0.00 1.96 1.98 0.00 0.00 175.50 179.44 1u87 h GLN 188 N 0.00 -0.06 -0.93 -0.52 7.50 -1.92 0.45 115.11 119.63 1u87 h GLN 188 Ca 0.06 0.00 0.27 0.00 0.50 0.00 0.00 58.65 59.48 1u87 h GLN 188 Cb 0.15 0.01 -0.04 0.00 0.05 0.00 0.00 27.48 27.65 1u87 h GLN 188 CO -0.33 -0.04 0.67 0.82 -1.50 0.00 0.00 178.83 178.44 1u87 h ILE 189 N -0.06 0.54 0.49 2.54 1.08 -1.21 -1.60 117.51 119.29 1u87 h ILE 189 Ca 0.05 -0.01 -0.02 0.00 -0.39 0.00 0.00 64.86 64.48 1u87 h ILE 189 Cb 0.19 0.51 0.00 0.00 -3.07 0.00 0.00 36.82 34.45 1u87 h ILE 189 CO -0.32 0.01 -0.24 -0.78 -0.69 0.00 0.00 178.15 176.13 1u87 h ASP 190 N 0.03 -0.56 -1.41 1.72 1.82 0.19 -2.59 116.42 115.62 1u87 h ASP 190 Ca 0.45 0.02 0.43 0.00 -0.39 0.00 0.00 57.03 57.53 1u87 h ASP 190 Cb 1.74 0.14 -0.10 0.00 0.68 0.00 0.00 39.33 41.80 1u87 h ASP 190 CO -0.02 -0.18 0.97 0.50 -1.61 0.00 0.00 179.24 178.89 1u87 h LYS 191 N -1.09 0.08 0.00 0.28 3.64 -0.08 -2.14 116.57 117.26 1u87 h LYS 191 Ca -0.07 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.31 1u87 h LYS 191 Cb 0.50 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.31 1u87 h LYS 191 CO 0.11 0.06 0.00 0.98 -2.27 0.00 0.00 179.45 178.33 1u87 n TYR 192 N -4.40 0.00 -0.43 1.91 9.36 -0.95 -3.25 117.16 119.39 1u87 n TYR 192 Ca 0.35 0.00 0.35 0.00 3.32 0.00 0.00 57.90 61.92 1u87 n TYR 192 Cb 1.46 -0.11 0.54 0.00 -0.63 0.00 0.00 39.34 40.61 1u87 n TYR 192 CO 0.00 0.00 0.00 1.28 0.22 0.00 0.00 176.86 178.36 1u87 n LEU 193 N -0.84 0.00 -0.48 2.98 4.77 -0.98 0.24 117.00 122.70 1u87 n LEU 193 Ca 0.00 0.72 0.12 0.00 -0.03 0.00 0.00 56.01 56.82 1u87 n LEU 193 Cb 0.00 -0.33 0.25 0.00 -2.33 0.00 0.00 43.42 41.01 1u87 n LEU 193 CO 0.00 -0.72 0.59 0.29 -1.33 0.00 0.00 177.39 176.22 1u87 n LYS 194 N -3.28 1.34 0.00 3.23 5.02 -0.84 -4.92 118.16 118.71 1u87 n LYS 194 Ca 0.30 -0.96 0.00 0.00 -2.02 0.00 0.00 58.31 55.62 1u87 n LYS 194 Cb 1.46 -1.48 0.00 0.00 -0.02 0.00 0.00 35.03 34.99 1u87 n LYS 194 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 1u87 n SER 195 N 0.01 0.00 -0.08 4.39 3.41 0.67 -5.06 113.62 116.95 1u87 n SER 195 Ca 0.13 0.00 -0.15 0.00 -0.26 0.00 0.00 58.87 58.59 1u87 n SER 195 Cb 0.43 0.00 -0.14 0.00 -0.26 0.00 0.00 64.21 64.24 1u87 n SER 195 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1u87 n SER 196 N 0.00 1.33 0.17 4.04 3.41 -1.26 -4.37 113.62 116.94 1u87 n SER 196 Ca 0.00 0.03 0.15 0.00 -0.26 0.00 0.00 58.87 58.78 1u87 n SER 196 Cb 0.00 -0.06 0.73 0.00 -0.26 0.00 0.00 64.21 64.62 1u87 n SER 196 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 1u87 h LYS 197 N 0.01 0.00 -6.58 4.33 1.57 -1.97 -3.43 116.57 110.50 1u87 h LYS 197 Ca -0.51 0.00 -0.53 0.00 -1.87 0.00 0.00 60.65 57.75 1u87 h LYS 197 Cb 2.04 0.00 0.04 0.00 0.08 0.00 0.00 32.23 34.39 1u87 h LYS 197 CO -0.00 0.00 0.94 -0.47 -0.57 0.00 0.00 179.45 179.35 1u87 s TYR 198 N -4.91 2.86 -0.37 -1.35 5.04 -1.26 -4.99 117.35 112.37 1u87 s TYR 198 Ca -0.05 0.47 -0.13 0.00 -2.44 0.00 0.00 57.07 54.92 1u87 s TYR 198 Cb 0.17 -4.00 0.01 0.00 0.35 0.00 0.00 41.96 38.49 1u87 s TYR 198 CO 0.65 -3.79 0.25 0.42 -1.34 0.00 0.00 175.55 171.75 1u87 s ILE 199 N 1.52 5.12 -0.51 3.14 1.01 -1.26 -4.94 121.20 125.29 1u87 s ILE 199 Ca 0.72 -0.51 0.23 0.00 0.00 0.00 0.00 60.65 61.10 1u87 s ILE 199 Cb -0.44 -3.76 0.01 0.00 0.01 0.00 0.00 42.46 38.28 1u87 s ILE 199 CO 0.32 -0.16 1.19 0.00 0.00 0.00 0.00 174.94 176.29 1u87 h ALA 200 N 8.53 0.52 -1.66 9.38 0.00 -1.96 -3.47 119.26 130.60 1u87 h ALA 200 Ca -0.29 0.00 0.05 0.00 0.00 0.00 0.00 54.91 54.67 1u87 h ALA 200 Cb 1.13 0.00 -0.22 0.00 0.00 0.00 0.00 17.79 18.70 1u87 h ALA 200 CO 0.68 0.00 0.46 -0.46 0.00 0.00 0.00 179.25 179.93 1u87 s TRP 201 N -3.23 -0.44 0.76 0.00 -0.11 -1.26 -4.83 118.94 109.83 1u87 s TRP 201 Ca 0.04 0.78 -0.05 0.00 1.22 0.00 0.00 56.10 58.09 1u87 s TRP 201 Cb 0.12 0.43 0.13 0.00 -1.50 0.00 0.00 33.47 32.66 1u87 s TRP 201 CO 0.75 -0.39 1.06 -1.25 -4.62 0.00 0.00 176.95 172.50 1u87 s PRO 202 N -1.02 1.55 0.15 5.86 0.04 -1.26 -4.87 135.00 135.46 1u87 s PRO 202 Ca -0.03 -0.82 0.11 0.00 0.04 0.00 0.00 61.00 60.30 1u87 s PRO 202 Cb -0.01 -2.21 -0.11 0.00 0.04 0.00 0.00 34.50 32.22 1u87 s PRO 202 CO 0.03 -1.60 1.23 -0.07 0.04 0.00 0.00 177.00 176.62 1u87 h LEU 203 N -0.76 0.00 0.00 -3.56 3.38 -1.96 -2.93 115.31 109.48 1u87 h LEU 203 Ca -0.40 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.57 1u87 h LEU 203 Cb 1.27 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.02 1u87 h LEU 203 CO 0.43 0.78 0.00 0.00 0.09 0.00 0.00 178.44 179.74 1u87 n GLN 204 N -3.23 1.45 -2.19 1.13 3.00 -1.26 -0.09 117.38 116.20 1u87 n GLN 204 Ca -0.02 0.00 -0.42 0.00 -0.01 0.00 0.00 57.00 56.55 1u87 n GLN 204 Cb 0.87 0.00 -0.03 0.00 0.00 0.00 0.00 30.24 31.08 1u87 n GLN 204 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.06 177.26 1u87 s GLY 205 N 0.00 2.27 0.35 1.08 0.00 -1.26 -4.72 107.32 105.05 1u87 s GLY 205 Ca 0.00 1.12 0.17 0.00 0.00 0.00 0.00 44.72 46.01 1u87 s GLY 205 CO 0.00 2.18 1.61 1.49 0.00 0.00 0.00 173.10 178.38 1u87 h TRP 206 N 5.87 0.77 -0.96 1.90 6.55 -1.96 0.63 115.95 128.75 1u87 h TRP 206 Ca -0.44 0.04 0.14 0.00 0.95 0.00 0.00 58.89 59.58 1u87 h TRP 206 Cb 1.21 -0.17 -0.08 0.00 -0.86 0.00 0.00 29.16 29.26 1u87 h TRP 206 CO 0.63 -0.37 0.61 1.96 -1.05 0.00 0.00 178.44 180.22 1u87 h GLN 207 N 0.11 0.82 -6.10 0.49 7.50 -1.99 -3.44 115.11 112.50 1u87 h GLN 207 Ca 0.78 -0.05 -0.50 0.00 0.50 0.00 0.00 58.65 59.38 1u87 h GLN 207 Cb 1.95 -0.19 0.25 0.00 0.05 0.00 0.00 27.48 29.55 1u87 h GLN 207 CO -0.73 0.55 -2.26 0.00 -1.50 0.00 0.00 178.83 174.89 1u87 n ALA 208 N -2.38 -5.45 1.74 3.87 0.00 0.22 -5.09 120.51 113.42 1u87 n ALA 208 Ca 0.19 -1.17 0.15 0.00 0.00 0.00 0.00 53.44 52.61 1u87 n ALA 208 Cb 0.43 -1.00 0.73 0.00 0.00 0.00 0.00 19.45 19.61 1u87 n ALA 208 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91