#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jxj n PRO 81 N 0.00 2.10 -4.10 1.61 -0.04 -1.26 -4.82 135.00 128.49 2jxj n PRO 81 Ca 0.00 -1.61 -0.33 0.00 -0.04 0.00 0.00 63.50 61.52 2jxj n PRO 81 Cb 0.00 -2.58 -0.16 0.00 -0.04 0.00 0.00 33.50 30.72 2jxj n PRO 81 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2jxj s LEU 82 N 0.36 2.52 0.00 1.53 1.43 -1.26 -4.94 118.68 118.33 2jxj s LEU 82 Ca 0.45 -0.85 0.00 0.00 -1.03 0.00 0.00 54.13 52.70 2jxj s LEU 82 Cb 0.12 -1.51 0.00 0.00 0.03 0.00 0.00 46.19 44.83 2jxj s LEU 82 CO -0.01 -0.05 0.00 0.61 0.23 0.00 0.00 176.35 177.13 2jxj n GLY 83 N 4.57 0.00 2.86 -3.19 0.00 -1.26 -5.06 105.19 103.11 2jxj n GLY 83 Ca -0.19 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.56 2jxj n GLY 83 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2jxj s SER 84 N -4.14 2.53 0.11 1.61 0.01 -1.26 -5.01 113.70 107.54 2jxj s SER 84 Ca 0.00 -0.53 -0.13 0.00 1.31 0.00 0.00 55.95 56.60 2jxj s SER 84 Cb 0.00 -0.80 -0.12 0.00 0.21 0.00 0.00 66.02 65.32 2jxj s SER 84 CO 0.00 -0.19 1.36 0.03 0.41 0.00 0.00 173.24 174.85 2jxj h ARG 85 N 8.17 0.80 -0.26 12.44 2.47 -2.00 -2.59 114.38 133.42 2jxj h ARG 85 Ca -0.24 -0.55 -0.11 0.00 -1.26 0.00 0.00 59.98 57.83 2jxj h ARG 85 Cb 1.12 0.08 -0.01 0.00 -1.65 0.00 0.00 29.97 29.51 2jxj h ARG 85 CO 0.38 1.17 -0.29 -0.39 0.56 0.00 0.00 179.97 181.40 2jxj h VAL 86 N 0.55 1.28 -0.28 2.04 -1.51 -1.99 -2.06 116.25 114.27 2jxj h VAL 86 Ca -0.01 -1.36 -0.06 0.00 -1.23 0.00 0.00 66.70 64.05 2jxj h VAL 86 Cb 1.19 1.40 -0.01 0.00 -2.13 0.00 0.00 31.29 31.74 2jxj h VAL 86 CO 0.12 0.43 -0.04 -0.09 -1.23 0.00 0.00 177.57 176.77 2jxj h ARG 87 N 0.45 0.52 -0.71 5.19 2.43 -1.97 -2.71 114.38 117.58 2jxj h ARG 87 Ca 0.06 -0.19 -0.07 0.00 -0.81 0.00 0.00 59.98 58.97 2jxj h ARG 87 Cb 0.74 -0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 30.22 2jxj h ARG 87 CO 0.06 0.71 0.18 -0.07 -1.51 0.00 0.00 179.97 179.34 2jxj h LEU 88 N 0.29 1.08 -0.73 3.80 4.07 -1.39 -2.86 115.31 119.58 2jxj h LEU 88 Ca 0.07 -0.23 0.05 0.00 0.08 0.00 0.00 57.88 57.85 2jxj h LEU 88 Cb 0.50 -0.28 -0.05 0.00 1.08 0.00 0.00 40.66 41.90 2jxj h LEU 88 CO 0.02 1.03 0.44 0.44 -1.08 0.00 0.00 178.44 179.29 2jxj h ASP 89 N 1.08 0.69 -0.26 -0.43 5.19 -1.29 -1.86 116.42 119.54 2jxj h ASP 89 Ca 0.23 0.01 0.02 0.00 -0.62 0.00 0.00 57.03 56.67 2jxj h ASP 89 Cb 0.37 -0.13 -0.02 0.00 0.18 0.00 0.00 39.33 39.72 2jxj h ASP 89 CO 0.00 0.46 0.13 0.15 -3.12 0.00 0.00 179.24 176.86 2jxj h PHE 90 N 0.83 0.23 -0.30 4.55 3.57 -1.26 -1.90 116.94 122.67 2jxj h PHE 90 Ca 0.31 0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.82 2jxj h PHE 90 Cb 0.10 -0.07 -0.01 0.00 2.79 0.00 0.00 35.95 38.76 2jxj h PHE 90 CO -0.05 0.13 0.18 -0.07 -2.23 0.00 0.00 178.31 176.27 2jxj h LEU 91 N 0.27 0.35 -0.25 0.59 3.38 -1.30 -2.19 115.31 116.16 2jxj h LEU 91 Ca 0.11 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.05 2jxj h LEU 91 Cb 0.04 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 2jxj h LEU 91 CO -0.08 0.27 0.10 -0.78 0.09 0.00 0.00 178.44 178.04 2jxj h ASP 92 N 0.41 0.34 -0.40 -0.43 3.58 -0.56 0.53 116.42 119.89 2jxj h ASP 92 Ca 0.11 -0.16 -0.02 0.00 0.42 0.00 0.00 57.03 57.37 2jxj h ASP 92 Cb -0.02 -0.09 -0.02 0.00 1.72 0.00 0.00 39.33 40.93 2jxj h ASP 92 CO -0.02 0.41 0.16 1.56 -2.88 0.00 0.00 179.24 178.46 2jxj h GLN 93 N 0.25 0.61 -0.16 0.28 1.08 -1.02 0.65 115.11 116.80 2jxj h GLN 93 Ca 0.08 -0.11 -0.01 0.00 -1.45 0.00 0.00 58.65 57.16 2jxj h GLN 93 Cb 0.17 -0.10 -0.01 0.00 -0.05 0.00 0.00 27.48 27.50 2jxj h GLN 93 CO -0.01 0.57 0.07 1.25 -0.95 0.00 0.00 178.83 179.77 2jxj h LEU 94 N 0.51 0.21 -0.25 1.46 5.85 -1.30 0.26 115.31 122.05 2jxj h LEU 94 Ca 0.13 -0.14 -0.12 0.00 0.84 0.00 0.00 57.88 58.60 2jxj h LEU 94 Cb 0.20 -0.05 -0.00 0.00 0.37 0.00 0.00 40.66 41.17 2jxj h LEU 94 CO -0.01 0.29 -0.29 0.00 -0.34 0.00 0.00 178.44 178.09 2jxj h ALA 95 N 0.93 0.38 -0.36 1.25 0.00 -0.79 -2.60 119.26 118.06 2jxj h ALA 95 Ca 0.05 -0.40 -0.04 0.00 0.00 0.00 0.00 54.91 54.52 2jxj h ALA 95 Cb 0.14 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 2jxj h ALA 95 CO -0.01 0.39 0.07 0.87 0.00 0.00 0.00 179.25 180.58 2jxj h LYS 96 N 0.36 0.58 -0.14 0.00 1.57 0.37 -0.50 116.57 118.82 2jxj h LYS 96 Ca 0.04 -0.15 0.01 0.00 -1.87 0.00 0.00 60.65 58.68 2jxj h LYS 96 Cb 0.86 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 33.08 2jxj h LYS 96 CO 0.07 0.64 0.04 0.35 -0.57 0.00 0.00 179.45 179.98 2jxj h PHE 97 N 0.43 0.07 -0.27 -1.35 3.57 -0.51 -2.36 116.94 116.53 2jxj h PHE 97 Ca 0.11 0.01 -0.08 0.00 3.53 0.00 0.00 57.97 61.54 2jxj h PHE 97 Cb 0.33 -0.01 -0.02 0.00 2.79 0.00 0.00 35.95 39.04 2jxj h PHE 97 CO 0.02 0.03 -0.16 -1.49 -2.23 0.00 0.00 178.31 174.49 2jxj h TRP 98 N 0.11 0.51 -0.67 0.41 4.06 -1.41 -2.94 115.95 116.01 2jxj h TRP 98 Ca 0.06 -0.08 0.07 0.00 2.06 0.00 0.00 58.89 61.00 2jxj h TRP 98 Cb 0.04 -0.13 -0.06 0.00 -1.00 0.00 0.00 29.16 28.01 2jxj h TRP 98 CO -0.11 0.61 0.35 1.49 -3.56 0.00 0.00 178.44 177.22 2jxj h GLU 99 N 0.43 0.61 -0.25 0.49 4.57 -0.57 -0.61 114.58 119.26 2jxj h GLU 99 Ca 0.08 -0.04 0.02 0.00 -1.18 0.00 0.00 59.36 58.24 2jxj h GLU 99 Cb 0.53 -0.14 -0.01 0.00 -0.16 0.00 0.00 28.75 28.97 2jxj h GLU 99 CO 0.03 0.40 0.17 -0.07 -1.18 0.00 0.00 179.01 178.37 2jxj h LEU 100 N 0.63 0.23 -0.37 1.64 4.07 -1.28 -1.96 115.31 118.27 2jxj h LEU 100 Ca 0.31 -0.00 -0.14 0.00 0.08 0.00 0.00 57.88 58.13 2jxj h LEU 100 Cb 0.26 -0.05 -0.01 0.00 1.08 0.00 0.00 40.66 41.94 2jxj h LEU 100 CO -0.22 0.16 -0.31 1.56 -1.08 0.00 0.00 178.44 178.55 2jxj h GLN 101 N 0.26 0.85 0.00 1.13 1.08 -1.16 -3.48 115.11 113.80 2jxj h GLN 101 Ca 0.10 -0.43 0.00 0.00 -1.45 0.00 0.00 58.65 56.87 2jxj h GLN 101 Cb 0.08 0.01 0.00 0.00 -0.05 0.00 0.00 27.48 27.52 2jxj h GLN 101 CO -0.02 1.07 0.00 0.41 -0.95 0.00 0.00 178.83 179.34 2jxj n GLY 102 N 0.09 1.70 0.09 3.46 0.00 -0.74 -5.02 105.19 104.78 2jxj n GLY 102 Ca -0.02 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.91 2jxj n GLY 102 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2jxj n SER 103 N 0.00 0.07 -2.25 1.61 7.64 -1.21 -5.07 113.62 114.41 2jxj n SER 103 Ca 0.00 0.03 -0.04 0.00 1.01 0.00 0.00 58.87 59.87 2jxj n SER 103 Cb 0.00 0.96 -0.03 0.00 -1.01 0.00 0.00 64.21 64.13 2jxj n SER 103 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 2jxj n THR 104 N -2.75-10.00 -2.11 0.44 -1.04 -1.26 -4.90 114.28 92.66 2jxj n THR 104 Ca -0.30 1.98 -0.42 0.00 -2.04 0.00 0.00 64.05 63.27 2jxj n THR 104 Cb 1.12 -5.63 -0.03 0.00 -1.82 0.00 0.00 70.33 63.97 2jxj n THR 104 CO 0.00 0.00 0.00 -0.22 -0.64 0.00 0.00 175.07 174.21 2jxj s LEU 105 N -0.46 4.35 -0.22 -4.42 2.96 -1.26 -5.00 118.68 114.62 2jxj s LEU 105 Ca -0.20 2.31 -0.00 0.00 -0.22 0.00 0.00 54.13 56.02 2jxj s LEU 105 Cb 0.01 -3.57 0.06 0.00 0.50 0.00 0.00 46.19 43.19 2jxj s LEU 105 CO 0.54 -0.75 -0.03 -0.54 -1.32 0.00 0.00 176.35 174.25 2jxj s LYS 106 N 2.00 1.38 -0.23 1.98 1.02 -1.26 -5.06 119.74 119.57 2jxj s LYS 106 Ca 0.67 -0.85 -0.28 0.00 0.02 0.00 0.00 55.97 55.53 2jxj s LYS 106 Cb -0.36 -2.47 -0.04 0.00 -0.52 0.00 0.00 37.83 34.43 2jxj s LYS 106 CO 0.29 -0.61 2.09 0.42 -0.92 0.00 0.00 175.35 176.62 2jxj s ILE 107 N 1.51 3.15 0.99 2.17 -1.09 -1.26 -4.97 121.20 121.69 2jxj s ILE 107 Ca -0.05 0.15 -0.17 0.00 -2.23 0.00 0.00 60.65 58.36 2jxj s ILE 107 Cb -0.18 -3.19 0.22 0.00 -1.58 0.00 0.00 42.46 37.73 2jxj s ILE 107 CO -0.07 -0.11 1.35 -2.16 -1.23 0.00 0.00 174.94 172.72 2jxj s PRO 108 N 6.03 0.41 0.09 2.79 0.04 -1.26 -5.07 135.00 138.03 2jxj s PRO 108 Ca 0.94 -0.50 0.08 0.00 0.04 0.00 0.00 61.00 61.56 2jxj s PRO 108 Cb -0.31 -1.83 -0.03 0.00 0.04 0.00 0.00 34.50 32.37 2jxj s PRO 108 CO 0.35 -2.56 -0.21 0.08 0.04 0.00 0.00 177.00 174.70 2jxj s VAL 109 N -3.95 1.70 -0.20 -0.36 1.01 -1.26 -4.27 120.40 113.07 2jxj s VAL 109 Ca 0.76 -1.48 -0.00 0.00 0.00 0.00 0.00 61.98 61.26 2jxj s VAL 109 Cb -0.03 -1.53 0.05 0.00 0.00 0.00 0.00 36.38 34.87 2jxj s VAL 109 CO 0.54 -0.01 -0.04 -0.69 0.00 0.00 0.00 175.10 174.89 2jxj s VAL 110 N -1.09 1.23 0.00 2.92 1.01 -0.21 -4.86 120.40 119.40 2jxj s VAL 110 Ca 0.07 -0.90 0.00 0.00 0.00 0.00 0.00 61.98 61.15 2jxj s VAL 110 Cb -0.10 -1.49 0.00 0.00 0.00 0.00 0.00 36.38 34.79 2jxj s VAL 110 CO 0.04 -0.02 0.00 -0.62 0.00 0.00 0.00 175.10 174.49 2jxj n GLU 111 N 4.80 0.00 0.00 2.72 -0.58 -1.26 -2.62 120.64 123.70 2jxj n GLU 111 Ca -0.12 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.62 2jxj n GLU 111 Cb 0.46 -0.01 0.00 0.00 -0.57 0.00 0.00 31.44 31.32 2jxj n GLU 111 CO 0.00 0.00 0.00 -2.13 -0.48 0.00 0.00 177.13 174.52 2jxj n ARG 112 N 0.00 0.00 -3.20 3.49 3.00 -1.26 -5.16 116.66 113.53 2jxj n ARG 112 Ca 0.00 0.00 -0.19 0.00 -0.00 0.00 0.00 57.85 57.66 2jxj n ARG 112 Cb 0.00 0.00 0.01 0.00 0.00 0.00 0.00 32.46 32.47 2jxj n ARG 112 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.63 177.78 2jxj s LYS 113 N 0.00 2.64 -0.05 -0.14 3.01 -1.08 -5.06 119.74 119.06 2jxj s LYS 113 Ca 0.00 -1.42 -0.18 0.00 -1.01 0.00 0.00 55.97 53.36 2jxj s LYS 113 Cb 0.00 -2.61 -0.05 0.00 -1.01 0.00 0.00 37.83 34.16 2jxj s LYS 113 CO 0.00 -0.37 0.50 0.42 0.51 0.00 0.00 175.35 176.42 2jxj s ILE 114 N -2.46 5.05 0.03 2.17 1.09 -1.26 -1.05 121.20 124.78 2jxj s ILE 114 Ca 0.53 1.03 -0.30 0.00 -1.10 0.00 0.00 60.65 60.81 2jxj s ILE 114 Cb -0.07 -3.84 -0.05 0.00 -1.06 0.00 0.00 42.46 37.44 2jxj s ILE 114 CO 0.32 0.41 1.19 -0.22 -0.10 0.00 0.00 174.94 176.54 2jxj s LEU 115 N -0.02 4.35 1.31 2.97 0.20 -1.26 -4.95 118.68 121.28 2jxj s LEU 115 Ca 0.27 1.95 -0.18 0.00 0.69 0.00 0.00 54.13 56.86 2jxj s LEU 115 Cb -0.17 -3.57 0.32 0.00 -0.43 0.00 0.00 46.19 42.34 2jxj s LEU 115 CO 0.13 -0.49 0.84 -0.67 -0.29 0.00 0.00 176.35 175.88 2jxj n ASP 116 N 4.24 -2.95 0.02 3.68 -0.08 -1.26 -5.01 116.55 115.18 2jxj n ASP 116 Ca 0.09 -0.49 0.00 0.00 -1.51 0.00 0.00 54.79 52.88 2jxj n ASP 116 Cb 0.47 -1.10 0.00 0.00 2.34 0.00 0.00 41.12 42.83 2jxj n ASP 116 CO 0.00 0.00 0.00 0.18 0.12 0.00 0.00 177.20 177.50 2jxj n LEU 117 N -4.92 0.03 0.08 -2.67 4.32 -1.26 -4.65 117.00 107.92 2jxj n LEU 117 Ca 0.07 0.05 -0.12 0.00 -0.02 0.00 0.00 56.01 55.99 2jxj n LEU 117 Cb 0.56 0.02 -0.07 0.00 -1.62 0.00 0.00 43.42 42.32 2jxj n LEU 117 CO 0.48 -0.54 0.82 0.22 -1.22 0.00 0.00 177.39 177.16 2jxj h TYR 118 N 0.00 -0.18 -0.05 -1.77 5.03 -1.95 -0.32 116.97 117.73 2jxj h TYR 118 Ca 0.00 0.00 -0.05 0.00 2.58 0.00 0.00 58.73 61.26 2jxj h TYR 118 Cb 0.00 0.07 -0.01 0.00 1.55 0.00 0.00 36.73 38.34 2jxj h TYR 118 CO 0.00 -0.11 -0.22 0.00 -1.32 0.00 0.00 178.16 176.51 2jxj h ALA 119 N 0.76 1.54 -0.04 1.82 0.00 -2.00 -2.55 119.26 118.79 2jxj h ALA 119 Ca 0.00 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.67 2jxj h ALA 119 Cb 0.15 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 17.89 2jxj h ALA 119 CO -0.02 0.34 -0.03 1.25 0.00 0.00 0.00 179.25 180.78 2jxj h LEU 120 N 0.07 0.10 -1.48 0.00 7.12 -1.69 -2.76 115.31 116.68 2jxj h LEU 120 Ca 0.01 -0.45 -0.00 0.00 0.13 0.00 0.00 57.88 57.57 2jxj h LEU 120 Cb 0.44 -0.03 -0.02 0.00 -0.53 0.00 0.00 40.66 40.52 2jxj h LEU 120 CO 0.03 0.53 0.29 -1.28 -0.13 0.00 0.00 178.44 177.88 2jxj h SER 121 N -0.33 0.56 -0.25 1.25 0.87 -0.95 -2.56 113.55 112.14 2jxj h SER 121 Ca 0.01 -0.03 -0.02 0.00 -1.23 0.00 0.00 61.79 60.52 2jxj h SER 121 Cb 0.50 -0.14 -0.01 0.00 -0.44 0.00 0.00 62.40 62.31 2jxj h SER 121 CO 0.01 0.43 0.07 0.11 -0.53 0.00 0.00 176.83 176.92 2jxj h LYS 122 N 0.65 0.40 -0.16 2.24 1.79 -1.41 -1.97 116.57 118.10 2jxj h LYS 122 Ca 0.17 -0.09 0.01 0.00 -2.18 0.00 0.00 60.65 58.57 2jxj h LYS 122 Cb -0.02 -0.06 -0.02 0.00 -1.58 0.00 0.00 32.23 30.55 2jxj h LYS 122 CO -0.03 0.48 0.06 0.82 -1.08 0.00 0.00 179.45 179.70 2jxj h ILE 123 N 0.24 0.97 -0.03 1.86 2.04 -1.17 0.22 117.51 121.64 2jxj h ILE 123 Ca 0.08 -0.05 0.01 0.00 1.00 0.00 0.00 64.86 65.90 2jxj h ILE 123 Cb 0.26 0.81 -0.01 0.00 -0.74 0.00 0.00 36.82 37.14 2jxj h ILE 123 CO -0.00 0.03 -0.02 0.58 0.00 0.00 0.00 178.15 178.73 2jxj h VAL 124 N 0.14 0.93 -0.65 1.67 2.07 -1.43 -2.64 116.25 116.35 2jxj h VAL 124 Ca 0.07 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.60 2jxj h VAL 124 Cb 0.04 0.93 -0.03 0.00 -1.52 0.00 0.00 31.29 30.71 2jxj h VAL 124 CO -0.07 0.00 0.42 0.00 0.02 0.00 0.00 177.57 177.94 2jxj h ALA 125 N 1.00 0.83 -0.22 1.67 0.00 -1.20 -1.46 119.26 119.89 2jxj h ALA 125 Ca 0.02 -0.04 0.06 0.00 0.00 0.00 0.00 54.91 54.96 2jxj h ALA 125 Cb 0.05 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 2jxj h ALA 125 CO -0.04 0.22 0.21 0.66 0.00 0.00 0.00 179.25 180.29 2jxj h SER 126 N 0.85 0.00 1.21 0.00 4.64 -0.68 0.10 113.55 119.67 2jxj h SER 126 Ca 0.24 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 61.44 2jxj h SER 126 Cb -0.06 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.01 2jxj h SER 126 CO -0.07 0.00 -0.83 0.11 -0.87 0.00 0.00 176.83 175.17 2jxj h LYS 127 N 0.00 0.00 0.00 4.77 1.79 -0.95 -3.47 116.57 118.71 2jxj h LYS 127 Ca 0.10 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.57 2jxj h LYS 127 Cb 0.52 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.17 2jxj h LYS 127 CO -0.00 0.41 0.00 0.41 -1.08 0.00 0.00 179.45 179.19 2jxj n GLY 128 N 1.28 0.49 0.00 3.86 0.00 0.35 -4.73 105.19 106.44 2jxj n GLY 128 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.00 2jxj n GLY 128 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jxj n GLY 129 N 0.00 3.19 0.02 -0.02 0.00 -0.75 -4.85 105.19 102.79 2jxj n GLY 129 Ca 0.00 -0.49 0.00 0.00 0.00 0.00 0.00 46.02 45.53 2jxj n GLY 129 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2jxj n PHE 130 N 0.00 -1.61 -0.35 1.61 -0.00 -1.26 -4.10 117.46 111.75 2jxj n PHE 130 Ca 0.00 0.01 -0.02 0.00 -0.00 0.00 0.00 57.45 57.44 2jxj n PHE 130 Cb 0.00 0.34 0.12 0.00 -0.00 0.00 0.00 39.48 39.94 2jxj n PHE 130 CO 0.00 0.00 0.00 0.93 -0.00 0.00 0.00 176.76 177.69 2jxj h GLU 131 N 0.00 1.28 -0.50 -4.13 5.08 -1.95 -1.91 114.58 112.44 2jxj h GLU 131 Ca 0.00 -0.10 -0.01 0.00 -1.00 0.00 0.00 59.36 58.25 2jxj h GLU 131 Cb 0.00 -0.28 -0.02 0.00 0.50 0.00 0.00 28.75 28.95 2jxj h GLU 131 CO 0.00 0.87 0.28 1.98 -1.00 0.00 0.00 179.01 181.14 2jxj h MET 132 N 1.31 0.69 -0.43 2.33 4.05 -1.90 -1.65 114.93 119.33 2jxj h MET 132 Ca 0.35 -0.06 -0.08 0.00 -0.28 0.00 0.00 59.70 59.62 2jxj h MET 132 Cb -0.10 -0.14 -0.01 0.00 -0.80 0.00 0.00 31.60 30.54 2jxj h MET 132 CO -0.07 0.50 -0.05 0.28 0.23 0.00 0.00 176.91 177.80 2jxj h VAL 133 N 0.70 1.27 -0.54 -5.77 2.07 -1.64 -2.69 116.25 109.64 2jxj h VAL 133 Ca 0.18 -1.12 -0.08 0.00 0.82 0.00 0.00 66.70 66.51 2jxj h VAL 133 Cb 0.01 1.12 -0.02 0.00 -1.52 0.00 0.00 31.29 30.88 2jxj h VAL 133 CO -0.03 0.38 0.03 0.74 0.02 0.00 0.00 177.57 178.71 2jxj h THR 134 N 0.63 1.25 -0.73 2.57 2.02 -1.08 0.83 112.91 118.40 2jxj h THR 134 Ca 0.12 -1.03 -0.02 0.00 0.77 0.00 0.00 66.41 66.25 2jxj h THR 134 Cb 0.56 0.81 -0.03 0.00 -1.74 0.00 0.00 68.15 67.74 2jxj h THR 134 CO 0.03 0.37 0.38 0.11 0.37 0.00 0.00 175.52 176.78 2jxj h LYS 135 N 0.84 1.03 0.00 6.66 1.79 -1.18 -2.58 116.57 123.12 2jxj h LYS 135 Ca 0.16 -0.13 0.00 0.00 -2.18 0.00 0.00 60.65 58.51 2jxj h LYS 135 Cb 0.46 -0.20 0.00 0.00 -1.58 0.00 0.00 32.23 30.91 2jxj h LYS 135 CO 0.02 0.77 -1.14 0.39 -1.08 0.00 0.00 179.45 178.41 2jxj n GLU 136 N -4.34 0.51 -3.05 3.15 1.02 -1.03 -4.98 120.64 111.92 2jxj n GLU 136 Ca 0.07 0.04 -0.15 0.00 -0.02 0.00 0.00 57.16 57.10 2jxj n GLU 136 Cb 0.12 -1.71 0.04 0.00 -0.02 0.00 0.00 31.44 29.87 2jxj n GLU 136 CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 2jxj n LYS 137 N -2.39 -4.47 -0.33 3.49 3.00 0.28 -4.91 118.16 112.83 2jxj n LYS 137 Ca 0.00 0.55 0.07 0.00 -0.00 0.00 0.00 58.31 58.93 2jxj n LYS 137 Cb 0.52 -4.71 0.22 0.00 0.00 0.00 0.00 35.03 31.06 2jxj n LYS 137 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.40 179.03 2jxj n LYS 138 N -3.22 2.47 -0.00 1.64 4.76 -0.83 -4.19 118.16 118.79 2jxj n LYS 138 Ca -0.02 -1.79 -0.04 0.00 -2.87 0.00 0.00 58.31 53.59 2jxj n LYS 138 Cb 0.55 -1.53 0.19 0.00 -1.84 0.00 0.00 35.03 32.40 2jxj n LYS 138 CO 0.00 0.00 0.00 -1.49 -1.37 0.00 0.00 177.40 174.54 2jxj h TRP 139 N 2.72 0.60 -0.29 2.13 4.06 -1.91 -2.61 115.95 120.65 2jxj h TRP 139 Ca 0.00 -0.12 -0.08 0.00 2.06 0.00 0.00 58.89 60.75 2jxj h TRP 139 Cb 0.85 -0.15 -0.02 0.00 -1.00 0.00 0.00 29.16 28.85 2jxj h TRP 139 CO 0.42 0.72 -0.14 0.77 -3.56 0.00 0.00 178.44 176.65 2jxj h SER 140 N 0.47 0.49 0.24 -3.49 0.02 -1.89 -2.66 113.55 106.73 2jxj h SER 140 Ca 0.07 -0.13 -0.14 0.00 -0.84 0.00 0.00 61.79 60.75 2jxj h SER 140 Cb 0.65 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 63.05 2jxj h SER 140 CO 0.05 0.66 -0.55 0.11 -1.14 0.00 0.00 176.83 175.96 2jxj h LYS 141 N 0.46 0.33 -0.08 3.45 1.57 -1.77 -2.29 116.57 118.25 2jxj h LYS 141 Ca 0.08 -0.21 -0.00 0.00 -1.87 0.00 0.00 60.65 58.65 2jxj h LYS 141 Cb 0.52 0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.85 2jxj h LYS 141 CO 0.03 0.79 0.05 0.28 -0.57 0.00 0.00 179.45 180.03 2jxj h VAL 142 N 0.26 1.09 -0.37 0.50 2.07 -1.12 -0.98 116.25 117.69 2jxj h VAL 142 Ca 0.00 -0.24 -0.09 0.00 0.82 0.00 0.00 66.70 67.20 2jxj h VAL 142 Cb 1.04 1.09 -0.01 0.00 -1.52 0.00 0.00 31.29 31.89 2jxj h VAL 142 CO 0.09 0.07 -0.12 1.23 0.02 0.00 0.00 177.57 178.86 2jxj h GLY 143 N 0.04 0.79 1.40 2.17 0.00 -1.52 -3.00 103.07 102.95 2jxj h GLY 143 Ca 0.03 -0.67 0.00 0.00 0.00 0.00 0.00 47.33 46.69 2jxj h GLY 143 CO -0.00 0.61 0.39 1.76 0.00 0.00 0.00 176.54 179.30 2jxj h SER 144 N 0.52 0.70 -0.28 0.19 0.02 -1.33 -1.56 113.55 111.81 2jxj h SER 144 Ca 0.09 -0.02 -0.03 0.00 -0.84 0.00 0.00 61.79 60.99 2jxj h SER 144 Cb 0.65 -0.18 -0.02 0.00 0.14 0.00 0.00 62.40 62.99 2jxj h SER 144 CO 0.04 0.52 0.09 0.03 -1.14 0.00 0.00 176.83 176.37 2jxj h ARG 145 N 0.82 0.51 -0.04 3.45 2.47 -1.04 -2.89 114.38 117.66 2jxj h ARG 145 Ca 0.22 -0.08 -0.01 0.00 -1.26 0.00 0.00 59.98 58.85 2jxj h ARG 145 Cb -0.08 -0.09 -0.00 0.00 -1.65 0.00 0.00 29.97 28.15 2jxj h ARG 145 CO -0.05 0.46 -0.02 -0.07 0.56 0.00 0.00 179.97 180.85 2jxj h LEU 146 N 0.50 0.09 0.00 3.04 4.07 -1.21 -3.47 115.31 118.33 2jxj h LEU 146 Ca 0.12 -0.42 0.00 0.00 0.08 0.00 0.00 57.88 57.66 2jxj h LEU 146 Cb 0.18 -0.02 0.00 0.00 1.08 0.00 0.00 40.66 41.90 2jxj h LEU 146 CO -0.01 0.49 0.00 0.61 -1.08 0.00 0.00 178.44 178.46 2jxj n GLY 147 N 0.05 -0.01 3.68 0.83 0.00 -1.04 -5.15 105.19 103.54 2jxj n GLY 147 Ca -0.08 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.60 2jxj n GLY 147 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2jxj s TYR 148 N 0.00 3.22 0.71 1.61 1.51 -1.21 -5.02 117.35 118.17 2jxj s TYR 148 Ca 0.00 0.15 -0.15 0.00 -1.01 0.00 0.00 57.07 56.06 2jxj s TYR 148 Cb 0.00 -1.89 0.03 0.00 -0.11 0.00 0.00 41.96 39.99 2jxj s TYR 148 CO 0.00 0.38 1.17 -0.51 -1.11 0.00 0.00 175.55 175.48 2jxj s LEU 149 N -0.49 3.33 -0.54 -1.29 1.43 -1.26 -4.72 118.68 115.15 2jxj s LEU 149 Ca 0.09 2.23 -0.27 0.00 -1.03 0.00 0.00 54.13 55.15 2jxj s LEU 149 Cb -0.12 -4.58 -0.01 0.00 0.03 0.00 0.00 46.19 41.52 2jxj s LEU 149 CO 0.02 -2.07 1.66 -2.16 0.23 0.00 0.00 176.35 174.03 2jxj s PRO 150 N -3.98 3.05 0.00 1.29 0.04 -1.26 -4.94 135.00 129.20 2jxj s PRO 150 Ca 0.72 0.68 0.00 0.00 0.04 0.00 0.00 61.00 62.44 2jxj s PRO 150 Cb -0.26 -4.24 0.00 0.00 0.04 0.00 0.00 34.50 30.04 2jxj s PRO 150 CO 0.44 -2.23 0.00 0.41 0.04 0.00 0.00 177.00 175.66 2jxj n GLY 151 N 5.46 4.27 0.00 0.56 0.00 -1.26 -5.12 105.19 109.11 2jxj n GLY 151 Ca 0.17 -1.66 0.00 0.00 0.00 0.00 0.00 46.02 44.54 2jxj n GLY 151 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2jxj n LYS 152 N 0.00 0.00 -2.80 1.61 5.02 -1.26 -4.87 118.16 115.86 2jxj n LYS 152 Ca 0.00 0.19 -0.42 0.00 -2.02 0.00 0.00 58.31 56.06 2jxj n LYS 152 Cb 0.00 -0.63 -0.03 0.00 -0.02 0.00 0.00 35.03 34.35 2jxj n LYS 152 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 2jxj s GLY 153 N -1.71 2.07 0.00 0.72 0.00 -1.26 -4.69 107.32 102.45 2jxj s GLY 153 Ca 0.00 0.14 0.00 0.00 0.00 0.00 0.00 44.72 44.86 2jxj s GLY 153 CO 0.00 1.83 0.00 2.41 0.00 0.00 0.00 173.10 177.34 2jxj n THR 154 N 4.83 0.00 -0.14 0.90 -1.04 -1.26 -4.93 114.28 112.64 2jxj n THR 154 Ca 0.07 0.00 0.04 0.00 -2.04 0.00 0.00 64.05 62.11 2jxj n THR 154 Cb 0.48 0.00 0.33 0.00 -1.82 0.00 0.00 70.33 69.32 2jxj n THR 154 CO 0.00 0.00 0.00 1.23 -0.64 0.00 0.00 175.07 175.66 2jxj h GLY 155 N 0.00 0.89 1.46 3.41 0.00 -1.86 -1.81 103.07 105.16 2jxj h GLY 155 Ca 0.00 -0.31 -0.11 0.00 0.00 0.00 0.00 47.33 46.91 2jxj h GLY 155 CO 0.00 0.28 -0.25 1.76 0.00 0.00 0.00 176.54 178.33 2jxj h SER 156 N 0.80 0.63 -0.63 0.19 0.02 -1.95 -1.18 113.55 111.42 2jxj h SER 156 Ca 0.25 -0.22 -0.07 0.00 -0.84 0.00 0.00 61.79 60.91 2jxj h SER 156 Cb 0.02 -0.17 -0.03 0.00 0.14 0.00 0.00 62.40 62.37 2jxj h SER 156 CO -0.07 0.86 0.12 -0.07 -1.14 0.00 0.00 176.83 176.54 2jxj h LEU 157 N 0.54 0.98 -0.14 5.07 3.38 -1.70 -0.20 115.31 123.23 2jxj h LEU 157 Ca 0.07 -0.25 -0.11 0.00 0.09 0.00 0.00 57.88 57.69 2jxj h LEU 157 Cb 0.72 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 41.21 2jxj h LEU 157 CO 0.06 0.98 -0.33 -0.07 0.09 0.00 0.00 178.44 179.16 2jxj h LEU 158 N 0.94 0.54 -0.72 1.67 3.38 -1.31 -1.80 115.31 118.00 2jxj h LEU 158 Ca 0.19 -0.57 -0.01 0.00 0.09 0.00 0.00 57.88 57.58 2jxj h LEU 158 Cb 0.40 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.96 2jxj h LEU 158 CO 0.01 1.02 0.40 0.11 0.09 0.00 0.00 178.44 180.06 2jxj h LYS 159 N 0.10 1.01 -0.23 1.13 1.57 -1.14 0.31 116.57 119.32 2jxj h LYS 159 Ca -0.00 -0.12 -0.04 0.00 -1.87 0.00 0.00 60.65 58.62 2jxj h LYS 159 Cb 0.94 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 33.04 2jxj h LYS 159 CO 0.07 0.76 -0.03 0.77 -0.57 0.00 0.00 179.45 180.45 2jxj h SER 160 N 1.00 0.42 -0.12 0.86 0.02 -1.05 -0.22 113.55 114.45 2jxj h SER 160 Ca 0.25 -0.34 -0.02 0.00 -0.84 0.00 0.00 61.79 60.85 2jxj h SER 160 Cb 0.04 -0.11 -0.00 0.00 0.14 0.00 0.00 62.40 62.46 2jxj h SER 160 CO -0.04 0.66 0.01 0.45 -1.14 0.00 0.00 176.83 176.76 2jxj h HIS 161 N 0.17 0.23 -0.10 3.45 3.86 -1.13 -3.16 115.15 118.47 2jxj h HIS 161 Ca 0.06 -0.04 0.00 0.00 -1.16 0.00 0.00 60.37 59.23 2jxj h HIS 161 Cb 0.46 -0.06 -0.00 0.00 1.06 0.00 0.00 27.41 28.86 2jxj h HIS 161 CO 0.04 0.43 0.06 -0.92 0.86 0.00 0.00 177.93 178.41 2jxj h TYR 162 N -0.04 0.12 -1.53 2.45 3.20 -0.40 -3.14 116.97 117.63 2jxj h TYR 162 Ca 0.04 0.00 -0.76 0.00 3.14 0.00 0.00 58.73 61.15 2jxj h TYR 162 Cb 0.34 -0.04 -0.17 0.00 1.54 0.00 0.00 36.73 38.40 2jxj h TYR 162 CO 0.03 0.08 1.97 -1.91 -1.64 0.00 0.00 178.16 176.68 2jxj n GLU 163 N -5.02 4.53 0.00 1.82 2.13 -0.10 -0.48 120.64 123.53 2jxj n GLU 163 Ca -0.05 -3.77 0.00 0.00 0.66 0.00 0.00 57.16 54.00 2jxj n GLU 163 Cb 0.03 -2.66 0.00 0.00 0.27 0.00 0.00 31.44 29.08 2jxj n GLU 163 CO 0.00 0.00 0.00 0.54 -0.41 0.00 0.00 177.13 177.26 2jxj n ARG 164 N 1.84 0.00 0.00 5.31 5.12 -1.18 -4.81 116.66 122.93 2jxj n ARG 164 Ca 0.52 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 56.44 2jxj n ARG 164 Cb 0.28 -0.12 0.00 0.00 -1.16 0.00 0.00 32.46 31.45 2jxj n ARG 164 CO 0.00 0.00 0.00 -0.89 -1.93 0.00 0.00 177.63 174.81 2jxj n ILE 165 N -1.91 0.00 0.04 0.55 -0.00 -1.25 -4.76 119.36 112.04 2jxj n ILE 165 Ca 0.00 0.00 -0.02 0.00 -0.00 0.00 0.00 62.75 62.73 2jxj n ILE 165 Cb 0.00 -0.45 -0.01 0.00 -0.00 0.00 0.00 39.64 39.18 2jxj n ILE 165 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 176.55 176.48 2jxj h LEU 166 N 0.00 -0.11 -0.62 1.39 3.38 -1.76 -3.20 115.31 114.40 2jxj h LEU 166 Ca 0.00 0.00 0.11 0.00 0.09 0.00 0.00 57.88 58.09 2jxj h LEU 166 Cb 0.50 0.03 -0.12 0.00 0.09 0.00 0.00 40.66 41.16 2jxj h LEU 166 CO 0.00 0.02 -0.29 0.22 0.09 0.00 0.00 178.44 178.48 2jxj h TYR 167 N -0.33 -0.76 -0.31 1.13 3.20 -1.09 0.20 116.97 119.00 2jxj h TYR 167 Ca -0.01 0.07 0.09 0.00 3.14 0.00 0.00 58.73 62.02 2jxj h TYR 167 Cb 0.10 0.43 -0.01 0.00 1.54 0.00 0.00 36.73 38.79 2jxj h TYR 167 CO 0.05 -0.36 0.34 -1.00 -1.64 0.00 0.00 178.16 175.55 2jxj h PRO 168 N -0.12 0.00 0.11 1.82 0.13 -1.79 -2.21 132.00 129.94 2jxj h PRO 168 Ca 0.26 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 65.40 2jxj h PRO 168 Cb 0.54 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.65 2jxj h PRO 168 CO -0.69 0.00 -0.18 -0.92 -0.23 0.00 0.00 178.00 175.98 2jxj h TYR 169 N 0.00 -0.48 -0.04 1.56 3.20 -0.59 0.11 116.97 120.73 2jxj h TYR 169 Ca 0.15 0.01 0.01 0.00 3.14 0.00 0.00 58.73 62.03 2jxj h TYR 169 Cb 0.82 0.20 -0.01 0.00 1.54 0.00 0.00 36.73 39.29 2jxj h TYR 169 CO 0.00 -0.27 -0.01 1.49 -1.64 0.00 0.00 178.16 177.73 2jxj h GLU 170 N -0.36 -0.00 -0.76 1.82 4.57 -1.46 -2.25 114.58 116.13 2jxj h GLU 170 Ca 0.02 0.00 0.09 0.00 -1.18 0.00 0.00 59.36 58.29 2jxj h GLU 170 Cb 0.37 0.00 -0.05 0.00 -0.16 0.00 0.00 28.75 28.91 2jxj h GLU 170 CO -0.10 -0.00 0.50 -0.07 -1.18 0.00 0.00 179.01 178.16 2jxj h LEU 171 N -0.00 0.62 -1.20 1.64 3.38 -1.46 0.53 115.31 118.82 2jxj h LEU 171 Ca 0.02 0.01 0.03 0.00 0.09 0.00 0.00 57.88 58.03 2jxj h LEU 171 Cb 0.03 -0.12 -0.05 0.00 0.09 0.00 0.00 40.66 40.62 2jxj h LEU 171 CO -0.04 0.38 0.55 0.15 0.09 0.00 0.00 178.44 179.56 2jxj h PHE 172 N 0.69 1.01 0.15 1.13 3.04 -0.17 1.03 116.94 123.81 2jxj h PHE 172 Ca 0.35 0.02 -0.22 0.00 3.98 0.00 0.00 57.97 62.10 2jxj h PHE 172 Cb 0.43 -0.34 0.02 0.00 2.56 0.00 0.00 35.95 38.62 2jxj h PHE 172 CO -0.00 0.60 -1.01 1.96 -2.02 0.00 0.00 178.31 177.85 2jxj h GLN 173 N 1.06 0.31 -1.01 1.11 4.20 -0.96 -3.32 115.11 116.50 2jxj h GLN 173 Ca 0.32 -0.53 -0.48 0.00 0.06 0.00 0.00 58.65 58.03 2jxj h GLN 173 Cb -0.01 0.20 -0.28 0.00 0.30 0.00 0.00 27.48 27.68 2jxj h GLN 173 CO -0.09 1.25 0.61 0.43 -0.67 0.00 0.00 178.83 180.36 2jxj n SER 174 N -4.05 3.89 0.00 1.46 7.64 0.04 -5.13 113.62 117.47 2jxj n SER 174 Ca -0.17 -3.46 0.00 0.00 1.01 0.00 0.00 58.87 56.25 2jxj n SER 174 Cb 0.86 -0.82 0.00 0.00 -1.01 0.00 0.00 64.21 63.25 2jxj n SER 174 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64