#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jxj s PRO 81 N 0.00 2.87 -1.15 1.61 0.04 -1.26 -4.92 135.00 132.19 2jxj s PRO 81 Ca 0.00 0.62 -0.20 0.00 0.04 0.00 0.00 61.00 61.46 2jxj s PRO 81 Cb 0.00 -4.30 0.07 0.00 0.04 0.00 0.00 34.50 30.31 2jxj s PRO 81 CO 0.00 -2.44 1.55 -0.51 0.04 0.00 0.00 177.00 175.64 2jxj s LEU 82 N 8.04 3.85 0.00 -3.56 1.02 -1.26 -4.87 118.68 121.90 2jxj s LEU 82 Ca 0.64 -2.03 0.00 0.00 0.02 0.00 0.00 54.13 52.76 2jxj s LEU 82 Cb -0.13 -2.55 0.00 0.00 0.02 0.00 0.00 46.19 43.53 2jxj s LEU 82 CO 0.23 -1.28 0.00 0.61 0.02 0.00 0.00 176.35 175.92 2jxj n GLY 83 N 5.97 1.74 1.21 -3.19 0.00 -1.26 -4.91 105.19 104.75 2jxj n GLY 83 Ca 0.40 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.44 2jxj n GLY 83 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2jxj n SER 84 N 0.00 1.63 -0.01 1.61 7.64 -1.26 -4.84 113.62 118.40 2jxj n SER 84 Ca 0.00 -2.99 -0.13 0.00 1.01 0.00 0.00 58.87 56.76 2jxj n SER 84 Cb 0.00 -0.42 -0.10 0.00 -1.01 0.00 0.00 64.21 62.68 2jxj n SER 84 CO 0.00 0.00 0.00 0.03 -3.01 0.00 0.00 175.04 172.06 2jxj h ARG 85 N 1.19 -0.05 -0.51 1.43 3.08 -1.93 -2.92 114.38 114.66 2jxj h ARG 85 Ca -0.08 0.00 -0.04 0.00 0.07 0.00 0.00 59.98 59.94 2jxj h ARG 85 Cb 1.43 0.01 -0.02 0.00 0.08 0.00 0.00 29.97 31.46 2jxj h ARG 85 CO 0.11 0.52 0.16 -0.39 -1.07 0.00 0.00 179.97 179.29 2jxj h VAL 86 N -0.67 1.20 -0.33 2.04 -1.51 -1.97 -1.95 116.25 113.05 2jxj h VAL 86 Ca -0.01 -0.69 0.01 0.00 -1.23 0.00 0.00 66.70 64.78 2jxj h VAL 86 Cb 0.59 0.65 -0.02 0.00 -2.13 0.00 0.00 31.29 30.38 2jxj h VAL 86 CO 0.01 0.26 0.21 0.03 -1.23 0.00 0.00 177.57 176.85 2jxj h ARG 87 N 0.73 0.42 -0.28 5.19 3.08 -1.90 -0.49 114.38 121.14 2jxj h ARG 87 Ca 0.17 -0.03 -0.04 0.00 0.07 0.00 0.00 59.98 60.15 2jxj h ARG 87 Cb 0.22 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.16 2jxj h ARG 87 CO -0.01 0.28 0.01 -0.07 -1.07 0.00 0.00 179.97 179.11 2jxj h LEU 88 N 0.43 0.47 -0.74 3.04 3.38 -1.29 -2.28 115.31 118.32 2jxj h LEU 88 Ca 0.13 -0.30 0.04 0.00 0.09 0.00 0.00 57.88 57.84 2jxj h LEU 88 Cb -0.03 -0.13 -0.05 0.00 0.09 0.00 0.00 40.66 40.54 2jxj h LEU 88 CO -0.04 0.65 0.45 0.44 0.09 0.00 0.00 178.44 180.04 2jxj h ASP 89 N 0.28 0.72 -0.10 -0.43 5.19 -1.16 -0.76 116.42 120.16 2jxj h ASP 89 Ca 0.08 0.01 -0.00 0.00 -0.62 0.00 0.00 57.03 56.50 2jxj h ASP 89 Cb 0.40 -0.14 -0.00 0.00 0.18 0.00 0.00 39.33 39.76 2jxj h ASP 89 CO 0.01 0.49 0.05 0.15 -3.12 0.00 0.00 179.24 176.82 2jxj h PHE 90 N 0.86 0.15 -0.30 4.55 3.04 -0.99 -2.57 116.94 121.68 2jxj h PHE 90 Ca 0.31 -0.01 0.00 0.00 3.98 0.00 0.00 57.97 62.26 2jxj h PHE 90 Cb 0.09 -0.05 -0.01 0.00 2.56 0.00 0.00 35.95 38.54 2jxj h PHE 90 CO -0.05 0.21 0.20 -0.07 -2.02 0.00 0.00 178.31 176.58 2jxj h LEU 91 N 0.04 0.34 -0.98 0.59 3.38 -1.03 -1.86 115.31 115.79 2jxj h LEU 91 Ca 0.04 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 2jxj h LEU 91 Cb 0.12 -0.09 -0.04 0.00 0.09 0.00 0.00 40.66 40.74 2jxj h LEU 91 CO -0.00 0.25 0.53 -0.78 0.09 0.00 0.00 178.44 178.52 2jxj h ASP 92 N 0.40 1.10 -0.16 -0.43 1.82 -0.74 0.29 116.42 118.69 2jxj h ASP 92 Ca 0.11 -0.07 -0.07 0.00 -0.39 0.00 0.00 57.03 56.60 2jxj h ASP 92 Cb -0.04 -0.28 -0.00 0.00 0.68 0.00 0.00 39.33 39.69 2jxj h ASP 92 CO -0.02 0.85 -0.18 1.56 -1.61 0.00 0.00 179.24 179.84 2jxj h GLN 93 N 1.25 0.41 -0.43 0.28 1.08 -1.15 -0.25 115.11 116.30 2jxj h GLN 93 Ca 0.32 -0.22 -0.07 0.00 -1.45 0.00 0.00 58.65 57.23 2jxj h GLN 93 Cb -0.03 0.01 -0.02 0.00 -0.05 0.00 0.00 27.48 27.40 2jxj h GLN 93 CO -0.06 0.79 0.01 1.25 -0.95 0.00 0.00 178.83 179.87 2jxj h LEU 94 N 0.05 0.74 -0.60 1.46 5.85 -1.23 0.31 115.31 121.89 2jxj h LEU 94 Ca 0.02 -0.30 -0.13 0.00 0.84 0.00 0.00 57.88 58.31 2jxj h LEU 94 Cb 0.72 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.54 2jxj h LEU 94 CO 0.04 0.86 -0.31 0.00 -0.34 0.00 0.00 178.44 178.70 2jxj h ALA 95 N 0.91 0.78 -0.03 1.25 0.00 -0.46 -1.93 119.26 119.78 2jxj h ALA 95 Ca 0.12 -0.41 -0.14 0.00 0.00 0.00 0.00 54.91 54.48 2jxj h ALA 95 Cb 0.48 -0.13 0.01 0.00 0.00 0.00 0.00 17.79 18.14 2jxj h ALA 95 CO 0.02 0.65 -0.54 0.87 0.00 0.00 0.00 179.25 180.25 2jxj h LYS 96 N 0.66 0.42 -0.07 0.00 1.57 -0.93 -1.99 116.57 116.23 2jxj h LYS 96 Ca 0.07 -0.41 0.00 0.00 -1.87 0.00 0.00 60.65 58.44 2jxj h LYS 96 Cb 0.84 0.11 -0.00 0.00 0.08 0.00 0.00 32.23 33.26 2jxj h LYS 96 CO 0.07 1.07 0.04 0.35 -0.57 0.00 0.00 179.45 180.41 2jxj h PHE 97 N -0.07 0.09 -0.31 -1.35 3.57 -0.40 -2.61 116.94 115.86 2jxj h PHE 97 Ca -0.06 0.00 -0.08 0.00 3.53 0.00 0.00 57.97 61.36 2jxj h PHE 97 Cb 1.23 -0.03 -0.02 0.00 2.79 0.00 0.00 35.95 39.93 2jxj h PHE 97 CO 0.14 0.07 -0.16 -1.49 -2.23 0.00 0.00 178.31 174.64 2jxj h TRP 98 N 0.08 0.59 -0.87 0.41 4.06 -1.45 -2.82 115.95 115.95 2jxj h TRP 98 Ca 0.02 -0.10 0.10 0.00 2.06 0.00 0.00 58.89 60.97 2jxj h TRP 98 Cb 0.01 -0.15 -0.06 0.00 -1.00 0.00 0.00 29.16 27.95 2jxj h TRP 98 CO -0.07 0.68 0.56 0.93 -3.56 0.00 0.00 178.44 176.98 2jxj h GLU 99 N 0.49 0.81 -0.23 0.49 5.08 -0.99 0.09 114.58 120.32 2jxj h GLU 99 Ca 0.08 -0.05 0.02 0.00 -1.00 0.00 0.00 59.36 58.42 2jxj h GLU 99 Cb 0.57 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.62 2jxj h GLU 99 CO 0.04 0.54 0.15 -0.07 -1.00 0.00 0.00 179.01 178.67 2jxj h LEU 100 N 0.84 0.18 -0.01 1.33 3.38 -1.21 -2.36 115.31 117.45 2jxj h LEU 100 Ca 0.41 -0.00 -0.14 0.00 0.09 0.00 0.00 57.88 58.24 2jxj h LEU 100 Cb 0.45 -0.04 0.01 0.00 0.09 0.00 0.00 40.66 41.16 2jxj h LEU 100 CO -0.17 0.13 -0.53 1.56 0.09 0.00 0.00 178.44 179.51 2jxj h GLN 101 N 0.21 0.38 0.00 1.13 7.50 -1.09 -3.48 115.11 119.76 2jxj h GLN 101 Ca 0.09 -0.40 0.00 0.00 0.50 0.00 0.00 58.65 58.85 2jxj h GLN 101 Cb 0.11 0.11 0.00 0.00 0.05 0.00 0.00 27.48 27.75 2jxj h GLN 101 CO -0.02 1.07 0.00 0.41 -1.50 0.00 0.00 178.83 178.79 2jxj n GLY 102 N 1.03 1.78 0.08 3.46 0.00 -0.89 -5.02 105.19 105.62 2jxj n GLY 102 Ca -0.10 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 45.91 2jxj n GLY 102 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2jxj n SER 103 N 0.00 0.37 -2.07 1.61 2.88 -1.23 -5.06 113.62 110.11 2jxj n SER 103 Ca 0.00 0.16 -0.00 0.00 -1.33 0.00 0.00 58.87 57.70 2jxj n SER 103 Cb 0.00 0.86 -0.00 0.00 -0.75 0.00 0.00 64.21 64.32 2jxj n SER 103 CO 0.00 0.00 0.00 0.41 -1.23 0.00 0.00 175.04 174.22 2jxj n THR 104 N -2.70-11.09 -1.95 2.46 -1.04 -1.26 -4.88 114.28 93.82 2jxj n THR 104 Ca -0.17 2.51 -0.42 0.00 -2.04 0.00 0.00 64.05 63.94 2jxj n THR 104 Cb 0.90 -5.48 -0.03 0.00 -1.82 0.00 0.00 70.33 63.90 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 -0.48 4.37 -0.06 -4.42 2.96 -1.26 -5.01 118.68 114.79 2jxj s LEU 105 Ca -0.01 2.67 0.03 0.00 -0.22 0.00 0.00 54.13 56.61 2jxj s LEU 105 Cb 0.00 -3.61 0.01 0.00 0.50 0.00 0.00 46.19 43.09 2jxj s LEU 105 CO 0.01 -0.79 -0.14 -0.54 -1.32 0.00 0.00 176.35 173.58 2jxj s LYS 106 N 0.34 1.69 -0.59 1.98 1.02 -1.26 -5.06 119.74 117.87 2jxj s LYS 106 Ca 0.65 -0.47 -0.16 0.00 0.02 0.00 0.00 55.97 56.00 2jxj s LYS 106 Cb -0.43 -1.42 0.14 0.00 -0.52 0.00 0.00 37.83 35.59 2jxj s LYS 106 CO 0.38 0.10 0.58 0.96 -0.92 0.00 0.00 175.35 176.45 2jxj s ILE 107 N 0.42 5.17 0.43 2.17 -4.36 -1.26 -5.06 121.20 118.72 2jxj s ILE 107 Ca -0.11 -1.51 -0.24 0.00 -0.26 0.00 0.00 60.65 58.53 2jxj s ILE 107 Cb -0.14 -4.39 -0.08 0.00 1.25 0.00 0.00 42.46 39.10 2jxj s ILE 107 CO 0.03 -0.95 1.21 -2.16 0.24 0.00 0.00 174.94 173.31 2jxj s PRO 108 N 1.66 3.87 -0.17 0.37 0.04 -1.26 -4.94 135.00 134.57 2jxj s PRO 108 Ca 0.07 1.90 -0.09 0.00 0.04 0.00 0.00 61.00 62.92 2jxj s PRO 108 Cb -0.26 -2.57 -0.05 0.00 0.04 0.00 0.00 34.50 31.66 2jxj s PRO 108 CO 0.02 -0.50 0.15 0.08 0.04 0.00 0.00 177.00 176.79 2jxj s VAL 109 N -1.42 5.43 -0.07 -0.36 1.01 -1.26 -3.54 120.40 120.19 2jxj s VAL 109 Ca 0.60 0.23 0.02 0.00 0.00 0.00 0.00 61.98 62.83 2jxj s VAL 109 Cb -0.32 -3.46 0.01 0.00 0.00 0.00 0.00 36.38 32.61 2jxj s VAL 109 CO 0.40 0.50 -0.11 -0.69 0.00 0.00 0.00 175.10 175.19 2jxj s VAL 110 N -0.10 1.09 -1.41 2.92 1.01 0.33 -4.77 120.40 119.48 2jxj s VAL 110 Ca 0.11 -0.44 -0.08 0.00 0.00 0.00 0.00 61.98 61.57 2jxj s VAL 110 Cb -0.12 -1.01 0.01 0.00 0.00 0.00 0.00 36.38 35.26 2jxj s VAL 110 CO 0.01 0.35 1.03 -0.62 0.00 0.00 0.00 175.10 175.86 2jxj n GLU 111 N 3.96 -7.13 -2.42 2.72 -0.58 -1.26 -1.46 120.64 114.46 2jxj n GLU 111 Ca -0.22 0.85 -0.21 0.00 -0.42 0.00 0.00 57.16 57.16 2jxj n GLU 111 Cb 0.51 -5.85 -0.01 0.00 -0.57 0.00 0.00 31.44 25.53 2jxj n GLU 111 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 2jxj n ARG 112 N -4.73 -1.78 -4.09 3.49 3.00 -1.26 -4.96 116.66 106.32 2jxj n ARG 112 Ca -0.02 1.01 -0.10 0.00 -0.01 0.00 0.00 57.85 58.72 2jxj n ARG 112 Cb 0.58 -5.68 -0.08 0.00 0.00 0.00 0.00 32.46 27.27 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 -5.07 1.19 0.23 5.56 1.02 -0.54 -5.15 119.74 116.99 2jxj s LYS 113 Ca 0.01 -1.39 -0.27 0.00 0.02 0.00 0.00 55.97 54.34 2jxj s LYS 113 Cb -0.00 0.33 -0.09 0.00 -0.52 0.00 0.00 37.83 37.55 2jxj s LYS 113 CO 0.01 -0.42 0.87 0.42 -0.92 0.00 0.00 175.35 175.32 2jxj s ILE 114 N -4.06 4.24 -0.29 2.17 1.01 -1.26 -0.51 121.20 122.50 2jxj s ILE 114 Ca 0.27 1.84 -0.26 0.00 0.00 0.00 0.00 60.65 62.50 2jxj s ILE 114 Cb 0.05 -4.16 0.01 0.00 0.01 0.00 0.00 42.46 38.36 2jxj s ILE 114 CO 0.06 0.40 0.91 -0.22 0.00 0.00 0.00 174.94 176.09 2jxj s LEU 115 N -1.44 4.05 1.00 2.97 1.98 -1.23 -4.84 118.68 121.17 2jxj s LEU 115 Ca 0.42 0.92 -0.11 0.00 -2.89 0.00 0.00 54.13 52.47 2jxj s LEU 115 Cb -0.23 -3.28 0.18 0.00 0.66 0.00 0.00 46.19 43.52 2jxj s LEU 115 CO 0.27 -0.68 1.02 -0.67 -1.89 0.00 0.00 176.35 174.40 2jxj n ASP 116 N 6.37 -0.53 0.12 3.68 -0.08 -1.26 -4.98 116.55 119.87 2jxj n ASP 116 Ca 0.07 0.23 0.00 0.00 -1.51 0.00 0.00 54.79 53.58 2jxj n ASP 116 Cb 0.47 -1.38 0.00 0.00 2.34 0.00 0.00 41.12 42.55 2jxj n ASP 116 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2jxj n LEU 117 N -4.15 -0.14 0.05 -2.67 -0.00 -1.26 -4.69 117.00 104.14 2jxj n LEU 117 Ca 0.09 0.42 -0.11 0.00 -0.00 0.00 0.00 56.01 56.41 2jxj n LEU 117 Cb 0.53 0.35 -0.05 0.00 -0.00 0.00 0.00 43.42 44.25 2jxj n LEU 117 CO 0.52 -0.75 0.80 0.22 -0.00 0.00 0.00 177.39 178.18 2jxj h TYR 118 N 0.00 -0.23 -0.46 1.47 3.20 -1.95 0.12 116.97 119.12 2jxj h TYR 118 Ca 0.00 0.01 -0.07 0.00 3.14 0.00 0.00 58.73 61.80 2jxj h TYR 118 Cb 0.00 0.10 -0.02 0.00 1.54 0.00 0.00 36.73 38.36 2jxj h TYR 118 CO 0.00 -0.14 -0.00 0.00 -1.64 0.00 0.00 178.16 176.38 2jxj h ALA 119 N 0.83 0.62 -0.80 1.82 0.00 -2.00 -2.61 119.26 117.12 2jxj h ALA 119 Ca 0.04 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.68 2jxj h ALA 119 Cb 0.20 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.78 2jxj h ALA 119 CO -0.10 0.42 0.51 1.25 0.00 0.00 0.00 179.25 181.34 2jxj h LEU 120 N 0.66 0.93 -0.59 0.00 5.85 -1.77 -0.99 115.31 119.40 2jxj h LEU 120 Ca 0.13 -0.03 -0.11 0.00 0.84 0.00 0.00 57.88 58.71 2jxj h LEU 120 Cb 0.51 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 41.28 2jxj h LEU 120 CO 0.02 0.69 -0.06 -1.28 -0.34 0.00 0.00 178.44 177.47 2jxj h SER 121 N 1.09 1.05 -0.31 1.25 0.87 -0.59 -2.53 113.55 114.38 2jxj h SER 121 Ca 0.29 -0.33 -0.08 0.00 -1.23 0.00 0.00 61.79 60.45 2jxj h SER 121 Cb -0.10 -0.28 -0.01 0.00 -0.44 0.00 0.00 62.40 61.57 2jxj h SER 121 CO -0.06 1.13 -0.12 0.11 -0.53 0.00 0.00 176.83 177.36 2jxj h LYS 122 N 0.95 0.62 -0.95 2.24 1.57 -1.05 -2.83 116.57 117.12 2jxj h LYS 122 Ca 0.16 -0.26 0.03 0.00 -1.87 0.00 0.00 60.65 58.71 2jxj h LYS 122 Cb 0.63 -0.02 -0.05 0.00 0.08 0.00 0.00 32.23 32.86 2jxj h LYS 122 CO 0.04 0.83 0.62 0.82 -0.57 0.00 0.00 179.45 181.19 2jxj h ILE 123 N 0.38 1.17 0.02 1.86 2.04 -1.14 -1.06 117.51 120.78 2jxj h ILE 123 Ca 0.07 -0.41 -0.00 0.00 1.00 0.00 0.00 64.86 65.52 2jxj h ILE 123 Cb 0.63 -0.14 0.00 0.00 -0.74 0.00 0.00 36.82 36.57 2jxj h ILE 123 CO 0.04 0.22 -0.01 0.58 0.00 0.00 0.00 178.15 178.98 2jxj h VAL 124 N 1.20 1.07 -0.32 1.67 2.07 -1.39 -2.68 116.25 117.88 2jxj h VAL 124 Ca 0.37 -0.26 0.01 0.00 0.82 0.00 0.00 66.70 67.64 2jxj h VAL 124 Cb -0.01 1.24 -0.02 0.00 -1.52 0.00 0.00 31.29 30.98 2jxj h VAL 124 CO -0.12 0.07 0.19 0.00 0.02 0.00 0.00 177.57 177.73 2jxj h ALA 125 N 0.84 0.40 -0.04 1.67 0.00 -1.24 -1.39 119.26 119.48 2jxj h ALA 125 Ca -0.00 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.91 2jxj h ALA 125 Cb 0.13 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.82 2jxj h ALA 125 CO 0.00 -0.17 0.16 0.66 0.00 0.00 0.00 179.25 179.90 2jxj h SER 126 N 0.39 0.00 0.84 0.00 4.64 -1.11 0.91 113.55 119.21 2jxj h SER 126 Ca 0.12 0.00 -0.21 0.00 -0.47 0.00 0.00 61.79 61.24 2jxj h SER 126 Cb -0.01 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.05 2jxj h SER 126 CO -0.05 0.00 -1.26 0.11 -0.87 0.00 0.00 176.83 174.76 2jxj h LYS 127 N 0.00 0.00 0.00 4.77 1.79 -0.92 -3.47 116.57 118.74 2jxj h LYS 127 Ca 0.02 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.49 2jxj h LYS 127 Cb 0.34 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.99 2jxj h LYS 127 CO -0.00 0.55 0.00 0.41 -1.08 0.00 0.00 179.45 179.33 2jxj n GLY 128 N 1.41 0.07 3.46 3.86 0.00 0.28 -4.54 105.19 109.74 2jxj n GLY 128 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.94 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 2.05 0.23 -0.02 0.00 -1.02 -3.77 105.19 102.66 2jxj n GLY 129 Ca 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 46.02 45.82 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 -1.12 -0.34 1.61 -0.00 -1.26 -3.96 117.46 112.40 2jxj n PHE 130 Ca 0.00 0.06 0.04 0.00 -0.00 0.00 0.00 57.45 57.55 2jxj n PHE 130 Cb 0.00 0.34 0.22 0.00 -0.00 0.00 0.00 39.48 40.04 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 1.05 -0.20 -4.13 5.08 -1.95 -0.70 114.58 113.73 2jxj h GLU 131 Ca 0.00 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.29 2jxj h GLU 131 Cb 0.00 -0.24 -0.01 0.00 0.50 0.00 0.00 28.75 29.00 2jxj h GLU 131 CO 0.00 0.70 0.08 0.52 -1.00 0.00 0.00 179.01 179.31 2jxj h MET 132 N 1.08 0.28 -0.25 2.33 2.86 -1.86 -0.28 114.93 119.09 2jxj h MET 132 Ca 0.42 -0.03 -0.05 0.00 -2.06 0.00 0.00 59.70 57.99 2jxj h MET 132 Cb 0.23 -0.06 -0.01 0.00 0.06 0.00 0.00 31.60 31.82 2jxj h MET 132 CO -0.17 0.23 -0.04 0.28 1.06 0.00 0.00 176.91 178.26 2jxj h VAL 133 N 0.28 1.28 -0.36 -2.22 2.07 -1.36 -1.90 116.25 114.04 2jxj h VAL 133 Ca 0.07 -1.03 -0.16 0.00 0.82 0.00 0.00 66.70 66.40 2jxj h VAL 133 Cb 0.06 1.45 -0.01 0.00 -1.52 0.00 0.00 31.29 31.27 2jxj h VAL 133 CO -0.01 0.32 -0.41 0.74 0.02 0.00 0.00 177.57 178.23 2jxj h THR 134 N 0.22 1.27 -0.71 2.57 2.02 -1.25 0.88 112.91 117.92 2jxj h THR 134 Ca 0.06 -1.59 -0.02 0.00 0.77 0.00 0.00 66.41 65.63 2jxj h THR 134 Cb 0.50 1.43 -0.03 0.00 -1.74 0.00 0.00 68.15 68.31 2jxj h THR 134 CO 0.02 0.53 0.36 0.11 0.37 0.00 0.00 175.52 176.91 2jxj h LYS 135 N 0.72 0.99 0.00 6.66 1.57 -1.03 -2.58 116.57 122.90 2jxj h LYS 135 Ca 0.05 -0.12 0.00 0.00 -1.87 0.00 0.00 60.65 58.71 2jxj h LYS 135 Cb 1.00 -0.19 0.00 0.00 0.08 0.00 0.00 32.23 33.12 2jxj h LYS 135 CO 0.10 0.75 -1.13 0.39 -0.57 0.00 0.00 179.45 178.99 2jxj n GLU 136 N -4.35 0.31 -3.10 3.15 -0.58 -0.72 -4.98 120.64 110.37 2jxj n GLU 136 Ca 0.07 -0.02 -0.15 0.00 -0.42 0.00 0.00 57.16 56.64 2jxj n GLU 136 Cb 0.12 -1.58 0.04 0.00 -0.57 0.00 0.00 31.44 29.45 2jxj n GLU 136 CO 0.00 0.00 0.00 1.17 -0.48 0.00 0.00 177.13 177.82 2jxj n LYS 137 N -1.97 -4.68 -0.37 3.49 0.00 0.29 -4.91 118.16 110.00 2jxj n LYS 137 Ca 0.01 0.54 0.06 0.00 0.00 0.00 0.00 58.31 58.93 2jxj n LYS 137 Cb 0.44 -4.69 0.23 0.00 0.00 0.00 0.00 35.03 31.01 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 -3.27 2.63 0.10 1.64 5.02 -0.08 -4.19 118.16 120.00 2jxj n LYS 138 Ca -0.01 -1.81 -0.00 0.00 -2.02 0.00 0.00 58.31 54.46 2jxj n LYS 138 Cb 0.55 -1.61 0.28 0.00 -0.02 0.00 0.00 35.03 34.23 2jxj n LYS 138 CO 0.00 0.00 0.00 -1.49 -0.52 0.00 0.00 177.40 175.39 2jxj h TRP 139 N 2.66 0.29 -0.94 2.13 4.06 -1.91 -2.85 115.95 119.38 2jxj h TRP 139 Ca 0.00 -0.06 0.00 0.00 2.06 0.00 0.00 58.89 60.90 2jxj h TRP 139 Cb 0.94 -0.07 -0.05 0.00 -1.00 0.00 0.00 29.16 28.99 2jxj h TRP 139 CO 0.46 0.53 0.61 0.77 -3.56 0.00 0.00 178.44 177.25 2jxj h SER 140 N 0.23 1.10 0.11 -3.49 0.02 -1.93 -1.76 113.55 107.82 2jxj h SER 140 Ca 0.03 -0.04 -0.06 0.00 -0.84 0.00 0.00 61.79 60.88 2jxj h SER 140 Cb 0.64 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 62.90 2jxj h SER 140 CO 0.05 0.81 -0.20 0.11 -1.14 0.00 0.00 176.83 176.46 2jxj h LYS 141 N 1.29 0.17 -0.07 3.45 1.79 -1.81 -1.72 116.57 119.66 2jxj h LYS 141 Ca 0.34 -0.05 -0.00 0.00 -2.18 0.00 0.00 60.65 58.76 2jxj h LYS 141 Cb -0.12 -0.02 -0.00 0.00 -1.58 0.00 0.00 32.23 30.51 2jxj h LYS 141 CO -0.07 0.37 0.03 0.28 -1.08 0.00 0.00 179.45 178.98 2jxj h VAL 142 N 0.16 1.14 -0.43 0.50 2.07 -1.28 -1.57 116.25 116.84 2jxj h VAL 142 Ca 0.03 -0.41 -0.15 0.00 0.82 0.00 0.00 66.70 66.99 2jxj h VAL 142 Cb 0.45 1.28 -0.01 0.00 -1.52 0.00 0.00 31.29 31.49 2jxj h VAL 142 CO 0.03 0.12 -0.30 1.23 0.02 0.00 0.00 177.57 178.67 2jxj h GLY 143 N -0.04 1.05 1.07 2.17 0.00 -1.33 -3.09 103.07 102.90 2jxj h GLY 143 Ca 0.02 -1.00 0.00 0.00 0.00 0.00 0.00 47.33 46.36 2jxj h GLY 143 CO -0.00 0.91 0.61 1.76 0.00 0.00 0.00 176.54 179.81 2jxj h SER 144 N 0.81 1.09 -0.09 0.19 0.02 -1.26 -1.68 113.55 112.64 2jxj h SER 144 Ca 0.09 -0.04 -0.02 0.00 -0.84 0.00 0.00 61.79 60.97 2jxj h SER 144 Cb 0.89 -0.27 -0.01 0.00 0.14 0.00 0.00 62.40 63.15 2jxj h SER 144 CO 0.08 0.81 0.01 0.03 -1.14 0.00 0.00 176.83 176.62 2jxj h ARG 145 N 1.28 0.24 0.18 3.45 3.08 -1.20 -2.93 114.38 118.48 2jxj h ARG 145 Ca 0.34 -0.03 -0.01 0.00 0.07 0.00 0.00 59.98 60.35 2jxj h ARG 145 Cb -0.12 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 29.89 2jxj h ARG 145 CO -0.07 0.26 -0.09 -0.07 -1.07 0.00 0.00 179.97 178.93 2jxj h LEU 146 N 0.24 -0.20 0.00 3.04 3.38 -1.25 -3.48 115.31 117.04 2jxj h LEU 146 Ca 0.06 -0.27 0.00 0.00 0.09 0.00 0.00 57.88 57.76 2jxj h LEU 146 Cb 0.15 0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.96 2jxj h LEU 146 CO 0.00 0.19 0.00 0.61 0.09 0.00 0.00 178.44 179.33 2jxj n GLY 147 N -0.12 0.00 3.63 0.83 0.00 -1.05 -5.14 105.19 103.34 2jxj n GLY 147 Ca -0.09 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.59 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 3.16 0.37 1.61 2.02 -1.21 -5.06 117.35 118.24 2jxj s TYR 148 Ca 0.00 0.05 -0.25 0.00 -0.37 0.00 0.00 57.07 56.50 2jxj s TYR 148 Cb 0.00 -1.91 -0.09 0.00 -0.40 0.00 0.00 41.96 39.56 2jxj s TYR 148 CO 0.00 0.27 1.04 -0.51 -1.57 0.00 0.00 175.55 174.78 2jxj s LEU 149 N -0.25 4.23 -0.85 -1.29 1.43 -1.26 -4.69 118.68 116.00 2jxj s LEU 149 Ca 0.06 2.03 -0.20 0.00 -1.03 0.00 0.00 54.13 54.99 2jxj s LEU 149 Cb -0.12 -4.08 -0.20 0.00 0.03 0.00 0.00 46.19 41.82 2jxj s LEU 149 CO 0.02 -0.37 2.28 -2.65 0.23 0.00 0.00 176.35 175.87 2jxj n PRO 150 N 0.22 0.35 0.00 1.29 -0.02 -1.26 -4.85 135.00 130.73 2jxj n PRO 150 Ca 0.04 -0.62 0.00 0.00 -2.02 0.00 0.00 63.50 60.90 2jxj n PRO 150 Cb 0.49 -2.82 0.00 0.00 -0.02 0.00 0.00 33.50 31.15 2jxj n PRO 150 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2jxj n GLY 151 N 6.32 2.62 0.00 -1.23 0.00 -1.26 -5.06 105.19 106.58 2jxj n GLY 151 Ca 0.52 -1.91 0.00 0.00 0.00 0.00 0.00 46.02 44.63 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 -2.73 1.61 5.02 -1.26 -4.81 118.16 115.98 2jxj n LYS 152 Ca 0.00 0.40 -0.06 0.00 -2.02 0.00 0.00 58.31 56.62 2jxj n LYS 152 Cb 0.00 -1.36 0.04 0.00 -0.02 0.00 0.00 35.03 33.70 2jxj n LYS 152 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2jxj n GLY 153 N -0.66 -0.53 0.27 0.72 0.00 -1.26 -4.99 105.19 98.73 2jxj n GLY 153 Ca 0.00 0.44 0.14 0.00 0.00 0.00 0.00 46.02 46.60 2jxj n GLY 153 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2jxj h THR 154 N 3.11 0.45 -0.80 2.61 2.02 -1.94 -2.83 112.91 115.52 2jxj h THR 154 Ca -0.11 -0.55 0.08 0.00 0.77 0.00 0.00 66.41 66.59 2jxj h THR 154 Cb 1.09 1.38 -0.05 0.00 -1.74 0.00 0.00 68.15 68.83 2jxj h THR 154 CO 0.14 0.11 0.52 1.23 0.37 0.00 0.00 175.52 177.89 2jxj h GLY 155 N 1.06 1.09 1.44 2.16 0.00 -1.94 -0.40 103.07 106.48 2jxj h GLY 155 Ca -0.00 -0.33 -0.09 0.00 0.00 0.00 0.00 47.33 46.91 2jxj h GLY 155 CO 0.01 0.22 -0.15 1.76 0.00 0.00 0.00 176.54 178.39 2jxj h SER 156 N 0.81 0.66 -0.05 0.19 0.02 -1.91 -2.05 113.55 111.22 2jxj h SER 156 Ca 0.35 -0.20 -0.20 0.00 -0.84 0.00 0.00 61.79 60.90 2jxj h SER 156 Cb 0.32 -0.18 0.00 0.00 0.14 0.00 0.00 62.40 62.69 2jxj h SER 156 CO -0.13 0.82 -0.72 -0.07 -1.14 0.00 0.00 176.83 175.60 2jxj h LEU 157 N 0.60 0.81 -0.43 5.07 4.07 -1.37 -2.77 115.31 121.29 2jxj h LEU 157 Ca 0.10 -0.51 -0.03 0.00 0.08 0.00 0.00 57.88 57.53 2jxj h LEU 157 Cb 0.60 -0.24 -0.02 0.00 1.08 0.00 0.00 40.66 42.08 2jxj h LEU 157 CO 0.04 1.29 0.16 -0.07 -1.08 0.00 0.00 178.44 178.78 2jxj h LEU 158 N 0.49 0.60 -0.19 1.67 3.38 -0.95 0.25 115.31 120.55 2jxj h LEU 158 Ca -0.03 -0.17 -0.00 0.00 0.09 0.00 0.00 57.88 57.76 2jxj h LEU 158 Cb 1.32 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.91 2jxj h LEU 158 CO 0.14 0.61 0.11 0.11 0.09 0.00 0.00 178.44 179.51 2jxj h LYS 159 N 0.55 0.26 -0.45 1.13 1.57 -1.40 0.25 116.57 118.48 2jxj h LYS 159 Ca 0.14 -0.02 -0.09 0.00 -1.87 0.00 0.00 60.65 58.81 2jxj h LYS 159 Cb 0.20 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.45 2jxj h LYS 159 CO -0.01 0.22 -0.07 0.77 -0.57 0.00 0.00 179.45 179.79 2jxj h SER 160 N 0.23 0.83 -0.17 0.86 0.02 -1.37 0.12 113.55 114.06 2jxj h SER 160 Ca 0.07 -0.34 -0.01 0.00 -0.84 0.00 0.00 61.79 60.66 2jxj h SER 160 Cb 0.03 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.33 2jxj h SER 160 CO -0.01 0.98 0.05 0.45 -1.14 0.00 0.00 176.83 177.16 2jxj h HIS 161 N 0.67 0.27 -0.17 3.45 3.86 -0.32 -3.18 115.15 119.73 2jxj h HIS 161 Ca 0.12 -0.03 -0.03 0.00 -1.16 0.00 0.00 60.37 59.27 2jxj h HIS 161 Cb 0.60 -0.08 -0.01 0.00 1.06 0.00 0.00 27.41 28.98 2jxj h HIS 161 CO 0.05 0.36 -0.03 -0.92 0.86 0.00 0.00 177.93 178.25 2jxj h TYR 162 N 0.09 0.36 -1.21 2.45 3.20 -0.48 -3.31 116.97 118.07 2jxj h TYR 162 Ca 0.05 -0.07 -0.75 0.00 3.14 0.00 0.00 58.73 61.10 2jxj h TYR 162 Cb 0.22 -0.09 -0.14 0.00 1.54 0.00 0.00 36.73 38.26 2jxj h TYR 162 CO -0.00 0.57 2.17 -1.91 -1.64 0.00 0.00 178.16 177.35 2jxj n GLU 163 N -4.68 3.57 0.00 1.82 2.13 0.40 -0.34 120.64 123.53 2jxj n GLU 163 Ca -0.05 -3.41 0.00 0.00 0.66 0.00 0.00 57.16 54.36 2jxj n GLU 163 Cb 0.25 -2.95 0.00 0.00 0.27 0.00 0.00 31.44 29.01 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 4.03 0.00 0.00 5.31 1.74 -1.23 -4.76 116.66 121.75 2jxj n ARG 164 Ca 0.42 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.50 2jxj n ARG 164 Cb 0.36 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.80 2jxj n ARG 164 CO 0.00 0.00 0.00 -0.89 -1.52 0.00 0.00 177.63 175.22 2jxj n ILE 165 N -0.70 0.00 -0.05 0.55 -0.00 -1.25 -4.72 119.36 113.20 2jxj n ILE 165 Ca 0.00 0.00 -0.12 0.00 -0.00 0.00 0.00 62.75 62.63 2jxj n ILE 165 Cb 0.00 -1.03 -0.10 0.00 -0.00 0.00 0.00 39.64 38.51 2jxj n ILE 165 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 176.55 176.80 2jxj h LEU 166 N 0.00 -0.02 0.18 1.39 5.85 -1.75 -3.24 115.31 117.73 2jxj h LEU 166 Ca 0.00 -0.74 0.01 0.00 0.84 0.00 0.00 57.88 57.99 2jxj h LEU 166 Cb 0.68 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.68 2jxj h LEU 166 CO 0.00 0.81 -0.33 0.22 -0.34 0.00 0.00 178.44 178.80 2jxj h TYR 167 N -0.93 -0.89 -0.30 1.25 3.20 -1.01 -1.93 116.97 116.34 2jxj h TYR 167 Ca -0.00 0.02 0.09 0.00 3.14 0.00 0.00 58.73 61.97 2jxj h TYR 167 Cb 0.76 0.37 -0.01 0.00 1.54 0.00 0.00 36.73 39.39 2jxj h TYR 167 CO 0.20 -0.44 0.33 -1.00 -1.64 0.00 0.00 178.16 175.60 2jxj h PRO 168 N -0.59 0.00 0.11 1.82 0.13 -1.80 -2.33 132.00 129.34 2jxj h PRO 168 Ca 0.01 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 65.16 2jxj h PRO 168 Cb 0.60 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.70 2jxj h PRO 168 CO -0.15 0.00 -0.18 -0.92 -0.23 0.00 0.00 178.00 176.51 2jxj h TYR 169 N 0.00 -0.48 -0.10 1.56 3.20 -1.37 0.20 116.97 119.98 2jxj h TYR 169 Ca 0.14 0.01 0.02 0.00 3.14 0.00 0.00 58.73 62.04 2jxj h TYR 169 Cb 0.80 0.20 -0.02 0.00 1.54 0.00 0.00 36.73 39.25 2jxj h TYR 169 CO 0.00 -0.27 -0.03 0.93 -1.64 0.00 0.00 178.16 177.14 2jxj h GLU 170 N -0.36 -0.01 -0.81 1.82 3.07 -1.47 -2.13 114.58 114.69 2jxj h GLU 170 Ca 0.02 0.00 0.09 0.00 -0.50 0.00 0.00 59.36 58.98 2jxj h GLU 170 Cb 0.37 0.00 -0.06 0.00 -0.84 0.00 0.00 28.75 28.23 2jxj h GLU 170 CO -0.10 -0.01 0.53 -0.07 -1.40 0.00 0.00 179.01 177.97 2jxj h LEU 171 N -0.01 0.70 -0.95 1.33 3.38 -1.50 0.46 115.31 118.72 2jxj h LEU 171 Ca 0.05 0.02 0.05 0.00 0.09 0.00 0.00 57.88 58.09 2jxj h LEU 171 Cb 0.09 -0.13 -0.06 0.00 0.09 0.00 0.00 40.66 40.66 2jxj h LEU 171 CO -0.11 0.42 0.61 0.15 0.09 0.00 0.00 178.44 179.59 2jxj h PHE 172 N 0.77 1.14 0.18 1.13 3.04 -0.27 1.02 116.94 123.95 2jxj h PHE 172 Ca 0.37 0.03 -0.33 0.00 3.98 0.00 0.00 57.97 62.02 2jxj h PHE 172 Cb 0.42 -0.38 0.01 0.00 2.56 0.00 0.00 35.95 38.56 2jxj h PHE 172 CO -0.00 0.63 -1.65 1.96 -2.02 0.00 0.00 178.31 177.23 2jxj h GLN 173 N 1.16 0.37 -1.01 1.11 4.20 -1.04 -3.33 115.11 116.57 2jxj h GLN 173 Ca 0.39 -0.64 -0.48 0.00 0.06 0.00 0.00 58.65 57.99 2jxj h GLN 173 Cb 0.06 0.24 -0.28 0.00 0.30 0.00 0.00 27.48 27.81 2jxj h GLN 173 CO -0.14 1.31 0.61 0.43 -0.67 0.00 0.00 178.83 180.36 2jxj n SER 174 N -3.68 4.00 -0.24 1.46 7.64 0.15 -5.13 113.62 117.82 2jxj n SER 174 Ca -0.24 -3.45 0.03 0.00 1.01 0.00 0.00 58.87 56.21 2jxj n SER 174 Cb 1.04 -0.82 0.03 0.00 -1.01 0.00 0.00 64.21 63.44 2jxj n SER 174 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64