#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jq8 h LEU 2 N 0.00 0.00 0.21 1.04 4.07 -1.82 -2.13 115.31 116.69 1jq8 h LEU 2 Ca 0.00 0.00 -0.01 0.00 0.08 0.00 0.00 57.88 57.95 1jq8 h LEU 2 Cb 0.00 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.74 1jq8 h LEU 2 CO 0.00 0.00 -0.10 0.25 -1.08 0.00 0.00 178.44 177.51 1jq8 h LEU 3 N 0.00 -0.24 -0.19 1.67 5.85 -1.98 -1.08 115.31 119.33 1jq8 h LEU 3 Ca 0.23 -0.09 -0.05 0.00 0.84 0.00 0.00 57.88 58.80 1jq8 h LEU 3 Cb 1.09 0.06 -0.00 0.00 0.37 0.00 0.00 40.66 42.18 1jq8 h LEU 3 CO -0.00 -0.06 -0.09 -0.33 -0.34 0.00 0.00 178.44 177.62 1jq8 h GLU 4 N -0.42 0.40 -0.86 1.25 3.07 -1.77 -2.88 114.58 113.38 1jq8 h GLU 4 Ca -0.03 -0.17 0.05 0.00 -0.50 0.00 0.00 59.36 58.71 1jq8 h GLU 4 Cb 0.32 -0.01 -0.06 0.00 -0.84 0.00 0.00 28.75 28.16 1jq8 h GLU 4 CO 0.05 0.70 0.54 0.35 -1.40 0.00 0.00 179.01 179.24 1jq8 h PHE 5 N 0.09 0.99 -0.35 4.33 3.57 -1.52 -1.34 116.94 122.72 1jq8 h PHE 5 Ca 0.04 0.03 -0.07 0.00 3.53 0.00 0.00 57.97 61.50 1jq8 h PHE 5 Cb 0.58 -0.32 -0.02 0.00 2.79 0.00 0.00 35.95 38.98 1jq8 h PHE 5 CO 0.06 0.52 -0.06 0.78 -2.23 0.00 0.00 178.31 177.39 1jq8 h GLY 6 N 0.99 0.61 0.98 2.40 0.00 -1.18 -0.45 103.07 106.43 1jq8 h GLY 6 Ca 0.36 -0.40 -0.07 0.00 0.00 0.00 0.00 47.33 47.23 1jq8 h GLY 6 CO -0.16 0.37 0.04 1.70 0.00 0.00 0.00 176.54 178.50 1jq8 h LYS 7 N 0.53 0.81 -0.41 4.80 3.64 -1.10 -1.66 116.57 123.18 1jq8 h LYS 7 Ca 0.11 -0.24 -0.01 0.00 -1.27 0.00 0.00 60.65 59.24 1jq8 h LYS 7 Cb 0.44 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 32.16 1jq8 h LYS 7 CO 0.02 0.84 0.21 0.52 -2.27 0.00 0.00 179.45 178.77 1jq8 h MET 8 N 0.67 0.57 -0.57 1.90 2.86 -0.86 -0.82 114.93 118.67 1jq8 h MET 8 Ca 0.14 -0.08 0.02 0.00 -2.06 0.00 0.00 59.70 57.72 1jq8 h MET 8 Cb 0.45 -0.11 -0.03 0.00 0.06 0.00 0.00 31.60 31.97 1jq8 h MET 8 CO 0.02 0.48 0.36 0.82 1.06 0.00 0.00 176.91 179.65 1jq8 h ILE 9 N 0.52 1.10 -0.09 -1.22 2.04 -0.90 -0.06 117.51 118.90 1jq8 h ILE 9 Ca 0.14 -0.25 -0.01 0.00 1.00 0.00 0.00 64.86 65.74 1jq8 h ILE 9 Cb 0.09 0.31 -0.00 0.00 -0.74 0.00 0.00 36.82 36.47 1jq8 h ILE 9 CO -0.02 0.13 0.03 0.25 0.00 0.00 0.00 178.15 178.55 1jq8 h LEU 10 N 0.73 0.13 -0.72 1.44 5.85 -1.05 0.56 115.31 122.24 1jq8 h LEU 10 Ca 0.22 -0.18 0.12 0.00 0.84 0.00 0.00 57.88 58.88 1jq8 h LEU 10 Cb -0.03 -0.03 -0.08 0.00 0.37 0.00 0.00 40.66 40.88 1jq8 h LEU 10 CO -0.07 0.28 0.32 -0.33 -0.34 0.00 0.00 178.44 178.29 1jq8 h GLU 11 N -0.02 0.49 0.00 1.25 5.08 -0.82 0.45 114.58 121.01 1jq8 h GLU 11 Ca 0.03 -0.03 -0.25 0.00 -1.00 0.00 0.00 59.36 58.12 1jq8 h GLU 11 Cb 0.19 -0.11 -0.04 0.00 0.50 0.00 0.00 28.75 29.29 1jq8 h GLU 11 CO -0.00 0.33 -1.34 0.93 -1.00 0.00 0.00 179.01 177.93 1jq8 h GLU 12 N 0.51 0.00 0.00 2.33 4.39 -0.89 -3.40 114.58 117.52 1jq8 h GLU 12 Ca 0.38 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.08 1jq8 h GLU 12 Cb 0.50 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.15 1jq8 h GLU 12 CO -0.34 0.73 -1.31 0.25 -1.16 0.00 0.00 179.01 177.17 1jq8 n THR 13 N -3.19 0.00 -0.99 1.13 -2.24 0.18 -4.64 114.28 104.52 1jq8 n THR 13 Ca -0.08 -0.19 0.00 0.00 -2.27 0.00 0.00 64.05 61.51 1jq8 n THR 13 Cb 0.99 0.35 0.00 0.00 -2.10 0.00 0.00 70.33 69.57 1jq8 n THR 13 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1jq8 n GLY 14 N 2.02 0.54 3.54 3.38 0.00 0.16 -5.01 105.19 109.82 1jq8 n GLY 14 Ca -0.01 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.70 1jq8 n GLY 14 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1jq8 s LYS 16 N -0.20 2.16 -0.04 1.61 1.02 -1.26 -5.02 119.74 118.02 1jq8 s LYS 16 Ca 0.00 -0.97 -0.30 0.00 0.02 0.00 0.00 55.97 54.72 1jq8 s LYS 16 Cb 0.00 -2.30 -0.03 0.00 -0.52 0.00 0.00 37.83 34.98 1jq8 s LYS 16 CO 0.00 0.53 1.09 -0.51 -0.92 0.00 0.00 175.35 175.54 1jq8 s LEU 17 N -1.85 4.30 0.30 3.17 2.01 -1.26 -3.42 118.68 121.93 1jq8 s LEU 17 Ca 0.18 1.72 0.05 0.00 0.01 0.00 0.00 54.13 56.10 1jq8 s LEU 17 Cb -0.11 -3.56 0.71 0.00 0.01 0.00 0.00 46.19 43.24 1jq8 s LEU 17 CO 0.10 -0.45 1.76 0.00 1.01 0.00 0.00 176.35 178.78 1jq8 h ALA 18 N 7.09 1.59 -3.21 4.21 0.00 -1.91 -2.88 119.26 124.14 1jq8 h ALA 18 Ca -0.36 0.09 -0.65 0.00 0.00 0.00 0.00 54.91 53.99 1jq8 h ALA 18 Cb 1.18 -0.05 -0.25 0.00 0.00 0.00 0.00 17.79 18.68 1jq8 h ALA 18 CO 0.83 -0.09 -0.71 0.42 0.00 0.00 0.00 179.25 179.70 1jq8 s ILE 19 N -5.87 3.55 -2.44 0.00 1.01 -1.26 0.11 121.20 116.30 1jq8 s ILE 19 Ca -0.11 -0.47 0.22 0.00 0.00 0.00 0.00 60.65 60.29 1jq8 s ILE 19 Cb 0.25 -2.56 0.42 0.00 0.01 0.00 0.00 42.46 40.58 1jq8 s ILE 19 CO 0.80 0.48 1.47 -0.81 0.00 0.00 0.00 174.94 176.87 1jq8 n PRO 20 N 3.90 2.11 -0.27 2.79 -0.04 -1.25 -4.96 135.00 137.29 1jq8 n PRO 20 Ca -0.18 -1.67 -0.03 0.00 -0.04 0.00 0.00 63.50 61.59 1jq8 n PRO 20 Cb 0.52 -1.45 0.09 0.00 -0.04 0.00 0.00 33.50 32.61 1jq8 n PRO 20 CO 0.00 0.00 0.00 0.77 -0.04 0.00 0.00 175.50 176.23 1jq8 h SER 21 N 3.39 0.80 -0.03 3.54 0.02 -1.36 -3.26 113.55 116.64 1jq8 h SER 21 Ca 0.00 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.94 1jq8 h SER 21 Cb 0.74 -0.18 0.00 0.00 0.14 0.00 0.00 62.40 63.10 1jq8 h SER 21 CO 0.00 0.56 0.00 -1.22 -1.14 0.00 0.00 176.83 175.03 1jq8 n TYR 22 N -4.62 0.09 1.03 3.45 4.01 0.12 -4.66 117.16 116.59 1jq8 n TYR 22 Ca 0.08 -0.87 0.11 0.00 -0.16 0.00 0.00 57.90 57.06 1jq8 n TYR 22 Cb 0.08 -0.14 0.03 0.00 -0.31 0.00 0.00 39.34 38.99 1jq8 n TYR 22 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27 1jq8 n SER 23 N -1.11 1.33 -0.96 7.72 3.41 -1.12 -4.32 113.62 118.58 1jq8 n SER 23 Ca 0.13 -1.09 0.01 0.00 -0.26 0.00 0.00 58.87 57.66 1jq8 n SER 23 Cb 0.57 0.62 0.01 0.00 -0.26 0.00 0.00 64.21 65.14 1jq8 n SER 23 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1jq8 n SER 24 N -0.85 0.40 -4.69 4.04 3.41 -1.06 -4.23 113.62 110.63 1jq8 n SER 24 Ca 0.07 -1.96 -0.40 0.00 -0.26 0.00 0.00 58.87 56.32 1jq8 n SER 24 Cb 0.38 -0.22 -0.05 0.00 -0.26 0.00 0.00 64.21 64.07 1jq8 n SER 24 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 175.04 174.41 1jq8 s TYR 25 N 0.00 3.50 0.00 7.33 6.14 -0.85 -1.68 117.35 131.79 1jq8 s TYR 25 Ca 0.15 1.23 0.00 0.00 0.64 0.00 0.00 57.07 59.09 1jq8 s TYR 25 Cb 0.17 -2.89 0.00 0.00 0.42 0.00 0.00 41.96 39.66 1jq8 s TYR 25 CO -0.07 -0.07 0.00 0.41 0.64 0.00 0.00 175.55 176.46 1jq8 n GLY 26 N 3.31 0.96 0.10 8.97 0.00 -0.20 -1.80 105.19 116.54 1jq8 n GLY 26 Ca 0.01 -0.65 0.02 0.00 0.00 0.00 0.00 46.02 45.41 1jq8 n GLY 26 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jq8 n TYR 28 N -2.88 0.00 -2.83 0.00 4.02 -1.25 -4.17 117.16 110.05 1jq8 n TYR 28 Ca -0.07 0.00 -0.44 0.00 -0.01 0.00 0.00 57.90 57.38 1jq8 n TYR 28 Cb 0.78 -0.00 0.00 0.00 -0.02 0.00 0.00 39.34 40.10 1jq8 n TYR 28 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1jq8 n GLY 30 N 3.47 -0.74 0.08 0.00 0.00 -1.26 -2.01 105.19 104.72 1jq8 n GLY 30 Ca 0.36 -0.28 -0.00 0.00 0.00 0.00 0.00 46.02 46.09 1jq8 n GLY 30 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1jq8 n TRP 31 N 1.42 0.48 -0.78 1.61 7.02 -1.26 -4.98 117.44 120.95 1jq8 n TRP 31 Ca 0.00 0.16 -0.33 0.00 -1.02 0.00 0.00 57.50 56.31 1jq8 n TRP 31 Cb 0.00 -0.93 0.13 0.00 -2.42 0.00 0.00 31.31 28.09 1jq8 n TRP 31 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1jq8 n GLY 32 N 1.47 -2.46 2.66 6.99 0.00 -1.26 -5.00 105.19 107.58 1jq8 n GLY 32 Ca -0.15 -0.74 -0.09 0.00 0.00 0.00 0.00 46.02 45.05 1jq8 n GLY 32 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1jq8 n GLY 33 N 1.95 1.42 3.65 -0.02 0.00 -1.26 -4.74 105.19 106.19 1jq8 n GLY 33 Ca 0.03 -0.50 -0.05 0.00 0.00 0.00 0.00 46.02 45.50 1jq8 n GLY 33 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1jq8 s LYS 34 N -0.80 1.01 0.00 1.61 -2.85 -1.26 -4.84 119.74 112.61 1jq8 s LYS 34 Ca 0.24 -0.50 0.00 0.00 -1.00 0.00 0.00 55.97 54.72 1jq8 s LYS 34 Cb 0.40 0.38 0.00 0.00 -2.06 0.00 0.00 37.83 36.55 1jq8 s LYS 34 CO -0.05 -0.46 0.00 0.41 0.10 0.00 0.00 175.35 175.35 1jq8 n GLY 35 N -0.38 -0.25 3.69 0.59 0.00 0.46 -4.44 105.19 104.85 1jq8 n GLY 35 Ca -0.07 -1.83 -0.41 0.00 0.00 0.00 0.00 46.02 43.71 1jq8 n GLY 35 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1jq8 s THR 36 N -1.38 4.91 0.30 2.61 2.01 -1.26 -4.66 115.64 118.17 1jq8 s THR 36 Ca 0.00 1.66 -0.28 0.00 0.31 0.00 0.00 61.69 63.38 1jq8 s THR 36 Cb 0.00 -4.15 -0.14 0.00 0.01 0.00 0.00 72.50 68.23 1jq8 s THR 36 CO 0.00 0.09 1.08 -2.65 -0.69 0.00 0.00 174.62 172.45 1jq8 n PRO 37 N 4.77 1.52 -0.09 4.92 -0.02 -1.26 -4.86 135.00 139.98 1jq8 n PRO 37 Ca 0.04 0.53 -0.10 0.00 -2.02 0.00 0.00 63.50 61.95 1jq8 n PRO 37 Cb 0.50 -1.96 0.03 0.00 -0.02 0.00 0.00 33.50 32.05 1jq8 n PRO 37 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 1jq8 h LYS 38 N 2.17 0.82 0.00 -0.52 1.79 -1.94 -3.47 116.57 115.42 1jq8 h LYS 38 Ca -0.41 -0.40 0.00 0.00 -2.18 0.00 0.00 60.65 57.66 1jq8 h LYS 38 Cb 1.33 -0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.97 1jq8 h LYS 38 CO 0.61 1.03 0.00 -0.40 -1.08 0.00 0.00 179.45 179.62 1jq8 n ASP 39 N -4.06 0.00 -0.26 0.86 5.68 -1.26 -5.01 116.55 112.49 1jq8 n ASP 39 Ca -0.01 -0.67 -0.05 0.00 -0.50 0.00 0.00 54.79 53.55 1jq8 n ASP 39 Cb 0.51 0.00 0.06 0.00 -1.14 0.00 0.00 41.12 40.55 1jq8 n ASP 39 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1jq8 h ALA 40 N 1.83 0.92 -0.53 2.12 0.00 -1.93 -0.73 119.26 120.94 1jq8 h ALA 40 Ca 0.00 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.80 1jq8 h ALA 40 Cb 0.00 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.47 1jq8 h ALA 40 CO 0.00 0.39 0.22 1.15 0.00 0.00 0.00 179.25 181.02 1jq8 h THR 41 N 0.99 1.21 -0.46 0.00 2.02 -1.90 -1.67 112.91 113.10 1jq8 h THR 41 Ca 0.26 -0.65 -0.05 0.00 0.77 0.00 0.00 66.41 66.74 1jq8 h THR 41 Cb -0.04 0.65 -0.02 0.00 -1.74 0.00 0.00 68.15 67.00 1jq8 h THR 41 CO -0.05 0.25 0.08 -0.78 0.37 0.00 0.00 175.52 175.39 1jq8 h ASP 42 N 0.72 0.65 0.37 4.18 3.58 -1.84 -1.20 116.42 122.88 1jq8 h ASP 42 Ca 0.18 -0.12 -0.08 0.00 0.42 0.00 0.00 57.03 57.44 1jq8 h ASP 42 Cb 0.18 -0.17 -0.01 0.00 1.72 0.00 0.00 39.33 41.05 1jq8 h ASP 42 CO -0.02 0.67 -0.37 0.03 -2.88 0.00 0.00 179.24 176.68 1jq8 h ARG 43 N 0.67 0.00 -0.65 0.28 3.08 -0.69 -1.61 114.38 115.46 1jq8 h ARG 43 Ca 0.15 0.00 0.01 0.00 0.07 0.00 0.00 59.98 60.21 1jq8 h ARG 43 Cb 0.30 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.32 1jq8 h ARG 43 CO 0.00 0.37 0.42 0.00 -1.07 0.00 0.00 179.97 179.69 1jq8 h PHE 46 N 0.58 -0.30 -0.74 0.00 3.57 -0.50 0.34 116.94 119.88 1jq8 h PHE 46 Ca 0.07 0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.59 1jq8 h PHE 46 Cb 0.78 0.12 -0.04 0.00 2.79 0.00 0.00 35.95 39.61 1jq8 h PHE 46 CO 0.04 -0.18 0.49 0.28 -2.23 0.00 0.00 178.31 176.70 1jq8 h VAL 47 N -0.25 1.15 -0.68 1.41 2.07 -0.98 -1.40 116.25 117.56 1jq8 h VAL 47 Ca 0.01 -0.33 -0.06 0.00 0.82 0.00 0.00 66.70 67.14 1jq8 h VAL 47 Cb 0.25 0.11 -0.03 0.00 -1.52 0.00 0.00 31.29 30.11 1jq8 h VAL 47 CO -0.05 0.17 0.18 -0.74 0.02 0.00 0.00 177.57 177.15 1jq8 h HIS 48 N 0.95 1.14 -0.53 1.57 -0.00 -0.42 -0.76 115.15 117.10 1jq8 h HIS 48 Ca 0.28 -0.13 -0.04 0.00 -0.00 0.00 0.00 60.37 60.48 1jq8 h HIS 48 Cb -0.03 -0.32 -0.02 0.00 -0.00 0.00 0.00 27.41 27.03 1jq8 h HIS 48 CO -0.00 0.93 0.19 -0.44 -0.00 0.00 0.00 177.93 178.61 1jq8 h ASP 49 N 1.02 0.76 -0.73 3.26 3.32 -0.15 -1.73 116.42 122.16 1jq8 h ASP 49 Ca 0.22 -0.19 -0.01 0.00 0.02 0.00 0.00 57.03 57.06 1jq8 h ASP 49 Cb 0.35 -0.20 -0.04 0.00 0.22 0.00 0.00 39.33 39.67 1jq8 h ASP 49 CO 0.00 0.75 0.42 0.00 -1.72 0.00 0.00 179.24 178.68 1jq8 h TYR 52 N -0.71 0.41 0.00 0.00 -1.99 -1.17 -0.37 116.97 113.15 1jq8 h TYR 52 Ca -0.05 0.01 0.00 0.00 2.00 0.00 0.00 58.73 60.69 1jq8 h TYR 52 Cb 0.49 -0.14 0.00 0.00 2.00 0.00 0.00 36.73 39.08 1jq8 h TYR 52 CO 0.01 0.25 0.00 0.41 -0.00 0.00 0.00 178.16 178.83 1jq8 n GLY 53 N -1.49 -1.20 1.30 3.88 0.00 0.11 -2.06 105.19 105.73 1jq8 n GLY 53 Ca 0.03 0.08 0.08 0.00 0.00 0.00 0.00 46.02 46.21 1jq8 n GLY 53 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1jq8 n ASN 54 N -2.14 4.64 -2.72 1.61 3.02 -0.15 -4.46 115.26 115.07 1jq8 n ASN 54 Ca 0.02 -2.99 -0.26 0.00 -0.03 0.00 0.00 54.58 51.31 1jq8 n ASN 54 Cb 0.20 -0.60 -0.02 0.00 -0.61 0.00 0.00 39.78 38.75 1jq8 n ASN 54 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1jq8 n LEU 55 N -0.06 4.41 -0.22 3.41 4.77 -0.87 -4.90 117.00 123.53 1jq8 n LEU 55 Ca 0.24 -5.39 0.10 0.00 -0.03 0.00 0.00 56.01 50.93 1jq8 n LEU 55 Cb 1.02 -0.45 0.38 0.00 -2.33 0.00 0.00 43.42 42.04 1jq8 n LEU 55 CO 0.22 2.28 1.22 -0.65 -1.33 0.00 0.00 177.39 179.13 1jq8 h PRO 56 N 2.79 0.68 0.00 3.23 0.11 -1.79 -0.96 132.00 136.06 1jq8 h PRO 56 Ca 0.20 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.27 1jq8 h PRO 56 Cb 0.74 -0.15 0.00 0.00 0.11 0.00 0.00 31.00 31.69 1jq8 h PRO 56 CO 0.82 0.45 0.00 -0.40 -0.21 0.00 0.00 178.00 178.66 1jq8 n ASP 59 N -4.51 0.00 -3.80 -2.05 5.75 -1.26 -4.88 116.55 105.79 1jq8 n ASP 59 Ca 0.14 -1.27 -0.23 0.00 -0.01 0.00 0.00 54.79 53.42 1jq8 n ASP 59 Cb 0.36 0.00 -0.05 0.00 -1.03 0.00 0.00 41.12 40.40 1jq8 n ASP 59 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1jq8 n ASN 67 N -1.34 1.34 -0.22 0.00 3.02 -1.26 -5.03 115.26 111.77 1jq8 n ASN 67 Ca -0.13 -2.87 -0.10 0.00 -0.03 0.00 0.00 54.58 51.45 1jq8 n ASN 67 Cb 0.47 -0.65 -0.08 0.00 -0.61 0.00 0.00 39.78 38.92 1jq8 n ASN 67 CO 0.00 0.00 0.00 -0.65 -2.62 0.00 0.00 177.26 173.99 1jq8 h PRO 68 N 4.75 -0.16 0.00 3.52 0.11 -1.92 -0.35 132.00 137.96 1jq8 h PRO 68 Ca 0.17 0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.29 1jq8 h PRO 68 Cb 0.81 0.04 0.00 0.00 0.11 0.00 0.00 31.00 31.96 1jq8 h PRO 68 CO 0.57 -0.11 0.00 0.87 -0.21 0.00 0.00 178.00 179.12 1jq8 h LYS 69 N -0.16 0.00 0.00 1.05 6.56 -1.96 -3.28 116.57 118.78 1jq8 h LYS 69 Ca 0.09 0.00 -0.08 0.00 -1.06 0.00 0.00 60.65 59.61 1jq8 h LYS 69 Cb 0.41 0.00 -0.01 0.00 -0.57 0.00 0.00 32.23 32.05 1jq8 h LYS 69 CO -0.61 0.00 -1.28 -1.13 -2.06 0.00 0.00 179.45 174.36 1jq8 n SER 70 N -2.58 3.92 -4.65 0.86 3.41 -1.01 -3.33 113.62 110.24 1jq8 n SER 70 Ca -0.00 -0.01 -0.42 0.00 -0.26 0.00 0.00 58.87 58.18 1jq8 n SER 70 Cb 0.15 0.47 -0.03 0.00 -0.26 0.00 0.00 64.21 64.54 1jq8 n SER 70 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1jq8 s ASP 71 N -3.69 6.40 0.16 4.04 2.15 -0.17 -4.58 116.67 120.98 1jq8 s ASP 71 Ca -0.03 2.14 -0.30 0.00 0.43 0.00 0.00 52.55 54.80 1jq8 s ASP 71 Cb 0.01 -2.53 -0.07 0.00 -0.30 0.00 0.00 42.92 40.03 1jq8 s ASP 71 CO 0.16 -1.16 0.98 -0.13 -0.17 0.00 0.00 175.17 174.84 1jq8 s ARG 72 N 4.57 4.73 0.28 4.34 1.81 -1.26 -1.49 118.95 131.92 1jq8 s ARG 72 Ca 0.80 1.51 0.02 0.00 -1.72 0.00 0.00 55.73 56.33 1jq8 s ARG 72 Cb -0.33 -3.33 -0.05 0.00 -0.45 0.00 0.00 34.95 30.79 1jq8 s ARG 72 CO 0.33 0.28 0.11 1.52 -0.68 0.00 0.00 175.30 176.85 1jq8 s TYR 73 N -0.38 1.60 0.18 -0.53 -0.85 -1.26 -4.92 117.35 111.19 1jq8 s TYR 73 Ca 0.46 -1.21 0.09 0.00 -0.52 0.00 0.00 57.07 55.88 1jq8 s TYR 73 Cb -0.25 -0.93 -0.04 0.00 0.38 0.00 0.00 41.96 41.11 1jq8 s TYR 73 CO 0.31 -0.35 -0.18 0.21 -1.52 0.00 0.00 175.55 174.03 1jq8 s LYS 74 N -3.96 1.31 0.18 -3.49 2.20 -1.26 -4.94 119.74 109.77 1jq8 s LYS 74 Ca 0.37 -1.45 -0.24 0.00 -0.36 0.00 0.00 55.97 54.29 1jq8 s LYS 74 Cb 0.07 -1.35 0.05 0.00 -1.51 0.00 0.00 37.83 35.10 1jq8 s LYS 74 CO 0.15 0.27 0.82 1.52 -0.36 0.00 0.00 175.35 177.74 1jq8 s TYR 75 N -2.17 -0.23 0.16 4.03 -0.85 -1.26 -2.50 117.35 114.53 1jq8 s TYR 75 Ca 0.17 -0.09 -0.14 0.00 -0.52 0.00 0.00 57.07 56.49 1jq8 s TYR 75 Cb -0.05 0.64 0.02 0.00 0.38 0.00 0.00 41.96 42.95 1jq8 s TYR 75 CO 0.07 -0.94 0.40 0.21 -1.52 0.00 0.00 175.55 173.77 1jq8 s LYS 76 N -3.54 1.18 -0.17 -3.49 2.47 -0.02 -4.87 119.74 111.30 1jq8 s LYS 76 Ca 0.09 -0.89 -0.09 0.00 -1.56 0.00 0.00 55.97 53.52 1jq8 s LYS 76 Cb -0.03 0.45 -0.05 0.00 -1.46 0.00 0.00 37.83 36.75 1jq8 s LYS 76 CO 0.00 -0.46 0.14 0.50 0.16 0.00 0.00 175.35 175.70 1jq8 s ARG 77 N -3.87 3.92 -0.25 4.03 3.52 -1.26 0.76 118.95 125.80 1jq8 s ARG 77 Ca 0.09 -0.17 -0.01 0.00 -0.13 0.00 0.00 55.73 55.51 1jq8 s ARG 77 Cb 0.01 -3.34 0.08 0.00 -1.56 0.00 0.00 34.95 30.15 1jq8 s ARG 77 CO -0.06 0.47 0.05 0.08 -0.81 0.00 0.00 175.30 175.03 1jq8 s VAL 78 N -0.14 0.87 -0.66 7.11 1.01 -0.64 -4.74 120.40 123.20 1jq8 s VAL 78 Ca 0.11 -1.06 0.00 0.00 0.00 0.00 0.00 61.98 61.03 1jq8 s VAL 78 Cb -0.12 -1.46 0.00 0.00 0.00 0.00 0.00 36.38 34.81 1jq8 s VAL 78 CO 0.01 -0.40 0.00 0.59 0.00 0.00 0.00 175.10 175.30 1jq8 n ASN 79 N 4.89 -3.17 0.00 3.32 4.13 -1.26 -3.04 115.26 120.13 1jq8 n ASN 79 Ca -0.06 0.07 0.00 0.00 1.68 0.00 0.00 54.58 56.27 1jq8 n ASN 79 Cb 0.44 -1.98 0.00 0.00 -1.54 0.00 0.00 39.78 36.70 1jq8 n ASN 79 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1jq8 n GLY 80 N -1.49 1.28 3.57 7.41 0.00 -1.26 -5.04 105.19 109.66 1jq8 n GLY 80 Ca -0.08 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.60 1jq8 n GLY 80 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jq8 s ALA 81 N -2.72 3.10 0.29 4.61 0.00 -1.17 -5.06 121.76 120.80 1jq8 s ALA 81 Ca 0.00 -0.82 -0.30 0.00 0.00 0.00 0.00 51.96 50.84 1jq8 s ALA 81 Cb 0.00 -1.49 -0.12 0.00 0.00 0.00 0.00 23.12 21.50 1jq8 s ALA 81 CO 0.00 0.38 1.44 -0.89 0.00 0.00 0.00 175.76 176.70 1jq8 n ILE 82 N 2.90 1.30 -3.79 0.00 5.41 -1.26 -1.62 119.36 122.29 1jq8 n ILE 82 Ca -0.18 -0.32 -0.28 0.00 1.00 0.00 0.00 62.75 62.97 1jq8 n ILE 82 Cb 0.53 -1.68 -0.16 0.00 -0.71 0.00 0.00 39.64 37.61 1jq8 n ILE 82 CO 0.00 0.00 0.00 -0.69 0.00 0.00 0.00 176.55 175.86 1jq8 s VAL 83 N -0.36 0.74 0.03 1.39 1.01 0.23 -4.88 120.40 118.55 1jq8 s VAL 83 Ca 0.63 -0.63 -0.30 0.00 0.00 0.00 0.00 61.98 61.67 1jq8 s VAL 83 Cb -0.57 -1.15 -0.06 0.00 0.00 0.00 0.00 36.38 34.59 1jq8 s VAL 83 CO 0.53 -0.13 1.45 0.00 0.00 0.00 0.00 175.10 176.95 1jq8 n GLU 85 N 5.22 -0.87 -3.98 0.00 -0.58 -1.04 -4.93 120.64 114.46 1jq8 n GLU 85 Ca 0.13 0.00 -0.33 0.00 -0.42 0.00 0.00 57.16 56.54 1jq8 n GLU 85 Cb 0.43 0.00 -0.14 0.00 -0.57 0.00 0.00 31.44 31.16 1jq8 n GLU 85 CO 0.00 0.00 0.00 0.21 -0.48 0.00 0.00 177.13 176.86 1jq8 s LYS 86 N -2.36 2.04 0.00 3.49 2.47 -1.26 -4.84 119.74 119.27 1jq8 s LYS 86 Ca 0.00 -1.54 0.00 0.00 -1.56 0.00 0.00 55.97 52.87 1jq8 s LYS 86 Cb 0.00 -3.14 0.00 0.00 -1.46 0.00 0.00 37.83 33.23 1jq8 s LYS 86 CO 0.00 -0.75 0.00 0.41 0.16 0.00 0.00 175.35 175.17 1jq8 n GLY 88 N 4.45 4.70 3.76 5.54 0.00 -1.26 -5.07 105.19 117.30 1jq8 n GLY 88 Ca -0.07 -1.70 -0.29 0.00 0.00 0.00 0.00 46.02 43.96 1jq8 n GLY 88 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1jq8 s THR 89 N 3.33 2.34 0.18 2.61 -4.23 -1.26 -4.76 115.64 113.84 1jq8 s THR 89 Ca 0.00 0.11 -0.15 0.00 -1.18 0.00 0.00 61.69 60.47 1jq8 s THR 89 Cb 0.00 -2.78 0.11 0.00 1.34 0.00 0.00 72.50 71.17 1jq8 s THR 89 CO 0.00 -0.15 1.68 -1.28 -0.54 0.00 0.00 174.62 174.33 1jq8 h SER 90 N -1.49 -0.25 -0.74 3.99 0.87 -2.00 -1.54 113.55 112.40 1jq8 h SER 90 Ca -0.50 0.11 0.02 0.00 -1.23 0.00 0.00 61.79 60.19 1jq8 h SER 90 Cb 1.31 0.21 -0.04 0.00 -0.44 0.00 0.00 62.40 63.44 1jq8 h SER 90 CO 0.60 -0.09 0.48 0.00 -0.53 0.00 0.00 176.83 177.29 1jq8 h GLU 92 N 0.94 1.17 -0.14 0.00 5.08 -1.65 0.50 114.58 120.49 1jq8 h GLU 92 Ca 0.29 -0.16 -0.18 0.00 -1.00 0.00 0.00 59.36 58.32 1jq8 h GLU 92 Cb -0.03 -0.22 -0.00 0.00 0.50 0.00 0.00 28.75 29.00 1jq8 h GLU 92 CO -0.09 0.88 -0.65 -0.91 -1.00 0.00 0.00 179.01 177.24 1jq8 h ASN 93 N 1.16 0.60 -0.12 1.42 4.21 -1.07 -1.51 115.58 120.27 1jq8 h ASN 93 Ca 0.29 -0.36 -0.20 0.00 1.21 0.00 0.00 56.30 57.24 1jq8 h ASN 93 Cb 0.08 -0.17 0.00 0.00 -1.12 0.00 0.00 38.32 37.11 1jq8 h ASN 93 CO -0.04 1.09 -0.70 0.03 -1.29 0.00 0.00 177.43 176.52 1jq8 h ARG 94 N 0.38 0.75 -0.39 0.81 3.08 -1.09 -1.87 114.38 116.05 1jq8 h ARG 94 Ca -0.01 -0.57 -0.07 0.00 0.07 0.00 0.00 59.98 59.40 1jq8 h ARG 94 Cb 1.21 0.10 -0.01 0.00 0.08 0.00 0.00 29.97 31.35 1jq8 h ARG 94 CO 0.12 1.18 -0.03 0.82 -1.07 0.00 0.00 179.97 180.99 1jq8 h ILE 95 N 0.54 1.27 -0.92 2.04 2.04 -0.92 -1.61 117.51 119.95 1jq8 h ILE 95 Ca -0.03 -1.07 0.02 0.00 1.00 0.00 0.00 64.86 64.78 1jq8 h ILE 95 Cb 1.31 1.18 -0.05 0.00 -0.74 0.00 0.00 36.82 38.52 1jq8 h ILE 95 CO 0.14 0.36 0.61 0.00 0.00 0.00 0.00 178.15 179.26 1jq8 h GLU 97 N 1.22 0.80 -0.60 0.00 4.39 -1.14 -0.18 114.58 119.08 1jq8 h GLU 97 Ca 0.34 -0.24 0.03 0.00 0.34 0.00 0.00 59.36 59.84 1jq8 h GLU 97 Cb -0.10 -0.08 -0.04 0.00 -0.10 0.00 0.00 28.75 28.42 1jq8 h GLU 97 CO -0.09 0.84 0.36 0.00 -1.16 0.00 0.00 179.01 178.96 1jq8 h ASP 99 N 0.69 0.68 -0.35 0.00 3.32 -1.10 -2.68 116.42 116.98 1jq8 h ASP 99 Ca 0.25 -0.24 0.03 0.00 0.02 0.00 0.00 57.03 57.09 1jq8 h ASP 99 Cb 0.06 -0.18 -0.03 0.00 0.22 0.00 0.00 39.33 39.40 1jq8 h ASP 99 CO -0.12 0.75 0.14 0.50 -1.72 0.00 0.00 179.24 178.79 1jq8 h LYS 100 N 0.58 0.30 -0.98 3.56 3.64 -0.70 0.05 116.57 123.01 1jq8 h LYS 100 Ca 0.14 -0.02 0.03 0.00 -1.27 0.00 0.00 60.65 59.52 1jq8 h LYS 100 Cb 0.35 -0.07 -0.05 0.00 -0.41 0.00 0.00 32.23 32.05 1jq8 h LYS 100 CO 0.00 0.20 0.65 0.00 -2.27 0.00 0.00 179.45 178.03 1jq8 h ALA 101 N 1.21 1.33 -0.09 5.00 0.00 -1.20 -1.72 119.26 123.79 1jq8 h ALA 101 Ca 0.15 -0.06 -0.06 0.00 0.00 0.00 0.00 54.91 54.94 1jq8 h ALA 101 Cb 0.10 -0.37 0.00 0.00 0.00 0.00 0.00 17.79 17.52 1jq8 h ALA 101 CO -0.14 0.59 -0.19 0.00 0.00 0.00 0.00 179.25 179.51 1jq8 h ALA 102 N 1.41 0.15 -0.61 0.00 0.00 -1.07 -1.64 119.26 117.50 1jq8 h ALA 102 Ca 0.38 -0.37 0.08 0.00 0.00 0.00 0.00 54.91 55.00 1jq8 h ALA 102 Cb -0.06 -0.02 -0.07 0.00 0.00 0.00 0.00 17.79 17.64 1jq8 h ALA 102 CO -0.10 0.09 0.27 0.00 0.00 0.00 0.00 179.25 179.50 1jq8 h ALA 103 N 0.51 0.80 -0.19 0.00 0.00 -0.82 0.90 119.26 120.46 1jq8 h ALA 103 Ca 0.00 0.06 -0.14 0.00 0.00 0.00 0.00 54.91 54.84 1jq8 h ALA 103 Cb 0.78 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.56 1jq8 h ALA 103 CO 0.04 -0.13 -0.45 0.82 0.00 0.00 0.00 179.25 179.53 1jq8 h ILE 104 N 0.48 1.31 -0.62 0.00 2.04 -1.36 -2.73 117.51 116.63 1jq8 h ILE 104 Ca 0.30 -1.64 -0.03 0.00 1.00 0.00 0.00 64.86 64.49 1jq8 h ILE 104 Cb 0.32 1.66 -0.03 0.00 -0.74 0.00 0.00 36.82 38.03 1jq8 h ILE 104 CO -0.26 0.51 0.28 0.00 0.00 0.00 0.00 178.15 178.67 1jq8 h PHE 106 N 0.85 0.89 -0.39 0.00 0.04 -0.71 -2.46 116.94 115.16 1jq8 h PHE 106 Ca 0.21 0.02 -0.09 0.00 2.80 0.00 0.00 57.97 60.91 1jq8 h PHE 106 Cb 0.15 -0.30 -0.01 0.00 2.20 0.00 0.00 35.95 37.99 1jq8 h PHE 106 CO 0.00 0.55 -0.12 -0.09 -0.60 0.00 0.00 178.31 178.06 1jq8 h ARG 107 N 0.95 0.77 0.00 1.51 2.43 -1.18 -2.08 114.38 116.79 1jq8 h ARG 107 Ca 0.26 -0.30 -0.01 0.00 -0.81 0.00 0.00 59.98 59.12 1jq8 h ARG 107 Cb -0.10 -0.04 -0.00 0.00 -0.42 0.00 0.00 29.97 29.41 1jq8 h ARG 107 CO -0.06 0.92 -0.04 1.96 -1.51 0.00 0.00 179.97 181.23 1jq8 h GLN 108 N 0.58 0.00 -0.20 0.20 4.20 -0.92 -2.72 115.11 116.24 1jq8 h GLN 108 Ca 0.10 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.81 1jq8 h GLN 108 Cb 0.64 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.42 1jq8 h GLN 108 CO 0.04 0.04 0.00 0.09 -0.67 0.00 0.00 178.83 178.34 1jq8 n ASN 109 N -3.96 3.48 0.22 1.46 3.02 -0.95 -4.54 115.26 113.98 1jq8 n ASN 109 Ca -0.03 -2.97 0.13 0.00 -0.03 0.00 0.00 54.58 51.67 1jq8 n ASN 109 Cb 0.13 -0.50 0.73 0.00 -0.61 0.00 0.00 39.78 39.53 1jq8 n ASN 109 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 1jq8 h LEU 110 N 1.39 0.00 -1.40 3.41 3.38 -1.04 -1.15 115.31 119.89 1jq8 h LEU 110 Ca 0.00 0.00 0.26 0.00 0.09 0.00 0.00 57.88 58.23 1jq8 h LEU 110 Cb 1.30 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 41.96 1jq8 h LEU 110 CO 0.16 0.00 0.67 -1.13 0.09 0.00 0.00 178.44 178.23 1jq8 h ASN 111 N 0.00 0.43 -0.12 -0.43 -0.00 -1.81 -2.04 115.58 111.61 1jq8 h ASN 111 Ca 0.05 0.08 0.00 0.00 -0.00 0.00 0.00 56.30 56.43 1jq8 h ASN 111 Cb 0.24 0.01 0.00 0.00 -0.00 0.00 0.00 38.32 38.56 1jq8 h ASN 111 CO -0.00 0.09 0.00 0.35 -0.00 0.00 0.00 177.43 177.87 1jq8 n THR 112 N -4.60 1.56 -1.93 -3.57 -2.24 -0.45 -5.01 114.28 98.04 1jq8 n THR 112 Ca 0.25 -1.60 -0.42 0.00 -2.27 0.00 0.00 64.05 60.01 1jq8 n THR 112 Cb 0.88 0.10 -0.03 0.00 -2.10 0.00 0.00 70.33 69.18 1jq8 n THR 112 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 1jq8 s TYR 113 N -2.00 2.55 -0.13 4.78 6.14 -0.77 -4.90 117.35 123.01 1jq8 s TYR 113 Ca 0.24 0.38 0.00 0.00 0.64 0.00 0.00 57.07 58.33 1jq8 s TYR 113 Cb 0.19 -3.96 -0.01 0.00 0.42 0.00 0.00 41.96 38.60 1jq8 s TYR 113 CO 0.06 -3.77 -0.14 -1.12 0.64 0.00 0.00 175.55 171.21 1jq8 s SER 114 N 2.16 3.87 0.48 4.32 0.01 -1.26 -5.00 113.70 118.28 1jq8 s SER 114 Ca 0.73 -0.38 0.15 0.00 1.31 0.00 0.00 55.95 57.76 1jq8 s SER 114 Cb -0.40 -1.59 1.14 0.00 0.21 0.00 0.00 66.02 65.37 1jq8 s SER 114 CO 0.32 0.14 2.08 0.11 0.41 0.00 0.00 173.24 176.31 1jq8 h LYS 115 N 6.86 0.04 0.00 12.44 1.57 -1.99 -2.46 116.57 133.03 1jq8 h LYS 115 Ca -0.27 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.51 1jq8 h LYS 115 Cb 1.21 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.51 1jq8 h LYS 115 CO 0.55 0.10 0.00 0.36 -0.57 0.00 0.00 179.45 179.89 1jq8 n LYS 116 N -4.45 0.13 0.00 3.15 2.85 -1.26 -1.24 118.16 117.33 1jq8 n LYS 116 Ca -0.02 0.56 0.13 0.00 -1.05 0.00 0.00 58.31 57.92 1jq8 n LYS 116 Cb 0.15 -1.86 0.23 0.00 -0.65 0.00 0.00 35.03 32.90 1jq8 n LYS 116 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 1jq8 n TYR 117 N -2.11 0.00 -2.60 5.58 4.01 -0.93 -4.86 117.16 116.25 1jq8 n TYR 117 Ca -0.00 0.00 -0.34 0.00 -0.16 0.00 0.00 57.90 57.40 1jq8 n TYR 117 Cb 0.08 -0.00 -0.04 0.00 -0.31 0.00 0.00 39.34 39.06 1jq8 n TYR 117 CO 0.00 0.00 0.00 -1.64 -0.46 0.00 0.00 176.86 174.76 1jq8 s MET 118 N -2.03 3.94 -1.41 -0.72 -1.94 -0.37 -1.03 119.30 115.72 1jq8 s MET 118 Ca 0.30 1.34 -0.08 0.00 -1.71 0.00 0.00 55.69 55.55 1jq8 s MET 118 Cb 0.20 -2.18 0.04 0.00 2.01 0.00 0.00 34.83 34.91 1jq8 s MET 118 CO 0.33 -0.31 0.58 1.28 -0.01 0.00 0.00 175.02 176.89 1jq8 n LEU 119 N -0.77 -2.11 -4.69 -0.03 4.77 -0.67 -4.89 117.00 108.61 1jq8 n LEU 119 Ca 0.08 -0.37 -0.42 0.00 -0.03 0.00 0.00 56.01 55.27 1jq8 n LEU 119 Cb 0.52 -2.52 -0.03 0.00 -2.33 0.00 0.00 43.42 39.07 1jq8 n LEU 119 CO 0.40 0.22 1.24 -0.47 -1.33 0.00 0.00 177.39 177.45 1jq8 s TYR 120 N -3.06 2.59 0.07 -1.77 5.04 -0.72 -4.96 117.35 114.54 1jq8 s TYR 120 Ca 0.38 0.52 -0.31 0.00 -2.44 0.00 0.00 57.07 55.22 1jq8 s TYR 120 Cb -0.19 -3.84 -0.08 0.00 0.35 0.00 0.00 41.96 38.20 1jq8 s TYR 120 CO 0.47 -3.29 1.64 -2.14 -1.34 0.00 0.00 175.55 170.89 1jq8 s PRO 121 N 2.55 4.20 0.49 4.97 0.02 -1.26 -4.88 135.00 141.08 1jq8 s PRO 121 Ca 0.70 2.32 0.18 0.00 0.02 0.00 0.00 61.00 64.22 1jq8 s PRO 121 Cb -0.36 -3.58 1.19 0.00 0.02 0.00 0.00 34.50 31.76 1jq8 s PRO 121 CO 0.30 -0.73 2.06 0.38 -0.33 0.00 0.00 177.00 178.68 1jq8 h ASP 122 N 8.27 0.00 0.38 2.53 2.03 -1.93 -2.14 116.42 125.56 1jq8 h ASP 122 Ca -0.42 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 55.88 1jq8 h ASP 122 Cb 1.20 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.70 1jq8 h ASP 122 CO 0.93 0.12 0.00 2.19 -1.03 0.00 0.00 179.24 181.44 1jq8 h PHE 124 N 0.00 0.00 0.00 4.15 -0.00 -2.02 -0.03 116.94 119.04 1jq8 h PHE 124 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 57.97 1jq8 h PHE 124 Cb 0.22 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 36.17 1jq8 h PHE 124 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 178.31 179.59 1jq8 n LEU 125 N -3.06 0.00 -4.13 2.10 4.77 -0.80 -4.59 117.00 111.28 1jq8 n LEU 125 Ca -0.02 0.00 -0.33 0.00 -0.03 0.00 0.00 56.01 55.63 1jq8 n LEU 125 Cb 0.16 0.00 -0.15 0.00 -2.33 0.00 0.00 43.42 41.10 1jq8 n LEU 125 CO 0.22 0.00 -0.44 0.00 -1.33 0.00 0.00 177.39 175.84 1jq8 s LYS 127 N 1.22 0.32 0.00 0.00 -0.14 -1.26 -4.61 119.74 115.27 1jq8 s LYS 127 Ca -0.03 -0.44 0.00 0.00 -1.36 0.00 0.00 55.97 54.14 1jq8 s LYS 127 Cb -0.18 -0.12 0.00 0.00 -1.68 0.00 0.00 37.83 35.85 1jq8 s LYS 127 CO -0.06 0.02 0.00 0.41 -0.76 0.00 0.00 175.35 174.96 1jq8 n GLY 128 N 2.13 2.60 3.73 -3.33 0.00 -1.26 -3.79 105.19 105.28 1jq8 n GLY 128 Ca -0.19 -1.50 -0.38 0.00 0.00 0.00 0.00 46.02 43.94 1jq8 n GLY 128 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1jq8 s GLU 129 N -5.10 4.34 -0.44 1.61 2.56 -1.26 0.17 118.70 120.59 1jq8 s GLU 129 Ca 0.00 0.58 -0.01 0.00 0.00 0.00 0.00 54.97 55.54 1jq8 s GLU 129 Cb 0.00 -3.42 0.12 0.00 2.00 0.00 0.00 34.13 32.83 1jq8 s GLU 129 CO 0.00 0.19 0.22 -1.17 -0.56 0.00 0.00 175.26 173.94 1jq8 s LEU 130 N 0.47 5.13 0.37 2.70 2.96 -1.26 -4.91 118.68 124.14 1jq8 s LEU 130 Ca 0.29 -2.23 -0.28 0.00 -0.22 0.00 0.00 54.13 51.69 1jq8 s LEU 130 Cb -0.16 -1.79 -0.11 0.00 0.50 0.00 0.00 46.19 44.63 1jq8 s LEU 130 CO 0.13 -0.48 1.49 -0.54 -1.32 0.00 0.00 176.35 175.64 1jq8 s LYS 131 N 0.85 4.10 0.00 1.98 1.02 -1.26 -5.04 119.74 121.40 1jq8 s LYS 131 Ca 0.10 2.58 0.19 0.00 0.02 0.00 0.00 55.97 58.86 1jq8 s LYS 131 Cb -0.22 -2.97 1.11 0.00 -0.52 0.00 0.00 37.83 35.23 1jq8 s LYS 131 CO -0.04 -0.54 1.50 0.00 -0.92 0.00 0.00 175.35 175.35